HEADER PROTEIN 19-JUL-19 NONE TITLE NULL COMPND NULL SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 19-JUL-19 0 HETATM 1 C UNK 0 -19.416 16.474 0.000 0.00 0.00 C+0 HETATM 2 C UNK 0 -18.195 15.535 0.000 0.00 0.00 C+0 HETATM 3 C UNK 0 -18.399 14.008 0.000 0.00 0.00 C+0 HETATM 4 C UNK 0 -17.178 13.069 0.000 0.00 0.00 C+0 HETATM 5 C UNK 0 -17.382 11.542 0.000 0.00 0.00 C+0 HETATM 6 C UNK 0 -16.161 10.603 0.000 0.00 0.00 C+0 HETATM 7 C UNK 0 -16.365 9.076 0.000 0.00 0.00 C+0 HETATM 8 C UNK 0 -15.144 8.137 0.000 0.00 0.00 C+0 HETATM 9 C UNK 0 -15.348 6.610 0.000 0.00 0.00 C+0 HETATM 10 C UNK 0 -14.128 5.671 0.000 0.00 0.00 C+0 HETATM 11 C UNK 0 -14.331 4.144 0.000 0.00 0.00 C+0 HETATM 12 C UNK 0 -13.111 3.205 0.000 0.00 0.00 C+0 HETATM 13 C UNK 0 -13.314 1.679 0.000 0.00 0.00 C+0 HETATM 14 C UNK 0 -12.094 0.739 0.000 0.00 0.00 C+0 HETATM 15 C UNK 0 -12.297 -0.787 0.000 0.00 0.00 C+0 HETATM 16 C UNK 0 -13.721 -1.374 0.000 0.00 0.00 C+0 HETATM 17 O UNK 0 -14.941 -0.435 0.000 0.00 0.00 O+0 HETATM 18 C UNK 0 -13.924 -2.901 0.000 0.00 0.00 C+0 HETATM 19 C UNK 0 -15.348 -3.488 0.000 0.00 0.00 C+0 HETATM 20 O UNK 0 -15.551 -5.015 0.000 0.00 0.00 O+0 HETATM 21 C UNK 0 -16.975 -5.602 0.000 0.00 0.00 C+0 HETATM 22 O UNK 0 -17.178 -7.128 0.000 0.00 0.00 O+0 HETATM 23 C UNK 0 -18.602 -7.715 0.000 0.00 0.00 C+0 HETATM 24 C UNK 0 -18.805 -9.242 0.000 0.00 0.00 C+0 HETATM 25 O UNK 0 -20.229 -9.829 0.000 0.00 0.00 O+0 HETATM 26 C UNK 0 -19.822 -6.776 0.000 0.00 0.00 C+0 HETATM 27 O UNK 0 -21.246 -7.363 0.000 0.00 0.00 O+0 HETATM 28 C UNK 0 -22.466 -6.424 0.000 0.00 0.00 C+0 HETATM 29 O UNK 0 -22.263 -4.897 0.000 0.00 0.00 O+0 HETATM 30 C UNK 0 -23.483 -3.958 0.000 0.00 0.00 C+0 HETATM 31 C UNK 0 -23.280 -2.431 0.000 0.00 0.00 C+0 HETATM 32 O UNK 0 -21.856 -1.844 0.000 0.00 0.00 O+0 HETATM 33 C UNK 0 -24.907 -4.545 0.000 0.00 0.00 C+0 HETATM 34 O UNK 0 -26.127 -3.605 0.000 0.00 0.00 O+0 HETATM 35 C UNK 0 -25.924 -2.079 0.000 0.00 0.00 C+0 HETATM 36 O UNK 0 -24.500 -1.492 0.000 0.00 0.00 O+0 HETATM 37 C UNK 0 -24.297 0.035 0.000 0.00 0.00 C+0 HETATM 38 C UNK 0 -22.873 0.622 0.000 0.00 0.00 C+0 HETATM 39 O UNK 0 -22.670 2.148 0.000 0.00 0.00 O+0 HETATM 40 C UNK 0 -25.517 0.974 0.000 0.00 0.00 C+0 HETATM 41 O UNK 0 -25.314 2.501 0.000 0.00 0.00 O+0 HETATM 42 C UNK 0 -26.941 0.387 0.000 0.00 0.00 C+0 HETATM 43 O UNK 0 -28.161 1.326 0.000 0.00 0.00 O+0 HETATM 44 C UNK 0 -27.144 -1.140 0.000 0.00 0.00 C+0 HETATM 45 C UNK 0 -28.568 -1.727 0.000 0.00 0.00 C+0 HETATM 46 C UNK 0 -29.788 -0.787 0.000 0.00 0.00 C+0 HETATM 47 C UNK 0 -29.585 0.739 0.000 0.00 0.00 C+0 HETATM 48 O UNK 0 -31.212 -1.374 0.000 0.00 0.00 O+0 HETATM 49 C UNK 0 -25.110 -6.072 0.000 0.00 0.00 C+0 HETATM 50 O UNK 0 -26.534 -6.659 0.000 0.00 0.00 O+0 HETATM 51 C UNK 0 -26.737 -8.185 0.000 0.00 0.00 C+0 HETATM 52 C UNK 0 -25.199 -8.120 0.000 0.00 0.00 C+0 HETATM 53 C UNK 0 -24.373 -9.420 0.000 0.00 0.00 C+0 HETATM 54 O UNK 0 -22.835 -9.356 0.000 0.00 0.00 O+0 HETATM 55 C UNK 0 -25.087 -10.785 0.000 0.00 0.00 C+0 HETATM 56 N UNK 0 -24.261 -12.085 0.000 0.00 0.00 N+0 HETATM 57 C UNK 0 -22.723 -12.021 0.000 0.00 0.00 C+0 HETATM 58 C UNK 0 -22.009 -10.656 0.000 0.00 0.00 C+0 HETATM 59 O UNK 0 -21.897 -13.321 0.000 0.00 0.00 O+0 HETATM 60 C UNK 0 -26.625 -10.850 0.000 0.00 0.00 C+0 HETATM 61 O UNK 0 -27.451 -9.550 0.000 0.00 0.00 O+0 HETATM 62 C UNK 0 -27.338 -12.215 0.000 0.00 0.00 C+0 HETATM 63 O UNK 0 -26.513 -13.515 0.000 0.00 0.00 O+0 HETATM 64 C UNK 0 -28.877 -12.280 0.000 0.00 0.00 C+0 HETATM 65 C UNK 0 -29.702 -10.980 0.000 0.00 0.00 C+0 HETATM 66 O UNK 0 -28.989 -9.615 0.000 0.00 0.00 O+0 HETATM 67 O UNK 0 -29.590 -13.645 0.000 0.00 0.00 O+0 HETATM 68 C UNK 0 -31.129 -13.709 0.000 0.00 0.00 C+0 HETATM 69 C UNK 0 -32.597 -13.244 0.000 0.00 0.00 C+0 HETATM 70 C UNK 0 -33.734 -14.283 0.000 0.00 0.00 C+0 HETATM 71 O UNK 0 -35.202 -13.817 0.000 0.00 0.00 O+0 HETATM 72 C UNK 0 -33.403 -15.787 0.000 0.00 0.00 C+0 HETATM 73 N UNK 0 -34.540 -16.825 0.000 0.00 0.00 N+0 HETATM 74 C UNK 0 -36.008 -16.360 0.000 0.00 0.00 C+0 HETATM 75 C UNK 0 -36.339 -14.856 0.000 0.00 0.00 C+0 HETATM 76 O UNK 0 -37.145 -17.399 0.000 0.00 0.00 O+0 HETATM 77 C UNK 0 -31.935 -16.252 0.000 0.00 0.00 C+0 HETATM 78 O UNK 0 -30.798 -15.213 0.000 0.00 0.00 O+0 HETATM 79 C UNK 0 -31.604 -17.756 0.000 0.00 0.00 C+0 HETATM 80 O UNK 0 -32.741 -18.795 0.000 0.00 0.00 O+0 HETATM 81 C UNK 0 -30.136 -18.221 0.000 0.00 0.00 C+0 HETATM 82 C UNK 0 -29.805 -19.725 0.000 0.00 0.00 C+0 HETATM 83 O UNK 0 -30.942 -20.764 0.000 0.00 0.00 O+0 HETATM 84 O UNK 0 -28.999 -17.183 0.000 0.00 0.00 O+0 HETATM 85 C UNK 0 -27.531 -17.648 0.000 0.00 0.00 C+0 HETATM 86 C UNK 0 -25.992 -17.583 0.000 0.00 0.00 C+0 HETATM 87 C UNK 0 -25.167 -18.884 0.000 0.00 0.00 C+0 HETATM 88 O UNK 0 -23.628 -18.819 0.000 0.00 0.00 O+0 HETATM 89 C UNK 0 -25.880 -20.248 0.000 0.00 0.00 C+0 HETATM 90 N UNK 0 -25.055 -21.548 0.000 0.00 0.00 N+0 HETATM 91 C UNK 0 -23.516 -21.484 0.000 0.00 0.00 C+0 HETATM 92 C UNK 0 -22.803 -20.119 0.000 0.00 0.00 C+0 HETATM 93 O UNK 0 -22.691 -22.784 0.000 0.00 0.00 O+0 HETATM 94 C UNK 0 -27.419 -20.313 0.000 0.00 0.00 C+0 HETATM 95 O UNK 0 -28.244 -19.013 0.000 0.00 0.00 O+0 HETATM 96 C UNK 0 -28.132 -21.678 0.000 0.00 0.00 C+0 HETATM 97 O UNK 0 -29.671 -21.743 0.000 0.00 0.00 O+0 HETATM 98 C UNK 0 -27.307 -22.978 0.000 0.00 0.00 C+0 HETATM 99 O UNK 0 -25.768 -22.913 0.000 0.00 0.00 O+0 HETATM 100 C UNK 0 -28.020 -24.343 0.000 0.00 0.00 C+0 HETATM 101 O UNK 0 -27.194 -25.643 0.000 0.00 0.00 O+0 HETATM 102 C UNK 0 -27.328 -16.122 0.000 0.00 0.00 C+0 HETATM 103 O UNK 0 -28.548 -15.182 0.000 0.00 0.00 O+0 HETATM 104 O UNK 0 -25.904 -15.535 0.000 0.00 0.00 O+0 HETATM 105 C UNK 0 -30.926 -12.183 0.000 0.00 0.00 C+0 HETATM 106 O UNK 0 -32.146 -11.243 0.000 0.00 0.00 O+0 HETATM 107 O UNK 0 -30.564 -10.686 0.000 0.00 0.00 O+0 HETATM 108 C UNK 0 -28.205 -7.720 0.000 0.00 0.00 C+0 HETATM 109 O UNK 0 -29.343 -8.758 0.000 0.00 0.00 O+0 HETATM 110 O UNK 0 -28.536 -6.216 0.000 0.00 0.00 O+0 HETATM 111 C UNK 0 -23.890 -7.011 0.000 0.00 0.00 C+0 HETATM 112 O UNK 0 -24.093 -8.537 0.000 0.00 0.00 O+0 HETATM 113 C UNK 0 -19.619 -5.249 0.000 0.00 0.00 C+0 HETATM 114 O UNK 0 -20.839 -4.310 0.000 0.00 0.00 O+0 HETATM 115 C UNK 0 -18.195 -4.662 0.000 0.00 0.00 C+0 HETATM 116 O UNK 0 -17.992 -3.136 0.000 0.00 0.00 O+0 HETATM 117 N UNK 0 -12.704 -3.840 0.000 0.00 0.00 N+0 HETATM 118 C UNK 0 -11.280 -3.253 0.000 0.00 0.00 C+0 HETATM 119 O UNK 0 -11.077 -1.727 0.000 0.00 0.00 O+0 HETATM 120 C UNK 0 -10.060 -4.193 0.000 0.00 0.00 C+0 HETATM 121 C UNK 0 -8.636 -3.605 0.000 0.00 0.00 C+0 HETATM 122 C UNK 0 -7.416 -4.545 0.000 0.00 0.00 C+0 HETATM 123 C UNK 0 -5.992 -3.958 0.000 0.00 0.00 C+0 HETATM 124 C UNK 0 -4.772 -4.897 0.000 0.00 0.00 C+0 HETATM 125 C UNK 0 -3.348 -4.310 0.000 0.00 0.00 C+0 HETATM 126 C UNK 0 -2.128 -5.249 0.000 0.00 0.00 C+0 HETATM 127 C UNK 0 -0.704 -4.662 0.000 0.00 0.00 C+0 HETATM 128 C UNK 0 0.516 -5.602 0.000 0.00 0.00 C+0 HETATM 129 C UNK 0 1.940 -5.015 0.000 0.00 0.00 C+0 HETATM 130 C UNK 0 3.160 -5.954 0.000 0.00 0.00 C+0 HETATM 131 H UNK 0 -15.386 -1.260 0.000 0.00 0.00 H+0 HETATM 132 H UNK 0 -15.521 -2.474 0.000 0.00 0.00 H+0 HETATM 133 H UNK 0 -18.410 -5.531 0.000 0.00 0.00 H+0 HETATM 134 H UNK 0 -17.352 -8.648 0.000 0.00 0.00 H+0 HETATM 135 H UNK 0 -19.391 -8.403 0.000 0.00 0.00 H+0 HETATM 136 H UNK 0 -20.674 -6.195 0.000 0.00 0.00 H+0 HETATM 137 H UNK 0 -24.963 -3.740 0.000 0.00 0.00 H+0 HETATM 138 H UNK 0 -23.919 -3.247 0.000 0.00 0.00 H+0 HETATM 139 H UNK 0 -26.296 -0.406 0.000 0.00 0.00 H+0 HETATM 140 H UNK 0 -23.791 1.558 0.000 0.00 0.00 H+0 HETATM 141 H UNK 0 -26.529 2.669 0.000 0.00 0.00 H+0 HETATM 142 H UNK 0 -25.992 1.742 0.000 0.00 0.00 H+0 HETATM 143 H UNK 0 -27.991 -2.702 0.000 0.00 0.00 H+0 HETATM 144 H UNK 0 -26.435 -5.308 0.000 0.00 0.00 H+0 HETATM 145 H UNK 0 -22.919 -11.005 0.000 0.00 0.00 H+0 HETATM 146 H UNK 0 -25.772 -9.373 0.000 0.00 0.00 H+0 HETATM 147 H UNK 0 -25.604 -13.116 0.000 0.00 0.00 H+0 HETATM 148 H UNK 0 -30.384 -13.247 0.000 0.00 0.00 H+0 HETATM 149 H UNK 0 -34.532 -15.736 0.000 0.00 0.00 H+0 HETATM 150 H UNK 0 -33.849 -17.595 0.000 0.00 0.00 H+0 HETATM 151 H UNK 0 -31.868 -19.310 0.000 0.00 0.00 H+0 HETATM 152 H UNK 0 -28.562 -17.880 0.000 0.00 0.00 H+0 HETATM 153 H UNK 0 -23.970 -19.683 0.000 0.00 0.00 H+0 HETATM 154 H UNK 0 -27.078 -19.431 0.000 0.00 0.00 H+0 HETATM 155 H UNK 0 -28.844 -23.114 0.000 0.00 0.00 H+0 HETATM 156 H UNK 0 -28.885 -24.257 0.000 0.00 0.00 H+0 HETATM 157 H UNK 0 -22.197 -7.446 0.000 0.00 0.00 H+0 HETATM 158 H UNK 0 -18.392 -3.889 0.000 0.00 0.00 H+0 HETATM 159 H UNK 0 -19.967 -4.377 0.000 0.00 0.00 H+0 CONECT 1 2 CONECT 2 1 3 CONECT 3 2 4 CONECT 4 3 5 CONECT 5 4 6 CONECT 6 5 7 CONECT 7 6 8 CONECT 8 7 9 CONECT 9 8 10 CONECT 10 9 11 CONECT 11 10 12 CONECT 12 11 13 CONECT 13 12 14 CONECT 14 13 15 CONECT 15 14 16 CONECT 16 15 17 18 131 CONECT 17 16 CONECT 18 16 19 117 132 CONECT 19 18 20 CONECT 20 19 21 CONECT 21 20 22 115 133 CONECT 22 21 23 CONECT 23 22 24 26 134 CONECT 24 23 25 CONECT 25 24 CONECT 26 23 27 113 135 CONECT 27 26 28 CONECT 28 27 29 111 136 CONECT 29 28 30 CONECT 30 29 31 33 137 CONECT 31 30 32 CONECT 32 31 CONECT 33 30 34 49 138 CONECT 34 33 35 CONECT 35 34 36 44 139 CONECT 36 35 37 CONECT 37 36 38 40 140 CONECT 38 37 39 CONECT 39 38 CONECT 40 37 41 42 141 CONECT 41 40 CONECT 42 40 43 44 142 CONECT 43 42 CONECT 44 42 35 45 143 CONECT 45 44 46 CONECT 46 45 47 48 CONECT 47 46 CONECT 48 46 CONECT 49 33 50 111 144 CONECT 50 49 51 CONECT 51 50 52 61 108 CONECT 52 51 53 CONECT 53 52 54 55 145 CONECT 54 53 CONECT 55 53 56 60 146 CONECT 56 55 57 CONECT 57 56 58 59 CONECT 58 57 CONECT 59 57 CONECT 60 55 61 62 CONECT 61 60 51 CONECT 62 60 63 64 147 CONECT 63 62 CONECT 64 62 65 67 148 CONECT 65 64 66 CONECT 66 65 CONECT 67 64 68 CONECT 68 67 69 78 105 CONECT 69 68 70 CONECT 70 69 71 72 149 CONECT 71 70 CONECT 72 70 73 77 150 CONECT 73 72 74 CONECT 74 73 75 76 CONECT 75 74 CONECT 76 74 CONECT 77 72 78 79 CONECT 78 77 68 CONECT 79 77 80 81 151 CONECT 80 79 CONECT 81 79 82 84 152 CONECT 82 81 83 CONECT 83 82 CONECT 84 81 85 CONECT 85 84 86 95 102 CONECT 86 85 87 CONECT 87 86 88 89 153 CONECT 88 87 CONECT 89 87 90 94 154 CONECT 90 89 91 CONECT 91 90 92 93 CONECT 92 91 CONECT 93 91 CONECT 94 89 95 96 CONECT 95 94 85 CONECT 96 94 97 98 155 CONECT 97 96 CONECT 98 96 99 100 156 CONECT 99 98 CONECT 100 98 101 CONECT 101 100 CONECT 102 85 103 104 CONECT 103 102 CONECT 104 102 CONECT 105 68 106 107 CONECT 106 105 CONECT 107 105 CONECT 108 51 109 110 CONECT 109 108 CONECT 110 108 CONECT 111 49 28 112 157 CONECT 112 111 CONECT 113 26 114 115 158 CONECT 114 113 CONECT 115 113 21 116 159 CONECT 116 115 CONECT 117 18 118 CONECT 118 117 119 120 CONECT 119 118 CONECT 120 118 121 CONECT 121 120 122 CONECT 122 121 123 CONECT 123 122 124 CONECT 124 123 125 CONECT 125 124 126 CONECT 126 125 127 CONECT 127 126 128 CONECT 128 127 129 CONECT 129 128 130 CONECT 130 129 CONECT 131 16 CONECT 132 18 CONECT 133 21 CONECT 134 23 CONECT 135 26 CONECT 136 28 CONECT 137 30 CONECT 138 33 CONECT 139 35 CONECT 140 37 CONECT 141 40 CONECT 142 42 CONECT 143 44 CONECT 144 49 CONECT 145 53 CONECT 146 55 CONECT 147 62 CONECT 148 64 CONECT 149 70 CONECT 150 72 CONECT 151 79 CONECT 152 81 CONECT 153 87 CONECT 154 89 CONECT 155 96 CONECT 156 98 CONECT 157 111 CONECT 158 113 CONECT 159 115 MASTER 0 0 0 0 0 0 0 0 159 0 328 0 END