HEADER PROTEIN 14-MAY-15 NONE TITLE NULL COMPND NULL SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 14-MAY-15 0 HETATM 1 C UNK 0 -7.043 4.782 0.000 0.00 0.00 C+0 HETATM 2 C UNK 0 -7.948 3.536 0.000 0.00 0.00 C+0 HETATM 3 C UNK 0 -7.322 2.129 0.000 0.00 0.00 C+0 HETATM 4 C UNK 0 -5.790 1.968 0.000 0.00 0.00 C+0 HETATM 5 C UNK 0 -4.885 3.214 0.000 0.00 0.00 C+0 HETATM 6 O UNK 0 -5.511 4.621 0.000 0.00 0.00 O+0 HETATM 7 C UNK 0 -7.669 6.189 0.000 0.00 0.00 C+0 HETATM 8 O UNK 0 -9.201 6.350 0.000 0.00 0.00 O+0 HETATM 9 C UNK 0 -6.764 7.435 0.000 0.00 0.00 C+0 HETATM 10 O UNK 0 -7.391 8.841 0.000 0.00 0.00 O+0 HETATM 11 O UNK 0 -9.480 3.697 0.000 0.00 0.00 O+0 HETATM 12 O UNK 0 -8.227 0.883 0.000 0.00 0.00 O+0 HETATM 13 O UNK 0 -5.164 0.561 0.000 0.00 0.00 O+0 HETATM 14 O UNK 0 -3.353 3.053 0.000 0.00 0.00 O+0 HETATM 15 C UNK 0 -0.927 2.779 0.000 0.00 0.00 C+0 HETATM 16 C UNK 0 -0.301 1.372 0.000 0.00 0.00 C+0 HETATM 17 C UNK 0 1.231 1.211 0.000 0.00 0.00 C+0 HETATM 18 O UNK 0 2.136 2.457 0.000 0.00 0.00 O+0 HETATM 19 C UNK 0 1.510 3.864 0.000 0.00 0.00 C+0 HETATM 20 C UNK 0 -0.022 4.025 0.000 0.00 0.00 C+0 HETATM 21 O UNK 0 -0.648 5.432 0.000 0.00 0.00 O+0 HETATM 22 O UNK 0 -1.206 0.126 0.000 0.00 0.00 O+0 HETATM 23 C UNK 0 2.415 5.110 0.000 0.00 0.00 C+0 HETATM 24 O UNK 0 1.789 6.517 0.000 0.00 0.00 O+0 HETATM 25 C UNK 0 3.947 4.949 0.000 0.00 0.00 C+0 HETATM 26 O UNK 0 4.852 6.195 0.000 0.00 0.00 O+0 HETATM 27 O UNK 0 1.857 -0.195 0.000 0.00 0.00 O+0 HETATM 28 C UNK 0 3.389 -0.356 0.000 0.00 0.00 C+0 HETATM 29 C UNK 0 3.389 -1.896 0.000 0.00 0.00 C+0 HETATM 30 C UNK 0 4.723 -2.666 0.000 0.00 0.00 C+0 HETATM 31 C UNK 0 6.056 -1.896 0.000 0.00 0.00 C+0 HETATM 32 O UNK 0 6.056 -0.356 0.000 0.00 0.00 O+0 HETATM 33 C UNK 0 4.723 0.414 0.000 0.00 0.00 C+0 HETATM 34 C UNK 0 4.723 1.954 0.000 0.00 0.00 C+0 HETATM 35 O UNK 0 3.389 2.724 0.000 0.00 0.00 O+0 HETATM 36 C UNK 0 6.056 2.724 0.000 0.00 0.00 C+0 HETATM 37 O UNK 0 7.390 1.954 0.000 0.00 0.00 O+0 HETATM 38 O UNK 0 2.055 -2.666 0.000 0.00 0.00 O+0 HETATM 39 C UNK 0 7.390 -2.666 0.000 0.00 0.00 C+0 HETATM 40 O UNK 0 6.056 -5.860 0.000 0.00 0.00 O+0 HETATM 41 O UNK 0 7.390 -4.206 0.000 0.00 0.00 O-1 HETATM 42 O UNK 0 8.724 -1.896 0.000 0.00 0.00 O+0 HETATM 43 C UNK 0 -2.012 -4.096 0.000 0.00 0.00 C+0 HETATM 44 O UNK 0 -3.345 -4.866 0.000 0.00 0.00 O+0 HETATM 45 C UNK 0 -3.345 -6.406 0.000 0.00 0.00 C+0 HETATM 46 C UNK 0 -2.012 -7.176 0.000 0.00 0.00 C+0 HETATM 47 C UNK 0 -0.678 -6.406 0.000 0.00 0.00 C+0 HETATM 48 C UNK 0 -0.678 -4.866 0.000 0.00 0.00 C+0 HETATM 49 C UNK 0 -3.379 -3.294 0.000 0.00 0.00 C+0 HETATM 50 C UNK 0 -4.719 -3.291 0.000 0.00 0.00 C+0 HETATM 51 C UNK 0 -2.940 -1.896 0.000 0.00 0.00 C+0 HETATM 52 O UNK 0 -2.012 -8.716 0.000 0.00 0.00 O+0 HETATM 53 O UNK 0 0.656 -7.177 0.000 0.00 0.00 O+0 HETATM 54 C UNK 0 -4.679 -7.177 0.000 0.00 0.00 C+0 HETATM 55 C UNK 0 -6.013 -6.407 0.000 0.00 0.00 C+0 HETATM 56 O UNK 0 -4.679 -8.717 0.000 0.00 0.00 O+0 HETATM 57 O UNK 0 -6.013 -4.867 0.000 0.00 0.00 O+0 HETATM 58 C UNK 0 6.122 -8.029 0.000 0.00 0.00 C+0 HETATM 59 C UNK 0 7.479 -8.758 0.000 0.00 0.00 C+0 HETATM 60 C UNK 0 7.479 -10.298 0.000 0.00 0.00 C+0 HETATM 61 C UNK 0 8.813 -11.069 0.000 0.00 0.00 C+0 HETATM 62 C UNK 0 10.146 -10.298 0.000 0.00 0.00 C+0 HETATM 63 C UNK 0 10.146 -8.758 0.000 0.00 0.00 C+0 HETATM 64 O UNK 0 8.813 -7.988 0.000 0.00 0.00 O+0 HETATM 65 O UNK 0 6.145 -11.068 0.000 0.00 0.00 O+0 HETATM 66 O UNK 0 6.274 -14.648 0.000 0.00 0.00 O+0 HETATM 67 N UNK 0 13.340 -12.163 0.000 0.00 0.00 N+0 HETATM 68 O UNK 0 11.480 -7.989 0.000 0.00 0.00 O+0 HETATM 69 P UNK 0 4.658 -11.467 0.000 0.00 0.00 P+0 HETATM 70 O UNK 0 4.235 -9.911 0.000 0.00 0.00 O+0 HETATM 71 O UNK 0 3.059 -11.955 0.000 0.00 0.00 O-1 HETATM 72 O UNK 0 5.347 -13.156 0.000 0.00 0.00 O-1 HETATM 73 C UNK 0 13.352 -6.716 0.000 0.00 0.00 C+0 HETATM 74 C UNK 0 16.269 -7.765 0.000 0.00 0.00 C+0 HETATM 75 C UNK 0 16.589 -9.271 0.000 0.00 0.00 C+0 HETATM 76 C UNK 0 18.054 -9.747 0.000 0.00 0.00 C+0 HETATM 77 C UNK 0 19.199 -8.717 0.000 0.00 0.00 C+0 HETATM 78 C UNK 0 18.879 -7.210 0.000 0.00 0.00 C+0 HETATM 79 O UNK 0 17.414 -6.734 0.000 0.00 0.00 O+0 HETATM 80 C UNK 0 5.019 -15.641 0.000 0.00 0.00 C+0 HETATM 81 C UNK 0 6.529 -17.102 0.000 0.00 0.00 C+0 HETATM 82 C UNK 0 4.480 -18.422 0.000 0.00 0.00 C+0 HETATM 83 C UNK 0 6.367 -19.891 0.000 0.00 0.00 C+0 HETATM 84 C UNK 0 4.254 -21.260 0.000 0.00 0.00 C+0 HETATM 85 C UNK 0 6.176 -22.689 0.000 0.00 0.00 C+0 HETATM 86 C UNK 0 6.064 -25.622 0.000 0.00 0.00 C+0 HETATM 87 C UNK 0 3.892 -26.594 0.000 0.00 0.00 C+0 HETATM 88 C UNK 0 5.511 -28.363 0.000 0.00 0.00 C+0 HETATM 89 C UNK 0 3.290 -28.993 0.000 0.00 0.00 C+0 HETATM 90 C UNK 0 5.500 -30.701 0.000 0.00 0.00 C+0 HETATM 91 C UNK 0 2.539 -31.086 0.000 0.00 0.00 C+0 HETATM 92 C UNK 0 4.845 -32.814 0.000 0.00 0.00 C+0 HETATM 93 C UNK 0 3.751 -23.917 0.000 0.00 0.00 C+0 HETATM 94 O UNK 0 3.481 -15.565 0.000 0.00 0.00 O+0 HETATM 95 O UNK 0 2.941 -18.353 0.000 0.00 0.00 O+0 HETATM 96 C UNK 0 2.113 -19.651 0.000 0.00 0.00 C+0 HETATM 97 C UNK 0 2.433 -21.157 0.000 0.00 0.00 C+0 HETATM 98 C UNK 0 1.288 -22.187 0.000 0.00 0.00 C+0 HETATM 99 C UNK 0 1.609 -23.694 0.000 0.00 0.00 C+0 HETATM 100 C UNK 0 0.464 -24.724 0.000 0.00 0.00 C+0 HETATM 101 C UNK 0 0.784 -26.231 0.000 0.00 0.00 C+0 HETATM 102 C UNK 0 -0.360 -27.261 0.000 0.00 0.00 C+0 HETATM 103 C UNK 0 -0.040 -28.767 0.000 0.00 0.00 C+0 HETATM 104 C UNK 0 -1.184 -29.798 0.000 0.00 0.00 C+0 HETATM 105 C UNK 0 -0.864 -31.304 0.000 0.00 0.00 C+0 HETATM 106 C UNK 0 -2.009 -32.335 0.000 0.00 0.00 C+0 HETATM 107 C UNK 0 -1.688 -33.841 0.000 0.00 0.00 C+0 HETATM 108 C UNK 0 -2.833 -34.872 0.000 0.00 0.00 C+0 HETATM 109 C UNK 0 -2.513 -36.378 0.000 0.00 0.00 C+0 HETATM 110 O UNK 0 0.597 -19.376 0.000 0.00 0.00 O+0 HETATM 111 C UNK 0 12.027 -13.593 0.000 0.00 0.00 C+0 HETATM 112 C UNK 0 12.797 -14.927 0.000 0.00 0.00 C+0 HETATM 113 C UNK 0 12.027 -16.261 0.000 0.00 0.00 C+0 HETATM 114 C UNK 0 12.797 -17.594 0.000 0.00 0.00 C+0 HETATM 115 C UNK 0 12.027 -18.928 0.000 0.00 0.00 C+0 HETATM 116 C UNK 0 12.797 -20.262 0.000 0.00 0.00 C+0 HETATM 117 C UNK 0 12.027 -21.595 0.000 0.00 0.00 C+0 HETATM 118 C UNK 0 12.797 -22.929 0.000 0.00 0.00 C+0 HETATM 119 C UNK 0 12.027 -24.263 0.000 0.00 0.00 C+0 HETATM 120 C UNK 0 12.797 -25.596 0.000 0.00 0.00 C+0 HETATM 121 C UNK 0 12.027 -26.930 0.000 0.00 0.00 C+0 HETATM 122 C UNK 0 12.797 -28.264 0.000 0.00 0.00 C+0 HETATM 123 C UNK 0 12.170 -29.670 0.000 0.00 0.00 C+0 HETATM 124 C UNK 0 13.577 -30.297 0.000 0.00 0.00 C+0 HETATM 125 O UNK 0 10.496 -13.425 0.000 0.00 0.00 O+0 HETATM 126 O UNK 0 10.487 -16.261 0.000 0.00 0.00 O+0 HETATM 127 C UNK 0 9.717 -17.594 0.000 0.00 0.00 C+0 HETATM 128 C UNK 0 10.487 -18.928 0.000 0.00 0.00 C+0 HETATM 129 C UNK 0 9.717 -20.262 0.000 0.00 0.00 C+0 HETATM 130 C UNK 0 10.487 -21.595 0.000 0.00 0.00 C+0 HETATM 131 C UNK 0 9.717 -22.929 0.000 0.00 0.00 C+0 HETATM 132 C UNK 0 10.487 -24.263 0.000 0.00 0.00 C+0 HETATM 133 C UNK 0 9.717 -25.596 0.000 0.00 0.00 C+0 HETATM 134 C UNK 0 10.487 -26.930 0.000 0.00 0.00 C+0 HETATM 135 C UNK 0 9.717 -28.264 0.000 0.00 0.00 C+0 HETATM 136 C UNK 0 10.487 -29.597 0.000 0.00 0.00 C+0 HETATM 137 O UNK 0 8.177 -17.594 0.000 0.00 0.00 O+0 HETATM 138 C UNK 0 9.860 -31.004 0.000 0.00 0.00 C+0 HETATM 139 C UNK 0 10.630 -32.338 0.000 0.00 0.00 C+0 HETATM 140 O UNK 0 20.023 -6.180 0.000 0.00 0.00 O+0 HETATM 141 O UNK 0 15.445 -10.302 0.000 0.00 0.00 O+0 HETATM 142 O UNK 0 18.375 -11.254 0.000 0.00 0.00 O+0 HETATM 143 N UNK 0 22.618 -9.763 0.000 0.00 0.00 N+0 HETATM 144 P UNK 0 19.703 -4.674 0.000 0.00 0.00 P+0 HETATM 145 O UNK 0 17.831 -5.175 0.000 0.00 0.00 O+0 HETATM 146 O UNK 0 19.219 -2.747 0.000 0.00 0.00 O-1 HETATM 147 O UNK 0 21.493 -4.335 0.000 0.00 0.00 O-1 HETATM 148 C UNK 0 17.230 -12.284 0.000 0.00 0.00 C+0 HETATM 149 C UNK 0 21.553 -11.106 0.000 0.00 0.00 C+0 HETATM 150 C UNK 0 18.000 -13.618 0.000 0.00 0.00 C+0 HETATM 151 C UNK 0 17.230 -14.951 0.000 0.00 0.00 C+0 HETATM 152 C UNK 0 18.000 -16.285 0.000 0.00 0.00 C+0 HETATM 153 C UNK 0 17.230 -17.619 0.000 0.00 0.00 C+0 HETATM 154 C UNK 0 18.000 -18.953 0.000 0.00 0.00 C+0 HETATM 155 C UNK 0 17.230 -20.286 0.000 0.00 0.00 C+0 HETATM 156 C UNK 0 18.000 -21.620 0.000 0.00 0.00 C+0 HETATM 157 C UNK 0 17.230 -22.954 0.000 0.00 0.00 C+0 HETATM 158 C UNK 0 18.000 -24.287 0.000 0.00 0.00 C+0 HETATM 159 C UNK 0 17.230 -25.621 0.000 0.00 0.00 C+0 HETATM 160 C UNK 0 18.000 -26.955 0.000 0.00 0.00 C+0 HETATM 161 C UNK 0 17.230 -28.288 0.000 0.00 0.00 C+0 HETATM 162 C UNK 0 18.000 -29.622 0.000 0.00 0.00 C+0 HETATM 163 O UNK 0 15.709 -12.043 0.000 0.00 0.00 O+0 HETATM 164 O UNK 0 15.690 -14.951 0.000 0.00 0.00 O+0 HETATM 165 C UNK 0 22.960 -11.733 0.000 0.00 0.00 C+0 HETATM 166 C UNK 0 21.627 -12.503 0.000 0.00 0.00 C+0 HETATM 167 C UNK 0 23.034 -13.129 0.000 0.00 0.00 C+0 HETATM 168 C UNK 0 22.003 -14.273 0.000 0.00 0.00 C+0 HETATM 169 C UNK 0 22.773 -15.607 0.000 0.00 0.00 C+0 HETATM 170 C UNK 0 22.003 -16.941 0.000 0.00 0.00 C+0 HETATM 171 C UNK 0 22.773 -18.274 0.000 0.00 0.00 C+0 HETATM 172 C UNK 0 22.003 -19.608 0.000 0.00 0.00 C+0 HETATM 173 C UNK 0 22.773 -20.942 0.000 0.00 0.00 C+0 HETATM 174 C UNK 0 22.003 -22.275 0.000 0.00 0.00 C+0 HETATM 175 C UNK 0 22.773 -23.609 0.000 0.00 0.00 C+0 HETATM 176 C UNK 0 21.743 -24.753 0.000 0.00 0.00 C+0 HETATM 177 C UNK 0 22.887 -25.784 0.000 0.00 0.00 C+0 HETATM 178 O UNK 0 20.058 -11.474 0.000 0.00 0.00 O+0 HETATM 179 O UNK 0 20.089 -12.583 0.000 0.00 0.00 O+0 CONECT 1 2 7 6 CONECT 2 1 3 11 CONECT 3 2 4 12 CONECT 4 3 5 13 CONECT 5 4 6 14 CONECT 6 1 5 CONECT 7 1 9 8 CONECT 8 7 CONECT 9 7 10 CONECT 10 9 CONECT 11 2 CONECT 12 3 CONECT 13 4 CONECT 14 5 15 CONECT 15 14 16 20 CONECT 16 17 15 22 CONECT 17 16 18 27 CONECT 18 17 19 CONECT 19 20 23 18 CONECT 20 19 15 21 CONECT 21 20 CONECT 22 16 CONECT 23 19 25 24 CONECT 24 23 CONECT 25 23 26 CONECT 26 25 CONECT 27 17 28 CONECT 28 27 29 33 CONECT 29 30 28 38 CONECT 30 29 31 CONECT 31 30 32 39 40 CONECT 32 31 33 CONECT 33 28 34 32 CONECT 34 33 36 35 CONECT 35 34 CONECT 36 34 37 CONECT 37 36 CONECT 38 29 43 CONECT 39 31 42 41 CONECT 40 31 58 CONECT 41 39 CONECT 42 39 CONECT 43 38 48 49 44 CONECT 44 45 43 CONECT 45 46 54 44 CONECT 46 45 47 52 CONECT 47 46 48 53 CONECT 48 47 43 CONECT 49 43 50 51 CONECT 50 49 CONECT 51 49 CONECT 52 46 CONECT 53 47 CONECT 54 45 55 56 CONECT 55 54 57 CONECT 56 54 CONECT 57 55 CONECT 58 40 59 CONECT 59 58 60 64 CONECT 60 61 59 65 CONECT 61 60 62 66 CONECT 62 61 63 67 CONECT 63 62 64 68 CONECT 64 63 59 CONECT 65 60 69 CONECT 66 61 80 CONECT 67 62 111 CONECT 68 63 73 CONECT 69 65 71 72 70 CONECT 70 69 CONECT 71 69 CONECT 72 69 CONECT 73 68 74 CONECT 74 73 75 79 CONECT 75 76 74 141 CONECT 76 75 77 142 CONECT 77 76 78 143 CONECT 78 77 79 140 CONECT 79 78 74 CONECT 80 66 81 94 CONECT 81 82 80 CONECT 82 81 83 95 CONECT 83 82 84 CONECT 84 83 85 CONECT 85 84 93 CONECT 86 87 93 CONECT 87 86 88 CONECT 88 87 89 CONECT 89 88 90 CONECT 90 89 91 CONECT 91 90 92 CONECT 92 91 CONECT 93 85 86 CONECT 94 80 CONECT 95 82 96 CONECT 96 97 110 95 CONECT 97 96 98 CONECT 98 97 99 CONECT 99 98 100 CONECT 100 99 101 CONECT 101 100 102 CONECT 102 101 103 CONECT 103 102 104 CONECT 104 103 105 CONECT 105 104 106 CONECT 106 105 107 CONECT 107 106 108 CONECT 108 107 109 CONECT 109 108 CONECT 110 96 CONECT 111 67 112 125 CONECT 112 111 113 CONECT 113 112 114 126 CONECT 114 113 115 CONECT 115 114 116 CONECT 116 115 117 CONECT 117 116 118 CONECT 118 117 119 CONECT 119 118 120 CONECT 120 119 121 CONECT 121 120 122 CONECT 122 121 123 CONECT 123 122 124 CONECT 124 123 CONECT 125 111 CONECT 126 113 127 CONECT 127 126 128 137 CONECT 128 127 129 CONECT 129 128 130 CONECT 130 129 131 CONECT 131 130 132 CONECT 132 131 133 CONECT 133 132 134 CONECT 134 133 135 CONECT 135 134 136 CONECT 136 135 138 CONECT 137 127 CONECT 138 136 139 CONECT 139 138 CONECT 140 78 144 CONECT 141 75 CONECT 142 76 148 CONECT 143 77 149 CONECT 144 140 145 146 147 CONECT 145 144 CONECT 146 144 CONECT 147 144 CONECT 148 142 150 163 CONECT 149 143 165 178 CONECT 150 148 151 CONECT 151 150 152 164 CONECT 152 151 153 CONECT 153 152 154 CONECT 154 153 155 CONECT 155 154 156 CONECT 156 155 157 CONECT 157 156 158 CONECT 158 157 159 CONECT 159 158 160 CONECT 160 159 161 CONECT 161 160 162 CONECT 162 161 CONECT 163 148 CONECT 164 151 CONECT 165 149 166 CONECT 166 165 167 179 CONECT 167 166 168 CONECT 168 167 169 CONECT 169 168 170 CONECT 170 169 171 CONECT 171 170 172 CONECT 172 171 173 CONECT 173 172 174 CONECT 174 173 175 CONECT 175 174 176 CONECT 176 175 177 CONECT 177 176 CONECT 178 149 CONECT 179 166 MASTER 0 0 0 0 0 0 0 0 179 0 368 0 END