--- /dev/null
+CRYST1 0.000 0.000 0.000 90.00 90.00 90.00 P 1 1
+ATOM 1 CAY ALA X 1 -19.094 -13.969 1.103 1.00 0.00 A
+ATOM 2 HY1 ALA X 1 -19.147 -13.967 2.213 1.00 0.00 A
+ATOM 3 HY2 ALA X 1 -19.369 -14.974 0.718 1.00 0.00 A
+ATOM 4 HY3 ALA X 1 -19.627 -13.144 0.583 1.00 0.00 A
+ATOM 5 CY ALA X 1 -17.586 -13.763 0.713 1.00 0.00 A
+ATOM 6 OY ALA X 1 -16.805 -14.674 0.925 1.00 0.00 A
+ATOM 7 N ALA X 1 -17.334 -12.571 0.149 1.00 0.00 A
+ATOM 8 HN ALA X 1 -18.132 -11.973 -0.088 1.00 0.00 A
+ATOM 9 CA ALA X 1 -16.084 -12.067 -0.236 1.00 0.00 A
+ATOM 10 HA ALA X 1 -15.347 -12.108 0.594 1.00 0.00 A
+ATOM 11 CB ALA X 1 -15.612 -12.765 -1.505 1.00 0.00 A
+ATOM 12 HB1 ALA X 1 -15.812 -13.856 -1.453 1.00 0.00 A
+ATOM 13 HB2 ALA X 1 -16.243 -12.343 -2.316 1.00 0.00 A
+ATOM 14 HB3 ALA X 1 -14.541 -12.615 -1.763 1.00 0.00 A
+ATOM 15 C ALA X 1 -16.184 -10.555 -0.363 1.00 0.00 A
+ATOM 16 O ALA X 1 -17.252 -10.049 -0.716 1.00 0.00 A
+ATOM 17 N ALA X 2 -15.073 -9.880 -0.135 1.00 0.00 A
+ATOM 18 HN ALA X 2 -14.300 -10.447 0.226 1.00 0.00 A
+ATOM 19 CA ALA X 2 -15.020 -8.478 -0.109 1.00 0.00 A
+ATOM 20 HA ALA X 2 -15.430 -8.073 -1.059 1.00 0.00 A
+ATOM 21 CB ALA X 2 -15.791 -7.905 1.110 1.00 0.00 A
+ATOM 22 HB1 ALA X 2 -16.779 -8.414 1.119 1.00 0.00 A
+ATOM 23 HB2 ALA X 2 -15.349 -8.136 2.103 1.00 0.00 A
+ATOM 24 HB3 ALA X 2 -15.901 -6.800 1.086 1.00 0.00 A
+ATOM 25 C ALA X 2 -13.610 -8.052 -0.212 1.00 0.00 A
+ATOM 26 O ALA X 2 -13.025 -7.663 0.786 1.00 0.00 A
+ATOM 27 N GLN X 3 -12.980 -8.328 -1.408 1.00 0.00 A
+ATOM 28 HN GLN X 3 -13.476 -8.251 -2.302 1.00 0.00 A
+ATOM 29 CA GLN X 3 -11.519 -8.382 -1.521 1.00 0.00 A
+ATOM 30 HA GLN X 3 -10.908 -8.820 -0.703 1.00 0.00 A
+ATOM 31 CB GLN X 3 -11.132 -9.122 -2.811 1.00 0.00 A
+ATOM 32 HB1 GLN X 3 -11.767 -8.887 -3.692 1.00 0.00 A
+ATOM 33 HB2 GLN X 3 -10.085 -8.927 -3.124 1.00 0.00 A
+ATOM 34 CG GLN X 3 -11.221 -10.640 -2.511 1.00 0.00 A
+ATOM 35 HG1 GLN X 3 -10.788 -10.975 -1.544 1.00 0.00 A
+ATOM 36 HG2 GLN X 3 -12.275 -10.945 -2.336 1.00 0.00 A
+ATOM 37 CD GLN X 3 -10.627 -11.431 -3.606 1.00 0.00 A
+ATOM 38 OE1 GLN X 3 -9.408 -11.711 -3.610 1.00 0.00 A
+ATOM 39 NE2 GLN X 3 -11.458 -11.874 -4.542 1.00 0.00 A
+ATOM 40 HE21 GLN X 3 -11.091 -12.430 -5.321 1.00 0.00 A
+ATOM 41 HE22 GLN X 3 -12.477 -11.768 -4.562 1.00 0.00 A
+ATOM 42 C GLN X 3 -11.129 -6.907 -1.631 1.00 0.00 A
+ATOM 43 O GLN X 3 -11.062 -6.338 -2.693 1.00 0.00 A
+ATOM 44 N ALA X 4 -11.031 -6.352 -0.450 1.00 0.00 A
+ATOM 45 HN ALA X 4 -11.600 -6.683 0.335 1.00 0.00 A
+ATOM 46 CA ALA X 4 -10.508 -5.041 -0.137 1.00 0.00 A
+ATOM 47 HA ALA X 4 -11.166 -4.345 -0.701 1.00 0.00 A
+ATOM 48 CB ALA X 4 -10.491 -4.741 1.330 1.00 0.00 A
+ATOM 49 HB1 ALA X 4 -11.459 -4.803 1.870 1.00 0.00 A
+ATOM 50 HB2 ALA X 4 -9.774 -5.399 1.866 1.00 0.00 A
+ATOM 51 HB3 ALA X 4 -10.173 -3.686 1.472 1.00 0.00 A
+ATOM 52 C ALA X 4 -9.124 -4.878 -0.708 1.00 0.00 A
+ATOM 53 O ALA X 4 -8.308 -5.877 -0.725 1.00 0.00 A
+ATOM 54 N ALA X 5 -8.801 -3.649 -1.140 1.00 0.00 A
+ATOM 55 HN ALA X 5 -9.483 -2.891 -1.037 1.00 0.00 A
+ATOM 56 CA ALA X 5 -7.545 -3.320 -1.765 1.00 0.00 A
+ATOM 57 HA ALA X 5 -7.060 -4.118 -2.368 1.00 0.00 A
+ATOM 58 CB ALA X 5 -7.841 -2.103 -2.618 1.00 0.00 A
+ATOM 59 HB1 ALA X 5 -8.505 -2.432 -3.446 1.00 0.00 A
+ATOM 60 HB2 ALA X 5 -8.369 -1.310 -2.046 1.00 0.00 A
+ATOM 61 HB3 ALA X 5 -6.925 -1.605 -3.001 1.00 0.00 A
+ATOM 62 C ALA X 5 -6.579 -3.040 -0.651 1.00 0.00 A
+ATOM 63 O ALA X 5 -6.893 -2.415 0.337 1.00 0.00 A
+ATOM 64 N ALA X 6 -5.304 -3.444 -0.905 1.00 0.00 A
+ATOM 65 HN ALA X 6 -5.078 -3.776 -1.848 1.00 0.00 A
+ATOM 66 CA ALA X 6 -4.161 -3.080 -0.113 1.00 0.00 A
+ATOM 67 HA ALA X 6 -4.204 -2.056 0.314 1.00 0.00 A
+ATOM 68 CB ALA X 6 -3.830 -3.969 1.080 1.00 0.00 A
+ATOM 69 HB1 ALA X 6 -4.440 -3.761 1.985 1.00 0.00 A
+ATOM 70 HB2 ALA X 6 -4.029 -5.025 0.797 1.00 0.00 A
+ATOM 71 HB3 ALA X 6 -2.736 -3.875 1.247 1.00 0.00 A
+ATOM 72 C ALA X 6 -3.081 -3.195 -1.116 1.00 0.00 A
+ATOM 73 O ALA X 6 -2.651 -4.298 -1.440 1.00 0.00 A
+ATOM 74 N ALA X 7 -2.683 -2.043 -1.692 1.00 0.00 A
+ATOM 75 HN ALA X 7 -2.988 -1.129 -1.343 1.00 0.00 A
+ATOM 76 CA ALA X 7 -1.651 -2.110 -2.724 1.00 0.00 A
+ATOM 77 HA ALA X 7 -1.027 -3.028 -2.670 1.00 0.00 A
+ATOM 78 CB ALA X 7 -2.328 -1.951 -4.082 1.00 0.00 A
+ATOM 79 HB1 ALA X 7 -3.054 -2.780 -4.220 1.00 0.00 A
+ATOM 80 HB2 ALA X 7 -3.044 -1.125 -4.281 1.00 0.00 A
+ATOM 81 HB3 ALA X 7 -1.640 -2.051 -4.949 1.00 0.00 A
+ATOM 82 C ALA X 7 -0.736 -0.916 -2.590 1.00 0.00 A
+ATOM 83 O ALA X 7 0.402 -1.039 -3.085 1.00 0.00 A
+ATOM 84 N GLN X 8 -1.196 0.163 -1.917 1.00 0.00 A
+ATOM 85 HN GLN X 8 -2.164 0.288 -1.602 1.00 0.00 A
+ATOM 86 CA GLN X 8 -0.291 1.238 -1.408 1.00 0.00 A
+ATOM 87 HA GLN X 8 -0.153 1.978 -2.225 1.00 0.00 A
+ATOM 88 CB GLN X 8 -1.207 1.927 -0.346 1.00 0.00 A
+ATOM 89 HB1 GLN X 8 -2.198 2.121 -0.810 1.00 0.00 A
+ATOM 90 HB2 GLN X 8 -1.400 1.179 0.452 1.00 0.00 A
+ATOM 91 CG GLN X 8 -0.655 3.164 0.365 1.00 0.00 A
+ATOM 92 HG1 GLN X 8 -0.309 3.793 -0.483 1.00 0.00 A
+ATOM 93 HG2 GLN X 8 -1.523 3.586 0.916 1.00 0.00 A
+ATOM 94 CD GLN X 8 0.387 2.984 1.338 1.00 0.00 A
+ATOM 95 OE1 GLN X 8 1.555 3.279 1.084 1.00 0.00 A
+ATOM 96 NE2 GLN X 8 0.132 2.346 2.454 1.00 0.00 A
+ATOM 97 HE21 GLN X 8 0.934 2.266 3.088 1.00 0.00 A
+ATOM 98 HE22 GLN X 8 -0.847 2.135 2.673 1.00 0.00 A
+ATOM 99 C GLN X 8 0.998 0.715 -0.887 1.00 0.00 A
+ATOM 100 O GLN X 8 1.068 -0.126 0.007 1.00 0.00 A
+ATOM 101 N ALA X 9 2.091 1.322 -1.302 1.00 0.00 A
+ATOM 102 HN ALA X 9 2.054 1.833 -2.190 1.00 0.00 A
+ATOM 103 CA ALA X 9 3.407 0.930 -0.856 1.00 0.00 A
+ATOM 104 HA ALA X 9 3.676 0.992 0.220 1.00 0.00 A
+ATOM 105 CB ALA X 9 3.711 -0.463 -1.462 1.00 0.00 A
+ATOM 106 HB1 ALA X 9 3.175 -1.228 -0.859 1.00 0.00 A
+ATOM 107 HB2 ALA X 9 3.378 -0.464 -2.522 1.00 0.00 A
+ATOM 108 HB3 ALA X 9 4.802 -0.625 -1.331 1.00 0.00 A
+ATOM 109 C ALA X 9 4.241 2.008 -1.444 1.00 0.00 A
+ATOM 110 O ALA X 9 5.032 1.730 -2.370 1.00 0.00 A
+ATOM 111 N ALA X 10 3.951 3.222 -0.912 1.00 0.00 A
+ATOM 112 HN ALA X 10 3.360 3.214 -0.075 1.00 0.00 A
+ATOM 113 CA ALA X 10 4.582 4.514 -1.347 1.00 0.00 A
+ATOM 114 HA ALA X 10 4.560 4.569 -2.456 1.00 0.00 A
+ATOM 115 CB ALA X 10 3.828 5.719 -0.794 1.00 0.00 A
+ATOM 116 HB1 ALA X 10 4.120 6.033 0.231 1.00 0.00 A
+ATOM 117 HB2 ALA X 10 3.993 6.554 -1.508 1.00 0.00 A
+ATOM 118 HB3 ALA X 10 2.727 5.570 -0.808 1.00 0.00 A
+ATOM 119 C ALA X 10 6.040 4.475 -1.023 1.00 0.00 A
+ATOM 120 O ALA X 10 6.481 3.720 -0.124 1.00 0.00 A
+ATOM 121 N ALA X 11 6.805 5.411 -1.671 1.00 0.00 A
+ATOM 122 HN ALA X 11 6.564 5.578 -2.654 1.00 0.00 A
+ATOM 123 CA ALA X 11 8.073 5.810 -1.173 1.00 0.00 A
+ATOM 124 HA ALA X 11 8.425 5.173 -0.334 1.00 0.00 A
+ATOM 125 CB ALA X 11 9.073 5.763 -2.346 1.00 0.00 A
+ATOM 126 HB1 ALA X 11 9.036 4.765 -2.834 1.00 0.00 A
+ATOM 127 HB2 ALA X 11 8.922 6.527 -3.138 1.00 0.00 A
+ATOM 128 HB3 ALA X 11 10.094 5.866 -1.921 1.00 0.00 A
+ATOM 129 C ALA X 11 7.790 7.218 -0.697 1.00 0.00 A
+ATOM 130 O ALA X 11 7.586 8.125 -1.492 1.00 0.00 A
+ATOM 131 N ALA X 12 7.659 7.358 0.586 1.00 0.00 A
+ATOM 132 HN ALA X 12 7.655 6.546 1.211 1.00 0.00 A
+ATOM 133 CA ALA X 12 7.741 8.689 1.248 1.00 0.00 A
+ATOM 134 HA ALA X 12 7.168 9.406 0.622 1.00 0.00 A
+ATOM 135 CB ALA X 12 7.063 8.697 2.624 1.00 0.00 A
+ATOM 136 HB1 ALA X 12 5.962 8.670 2.479 1.00 0.00 A
+ATOM 137 HB2 ALA X 12 7.487 7.872 3.236 1.00 0.00 A
+ATOM 138 HB3 ALA X 12 7.442 9.656 3.037 1.00 0.00 A
+ATOM 139 C ALA X 12 9.155 8.988 1.097 1.00 0.00 A
+ATOM 140 O ALA X 12 9.999 8.272 1.784 1.00 0.00 A
+ATOM 141 N GLN X 13 9.516 9.879 0.157 1.00 0.00 A
+ATOM 142 HN GLN X 13 8.750 10.335 -0.349 1.00 0.00 A
+ATOM 143 CA GLN X 13 10.821 10.434 0.048 1.00 0.00 A
+ATOM 144 HA GLN X 13 11.463 9.555 -0.174 1.00 0.00 A
+ATOM 145 CB GLN X 13 10.990 11.289 -1.203 1.00 0.00 A
+ATOM 146 HB1 GLN X 13 10.752 10.503 -1.951 1.00 0.00 A
+ATOM 147 HB2 GLN X 13 10.110 11.965 -1.153 1.00 0.00 A
+ATOM 148 CG GLN X 13 12.288 12.175 -1.352 1.00 0.00 A
+ATOM 149 HG1 GLN X 13 12.137 12.955 -2.129 1.00 0.00 A
+ATOM 150 HG2 GLN X 13 12.452 12.615 -0.346 1.00 0.00 A
+ATOM 151 CD GLN X 13 13.421 11.301 -1.650 1.00 0.00 A
+ATOM 152 OE1 GLN X 13 13.902 10.614 -0.720 1.00 0.00 A
+ATOM 153 NE2 GLN X 13 13.988 11.307 -2.870 1.00 0.00 A
+ATOM 154 HE21 GLN X 13 14.793 10.744 -3.160 1.00 0.00 A
+ATOM 155 HE22 GLN X 13 13.590 11.736 -3.712 1.00 0.00 A
+ATOM 156 C GLN X 13 11.221 11.104 1.345 1.00 0.00 A
+ATOM 157 O GLN X 13 10.342 11.786 1.904 1.00 0.00 A
+ATOM 158 N ALA X 14 12.543 11.059 1.605 1.00 0.00 A
+ATOM 159 HN ALA X 14 13.147 10.770 0.829 1.00 0.00 A
+ATOM 160 CA ALA X 14 13.123 11.361 2.878 1.00 0.00 A
+ATOM 161 HA ALA X 14 12.788 12.408 3.043 1.00 0.00 A
+ATOM 162 CB ALA X 14 12.557 10.437 3.961 1.00 0.00 A
+ATOM 163 HB1 ALA X 14 11.453 10.558 4.008 1.00 0.00 A
+ATOM 164 HB2 ALA X 14 12.888 9.440 3.600 1.00 0.00 A
+ATOM 165 HB3 ALA X 14 12.918 10.589 5.000 1.00 0.00 A
+ATOM 166 C ALA X 14 14.610 11.418 2.775 1.00 0.00 A
+ATOM 167 O ALA X 14 15.246 11.529 3.839 1.00 0.00 A
+ATOM 168 N ALA X 15 15.227 11.328 1.582 1.00 0.00 A
+ATOM 169 HN ALA X 15 14.723 11.125 0.741 1.00 0.00 A
+ATOM 170 CA ALA X 15 16.658 11.428 1.401 1.00 0.00 A
+ATOM 171 HA ALA X 15 17.128 11.778 2.312 1.00 0.00 A
+ATOM 172 CB ALA X 15 17.224 10.038 1.049 1.00 0.00 A
+ATOM 173 HB1 ALA X 15 16.976 9.317 1.857 1.00 0.00 A
+ATOM 174 HB2 ALA X 15 16.785 9.667 0.098 1.00 0.00 A
+ATOM 175 HB3 ALA X 15 18.328 10.082 0.939 1.00 0.00 A
+ATOM 176 C ALA X 15 16.986 12.460 0.276 1.00 0.00 A
+ATOM 177 O ALA X 15 17.474 12.148 -0.811 1.00 0.00 A
+ATOM 178 NT ALA X 15 16.694 13.758 0.535 1.00 0.00 A
+ATOM 179 HT1 ALA X 15 16.921 14.414 -0.177 1.00 0.00 A
+ATOM 180 HT2 ALA X 15 16.293 14.006 1.412 1.00 0.00 A
+ATOM 181 OH2 TIP3X 1 28.243 24.013 23.451 0.00 0.00 WT1 O
+ATOM 182 H1 TIP3X 1 29.061 24.406 23.263 0.00 0.00 WT1 H
+ATOM 183 H2 TIP3X 1 28.513 23.071 23.526 0.00 0.00 WT1 H
+ATOM 184 OH2 TIP3X 2 -27.860 29.861 -26.672 0.00 0.00 WT1 O
+ATOM 185 H1 TIP3X 2 -27.678 28.960 -26.683 0.00 0.00 WT1 H
+ATOM 186 H2 TIP3X 2 -28.697 29.922 -27.088 0.00 0.00 WT1 H
+ATOM 187 OH2 TIP3X 3 -19.244 21.344 -28.144 0.00 0.00 WT1 O
+ATOM 188 H1 TIP3X 3 -19.473 21.366 -27.167 0.00 0.00 WT1 H
+ATOM 189 H2 TIP3X 3 -19.961 21.747 -28.546 0.00 0.00 WT1 H
+ATOM 190 OH2 TIP3X 4 19.402 -24.878 -18.608 0.00 0.00 WT1 O
+ATOM 191 H1 TIP3X 4 19.609 -24.701 -19.571 0.00 0.00 WT1 H
+ATOM 192 H2 TIP3X 4 18.471 -24.594 -18.411 0.00 0.00 WT1 H
+ATOM 193 OH2 TIP3X 5 -28.332 -21.918 -16.096 0.00 0.00 WT1 O
+ATOM 194 H1 TIP3X 5 -28.776 -21.549 -16.899 0.00 0.00 WT1 H
+ATOM 195 H2 TIP3X 5 -28.908 -21.621 -15.373 0.00 0.00 WT1 H
+ATOM 196 OH2 TIP3X 6 29.926 -21.653 25.923 0.00 0.00 WT1 O
+ATOM 197 H1 TIP3X 6 30.469 -22.263 25.275 0.00 0.00 WT1 H
+ATOM 198 H2 TIP3X 6 29.370 -21.095 25.358 0.00 0.00 WT1 H
+ATOM 199 OH2 TIP3X 7 -25.967 -27.124 -11.109 0.00 0.00 WT1 O
+ATOM 200 H1 TIP3X 7 -25.922 -26.776 -10.202 0.00 0.00 WT1 H
+ATOM 201 H2 TIP3X 7 -25.408 -27.912 -11.039 0.00 0.00 WT1 H
+ATOM 202 OH2 TIP3X 8 -27.431 -28.040 -2.113 0.00 0.00 WT1 O
+ATOM 203 H1 TIP3X 8 -28.041 -28.840 -2.020 0.00 0.00 WT1 H
+ATOM 204 H2 TIP3X 8 -28.005 -27.345 -2.578 0.00 0.00 WT1 H
+ATOM 205 OH2 TIP3X 9 29.366 28.616 -19.121 0.00 0.00 WT1 O
+ATOM 206 H1 TIP3X 9 29.510 29.314 -18.413 0.00 0.00 WT1 H
+ATOM 207 H2 TIP3X 9 28.768 27.981 -18.689 0.00 0.00 WT1 H
+ATOM 208 OH2 TIP3X 11 28.718 -29.583 -27.459 0.00 0.00 WT1 O
+ATOM 209 H1 TIP3X 11 28.127 -29.939 -26.778 0.00 0.00 WT1 H
+ATOM 210 H2 TIP3X 11 28.558 -28.571 -27.319 0.00 0.00 WT1 H
+ATOM 211 OH2 TIP3X 12 27.567 -25.414 2.123 0.00 0.00 WT1 O
+ATOM 212 H1 TIP3X 12 27.893 -24.681 1.526 0.00 0.00 WT1 H
+ATOM 213 H2 TIP3X 12 27.377 -26.190 1.503 0.00 0.00 WT1 H
+ATOM 214 OH2 TIP3X 13 30.198 -31.035 16.583 0.00 0.00 WT1 O
+ATOM 215 H1 TIP3X 13 29.390 -31.519 16.710 0.00 0.00 WT1 H
+ATOM 216 H2 TIP3X 13 29.944 -30.094 16.487 0.00 0.00 WT1 H
+ATOM 217 OH2 TIP3X 14 -31.204 31.517 13.834 0.00 0.00 WT1 O
+ATOM 218 H1 TIP3X 14 -31.065 30.500 13.907 0.00 0.00 WT1 H
+ATOM 219 H2 TIP3X 14 -31.953 31.565 14.457 0.00 0.00 WT1 H
+ATOM 220 OH2 TIP3X 15 -31.025 -17.993 6.567 0.00 0.00 WT1 O
+ATOM 221 H1 TIP3X 15 -30.863 -18.737 5.966 0.00 0.00 WT1 H
+ATOM 222 H2 TIP3X 15 -31.381 -18.461 7.360 0.00 0.00 WT1 H
+ATOM 223 OH2 TIP3X 16 27.895 -29.426 10.983 0.00 0.00 WT1 O
+ATOM 224 H1 TIP3X 16 27.710 -29.101 10.107 0.00 0.00 WT1 H
+ATOM 225 H2 TIP3X 16 27.067 -29.164 11.462 0.00 0.00 WT1 H
+ATOM 226 OH2 TIP3X 17 -25.613 -31.626 18.856 0.00 0.00 WT1 O
+ATOM 227 H1 TIP3X 17 -25.694 -31.900 17.924 0.00 0.00 WT1 H
+ATOM 228 H2 TIP3X 17 -24.844 -30.974 18.774 0.00 0.00 WT1 H
+ATOM 229 OH2 TIP3X 19 -31.076 -27.751 18.231 0.00 0.00 WT1 O
+ATOM 230 H1 TIP3X 19 -30.647 -28.286 18.991 0.00 0.00 WT1 H
+ATOM 231 H2 TIP3X 19 -31.340 -26.914 18.717 0.00 0.00 WT1 H
+ATOM 232 OH2 TIP3X 20 -25.464 -28.958 24.393 0.00 0.00 WT1 O
+ATOM 233 H1 TIP3X 20 -25.077 -29.456 23.606 0.00 0.00 WT1 H
+ATOM 234 H2 TIP3X 20 -24.785 -28.234 24.585 0.00 0.00 WT1 H
+ATOM 235 OH2 TIP3X 21 -26.814 -15.304 -19.928 0.00 0.00 WT1 O
+ATOM 236 H1 TIP3X 21 -25.917 -15.021 -20.184 0.00 0.00 WT1 H
+ATOM 237 H2 TIP3X 21 -26.663 -16.168 -19.510 0.00 0.00 WT1 H
+ATOM 238 OH2 TIP3X 22 18.896 -27.095 -21.844 0.00 0.00 WT1 O
+ATOM 239 H1 TIP3X 22 18.336 -26.373 -21.511 0.00 0.00 WT1 H
+ATOM 240 H2 TIP3X 22 19.214 -26.680 -22.697 0.00 0.00 WT1 H
+ATOM 241 OH2 TIP3X 23 31.067 -13.593 -27.637 0.00 0.00 WT1 O
+ATOM 242 H1 TIP3X 23 30.687 -14.304 -27.132 0.00 0.00 WT1 H
+ATOM 243 H2 TIP3X 23 30.642 -12.794 -27.264 0.00 0.00 WT1 H
+ATOM 244 OH2 TIP3X 24 31.076 -20.281 -17.775 0.00 0.00 WT1 O
+ATOM 245 H1 TIP3X 24 31.622 -20.948 -18.180 0.00 0.00 WT1 H
+ATOM 246 H2 TIP3X 24 31.162 -19.493 -18.398 0.00 0.00 WT1 H
+ATOM 247 OH2 TIP3X 25 29.407 -11.481 -20.692 0.00 0.00 WT1 O
+ATOM 248 H1 TIP3X 25 28.497 -11.164 -20.881 0.00 0.00 WT1 H
+ATOM 249 H2 TIP3X 25 29.356 -11.537 -19.751 0.00 0.00 WT1 H
+ATOM 250 OH2 TIP3X 26 -17.563 -26.206 -1.444 0.00 0.00 WT1 O
+ATOM 251 H1 TIP3X 26 -18.476 -26.681 -1.468 0.00 0.00 WT1 H
+ATOM 252 H2 TIP3X 26 -17.016 -26.887 -1.027 0.00 0.00 WT1 H
+ATOM 253 OH2 TIP3X 29 -23.676 -18.189 -10.668 0.00 0.00 WT1 O
+ATOM 254 H1 TIP3X 29 -23.367 -18.652 -9.888 0.00 0.00 WT1 H
+ATOM 255 H2 TIP3X 29 -23.494 -18.884 -11.355 0.00 0.00 WT1 H
+ATOM 256 OH2 TIP3X 30 -20.538 -5.974 -0.627 0.00 0.00 WT1 O
+ATOM 257 H1 TIP3X 30 -20.614 -5.305 0.076 0.00 0.00 WT1 H
+ATOM 258 H2 TIP3X 30 -21.381 -5.920 -1.064 0.00 0.00 WT1 H
+ATOM 259 OH2 TIP3X 32 31.224 -26.673 2.041 0.00 0.00 WT1 O
+ATOM 260 H1 TIP3X 32 30.751 -27.307 1.602 0.00 0.00 WT1 H
+ATOM 261 H2 TIP3X 32 31.117 -26.957 2.986 0.00 0.00 WT1 H
+ATOM 262 OH2 TIP3X 33 30.514 -30.317 3.946 0.00 0.00 WT1 O
+ATOM 263 H1 TIP3X 33 29.817 -30.694 4.551 0.00 0.00 WT1 H
+ATOM 264 H2 TIP3X 33 31.258 -30.315 4.547 0.00 0.00 WT1 H
+ATOM 265 OH2 TIP3X 34 -23.563 -29.831 19.651 0.00 0.00 WT1 O
+ATOM 266 H1 TIP3X 34 -22.961 -29.600 18.893 0.00 0.00 WT1 H
+ATOM 267 H2 TIP3X 34 -23.729 -29.088 20.144 0.00 0.00 WT1 H
+ATOM 268 OH2 TIP3X 38 26.634 24.856 7.835 0.00 0.00 WT1 O
+ATOM 269 H1 TIP3X 38 25.865 24.549 8.306 0.00 0.00 WT1 H
+ATOM 270 H2 TIP3X 38 26.289 24.977 6.920 0.00 0.00 WT1 H
+ATOM 271 OH2 TIP3X 41 -24.361 -22.403 30.226 0.00 0.00 WT1 O
+ATOM 272 H1 TIP3X 41 -24.627 -21.652 29.586 0.00 0.00 WT1 H
+ATOM 273 H2 TIP3X 41 -25.260 -22.581 30.590 0.00 0.00 WT1 H
+ATOM 274 OH2 TIP3X 42 -28.691 -24.290 29.643 0.00 0.00 WT1 O
+ATOM 275 H1 TIP3X 42 -28.392 -23.771 30.471 0.00 0.00 WT1 H
+ATOM 276 H2 TIP3X 42 -29.274 -24.966 29.965 0.00 0.00 WT1 H
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+ATOM 278 H1 TIP3X 43 24.191 -11.475 -21.872 0.00 0.00 WT1 H
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+ATOM 281 H1 TIP3X 44 -28.219 -16.612 -30.804 0.00 0.00 WT1 H
+ATOM 282 H2 TIP3X 44 -27.472 -15.420 -31.219 0.00 0.00 WT1 H
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+ATOM 284 H1 TIP3X 45 28.120 -20.627 -8.013 0.00 0.00 WT1 H
+ATOM 285 H2 TIP3X 45 28.093 -19.149 -8.556 0.00 0.00 WT1 H
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+ATOM 287 H1 TIP3X 46 -25.218 -24.653 -12.848 0.00 0.00 WT1 H
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+ATOM 290 H1 TIP3X 47 -15.930 -17.728 -28.274 0.00 0.00 WT1 H
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+ATOM 305 H1 TIP3X 54 20.216 30.683 -5.932 0.00 0.00 WT1 H
+ATOM 306 H2 TIP3X 54 21.491 29.847 -5.538 0.00 0.00 WT1 H
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+ATOM 309 H2 TIP3X 55 -28.214 -24.572 -4.188 0.00 0.00 WT1 H
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+ATOM 329 H1 TIP3X 63 28.863 -14.828 26.174 0.00 0.00 WT1 H
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+ATOM 509 H1 TIP3X 133 -24.036 -28.389 -12.674 0.00 0.00 WT1 H
+ATOM 510 H2 TIP3X 133 -23.957 -26.936 -12.847 0.00 0.00 WT1 H
+ATOM 511 OH2 TIP3X 134 -23.619 -14.681 -8.725 0.00 0.00 WT1 O
+ATOM 512 H1 TIP3X 134 -24.484 -14.660 -8.305 0.00 0.00 WT1 H
+ATOM 513 H2 TIP3X 134 -23.569 -13.737 -8.991 0.00 0.00 WT1 H
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+ATOM 515 H1 TIP3X 135 -27.158 -21.303 -6.322 0.00 0.00 WT1 H
+ATOM 516 H2 TIP3X 135 -27.097 -19.852 -6.422 0.00 0.00 WT1 H
+ATOM 517 OH2 TIP3X 136 29.724 -9.362 -0.439 0.00 0.00 WT1 O
+ATOM 518 H1 TIP3X 136 30.035 -10.215 -0.163 0.00 0.00 WT1 H
+ATOM 519 H2 TIP3X 136 29.754 -9.447 -1.506 0.00 0.00 WT1 H
+ATOM 520 OH2 TIP3X 137 -30.330 -16.325 -2.834 0.00 0.00 WT1 O
+ATOM 521 H1 TIP3X 137 -29.880 -16.050 -2.026 0.00 0.00 WT1 H
+ATOM 522 H2 TIP3X 137 -31.237 -16.483 -2.532 0.00 0.00 WT1 H
+ATOM 523 OH2 TIP3X 138 16.052 -20.429 17.732 0.00 0.00 WT1 O
+ATOM 524 H1 TIP3X 138 16.599 -21.059 18.232 0.00 0.00 WT1 H
+ATOM 525 H2 TIP3X 138 15.169 -20.591 18.096 0.00 0.00 WT1 H
+ATOM 526 OH2 TIP3X 139 28.866 -13.598 3.873 0.00 0.00 WT1 O
+ATOM 527 H1 TIP3X 139 28.242 -13.140 3.343 0.00 0.00 WT1 H
+ATOM 528 H2 TIP3X 139 28.268 -13.974 4.639 0.00 0.00 WT1 H
+ATOM 529 OH2 TIP3X 140 27.524 -13.944 10.424 0.00 0.00 WT1 O
+ATOM 530 H1 TIP3X 140 27.906 -13.949 9.556 0.00 0.00 WT1 H
+ATOM 531 H2 TIP3X 140 28.279 -13.911 11.037 0.00 0.00 WT1 H
+ATOM 532 OH2 TIP3X 142 21.791 -19.900 2.463 0.00 0.00 WT1 O
+ATOM 533 H1 TIP3X 142 21.799 -20.220 1.503 0.00 0.00 WT1 H
+ATOM 534 H2 TIP3X 142 21.083 -19.237 2.462 0.00 0.00 WT1 H
+ATOM 535 OH2 TIP3X 143 21.458 -28.781 17.728 0.00 0.00 WT1 O
+ATOM 536 H1 TIP3X 143 20.625 -28.212 17.715 0.00 0.00 WT1 H
+ATOM 537 H2 TIP3X 143 21.994 -28.489 16.965 0.00 0.00 WT1 H
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+ATOM 539 H1 TIP3X 145 -15.146 -4.770 -29.501 0.00 0.00 WT1 H
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+ATOM 542 H1 TIP3X 146 -22.900 0.283 -23.266 0.00 0.00 WT1 H
+ATOM 543 H2 TIP3X 146 -23.193 1.795 -23.432 0.00 0.00 WT1 H
+ATOM 544 OH2 TIP3X 147 -24.318 -15.535 29.067 0.00 0.00 WT1 O
+ATOM 545 H1 TIP3X 147 -25.266 -15.379 29.083 0.00 0.00 WT1 H
+ATOM 546 H2 TIP3X 147 -24.018 -15.031 29.884 0.00 0.00 WT1 H
+ATOM 547 OH2 TIP3X 148 -25.979 -24.516 25.109 0.00 0.00 WT1 O
+ATOM 548 H1 TIP3X 148 -26.335 -24.038 25.878 0.00 0.00 WT1 H
+ATOM 549 H2 TIP3X 148 -25.843 -23.892 24.470 0.00 0.00 WT1 H
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+ATOM 551 H1 TIP3X 149 -31.421 -5.935 -26.495 0.00 0.00 WT1 H
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+ATOM 569 H1 TIP3X 157 29.047 -6.348 -1.486 0.00 0.00 WT1 H
+ATOM 570 H2 TIP3X 157 29.495 -7.092 -0.233 0.00 0.00 WT1 H
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+ATOM 572 H1 TIP3X 158 19.791 -2.707 1.770 0.00 0.00 WT1 H
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+ATOM 574 OH2 TIP3X 159 26.042 -12.127 13.283 0.00 0.00 WT1 O
+ATOM 575 H1 TIP3X 159 25.627 -11.272 13.118 0.00 0.00 WT1 H
+ATOM 576 H2 TIP3X 159 25.402 -12.684 12.941 0.00 0.00 WT1 H
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+ATOM 578 H1 TIP3X 160 13.317 -6.352 16.511 0.00 0.00 WT1 H
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+ATOM 594 H2 TIP3X 165 -29.058 -23.259 21.459 0.00 0.00 WT1 H
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+ATOM 596 H1 TIP3X 166 12.978 -13.537 25.003 0.00 0.00 WT1 H
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+ATOM 745 OH2 TIP3X 228 21.462 19.854 23.498 0.00 0.00 WT1 O
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+ATOM 749 H1 TIP3X 229 27.478 5.788 23.736 0.00 0.00 WT1 H
+ATOM 750 H2 TIP3X 229 28.055 4.358 23.728 0.00 0.00 WT1 H
+ATOM 751 OH2 TIP3X 230 29.685 1.358 20.741 0.00 0.00 WT1 O
+ATOM 752 H1 TIP3X 230 29.265 2.111 21.262 0.00 0.00 WT1 H
+ATOM 753 H2 TIP3X 230 30.382 1.109 21.340 0.00 0.00 WT1 H
+ATOM 754 OH2 TIP3X 231 -20.328 1.151 9.475 0.00 0.00 WT1 O
+ATOM 755 H1 TIP3X 231 -20.843 0.335 9.571 0.00 0.00 WT1 H
+ATOM 756 H2 TIP3X 231 -19.891 1.295 10.322 0.00 0.00 WT1 H
+ATOM 757 OH2 TIP3X 232 -19.735 -10.115 19.886 0.00 0.00 WT1 O
+ATOM 758 H1 TIP3X 232 -19.347 -10.873 19.369 0.00 0.00 WT1 H
+ATOM 759 H2 TIP3X 232 -19.036 -9.453 19.865 0.00 0.00 WT1 H
+ATOM 760 OH2 TIP3X 233 28.152 2.834 -20.358 0.00 0.00 WT1 O
+ATOM 761 H1 TIP3X 233 27.680 3.746 -20.396 0.00 0.00 WT1 H
+ATOM 762 H2 TIP3X 233 28.089 2.556 -19.449 0.00 0.00 WT1 H
+ATOM 763 OH2 TIP3X 234 -29.691 -1.722 30.894 0.00 0.00 WT1 O
+ATOM 764 H1 TIP3X 234 -29.267 -0.895 31.284 0.00 0.00 WT1 H
+ATOM 765 H2 TIP3X 234 -29.004 -2.376 31.054 0.00 0.00 WT1 H
+ATOM 766 OH2 TIP3X 235 16.019 6.731 -16.641 0.00 0.00 WT1 O
+ATOM 767 H1 TIP3X 235 15.167 6.671 -17.143 0.00 0.00 WT1 H
+ATOM 768 H2 TIP3X 235 16.056 5.760 -16.248 0.00 0.00 WT1 H
+ATOM 769 OH2 TIP3X 236 29.982 -11.996 -17.963 0.00 0.00 WT1 O
+ATOM 770 H1 TIP3X 236 30.281 -12.720 -17.413 0.00 0.00 WT1 H
+ATOM 771 H2 TIP3X 236 30.244 -11.143 -17.470 0.00 0.00 WT1 H
+ATOM 772 OH2 TIP3X 237 -31.435 -2.748 -30.417 0.00 0.00 WT1 O
+ATOM 773 H1 TIP3X 237 -30.537 -2.438 -30.264 0.00 0.00 WT1 H
+ATOM 774 H2 TIP3X 237 -31.414 -3.665 -30.212 0.00 0.00 WT1 H
+ATOM 775 OH2 TIP3X 238 -18.261 1.516 5.538 0.00 0.00 WT1 O
+ATOM 776 H1 TIP3X 238 -18.658 1.364 4.663 0.00 0.00 WT1 H
+ATOM 777 H2 TIP3X 238 -18.871 0.963 6.063 0.00 0.00 WT1 H
+ATOM 778 OH2 TIP3X 239 -18.388 -14.320 -13.378 0.00 0.00 WT1 O
+ATOM 779 H1 TIP3X 239 -18.256 -14.586 -12.492 0.00 0.00 WT1 H
+ATOM 780 H2 TIP3X 239 -17.474 -14.169 -13.653 0.00 0.00 WT1 H
+ATOM 781 OH2 TIP3X 240 31.023 1.370 5.908 0.00 0.00 WT1 O
+ATOM 782 H1 TIP3X 240 30.652 1.904 5.133 0.00 0.00 WT1 H
+ATOM 783 H2 TIP3X 240 31.084 2.003 6.651 0.00 0.00 WT1 H
+ATOM 784 OH2 TIP3X 241 28.218 -9.812 -5.264 0.00 0.00 WT1 O
+ATOM 785 H1 TIP3X 241 27.506 -10.304 -4.959 0.00 0.00 WT1 H
+ATOM 786 H2 TIP3X 241 27.768 -9.063 -5.688 0.00 0.00 WT1 H
+ATOM 787 OH2 TIP3X 242 -21.885 17.941 -2.676 0.00 0.00 WT1 O
+ATOM 788 H1 TIP3X 242 -21.387 17.208 -3.014 0.00 0.00 WT1 H
+ATOM 789 H2 TIP3X 242 -21.498 18.092 -1.845 0.00 0.00 WT1 H
+ATOM 790 OH2 TIP3X 243 28.072 9.295 13.706 0.00 0.00 WT1 O
+ATOM 791 H1 TIP3X 243 28.462 10.111 13.949 0.00 0.00 WT1 H
+ATOM 792 H2 TIP3X 243 27.265 9.601 13.226 0.00 0.00 WT1 H
+ATOM 793 OH2 TIP3X 244 16.988 19.272 -10.946 0.00 0.00 WT1 O
+ATOM 794 H1 TIP3X 244 16.330 18.980 -10.291 0.00 0.00 WT1 H
+ATOM 795 H2 TIP3X 244 17.105 20.151 -10.612 0.00 0.00 WT1 H
+ATOM 796 OH2 TIP3X 245 27.323 -4.513 -8.318 0.00 0.00 WT1 O
+ATOM 797 H1 TIP3X 245 27.965 -5.291 -8.233 0.00 0.00 WT1 H
+ATOM 798 H2 TIP3X 245 27.904 -3.750 -8.105 0.00 0.00 WT1 H
+ATOM 799 OH2 TIP3X 246 24.877 12.144 3.882 0.00 0.00 WT1 O
+ATOM 800 H1 TIP3X 246 25.428 12.469 4.595 0.00 0.00 WT1 H
+ATOM 801 H2 TIP3X 246 24.519 11.325 4.158 0.00 0.00 WT1 H
+ATOM 802 OH2 TIP3X 247 -22.740 6.463 24.307 0.00 0.00 WT1 O
+ATOM 803 H1 TIP3X 247 -22.684 6.168 23.404 0.00 0.00 WT1 H
+ATOM 804 H2 TIP3X 247 -23.694 6.436 24.533 0.00 0.00 WT1 H
+ATOM 805 OH2 TIP3X 248 -29.830 13.398 21.835 0.00 0.00 WT1 O
+ATOM 806 H1 TIP3X 248 -29.636 13.002 20.996 0.00 0.00 WT1 H
+ATOM 807 H2 TIP3X 248 -29.002 13.807 22.034 0.00 0.00 WT1 H
+ATOM 808 OH2 TIP3X 250 -30.024 4.960 22.351 0.00 0.00 WT1 O
+ATOM 809 H1 TIP3X 250 -30.224 4.257 22.989 0.00 0.00 WT1 H
+ATOM 810 H2 TIP3X 250 -29.546 5.627 22.899 0.00 0.00 WT1 H
+ATOM 811 OH2 TIP3X 251 -26.789 18.438 15.713 0.00 0.00 WT1 O
+ATOM 812 H1 TIP3X 251 -25.839 18.314 15.491 0.00 0.00 WT1 H
+ATOM 813 H2 TIP3X 251 -26.746 18.551 16.678 0.00 0.00 WT1 H
+ATOM 814 OH2 TIP3X 252 -22.142 6.394 -26.444 0.00 0.00 WT1 O
+ATOM 815 H1 TIP3X 252 -22.914 6.132 -26.008 0.00 0.00 WT1 H
+ATOM 816 H2 TIP3X 252 -21.715 7.003 -25.917 0.00 0.00 WT1 H
+ATOM 817 OH2 TIP3X 253 -21.918 2.674 -20.066 0.00 0.00 WT1 O
+ATOM 818 H1 TIP3X 253 -21.792 3.123 -19.205 0.00 0.00 WT1 H
+ATOM 819 H2 TIP3X 253 -22.552 3.288 -20.455 0.00 0.00 WT1 H
+ATOM 820 OH2 TIP3X 255 -24.766 13.628 -29.805 0.00 0.00 WT1 O
+ATOM 821 H1 TIP3X 255 -24.183 13.255 -30.472 0.00 0.00 WT1 H
+ATOM 822 H2 TIP3X 255 -24.189 14.302 -29.443 0.00 0.00 WT1 H
+ATOM 823 OH2 TIP3X 256 25.725 -3.804 -19.785 0.00 0.00 WT1 O
+ATOM 824 H1 TIP3X 256 26.497 -3.428 -20.230 0.00 0.00 WT1 H
+ATOM 825 H2 TIP3X 256 26.083 -4.531 -19.290 0.00 0.00 WT1 H
+ATOM 826 OH2 TIP3X 257 -26.115 3.212 -24.437 0.00 0.00 WT1 O
+ATOM 827 H1 TIP3X 257 -26.491 3.849 -25.109 0.00 0.00 WT1 H
+ATOM 828 H2 TIP3X 257 -25.198 3.079 -24.688 0.00 0.00 WT1 H
+ATOM 829 OH2 TIP3X 258 -21.680 11.797 -22.095 0.00 0.00 WT1 O
+ATOM 830 H1 TIP3X 258 -21.714 11.722 -21.101 0.00 0.00 WT1 H
+ATOM 831 H2 TIP3X 258 -22.280 12.595 -22.285 0.00 0.00 WT1 H
+ATOM 832 OH2 TIP3X 259 -22.515 12.844 -3.471 0.00 0.00 WT1 O
+ATOM 833 H1 TIP3X 259 -23.038 12.563 -4.275 0.00 0.00 WT1 H
+ATOM 834 H2 TIP3X 259 -22.886 13.669 -3.338 0.00 0.00 WT1 H
+ATOM 835 OH2 TIP3X 260 17.695 1.686 -9.765 0.00 0.00 WT1 O
+ATOM 836 H1 TIP3X 260 18.173 2.124 -10.520 0.00 0.00 WT1 H
+ATOM 837 H2 TIP3X 260 18.134 0.840 -9.653 0.00 0.00 WT1 H
+ATOM 838 OH2 TIP3X 261 -30.713 -7.868 -8.263 0.00 0.00 WT1 O
+ATOM 839 H1 TIP3X 261 -30.765 -8.076 -7.269 0.00 0.00 WT1 H
+ATOM 840 H2 TIP3X 261 -29.912 -7.291 -8.361 0.00 0.00 WT1 H
+ATOM 841 OH2 TIP3X 262 -15.530 10.714 -11.482 0.00 0.00 WT1 O
+ATOM 842 H1 TIP3X 262 -15.581 11.264 -10.661 0.00 0.00 WT1 H
+ATOM 843 H2 TIP3X 262 -15.042 11.324 -12.072 0.00 0.00 WT1 H
+ATOM 844 OH2 TIP3X 263 20.532 6.783 -5.590 0.00 0.00 WT1 O
+ATOM 845 H1 TIP3X 263 21.083 7.343 -6.094 0.00 0.00 WT1 H
+ATOM 846 H2 TIP3X 263 20.204 7.412 -4.923 0.00 0.00 WT1 H
+ATOM 847 OH2 TIP3X 264 30.830 21.592 -8.547 0.00 0.00 WT1 O
+ATOM 848 H1 TIP3X 264 30.377 22.057 -7.816 0.00 0.00 WT1 H
+ATOM 849 H2 TIP3X 264 30.374 20.786 -8.626 0.00 0.00 WT1 H
+ATOM 850 OH2 TIP3X 265 29.059 8.191 21.160 0.00 0.00 WT1 O
+ATOM 851 H1 TIP3X 265 28.768 8.631 20.345 0.00 0.00 WT1 H
+ATOM 852 H2 TIP3X 265 28.815 8.856 21.924 0.00 0.00 WT1 H
+ATOM 853 OH2 TIP3X 266 17.449 16.050 8.241 0.00 0.00 WT1 O
+ATOM 854 H1 TIP3X 266 18.300 15.595 8.423 0.00 0.00 WT1 H
+ATOM 855 H2 TIP3X 266 16.857 15.658 8.985 0.00 0.00 WT1 H
+ATOM 856 OH2 TIP3X 267 -28.397 13.412 10.439 0.00 0.00 WT1 O
+ATOM 857 H1 TIP3X 267 -27.641 13.900 10.040 0.00 0.00 WT1 H
+ATOM 858 H2 TIP3X 267 -28.840 14.158 10.919 0.00 0.00 WT1 H
+ATOM 859 OH2 TIP3X 268 -30.563 -7.710 22.455 0.00 0.00 WT1 O
+ATOM 860 H1 TIP3X 268 -31.324 -7.334 21.928 0.00 0.00 WT1 H
+ATOM 861 H2 TIP3X 268 -29.953 -7.884 21.793 0.00 0.00 WT1 H
+ATOM 862 OH2 TIP3X 269 -25.787 18.296 18.204 0.00 0.00 WT1 O
+ATOM 863 H1 TIP3X 269 -25.838 17.484 18.740 0.00 0.00 WT1 H
+ATOM 864 H2 TIP3X 269 -24.860 18.294 17.957 0.00 0.00 WT1 H
+ATOM 865 OH2 TIP3X 270 25.628 -8.565 20.128 0.00 0.00 WT1 O
+ATOM 866 H1 TIP3X 270 25.253 -8.829 20.943 0.00 0.00 WT1 H
+ATOM 867 H2 TIP3X 270 25.134 -7.711 19.929 0.00 0.00 WT1 H
+ATOM 868 OH2 TIP3X 272 26.911 -5.082 25.104 0.00 0.00 WT1 O
+ATOM 869 H1 TIP3X 272 26.358 -5.526 24.435 0.00 0.00 WT1 H
+ATOM 870 H2 TIP3X 272 26.255 -4.966 25.796 0.00 0.00 WT1 H
+ATOM 871 OH2 TIP3X 273 25.450 6.617 -31.699 0.00 0.00 WT1 O
+ATOM 872 H1 TIP3X 273 25.250 7.273 -31.032 0.00 0.00 WT1 H
+ATOM 873 H2 TIP3X 273 26.409 6.490 -31.604 0.00 0.00 WT1 H
+ATOM 874 OH2 TIP3X 274 30.784 8.966 24.967 0.00 0.00 WT1 O
+ATOM 875 H1 TIP3X 274 31.081 9.343 25.792 0.00 0.00 WT1 H
+ATOM 876 H2 TIP3X 274 31.542 8.547 24.514 0.00 0.00 WT1 H
+ATOM 877 OH2 TIP3X 275 26.950 7.725 27.579 0.00 0.00 WT1 O
+ATOM 878 H1 TIP3X 275 26.108 8.237 27.599 0.00 0.00 WT1 H
+ATOM 879 H2 TIP3X 275 27.410 8.085 28.330 0.00 0.00 WT1 H
+ATOM 880 OH2 TIP3X 276 27.955 17.592 31.427 0.00 0.00 WT1 O
+ATOM 881 H1 TIP3X 276 27.195 17.380 31.834 0.00 0.00 WT1 H
+ATOM 882 H2 TIP3X 276 27.770 17.796 30.511 0.00 0.00 WT1 H
+ATOM 883 OH2 TIP3X 277 26.458 14.441 31.090 0.00 0.00 WT1 O
+ATOM 884 H1 TIP3X 277 26.306 15.243 31.671 0.00 0.00 WT1 H
+ATOM 885 H2 TIP3X 277 27.431 14.191 31.170 0.00 0.00 WT1 H
+ATOM 886 OH2 TIP3X 278 22.395 6.075 -28.738 0.00 0.00 WT1 O
+ATOM 887 H1 TIP3X 278 22.562 6.563 -27.937 0.00 0.00 WT1 H
+ATOM 888 H2 TIP3X 278 22.390 6.811 -29.406 0.00 0.00 WT1 H
+ATOM 889 OH2 TIP3X 279 26.768 2.009 -16.540 0.00 0.00 WT1 O
+ATOM 890 H1 TIP3X 279 27.591 2.244 -17.107 0.00 0.00 WT1 H
+ATOM 891 H2 TIP3X 279 26.106 1.765 -17.266 0.00 0.00 WT1 H
+ATOM 892 OH2 TIP3X 280 24.545 11.513 -20.935 0.00 0.00 WT1 O
+ATOM 893 H1 TIP3X 280 25.048 11.059 -20.280 0.00 0.00 WT1 H
+ATOM 894 H2 TIP3X 280 23.595 11.319 -20.747 0.00 0.00 WT1 H
+ATOM 895 OH2 TIP3X 281 -25.418 5.780 -4.600 0.00 0.00 WT1 O
+ATOM 896 H1 TIP3X 281 -25.160 4.904 -4.785 0.00 0.00 WT1 H
+ATOM 897 H2 TIP3X 281 -24.817 6.042 -3.860 0.00 0.00 WT1 H
+ATOM 898 OH2 TIP3X 282 16.398 -5.165 -10.152 0.00 0.00 WT1 O
+ATOM 899 H1 TIP3X 282 16.075 -5.676 -9.414 0.00 0.00 WT1 H
+ATOM 900 H2 TIP3X 282 17.266 -4.840 -9.794 0.00 0.00 WT1 H
+ATOM 901 OH2 TIP3X 283 -28.715 21.986 3.579 0.00 0.00 WT1 O
+ATOM 902 H1 TIP3X 283 -28.318 22.805 3.966 0.00 0.00 WT1 H
+ATOM 903 H2 TIP3X 283 -27.952 21.545 3.128 0.00 0.00 WT1 H
+ATOM 904 OH2 TIP3X 284 -24.344 9.012 5.374 0.00 0.00 WT1 O
+ATOM 905 H1 TIP3X 284 -23.620 8.345 5.432 0.00 0.00 WT1 H
+ATOM 906 H2 TIP3X 284 -23.891 9.792 5.153 0.00 0.00 WT1 H
+ATOM 907 OH2 TIP3X 285 -26.779 14.049 -5.638 0.00 0.00 WT1 O
+ATOM 908 H1 TIP3X 285 -27.047 13.619 -4.797 0.00 0.00 WT1 H
+ATOM 909 H2 TIP3X 285 -26.068 13.492 -5.997 0.00 0.00 WT1 H
+ATOM 910 OH2 TIP3X 286 27.825 8.854 18.616 0.00 0.00 WT1 O
+ATOM 911 H1 TIP3X 286 27.153 8.557 19.252 0.00 0.00 WT1 H
+ATOM 912 H2 TIP3X 286 27.464 9.641 18.216 0.00 0.00 WT1 H
+ATOM 913 OH2 TIP3X 287 30.948 -4.798 17.491 0.00 0.00 WT1 O
+ATOM 914 H1 TIP3X 287 31.520 -4.369 16.893 0.00 0.00 WT1 H
+ATOM 915 H2 TIP3X 287 31.129 -5.744 17.305 0.00 0.00 WT1 H
+ATOM 916 OH2 TIP3X 288 25.289 2.925 18.872 0.00 0.00 WT1 O
+ATOM 917 H1 TIP3X 288 25.593 2.505 19.725 0.00 0.00 WT1 H
+ATOM 918 H2 TIP3X 288 24.374 2.628 18.689 0.00 0.00 WT1 H
+ATOM 919 OH2 TIP3X 291 18.790 1.610 12.232 0.00 0.00 WT1 O
+ATOM 920 H1 TIP3X 291 18.533 0.790 11.809 0.00 0.00 WT1 H
+ATOM 921 H2 TIP3X 291 17.982 2.047 12.237 0.00 0.00 WT1 H
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+ATOM 923 H1 TIP3X 292 -30.300 8.898 21.191 0.00 0.00 WT1 H
+ATOM 924 H2 TIP3X 292 -31.216 10.051 21.543 0.00 0.00 WT1 H
+ATOM 925 OH2 TIP3X 294 27.994 11.571 21.038 0.00 0.00 WT1 O
+ATOM 926 H1 TIP3X 294 28.045 12.050 21.880 0.00 0.00 WT1 H
+ATOM 927 H2 TIP3X 294 27.136 11.261 20.921 0.00 0.00 WT1 H
+ATOM 928 OH2 TIP3X 295 -23.916 0.876 -16.176 0.00 0.00 WT1 O
+ATOM 929 H1 TIP3X 295 -24.857 0.955 -16.219 0.00 0.00 WT1 H
+ATOM 930 H2 TIP3X 295 -23.723 0.234 -15.503 0.00 0.00 WT1 H
+ATOM 931 OH2 TIP3X 297 18.099 9.286 -25.399 0.00 0.00 WT1 O
+ATOM 932 H1 TIP3X 297 18.835 9.853 -25.217 0.00 0.00 WT1 H
+ATOM 933 H2 TIP3X 297 17.401 9.568 -24.797 0.00 0.00 WT1 H
+ATOM 934 OH2 TIP3X 298 26.665 2.404 -8.529 0.00 0.00 WT1 O
+ATOM 935 H1 TIP3X 298 25.994 2.548 -9.215 0.00 0.00 WT1 H
+ATOM 936 H2 TIP3X 298 26.137 2.471 -7.721 0.00 0.00 WT1 H
+ATOM 937 OH2 TIP3X 299 24.608 14.543 -20.957 0.00 0.00 WT1 O
+ATOM 938 H1 TIP3X 299 24.728 13.640 -20.542 0.00 0.00 WT1 H
+ATOM 939 H2 TIP3X 299 24.201 14.336 -21.800 0.00 0.00 WT1 H
+ATOM 940 OH2 TIP3X 300 18.629 4.576 -25.022 0.00 0.00 WT1 O
+ATOM 941 H1 TIP3X 300 19.392 4.675 -25.658 0.00 0.00 WT1 H
+ATOM 942 H2 TIP3X 300 17.864 4.430 -25.627 0.00 0.00 WT1 H
+ATOM 943 OH2 TIP3X 301 28.764 15.779 -9.650 0.00 0.00 WT1 O
+ATOM 944 H1 TIP3X 301 28.320 15.128 -10.237 0.00 0.00 WT1 H
+ATOM 945 H2 TIP3X 301 28.968 16.582 -10.145 0.00 0.00 WT1 H
+ATOM 946 OH2 TIP3X 302 -22.094 12.868 -12.737 0.00 0.00 WT1 O
+ATOM 947 H1 TIP3X 302 -22.311 12.526 -13.616 0.00 0.00 WT1 H
+ATOM 948 H2 TIP3X 302 -21.121 12.744 -12.709 0.00 0.00 WT1 H
+ATOM 949 OH2 TIP3X 303 -29.822 18.326 -10.662 0.00 0.00 WT1 O
+ATOM 950 H1 TIP3X 303 -28.923 17.972 -10.590 0.00 0.00 WT1 H
+ATOM 951 H2 TIP3X 303 -29.887 18.600 -11.558 0.00 0.00 WT1 H
+ATOM 952 OH2 TIP3X 304 24.375 2.731 -3.369 0.00 0.00 WT1 O
+ATOM 953 H1 TIP3X 304 24.942 3.292 -2.838 0.00 0.00 WT1 H
+ATOM 954 H2 TIP3X 304 23.563 3.272 -3.317 0.00 0.00 WT1 H
+ATOM 955 OH2 TIP3X 305 -17.739 19.579 -6.699 0.00 0.00 WT1 O
+ATOM 956 H1 TIP3X 305 -18.524 19.067 -6.568 0.00 0.00 WT1 H
+ATOM 957 H2 TIP3X 305 -17.610 19.803 -5.775 0.00 0.00 WT1 H
+ATOM 958 OH2 TIP3X 306 -29.114 15.919 3.320 0.00 0.00 WT1 O
+ATOM 959 H1 TIP3X 306 -28.858 16.588 4.003 0.00 0.00 WT1 H
+ATOM 960 H2 TIP3X 306 -30.008 15.636 3.497 0.00 0.00 WT1 H
+ATOM 961 OH2 TIP3X 307 -27.476 24.330 4.818 0.00 0.00 WT1 O
+ATOM 962 H1 TIP3X 307 -27.760 23.713 5.489 0.00 0.00 WT1 H
+ATOM 963 H2 TIP3X 307 -26.585 24.431 5.060 0.00 0.00 WT1 H
+ATOM 964 OH2 TIP3X 308 19.890 0.801 15.652 0.00 0.00 WT1 O
+ATOM 965 H1 TIP3X 308 20.048 1.576 15.124 0.00 0.00 WT1 H
+ATOM 966 H2 TIP3X 308 19.374 0.160 15.029 0.00 0.00 WT1 H
+ATOM 967 OH2 TIP3X 309 -29.991 20.021 6.816 0.00 0.00 WT1 O
+ATOM 968 H1 TIP3X 309 -30.613 20.672 7.081 0.00 0.00 WT1 H
+ATOM 969 H2 TIP3X 309 -29.417 19.846 7.651 0.00 0.00 WT1 H
+ATOM 970 OH2 TIP3X 310 4.107 24.454 17.698 0.00 0.00 WT1 O
+ATOM 971 H1 TIP3X 310 4.113 23.496 17.950 0.00 0.00 WT1 H
+ATOM 972 H2 TIP3X 310 4.764 24.449 16.881 0.00 0.00 WT1 H
+ATOM 973 OH2 TIP3X 311 -26.787 16.070 19.235 0.00 0.00 WT1 O
+ATOM 974 H1 TIP3X 311 -26.997 15.836 18.281 0.00 0.00 WT1 H
+ATOM 975 H2 TIP3X 311 -26.127 15.423 19.559 0.00 0.00 WT1 H
+ATOM 976 OH2 TIP3X 312 22.477 6.836 25.427 0.00 0.00 WT1 O
+ATOM 977 H1 TIP3X 312 21.866 7.464 25.720 0.00 0.00 WT1 H
+ATOM 978 H2 TIP3X 312 22.483 6.060 25.993 0.00 0.00 WT1 H
+ATOM 979 OH2 TIP3X 313 -29.509 -0.319 28.217 0.00 0.00 WT1 O
+ATOM 980 H1 TIP3X 313 -30.071 -0.551 27.515 0.00 0.00 WT1 H
+ATOM 981 H2 TIP3X 313 -29.509 -1.106 28.761 0.00 0.00 WT1 H
+ATOM 982 OH2 TIP3X 314 -30.567 13.406 27.653 0.00 0.00 WT1 O
+ATOM 983 H1 TIP3X 314 -30.301 13.632 28.502 0.00 0.00 WT1 H
+ATOM 984 H2 TIP3X 314 -29.771 13.748 27.158 0.00 0.00 WT1 H
+ATOM 985 OH2 TIP3X 316 -8.654 13.486 -26.709 0.00 0.00 WT1 O
+ATOM 986 H1 TIP3X 316 -9.345 13.383 -27.346 0.00 0.00 WT1 H
+ATOM 987 H2 TIP3X 316 -8.259 12.565 -26.586 0.00 0.00 WT1 H
+ATOM 988 OH2 TIP3X 317 -24.681 20.225 -14.157 0.00 0.00 WT1 O
+ATOM 989 H1 TIP3X 317 -24.346 20.978 -14.707 0.00 0.00 WT1 H
+ATOM 990 H2 TIP3X 317 -24.702 20.651 -13.229 0.00 0.00 WT1 H
+ATOM 991 OH2 TIP3X 319 30.074 16.481 -27.799 0.00 0.00 WT1 O
+ATOM 992 H1 TIP3X 319 30.949 16.178 -28.016 0.00 0.00 WT1 H
+ATOM 993 H2 TIP3X 319 30.218 17.426 -27.853 0.00 0.00 WT1 H
+ATOM 994 OH2 TIP3X 320 24.494 3.228 -10.942 0.00 0.00 WT1 O
+ATOM 995 H1 TIP3X 320 24.277 3.600 -11.799 0.00 0.00 WT1 H
+ATOM 996 H2 TIP3X 320 24.118 2.362 -11.045 0.00 0.00 WT1 H
+ATOM 997 OH2 TIP3X 321 26.195 16.476 -20.232 0.00 0.00 WT1 O
+ATOM 998 H1 TIP3X 321 25.857 15.875 -20.874 0.00 0.00 WT1 H
+ATOM 999 H2 TIP3X 321 26.279 15.848 -19.445 0.00 0.00 WT1 H
+ATOM 1000 OH2 TIP3X 322 -19.718 12.684 -18.371 0.00 0.00 WT1 O
+ATOM 1001 H1 TIP3X 322 -20.353 12.737 -17.654 0.00 0.00 WT1 H
+ATOM 1002 H2 TIP3X 322 -18.832 12.471 -17.990 0.00 0.00 WT1 H
+ATOM 1003 OH2 TIP3X 324 30.838 19.473 -5.113 0.00 0.00 WT1 O
+ATOM 1004 H1 TIP3X 324 30.486 19.399 -4.178 0.00 0.00 WT1 H
+ATOM 1005 H2 TIP3X 324 31.792 19.294 -5.030 0.00 0.00 WT1 H
+ATOM 1006 OH2 TIP3X 325 -29.270 16.596 -0.188 0.00 0.00 WT1 O
+ATOM 1007 H1 TIP3X 325 -28.800 16.125 0.487 0.00 0.00 WT1 H
+ATOM 1008 H2 TIP3X 325 -29.109 16.058 -0.992 0.00 0.00 WT1 H
+ATOM 1009 OH2 TIP3X 326 -25.978 30.242 -5.256 0.00 0.00 WT1 O
+ATOM 1010 H1 TIP3X 326 -26.091 30.082 -6.262 0.00 0.00 WT1 H
+ATOM 1011 H2 TIP3X 326 -26.490 31.040 -5.007 0.00 0.00 WT1 H
+ATOM 1012 OH2 TIP3X 327 -27.107 5.772 11.848 0.00 0.00 WT1 O
+ATOM 1013 H1 TIP3X 327 -27.098 4.802 11.950 0.00 0.00 WT1 H
+ATOM 1014 H2 TIP3X 327 -27.071 5.949 10.892 0.00 0.00 WT1 H
+ATOM 1015 OH2 TIP3X 328 -31.242 10.342 15.249 0.00 0.00 WT1 O
+ATOM 1016 H1 TIP3X 328 -30.930 9.625 15.844 0.00 0.00 WT1 H
+ATOM 1017 H2 TIP3X 328 -30.517 10.272 14.606 0.00 0.00 WT1 H
+ATOM 1018 OH2 TIP3X 329 -31.398 20.900 9.087 0.00 0.00 WT1 O
+ATOM 1019 H1 TIP3X 329 -30.541 21.249 9.394 0.00 0.00 WT1 H
+ATOM 1020 H2 TIP3X 329 -31.988 21.742 9.107 0.00 0.00 WT1 H
+ATOM 1021 OH2 TIP3X 330 28.028 19.729 19.854 0.00 0.00 WT1 O
+ATOM 1022 H1 TIP3X 330 28.682 20.392 20.206 0.00 0.00 WT1 H
+ATOM 1023 H2 TIP3X 330 27.434 19.533 20.578 0.00 0.00 WT1 H
+ATOM 1024 OH2 TIP3X 332 -24.229 15.064 13.185 0.00 0.00 WT1 O
+ATOM 1025 H1 TIP3X 332 -24.782 14.307 12.988 0.00 0.00 WT1 H
+ATOM 1026 H2 TIP3X 332 -23.488 14.621 13.673 0.00 0.00 WT1 H
+ATOM 1027 OH2 TIP3X 333 26.597 2.027 16.439 0.00 0.00 WT1 O
+ATOM 1028 H1 TIP3X 333 25.687 1.910 16.684 0.00 0.00 WT1 H
+ATOM 1029 H2 TIP3X 333 26.968 2.479 17.234 0.00 0.00 WT1 H
+ATOM 1030 OH2 TIP3X 335 -23.394 26.458 -30.601 0.00 0.00 WT1 O
+ATOM 1031 H1 TIP3X 335 -23.059 27.381 -30.523 0.00 0.00 WT1 H
+ATOM 1032 H2 TIP3X 335 -23.209 26.302 -31.515 0.00 0.00 WT1 H
+ATOM 1033 OH2 TIP3X 336 -28.827 3.164 19.410 0.00 0.00 WT1 O
+ATOM 1034 H1 TIP3X 336 -27.906 2.954 19.529 0.00 0.00 WT1 H
+ATOM 1035 H2 TIP3X 336 -29.239 2.337 19.136 0.00 0.00 WT1 H
+ATOM 1036 OH2 TIP3X 337 29.755 8.352 -25.953 0.00 0.00 WT1 O
+ATOM 1037 H1 TIP3X 337 30.510 9.075 -25.838 0.00 0.00 WT1 H
+ATOM 1038 H2 TIP3X 337 29.351 8.319 -25.041 0.00 0.00 WT1 H
+ATOM 1039 OH2 TIP3X 338 -28.357 13.468 -25.767 0.00 0.00 WT1 O
+ATOM 1040 H1 TIP3X 338 -28.274 14.140 -25.114 0.00 0.00 WT1 H
+ATOM 1041 H2 TIP3X 338 -27.551 12.957 -25.695 0.00 0.00 WT1 H
+ATOM 1042 OH2 TIP3X 340 23.788 3.934 -13.423 0.00 0.00 WT1 O
+ATOM 1043 H1 TIP3X 340 23.995 4.867 -13.491 0.00 0.00 WT1 H
+ATOM 1044 H2 TIP3X 340 23.149 3.769 -14.196 0.00 0.00 WT1 H
+ATOM 1045 OH2 TIP3X 341 21.698 21.495 -24.801 0.00 0.00 WT1 O
+ATOM 1046 H1 TIP3X 341 21.735 22.210 -25.540 0.00 0.00 WT1 H
+ATOM 1047 H2 TIP3X 341 21.994 22.119 -24.067 0.00 0.00 WT1 H
+ATOM 1048 OH2 TIP3X 342 21.625 24.296 -7.468 0.00 0.00 WT1 O
+ATOM 1049 H1 TIP3X 342 21.156 23.521 -7.216 0.00 0.00 WT1 H
+ATOM 1050 H2 TIP3X 342 22.365 24.463 -6.851 0.00 0.00 WT1 H
+ATOM 1051 OH2 TIP3X 343 31.520 17.496 -9.029 0.00 0.00 WT1 O
+ATOM 1052 H1 TIP3X 343 30.729 17.542 -9.566 0.00 0.00 WT1 H
+ATOM 1053 H2 TIP3X 343 31.308 18.137 -8.342 0.00 0.00 WT1 H
+ATOM 1054 OH2 TIP3X 344 -30.394 15.334 -26.660 0.00 0.00 WT1 O
+ATOM 1055 H1 TIP3X 344 -29.928 14.480 -26.823 0.00 0.00 WT1 H
+ATOM 1056 H2 TIP3X 344 -29.683 15.972 -26.687 0.00 0.00 WT1 H
+ATOM 1057 OH2 TIP3X 345 27.813 26.928 -0.126 0.00 0.00 WT1 O
+ATOM 1058 H1 TIP3X 345 28.016 26.020 0.145 0.00 0.00 WT1 H
+ATOM 1059 H2 TIP3X 345 27.375 27.277 0.687 0.00 0.00 WT1 H
+ATOM 1060 OH2 TIP3X 346 10.145 20.932 -10.777 0.00 0.00 WT1 O
+ATOM 1061 H1 TIP3X 346 9.837 21.441 -10.023 0.00 0.00 WT1 H
+ATOM 1062 H2 TIP3X 346 11.039 20.675 -10.461 0.00 0.00 WT1 H
+ATOM 1063 OH2 TIP3X 347 -29.269 22.497 10.048 0.00 0.00 WT1 O
+ATOM 1064 H1 TIP3X 347 -29.455 22.853 10.969 0.00 0.00 WT1 H
+ATOM 1065 H2 TIP3X 347 -28.978 23.340 9.606 0.00 0.00 WT1 H
+ATOM 1066 OH2 TIP3X 349 -26.019 25.846 11.694 0.00 0.00 WT1 O
+ATOM 1067 H1 TIP3X 349 -26.472 25.607 12.522 0.00 0.00 WT1 H
+ATOM 1068 H2 TIP3X 349 -25.748 24.918 11.338 0.00 0.00 WT1 H
+ATOM 1069 OH2 TIP3X 351 26.545 14.930 21.196 0.00 0.00 WT1 O
+ATOM 1070 H1 TIP3X 351 26.711 13.977 21.389 0.00 0.00 WT1 H
+ATOM 1071 H2 TIP3X 351 27.116 15.157 20.449 0.00 0.00 WT1 H
+ATOM 1072 OH2 TIP3X 352 -29.855 23.662 22.638 0.00 0.00 WT1 O
+ATOM 1073 H1 TIP3X 352 -30.146 23.442 23.515 0.00 0.00 WT1 H
+ATOM 1074 H2 TIP3X 352 -29.291 24.407 22.843 0.00 0.00 WT1 H
+ATOM 1075 OH2 TIP3X 354 15.739 24.129 30.781 0.00 0.00 WT1 O
+ATOM 1076 H1 TIP3X 354 15.434 24.992 31.234 0.00 0.00 WT1 H
+ATOM 1077 H2 TIP3X 354 16.489 24.360 30.203 0.00 0.00 WT1 H
+ATOM 1078 OH2 TIP3X 355 24.660 16.374 23.533 0.00 0.00 WT1 O
+ATOM 1079 H1 TIP3X 355 25.273 16.579 22.839 0.00 0.00 WT1 H
+ATOM 1080 H2 TIP3X 355 24.747 15.404 23.615 0.00 0.00 WT1 H
+ATOM 1081 OH2 TIP3X 356 -20.628 25.766 27.662 0.00 0.00 WT1 O
+ATOM 1082 H1 TIP3X 356 -21.177 25.018 27.927 0.00 0.00 WT1 H
+ATOM 1083 H2 TIP3X 356 -19.753 25.632 28.072 0.00 0.00 WT1 H
+ATOM 1084 OH2 TIP3X 357 26.213 6.515 22.520 0.00 0.00 WT1 O
+ATOM 1085 H1 TIP3X 357 26.337 7.454 22.377 0.00 0.00 WT1 H
+ATOM 1086 H2 TIP3X 357 26.365 6.131 21.632 0.00 0.00 WT1 H
+ATOM 1087 OH2 TIP3X 361 10.471 12.720 -23.284 0.00 0.00 WT1 O
+ATOM 1088 H1 TIP3X 361 10.895 13.351 -22.629 0.00 0.00 WT1 H
+ATOM 1089 H2 TIP3X 361 9.619 13.104 -23.425 0.00 0.00 WT1 H
+ATOM 1090 OH2 TIP3X 362 -19.926 29.260 -17.838 0.00 0.00 WT1 O
+ATOM 1091 H1 TIP3X 362 -20.438 28.501 -17.661 0.00 0.00 WT1 H
+ATOM 1092 H2 TIP3X 362 -19.487 29.380 -16.954 0.00 0.00 WT1 H
+ATOM 1093 OH2 TIP3X 364 -17.566 27.461 -27.509 0.00 0.00 WT1 O
+ATOM 1094 H1 TIP3X 364 -18.015 26.555 -27.573 0.00 0.00 WT1 H
+ATOM 1095 H2 TIP3X 364 -17.130 27.487 -28.319 0.00 0.00 WT1 H
+ATOM 1096 OH2 TIP3X 365 -25.635 -29.326 -3.941 0.00 0.00 WT1 O
+ATOM 1097 H1 TIP3X 365 -26.201 -28.563 -4.151 0.00 0.00 WT1 H
+ATOM 1098 H2 TIP3X 365 -24.825 -28.945 -3.597 0.00 0.00 WT1 H
+ATOM 1099 OH2 TIP3X 367 -18.454 1.837 11.438 0.00 0.00 WT1 O
+ATOM 1100 H1 TIP3X 367 -18.862 2.233 12.227 0.00 0.00 WT1 H
+ATOM 1101 H2 TIP3X 367 -17.944 1.142 11.844 0.00 0.00 WT1 H
+ATOM 1102 OH2 TIP3X 368 -27.227 12.261 -3.669 0.00 0.00 WT1 O
+ATOM 1103 H1 TIP3X 368 -27.654 11.393 -3.488 0.00 0.00 WT1 H
+ATOM 1104 H2 TIP3X 368 -26.345 12.180 -3.267 0.00 0.00 WT1 H
+ATOM 1105 OH2 TIP3X 369 -25.869 12.247 7.383 0.00 0.00 WT1 O
+ATOM 1106 H1 TIP3X 369 -26.509 11.863 8.034 0.00 0.00 WT1 H
+ATOM 1107 H2 TIP3X 369 -26.426 12.783 6.772 0.00 0.00 WT1 H
+ATOM 1108 OH2 TIP3X 371 -26.017 20.482 7.002 0.00 0.00 WT1 O
+ATOM 1109 H1 TIP3X 371 -26.780 21.035 7.196 0.00 0.00 WT1 H
+ATOM 1110 H2 TIP3X 371 -25.655 20.408 7.913 0.00 0.00 WT1 H
+ATOM 1111 OH2 TIP3X 372 -27.972 24.835 8.686 0.00 0.00 WT1 O
+ATOM 1112 H1 TIP3X 372 -27.444 24.190 8.162 0.00 0.00 WT1 H
+ATOM 1113 H2 TIP3X 372 -27.627 25.673 8.414 0.00 0.00 WT1 H
+ATOM 1114 OH2 TIP3X 373 27.816 22.018 9.497 0.00 0.00 WT1 O
+ATOM 1115 H1 TIP3X 373 27.020 21.672 9.073 0.00 0.00 WT1 H
+ATOM 1116 H2 TIP3X 373 28.482 21.321 9.339 0.00 0.00 WT1 H
+ATOM 1117 OH2 TIP3X 374 30.712 20.077 21.864 0.00 0.00 WT1 O
+ATOM 1118 H1 TIP3X 374 31.224 19.273 21.868 0.00 0.00 WT1 H
+ATOM 1119 H2 TIP3X 374 31.300 20.645 21.290 0.00 0.00 WT1 H
+ATOM 1120 OH2 TIP3X 375 30.435 30.982 -26.527 0.00 0.00 WT1 O
+ATOM 1121 H1 TIP3X 375 31.341 31.106 -26.423 0.00 0.00 WT1 H
+ATOM 1122 H2 TIP3X 375 30.209 30.652 -25.726 0.00 0.00 WT1 H
+ATOM 1123 OH2 TIP3X 377 25.616 24.125 22.798 0.00 0.00 WT1 O
+ATOM 1124 H1 TIP3X 377 26.635 24.072 22.959 0.00 0.00 WT1 H
+ATOM 1125 H2 TIP3X 377 25.578 24.517 21.915 0.00 0.00 WT1 H
+ATOM 1126 OH2 TIP3X 378 -12.777 23.310 -29.551 0.00 0.00 WT1 O
+ATOM 1127 H1 TIP3X 378 -13.323 22.908 -28.796 0.00 0.00 WT1 H
+ATOM 1128 H2 TIP3X 378 -12.069 23.784 -29.078 0.00 0.00 WT1 H
+ATOM 1129 OH2 TIP3X 379 -27.496 -15.968 29.557 0.00 0.00 WT1 O
+ATOM 1130 H1 TIP3X 379 -27.498 -16.985 29.741 0.00 0.00 WT1 H
+ATOM 1131 H2 TIP3X 379 -28.291 -15.893 28.960 0.00 0.00 WT1 H
+ATOM 1132 OH2 TIP3X 380 -25.165 23.342 27.921 0.00 0.00 WT1 O
+ATOM 1133 H1 TIP3X 380 -24.872 24.266 28.037 0.00 0.00 WT1 H
+ATOM 1134 H2 TIP3X 380 -25.725 23.114 28.641 0.00 0.00 WT1 H
+ATOM 1135 OH2 TIP3X 381 29.002 22.800 -19.529 0.00 0.00 WT1 O
+ATOM 1136 H1 TIP3X 381 28.429 22.889 -18.758 0.00 0.00 WT1 H
+ATOM 1137 H2 TIP3X 381 28.730 21.966 -19.826 0.00 0.00 WT1 H
+ATOM 1138 OH2 TIP3X 382 22.310 29.164 29.644 0.00 0.00 WT1 O
+ATOM 1139 H1 TIP3X 382 21.737 28.578 29.132 0.00 0.00 WT1 H
+ATOM 1140 H2 TIP3X 382 21.778 29.981 29.785 0.00 0.00 WT1 H
+ATOM 1141 OH2 TIP3X 383 30.478 26.982 -21.630 0.00 0.00 WT1 O
+ATOM 1142 H1 TIP3X 383 30.236 27.343 -20.709 0.00 0.00 WT1 H
+ATOM 1143 H2 TIP3X 383 29.964 26.136 -21.716 0.00 0.00 WT1 H
+ATOM 1144 OH2 TIP3X 384 -27.034 20.957 -21.095 0.00 0.00 WT1 O
+ATOM 1145 H1 TIP3X 384 -27.610 20.409 -20.551 0.00 0.00 WT1 H
+ATOM 1146 H2 TIP3X 384 -27.706 21.525 -21.500 0.00 0.00 WT1 H
+ATOM 1147 OH2 TIP3X 385 31.987 22.009 -15.358 0.00 0.00 WT1 O
+ATOM 1148 H1 TIP3X 385 31.094 21.952 -15.824 0.00 0.00 WT1 H
+ATOM 1149 H2 TIP3X 385 31.852 22.018 -14.400 0.00 0.00 WT1 H
+ATOM 1150 OH2 TIP3X 386 27.019 15.502 -4.569 0.00 0.00 WT1 O
+ATOM 1151 H1 TIP3X 386 27.515 14.993 -5.254 0.00 0.00 WT1 H
+ATOM 1152 H2 TIP3X 386 27.722 16.144 -4.369 0.00 0.00 WT1 H
+ATOM 1153 OH2 TIP3X 387 -18.603 26.393 -10.653 0.00 0.00 WT1 O
+ATOM 1154 H1 TIP3X 387 -18.499 25.441 -10.701 0.00 0.00 WT1 H
+ATOM 1155 H2 TIP3X 387 -19.145 26.599 -9.912 0.00 0.00 WT1 H
+ATOM 1156 OH2 TIP3X 388 -24.383 18.543 -3.154 0.00 0.00 WT1 O
+ATOM 1157 H1 TIP3X 388 -25.000 18.096 -2.565 0.00 0.00 WT1 H
+ATOM 1158 H2 TIP3X 388 -23.575 18.136 -2.877 0.00 0.00 WT1 H
+ATOM 1159 OH2 TIP3X 389 -30.578 27.121 3.260 0.00 0.00 WT1 O
+ATOM 1160 H1 TIP3X 389 -31.296 26.727 2.820 0.00 0.00 WT1 H
+ATOM 1161 H2 TIP3X 389 -29.719 26.702 2.895 0.00 0.00 WT1 H
+ATOM 1162 OH2 TIP3X 390 -26.437 27.329 2.286 0.00 0.00 WT1 O
+ATOM 1163 H1 TIP3X 390 -25.476 27.384 2.134 0.00 0.00 WT1 H
+ATOM 1164 H2 TIP3X 390 -26.442 27.044 3.192 0.00 0.00 WT1 H
+ATOM 1165 OH2 TIP3X 391 -30.654 14.350 13.134 0.00 0.00 WT1 O
+ATOM 1166 H1 TIP3X 391 -29.872 13.933 13.595 0.00 0.00 WT1 H
+ATOM 1167 H2 TIP3X 391 -31.388 14.267 13.785 0.00 0.00 WT1 H
+ATOM 1168 OH2 TIP3X 393 -25.052 19.453 4.735 0.00 0.00 WT1 O
+ATOM 1169 H1 TIP3X 393 -25.219 20.037 5.489 0.00 0.00 WT1 H
+ATOM 1170 H2 TIP3X 393 -24.151 19.224 4.990 0.00 0.00 WT1 H
+ATOM 1171 OH2 TIP3X 394 24.808 25.585 11.515 0.00 0.00 WT1 O
+ATOM 1172 H1 TIP3X 394 24.370 25.873 10.651 0.00 0.00 WT1 H
+ATOM 1173 H2 TIP3X 394 23.942 25.585 12.040 0.00 0.00 WT1 H
+ATOM 1174 OH2 TIP3X 397 -24.224 18.421 13.113 0.00 0.00 WT1 O
+ATOM 1175 H1 TIP3X 397 -24.342 18.170 14.071 0.00 0.00 WT1 H
+ATOM 1176 H2 TIP3X 397 -23.688 19.215 13.201 0.00 0.00 WT1 H
+ATOM 1177 OH2 TIP3X 400 -27.302 -26.931 25.346 0.00 0.00 WT1 O
+ATOM 1178 H1 TIP3X 400 -26.646 -27.672 25.188 0.00 0.00 WT1 H
+ATOM 1179 H2 TIP3X 400 -26.753 -26.166 25.550 0.00 0.00 WT1 H
+ATOM 1180 OH2 TIP3X 401 -30.481 21.320 -20.121 0.00 0.00 WT1 O
+ATOM 1181 H1 TIP3X 401 -31.107 21.595 -20.876 0.00 0.00 WT1 H
+ATOM 1182 H2 TIP3X 401 -31.026 21.473 -19.314 0.00 0.00 WT1 H
+ATOM 1183 OH2 TIP3X 402 -11.665 9.888 26.817 0.00 0.00 WT1 O
+ATOM 1184 H1 TIP3X 402 -11.316 10.453 26.082 0.00 0.00 WT1 H
+ATOM 1185 H2 TIP3X 402 -12.028 10.547 27.379 0.00 0.00 WT1 H
+ATOM 1186 OH2 TIP3X 403 -20.336 17.522 -27.675 0.00 0.00 WT1 O
+ATOM 1187 H1 TIP3X 403 -20.324 16.614 -27.430 0.00 0.00 WT1 H
+ATOM 1188 H2 TIP3X 403 -19.597 17.864 -27.243 0.00 0.00 WT1 H
+ATOM 1189 OH2 TIP3X 407 28.850 -27.793 -12.062 0.00 0.00 WT1 O
+ATOM 1190 H1 TIP3X 407 28.074 -28.000 -11.596 0.00 0.00 WT1 H
+ATOM 1191 H2 TIP3X 407 29.459 -27.621 -11.303 0.00 0.00 WT1 H
+ATOM 1192 OH2 TIP3X 408 30.499 -27.432 -9.831 0.00 0.00 WT1 O
+ATOM 1193 H1 TIP3X 408 30.134 -26.569 -9.557 0.00 0.00 WT1 H
+ATOM 1194 H2 TIP3X 408 31.458 -27.202 -9.824 0.00 0.00 WT1 H
+ATOM 1195 OH2 TIP3X 409 -28.182 16.147 -7.040 0.00 0.00 WT1 O
+ATOM 1196 H1 TIP3X 409 -28.033 15.607 -6.277 0.00 0.00 WT1 H
+ATOM 1197 H2 TIP3X 409 -27.887 16.986 -6.742 0.00 0.00 WT1 H
+ATOM 1198 OH2 TIP3X 410 12.728 19.819 -1.493 0.00 0.00 WT1 O
+ATOM 1199 H1 TIP3X 410 13.676 20.053 -1.271 0.00 0.00 WT1 H
+ATOM 1200 H2 TIP3X 410 12.672 19.880 -2.491 0.00 0.00 WT1 H
+ATOM 1201 OH2 TIP3X 411 -22.661 -25.262 -0.099 0.00 0.00 WT1 O
+ATOM 1202 H1 TIP3X 411 -23.096 -24.764 0.634 0.00 0.00 WT1 H
+ATOM 1203 H2 TIP3X 411 -22.596 -26.162 0.222 0.00 0.00 WT1 H
+ATOM 1204 OH2 TIP3X 412 28.904 -25.137 -9.652 0.00 0.00 WT1 O
+ATOM 1205 H1 TIP3X 412 28.342 -25.913 -9.654 0.00 0.00 WT1 H
+ATOM 1206 H2 TIP3X 412 28.333 -24.433 -9.287 0.00 0.00 WT1 H
+ATOM 1207 OH2 TIP3X 414 12.961 31.290 13.367 0.00 0.00 WT1 O
+ATOM 1208 H1 TIP3X 414 13.419 31.906 12.732 0.00 0.00 WT1 H
+ATOM 1209 H2 TIP3X 414 12.767 31.924 14.069 0.00 0.00 WT1 H
+ATOM 1210 OH2 TIP3X 415 27.816 24.457 19.452 0.00 0.00 WT1 O
+ATOM 1211 H1 TIP3X 415 27.983 24.932 18.639 0.00 0.00 WT1 H
+ATOM 1212 H2 TIP3X 415 28.714 24.169 19.691 0.00 0.00 WT1 H
+ATOM 1213 OH2 TIP3X 417 -28.204 -20.445 25.362 0.00 0.00 WT1 O
+ATOM 1214 H1 TIP3X 417 -28.175 -19.627 24.869 0.00 0.00 WT1 H
+ATOM 1215 H2 TIP3X 417 -28.554 -21.128 24.786 0.00 0.00 WT1 H
+ATOM 1216 OH2 TIP3X 418 -30.031 24.832 19.429 0.00 0.00 WT1 O
+ATOM 1217 H1 TIP3X 418 -29.701 24.220 20.217 0.00 0.00 WT1 H
+ATOM 1218 H2 TIP3X 418 -29.476 25.662 19.513 0.00 0.00 WT1 H
+ATOM 1219 OH2 TIP3X 421 28.249 -30.781 27.689 0.00 0.00 WT1 O
+ATOM 1220 H1 TIP3X 421 27.802 -31.278 26.947 0.00 0.00 WT1 H
+ATOM 1221 H2 TIP3X 421 28.061 -31.379 28.484 0.00 0.00 WT1 H
+ATOM 1222 OH2 TIP3X 423 24.713 22.589 28.112 0.00 0.00 WT1 O
+ATOM 1223 H1 TIP3X 423 24.165 21.927 27.666 0.00 0.00 WT1 H
+ATOM 1224 H2 TIP3X 423 24.697 23.359 27.473 0.00 0.00 WT1 H
+ATOM 1225 OH2 TIP3X 424 -16.586 -25.431 -29.499 0.00 0.00 WT1 O
+ATOM 1226 H1 TIP3X 424 -15.776 -25.142 -29.872 0.00 0.00 WT1 H
+ATOM 1227 H2 TIP3X 424 -17.192 -25.300 -30.329 0.00 0.00 WT1 H
+ATOM 1228 OH2 TIP3X 425 -31.476 21.226 -26.729 0.00 0.00 WT1 O
+ATOM 1229 H1 TIP3X 425 -31.621 22.194 -26.861 0.00 0.00 WT1 H
+ATOM 1230 H2 TIP3X 425 -30.556 21.138 -26.631 0.00 0.00 WT1 H
+ATOM 1231 OH2 TIP3X 427 -27.099 24.219 -20.574 0.00 0.00 WT1 O
+ATOM 1232 H1 TIP3X 427 -27.250 25.082 -21.009 0.00 0.00 WT1 H
+ATOM 1233 H2 TIP3X 427 -26.265 24.339 -20.142 0.00 0.00 WT1 H
+ATOM 1234 OH2 TIP3X 428 27.907 29.769 -4.268 0.00 0.00 WT1 O
+ATOM 1235 H1 TIP3X 428 26.977 30.079 -4.183 0.00 0.00 WT1 H
+ATOM 1236 H2 TIP3X 428 27.813 28.774 -4.390 0.00 0.00 WT1 H
+ATOM 1237 OH2 TIP3X 429 30.893 -30.080 0.128 0.00 0.00 WT1 O
+ATOM 1238 H1 TIP3X 429 31.326 -30.758 0.625 0.00 0.00 WT1 H
+ATOM 1239 H2 TIP3X 429 30.207 -29.744 0.743 0.00 0.00 WT1 H
+ATOM 1240 OH2 TIP3X 430 25.701 -24.122 -9.698 0.00 0.00 WT1 O
+ATOM 1241 H1 TIP3X 430 25.991 -24.984 -9.906 0.00 0.00 WT1 H
+ATOM 1242 H2 TIP3X 430 25.811 -23.666 -10.573 0.00 0.00 WT1 H
+ATOM 1243 OH2 TIP3X 431 -29.397 28.792 -5.801 0.00 0.00 WT1 O
+ATOM 1244 H1 TIP3X 431 -28.657 28.647 -5.170 0.00 0.00 WT1 H
+ATOM 1245 H2 TIP3X 431 -29.207 29.629 -6.245 0.00 0.00 WT1 H
+ATOM 1246 OH2 TIP3X 432 -24.429 -28.202 2.095 0.00 0.00 WT1 O
+ATOM 1247 H1 TIP3X 432 -25.034 -27.596 1.494 0.00 0.00 WT1 H
+ATOM 1248 H2 TIP3X 432 -24.554 -27.905 3.028 0.00 0.00 WT1 H
+ATOM 1249 OH2 TIP3X 433 -29.495 22.649 -2.855 0.00 0.00 WT1 O
+ATOM 1250 H1 TIP3X 433 -29.727 23.388 -3.299 0.00 0.00 WT1 H
+ATOM 1251 H2 TIP3X 433 -29.380 22.983 -1.956 0.00 0.00 WT1 H
+ATOM 1252 OH2 TIP3X 434 23.367 -28.507 15.431 0.00 0.00 WT1 O
+ATOM 1253 H1 TIP3X 434 24.020 -29.152 15.923 0.00 0.00 WT1 H
+ATOM 1254 H2 TIP3X 434 23.846 -27.665 15.511 0.00 0.00 WT1 H
+ATOM 1255 OH2 TIP3X 436 28.015 -12.635 30.959 0.00 0.00 WT1 O
+ATOM 1256 H1 TIP3X 436 28.514 -13.024 31.699 0.00 0.00 WT1 H
+ATOM 1257 H2 TIP3X 436 28.686 -12.241 30.331 0.00 0.00 WT1 H
+ATOM 1258 OH2 TIP3X 437 -20.204 -5.878 18.288 0.00 0.00 WT1 O
+ATOM 1259 H1 TIP3X 437 -20.137 -5.709 17.363 0.00 0.00 WT1 H
+ATOM 1260 H2 TIP3X 437 -20.981 -6.493 18.334 0.00 0.00 WT1 H
+ATOM 1261 OH2 TIP3X 438 11.258 -24.444 15.455 0.00 0.00 WT1 O
+ATOM 1262 H1 TIP3X 438 10.729 -25.002 16.050 0.00 0.00 WT1 H
+ATOM 1263 H2 TIP3X 438 11.927 -24.092 16.047 0.00 0.00 WT1 H
+ATOM 1264 OH2 TIP3X 442 15.908 -16.722 15.421 0.00 0.00 WT1 O
+ATOM 1265 H1 TIP3X 442 15.942 -16.706 14.490 0.00 0.00 WT1 H
+ATOM 1266 H2 TIP3X 442 14.996 -17.097 15.565 0.00 0.00 WT1 H
+ATOM 1267 OH2 TIP3X 443 -22.065 -19.124 -21.809 0.00 0.00 WT1 O
+ATOM 1268 H1 TIP3X 443 -22.291 -19.902 -22.366 0.00 0.00 WT1 H
+ATOM 1269 H2 TIP3X 443 -22.528 -19.234 -20.982 0.00 0.00 WT1 H
+ATOM 1270 OH2 TIP3X 446 -26.888 16.289 -20.040 0.00 0.00 WT1 O
+ATOM 1271 H1 TIP3X 446 -26.563 15.364 -19.949 0.00 0.00 WT1 H
+ATOM 1272 H2 TIP3X 446 -26.309 16.920 -19.576 0.00 0.00 WT1 H
+ATOM 1273 OH2 TIP3X 447 29.987 -28.298 -31.977 0.00 0.00 WT1 O
+ATOM 1274 H1 TIP3X 447 29.892 -29.053 -31.340 0.00 0.00 WT1 H
+ATOM 1275 H2 TIP3X 447 29.854 -27.527 -31.371 0.00 0.00 WT1 H
+ATOM 1276 OH2 TIP3X 448 -17.922 30.732 -0.284 0.00 0.00 WT1 O
+ATOM 1277 H1 TIP3X 448 -18.254 29.816 -0.199 0.00 0.00 WT1 H
+ATOM 1278 H2 TIP3X 448 -18.240 31.207 0.541 0.00 0.00 WT1 H
+ATOM 1279 OH2 TIP3X 450 -24.940 -29.926 -12.170 0.00 0.00 WT1 O
+ATOM 1280 H1 TIP3X 450 -24.350 -30.381 -11.472 0.00 0.00 WT1 H
+ATOM 1281 H2 TIP3X 450 -25.852 -30.204 -11.965 0.00 0.00 WT1 H
+ATOM 1282 OH2 TIP3X 452 -21.105 -12.675 7.064 0.00 0.00 WT1 O
+ATOM 1283 H1 TIP3X 452 -21.633 -13.232 7.669 0.00 0.00 WT1 H
+ATOM 1284 H2 TIP3X 452 -20.214 -13.042 7.229 0.00 0.00 WT1 H
+ATOM 1285 OH2 TIP3X 453 27.239 -27.332 8.181 0.00 0.00 WT1 O
+ATOM 1286 H1 TIP3X 453 26.724 -26.888 7.555 0.00 0.00 WT1 H
+ATOM 1287 H2 TIP3X 453 28.023 -26.783 8.307 0.00 0.00 WT1 H
+ATOM 1288 OH2 TIP3X 454 30.988 27.102 3.022 0.00 0.00 WT1 O
+ATOM 1289 H1 TIP3X 454 30.793 28.050 3.297 0.00 0.00 WT1 H
+ATOM 1290 H2 TIP3X 454 30.956 27.222 2.025 0.00 0.00 WT1 H
+ATOM 1291 OH2 TIP3X 455 27.908 -23.179 6.486 0.00 0.00 WT1 O
+ATOM 1292 H1 TIP3X 455 27.492 -22.897 5.688 0.00 0.00 WT1 H
+ATOM 1293 H2 TIP3X 455 28.274 -24.060 6.213 0.00 0.00 WT1 H
+ATOM 1294 OH2 TIP3X 456 -16.423 28.954 17.985 0.00 0.00 WT1 O
+ATOM 1295 H1 TIP3X 456 -17.300 28.594 17.789 0.00 0.00 WT1 H
+ATOM 1296 H2 TIP3X 456 -16.308 28.650 18.918 0.00 0.00 WT1 H
+ATOM 1297 OH2 TIP3X 457 -22.043 -17.220 16.733 0.00 0.00 WT1 O
+ATOM 1298 H1 TIP3X 457 -21.942 -17.825 15.972 0.00 0.00 WT1 H
+ATOM 1299 H2 TIP3X 457 -22.893 -16.804 16.518 0.00 0.00 WT1 H
+ATOM 1300 OH2 TIP3X 458 29.559 -21.450 9.792 0.00 0.00 WT1 O
+ATOM 1301 H1 TIP3X 458 29.725 -20.625 9.339 0.00 0.00 WT1 H
+ATOM 1302 H2 TIP3X 458 28.634 -21.487 9.844 0.00 0.00 WT1 H
+ATOM 1303 OH2 TIP3X 459 24.334 -23.003 15.549 0.00 0.00 WT1 O
+ATOM 1304 H1 TIP3X 459 24.962 -22.334 15.100 0.00 0.00 WT1 H
+ATOM 1305 H2 TIP3X 459 24.432 -22.833 16.500 0.00 0.00 WT1 H
+ATOM 1306 OH2 TIP3X 460 -27.827 25.187 -31.124 0.00 0.00 WT1 O
+ATOM 1307 H1 TIP3X 460 -27.667 25.801 -31.833 0.00 0.00 WT1 H
+ATOM 1308 H2 TIP3X 460 -26.971 24.878 -30.725 0.00 0.00 WT1 H
+ATOM 1309 OH2 TIP3X 461 -22.792 -25.704 27.333 0.00 0.00 WT1 O
+ATOM 1310 H1 TIP3X 461 -22.544 -26.051 28.176 0.00 0.00 WT1 H
+ATOM 1311 H2 TIP3X 461 -23.397 -24.955 27.554 0.00 0.00 WT1 H
+ATOM 1312 OH2 TIP3X 462 -30.076 -29.023 20.563 0.00 0.00 WT1 O
+ATOM 1313 H1 TIP3X 462 -30.037 -28.502 21.379 0.00 0.00 WT1 H
+ATOM 1314 H2 TIP3X 462 -30.467 -29.874 20.861 0.00 0.00 WT1 H
+ATOM 1315 OH2 TIP3X 464 -11.600 28.102 17.087 0.00 0.00 WT1 O
+ATOM 1316 H1 TIP3X 464 -12.224 27.702 16.396 0.00 0.00 WT1 H
+ATOM 1317 H2 TIP3X 464 -12.035 28.935 17.354 0.00 0.00 WT1 H
+ATOM 1318 OH2 TIP3X 465 -18.109 -30.081 -29.008 0.00 0.00 WT1 O
+ATOM 1319 H1 TIP3X 465 -17.802 -29.319 -28.578 0.00 0.00 WT1 H
+ATOM 1320 H2 TIP3X 465 -18.788 -30.423 -28.422 0.00 0.00 WT1 H
+ATOM 1321 OH2 TIP3X 466 -23.177 -21.419 -23.173 0.00 0.00 WT1 O
+ATOM 1322 H1 TIP3X 466 -23.817 -21.247 -23.852 0.00 0.00 WT1 H
+ATOM 1323 H2 TIP3X 466 -23.611 -21.939 -22.466 0.00 0.00 WT1 H
+ATOM 1324 OH2 TIP3X 467 26.057 -26.648 -20.241 0.00 0.00 WT1 O
+ATOM 1325 H1 TIP3X 467 26.312 -25.898 -19.795 0.00 0.00 WT1 H
+ATOM 1326 H2 TIP3X 467 26.629 -27.268 -19.854 0.00 0.00 WT1 H
+ATOM 1327 OH2 TIP3X 468 -22.336 20.367 -28.669 0.00 0.00 WT1 O
+ATOM 1328 H1 TIP3X 468 -21.797 19.779 -29.181 0.00 0.00 WT1 H
+ATOM 1329 H2 TIP3X 468 -22.593 19.859 -27.890 0.00 0.00 WT1 H
+ATOM 1330 OH2 TIP3X 469 -22.922 -20.033 -19.266 0.00 0.00 WT1 O
+ATOM 1331 H1 TIP3X 469 -23.772 -20.439 -19.007 0.00 0.00 WT1 H
+ATOM 1332 H2 TIP3X 469 -22.488 -19.806 -18.440 0.00 0.00 WT1 H
+ATOM 1333 OH2 TIP3X 470 -28.875 27.101 -12.190 0.00 0.00 WT1 O
+ATOM 1334 H1 TIP3X 470 -29.666 26.779 -11.826 0.00 0.00 WT1 H
+ATOM 1335 H2 TIP3X 470 -29.183 27.384 -13.098 0.00 0.00 WT1 H
+ATOM 1336 OH2 TIP3X 472 -31.085 26.895 -21.765 0.00 0.00 WT1 O
+ATOM 1337 H1 TIP3X 472 -31.654 27.289 -22.413 0.00 0.00 WT1 H
+ATOM 1338 H2 TIP3X 472 -30.743 26.095 -22.204 0.00 0.00 WT1 H
+ATOM 1339 OH2 TIP3X 475 27.096 28.688 6.058 0.00 0.00 WT1 O
+ATOM 1340 H1 TIP3X 475 26.615 29.072 5.261 0.00 0.00 WT1 H
+ATOM 1341 H2 TIP3X 475 26.578 29.015 6.891 0.00 0.00 WT1 H
+ATOM 1342 OH2 TIP3X 477 31.520 27.620 14.741 0.00 0.00 WT1 O
+ATOM 1343 H1 TIP3X 477 30.921 28.357 14.596 0.00 0.00 WT1 H
+ATOM 1344 H2 TIP3X 477 31.374 27.079 13.974 0.00 0.00 WT1 H
+ATOM 1345 OH2 TIP3X 478 28.877 -11.816 -30.957 0.00 0.00 WT1 O
+ATOM 1346 H1 TIP3X 478 28.850 -12.707 -31.414 0.00 0.00 WT1 H
+ATOM 1347 H2 TIP3X 478 28.671 -11.232 -31.709 0.00 0.00 WT1 H
+ATOM 1348 OH2 TIP3X 479 -23.631 -14.842 16.436 0.00 0.00 WT1 O
+ATOM 1349 H1 TIP3X 479 -24.017 -14.979 15.575 0.00 0.00 WT1 H
+ATOM 1350 H2 TIP3X 479 -24.236 -14.112 16.785 0.00 0.00 WT1 H
+ATOM 1351 OH2 TIP3X 480 -30.203 25.346 5.784 0.00 0.00 WT1 O
+ATOM 1352 H1 TIP3X 480 -30.832 25.837 5.233 0.00 0.00 WT1 H
+ATOM 1353 H2 TIP3X 480 -29.359 25.534 5.409 0.00 0.00 WT1 H
+ATOM 1354 OH2 TIP3X 481 -27.170 30.391 4.547 0.00 0.00 WT1 O
+ATOM 1355 H1 TIP3X 481 -26.681 29.961 3.840 0.00 0.00 WT1 H
+ATOM 1356 H2 TIP3X 481 -28.057 29.889 4.438 0.00 0.00 WT1 H
+ATOM 1357 OH2 TIP3X 482 -25.755 28.065 29.373 0.00 0.00 WT1 O
+ATOM 1358 H1 TIP3X 482 -25.165 28.746 29.068 0.00 0.00 WT1 H
+ATOM 1359 H2 TIP3X 482 -26.476 28.599 29.890 0.00 0.00 WT1 H
+ATOM 1360 OH2 TIP3X 483 -21.654 27.612 -25.038 0.00 0.00 WT1 O
+ATOM 1361 H1 TIP3X 483 -20.843 28.093 -25.106 0.00 0.00 WT1 H
+ATOM 1362 H2 TIP3X 483 -21.431 26.857 -24.552 0.00 0.00 WT1 H
+ATOM 1363 OH2 TIP3X 484 -21.718 -31.360 -29.947 0.00 0.00 WT1 O
+ATOM 1364 H1 TIP3X 484 -21.633 -31.041 -28.984 0.00 0.00 WT1 H
+ATOM 1365 H2 TIP3X 484 -22.257 -30.677 -30.333 0.00 0.00 WT1 H
+ATOM 1366 OH2 TIP3X 485 -27.382 -23.875 -24.223 0.00 0.00 WT1 O
+ATOM 1367 H1 TIP3X 485 -26.595 -24.081 -23.686 0.00 0.00 WT1 H
+ATOM 1368 H2 TIP3X 485 -27.998 -23.542 -23.578 0.00 0.00 WT1 H
+ATOM 1369 OH2 TIP3X 486 -28.597 -27.313 -22.185 0.00 0.00 WT1 O
+ATOM 1370 H1 TIP3X 486 -28.891 -26.728 -22.903 0.00 0.00 WT1 H
+ATOM 1371 H2 TIP3X 486 -28.183 -28.027 -22.673 0.00 0.00 WT1 H
+ATOM 1372 OH2 TIP3X 487 -14.204 -15.459 29.000 0.00 0.00 WT1 O
+ATOM 1373 H1 TIP3X 487 -13.703 -16.270 29.198 0.00 0.00 WT1 H
+ATOM 1374 H2 TIP3X 487 -14.487 -15.499 28.054 0.00 0.00 WT1 H
+ATOM 1375 OH2 TIP3X 488 18.438 -28.733 -12.540 0.00 0.00 WT1 O
+ATOM 1376 H1 TIP3X 488 17.477 -28.827 -12.826 0.00 0.00 WT1 H
+ATOM 1377 H2 TIP3X 488 18.587 -29.399 -11.815 0.00 0.00 WT1 H
+ATOM 1378 OH2 TIP3X 489 -28.724 -24.535 -12.675 0.00 0.00 WT1 O
+ATOM 1379 H1 TIP3X 489 -29.228 -25.009 -12.036 0.00 0.00 WT1 H
+ATOM 1380 H2 TIP3X 489 -28.396 -23.712 -12.247 0.00 0.00 WT1 H
+ATOM 1381 OH2 TIP3X 490 -29.109 -26.956 0.613 0.00 0.00 WT1 O
+ATOM 1382 H1 TIP3X 490 -29.740 -27.480 1.150 0.00 0.00 WT1 H
+ATOM 1383 H2 TIP3X 490 -29.697 -26.490 0.020 0.00 0.00 WT1 H
+ATOM 1384 OH2 TIP3X 491 -30.160 -23.735 -3.338 0.00 0.00 WT1 O
+ATOM 1385 H1 TIP3X 491 -30.320 -23.956 -4.253 0.00 0.00 WT1 H
+ATOM 1386 H2 TIP3X 491 -30.166 -22.789 -3.267 0.00 0.00 WT1 H
+ATOM 1387 OH2 TIP3X 493 -22.300 -18.907 14.444 0.00 0.00 WT1 O
+ATOM 1388 H1 TIP3X 493 -21.488 -18.845 14.012 0.00 0.00 WT1 H
+ATOM 1389 H2 TIP3X 493 -22.219 -19.807 14.755 0.00 0.00 WT1 H
+ATOM 1390 OH2 TIP3X 494 -31.263 -14.098 5.090 0.00 0.00 WT1 O
+ATOM 1391 H1 TIP3X 494 -31.541 -13.208 5.352 0.00 0.00 WT1 H
+ATOM 1392 H2 TIP3X 494 -31.134 -14.051 4.147 0.00 0.00 WT1 H
+ATOM 1393 OH2 TIP3X 495 -22.022 -24.125 -7.052 0.00 0.00 WT1 O
+ATOM 1394 H1 TIP3X 495 -22.411 -24.374 -6.155 0.00 0.00 WT1 H
+ATOM 1395 H2 TIP3X 495 -21.564 -23.344 -6.813 0.00 0.00 WT1 H
+ATOM 1396 OH2 TIP3X 496 -27.841 31.382 7.887 0.00 0.00 WT1 O
+ATOM 1397 H1 TIP3X 496 -27.634 30.852 7.127 0.00 0.00 WT1 H
+ATOM 1398 H2 TIP3X 496 -27.193 30.983 8.561 0.00 0.00 WT1 H
+ATOM 1399 OH2 TIP3X 497 -11.525 -13.838 21.736 0.00 0.00 WT1 O
+ATOM 1400 H1 TIP3X 497 -11.558 -12.816 21.542 0.00 0.00 WT1 H
+ATOM 1401 H2 TIP3X 497 -12.159 -14.243 21.113 0.00 0.00 WT1 H
+ATOM 1402 OH2 TIP3X 498 -22.073 -27.815 0.805 0.00 0.00 WT1 O
+ATOM 1403 H1 TIP3X 498 -22.944 -28.065 1.202 0.00 0.00 WT1 H
+ATOM 1404 H2 TIP3X 498 -21.640 -28.675 0.665 0.00 0.00 WT1 H
+ATOM 1405 OH2 TIP3X 499 28.701 -25.215 8.898 0.00 0.00 WT1 O
+ATOM 1406 H1 TIP3X 499 29.416 -24.880 9.466 0.00 0.00 WT1 H
+ATOM 1407 H2 TIP3X 499 28.506 -24.499 8.270 0.00 0.00 WT1 H
+ATOM 1408 OH2 TIP3X 500 -11.235 -15.782 16.372 0.00 0.00 WT1 O
+ATOM 1409 H1 TIP3X 500 -11.178 -15.842 15.390 0.00 0.00 WT1 H
+ATOM 1410 H2 TIP3X 500 -10.405 -16.143 16.699 0.00 0.00 WT1 H
+ATOM 1411 OH2 TIP3X 501 -31.103 -27.526 22.719 0.00 0.00 WT1 O
+ATOM 1412 H1 TIP3X 501 -30.678 -26.657 22.752 0.00 0.00 WT1 H
+ATOM 1413 H2 TIP3X 501 -31.810 -27.424 23.344 0.00 0.00 WT1 H
+ATOM 1414 OH2 TIP3X 502 -30.148 -21.293 29.751 0.00 0.00 WT1 O
+ATOM 1415 H1 TIP3X 502 -29.368 -21.885 29.853 0.00 0.00 WT1 H
+ATOM 1416 H2 TIP3X 502 -30.425 -21.015 30.656 0.00 0.00 WT1 H
+ATOM 1417 OH2 TIP3X 503 -28.881 -21.675 -18.842 0.00 0.00 WT1 O
+ATOM 1418 H1 TIP3X 503 -28.402 -21.100 -19.488 0.00 0.00 WT1 H
+ATOM 1419 H2 TIP3X 503 -28.560 -22.570 -19.038 0.00 0.00 WT1 H
+ATOM 1420 OH2 TIP3X 504 23.260 -21.773 30.969 0.00 0.00 WT1 O
+ATOM 1421 H1 TIP3X 504 23.773 -21.932 30.184 0.00 0.00 WT1 H
+ATOM 1422 H2 TIP3X 504 23.202 -20.764 30.999 0.00 0.00 WT1 H
+ATOM 1423 OH2 TIP3X 506 -29.622 -26.194 -15.747 0.00 0.00 WT1 O
+ATOM 1424 H1 TIP3X 506 -29.843 -25.839 -14.901 0.00 0.00 WT1 H
+ATOM 1425 H2 TIP3X 506 -28.699 -25.968 -15.874 0.00 0.00 WT1 H
+ATOM 1426 OH2 TIP3X 507 -25.618 -9.729 -29.681 0.00 0.00 WT1 O
+ATOM 1427 H1 TIP3X 507 -26.450 -9.965 -30.153 0.00 0.00 WT1 H
+ATOM 1428 H2 TIP3X 507 -25.141 -10.528 -29.808 0.00 0.00 WT1 H
+ATOM 1429 OH2 TIP3X 508 -0.196 -19.244 -24.948 0.00 0.00 WT1 O
+ATOM 1430 H1 TIP3X 508 -0.457 -18.358 -25.269 0.00 0.00 WT1 H
+ATOM 1431 H2 TIP3X 508 0.291 -19.070 -24.133 0.00 0.00 WT1 H
+ATOM 1432 OH2 TIP3X 509 -27.983 -28.095 -12.582 0.00 0.00 WT1 O
+ATOM 1433 H1 TIP3X 509 -28.858 -27.958 -12.868 0.00 0.00 WT1 H
+ATOM 1434 H2 TIP3X 509 -27.418 -27.273 -12.705 0.00 0.00 WT1 H
+ATOM 1435 OH2 TIP3X 510 23.085 -31.094 -5.494 0.00 0.00 WT1 O
+ATOM 1436 H1 TIP3X 510 23.544 -31.702 -5.981 0.00 0.00 WT1 H
+ATOM 1437 H2 TIP3X 510 23.754 -30.793 -4.927 0.00 0.00 WT1 H
+ATOM 1438 OH2 TIP3X 511 -29.656 -11.528 -10.369 0.00 0.00 WT1 O
+ATOM 1439 H1 TIP3X 511 -29.068 -11.179 -11.055 0.00 0.00 WT1 H
+ATOM 1440 H2 TIP3X 511 -30.533 -11.452 -10.862 0.00 0.00 WT1 H
+ATOM 1441 OH2 TIP3X 512 -11.387 -18.384 -20.934 0.00 0.00 WT1 O
+ATOM 1442 H1 TIP3X 512 -11.261 -18.041 -21.782 0.00 0.00 WT1 H
+ATOM 1443 H2 TIP3X 512 -12.381 -18.184 -20.750 0.00 0.00 WT1 H
+ATOM 1444 OH2 TIP3X 514 -20.508 -26.452 2.846 0.00 0.00 WT1 O
+ATOM 1445 H1 TIP3X 514 -20.837 -26.796 2.040 0.00 0.00 WT1 H
+ATOM 1446 H2 TIP3X 514 -20.614 -25.521 2.859 0.00 0.00 WT1 H
+ATOM 1447 OH2 TIP3X 515 -30.213 -22.482 -7.485 0.00 0.00 WT1 O
+ATOM 1448 H1 TIP3X 515 -29.868 -22.425 -8.354 0.00 0.00 WT1 H
+ATOM 1449 H2 TIP3X 515 -30.140 -21.594 -7.213 0.00 0.00 WT1 H
+ATOM 1450 OH2 TIP3X 516 -27.873 -30.130 0.761 0.00 0.00 WT1 O
+ATOM 1451 H1 TIP3X 516 -28.170 -29.728 -0.011 0.00 0.00 WT1 H
+ATOM 1452 H2 TIP3X 516 -27.270 -29.438 1.098 0.00 0.00 WT1 H
+ATOM 1453 OH2 TIP3X 517 -17.474 -21.468 -11.863 0.00 0.00 WT1 O
+ATOM 1454 H1 TIP3X 517 -17.838 -22.267 -11.497 0.00 0.00 WT1 H
+ATOM 1455 H2 TIP3X 517 -17.534 -21.580 -12.806 0.00 0.00 WT1 H
+ATOM 1456 OH2 TIP3X 518 -21.511 -22.258 21.492 0.00 0.00 WT1 O
+ATOM 1457 H1 TIP3X 518 -21.965 -22.650 22.219 0.00 0.00 WT1 H
+ATOM 1458 H2 TIP3X 518 -21.253 -23.002 20.966 0.00 0.00 WT1 H
+ATOM 1459 OH2 TIP3X 519 30.400 -21.367 13.609 0.00 0.00 WT1 O
+ATOM 1460 H1 TIP3X 519 30.309 -22.103 12.948 0.00 0.00 WT1 H
+ATOM 1461 H2 TIP3X 519 29.765 -20.719 13.374 0.00 0.00 WT1 H
+ATOM 1462 OH2 TIP3X 521 -29.081 30.778 17.102 0.00 0.00 WT1 O
+ATOM 1463 H1 TIP3X 521 -28.518 31.540 17.404 0.00 0.00 WT1 H
+ATOM 1464 H2 TIP3X 521 -29.945 31.197 17.101 0.00 0.00 WT1 H
+ATOM 1465 OH2 TIP3X 522 -20.719 -19.587 24.453 0.00 0.00 WT1 O
+ATOM 1466 H1 TIP3X 522 -20.638 -20.281 25.141 0.00 0.00 WT1 H
+ATOM 1467 H2 TIP3X 522 -20.342 -20.006 23.649 0.00 0.00 WT1 H
+ATOM 1468 OH2 TIP3X 523 -21.800 -11.910 30.689 0.00 0.00 WT1 O
+ATOM 1469 H1 TIP3X 523 -21.601 -10.975 30.956 0.00 0.00 WT1 H
+ATOM 1470 H2 TIP3X 523 -22.688 -11.851 30.516 0.00 0.00 WT1 H
+ATOM 1471 OH2 TIP3X 525 -24.035 -26.544 24.678 0.00 0.00 WT1 O
+ATOM 1472 H1 TIP3X 525 -23.605 -26.389 25.489 0.00 0.00 WT1 H
+ATOM 1473 H2 TIP3X 525 -24.715 -25.857 24.677 0.00 0.00 WT1 H
+ATOM 1474 OH2 TIP3X 526 -30.753 -17.107 29.018 0.00 0.00 WT1 O
+ATOM 1475 H1 TIP3X 526 -30.924 -16.137 29.159 0.00 0.00 WT1 H
+ATOM 1476 H2 TIP3X 526 -31.400 -17.530 29.550 0.00 0.00 WT1 H
+ATOM 1477 OH2 TIP3X 527 -22.108 -18.004 30.593 0.00 0.00 WT1 O
+ATOM 1478 H1 TIP3X 527 -21.527 -17.762 31.338 0.00 0.00 WT1 H
+ATOM 1479 H2 TIP3X 527 -22.422 -18.847 30.904 0.00 0.00 WT1 H
+ATOM 1480 OH2 TIP3X 528 -5.876 -15.406 -15.193 0.00 0.00 WT1 O
+ATOM 1481 H1 TIP3X 528 -5.052 -15.136 -14.756 0.00 0.00 WT1 H
+ATOM 1482 H2 TIP3X 528 -5.863 -14.952 -16.100 0.00 0.00 WT1 H
+ATOM 1483 OH2 TIP3X 529 -23.124 -3.563 -26.421 0.00 0.00 WT1 O
+ATOM 1484 H1 TIP3X 529 -22.773 -4.423 -26.642 0.00 0.00 WT1 H
+ATOM 1485 H2 TIP3X 529 -23.210 -3.602 -25.467 0.00 0.00 WT1 H
+ATOM 1486 OH2 TIP3X 530 28.432 -15.991 -20.886 0.00 0.00 WT1 O
+ATOM 1487 H1 TIP3X 530 28.363 -15.507 -20.084 0.00 0.00 WT1 H
+ATOM 1488 H2 TIP3X 530 29.300 -15.822 -21.207 0.00 0.00 WT1 H
+ATOM 1489 OH2 TIP3X 531 30.954 0.778 -8.344 0.00 0.00 WT1 O
+ATOM 1490 H1 TIP3X 531 31.485 0.016 -8.523 0.00 0.00 WT1 H
+ATOM 1491 H2 TIP3X 531 30.420 0.804 -9.200 0.00 0.00 WT1 H
+ATOM 1492 OH2 TIP3X 532 30.992 -9.994 -15.068 0.00 0.00 WT1 O
+ATOM 1493 H1 TIP3X 532 31.937 -10.116 -15.480 0.00 0.00 WT1 H
+ATOM 1494 H2 TIP3X 532 31.218 -10.178 -14.141 0.00 0.00 WT1 H
+ATOM 1495 OH2 TIP3X 533 -26.427 -17.196 -12.910 0.00 0.00 WT1 O
+ATOM 1496 H1 TIP3X 533 -26.041 -16.661 -12.192 0.00 0.00 WT1 H
+ATOM 1497 H2 TIP3X 533 -26.131 -16.587 -13.669 0.00 0.00 WT1 H
+ATOM 1498 OH2 TIP3X 534 -15.717 -24.646 -9.219 0.00 0.00 WT1 O
+ATOM 1499 H1 TIP3X 534 -16.360 -23.942 -9.551 0.00 0.00 WT1 H
+ATOM 1500 H2 TIP3X 534 -16.027 -25.440 -9.621 0.00 0.00 WT1 H
+ATOM 1501 OH2 TIP3X 535 -9.128 -13.559 -15.212 0.00 0.00 WT1 O
+ATOM 1502 H1 TIP3X 535 -9.799 -14.136 -15.621 0.00 0.00 WT1 H
+ATOM 1503 H2 TIP3X 535 -9.665 -13.019 -14.575 0.00 0.00 WT1 H
+ATOM 1504 OH2 TIP3X 536 21.734 -19.757 11.054 0.00 0.00 WT1 O
+ATOM 1505 H1 TIP3X 536 22.424 -20.320 11.408 0.00 0.00 WT1 H
+ATOM 1506 H2 TIP3X 536 21.961 -19.695 10.075 0.00 0.00 WT1 H
+ATOM 1507 OH2 TIP3X 538 -21.895 -31.159 7.111 0.00 0.00 WT1 O
+ATOM 1508 H1 TIP3X 538 -22.512 -30.550 6.631 0.00 0.00 WT1 H
+ATOM 1509 H2 TIP3X 538 -21.368 -30.582 7.705 0.00 0.00 WT1 H
+ATOM 1510 OH2 TIP3X 539 -24.053 -11.389 21.968 0.00 0.00 WT1 O
+ATOM 1511 H1 TIP3X 539 -24.280 -11.807 22.774 0.00 0.00 WT1 H
+ATOM 1512 H2 TIP3X 539 -23.456 -10.639 22.249 0.00 0.00 WT1 H
+ATOM 1513 OH2 TIP3X 540 -31.258 -11.353 5.424 0.00 0.00 WT1 O
+ATOM 1514 H1 TIP3X 540 -31.837 -10.798 4.855 0.00 0.00 WT1 H
+ATOM 1515 H2 TIP3X 540 -30.468 -11.590 4.837 0.00 0.00 WT1 H
+ATOM 1516 OH2 TIP3X 541 -29.993 -18.746 16.653 0.00 0.00 WT1 O
+ATOM 1517 H1 TIP3X 541 -30.367 -18.867 15.753 0.00 0.00 WT1 H
+ATOM 1518 H2 TIP3X 541 -29.918 -17.799 16.655 0.00 0.00 WT1 H
+ATOM 1519 OH2 TIP3X 542 31.340 -7.837 20.816 0.00 0.00 WT1 O
+ATOM 1520 H1 TIP3X 542 30.921 -7.242 21.439 0.00 0.00 WT1 H
+ATOM 1521 H2 TIP3X 542 31.242 -8.703 21.162 0.00 0.00 WT1 H
+ATOM 1522 OH2 TIP3X 543 -26.542 -18.903 -27.411 0.00 0.00 WT1 O
+ATOM 1523 H1 TIP3X 543 -26.327 -18.981 -28.388 0.00 0.00 WT1 H
+ATOM 1524 H2 TIP3X 543 -27.101 -18.106 -27.343 0.00 0.00 WT1 H
+ATOM 1525 OH2 TIP3X 544 -23.031 -14.993 23.718 0.00 0.00 WT1 O
+ATOM 1526 H1 TIP3X 544 -22.358 -15.653 23.615 0.00 0.00 WT1 H
+ATOM 1527 H2 TIP3X 544 -22.987 -14.831 24.658 0.00 0.00 WT1 H
+ATOM 1528 OH2 TIP3X 545 -29.476 26.649 23.268 0.00 0.00 WT1 O
+ATOM 1529 H1 TIP3X 545 -29.988 27.403 23.502 0.00 0.00 WT1 H
+ATOM 1530 H2 TIP3X 545 -28.568 26.788 23.581 0.00 0.00 WT1 H
+ATOM 1531 OH2 TIP3X 547 27.002 -2.283 -16.746 0.00 0.00 WT1 O
+ATOM 1532 H1 TIP3X 547 27.688 -2.655 -16.215 0.00 0.00 WT1 H
+ATOM 1533 H2 TIP3X 547 27.456 -1.590 -17.286 0.00 0.00 WT1 H
+ATOM 1534 OH2 TIP3X 549 -4.151 -22.132 -12.827 0.00 0.00 WT1 O
+ATOM 1535 H1 TIP3X 549 -4.830 -22.280 -12.137 0.00 0.00 WT1 H
+ATOM 1536 H2 TIP3X 549 -4.597 -21.581 -13.511 0.00 0.00 WT1 H
+ATOM 1537 OH2 TIP3X 550 -27.448 -30.630 -11.670 0.00 0.00 WT1 O
+ATOM 1538 H1 TIP3X 550 -27.726 -29.806 -12.047 0.00 0.00 WT1 H
+ATOM 1539 H2 TIP3X 550 -27.765 -31.199 -12.429 0.00 0.00 WT1 H
+ATOM 1540 OH2 TIP3X 551 -27.406 -6.734 -16.800 0.00 0.00 WT1 O
+ATOM 1541 H1 TIP3X 551 -28.362 -6.500 -16.804 0.00 0.00 WT1 H
+ATOM 1542 H2 TIP3X 551 -27.242 -7.103 -17.688 0.00 0.00 WT1 H
+ATOM 1543 OH2 TIP3X 552 -21.034 -31.513 -4.336 0.00 0.00 WT1 O
+ATOM 1544 H1 TIP3X 552 -21.165 -30.577 -4.525 0.00 0.00 WT1 H
+ATOM 1545 H2 TIP3X 552 -21.442 -31.908 -5.117 0.00 0.00 WT1 H
+ATOM 1546 OH2 TIP3X 553 -25.420 -19.008 -2.309 0.00 0.00 WT1 O
+ATOM 1547 H1 TIP3X 553 -25.570 -18.114 -2.028 0.00 0.00 WT1 H
+ATOM 1548 H2 TIP3X 553 -25.571 -19.501 -1.519 0.00 0.00 WT1 H
+ATOM 1549 OH2 TIP3X 554 -26.840 -18.256 -24.046 0.00 0.00 WT1 O
+ATOM 1550 H1 TIP3X 554 -25.952 -18.578 -23.793 0.00 0.00 WT1 H
+ATOM 1551 H2 TIP3X 554 -26.992 -17.507 -23.472 0.00 0.00 WT1 H
+ATOM 1552 OH2 TIP3X 555 -30.512 -24.246 -0.162 0.00 0.00 WT1 O
+ATOM 1553 H1 TIP3X 555 -31.222 -23.677 0.195 0.00 0.00 WT1 H
+ATOM 1554 H2 TIP3X 555 -30.457 -23.957 -1.079 0.00 0.00 WT1 H
+ATOM 1555 OH2 TIP3X 556 -28.652 -4.913 12.369 0.00 0.00 WT1 O
+ATOM 1556 H1 TIP3X 556 -28.153 -4.745 13.225 0.00 0.00 WT1 H
+ATOM 1557 H2 TIP3X 556 -29.187 -5.665 12.661 0.00 0.00 WT1 H
+ATOM 1558 OH2 TIP3X 558 -21.610 -25.614 -13.172 0.00 0.00 WT1 O
+ATOM 1559 H1 TIP3X 558 -21.312 -25.516 -12.269 0.00 0.00 WT1 H
+ATOM 1560 H2 TIP3X 558 -22.156 -26.411 -13.079 0.00 0.00 WT1 H
+ATOM 1561 OH2 TIP3X 561 27.971 -19.404 14.959 0.00 0.00 WT1 O
+ATOM 1562 H1 TIP3X 561 28.308 -18.837 14.313 0.00 0.00 WT1 H
+ATOM 1563 H2 TIP3X 561 27.901 -18.826 15.762 0.00 0.00 WT1 H
+ATOM 1564 OH2 TIP3X 562 -30.322 -10.058 -30.965 0.00 0.00 WT1 O
+ATOM 1565 H1 TIP3X 562 -30.728 -10.720 -30.408 0.00 0.00 WT1 H
+ATOM 1566 H2 TIP3X 562 -30.502 -9.191 -30.507 0.00 0.00 WT1 H
+ATOM 1567 OH2 TIP3X 563 28.271 -12.484 -1.440 0.00 0.00 WT1 O
+ATOM 1568 H1 TIP3X 563 28.784 -11.710 -1.722 0.00 0.00 WT1 H
+ATOM 1569 H2 TIP3X 563 27.773 -12.628 -2.224 0.00 0.00 WT1 H
+ATOM 1570 OH2 TIP3X 564 -28.223 -0.953 22.600 0.00 0.00 WT1 O
+ATOM 1571 H1 TIP3X 564 -28.378 -1.083 23.526 0.00 0.00 WT1 H
+ATOM 1572 H2 TIP3X 564 -28.936 -0.379 22.437 0.00 0.00 WT1 H
+ATOM 1573 OH2 TIP3X 567 31.062 2.888 23.799 0.00 0.00 WT1 O
+ATOM 1574 H1 TIP3X 567 30.228 2.401 23.609 0.00 0.00 WT1 H
+ATOM 1575 H2 TIP3X 567 31.086 3.536 23.076 0.00 0.00 WT1 H
+ATOM 1576 OH2 TIP3X 568 -22.370 -10.453 -29.000 0.00 0.00 WT1 O
+ATOM 1577 H1 TIP3X 568 -22.399 -9.529 -29.357 0.00 0.00 WT1 H
+ATOM 1578 H2 TIP3X 568 -22.713 -11.046 -29.688 0.00 0.00 WT1 H
+ATOM 1579 OH2 TIP3X 570 -31.245 2.044 -19.077 0.00 0.00 WT1 O
+ATOM 1580 H1 TIP3X 570 -30.622 2.200 -18.344 0.00 0.00 WT1 H
+ATOM 1581 H2 TIP3X 570 -31.669 1.221 -18.771 0.00 0.00 WT1 H
+ATOM 1582 OH2 TIP3X 571 -25.548 -19.577 28.874 0.00 0.00 WT1 O
+ATOM 1583 H1 TIP3X 571 -25.003 -19.206 28.125 0.00 0.00 WT1 H
+ATOM 1584 H2 TIP3X 571 -26.413 -19.078 28.867 0.00 0.00 WT1 H
+ATOM 1585 OH2 TIP3X 572 27.872 -2.496 -20.805 0.00 0.00 WT1 O
+ATOM 1586 H1 TIP3X 572 28.609 -2.335 -21.390 0.00 0.00 WT1 H
+ATOM 1587 H2 TIP3X 572 28.018 -1.939 -20.026 0.00 0.00 WT1 H
+ATOM 1588 OH2 TIP3X 573 -27.609 -2.577 -10.880 0.00 0.00 WT1 O
+ATOM 1589 H1 TIP3X 573 -28.237 -3.201 -10.489 0.00 0.00 WT1 H
+ATOM 1590 H2 TIP3X 573 -27.406 -2.956 -11.792 0.00 0.00 WT1 H
+ATOM 1591 OH2 TIP3X 574 30.320 -16.150 -14.599 0.00 0.00 WT1 O
+ATOM 1592 H1 TIP3X 574 30.996 -16.254 -13.952 0.00 0.00 WT1 H
+ATOM 1593 H2 TIP3X 574 29.562 -15.741 -14.100 0.00 0.00 WT1 H
+ATOM 1594 OH2 TIP3X 575 -29.656 -21.429 -29.376 0.00 0.00 WT1 O
+ATOM 1595 H1 TIP3X 575 -29.878 -21.247 -28.447 0.00 0.00 WT1 H
+ATOM 1596 H2 TIP3X 575 -29.053 -22.209 -29.383 0.00 0.00 WT1 H
+ATOM 1597 OH2 TIP3X 576 -29.418 -4.365 -9.937 0.00 0.00 WT1 O
+ATOM 1598 H1 TIP3X 576 -30.174 -4.666 -9.390 0.00 0.00 WT1 H
+ATOM 1599 H2 TIP3X 576 -29.859 -4.127 -10.773 0.00 0.00 WT1 H
+ATOM 1600 OH2 TIP3X 578 -29.381 -3.953 5.820 0.00 0.00 WT1 O
+ATOM 1601 H1 TIP3X 578 -29.531 -3.006 5.611 0.00 0.00 WT1 H
+ATOM 1602 H2 TIP3X 578 -30.029 -4.244 6.500 0.00 0.00 WT1 H
+ATOM 1603 OH2 TIP3X 579 -23.877 -24.110 2.105 0.00 0.00 WT1 O
+ATOM 1604 H1 TIP3X 579 -23.717 -24.461 3.039 0.00 0.00 WT1 H
+ATOM 1605 H2 TIP3X 579 -23.271 -23.366 2.000 0.00 0.00 WT1 H
+ATOM 1606 OH2 TIP3X 580 -18.615 -22.231 -2.547 0.00 0.00 WT1 O
+ATOM 1607 H1 TIP3X 580 -18.144 -21.609 -1.938 0.00 0.00 WT1 H
+ATOM 1608 H2 TIP3X 580 -19.401 -22.487 -2.035 0.00 0.00 WT1 H
+ATOM 1609 OH2 TIP3X 581 -26.846 -22.119 18.096 0.00 0.00 WT1 O
+ATOM 1610 H1 TIP3X 581 -25.980 -21.947 17.589 0.00 0.00 WT1 H
+ATOM 1611 H2 TIP3X 581 -27.436 -21.757 17.410 0.00 0.00 WT1 H
+ATOM 1612 OH2 TIP3X 584 -31.177 -8.332 -29.112 0.00 0.00 WT1 O
+ATOM 1613 H1 TIP3X 584 -30.364 -8.684 -28.660 0.00 0.00 WT1 H
+ATOM 1614 H2 TIP3X 584 -31.747 -8.022 -28.360 0.00 0.00 WT1 H
+ATOM 1615 OH2 TIP3X 585 -18.646 -17.242 16.647 0.00 0.00 WT1 O
+ATOM 1616 H1 TIP3X 585 -17.680 -17.636 16.687 0.00 0.00 WT1 H
+ATOM 1617 H2 TIP3X 585 -19.170 -17.790 17.217 0.00 0.00 WT1 H
+ATOM 1618 OH2 TIP3X 586 -28.389 -12.359 22.299 0.00 0.00 WT1 O
+ATOM 1619 H1 TIP3X 586 -29.175 -11.832 22.496 0.00 0.00 WT1 H
+ATOM 1620 H2 TIP3X 586 -27.742 -12.028 22.931 0.00 0.00 WT1 H
+ATOM 1621 OH2 TIP3X 587 -15.927 -8.280 16.915 0.00 0.00 WT1 O
+ATOM 1622 H1 TIP3X 587 -15.273 -8.967 17.145 0.00 0.00 WT1 H
+ATOM 1623 H2 TIP3X 587 -15.463 -7.630 16.361 0.00 0.00 WT1 H
+ATOM 1624 OH2 TIP3X 588 -17.206 8.182 -30.476 0.00 0.00 WT1 O
+ATOM 1625 H1 TIP3X 588 -17.123 8.914 -31.079 0.00 0.00 WT1 H
+ATOM 1626 H2 TIP3X 588 -16.357 7.718 -30.585 0.00 0.00 WT1 H
+ATOM 1627 OH2 TIP3X 589 -5.545 0.117 27.793 0.00 0.00 WT1 O
+ATOM 1628 H1 TIP3X 589 -4.924 0.770 28.140 0.00 0.00 WT1 H
+ATOM 1629 H2 TIP3X 589 -5.172 -0.248 27.017 0.00 0.00 WT1 H
+ATOM 1630 OH2 TIP3X 590 -8.041 -1.069 27.159 0.00 0.00 WT1 O
+ATOM 1631 H1 TIP3X 590 -7.185 -0.865 27.598 0.00 0.00 WT1 H
+ATOM 1632 H2 TIP3X 590 -8.609 -1.241 27.907 0.00 0.00 WT1 H
+ATOM 1633 OH2 TIP3X 591 -29.917 -3.668 -24.674 0.00 0.00 WT1 O
+ATOM 1634 H1 TIP3X 591 -30.442 -3.486 -23.885 0.00 0.00 WT1 H
+ATOM 1635 H2 TIP3X 591 -30.504 -4.263 -25.189 0.00 0.00 WT1 H
+ATOM 1636 OH2 TIP3X 592 -18.780 -7.506 -18.908 0.00 0.00 WT1 O
+ATOM 1637 H1 TIP3X 592 -19.109 -6.617 -18.713 0.00 0.00 WT1 H
+ATOM 1638 H2 TIP3X 592 -18.944 -8.082 -18.147 0.00 0.00 WT1 H
+ATOM 1639 OH2 TIP3X 593 -31.005 -3.979 -21.985 0.00 0.00 WT1 O
+ATOM 1640 H1 TIP3X 593 -31.987 -4.019 -21.957 0.00 0.00 WT1 H
+ATOM 1641 H2 TIP3X 593 -30.702 -4.881 -21.737 0.00 0.00 WT1 H
+ATOM 1642 OH2 TIP3X 594 -29.290 -25.815 -24.460 0.00 0.00 WT1 O
+ATOM 1643 H1 TIP3X 594 -29.533 -25.764 -25.439 0.00 0.00 WT1 H
+ATOM 1644 H2 TIP3X 594 -28.590 -25.145 -24.420 0.00 0.00 WT1 H
+ATOM 1645 OH2 TIP3X 595 -25.089 -12.542 -14.665 0.00 0.00 WT1 O
+ATOM 1646 H1 TIP3X 595 -24.483 -11.882 -15.043 0.00 0.00 WT1 H
+ATOM 1647 H2 TIP3X 595 -25.685 -12.864 -15.412 0.00 0.00 WT1 H
+ATOM 1648 OH2 TIP3X 596 25.673 -0.385 -15.021 0.00 0.00 WT1 O
+ATOM 1649 H1 TIP3X 596 25.787 0.444 -15.444 0.00 0.00 WT1 H
+ATOM 1650 H2 TIP3X 596 26.059 -1.040 -15.625 0.00 0.00 WT1 H
+ATOM 1651 OH2 TIP3X 597 26.614 -26.942 -9.995 0.00 0.00 WT1 O
+ATOM 1652 H1 TIP3X 597 26.147 -27.035 -9.175 0.00 0.00 WT1 H
+ATOM 1653 H2 TIP3X 597 26.562 -27.837 -10.359 0.00 0.00 WT1 H
+ATOM 1654 OH2 TIP3X 598 -18.664 -7.539 4.785 0.00 0.00 WT1 O
+ATOM 1655 H1 TIP3X 598 -18.761 -6.836 5.434 0.00 0.00 WT1 H
+ATOM 1656 H2 TIP3X 598 -18.307 -8.287 5.244 0.00 0.00 WT1 H
+ATOM 1657 OH2 TIP3X 599 -29.166 -16.957 2.374 0.00 0.00 WT1 O
+ATOM 1658 H1 TIP3X 599 -29.721 -17.193 3.123 0.00 0.00 WT1 H
+ATOM 1659 H2 TIP3X 599 -28.393 -17.451 2.503 0.00 0.00 WT1 H
+ATOM 1660 OH2 TIP3X 600 -28.915 3.286 8.650 0.00 0.00 WT1 O
+ATOM 1661 H1 TIP3X 600 -28.056 3.236 9.009 0.00 0.00 WT1 H
+ATOM 1662 H2 TIP3X 600 -29.477 2.815 9.264 0.00 0.00 WT1 H
+ATOM 1663 OH2 TIP3X 601 -8.876 -11.371 13.624 0.00 0.00 WT1 O
+ATOM 1664 H1 TIP3X 601 -9.890 -11.414 13.371 0.00 0.00 WT1 H
+ATOM 1665 H2 TIP3X 601 -8.705 -12.337 13.829 0.00 0.00 WT1 H
+ATOM 1666 OH2 TIP3X 602 -26.821 -11.110 -4.613 0.00 0.00 WT1 O
+ATOM 1667 H1 TIP3X 602 -27.382 -10.394 -4.354 0.00 0.00 WT1 H
+ATOM 1668 H2 TIP3X 602 -26.804 -11.789 -3.893 0.00 0.00 WT1 H
+ATOM 1669 OH2 TIP3X 603 -18.518 -8.545 29.569 0.00 0.00 WT1 O
+ATOM 1670 H1 TIP3X 603 -19.226 -8.716 30.138 0.00 0.00 WT1 H
+ATOM 1671 H2 TIP3X 603 -17.754 -8.438 30.223 0.00 0.00 WT1 H
+ATOM 1672 OH2 TIP3X 604 -18.748 -11.912 28.517 0.00 0.00 WT1 O
+ATOM 1673 H1 TIP3X 604 -19.346 -11.662 29.255 0.00 0.00 WT1 H
+ATOM 1674 H2 TIP3X 604 -17.860 -11.558 28.830 0.00 0.00 WT1 H
+ATOM 1675 OH2 TIP3X 605 30.547 -18.376 19.735 0.00 0.00 WT1 O
+ATOM 1676 H1 TIP3X 605 30.516 -18.537 20.688 0.00 0.00 WT1 H
+ATOM 1677 H2 TIP3X 605 31.051 -17.581 19.603 0.00 0.00 WT1 H
+ATOM 1678 OH2 TIP3X 606 -30.571 -9.589 18.856 0.00 0.00 WT1 O
+ATOM 1679 H1 TIP3X 606 -30.365 -8.672 18.606 0.00 0.00 WT1 H
+ATOM 1680 H2 TIP3X 606 -29.641 -9.949 19.025 0.00 0.00 WT1 H
+ATOM 1681 OH2 TIP3X 610 -29.634 12.352 31.230 0.00 0.00 WT1 O
+ATOM 1682 H1 TIP3X 610 -29.335 11.657 31.892 0.00 0.00 WT1 H
+ATOM 1683 H2 TIP3X 610 -30.220 11.873 30.634 0.00 0.00 WT1 H
+ATOM 1684 OH2 TIP3X 611 -22.661 6.413 -13.977 0.00 0.00 WT1 O
+ATOM 1685 H1 TIP3X 611 -22.709 5.725 -13.291 0.00 0.00 WT1 H
+ATOM 1686 H2 TIP3X 611 -21.895 6.114 -14.489 0.00 0.00 WT1 H
+ATOM 1687 OH2 TIP3X 612 -15.808 -9.597 -28.218 0.00 0.00 WT1 O
+ATOM 1688 H1 TIP3X 612 -15.637 -9.119 -27.378 0.00 0.00 WT1 H
+ATOM 1689 H2 TIP3X 612 -15.573 -8.935 -28.914 0.00 0.00 WT1 H
+ATOM 1690 OH2 TIP3X 613 -18.460 -9.780 -29.252 0.00 0.00 WT1 O
+ATOM 1691 H1 TIP3X 613 -19.035 -9.525 -28.538 0.00 0.00 WT1 H
+ATOM 1692 H2 TIP3X 613 -17.572 -9.596 -28.926 0.00 0.00 WT1 H
+ATOM 1693 OH2 TIP3X 614 28.300 2.302 25.897 0.00 0.00 WT1 O
+ATOM 1694 H1 TIP3X 614 27.688 2.566 26.605 0.00 0.00 WT1 H
+ATOM 1695 H2 TIP3X 614 29.139 2.801 26.067 0.00 0.00 WT1 H
+ATOM 1696 OH2 TIP3X 615 -22.475 -3.459 -1.849 0.00 0.00 WT1 O
+ATOM 1697 H1 TIP3X 615 -21.585 -3.582 -2.314 0.00 0.00 WT1 H
+ATOM 1698 H2 TIP3X 615 -22.803 -4.329 -1.761 0.00 0.00 WT1 H
+ATOM 1699 OH2 TIP3X 616 -28.995 1.969 -17.251 0.00 0.00 WT1 O
+ATOM 1700 H1 TIP3X 616 -28.251 2.208 -17.841 0.00 0.00 WT1 H
+ATOM 1701 H2 TIP3X 616 -28.897 1.042 -17.075 0.00 0.00 WT1 H
+ATOM 1702 OH2 TIP3X 617 28.417 -14.307 -13.841 0.00 0.00 WT1 O
+ATOM 1703 H1 TIP3X 617 27.813 -14.389 -13.106 0.00 0.00 WT1 H
+ATOM 1704 H2 TIP3X 617 29.029 -13.598 -13.432 0.00 0.00 WT1 H
+ATOM 1705 OH2 TIP3X 618 -23.611 -13.835 -1.008 0.00 0.00 WT1 O
+ATOM 1706 H1 TIP3X 618 -24.032 -14.230 -1.790 0.00 0.00 WT1 H
+ATOM 1707 H2 TIP3X 618 -23.583 -14.549 -0.359 0.00 0.00 WT1 H
+ATOM 1708 OH2 TIP3X 619 -26.803 5.740 -11.488 0.00 0.00 WT1 O
+ATOM 1709 H1 TIP3X 619 -26.483 6.488 -11.972 0.00 0.00 WT1 H
+ATOM 1710 H2 TIP3X 619 -27.762 5.952 -11.227 0.00 0.00 WT1 H
+ATOM 1711 OH2 TIP3X 621 31.226 -8.264 -9.117 0.00 0.00 WT1 O
+ATOM 1712 H1 TIP3X 621 31.816 -8.445 -9.835 0.00 0.00 WT1 H
+ATOM 1713 H2 TIP3X 621 31.482 -8.921 -8.511 0.00 0.00 WT1 H
+ATOM 1714 OH2 TIP3X 622 30.182 30.817 22.875 0.00 0.00 WT1 O
+ATOM 1715 H1 TIP3X 622 29.506 31.573 22.875 0.00 0.00 WT1 H
+ATOM 1716 H2 TIP3X 622 30.802 31.101 22.170 0.00 0.00 WT1 H
+ATOM 1717 OH2 TIP3X 623 -21.562 -10.763 9.009 0.00 0.00 WT1 O
+ATOM 1718 H1 TIP3X 623 -21.154 -11.260 8.268 0.00 0.00 WT1 H
+ATOM 1719 H2 TIP3X 623 -22.423 -10.520 8.712 0.00 0.00 WT1 H
+ATOM 1720 OH2 TIP3X 624 -16.674 -5.032 -0.598 0.00 0.00 WT1 O
+ATOM 1721 H1 TIP3X 624 -17.547 -5.264 -1.072 0.00 0.00 WT1 H
+ATOM 1722 H2 TIP3X 624 -16.932 -4.380 0.033 0.00 0.00 WT1 H
+ATOM 1723 OH2 TIP3X 625 18.200 -22.582 4.459 0.00 0.00 WT1 O
+ATOM 1724 H1 TIP3X 625 18.231 -22.802 3.524 0.00 0.00 WT1 H
+ATOM 1725 H2 TIP3X 625 18.629 -23.367 4.839 0.00 0.00 WT1 H
+ATOM 1726 OH2 TIP3X 626 -28.729 -13.026 11.187 0.00 0.00 WT1 O
+ATOM 1727 H1 TIP3X 626 -28.542 -13.927 10.988 0.00 0.00 WT1 H
+ATOM 1728 H2 TIP3X 626 -28.680 -12.571 10.313 0.00 0.00 WT1 H
+ATOM 1729 OH2 TIP3X 627 -24.270 -1.183 23.660 0.00 0.00 WT1 O
+ATOM 1730 H1 TIP3X 627 -23.579 -1.153 24.240 0.00 0.00 WT1 H
+ATOM 1731 H2 TIP3X 627 -25.049 -0.947 24.150 0.00 0.00 WT1 H
+ATOM 1732 OH2 TIP3X 629 -29.899 1.097 25.189 0.00 0.00 WT1 O
+ATOM 1733 H1 TIP3X 629 -30.741 0.623 25.065 0.00 0.00 WT1 H
+ATOM 1734 H2 TIP3X 629 -30.081 1.534 26.062 0.00 0.00 WT1 H
+ATOM 1735 OH2 TIP3X 630 -20.648 -1.399 29.013 0.00 0.00 WT1 O
+ATOM 1736 H1 TIP3X 630 -19.731 -1.184 28.919 0.00 0.00 WT1 H
+ATOM 1737 H2 TIP3X 630 -20.835 -1.103 29.913 0.00 0.00 WT1 H
+ATOM 1738 OH2 TIP3X 631 24.021 9.447 17.575 0.00 0.00 WT1 O
+ATOM 1739 H1 TIP3X 631 24.665 9.519 16.814 0.00 0.00 WT1 H
+ATOM 1740 H2 TIP3X 631 23.690 8.626 17.392 0.00 0.00 WT1 H
+ATOM 1741 OH2 TIP3X 632 -23.819 -8.535 -24.363 0.00 0.00 WT1 O
+ATOM 1742 H1 TIP3X 632 -22.993 -8.063 -24.297 0.00 0.00 WT1 H
+ATOM 1743 H2 TIP3X 632 -24.483 -7.883 -24.688 0.00 0.00 WT1 H
+ATOM 1744 OH2 TIP3X 634 -21.071 -17.250 -26.282 0.00 0.00 WT1 O
+ATOM 1745 H1 TIP3X 634 -21.950 -17.459 -26.592 0.00 0.00 WT1 H
+ATOM 1746 H2 TIP3X 634 -20.599 -18.121 -26.283 0.00 0.00 WT1 H
+ATOM 1747 OH2 TIP3X 635 -12.341 -6.448 -14.551 0.00 0.00 WT1 O
+ATOM 1748 H1 TIP3X 635 -11.818 -5.654 -14.501 0.00 0.00 WT1 H
+ATOM 1749 H2 TIP3X 635 -13.266 -6.142 -14.619 0.00 0.00 WT1 H
+ATOM 1750 OH2 TIP3X 636 -25.016 2.157 -8.952 0.00 0.00 WT1 O
+ATOM 1751 H1 TIP3X 636 -25.782 2.085 -9.543 0.00 0.00 WT1 H
+ATOM 1752 H2 TIP3X 636 -25.284 1.608 -8.200 0.00 0.00 WT1 H
+ATOM 1753 OH2 TIP3X 637 -25.003 2.755 3.342 0.00 0.00 WT1 O
+ATOM 1754 H1 TIP3X 637 -24.400 2.991 3.995 0.00 0.00 WT1 H
+ATOM 1755 H2 TIP3X 637 -25.065 1.804 3.464 0.00 0.00 WT1 H
+ATOM 1756 OH2 TIP3X 638 -29.914 -6.548 -13.806 0.00 0.00 WT1 O
+ATOM 1757 H1 TIP3X 638 -29.826 -6.077 -14.606 0.00 0.00 WT1 H
+ATOM 1758 H2 TIP3X 638 -30.728 -6.131 -13.396 0.00 0.00 WT1 H
+ATOM 1759 OH2 TIP3X 639 -30.317 -6.333 -5.668 0.00 0.00 WT1 O
+ATOM 1760 H1 TIP3X 639 -29.420 -6.093 -5.574 0.00 0.00 WT1 H
+ATOM 1761 H2 TIP3X 639 -30.515 -6.773 -4.874 0.00 0.00 WT1 H
+ATOM 1762 OH2 TIP3X 640 -8.669 -10.381 -13.931 0.00 0.00 WT1 O
+ATOM 1763 H1 TIP3X 640 -8.863 -9.484 -13.544 0.00 0.00 WT1 H
+ATOM 1764 H2 TIP3X 640 -9.337 -11.015 -13.550 0.00 0.00 WT1 H
+ATOM 1765 OH2 TIP3X 641 30.278 0.015 9.662 0.00 0.00 WT1 O
+ATOM 1766 H1 TIP3X 641 30.493 -0.327 10.515 0.00 0.00 WT1 H
+ATOM 1767 H2 TIP3X 641 29.777 0.814 9.906 0.00 0.00 WT1 H
+ATOM 1768 OH2 TIP3X 642 -30.246 2.617 2.408 0.00 0.00 WT1 O
+ATOM 1769 H1 TIP3X 642 -30.209 2.662 3.420 0.00 0.00 WT1 H
+ATOM 1770 H2 TIP3X 642 -29.432 3.011 2.179 0.00 0.00 WT1 H
+ATOM 1771 OH2 TIP3X 643 -17.300 -2.823 1.075 0.00 0.00 WT1 O
+ATOM 1772 H1 TIP3X 643 -17.425 -3.113 1.996 0.00 0.00 WT1 H
+ATOM 1773 H2 TIP3X 643 -18.231 -2.817 0.748 0.00 0.00 WT1 H
+ATOM 1774 OH2 TIP3X 644 -16.582 -14.709 17.569 0.00 0.00 WT1 O
+ATOM 1775 H1 TIP3X 644 -15.916 -14.941 16.956 0.00 0.00 WT1 H
+ATOM 1776 H2 TIP3X 644 -16.016 -14.178 18.135 0.00 0.00 WT1 H
+ATOM 1777 OH2 TIP3X 645 28.973 0.325 1.542 0.00 0.00 WT1 O
+ATOM 1778 H1 TIP3X 645 29.725 0.302 2.152 0.00 0.00 WT1 H
+ATOM 1779 H2 TIP3X 645 28.788 -0.630 1.643 0.00 0.00 WT1 H
+ATOM 1780 OH2 TIP3X 646 -23.354 1.983 21.165 0.00 0.00 WT1 O
+ATOM 1781 H1 TIP3X 646 -23.732 2.771 21.714 0.00 0.00 WT1 H
+ATOM 1782 H2 TIP3X 646 -22.742 2.464 20.572 0.00 0.00 WT1 H
+ATOM 1783 OH2 TIP3X 647 27.484 -9.339 24.480 0.00 0.00 WT1 O
+ATOM 1784 H1 TIP3X 647 27.831 -10.168 24.908 0.00 0.00 WT1 H
+ATOM 1785 H2 TIP3X 647 28.215 -8.736 24.597 0.00 0.00 WT1 H
+ATOM 1786 OH2 TIP3X 648 13.797 -21.958 9.231 0.00 0.00 WT1 O
+ATOM 1787 H1 TIP3X 648 14.158 -22.516 9.976 0.00 0.00 WT1 H
+ATOM 1788 H2 TIP3X 648 14.212 -21.087 9.424 0.00 0.00 WT1 H
+ATOM 1789 OH2 TIP3X 650 -31.340 -10.019 23.974 0.00 0.00 WT1 O
+ATOM 1790 H1 TIP3X 650 -31.009 -9.889 24.863 0.00 0.00 WT1 H
+ATOM 1791 H2 TIP3X 650 -31.046 -9.250 23.491 0.00 0.00 WT1 H
+ATOM 1792 OH2 TIP3X 651 -18.540 -5.954 31.177 0.00 0.00 WT1 O
+ATOM 1793 H1 TIP3X 651 -18.958 -5.476 31.883 0.00 0.00 WT1 H
+ATOM 1794 H2 TIP3X 651 -19.073 -5.614 30.395 0.00 0.00 WT1 H
+ATOM 1795 OH2 TIP3X 652 26.088 2.235 24.117 0.00 0.00 WT1 O
+ATOM 1796 H1 TIP3X 652 25.713 1.942 24.957 0.00 0.00 WT1 H
+ATOM 1797 H2 TIP3X 652 26.986 2.451 24.396 0.00 0.00 WT1 H
+ATOM 1798 OH2 TIP3X 653 -26.443 9.084 -21.034 0.00 0.00 WT1 O
+ATOM 1799 H1 TIP3X 653 -27.359 8.939 -20.634 0.00 0.00 WT1 H
+ATOM 1800 H2 TIP3X 653 -26.148 9.949 -20.622 0.00 0.00 WT1 H
+ATOM 1801 OH2 TIP3X 656 23.549 -2.085 -19.940 0.00 0.00 WT1 O
+ATOM 1802 H1 TIP3X 656 24.425 -2.388 -19.623 0.00 0.00 WT1 H
+ATOM 1803 H2 TIP3X 656 23.266 -2.809 -20.472 0.00 0.00 WT1 H
+ATOM 1804 OH2 TIP3X 657 -22.914 5.628 -21.139 0.00 0.00 WT1 O
+ATOM 1805 H1 TIP3X 657 -23.399 6.463 -21.333 0.00 0.00 WT1 H
+ATOM 1806 H2 TIP3X 657 -22.805 5.683 -20.136 0.00 0.00 WT1 H
+ATOM 1807 OH2 TIP3X 658 30.059 9.035 -9.065 0.00 0.00 WT1 O
+ATOM 1808 H1 TIP3X 658 30.086 8.099 -8.806 0.00 0.00 WT1 H
+ATOM 1809 H2 TIP3X 658 30.567 9.476 -8.411 0.00 0.00 WT1 H
+ATOM 1810 OH2 TIP3X 659 -15.493 -14.830 -10.994 0.00 0.00 WT1 O
+ATOM 1811 H1 TIP3X 659 -14.774 -14.994 -11.705 0.00 0.00 WT1 H
+ATOM 1812 H2 TIP3X 659 -15.970 -15.703 -10.918 0.00 0.00 WT1 H
+ATOM 1813 OH2 TIP3X 660 22.458 -2.354 -10.298 0.00 0.00 WT1 O
+ATOM 1814 H1 TIP3X 660 22.172 -2.319 -11.209 0.00 0.00 WT1 H
+ATOM 1815 H2 TIP3X 660 22.265 -1.494 -9.860 0.00 0.00 WT1 H
+ATOM 1816 OH2 TIP3X 661 -20.069 4.535 0.386 0.00 0.00 WT1 O
+ATOM 1817 H1 TIP3X 661 -20.561 4.173 1.148 0.00 0.00 WT1 H
+ATOM 1818 H2 TIP3X 661 -19.757 3.723 -0.155 0.00 0.00 WT1 H
+ATOM 1819 OH2 TIP3X 662 -28.210 -8.682 -5.933 0.00 0.00 WT1 O
+ATOM 1820 H1 TIP3X 662 -27.889 -8.316 -5.099 0.00 0.00 WT1 H
+ATOM 1821 H2 TIP3X 662 -29.165 -8.804 -5.752 0.00 0.00 WT1 H
+ATOM 1822 OH2 TIP3X 663 28.047 2.226 7.611 0.00 0.00 WT1 O
+ATOM 1823 H1 TIP3X 663 27.800 1.879 8.489 0.00 0.00 WT1 H
+ATOM 1824 H2 TIP3X 663 28.849 2.706 7.814 0.00 0.00 WT1 H
+ATOM 1825 OH2 TIP3X 664 24.407 -6.132 18.777 0.00 0.00 WT1 O
+ATOM 1826 H1 TIP3X 664 24.429 -5.629 17.916 0.00 0.00 WT1 H
+ATOM 1827 H2 TIP3X 664 23.447 -6.045 18.996 0.00 0.00 WT1 H
+ATOM 1828 OH2 TIP3X 665 27.827 10.582 -7.531 0.00 0.00 WT1 O
+ATOM 1829 H1 TIP3X 665 28.298 9.714 -7.856 0.00 0.00 WT1 H
+ATOM 1830 H2 TIP3X 665 28.489 11.175 -7.404 0.00 0.00 WT1 H
+ATOM 1831 OH2 TIP3X 666 -30.375 -1.900 4.358 0.00 0.00 WT1 O
+ATOM 1832 H1 TIP3X 666 -30.272 -1.288 3.618 0.00 0.00 WT1 H
+ATOM 1833 H2 TIP3X 666 -31.088 -1.451 4.843 0.00 0.00 WT1 H
+ATOM 1834 OH2 TIP3X 667 -4.071 8.015 16.541 0.00 0.00 WT1 O
+ATOM 1835 H1 TIP3X 667 -4.581 7.596 17.286 0.00 0.00 WT1 H
+ATOM 1836 H2 TIP3X 667 -4.184 7.375 15.799 0.00 0.00 WT1 H
+ATOM 1837 OH2 TIP3X 668 -27.765 -7.590 20.374 0.00 0.00 WT1 O
+ATOM 1838 H1 TIP3X 668 -27.325 -6.864 20.820 0.00 0.00 WT1 H
+ATOM 1839 H2 TIP3X 668 -28.424 -7.109 19.767 0.00 0.00 WT1 H
+ATOM 1840 OH2 TIP3X 670 -24.846 -1.366 17.484 0.00 0.00 WT1 O
+ATOM 1841 H1 TIP3X 670 -25.409 -1.274 18.262 0.00 0.00 WT1 H
+ATOM 1842 H2 TIP3X 670 -24.106 -1.926 17.745 0.00 0.00 WT1 H
+ATOM 1843 OH2 TIP3X 671 -28.239 6.263 24.091 0.00 0.00 WT1 O
+ATOM 1844 H1 TIP3X 671 -28.172 5.364 24.361 0.00 0.00 WT1 H
+ATOM 1845 H2 TIP3X 671 -27.943 6.745 24.855 0.00 0.00 WT1 H
+ATOM 1846 OH2 TIP3X 672 13.823 6.116 -27.286 0.00 0.00 WT1 O
+ATOM 1847 H1 TIP3X 672 14.056 5.908 -26.360 0.00 0.00 WT1 H
+ATOM 1848 H2 TIP3X 672 13.481 7.058 -27.077 0.00 0.00 WT1 H
+ATOM 1849 OH2 TIP3X 673 -27.966 10.651 21.832 0.00 0.00 WT1 O
+ATOM 1850 H1 TIP3X 673 -28.296 9.712 21.750 0.00 0.00 WT1 H
+ATOM 1851 H2 TIP3X 673 -28.453 11.145 21.156 0.00 0.00 WT1 H
+ATOM 1852 OH2 TIP3X 674 -26.786 3.728 -30.104 0.00 0.00 WT1 O
+ATOM 1853 H1 TIP3X 674 -26.253 3.733 -30.902 0.00 0.00 WT1 H
+ATOM 1854 H2 TIP3X 674 -27.411 4.462 -30.332 0.00 0.00 WT1 H
+ATOM 1855 OH2 TIP3X 675 -25.009 8.669 -26.851 0.00 0.00 WT1 O
+ATOM 1856 H1 TIP3X 675 -25.093 8.886 -25.919 0.00 0.00 WT1 H
+ATOM 1857 H2 TIP3X 675 -25.758 9.160 -27.276 0.00 0.00 WT1 H
+ATOM 1858 OH2 TIP3X 676 -10.045 0.145 -19.880 0.00 0.00 WT1 O
+ATOM 1859 H1 TIP3X 676 -9.972 0.757 -19.174 0.00 0.00 WT1 H
+ATOM 1860 H2 TIP3X 676 -9.298 0.400 -20.501 0.00 0.00 WT1 H
+ATOM 1861 OH2 TIP3X 677 -27.793 12.540 -14.450 0.00 0.00 WT1 O
+ATOM 1862 H1 TIP3X 677 -27.695 11.941 -13.732 0.00 0.00 WT1 H
+ATOM 1863 H2 TIP3X 677 -27.761 13.422 -14.035 0.00 0.00 WT1 H
+ATOM 1864 OH2 TIP3X 679 -24.514 -2.258 -0.029 0.00 0.00 WT1 O
+ATOM 1865 H1 TIP3X 679 -23.884 -2.845 -0.508 0.00 0.00 WT1 H
+ATOM 1866 H2 TIP3X 679 -25.222 -2.904 0.064 0.00 0.00 WT1 H
+ATOM 1867 OH2 TIP3X 680 -16.816 11.694 -14.304 0.00 0.00 WT1 O
+ATOM 1868 H1 TIP3X 680 -15.827 11.731 -14.130 0.00 0.00 WT1 H
+ATOM 1869 H2 TIP3X 680 -17.000 10.767 -14.165 0.00 0.00 WT1 H
+ATOM 1870 OH2 TIP3X 682 -24.565 -0.884 -11.900 0.00 0.00 WT1 O
+ATOM 1871 H1 TIP3X 682 -25.422 -0.736 -12.334 0.00 0.00 WT1 H
+ATOM 1872 H2 TIP3X 682 -24.686 -0.458 -10.986 0.00 0.00 WT1 H
+ATOM 1873 OH2 TIP3X 683 29.722 0.392 -10.831 0.00 0.00 WT1 O
+ATOM 1874 H1 TIP3X 683 28.853 0.768 -11.059 0.00 0.00 WT1 H
+ATOM 1875 H2 TIP3X 683 30.276 0.774 -11.503 0.00 0.00 WT1 H
+ATOM 1876 OH2 TIP3X 684 -29.843 4.500 -6.645 0.00 0.00 WT1 O
+ATOM 1877 H1 TIP3X 684 -29.109 4.045 -7.065 0.00 0.00 WT1 H
+ATOM 1878 H2 TIP3X 684 -29.597 5.436 -6.801 0.00 0.00 WT1 H
+ATOM 1879 OH2 TIP3X 685 26.501 19.270 -6.789 0.00 0.00 WT1 O
+ATOM 1880 H1 TIP3X 685 25.851 19.609 -7.438 0.00 0.00 WT1 H
+ATOM 1881 H2 TIP3X 685 26.495 18.297 -6.830 0.00 0.00 WT1 H
+ATOM 1882 OH2 TIP3X 686 -22.854 6.558 6.491 0.00 0.00 WT1 O
+ATOM 1883 H1 TIP3X 686 -22.109 5.964 6.496 0.00 0.00 WT1 H
+ATOM 1884 H2 TIP3X 686 -22.518 7.356 6.944 0.00 0.00 WT1 H
+ATOM 1885 OH2 TIP3X 687 -21.928 1.438 11.963 0.00 0.00 WT1 O
+ATOM 1886 H1 TIP3X 687 -21.501 0.562 12.173 0.00 0.00 WT1 H
+ATOM 1887 H2 TIP3X 687 -22.585 1.093 11.310 0.00 0.00 WT1 H
+ATOM 1888 OH2 TIP3X 689 30.000 0.340 23.466 0.00 0.00 WT1 O
+ATOM 1889 H1 TIP3X 689 30.543 -0.419 23.794 0.00 0.00 WT1 H
+ATOM 1890 H2 TIP3X 689 29.333 -0.157 22.994 0.00 0.00 WT1 H
+ATOM 1891 OH2 TIP3X 692 26.296 14.469 -28.353 0.00 0.00 WT1 O
+ATOM 1892 H1 TIP3X 692 27.158 14.866 -28.572 0.00 0.00 WT1 H
+ATOM 1893 H2 TIP3X 692 25.874 14.580 -29.256 0.00 0.00 WT1 H
+ATOM 1894 OH2 TIP3X 693 29.278 5.117 29.251 0.00 0.00 WT1 O
+ATOM 1895 H1 TIP3X 693 30.027 4.727 28.903 0.00 0.00 WT1 H
+ATOM 1896 H2 TIP3X 693 28.536 4.737 28.752 0.00 0.00 WT1 H
+ATOM 1897 OH2 TIP3X 695 25.178 -0.898 -12.292 0.00 0.00 WT1 O
+ATOM 1898 H1 TIP3X 695 25.474 -0.679 -13.179 0.00 0.00 WT1 H
+ATOM 1899 H2 TIP3X 695 25.216 -1.807 -12.231 0.00 0.00 WT1 H
+ATOM 1900 OH2 TIP3X 696 30.170 19.280 -29.471 0.00 0.00 WT1 O
+ATOM 1901 H1 TIP3X 696 30.133 18.940 -30.409 0.00 0.00 WT1 H
+ATOM 1902 H2 TIP3X 696 31.098 19.428 -29.303 0.00 0.00 WT1 H
+ATOM 1903 OH2 TIP3X 697 29.029 -2.686 -26.053 0.00 0.00 WT1 O
+ATOM 1904 H1 TIP3X 697 29.904 -2.224 -26.132 0.00 0.00 WT1 H
+ATOM 1905 H2 TIP3X 697 28.913 -2.630 -25.088 0.00 0.00 WT1 H
+ATOM 1906 OH2 TIP3X 698 26.953 1.363 -23.761 0.00 0.00 WT1 O
+ATOM 1907 H1 TIP3X 698 26.426 2.139 -24.009 0.00 0.00 WT1 H
+ATOM 1908 H2 TIP3X 698 27.664 1.275 -24.421 0.00 0.00 WT1 H
+ATOM 1909 OH2 TIP3X 699 -20.563 1.795 -12.051 0.00 0.00 WT1 O
+ATOM 1910 H1 TIP3X 699 -21.108 1.629 -12.834 0.00 0.00 WT1 H
+ATOM 1911 H2 TIP3X 699 -21.124 1.721 -11.241 0.00 0.00 WT1 H
+ATOM 1912 OH2 TIP3X 700 -20.050 3.322 2.900 0.00 0.00 WT1 O
+ATOM 1913 H1 TIP3X 700 -19.928 2.397 2.787 0.00 0.00 WT1 H
+ATOM 1914 H2 TIP3X 700 -19.182 3.651 3.219 0.00 0.00 WT1 H
+ATOM 1915 OH2 TIP3X 701 -25.200 5.116 -9.348 0.00 0.00 WT1 O
+ATOM 1916 H1 TIP3X 701 -25.097 4.138 -9.173 0.00 0.00 WT1 H
+ATOM 1917 H2 TIP3X 701 -25.771 5.169 -10.092 0.00 0.00 WT1 H
+ATOM 1918 OH2 TIP3X 702 -18.423 2.692 8.054 0.00 0.00 WT1 O
+ATOM 1919 H1 TIP3X 702 -18.901 2.172 8.716 0.00 0.00 WT1 H
+ATOM 1920 H2 TIP3X 702 -18.304 2.095 7.252 0.00 0.00 WT1 H
+ATOM 1921 OH2 TIP3X 703 -13.363 3.088 -6.121 0.00 0.00 WT1 O
+ATOM 1922 H1 TIP3X 703 -13.313 3.420 -7.019 0.00 0.00 WT1 H
+ATOM 1923 H2 TIP3X 703 -13.991 3.716 -5.641 0.00 0.00 WT1 H
+ATOM 1924 OH2 TIP3X 704 -28.990 8.709 6.343 0.00 0.00 WT1 O
+ATOM 1925 H1 TIP3X 704 -29.353 8.690 7.167 0.00 0.00 WT1 H
+ATOM 1926 H2 TIP3X 704 -29.297 9.599 5.964 0.00 0.00 WT1 H
+ATOM 1927 OH2 TIP3X 705 20.210 3.253 0.766 0.00 0.00 WT1 O
+ATOM 1928 H1 TIP3X 705 20.720 3.413 1.589 0.00 0.00 WT1 H
+ATOM 1929 H2 TIP3X 705 19.431 3.836 0.888 0.00 0.00 WT1 H
+ATOM 1930 OH2 TIP3X 706 -13.008 12.935 1.346 0.00 0.00 WT1 O
+ATOM 1931 H1 TIP3X 706 -13.761 12.566 0.842 0.00 0.00 WT1 H
+ATOM 1932 H2 TIP3X 706 -13.033 13.891 0.958 0.00 0.00 WT1 H
+ATOM 1933 OH2 TIP3X 707 -25.869 3.299 7.590 0.00 0.00 WT1 O
+ATOM 1934 H1 TIP3X 707 -26.501 3.415 6.908 0.00 0.00 WT1 H
+ATOM 1935 H2 TIP3X 707 -25.638 2.387 7.519 0.00 0.00 WT1 H
+ATOM 1936 OH2 TIP3X 708 -15.990 5.713 -0.797 0.00 0.00 WT1 O
+ATOM 1937 H1 TIP3X 708 -15.036 5.525 -1.052 0.00 0.00 WT1 H
+ATOM 1938 H2 TIP3X 708 -16.293 6.267 -1.568 0.00 0.00 WT1 H
+ATOM 1939 OH2 TIP3X 710 -25.960 4.974 2.283 0.00 0.00 WT1 O
+ATOM 1940 H1 TIP3X 710 -25.562 5.353 3.061 0.00 0.00 WT1 H
+ATOM 1941 H2 TIP3X 710 -25.197 4.869 1.683 0.00 0.00 WT1 H
+ATOM 1942 OH2 TIP3X 711 -30.212 -2.926 14.444 0.00 0.00 WT1 O
+ATOM 1943 H1 TIP3X 711 -29.472 -3.450 14.082 0.00 0.00 WT1 H
+ATOM 1944 H2 TIP3X 711 -30.769 -2.899 13.658 0.00 0.00 WT1 H
+ATOM 1945 OH2 TIP3X 712 -21.237 3.011 18.893 0.00 0.00 WT1 O
+ATOM 1946 H1 TIP3X 712 -21.375 2.038 18.760 0.00 0.00 WT1 H
+ATOM 1947 H2 TIP3X 712 -20.366 3.109 19.447 0.00 0.00 WT1 H
+ATOM 1948 OH2 TIP3X 713 -20.780 -3.185 13.709 0.00 0.00 WT1 O
+ATOM 1949 H1 TIP3X 713 -20.126 -3.895 13.431 0.00 0.00 WT1 H
+ATOM 1950 H2 TIP3X 713 -20.518 -3.120 14.673 0.00 0.00 WT1 H
+ATOM 1951 OH2 TIP3X 714 -24.131 11.826 22.456 0.00 0.00 WT1 O
+ATOM 1952 H1 TIP3X 714 -23.278 12.004 21.895 0.00 0.00 WT1 H
+ATOM 1953 H2 TIP3X 714 -24.817 11.961 21.807 0.00 0.00 WT1 H
+ATOM 1954 OH2 TIP3X 715 -29.287 18.909 -21.161 0.00 0.00 WT1 O
+ATOM 1955 H1 TIP3X 715 -29.702 19.649 -20.710 0.00 0.00 WT1 H
+ATOM 1956 H2 TIP3X 715 -29.971 18.692 -21.836 0.00 0.00 WT1 H
+ATOM 1957 OH2 TIP3X 717 -28.118 16.633 -25.956 0.00 0.00 WT1 O
+ATOM 1958 H1 TIP3X 717 -27.269 16.116 -26.018 0.00 0.00 WT1 H
+ATOM 1959 H2 TIP3X 717 -27.921 17.242 -25.262 0.00 0.00 WT1 H
+ATOM 1960 OH2 TIP3X 718 20.394 0.886 -15.691 0.00 0.00 WT1 O
+ATOM 1961 H1 TIP3X 718 19.823 0.197 -15.265 0.00 0.00 WT1 H
+ATOM 1962 H2 TIP3X 718 21.213 0.401 -15.825 0.00 0.00 WT1 H
+ATOM 1963 OH2 TIP3X 719 23.275 11.358 -15.418 0.00 0.00 WT1 O
+ATOM 1964 H1 TIP3X 719 22.343 11.210 -15.552 0.00 0.00 WT1 H
+ATOM 1965 H2 TIP3X 719 23.580 10.466 -15.085 0.00 0.00 WT1 H
+ATOM 1966 OH2 TIP3X 720 25.460 5.895 -28.236 0.00 0.00 WT1 O
+ATOM 1967 H1 TIP3X 720 25.503 6.873 -28.361 0.00 0.00 WT1 H
+ATOM 1968 H2 TIP3X 720 24.551 5.797 -28.377 0.00 0.00 WT1 H
+ATOM 1969 OH2 TIP3X 721 -28.049 0.492 -11.901 0.00 0.00 WT1 O
+ATOM 1970 H1 TIP3X 721 -28.045 -0.230 -12.607 0.00 0.00 WT1 H
+ATOM 1971 H2 TIP3X 721 -28.883 0.282 -11.454 0.00 0.00 WT1 H
+ATOM 1972 OH2 TIP3X 722 -28.140 9.720 -3.018 0.00 0.00 WT1 O
+ATOM 1973 H1 TIP3X 722 -27.930 9.844 -2.085 0.00 0.00 WT1 H
+ATOM 1974 H2 TIP3X 722 -28.090 8.756 -3.135 0.00 0.00 WT1 H
+ATOM 1975 OH2 TIP3X 723 25.515 13.262 -7.447 0.00 0.00 WT1 O
+ATOM 1976 H1 TIP3X 723 25.628 12.361 -7.113 0.00 0.00 WT1 H
+ATOM 1977 H2 TIP3X 723 26.374 13.606 -7.172 0.00 0.00 WT1 H
+ATOM 1978 OH2 TIP3X 725 -21.732 9.145 7.522 0.00 0.00 WT1 O
+ATOM 1979 H1 TIP3X 725 -22.280 9.846 7.922 0.00 0.00 WT1 H
+ATOM 1980 H2 TIP3X 725 -20.854 9.483 7.615 0.00 0.00 WT1 H
+ATOM 1981 OH2 TIP3X 726 -26.125 9.598 3.350 0.00 0.00 WT1 O
+ATOM 1982 H1 TIP3X 726 -25.474 9.344 4.043 0.00 0.00 WT1 H
+ATOM 1983 H2 TIP3X 726 -26.609 8.811 3.131 0.00 0.00 WT1 H
+ATOM 1984 OH2 TIP3X 729 31.010 23.256 14.253 0.00 0.00 WT1 O
+ATOM 1985 H1 TIP3X 729 31.880 22.917 13.947 0.00 0.00 WT1 H
+ATOM 1986 H2 TIP3X 729 30.729 23.797 13.514 0.00 0.00 WT1 H
+ATOM 1987 OH2 TIP3X 730 23.419 10.380 24.153 0.00 0.00 WT1 O
+ATOM 1988 H1 TIP3X 730 22.702 10.898 24.672 0.00 0.00 WT1 H
+ATOM 1989 H2 TIP3X 730 22.989 9.598 23.774 0.00 0.00 WT1 H
+ATOM 1990 OH2 TIP3X 731 -21.216 21.710 21.629 0.00 0.00 WT1 O
+ATOM 1991 H1 TIP3X 731 -22.122 22.075 21.700 0.00 0.00 WT1 H
+ATOM 1992 H2 TIP3X 731 -20.990 22.021 20.753 0.00 0.00 WT1 H
+ATOM 1993 OH2 TIP3X 732 30.786 13.020 3.217 0.00 0.00 WT1 O
+ATOM 1994 H1 TIP3X 732 30.745 13.817 2.661 0.00 0.00 WT1 H
+ATOM 1995 H2 TIP3X 732 30.688 12.319 2.546 0.00 0.00 WT1 H
+ATOM 1996 OH2 TIP3X 733 -29.802 4.364 12.353 0.00 0.00 WT1 O
+ATOM 1997 H1 TIP3X 733 -29.898 4.957 13.124 0.00 0.00 WT1 H
+ATOM 1998 H2 TIP3X 733 -30.588 4.494 11.732 0.00 0.00 WT1 H
+ATOM 1999 OH2 TIP3X 734 -25.073 19.883 23.388 0.00 0.00 WT1 O
+ATOM 2000 H1 TIP3X 734 -24.969 19.024 22.888 0.00 0.00 WT1 H
+ATOM 2001 H2 TIP3X 734 -24.242 19.939 23.889 0.00 0.00 WT1 H
+ATOM 2002 OH2 TIP3X 736 -24.522 11.797 -27.816 0.00 0.00 WT1 O
+ATOM 2003 H1 TIP3X 736 -25.139 11.153 -28.010 0.00 0.00 WT1 H
+ATOM 2004 H2 TIP3X 736 -24.487 12.419 -28.541 0.00 0.00 WT1 H
+ATOM 2005 OH2 TIP3X 737 -25.666 0.822 -1.400 0.00 0.00 WT1 O
+ATOM 2006 H1 TIP3X 737 -24.807 0.842 -0.903 0.00 0.00 WT1 H
+ATOM 2007 H2 TIP3X 737 -25.370 0.523 -2.296 0.00 0.00 WT1 H
+ATOM 2008 OH2 TIP3X 738 -27.938 1.760 -26.358 0.00 0.00 WT1 O
+ATOM 2009 H1 TIP3X 738 -28.316 2.308 -25.637 0.00 0.00 WT1 H
+ATOM 2010 H2 TIP3X 738 -28.706 1.253 -26.618 0.00 0.00 WT1 H
+ATOM 2011 OH2 TIP3X 739 24.464 6.836 -12.902 0.00 0.00 WT1 O
+ATOM 2012 H1 TIP3X 739 24.100 7.329 -13.654 0.00 0.00 WT1 H
+ATOM 2013 H2 TIP3X 739 23.792 6.955 -12.259 0.00 0.00 WT1 H
+ATOM 2014 OH2 TIP3X 740 -23.531 18.366 -22.869 0.00 0.00 WT1 O
+ATOM 2015 H1 TIP3X 740 -23.186 17.595 -23.300 0.00 0.00 WT1 H
+ATOM 2016 H2 TIP3X 740 -24.360 18.111 -22.474 0.00 0.00 WT1 H
+ATOM 2017 OH2 TIP3X 741 -20.387 2.832 -16.054 0.00 0.00 WT1 O
+ATOM 2018 H1 TIP3X 741 -20.331 1.875 -15.795 0.00 0.00 WT1 H
+ATOM 2019 H2 TIP3X 741 -21.152 3.107 -15.614 0.00 0.00 WT1 H
+ATOM 2020 OH2 TIP3X 742 23.324 5.099 -7.889 0.00 0.00 WT1 O
+ATOM 2021 H1 TIP3X 742 23.292 5.802 -7.300 0.00 0.00 WT1 H
+ATOM 2022 H2 TIP3X 742 22.480 4.608 -7.642 0.00 0.00 WT1 H
+ATOM 2023 OH2 TIP3X 743 -17.092 24.685 -4.264 0.00 0.00 WT1 O
+ATOM 2024 H1 TIP3X 743 -18.002 24.291 -4.116 0.00 0.00 WT1 H
+ATOM 2025 H2 TIP3X 743 -16.756 24.584 -3.392 0.00 0.00 WT1 H
+ATOM 2026 OH2 TIP3X 744 -20.116 22.346 -21.504 0.00 0.00 WT1 O
+ATOM 2027 H1 TIP3X 744 -20.679 21.616 -21.837 0.00 0.00 WT1 H
+ATOM 2028 H2 TIP3X 744 -20.628 22.695 -20.835 0.00 0.00 WT1 H
+ATOM 2029 OH2 TIP3X 745 -21.350 23.377 -6.823 0.00 0.00 WT1 O
+ATOM 2030 H1 TIP3X 745 -21.526 22.704 -7.461 0.00 0.00 WT1 H
+ATOM 2031 H2 TIP3X 745 -20.379 23.280 -6.682 0.00 0.00 WT1 H
+ATOM 2032 OH2 TIP3X 746 -28.560 10.702 -26.510 0.00 0.00 WT1 O
+ATOM 2033 H1 TIP3X 746 -28.301 10.534 -25.613 0.00 0.00 WT1 H
+ATOM 2034 H2 TIP3X 746 -28.501 11.699 -26.558 0.00 0.00 WT1 H
+ATOM 2035 OH2 TIP3X 747 -12.600 7.416 -0.969 0.00 0.00 WT1 O
+ATOM 2036 H1 TIP3X 747 -12.618 6.448 -0.652 0.00 0.00 WT1 H
+ATOM 2037 H2 TIP3X 747 -12.105 7.358 -1.780 0.00 0.00 WT1 H
+ATOM 2038 OH2 TIP3X 748 -23.664 3.885 9.193 0.00 0.00 WT1 O
+ATOM 2039 H1 TIP3X 748 -23.384 4.770 9.464 0.00 0.00 WT1 H
+ATOM 2040 H2 TIP3X 748 -24.429 4.196 8.573 0.00 0.00 WT1 H
+ATOM 2041 OH2 TIP3X 749 -26.378 15.501 9.684 0.00 0.00 WT1 O
+ATOM 2042 H1 TIP3X 749 -26.690 16.169 10.304 0.00 0.00 WT1 H
+ATOM 2043 H2 TIP3X 749 -27.214 15.473 9.176 0.00 0.00 WT1 H
+ATOM 2044 OH2 TIP3X 750 -20.639 20.524 10.821 0.00 0.00 WT1 O
+ATOM 2045 H1 TIP3X 750 -20.807 21.342 11.238 0.00 0.00 WT1 H
+ATOM 2046 H2 TIP3X 750 -21.273 20.453 10.055 0.00 0.00 WT1 H
+ATOM 2047 OH2 TIP3X 752 27.845 29.738 25.998 0.00 0.00 WT1 O
+ATOM 2048 H1 TIP3X 752 28.432 29.124 25.489 0.00 0.00 WT1 H
+ATOM 2049 H2 TIP3X 752 27.081 29.904 25.466 0.00 0.00 WT1 H
+ATOM 2050 OH2 TIP3X 753 -28.622 17.313 25.955 0.00 0.00 WT1 O
+ATOM 2051 H1 TIP3X 753 -28.341 18.109 25.552 0.00 0.00 WT1 H
+ATOM 2052 H2 TIP3X 753 -29.217 17.613 26.730 0.00 0.00 WT1 H
+ATOM 2053 OH2 TIP3X 754 -28.017 17.560 21.463 0.00 0.00 WT1 O
+ATOM 2054 H1 TIP3X 754 -28.201 17.326 20.616 0.00 0.00 WT1 H
+ATOM 2055 H2 TIP3X 754 -28.668 17.047 21.998 0.00 0.00 WT1 H
+ATOM 2056 OH2 TIP3X 755 -10.803 19.364 28.251 0.00 0.00 WT1 O
+ATOM 2057 H1 TIP3X 755 -10.374 19.893 28.904 0.00 0.00 WT1 H
+ATOM 2058 H2 TIP3X 755 -10.141 19.305 27.539 0.00 0.00 WT1 H
+ATOM 2059 OH2 TIP3X 757 -14.710 22.467 -15.940 0.00 0.00 WT1 O
+ATOM 2060 H1 TIP3X 757 -14.743 21.610 -16.352 0.00 0.00 WT1 H
+ATOM 2061 H2 TIP3X 757 -14.399 22.303 -15.000 0.00 0.00 WT1 H
+ATOM 2062 OH2 TIP3X 758 31.573 -28.916 -13.915 0.00 0.00 WT1 O
+ATOM 2063 H1 TIP3X 758 30.797 -28.904 -14.485 0.00 0.00 WT1 H
+ATOM 2064 H2 TIP3X 758 31.762 -27.994 -13.806 0.00 0.00 WT1 H
+ATOM 2065 OH2 TIP3X 759 -25.397 5.068 -18.343 0.00 0.00 WT1 O
+ATOM 2066 H1 TIP3X 759 -25.152 4.670 -17.550 0.00 0.00 WT1 H
+ATOM 2067 H2 TIP3X 759 -25.286 6.036 -18.135 0.00 0.00 WT1 H
+ATOM 2068 OH2 TIP3X 761 -30.534 15.470 -8.217 0.00 0.00 WT1 O
+ATOM 2069 H1 TIP3X 761 -30.749 16.364 -8.534 0.00 0.00 WT1 H
+ATOM 2070 H2 TIP3X 761 -29.571 15.607 -7.879 0.00 0.00 WT1 H
+ATOM 2071 OH2 TIP3X 762 20.058 11.018 7.825 0.00 0.00 WT1 O
+ATOM 2072 H1 TIP3X 762 19.603 10.183 7.921 0.00 0.00 WT1 H
+ATOM 2073 H2 TIP3X 762 19.463 11.657 8.174 0.00 0.00 WT1 H
+ATOM 2074 OH2 TIP3X 763 -25.539 17.950 -5.837 0.00 0.00 WT1 O
+ATOM 2075 H1 TIP3X 763 -24.954 17.395 -6.288 0.00 0.00 WT1 H
+ATOM 2076 H2 TIP3X 763 -24.934 18.236 -5.120 0.00 0.00 WT1 H
+ATOM 2077 OH2 TIP3X 764 31.023 14.425 6.735 0.00 0.00 WT1 O
+ATOM 2078 H1 TIP3X 764 30.940 15.029 7.490 0.00 0.00 WT1 H
+ATOM 2079 H2 TIP3X 764 30.147 14.598 6.280 0.00 0.00 WT1 H
+ATOM 2080 OH2 TIP3X 765 -24.340 14.281 -14.030 0.00 0.00 WT1 O
+ATOM 2081 H1 TIP3X 765 -24.052 13.520 -13.589 0.00 0.00 WT1 H
+ATOM 2082 H2 TIP3X 765 -24.771 13.967 -14.857 0.00 0.00 WT1 H
+ATOM 2083 OH2 TIP3X 766 -28.704 21.518 -17.964 0.00 0.00 WT1 O
+ATOM 2084 H1 TIP3X 766 -29.254 21.622 -18.754 0.00 0.00 WT1 H
+ATOM 2085 H2 TIP3X 766 -28.687 22.452 -17.648 0.00 0.00 WT1 H
+ATOM 2086 OH2 TIP3X 767 -20.895 21.376 -2.985 0.00 0.00 WT1 O
+ATOM 2087 H1 TIP3X 767 -21.136 21.022 -2.106 0.00 0.00 WT1 H
+ATOM 2088 H2 TIP3X 767 -20.233 20.748 -3.203 0.00 0.00 WT1 H
+ATOM 2089 OH2 TIP3X 768 -29.387 25.981 -4.184 0.00 0.00 WT1 O
+ATOM 2090 H1 TIP3X 768 -29.521 25.837 -3.203 0.00 0.00 WT1 H
+ATOM 2091 H2 TIP3X 768 -28.952 26.865 -4.206 0.00 0.00 WT1 H
+ATOM 2092 OH2 TIP3X 769 30.945 21.270 16.243 0.00 0.00 WT1 O
+ATOM 2093 H1 TIP3X 769 31.920 21.340 16.082 0.00 0.00 WT1 H
+ATOM 2094 H2 TIP3X 769 30.575 21.767 15.512 0.00 0.00 WT1 H
+ATOM 2095 OH2 TIP3X 771 -28.718 21.476 17.494 0.00 0.00 WT1 O
+ATOM 2096 H1 TIP3X 771 -27.888 21.971 17.728 0.00 0.00 WT1 H
+ATOM 2097 H2 TIP3X 771 -29.419 22.171 17.486 0.00 0.00 WT1 H
+ATOM 2098 OH2 TIP3X 772 -11.006 6.433 29.571 0.00 0.00 WT1 O
+ATOM 2099 H1 TIP3X 772 -11.521 6.258 30.427 0.00 0.00 WT1 H
+ATOM 2100 H2 TIP3X 772 -10.724 7.386 29.762 0.00 0.00 WT1 H
+ATOM 2101 OH2 TIP3X 773 -29.295 19.529 28.017 0.00 0.00 WT1 O
+ATOM 2102 H1 TIP3X 773 -29.484 20.417 28.193 0.00 0.00 WT1 H
+ATOM 2103 H2 TIP3X 773 -30.061 19.023 28.418 0.00 0.00 WT1 H
+ATOM 2104 OH2 TIP3X 774 -22.115 22.844 27.602 0.00 0.00 WT1 O
+ATOM 2105 H1 TIP3X 774 -22.634 23.315 26.877 0.00 0.00 WT1 H
+ATOM 2106 H2 TIP3X 774 -22.636 21.978 27.651 0.00 0.00 WT1 H
+ATOM 2107 OH2 TIP3X 775 -22.585 17.811 26.768 0.00 0.00 WT1 O
+ATOM 2108 H1 TIP3X 775 -22.292 17.613 27.644 0.00 0.00 WT1 H
+ATOM 2109 H2 TIP3X 775 -21.794 17.597 26.217 0.00 0.00 WT1 H
+ATOM 2110 OH2 TIP3X 778 -30.235 7.532 -24.241 0.00 0.00 WT1 O
+ATOM 2111 H1 TIP3X 778 -31.239 7.599 -24.280 0.00 0.00 WT1 H
+ATOM 2112 H2 TIP3X 778 -30.064 6.964 -23.458 0.00 0.00 WT1 H
+ATOM 2113 OH2 TIP3X 780 30.084 12.812 -15.937 0.00 0.00 WT1 O
+ATOM 2114 H1 TIP3X 780 30.925 12.460 -16.189 0.00 0.00 WT1 H
+ATOM 2115 H2 TIP3X 780 29.667 13.132 -16.792 0.00 0.00 WT1 H
+ATOM 2116 OH2 TIP3X 781 -26.028 27.189 -26.873 0.00 0.00 WT1 O
+ATOM 2117 H1 TIP3X 781 -25.105 27.422 -26.769 0.00 0.00 WT1 H
+ATOM 2118 H2 TIP3X 781 -26.032 26.893 -27.750 0.00 0.00 WT1 H
+ATOM 2119 OH2 TIP3X 782 -25.907 29.265 -11.227 0.00 0.00 WT1 O
+ATOM 2120 H1 TIP3X 782 -26.859 29.482 -11.114 0.00 0.00 WT1 H
+ATOM 2121 H2 TIP3X 782 -25.740 29.799 -12.025 0.00 0.00 WT1 H
+ATOM 2122 OH2 TIP3X 783 -24.907 21.668 -11.702 0.00 0.00 WT1 O
+ATOM 2123 H1 TIP3X 783 -24.371 22.385 -11.305 0.00 0.00 WT1 H
+ATOM 2124 H2 TIP3X 783 -25.854 22.043 -11.666 0.00 0.00 WT1 H
+ATOM 2125 OH2 TIP3X 785 -25.657 11.952 -12.145 0.00 0.00 WT1 O
+ATOM 2126 H1 TIP3X 785 -26.235 11.916 -11.407 0.00 0.00 WT1 H
+ATOM 2127 H2 TIP3X 785 -24.844 12.344 -11.777 0.00 0.00 WT1 H
+ATOM 2128 OH2 TIP3X 786 -19.899 26.788 -8.265 0.00 0.00 WT1 O
+ATOM 2129 H1 TIP3X 786 -20.117 26.382 -7.394 0.00 0.00 WT1 H
+ATOM 2130 H2 TIP3X 786 -19.517 27.632 -7.967 0.00 0.00 WT1 H
+ATOM 2131 OH2 TIP3X 787 -11.241 5.628 -6.044 0.00 0.00 WT1 O
+ATOM 2132 H1 TIP3X 787 -11.896 5.147 -6.657 0.00 0.00 WT1 H
+ATOM 2133 H2 TIP3X 787 -10.722 6.219 -6.591 0.00 0.00 WT1 H
+ATOM 2134 OH2 TIP3X 788 -10.433 17.625 -1.859 0.00 0.00 WT1 O
+ATOM 2135 H1 TIP3X 788 -11.056 17.008 -1.436 0.00 0.00 WT1 H
+ATOM 2136 H2 TIP3X 788 -10.920 17.933 -2.647 0.00 0.00 WT1 H
+ATOM 2137 OH2 TIP3X 790 25.767 25.205 1.233 0.00 0.00 WT1 O
+ATOM 2138 H1 TIP3X 790 26.110 24.706 1.987 0.00 0.00 WT1 H
+ATOM 2139 H2 TIP3X 790 25.925 24.618 0.421 0.00 0.00 WT1 H
+ATOM 2140 OH2 TIP3X 791 19.785 21.070 12.764 0.00 0.00 WT1 O
+ATOM 2141 H1 TIP3X 791 19.503 21.526 11.897 0.00 0.00 WT1 H
+ATOM 2142 H2 TIP3X 791 19.273 20.183 12.664 0.00 0.00 WT1 H
+ATOM 2143 OH2 TIP3X 792 -28.513 19.746 9.053 0.00 0.00 WT1 O
+ATOM 2144 H1 TIP3X 792 -28.557 20.622 9.446 0.00 0.00 WT1 H
+ATOM 2145 H2 TIP3X 792 -27.756 19.311 9.490 0.00 0.00 WT1 H
+ATOM 2146 OH2 TIP3X 793 -25.908 11.809 15.292 0.00 0.00 WT1 O
+ATOM 2147 H1 TIP3X 793 -26.125 11.071 15.858 0.00 0.00 WT1 H
+ATOM 2148 H2 TIP3X 793 -25.042 11.510 14.907 0.00 0.00 WT1 H
+ATOM 2149 OH2 TIP3X 794 23.629 12.550 8.177 0.00 0.00 WT1 O
+ATOM 2150 H1 TIP3X 794 23.147 13.337 8.466 0.00 0.00 WT1 H
+ATOM 2151 H2 TIP3X 794 24.461 12.864 7.956 0.00 0.00 WT1 H
+ATOM 2152 OH2 TIP3X 795 -25.124 17.515 21.933 0.00 0.00 WT1 O
+ATOM 2153 H1 TIP3X 795 -24.965 16.605 21.602 0.00 0.00 WT1 H
+ATOM 2154 H2 TIP3X 795 -26.078 17.641 21.718 0.00 0.00 WT1 H
+ATOM 2155 OH2 TIP3X 796 -21.834 9.124 10.432 0.00 0.00 WT1 O
+ATOM 2156 H1 TIP3X 796 -21.764 8.247 10.012 0.00 0.00 WT1 H
+ATOM 2157 H2 TIP3X 796 -21.106 9.615 10.053 0.00 0.00 WT1 H
+ATOM 2158 OH2 TIP3X 797 -22.186 11.009 20.622 0.00 0.00 WT1 O
+ATOM 2159 H1 TIP3X 797 -22.759 10.609 19.943 0.00 0.00 WT1 H
+ATOM 2160 H2 TIP3X 797 -22.018 10.222 21.189 0.00 0.00 WT1 H
+ATOM 2161 OH2 TIP3X 798 -26.486 10.767 24.137 0.00 0.00 WT1 O
+ATOM 2162 H1 TIP3X 798 -27.196 10.727 23.456 0.00 0.00 WT1 H
+ATOM 2163 H2 TIP3X 798 -25.703 10.902 23.669 0.00 0.00 WT1 H
+ATOM 2164 OH2 TIP3X 799 16.964 15.723 26.236 0.00 0.00 WT1 O
+ATOM 2165 H1 TIP3X 799 17.503 16.267 26.718 0.00 0.00 WT1 H
+ATOM 2166 H2 TIP3X 799 16.296 16.289 25.778 0.00 0.00 WT1 H
+ATOM 2167 OH2 TIP3X 800 -22.675 26.196 20.875 0.00 0.00 WT1 O
+ATOM 2168 H1 TIP3X 800 -22.616 27.169 20.638 0.00 0.00 WT1 H
+ATOM 2169 H2 TIP3X 800 -23.065 25.855 20.030 0.00 0.00 WT1 H
+ATOM 2170 OH2 TIP3X 801 -25.592 24.906 -29.581 0.00 0.00 WT1 O
+ATOM 2171 H1 TIP3X 801 -24.886 25.436 -30.028 0.00 0.00 WT1 H
+ATOM 2172 H2 TIP3X 801 -25.135 24.293 -28.939 0.00 0.00 WT1 H
+ATOM 2173 OH2 TIP3X 803 -20.968 23.156 -17.203 0.00 0.00 WT1 O
+ATOM 2174 H1 TIP3X 803 -21.948 22.931 -17.116 0.00 0.00 WT1 H
+ATOM 2175 H2 TIP3X 803 -20.812 23.898 -16.524 0.00 0.00 WT1 H
+ATOM 2176 OH2 TIP3X 804 -20.278 26.412 -20.707 0.00 0.00 WT1 O
+ATOM 2177 H1 TIP3X 804 -20.172 27.404 -20.698 0.00 0.00 WT1 H
+ATOM 2178 H2 TIP3X 804 -20.150 26.219 -21.641 0.00 0.00 WT1 H
+ATOM 2179 OH2 TIP3X 805 27.306 -30.626 -17.538 0.00 0.00 WT1 O
+ATOM 2180 H1 TIP3X 805 27.201 -31.161 -18.331 0.00 0.00 WT1 H
+ATOM 2181 H2 TIP3X 805 27.233 -31.246 -16.777 0.00 0.00 WT1 H
+ATOM 2182 OH2 TIP3X 806 -24.518 12.017 -5.280 0.00 0.00 WT1 O
+ATOM 2183 H1 TIP3X 806 -24.948 11.187 -5.209 0.00 0.00 WT1 H
+ATOM 2184 H2 TIP3X 806 -24.310 11.992 -6.218 0.00 0.00 WT1 H
+ATOM 2185 OH2 TIP3X 807 -27.573 24.130 -23.771 0.00 0.00 WT1 O
+ATOM 2186 H1 TIP3X 807 -26.887 23.444 -23.440 0.00 0.00 WT1 H
+ATOM 2187 H2 TIP3X 807 -27.013 24.883 -23.816 0.00 0.00 WT1 H
+ATOM 2188 OH2 TIP3X 808 -27.559 28.286 -0.177 0.00 0.00 WT1 O
+ATOM 2189 H1 TIP3X 808 -27.089 27.864 0.575 0.00 0.00 WT1 H
+ATOM 2190 H2 TIP3X 808 -27.370 29.257 -0.084 0.00 0.00 WT1 H
+ATOM 2191 OH2 TIP3X 809 -23.928 13.650 -11.019 0.00 0.00 WT1 O
+ATOM 2192 H1 TIP3X 809 -23.524 14.133 -10.302 0.00 0.00 WT1 H
+ATOM 2193 H2 TIP3X 809 -23.112 13.406 -11.462 0.00 0.00 WT1 H
+ATOM 2194 OH2 TIP3X 810 -21.617 25.309 0.774 0.00 0.00 WT1 O
+ATOM 2195 H1 TIP3X 810 -21.841 24.671 1.466 0.00 0.00 WT1 H
+ATOM 2196 H2 TIP3X 810 -20.815 24.971 0.459 0.00 0.00 WT1 H
+ATOM 2197 OH2 TIP3X 811 -12.988 17.938 6.775 0.00 0.00 WT1 O
+ATOM 2198 H1 TIP3X 811 -12.459 17.242 6.296 0.00 0.00 WT1 H
+ATOM 2199 H2 TIP3X 811 -12.828 17.660 7.739 0.00 0.00 WT1 H
+ATOM 2200 OH2 TIP3X 812 -30.726 24.537 16.812 0.00 0.00 WT1 O
+ATOM 2201 H1 TIP3X 812 -30.874 25.504 16.587 0.00 0.00 WT1 H
+ATOM 2202 H2 TIP3X 812 -30.335 24.644 17.703 0.00 0.00 WT1 H
+ATOM 2203 OH2 TIP3X 813 -13.416 11.864 3.906 0.00 0.00 WT1 O
+ATOM 2204 H1 TIP3X 813 -13.287 12.213 3.031 0.00 0.00 WT1 H
+ATOM 2205 H2 TIP3X 813 -13.232 10.949 3.831 0.00 0.00 WT1 H
+ATOM 2206 OH2 TIP3X 814 -27.836 28.243 17.509 0.00 0.00 WT1 O
+ATOM 2207 H1 TIP3X 814 -28.172 29.144 17.374 0.00 0.00 WT1 H
+ATOM 2208 H2 TIP3X 814 -27.965 28.024 18.432 0.00 0.00 WT1 H
+ATOM 2209 OH2 TIP3X 816 21.522 23.706 27.822 0.00 0.00 WT1 O
+ATOM 2210 H1 TIP3X 816 20.623 23.855 27.445 0.00 0.00 WT1 H
+ATOM 2211 H2 TIP3X 816 21.940 23.191 27.126 0.00 0.00 WT1 H
+ATOM 2212 OH2 TIP3X 817 -4.114 13.757 -28.302 0.00 0.00 WT1 O
+ATOM 2213 H1 TIP3X 817 -4.542 13.755 -27.429 0.00 0.00 WT1 H
+ATOM 2214 H2 TIP3X 817 -3.261 14.156 -28.125 0.00 0.00 WT1 H
+ATOM 2215 OH2 TIP3X 818 -26.198 21.922 30.133 0.00 0.00 WT1 O
+ATOM 2216 H1 TIP3X 818 -26.701 21.076 30.118 0.00 0.00 WT1 H
+ATOM 2217 H2 TIP3X 818 -25.549 21.769 30.858 0.00 0.00 WT1 H
+ATOM 2218 OH2 TIP3X 819 -14.911 16.079 16.100 0.00 0.00 WT1 O
+ATOM 2219 H1 TIP3X 819 -15.494 16.252 16.895 0.00 0.00 WT1 H
+ATOM 2220 H2 TIP3X 819 -14.138 15.764 16.521 0.00 0.00 WT1 H
+ATOM 2221 OH2 TIP3X 820 -30.999 24.292 25.756 0.00 0.00 WT1 O
+ATOM 2222 H1 TIP3X 820 -31.758 23.719 25.824 0.00 0.00 WT1 H
+ATOM 2223 H2 TIP3X 820 -31.194 24.954 26.492 0.00 0.00 WT1 H
+ATOM 2224 OH2 TIP3X 821 -26.217 -29.567 30.395 0.00 0.00 WT1 O
+ATOM 2225 H1 TIP3X 821 -26.609 -29.312 31.192 0.00 0.00 WT1 H
+ATOM 2226 H2 TIP3X 821 -26.333 -28.774 29.749 0.00 0.00 WT1 H
+ATOM 2227 OH2 TIP3X 822 -31.253 -27.531 -21.421 0.00 0.00 WT1 O
+ATOM 2228 H1 TIP3X 822 -31.574 -28.432 -21.661 0.00 0.00 WT1 H
+ATOM 2229 H2 TIP3X 822 -30.495 -27.415 -22.010 0.00 0.00 WT1 H
+ATOM 2230 OH2 TIP3X 825 30.530 -29.898 -8.636 0.00 0.00 WT1 O
+ATOM 2231 H1 TIP3X 825 30.559 -29.073 -9.198 0.00 0.00 WT1 H
+ATOM 2232 H2 TIP3X 825 30.927 -29.618 -7.824 0.00 0.00 WT1 H
+ATOM 2233 OH2 TIP3X 826 29.864 20.877 -12.386 0.00 0.00 WT1 O
+ATOM 2234 H1 TIP3X 826 29.270 20.939 -13.133 0.00 0.00 WT1 H
+ATOM 2235 H2 TIP3X 826 29.269 21.004 -11.638 0.00 0.00 WT1 H
+ATOM 2236 OH2 TIP3X 827 -27.822 25.618 -8.050 0.00 0.00 WT1 O
+ATOM 2237 H1 TIP3X 827 -27.504 25.810 -7.181 0.00 0.00 WT1 H
+ATOM 2238 H2 TIP3X 827 -27.824 26.492 -8.490 0.00 0.00 WT1 H
+ATOM 2239 OH2 TIP3X 828 -21.860 26.823 -10.457 0.00 0.00 WT1 O
+ATOM 2240 H1 TIP3X 828 -21.298 26.866 -9.629 0.00 0.00 WT1 H
+ATOM 2241 H2 TIP3X 828 -22.723 27.003 -10.115 0.00 0.00 WT1 H
+ATOM 2242 OH2 TIP3X 829 -27.983 28.351 -3.300 0.00 0.00 WT1 O
+ATOM 2243 H1 TIP3X 829 -28.330 28.342 -2.435 0.00 0.00 WT1 H
+ATOM 2244 H2 TIP3X 829 -27.002 28.235 -3.324 0.00 0.00 WT1 H
+ATOM 2245 OH2 TIP3X 830 -21.173 25.522 -1.985 0.00 0.00 WT1 O
+ATOM 2246 H1 TIP3X 830 -22.006 25.419 -2.509 0.00 0.00 WT1 H
+ATOM 2247 H2 TIP3X 830 -21.509 25.533 -1.071 0.00 0.00 WT1 H
+ATOM 2248 OH2 TIP3X 831 -27.087 23.109 1.246 0.00 0.00 WT1 O
+ATOM 2249 H1 TIP3X 831 -26.366 23.484 0.764 0.00 0.00 WT1 H
+ATOM 2250 H2 TIP3X 831 -27.477 22.554 0.615 0.00 0.00 WT1 H
+ATOM 2251 OH2 TIP3X 833 -23.624 26.074 13.726 0.00 0.00 WT1 O
+ATOM 2252 H1 TIP3X 833 -24.174 26.220 14.509 0.00 0.00 WT1 H
+ATOM 2253 H2 TIP3X 833 -23.640 26.957 13.266 0.00 0.00 WT1 H
+ATOM 2254 OH2 TIP3X 834 -27.497 25.231 13.758 0.00 0.00 WT1 O
+ATOM 2255 H1 TIP3X 834 -27.782 25.979 14.199 0.00 0.00 WT1 H
+ATOM 2256 H2 TIP3X 834 -27.065 24.674 14.483 0.00 0.00 WT1 H
+ATOM 2257 OH2 TIP3X 835 -16.279 -29.016 13.034 0.00 0.00 WT1 O
+ATOM 2258 H1 TIP3X 835 -16.083 -28.715 13.986 0.00 0.00 WT1 H
+ATOM 2259 H2 TIP3X 835 -17.052 -28.530 12.776 0.00 0.00 WT1 H
+ATOM 2260 OH2 TIP3X 836 -27.863 -23.137 26.934 0.00 0.00 WT1 O
+ATOM 2261 H1 TIP3X 836 -28.204 -23.487 27.751 0.00 0.00 WT1 H
+ATOM 2262 H2 TIP3X 836 -27.902 -22.174 27.075 0.00 0.00 WT1 H
+ATOM 2263 OH2 TIP3X 837 29.266 29.525 17.096 0.00 0.00 WT1 O
+ATOM 2264 H1 TIP3X 837 29.192 29.133 17.978 0.00 0.00 WT1 H
+ATOM 2265 H2 TIP3X 837 29.146 28.802 16.501 0.00 0.00 WT1 H
+ATOM 2266 OH2 TIP3X 838 30.475 27.160 31.000 0.00 0.00 WT1 O
+ATOM 2267 H1 TIP3X 838 30.613 27.912 30.434 0.00 0.00 WT1 H
+ATOM 2268 H2 TIP3X 838 29.556 26.997 30.794 0.00 0.00 WT1 H
+ATOM 2269 OH2 TIP3X 839 -25.678 4.086 25.813 0.00 0.00 WT1 O
+ATOM 2270 H1 TIP3X 839 -25.780 3.110 25.701 0.00 0.00 WT1 H
+ATOM 2271 H2 TIP3X 839 -26.272 4.274 26.622 0.00 0.00 WT1 H
+ATOM 2272 OH2 TIP3X 840 -24.517 22.180 21.788 0.00 0.00 WT1 O
+ATOM 2273 H1 TIP3X 840 -24.633 21.786 20.930 0.00 0.00 WT1 H
+ATOM 2274 H2 TIP3X 840 -24.550 21.414 22.344 0.00 0.00 WT1 H
+ATOM 2275 OH2 TIP3X 841 25.028 28.433 30.422 0.00 0.00 WT1 O
+ATOM 2276 H1 TIP3X 841 25.690 29.134 30.303 0.00 0.00 WT1 H
+ATOM 2277 H2 TIP3X 841 24.419 28.604 29.679 0.00 0.00 WT1 H
+ATOM 2278 OH2 TIP3X 843 -27.964 26.690 -21.579 0.00 0.00 WT1 O
+ATOM 2279 H1 TIP3X 843 -27.908 27.449 -20.940 0.00 0.00 WT1 H
+ATOM 2280 H2 TIP3X 843 -27.804 27.203 -22.463 0.00 0.00 WT1 H
+ATOM 2281 OH2 TIP3X 846 -30.938 25.450 -26.360 0.00 0.00 WT1 O
+ATOM 2282 H1 TIP3X 846 -31.419 24.905 -26.994 0.00 0.00 WT1 H
+ATOM 2283 H2 TIP3X 846 -31.624 26.195 -26.197 0.00 0.00 WT1 H
+ATOM 2284 OH2 TIP3X 847 -21.781 24.887 -12.820 0.00 0.00 WT1 O
+ATOM 2285 H1 TIP3X 847 -22.699 24.672 -12.705 0.00 0.00 WT1 H
+ATOM 2286 H2 TIP3X 847 -21.621 25.573 -12.104 0.00 0.00 WT1 H
+ATOM 2287 OH2 TIP3X 848 26.638 -17.580 -12.454 0.00 0.00 WT1 O
+ATOM 2288 H1 TIP3X 848 27.358 -18.141 -12.057 0.00 0.00 WT1 H
+ATOM 2289 H2 TIP3X 848 26.608 -17.902 -13.415 0.00 0.00 WT1 H
+ATOM 2290 OH2 TIP3X 849 -26.644 -26.612 -15.954 0.00 0.00 WT1 O
+ATOM 2291 H1 TIP3X 849 -26.116 -25.936 -15.539 0.00 0.00 WT1 H
+ATOM 2292 H2 TIP3X 849 -26.408 -27.378 -15.463 0.00 0.00 WT1 H
+ATOM 2293 OH2 TIP3X 851 -16.035 30.289 -4.108 0.00 0.00 WT1 O
+ATOM 2294 H1 TIP3X 851 -16.262 30.384 -5.055 0.00 0.00 WT1 H
+ATOM 2295 H2 TIP3X 851 -15.105 30.121 -4.142 0.00 0.00 WT1 H
+ATOM 2296 OH2 TIP3X 852 -30.111 -26.415 -2.459 0.00 0.00 WT1 O
+ATOM 2297 H1 TIP3X 852 -30.062 -25.498 -2.737 0.00 0.00 WT1 H
+ATOM 2298 H2 TIP3X 852 -30.985 -26.688 -2.855 0.00 0.00 WT1 H
+ATOM 2299 OH2 TIP3X 854 -29.319 -29.452 9.152 0.00 0.00 WT1 O
+ATOM 2300 H1 TIP3X 854 -29.402 -30.410 8.994 0.00 0.00 WT1 H
+ATOM 2301 H2 TIP3X 854 -28.630 -29.343 9.870 0.00 0.00 WT1 H
+ATOM 2302 OH2 TIP3X 856 25.051 24.384 18.938 0.00 0.00 WT1 O
+ATOM 2303 H1 TIP3X 856 25.934 24.382 19.303 0.00 0.00 WT1 H
+ATOM 2304 H2 TIP3X 856 25.184 24.848 18.065 0.00 0.00 WT1 H
+ATOM 2305 OH2 TIP3X 857 -19.010 30.848 15.374 0.00 0.00 WT1 O
+ATOM 2306 H1 TIP3X 857 -18.254 30.878 15.910 0.00 0.00 WT1 H
+ATOM 2307 H2 TIP3X 857 -18.662 30.769 14.505 0.00 0.00 WT1 H
+ATOM 2308 OH2 TIP3X 858 27.792 -30.464 14.334 0.00 0.00 WT1 O
+ATOM 2309 H1 TIP3X 858 27.081 -30.165 13.699 0.00 0.00 WT1 H
+ATOM 2310 H2 TIP3X 858 27.866 -31.424 14.194 0.00 0.00 WT1 H
+ATOM 2311 OH2 TIP3X 859 -26.653 23.083 18.371 0.00 0.00 WT1 O
+ATOM 2312 H1 TIP3X 859 -26.886 23.470 19.169 0.00 0.00 WT1 H
+ATOM 2313 H2 TIP3X 859 -25.737 22.835 18.440 0.00 0.00 WT1 H
+ATOM 2314 OH2 TIP3X 860 -31.261 -23.731 25.063 0.00 0.00 WT1 O
+ATOM 2315 H1 TIP3X 860 -31.098 -23.015 24.410 0.00 0.00 WT1 H
+ATOM 2316 H2 TIP3X 860 -30.627 -24.395 24.851 0.00 0.00 WT1 H
+ATOM 2317 OH2 TIP3X 861 -19.159 18.944 18.319 0.00 0.00 WT1 O
+ATOM 2318 H1 TIP3X 861 -19.322 17.970 18.354 0.00 0.00 WT1 H
+ATOM 2319 H2 TIP3X 861 -18.948 19.019 17.368 0.00 0.00 WT1 H
+ATOM 2320 OH2 TIP3X 865 -16.672 21.229 -19.031 0.00 0.00 WT1 O
+ATOM 2321 H1 TIP3X 865 -16.582 22.087 -18.610 0.00 0.00 WT1 H
+ATOM 2322 H2 TIP3X 865 -16.165 21.375 -19.861 0.00 0.00 WT1 H
+ATOM 2323 OH2 TIP3X 866 22.171 -24.291 -11.283 0.00 0.00 WT1 O
+ATOM 2324 H1 TIP3X 866 22.770 -24.056 -12.065 0.00 0.00 WT1 H
+ATOM 2325 H2 TIP3X 866 22.460 -25.178 -11.110 0.00 0.00 WT1 H
+ATOM 2326 OH2 TIP3X 867 -21.296 -25.279 -16.117 0.00 0.00 WT1 O
+ATOM 2327 H1 TIP3X 867 -21.099 -25.088 -15.164 0.00 0.00 WT1 H
+ATOM 2328 H2 TIP3X 867 -21.873 -26.028 -16.002 0.00 0.00 WT1 H
+ATOM 2329 OH2 TIP3X 870 -17.179 25.583 1.067 0.00 0.00 WT1 O
+ATOM 2330 H1 TIP3X 870 -16.995 25.488 0.115 0.00 0.00 WT1 H
+ATOM 2331 H2 TIP3X 870 -17.999 24.997 1.157 0.00 0.00 WT1 H
+ATOM 2332 OH2 TIP3X 873 -18.752 26.602 4.318 0.00 0.00 WT1 O
+ATOM 2333 H1 TIP3X 873 -19.389 26.972 4.987 0.00 0.00 WT1 H
+ATOM 2334 H2 TIP3X 873 -17.885 27.127 4.422 0.00 0.00 WT1 H
+ATOM 2335 OH2 TIP3X 875 -24.772 30.981 -1.965 0.00 0.00 WT1 O
+ATOM 2336 H1 TIP3X 875 -25.630 30.722 -1.877 0.00 0.00 WT1 H
+ATOM 2337 H2 TIP3X 875 -24.925 31.848 -2.386 0.00 0.00 WT1 H
+ATOM 2338 OH2 TIP3X 876 -21.174 29.174 14.015 0.00 0.00 WT1 O
+ATOM 2339 H1 TIP3X 876 -20.728 29.867 14.580 0.00 0.00 WT1 H
+ATOM 2340 H2 TIP3X 876 -22.112 29.286 14.244 0.00 0.00 WT1 H
+ATOM 2341 OH2 TIP3X 878 -31.886 15.427 9.513 0.00 0.00 WT1 O
+ATOM 2342 H1 TIP3X 878 -31.654 16.391 9.676 0.00 0.00 WT1 H
+ATOM 2343 H2 TIP3X 878 -31.940 15.336 8.555 0.00 0.00 WT1 H
+ATOM 2344 OH2 TIP3X 880 -30.885 23.047 6.932 0.00 0.00 WT1 O
+ATOM 2345 H1 TIP3X 880 -31.795 23.011 6.761 0.00 0.00 WT1 H
+ATOM 2346 H2 TIP3X 880 -30.625 23.921 6.567 0.00 0.00 WT1 H
+ATOM 2347 OH2 TIP3X 881 23.604 -25.667 25.915 0.00 0.00 WT1 O
+ATOM 2348 H1 TIP3X 881 22.722 -25.625 26.301 0.00 0.00 WT1 H
+ATOM 2349 H2 TIP3X 881 24.123 -26.124 26.639 0.00 0.00 WT1 H
+ATOM 2350 OH2 TIP3X 883 -23.054 16.237 -30.792 0.00 0.00 WT1 O
+ATOM 2351 H1 TIP3X 883 -22.685 15.752 -30.037 0.00 0.00 WT1 H
+ATOM 2352 H2 TIP3X 883 -23.314 17.083 -30.370 0.00 0.00 WT1 H
+ATOM 2353 OH2 TIP3X 884 -28.996 24.407 29.233 0.00 0.00 WT1 O
+ATOM 2354 H1 TIP3X 884 -29.345 23.736 28.692 0.00 0.00 WT1 H
+ATOM 2355 H2 TIP3X 884 -28.638 23.897 29.952 0.00 0.00 WT1 H
+ATOM 2356 OH2 TIP3X 885 -24.975 22.979 -25.765 0.00 0.00 WT1 O
+ATOM 2357 H1 TIP3X 885 -25.859 23.491 -25.818 0.00 0.00 WT1 H
+ATOM 2358 H2 TIP3X 885 -25.135 22.443 -24.949 0.00 0.00 WT1 H
+ATOM 2359 OH2 TIP3X 886 -17.749 -16.398 26.715 0.00 0.00 WT1 O
+ATOM 2360 H1 TIP3X 886 -17.512 -15.733 25.953 0.00 0.00 WT1 H
+ATOM 2361 H2 TIP3X 886 -18.566 -15.971 27.028 0.00 0.00 WT1 H
+ATOM 2362 OH2 TIP3X 887 -5.103 -19.906 -31.321 0.00 0.00 WT1 O
+ATOM 2363 H1 TIP3X 887 -5.486 -20.720 -31.696 0.00 0.00 WT1 H
+ATOM 2364 H2 TIP3X 887 -4.125 -20.073 -31.447 0.00 0.00 WT1 H
+ATOM 2365 OH2 TIP3X 889 -29.811 -30.294 -7.122 0.00 0.00 WT1 O
+ATOM 2366 H1 TIP3X 889 -30.536 -30.909 -7.290 0.00 0.00 WT1 H
+ATOM 2367 H2 TIP3X 889 -29.875 -30.195 -6.100 0.00 0.00 WT1 H
+ATOM 2368 OH2 TIP3X 890 21.430 -17.667 4.527 0.00 0.00 WT1 O
+ATOM 2369 H1 TIP3X 890 21.231 -18.316 5.214 0.00 0.00 WT1 H
+ATOM 2370 H2 TIP3X 890 22.313 -17.931 4.250 0.00 0.00 WT1 H
+ATOM 2371 OH2 TIP3X 891 -20.237 -12.386 -22.042 0.00 0.00 WT1 O
+ATOM 2372 H1 TIP3X 891 -19.721 -11.595 -22.134 0.00 0.00 WT1 H
+ATOM 2373 H2 TIP3X 891 -19.565 -13.095 -22.099 0.00 0.00 WT1 H
+ATOM 2374 OH2 TIP3X 893 30.264 27.130 -1.747 0.00 0.00 WT1 O
+ATOM 2375 H1 TIP3X 893 30.134 26.594 -2.587 0.00 0.00 WT1 H
+ATOM 2376 H2 TIP3X 893 29.497 26.906 -1.232 0.00 0.00 WT1 H
+ATOM 2377 OH2 TIP3X 894 -24.136 -21.397 -3.050 0.00 0.00 WT1 O
+ATOM 2378 H1 TIP3X 894 -24.531 -20.725 -2.493 0.00 0.00 WT1 H
+ATOM 2379 H2 TIP3X 894 -24.846 -22.008 -3.217 0.00 0.00 WT1 H
+ATOM 2380 OH2 TIP3X 895 -27.353 -25.368 5.534 0.00 0.00 WT1 O
+ATOM 2381 H1 TIP3X 895 -28.158 -25.824 5.198 0.00 0.00 WT1 H
+ATOM 2382 H2 TIP3X 895 -27.370 -24.514 5.090 0.00 0.00 WT1 H
+ATOM 2383 OH2 TIP3X 896 -21.553 -25.556 22.869 0.00 0.00 WT1 O
+ATOM 2384 H1 TIP3X 896 -22.465 -25.587 22.718 0.00 0.00 WT1 H
+ATOM 2385 H2 TIP3X 896 -21.431 -25.950 23.666 0.00 0.00 WT1 H
+ATOM 2386 OH2 TIP3X 897 -21.107 -23.584 -1.685 0.00 0.00 WT1 O
+ATOM 2387 H1 TIP3X 897 -21.261 -24.213 -2.462 0.00 0.00 WT1 H
+ATOM 2388 H2 TIP3X 897 -21.639 -24.029 -1.026 0.00 0.00 WT1 H
+ATOM 2389 OH2 TIP3X 899 -24.915 -19.677 12.901 0.00 0.00 WT1 O
+ATOM 2390 H1 TIP3X 899 -24.972 -20.485 13.480 0.00 0.00 WT1 H
+ATOM 2391 H2 TIP3X 899 -24.003 -19.638 12.643 0.00 0.00 WT1 H
+ATOM 2392 OH2 TIP3X 900 -22.758 29.974 17.939 0.00 0.00 WT1 O
+ATOM 2393 H1 TIP3X 900 -21.825 30.246 17.878 0.00 0.00 WT1 H
+ATOM 2394 H2 TIP3X 900 -23.076 30.046 17.032 0.00 0.00 WT1 H
+ATOM 2395 OH2 TIP3X 901 -26.909 25.755 28.117 0.00 0.00 WT1 O
+ATOM 2396 H1 TIP3X 901 -26.909 26.563 28.648 0.00 0.00 WT1 H
+ATOM 2397 H2 TIP3X 901 -27.439 25.159 28.677 0.00 0.00 WT1 H
+ATOM 2398 OH2 TIP3X 902 -21.681 25.331 4.961 0.00 0.00 WT1 O
+ATOM 2399 H1 TIP3X 902 -20.983 24.863 5.526 0.00 0.00 WT1 H
+ATOM 2400 H2 TIP3X 902 -22.047 24.697 4.330 0.00 0.00 WT1 H
+ATOM 2401 OH2 TIP3X 903 -20.746 -26.709 25.124 0.00 0.00 WT1 O
+ATOM 2402 H1 TIP3X 903 -21.089 -26.846 25.985 0.00 0.00 WT1 H
+ATOM 2403 H2 TIP3X 903 -19.822 -26.530 25.240 0.00 0.00 WT1 H
+ATOM 2404 OH2 TIP3X 905 -11.928 29.669 -27.561 0.00 0.00 WT1 O
+ATOM 2405 H1 TIP3X 905 -11.014 29.505 -27.602 0.00 0.00 WT1 H
+ATOM 2406 H2 TIP3X 905 -12.224 29.311 -28.366 0.00 0.00 WT1 H
+ATOM 2407 OH2 TIP3X 906 -24.973 -29.776 -18.589 0.00 0.00 WT1 O
+ATOM 2408 H1 TIP3X 906 -25.815 -29.199 -18.465 0.00 0.00 WT1 H
+ATOM 2409 H2 TIP3X 906 -25.308 -30.597 -18.258 0.00 0.00 WT1 H
+ATOM 2410 OH2 TIP3X 907 -14.188 -26.229 -26.124 0.00 0.00 WT1 O
+ATOM 2411 H1 TIP3X 907 -14.780 -25.684 -26.620 0.00 0.00 WT1 H
+ATOM 2412 H2 TIP3X 907 -14.449 -27.131 -26.331 0.00 0.00 WT1 H
+ATOM 2413 OH2 TIP3X 908 -27.972 -24.301 -19.224 0.00 0.00 WT1 O
+ATOM 2414 H1 TIP3X 908 -27.423 -24.807 -19.862 0.00 0.00 WT1 H
+ATOM 2415 H2 TIP3X 908 -28.829 -24.680 -19.456 0.00 0.00 WT1 H
+ATOM 2416 OH2 TIP3X 910 -26.522 25.586 -11.640 0.00 0.00 WT1 O
+ATOM 2417 H1 TIP3X 910 -27.040 24.714 -11.562 0.00 0.00 WT1 H
+ATOM 2418 H2 TIP3X 910 -27.247 26.127 -12.093 0.00 0.00 WT1 H
+ATOM 2419 OH2 TIP3X 911 -20.951 -22.120 -5.118 0.00 0.00 WT1 O
+ATOM 2420 H1 TIP3X 911 -20.605 -22.519 -4.345 0.00 0.00 WT1 H
+ATOM 2421 H2 TIP3X 911 -20.095 -21.905 -5.617 0.00 0.00 WT1 H
+ATOM 2422 OH2 TIP3X 912 -9.867 -29.114 -12.157 0.00 0.00 WT1 O
+ATOM 2423 H1 TIP3X 912 -9.071 -29.404 -11.738 0.00 0.00 WT1 H
+ATOM 2424 H2 TIP3X 912 -10.514 -29.172 -11.439 0.00 0.00 WT1 H
+ATOM 2425 OH2 TIP3X 913 -20.659 28.732 -12.133 0.00 0.00 WT1 O
+ATOM 2426 H1 TIP3X 913 -21.321 29.289 -12.542 0.00 0.00 WT1 H
+ATOM 2427 H2 TIP3X 913 -21.124 28.115 -11.569 0.00 0.00 WT1 H
+ATOM 2428 OH2 TIP3X 915 -15.368 20.340 -9.844 0.00 0.00 WT1 O
+ATOM 2429 H1 TIP3X 915 -14.442 20.505 -10.123 0.00 0.00 WT1 H
+ATOM 2430 H2 TIP3X 915 -15.558 21.103 -9.317 0.00 0.00 WT1 H
+ATOM 2431 OH2 TIP3X 916 -11.025 -24.700 -1.424 0.00 0.00 WT1 O
+ATOM 2432 H1 TIP3X 916 -10.219 -25.270 -1.581 0.00 0.00 WT1 H
+ATOM 2433 H2 TIP3X 916 -10.711 -24.181 -0.695 0.00 0.00 WT1 H
+ATOM 2434 OH2 TIP3X 917 -19.479 -18.984 14.724 0.00 0.00 WT1 O
+ATOM 2435 H1 TIP3X 917 -19.189 -18.359 15.535 0.00 0.00 WT1 H
+ATOM 2436 H2 TIP3X 917 -18.735 -19.616 14.647 0.00 0.00 WT1 H
+ATOM 2437 OH2 TIP3X 918 30.966 -29.366 8.351 0.00 0.00 WT1 O
+ATOM 2438 H1 TIP3X 918 31.375 -29.280 9.245 0.00 0.00 WT1 H
+ATOM 2439 H2 TIP3X 918 30.179 -29.904 8.542 0.00 0.00 WT1 H
+ATOM 2440 OH2 TIP3X 919 -28.921 -26.281 20.435 0.00 0.00 WT1 O
+ATOM 2441 H1 TIP3X 919 -29.900 -26.222 20.386 0.00 0.00 WT1 H
+ATOM 2442 H2 TIP3X 919 -28.721 -25.466 20.962 0.00 0.00 WT1 H
+ATOM 2443 OH2 TIP3X 920 -13.132 23.992 18.033 0.00 0.00 WT1 O
+ATOM 2444 H1 TIP3X 920 -12.378 24.541 18.223 0.00 0.00 WT1 H
+ATOM 2445 H2 TIP3X 920 -13.728 24.232 18.757 0.00 0.00 WT1 H
+ATOM 2446 OH2 TIP3X 921 -19.526 -18.471 27.691 0.00 0.00 WT1 O
+ATOM 2447 H1 TIP3X 921 -19.106 -19.248 27.215 0.00 0.00 WT1 H
+ATOM 2448 H2 TIP3X 921 -19.235 -17.725 27.223 0.00 0.00 WT1 H
+ATOM 2449 OH2 TIP3X 922 -26.598 19.208 27.904 0.00 0.00 WT1 O
+ATOM 2450 H1 TIP3X 922 -27.603 19.242 27.757 0.00 0.00 WT1 H
+ATOM 2451 H2 TIP3X 922 -26.282 20.038 27.612 0.00 0.00 WT1 H
+ATOM 2452 OH2 TIP3X 924 -19.507 -22.549 -29.785 0.00 0.00 WT1 O
+ATOM 2453 H1 TIP3X 924 -19.092 -22.160 -29.013 0.00 0.00 WT1 H
+ATOM 2454 H2 TIP3X 924 -19.018 -23.359 -29.961 0.00 0.00 WT1 H
+ATOM 2455 OH2 TIP3X 926 -25.367 30.537 -29.801 0.00 0.00 WT1 O
+ATOM 2456 H1 TIP3X 926 -25.737 29.651 -29.841 0.00 0.00 WT1 H
+ATOM 2457 H2 TIP3X 926 -24.649 30.403 -29.153 0.00 0.00 WT1 H
+ATOM 2458 OH2 TIP3X 927 -20.823 -22.390 -24.072 0.00 0.00 WT1 O
+ATOM 2459 H1 TIP3X 927 -21.557 -21.828 -23.947 0.00 0.00 WT1 H
+ATOM 2460 H2 TIP3X 927 -21.134 -23.212 -23.702 0.00 0.00 WT1 H
+ATOM 2461 OH2 TIP3X 928 -30.162 -28.794 -16.602 0.00 0.00 WT1 O
+ATOM 2462 H1 TIP3X 928 -29.799 -27.919 -16.455 0.00 0.00 WT1 H
+ATOM 2463 H2 TIP3X 928 -29.883 -29.001 -17.578 0.00 0.00 WT1 H
+ATOM 2464 OH2 TIP3X 929 -15.867 -19.407 -15.092 0.00 0.00 WT1 O
+ATOM 2465 H1 TIP3X 929 -16.648 -19.231 -15.609 0.00 0.00 WT1 H
+ATOM 2466 H2 TIP3X 929 -16.113 -20.124 -14.489 0.00 0.00 WT1 H
+ATOM 2467 OH2 TIP3X 930 -30.101 -20.376 -14.107 0.00 0.00 WT1 O
+ATOM 2468 H1 TIP3X 930 -30.861 -20.322 -14.695 0.00 0.00 WT1 H
+ATOM 2469 H2 TIP3X 930 -29.742 -19.465 -14.145 0.00 0.00 WT1 H
+ATOM 2470 OH2 TIP3X 931 -16.191 30.818 -7.011 0.00 0.00 WT1 O
+ATOM 2471 H1 TIP3X 931 -16.987 31.250 -7.243 0.00 0.00 WT1 H
+ATOM 2472 H2 TIP3X 931 -15.683 31.107 -7.733 0.00 0.00 WT1 H
+ATOM 2473 OH2 TIP3X 932 -22.780 -18.096 -14.660 0.00 0.00 WT1 O
+ATOM 2474 H1 TIP3X 932 -21.938 -17.802 -14.262 0.00 0.00 WT1 H
+ATOM 2475 H2 TIP3X 932 -22.606 -19.001 -14.898 0.00 0.00 WT1 H
+ATOM 2476 OH2 TIP3X 933 -28.542 -22.132 -9.581 0.00 0.00 WT1 O
+ATOM 2477 H1 TIP3X 933 -27.602 -21.984 -9.346 0.00 0.00 WT1 H
+ATOM 2478 H2 TIP3X 933 -28.552 -21.811 -10.505 0.00 0.00 WT1 H
+ATOM 2479 OH2 TIP3X 935 -26.596 30.755 -8.117 0.00 0.00 WT1 O
+ATOM 2480 H1 TIP3X 935 -27.526 30.975 -8.042 0.00 0.00 WT1 H
+ATOM 2481 H2 TIP3X 935 -26.434 30.389 -9.016 0.00 0.00 WT1 H
+ATOM 2482 OH2 TIP3X 936 -29.076 -27.857 -5.041 0.00 0.00 WT1 O
+ATOM 2483 H1 TIP3X 936 -28.442 -27.454 -5.624 0.00 0.00 WT1 H
+ATOM 2484 H2 TIP3X 936 -29.335 -27.170 -4.408 0.00 0.00 WT1 H
+ATOM 2485 OH2 TIP3X 937 -26.047 -18.886 18.609 0.00 0.00 WT1 O
+ATOM 2486 H1 TIP3X 937 -25.707 -18.806 17.670 0.00 0.00 WT1 H
+ATOM 2487 H2 TIP3X 937 -25.195 -18.757 19.096 0.00 0.00 WT1 H
+ATOM 2488 OH2 TIP3X 940 -31.250 -29.062 1.461 0.00 0.00 WT1 O
+ATOM 2489 H1 TIP3X 940 -31.256 -29.491 2.315 0.00 0.00 WT1 H
+ATOM 2490 H2 TIP3X 940 -31.609 -28.191 1.743 0.00 0.00 WT1 H
+ATOM 2491 OH2 TIP3X 941 -21.333 -19.566 3.503 0.00 0.00 WT1 O
+ATOM 2492 H1 TIP3X 941 -22.126 -19.052 3.227 0.00 0.00 WT1 H
+ATOM 2493 H2 TIP3X 941 -21.061 -19.055 4.214 0.00 0.00 WT1 H
+ATOM 2494 OH2 TIP3X 942 -13.559 -15.866 -28.160 0.00 0.00 WT1 O
+ATOM 2495 H1 TIP3X 942 -13.390 -15.512 -29.032 0.00 0.00 WT1 H
+ATOM 2496 H2 TIP3X 942 -12.887 -16.593 -28.039 0.00 0.00 WT1 H
+ATOM 2497 OH2 TIP3X 943 -19.869 26.097 24.679 0.00 0.00 WT1 O
+ATOM 2498 H1 TIP3X 943 -18.976 26.388 24.944 0.00 0.00 WT1 H
+ATOM 2499 H2 TIP3X 943 -20.246 25.796 25.500 0.00 0.00 WT1 H
+ATOM 2500 OH2 TIP3X 946 -20.241 -27.833 29.378 0.00 0.00 WT1 O
+ATOM 2501 H1 TIP3X 946 -19.814 -28.406 28.672 0.00 0.00 WT1 H
+ATOM 2502 H2 TIP3X 946 -21.032 -28.267 29.598 0.00 0.00 WT1 H
+ATOM 2503 OH2 TIP3X 947 -16.570 -28.726 -24.593 0.00 0.00 WT1 O
+ATOM 2504 H1 TIP3X 947 -16.542 -29.259 -23.843 0.00 0.00 WT1 H
+ATOM 2505 H2 TIP3X 947 -16.067 -29.260 -25.230 0.00 0.00 WT1 H
+ATOM 2506 OH2 TIP3X 948 -18.866 -27.465 -25.441 0.00 0.00 WT1 O
+ATOM 2507 H1 TIP3X 948 -19.566 -28.068 -25.062 0.00 0.00 WT1 H
+ATOM 2508 H2 TIP3X 948 -18.041 -27.838 -25.035 0.00 0.00 WT1 H
+ATOM 2509 OH2 TIP3X 949 -26.292 -27.574 -7.582 0.00 0.00 WT1 O
+ATOM 2510 H1 TIP3X 949 -25.998 -27.297 -6.700 0.00 0.00 WT1 H
+ATOM 2511 H2 TIP3X 949 -26.843 -26.832 -7.856 0.00 0.00 WT1 H
+ATOM 2512 OH2 TIP3X 950 -15.679 -12.505 -16.130 0.00 0.00 WT1 O
+ATOM 2513 H1 TIP3X 950 -15.040 -12.841 -16.808 0.00 0.00 WT1 H
+ATOM 2514 H2 TIP3X 950 -15.146 -11.868 -15.612 0.00 0.00 WT1 H
+ATOM 2515 OH2 TIP3X 951 -21.705 -17.934 -17.680 0.00 0.00 WT1 O
+ATOM 2516 H1 TIP3X 951 -21.408 -17.933 -16.774 0.00 0.00 WT1 H
+ATOM 2517 H2 TIP3X 951 -22.678 -17.774 -17.650 0.00 0.00 WT1 H
+ATOM 2518 OH2 TIP3X 952 -15.992 -14.203 -20.590 0.00 0.00 WT1 O
+ATOM 2519 H1 TIP3X 952 -15.305 -14.298 -21.316 0.00 0.00 WT1 H
+ATOM 2520 H2 TIP3X 952 -16.814 -14.479 -21.058 0.00 0.00 WT1 H
+ATOM 2521 OH2 TIP3X 953 -16.602 -30.448 -13.754 0.00 0.00 WT1 O
+ATOM 2522 H1 TIP3X 953 -15.984 -30.049 -14.434 0.00 0.00 WT1 H
+ATOM 2523 H2 TIP3X 953 -17.426 -29.989 -13.891 0.00 0.00 WT1 H
+ATOM 2524 OH2 TIP3X 954 -28.945 -19.898 10.696 0.00 0.00 WT1 O
+ATOM 2525 H1 TIP3X 954 -29.366 -19.806 11.551 0.00 0.00 WT1 H
+ATOM 2526 H2 TIP3X 954 -29.356 -19.223 10.190 0.00 0.00 WT1 H
+ATOM 2527 OH2 TIP3X 955 -24.942 30.508 2.173 0.00 0.00 WT1 O
+ATOM 2528 H1 TIP3X 955 -24.155 30.252 2.616 0.00 0.00 WT1 H
+ATOM 2529 H2 TIP3X 955 -24.667 31.360 1.758 0.00 0.00 WT1 H
+ATOM 2530 OH2 TIP3X 957 -23.019 -18.815 19.609 0.00 0.00 WT1 O
+ATOM 2531 H1 TIP3X 957 -22.854 -17.904 19.841 0.00 0.00 WT1 H
+ATOM 2532 H2 TIP3X 957 -22.162 -19.126 19.272 0.00 0.00 WT1 H
+ATOM 2533 OH2 TIP3X 958 -28.892 -29.797 13.686 0.00 0.00 WT1 O
+ATOM 2534 H1 TIP3X 958 -28.948 -28.829 13.503 0.00 0.00 WT1 H
+ATOM 2535 H2 TIP3X 958 -28.854 -29.885 14.673 0.00 0.00 WT1 H
+ATOM 2536 OH2 TIP3X 959 -26.163 -23.044 20.857 0.00 0.00 WT1 O
+ATOM 2537 H1 TIP3X 959 -26.674 -23.000 20.087 0.00 0.00 WT1 H
+ATOM 2538 H2 TIP3X 959 -25.578 -22.319 20.674 0.00 0.00 WT1 H
+ATOM 2539 OH2 TIP3X 960 -29.858 -16.621 23.417 0.00 0.00 WT1 O
+ATOM 2540 H1 TIP3X 960 -29.371 -15.945 23.815 0.00 0.00 WT1 H
+ATOM 2541 H2 TIP3X 960 -30.785 -16.527 23.675 0.00 0.00 WT1 H
+ATOM 2542 OH2 TIP3X 961 -24.697 -16.638 13.030 0.00 0.00 WT1 O
+ATOM 2543 H1 TIP3X 961 -25.376 -16.188 13.629 0.00 0.00 WT1 H
+ATOM 2544 H2 TIP3X 961 -25.140 -17.405 12.678 0.00 0.00 WT1 H
+ATOM 2545 OH2 TIP3X 962 -20.231 -16.498 13.598 0.00 0.00 WT1 O
+ATOM 2546 H1 TIP3X 962 -19.838 -17.380 13.780 0.00 0.00 WT1 H
+ATOM 2547 H2 TIP3X 962 -20.081 -16.007 14.379 0.00 0.00 WT1 H
+ATOM 2548 OH2 TIP3X 963 -16.945 -27.216 21.071 0.00 0.00 WT1 O
+ATOM 2549 H1 TIP3X 963 -16.818 -27.756 21.887 0.00 0.00 WT1 H
+ATOM 2550 H2 TIP3X 963 -16.093 -26.687 21.052 0.00 0.00 WT1 H
+ATOM 2551 OH2 TIP3X 964 -24.170 -12.249 -30.005 0.00 0.00 WT1 O
+ATOM 2552 H1 TIP3X 964 -24.743 -12.130 -30.753 0.00 0.00 WT1 H
+ATOM 2553 H2 TIP3X 964 -23.671 -13.077 -30.115 0.00 0.00 WT1 H
+ATOM 2554 OH2 TIP3X 965 -22.967 -16.220 21.122 0.00 0.00 WT1 O
+ATOM 2555 H1 TIP3X 965 -22.230 -15.756 20.683 0.00 0.00 WT1 H
+ATOM 2556 H2 TIP3X 965 -23.015 -15.836 22.005 0.00 0.00 WT1 H
+ATOM 2557 OH2 TIP3X 966 -25.955 -1.338 28.169 0.00 0.00 WT1 O
+ATOM 2558 H1 TIP3X 966 -25.421 -2.105 28.412 0.00 0.00 WT1 H
+ATOM 2559 H2 TIP3X 966 -25.489 -0.903 27.430 0.00 0.00 WT1 H
+ATOM 2560 OH2 TIP3X 969 -27.424 27.897 -24.051 0.00 0.00 WT1 O
+ATOM 2561 H1 TIP3X 969 -28.042 27.832 -24.821 0.00 0.00 WT1 H
+ATOM 2562 H2 TIP3X 969 -26.662 27.505 -24.390 0.00 0.00 WT1 H
+ATOM 2563 OH2 TIP3X 970 -18.337 -5.568 -25.471 0.00 0.00 WT1 O
+ATOM 2564 H1 TIP3X 970 -18.149 -5.739 -24.518 0.00 0.00 WT1 H
+ATOM 2565 H2 TIP3X 970 -18.645 -4.625 -25.468 0.00 0.00 WT1 H
+ATOM 2566 OH2 TIP3X 972 -16.973 -20.751 -22.194 0.00 0.00 WT1 O
+ATOM 2567 H1 TIP3X 972 -16.364 -21.047 -22.896 0.00 0.00 WT1 H
+ATOM 2568 H2 TIP3X 972 -17.071 -19.806 -22.455 0.00 0.00 WT1 H
+ATOM 2569 OH2 TIP3X 973 -12.470 -12.187 -7.587 0.00 0.00 WT1 O
+ATOM 2570 H1 TIP3X 973 -11.601 -11.749 -7.669 0.00 0.00 WT1 H
+ATOM 2571 H2 TIP3X 973 -12.245 -13.124 -7.582 0.00 0.00 WT1 H
+ATOM 2572 OH2 TIP3X 974 -21.726 -20.552 -11.041 0.00 0.00 WT1 O
+ATOM 2573 H1 TIP3X 974 -21.107 -20.927 -10.346 0.00 0.00 WT1 H
+ATOM 2574 H2 TIP3X 974 -21.656 -21.109 -11.762 0.00 0.00 WT1 H
+ATOM 2575 OH2 TIP3X 975 -20.527 -25.925 -10.298 0.00 0.00 WT1 O
+ATOM 2576 H1 TIP3X 975 -19.954 -26.333 -9.569 0.00 0.00 WT1 H
+ATOM 2577 H2 TIP3X 975 -21.446 -26.061 -9.900 0.00 0.00 WT1 H
+ATOM 2578 OH2 TIP3X 976 26.134 -19.349 -9.474 0.00 0.00 WT1 O
+ATOM 2579 H1 TIP3X 976 25.299 -18.949 -9.754 0.00 0.00 WT1 H
+ATOM 2580 H2 TIP3X 976 26.680 -19.219 -10.244 0.00 0.00 WT1 H
+ATOM 2581 OH2 TIP3X 977 -23.682 -16.716 -6.850 0.00 0.00 WT1 O
+ATOM 2582 H1 TIP3X 977 -23.010 -16.921 -6.264 0.00 0.00 WT1 H
+ATOM 2583 H2 TIP3X 977 -23.264 -16.047 -7.436 0.00 0.00 WT1 H
+ATOM 2584 OH2 TIP3X 978 -28.453 -9.434 11.145 0.00 0.00 WT1 O
+ATOM 2585 H1 TIP3X 978 -29.338 -9.390 11.484 0.00 0.00 WT1 H
+ATOM 2586 H2 TIP3X 978 -28.535 -9.296 10.177 0.00 0.00 WT1 H
+ATOM 2587 OH2 TIP3X 979 20.973 -10.946 15.298 0.00 0.00 WT1 O
+ATOM 2588 H1 TIP3X 979 21.637 -11.143 15.973 0.00 0.00 WT1 H
+ATOM 2589 H2 TIP3X 979 21.374 -10.453 14.663 0.00 0.00 WT1 H
+ATOM 2590 OH2 TIP3X 980 -20.567 -24.685 20.562 0.00 0.00 WT1 O
+ATOM 2591 H1 TIP3X 980 -20.835 -25.007 21.419 0.00 0.00 WT1 H
+ATOM 2592 H2 TIP3X 980 -21.040 -25.316 19.930 0.00 0.00 WT1 H
+ATOM 2593 OH2 TIP3X 982 -27.278 -11.844 15.685 0.00 0.00 WT1 O
+ATOM 2594 H1 TIP3X 982 -27.469 -12.141 16.529 0.00 0.00 WT1 H
+ATOM 2595 H2 TIP3X 982 -27.049 -10.939 15.843 0.00 0.00 WT1 H
+ATOM 2596 OH2 TIP3X 983 -30.425 -21.621 14.404 0.00 0.00 WT1 O
+ATOM 2597 H1 TIP3X 983 -30.729 -22.220 15.081 0.00 0.00 WT1 H
+ATOM 2598 H2 TIP3X 983 -31.259 -21.259 13.997 0.00 0.00 WT1 H
+ATOM 2599 OH2 TIP3X 985 -1.132 -3.266 -29.269 0.00 0.00 WT1 O
+ATOM 2600 H1 TIP3X 985 -1.009 -2.578 -29.981 0.00 0.00 WT1 H
+ATOM 2601 H2 TIP3X 985 -0.485 -3.957 -29.516 0.00 0.00 WT1 H
+ATOM 2602 OH2 TIP3X 986 -29.110 -11.950 26.167 0.00 0.00 WT1 O
+ATOM 2603 H1 TIP3X 986 -29.587 -11.109 26.252 0.00 0.00 WT1 H
+ATOM 2604 H2 TIP3X 986 -29.758 -12.430 25.602 0.00 0.00 WT1 H
+ATOM 2605 OH2 TIP3X 988 -18.088 -5.538 -29.714 0.00 0.00 WT1 O
+ATOM 2606 H1 TIP3X 988 -18.333 -4.612 -29.461 0.00 0.00 WT1 H
+ATOM 2607 H2 TIP3X 988 -18.512 -6.084 -29.000 0.00 0.00 WT1 H
+ATOM 2608 OH2 TIP3X 989 -20.835 0.860 -30.664 0.00 0.00 WT1 O
+ATOM 2609 H1 TIP3X 989 -20.617 0.035 -31.026 0.00 0.00 WT1 H
+ATOM 2610 H2 TIP3X 989 -21.094 0.669 -29.759 0.00 0.00 WT1 H
+ATOM 2611 OH2 TIP3X 990 -7.551 4.400 -24.116 0.00 0.00 WT1 O
+ATOM 2612 H1 TIP3X 990 -6.566 4.551 -24.143 0.00 0.00 WT1 H
+ATOM 2613 H2 TIP3X 990 -7.858 4.332 -25.058 0.00 0.00 WT1 H
+ATOM 2614 OH2 TIP3X 991 -17.665 2.997 -16.341 0.00 0.00 WT1 O
+ATOM 2615 H1 TIP3X 991 -18.636 2.868 -16.261 0.00 0.00 WT1 H
+ATOM 2616 H2 TIP3X 991 -17.590 3.230 -17.279 0.00 0.00 WT1 H
+ATOM 2617 OH2 TIP3X 992 -10.992 -28.730 -16.827 0.00 0.00 WT1 O
+ATOM 2618 H1 TIP3X 992 -11.610 -27.964 -16.916 0.00 0.00 WT1 H
+ATOM 2619 H2 TIP3X 992 -10.232 -28.408 -17.251 0.00 0.00 WT1 H
+ATOM 2620 OH2 TIP3X 994 -14.690 -19.275 -1.683 0.00 0.00 WT1 O
+ATOM 2621 H1 TIP3X 994 -15.519 -18.839 -1.409 0.00 0.00 WT1 H
+ATOM 2622 H2 TIP3X 994 -14.943 -20.144 -2.061 0.00 0.00 WT1 H
+ATOM 2623 OH2 TIP3X 995 -25.200 -15.341 -14.816 0.00 0.00 WT1 O
+ATOM 2624 H1 TIP3X 995 -24.857 -15.351 -15.673 0.00 0.00 WT1 H
+ATOM 2625 H2 TIP3X 995 -24.891 -14.498 -14.432 0.00 0.00 WT1 H
+ATOM 2626 OH2 TIP3X 996 -26.220 -14.484 -7.976 0.00 0.00 WT1 O
+ATOM 2627 H1 TIP3X 996 -26.894 -14.674 -8.659 0.00 0.00 WT1 H
+ATOM 2628 H2 TIP3X 996 -26.250 -13.515 -7.906 0.00 0.00 WT1 H
+ATOM 2629 OH2 TIP3X 999 -27.646 -4.937 17.299 0.00 0.00 WT1 O
+ATOM 2630 H1 TIP3X 999 -27.710 -4.463 18.195 0.00 0.00 WT1 H
+ATOM 2631 H2 TIP3X 999 -28.289 -5.677 17.492 0.00 0.00 WT1 H
+ATOM 2632 OH2 TIP3X1000 31.025 -11.757 4.034 0.00 0.00 WT1 O
+ATOM 2633 H1 TIP3X1000 30.142 -11.561 4.344 0.00 0.00 WT1 H
+ATOM 2634 H2 TIP3X1000 31.038 -12.696 3.896 0.00 0.00 WT1 H
+ATOM 2635 OH2 TIP3X1001 31.968 -24.556 8.301 0.00 0.00 WT1 O
+ATOM 2636 H1 TIP3X1001 31.952 -25.530 8.232 0.00 0.00 WT1 H
+ATOM 2637 H2 TIP3X1001 31.685 -24.244 7.449 0.00 0.00 WT1 H
+ATOM 2638 OH2 TIP3X1002 -25.873 -15.296 19.995 0.00 0.00 WT1 O
+ATOM 2639 H1 TIP3X1002 -25.145 -14.649 20.039 0.00 0.00 WT1 H
+ATOM 2640 H2 TIP3X1002 -25.479 -16.139 19.920 0.00 0.00 WT1 H
+ATOM 2641 OH2 TIP3X1004 -7.730 -16.966 13.943 0.00 0.00 WT1 O
+ATOM 2642 H1 TIP3X1004 -8.459 -17.597 14.224 0.00 0.00 WT1 H
+ATOM 2643 H2 TIP3X1004 -6.976 -17.275 14.550 0.00 0.00 WT1 H
+ATOM 2644 OH2 TIP3X1005 29.703 -5.946 28.359 0.00 0.00 WT1 O
+ATOM 2645 H1 TIP3X1005 30.298 -6.219 29.045 0.00 0.00 WT1 H
+ATOM 2646 H2 TIP3X1005 29.888 -5.015 28.274 0.00 0.00 WT1 H
+ATOM 2647 OH2 TIP3X1006 -22.376 -8.608 28.118 0.00 0.00 WT1 O
+ATOM 2648 H1 TIP3X1006 -21.732 -8.149 27.595 0.00 0.00 WT1 H
+ATOM 2649 H2 TIP3X1006 -22.478 -8.048 28.966 0.00 0.00 WT1 H
+ATOM 2650 OH2 TIP3X1007 -17.397 -13.890 -28.787 0.00 0.00 WT1 O
+ATOM 2651 H1 TIP3X1007 -17.725 -14.345 -28.037 0.00 0.00 WT1 H
+ATOM 2652 H2 TIP3X1007 -18.158 -13.394 -29.122 0.00 0.00 WT1 H
+ATOM 2653 OH2 TIP3X1008 -15.175 -18.942 31.172 0.00 0.00 WT1 O
+ATOM 2654 H1 TIP3X1008 -14.320 -18.513 31.423 0.00 0.00 WT1 H
+ATOM 2655 H2 TIP3X1008 -15.580 -18.321 30.541 0.00 0.00 WT1 H
+ATOM 2656 OH2 TIP3X1009 -12.411 -11.389 26.270 0.00 0.00 WT1 O
+ATOM 2657 H1 TIP3X1009 -12.032 -10.893 26.978 0.00 0.00 WT1 H
+ATOM 2658 H2 TIP3X1009 -13.387 -11.473 26.614 0.00 0.00 WT1 H
+ATOM 2659 OH2 TIP3X1011 -27.247 -11.861 -26.525 0.00 0.00 WT1 O
+ATOM 2660 H1 TIP3X1011 -27.231 -10.947 -26.154 0.00 0.00 WT1 H
+ATOM 2661 H2 TIP3X1011 -26.337 -11.969 -26.799 0.00 0.00 WT1 H
+ATOM 2662 OH2 TIP3X1012 -22.750 -9.597 -3.596 0.00 0.00 WT1 O
+ATOM 2663 H1 TIP3X1012 -23.576 -9.148 -3.695 0.00 0.00 WT1 H
+ATOM 2664 H2 TIP3X1012 -22.857 -10.074 -2.747 0.00 0.00 WT1 H
+ATOM 2665 OH2 TIP3X1013 -30.385 -14.645 -17.645 0.00 0.00 WT1 O
+ATOM 2666 H1 TIP3X1013 -30.775 -15.520 -17.580 0.00 0.00 WT1 H
+ATOM 2667 H2 TIP3X1013 -31.141 -14.016 -17.949 0.00 0.00 WT1 H
+ATOM 2668 OH2 TIP3X1014 -20.913 -16.213 -11.850 0.00 0.00 WT1 O
+ATOM 2669 H1 TIP3X1014 -20.779 -17.123 -12.302 0.00 0.00 WT1 H
+ATOM 2670 H2 TIP3X1014 -20.064 -16.060 -11.409 0.00 0.00 WT1 H
+ATOM 2671 OH2 TIP3X1015 -9.422 -8.335 -8.771 0.00 0.00 WT1 O
+ATOM 2672 H1 TIP3X1015 -8.604 -8.501 -9.266 0.00 0.00 WT1 H
+ATOM 2673 H2 TIP3X1015 -10.080 -8.225 -9.439 0.00 0.00 WT1 H
+ATOM 2674 OH2 TIP3X1016 28.463 29.566 -1.019 0.00 0.00 WT1 O
+ATOM 2675 H1 TIP3X1016 28.584 28.618 -0.764 0.00 0.00 WT1 H
+ATOM 2676 H2 TIP3X1016 28.475 29.639 -1.964 0.00 0.00 WT1 H
+ATOM 2677 OH2 TIP3X1017 -22.216 -13.940 -15.561 0.00 0.00 WT1 O
+ATOM 2678 H1 TIP3X1017 -21.424 -13.834 -16.078 0.00 0.00 WT1 H
+ATOM 2679 H2 TIP3X1017 -22.059 -13.416 -14.766 0.00 0.00 WT1 H
+ATOM 2680 OH2 TIP3X1018 -29.631 -12.380 -21.162 0.00 0.00 WT1 O
+ATOM 2681 H1 TIP3X1018 -29.949 -12.575 -20.299 0.00 0.00 WT1 H
+ATOM 2682 H2 TIP3X1018 -28.653 -12.283 -21.077 0.00 0.00 WT1 H
+ATOM 2683 OH2 TIP3X1020 -19.801 -20.646 -0.035 0.00 0.00 WT1 O
+ATOM 2684 H1 TIP3X1020 -19.720 -19.730 0.149 0.00 0.00 WT1 H
+ATOM 2685 H2 TIP3X1020 -20.615 -20.646 -0.514 0.00 0.00 WT1 H
+ATOM 2686 OH2 TIP3X1021 29.547 1.833 12.979 0.00 0.00 WT1 O
+ATOM 2687 H1 TIP3X1021 29.165 1.682 13.848 0.00 0.00 WT1 H
+ATOM 2688 H2 TIP3X1021 30.478 1.621 13.203 0.00 0.00 WT1 H
+ATOM 2689 OH2 TIP3X1022 -24.903 -14.289 8.718 0.00 0.00 WT1 O
+ATOM 2690 H1 TIP3X1022 -24.753 -15.147 9.184 0.00 0.00 WT1 H
+ATOM 2691 H2 TIP3X1022 -25.765 -14.387 8.242 0.00 0.00 WT1 H
+ATOM 2692 OH2 TIP3X1023 -25.013 -6.657 0.803 0.00 0.00 WT1 O
+ATOM 2693 H1 TIP3X1023 -25.938 -6.907 1.100 0.00 0.00 WT1 H
+ATOM 2694 H2 TIP3X1023 -24.532 -7.005 1.508 0.00 0.00 WT1 H
+ATOM 2695 OH2 TIP3X1025 -27.600 -3.657 25.045 0.00 0.00 WT1 O
+ATOM 2696 H1 TIP3X1025 -27.093 -4.490 24.868 0.00 0.00 WT1 H
+ATOM 2697 H2 TIP3X1025 -27.271 -3.485 25.923 0.00 0.00 WT1 H
+ATOM 2698 OH2 TIP3X1026 -14.813 -9.638 25.961 0.00 0.00 WT1 O
+ATOM 2699 H1 TIP3X1026 -15.717 -9.353 25.918 0.00 0.00 WT1 H
+ATOM 2700 H2 TIP3X1026 -14.450 -9.196 26.716 0.00 0.00 WT1 H
+ATOM 2701 OH2 TIP3X1027 -16.842 -16.782 -30.547 0.00 0.00 WT1 O
+ATOM 2702 H1 TIP3X1027 -16.714 -15.877 -30.840 0.00 0.00 WT1 H
+ATOM 2703 H2 TIP3X1027 -17.825 -16.781 -30.413 0.00 0.00 WT1 H
+ATOM 2704 OH2 TIP3X1029 31.013 -12.779 26.206 0.00 0.00 WT1 O
+ATOM 2705 H1 TIP3X1029 30.943 -13.361 26.967 0.00 0.00 WT1 H
+ATOM 2706 H2 TIP3X1029 31.428 -12.029 26.565 0.00 0.00 WT1 H
+ATOM 2707 OH2 TIP3X1030 -16.271 -10.933 29.596 0.00 0.00 WT1 O
+ATOM 2708 H1 TIP3X1030 -16.055 -10.227 29.035 0.00 0.00 WT1 H
+ATOM 2709 H2 TIP3X1030 -16.695 -10.505 30.404 0.00 0.00 WT1 H
+ATOM 2710 OH2 TIP3X1031 25.107 -9.093 23.066 0.00 0.00 WT1 O
+ATOM 2711 H1 TIP3X1031 25.856 -9.211 23.704 0.00 0.00 WT1 H
+ATOM 2712 H2 TIP3X1031 24.734 -9.939 23.117 0.00 0.00 WT1 H
+ATOM 2713 OH2 TIP3X1032 -24.071 -22.399 -27.678 0.00 0.00 WT1 O
+ATOM 2714 H1 TIP3X1032 -24.636 -21.660 -28.088 0.00 0.00 WT1 H
+ATOM 2715 H2 TIP3X1032 -24.682 -22.989 -27.180 0.00 0.00 WT1 H
+ATOM 2716 OH2 TIP3X1033 -21.791 -5.065 -30.027 0.00 0.00 WT1 O
+ATOM 2717 H1 TIP3X1033 -22.603 -4.712 -30.480 0.00 0.00 WT1 H
+ATOM 2718 H2 TIP3X1033 -21.477 -4.328 -29.376 0.00 0.00 WT1 H
+ATOM 2719 OH2 TIP3X1034 -22.946 0.644 29.377 0.00 0.00 WT1 O
+ATOM 2720 H1 TIP3X1034 -22.723 0.083 30.186 0.00 0.00 WT1 H
+ATOM 2721 H2 TIP3X1034 -22.075 0.894 29.114 0.00 0.00 WT1 H
+ATOM 2722 OH2 TIP3X1035 24.892 -13.137 -4.065 0.00 0.00 WT1 O
+ATOM 2723 H1 TIP3X1035 24.616 -12.279 -4.233 0.00 0.00 WT1 H
+ATOM 2724 H2 TIP3X1035 24.645 -13.510 -4.967 0.00 0.00 WT1 H
+ATOM 2725 OH2 TIP3X1036 15.839 -5.158 -5.930 0.00 0.00 WT1 O
+ATOM 2726 H1 TIP3X1036 16.207 -4.312 -6.189 0.00 0.00 WT1 H
+ATOM 2727 H2 TIP3X1036 15.257 -4.908 -5.274 0.00 0.00 WT1 H
+ATOM 2728 OH2 TIP3X1037 30.912 2.823 8.406 0.00 0.00 WT1 O
+ATOM 2729 H1 TIP3X1037 31.109 2.493 9.350 0.00 0.00 WT1 H
+ATOM 2730 H2 TIP3X1037 31.011 3.783 8.522 0.00 0.00 WT1 H
+ATOM 2731 OH2 TIP3X1038 21.872 3.356 -1.637 0.00 0.00 WT1 O
+ATOM 2732 H1 TIP3X1038 21.760 2.535 -2.085 0.00 0.00 WT1 H
+ATOM 2733 H2 TIP3X1038 22.208 3.111 -0.751 0.00 0.00 WT1 H
+ATOM 2734 OH2 TIP3X1039 -22.941 1.382 -0.402 0.00 0.00 WT1 O
+ATOM 2735 H1 TIP3X1039 -22.702 0.548 -0.879 0.00 0.00 WT1 H
+ATOM 2736 H2 TIP3X1039 -22.814 1.114 0.523 0.00 0.00 WT1 H
+ATOM 2737 OH2 TIP3X1040 -24.875 -5.992 -15.795 0.00 0.00 WT1 O
+ATOM 2738 H1 TIP3X1040 -24.695 -5.088 -16.006 0.00 0.00 WT1 H
+ATOM 2739 H2 TIP3X1040 -25.715 -6.111 -16.266 0.00 0.00 WT1 H
+ATOM 2740 OH2 TIP3X1041 26.304 -3.855 12.865 0.00 0.00 WT1 O
+ATOM 2741 H1 TIP3X1041 26.119 -3.318 13.575 0.00 0.00 WT1 H
+ATOM 2742 H2 TIP3X1041 26.711 -4.664 13.197 0.00 0.00 WT1 H
+ATOM 2743 OH2 TIP3X1042 -17.825 -18.622 9.445 0.00 0.00 WT1 O
+ATOM 2744 H1 TIP3X1042 -17.924 -18.441 8.486 0.00 0.00 WT1 H
+ATOM 2745 H2 TIP3X1042 -17.142 -18.010 9.745 0.00 0.00 WT1 H
+ATOM 2746 OH2 TIP3X1043 -29.216 -6.092 9.571 0.00 0.00 WT1 O
+ATOM 2747 H1 TIP3X1043 -29.473 -5.881 10.490 0.00 0.00 WT1 H
+ATOM 2748 H2 TIP3X1043 -28.270 -5.834 9.504 0.00 0.00 WT1 H
+ATOM 2749 OH2 TIP3X1044 27.791 -9.797 15.106 0.00 0.00 WT1 O
+ATOM 2750 H1 TIP3X1044 27.012 -9.964 14.560 0.00 0.00 WT1 H
+ATOM 2751 H2 TIP3X1044 27.536 -9.015 15.641 0.00 0.00 WT1 H
+ATOM 2752 OH2 TIP3X1045 -27.268 -4.063 14.607 0.00 0.00 WT1 O
+ATOM 2753 H1 TIP3X1045 -27.416 -4.176 15.582 0.00 0.00 WT1 H
+ATOM 2754 H2 TIP3X1045 -26.487 -3.479 14.613 0.00 0.00 WT1 H
+ATOM 2755 OH2 TIP3X1046 -25.908 -10.205 20.113 0.00 0.00 WT1 O
+ATOM 2756 H1 TIP3X1046 -25.291 -10.587 20.797 0.00 0.00 WT1 H
+ATOM 2757 H2 TIP3X1046 -26.187 -9.376 20.586 0.00 0.00 WT1 H
+ATOM 2758 OH2 TIP3X1047 -26.708 -9.441 29.070 0.00 0.00 WT1 O
+ATOM 2759 H1 TIP3X1047 -26.480 -8.788 28.356 0.00 0.00 WT1 H
+ATOM 2760 H2 TIP3X1047 -26.824 -10.242 28.549 0.00 0.00 WT1 H
+ATOM 2761 OH2 TIP3X1048 -28.315 -2.952 27.823 0.00 0.00 WT1 O
+ATOM 2762 H1 TIP3X1048 -27.666 -2.420 28.301 0.00 0.00 WT1 H
+ATOM 2763 H2 TIP3X1048 -28.445 -3.793 28.267 0.00 0.00 WT1 H
+ATOM 2764 OH2 TIP3X1049 -23.418 3.185 23.756 0.00 0.00 WT1 O
+ATOM 2765 H1 TIP3X1049 -24.096 3.574 24.287 0.00 0.00 WT1 H
+ATOM 2766 H2 TIP3X1049 -23.153 3.965 23.214 0.00 0.00 WT1 H
+ATOM 2767 OH2 TIP3X1050 -3.353 -4.446 29.998 0.00 0.00 WT1 O
+ATOM 2768 H1 TIP3X1050 -3.673 -5.255 30.309 0.00 0.00 WT1 H
+ATOM 2769 H2 TIP3X1050 -3.677 -3.875 30.649 0.00 0.00 WT1 H
+ATOM 2770 OH2 TIP3X1051 27.919 -20.533 -30.640 0.00 0.00 WT1 O
+ATOM 2771 H1 TIP3X1051 28.342 -21.385 -30.489 0.00 0.00 WT1 H
+ATOM 2772 H2 TIP3X1051 27.064 -20.520 -30.161 0.00 0.00 WT1 H
+ATOM 2773 OH2 TIP3X1053 -20.415 -8.879 -12.545 0.00 0.00 WT1 O
+ATOM 2774 H1 TIP3X1053 -19.587 -8.795 -12.018 0.00 0.00 WT1 H
+ATOM 2775 H2 TIP3X1053 -21.184 -8.734 -11.905 0.00 0.00 WT1 H
+ATOM 2776 OH2 TIP3X1054 -10.967 -4.040 -14.407 0.00 0.00 WT1 O
+ATOM 2777 H1 TIP3X1054 -10.967 -3.044 -14.379 0.00 0.00 WT1 H
+ATOM 2778 H2 TIP3X1054 -10.075 -4.223 -14.825 0.00 0.00 WT1 H
+ATOM 2779 OH2 TIP3X1055 -23.543 -0.989 -31.140 0.00 0.00 WT1 O
+ATOM 2780 H1 TIP3X1055 -23.756 -0.336 -30.486 0.00 0.00 WT1 H
+ATOM 2781 H2 TIP3X1055 -24.191 -1.695 -30.933 0.00 0.00 WT1 H
+ATOM 2782 OH2 TIP3X1056 -12.599 4.861 -8.152 0.00 0.00 WT1 O
+ATOM 2783 H1 TIP3X1056 -12.612 5.833 -8.349 0.00 0.00 WT1 H
+ATOM 2784 H2 TIP3X1056 -13.025 4.454 -8.974 0.00 0.00 WT1 H
+ATOM 2785 OH2 TIP3X1057 -22.077 6.910 -9.487 0.00 0.00 WT1 O
+ATOM 2786 H1 TIP3X1057 -22.245 6.506 -8.543 0.00 0.00 WT1 H
+ATOM 2787 H2 TIP3X1057 -22.853 6.717 -10.052 0.00 0.00 WT1 H
+ATOM 2788 OH2 TIP3X1058 -25.751 -4.265 -18.332 0.00 0.00 WT1 O
+ATOM 2789 H1 TIP3X1058 -25.537 -3.642 -19.002 0.00 0.00 WT1 H
+ATOM 2790 H2 TIP3X1058 -24.910 -4.757 -18.152 0.00 0.00 WT1 H
+ATOM 2791 OH2 TIP3X1059 -18.245 -6.206 -22.480 0.00 0.00 WT1 O
+ATOM 2792 H1 TIP3X1059 -19.174 -6.331 -22.233 0.00 0.00 WT1 H
+ATOM 2793 H2 TIP3X1059 -17.852 -6.249 -21.626 0.00 0.00 WT1 H
+ATOM 2794 OH2 TIP3X1061 -28.604 -12.006 4.503 0.00 0.00 WT1 O
+ATOM 2795 H1 TIP3X1061 -28.646 -12.905 4.141 0.00 0.00 WT1 H
+ATOM 2796 H2 TIP3X1061 -28.475 -11.446 3.622 0.00 0.00 WT1 H
+ATOM 2797 OH2 TIP3X1062 -16.502 -5.689 5.716 0.00 0.00 WT1 O
+ATOM 2798 H1 TIP3X1062 -16.891 -4.854 5.683 0.00 0.00 WT1 H
+ATOM 2799 H2 TIP3X1062 -16.551 -6.025 4.834 0.00 0.00 WT1 H
+ATOM 2800 OH2 TIP3X1063 -18.374 -1.156 4.012 0.00 0.00 WT1 O
+ATOM 2801 H1 TIP3X1063 -19.039 -1.399 4.641 0.00 0.00 WT1 H
+ATOM 2802 H2 TIP3X1063 -17.591 -1.261 4.544 0.00 0.00 WT1 H
+ATOM 2803 OH2 TIP3X1064 -24.051 3.699 17.646 0.00 0.00 WT1 O
+ATOM 2804 H1 TIP3X1064 -24.396 3.056 17.052 0.00 0.00 WT1 H
+ATOM 2805 H2 TIP3X1064 -23.063 3.641 17.485 0.00 0.00 WT1 H
+ATOM 2806 OH2 TIP3X1065 -15.665 6.240 6.854 0.00 0.00 WT1 O
+ATOM 2807 H1 TIP3X1065 -15.807 5.407 7.375 0.00 0.00 WT1 H
+ATOM 2808 H2 TIP3X1065 -16.496 6.528 6.513 0.00 0.00 WT1 H
+ATOM 2809 OH2 TIP3X1066 -28.259 1.268 -0.480 0.00 0.00 WT1 O
+ATOM 2810 H1 TIP3X1066 -27.303 1.107 -0.610 0.00 0.00 WT1 H
+ATOM 2811 H2 TIP3X1066 -28.330 1.920 0.193 0.00 0.00 WT1 H
+ATOM 2812 OH2 TIP3X1067 23.195 -4.947 21.605 0.00 0.00 WT1 O
+ATOM 2813 H1 TIP3X1067 22.925 -5.471 20.795 0.00 0.00 WT1 H
+ATOM 2814 H2 TIP3X1067 22.338 -4.691 22.107 0.00 0.00 WT1 H
+ATOM 2815 OH2 TIP3X1068 -22.547 -2.983 27.769 0.00 0.00 WT1 O
+ATOM 2816 H1 TIP3X1068 -22.592 -2.129 27.280 0.00 0.00 WT1 H
+ATOM 2817 H2 TIP3X1068 -21.862 -2.723 28.452 0.00 0.00 WT1 H
+ATOM 2818 OH2 TIP3X1069 -22.011 -24.785 16.190 0.00 0.00 WT1 O
+ATOM 2819 H1 TIP3X1069 -21.444 -24.028 16.089 0.00 0.00 WT1 H
+ATOM 2820 H2 TIP3X1069 -21.704 -25.451 15.525 0.00 0.00 WT1 H
+ATOM 2821 OH2 TIP3X1070 25.594 -14.793 24.810 0.00 0.00 WT1 O
+ATOM 2822 H1 TIP3X1070 25.241 -14.976 23.946 0.00 0.00 WT1 H
+ATOM 2823 H2 TIP3X1070 25.411 -13.832 24.898 0.00 0.00 WT1 H
+ATOM 2824 OH2 TIP3X1071 -29.435 -12.198 31.263 0.00 0.00 WT1 O
+ATOM 2825 H1 TIP3X1071 -29.688 -13.027 31.672 0.00 0.00 WT1 H
+ATOM 2826 H2 TIP3X1071 -28.567 -12.483 30.886 0.00 0.00 WT1 H
+ATOM 2827 OH2 TIP3X1072 -18.290 19.119 -19.882 0.00 0.00 WT1 O
+ATOM 2828 H1 TIP3X1072 -17.755 19.889 -19.669 0.00 0.00 WT1 H
+ATOM 2829 H2 TIP3X1072 -19.219 19.467 -19.693 0.00 0.00 WT1 H
+ATOM 2830 OH2 TIP3X1074 -20.673 -7.222 26.466 0.00 0.00 WT1 O
+ATOM 2831 H1 TIP3X1074 -20.793 -6.283 26.417 0.00 0.00 WT1 H
+ATOM 2832 H2 TIP3X1074 -19.833 -7.310 26.901 0.00 0.00 WT1 H
+ATOM 2833 OH2 TIP3X1076 -29.480 -1.330 -25.743 0.00 0.00 WT1 O
+ATOM 2834 H1 TIP3X1076 -29.328 -2.249 -25.563 0.00 0.00 WT1 H
+ATOM 2835 H2 TIP3X1076 -29.584 -0.850 -24.855 0.00 0.00 WT1 H
+ATOM 2836 OH2 TIP3X1077 -30.921 10.038 -22.312 0.00 0.00 WT1 O
+ATOM 2837 H1 TIP3X1077 -31.621 10.718 -22.578 0.00 0.00 WT1 H
+ATOM 2838 H2 TIP3X1077 -31.522 9.301 -22.062 0.00 0.00 WT1 H
+ATOM 2839 OH2 TIP3X1078 -21.286 11.921 -9.652 0.00 0.00 WT1 O
+ATOM 2840 H1 TIP3X1078 -21.233 12.877 -9.297 0.00 0.00 WT1 H
+ATOM 2841 H2 TIP3X1078 -21.831 11.992 -10.409 0.00 0.00 WT1 H
+ATOM 2842 OH2 TIP3X1080 -26.020 -4.452 -8.529 0.00 0.00 WT1 O
+ATOM 2843 H1 TIP3X1080 -25.723 -3.700 -8.968 0.00 0.00 WT1 H
+ATOM 2844 H2 TIP3X1080 -26.003 -4.256 -7.625 0.00 0.00 WT1 H
+ATOM 2845 OH2 TIP3X1081 -24.309 2.925 -4.864 0.00 0.00 WT1 O
+ATOM 2846 H1 TIP3X1081 -23.552 2.853 -5.501 0.00 0.00 WT1 H
+ATOM 2847 H2 TIP3X1081 -23.810 3.003 -4.013 0.00 0.00 WT1 H
+ATOM 2848 OH2 TIP3X1082 -12.176 -8.138 5.888 0.00 0.00 WT1 O
+ATOM 2849 H1 TIP3X1082 -11.602 -8.783 5.384 0.00 0.00 WT1 H
+ATOM 2850 H2 TIP3X1082 -11.477 -7.745 6.430 0.00 0.00 WT1 H
+ATOM 2851 OH2 TIP3X1083 -1.163 7.369 10.476 0.00 0.00 WT1 O
+ATOM 2852 H1 TIP3X1083 -1.875 7.869 10.045 0.00 0.00 WT1 H
+ATOM 2853 H2 TIP3X1083 -1.169 7.780 11.327 0.00 0.00 WT1 H
+ATOM 2854 OH2 TIP3X1084 27.754 -7.324 16.138 0.00 0.00 WT1 O
+ATOM 2855 H1 TIP3X1084 27.109 -7.723 16.747 0.00 0.00 WT1 H
+ATOM 2856 H2 TIP3X1084 28.558 -7.209 16.722 0.00 0.00 WT1 H
+ATOM 2857 OH2 TIP3X1085 -24.019 -4.094 8.131 0.00 0.00 WT1 O
+ATOM 2858 H1 TIP3X1085 -24.048 -3.980 7.160 0.00 0.00 WT1 H
+ATOM 2859 H2 TIP3X1085 -24.656 -3.379 8.425 0.00 0.00 WT1 H
+ATOM 2860 OH2 TIP3X1086 27.595 -10.741 19.474 0.00 0.00 WT1 O
+ATOM 2861 H1 TIP3X1086 27.323 -9.840 19.886 0.00 0.00 WT1 H
+ATOM 2862 H2 TIP3X1086 26.849 -11.357 19.651 0.00 0.00 WT1 H
+ATOM 2863 OH2 TIP3X1087 -16.252 -15.053 12.961 0.00 0.00 WT1 O
+ATOM 2864 H1 TIP3X1087 -16.384 -14.336 12.304 0.00 0.00 WT1 H
+ATOM 2865 H2 TIP3X1087 -16.830 -14.698 13.687 0.00 0.00 WT1 H
+ATOM 2866 OH2 TIP3X1088 -10.859 -8.192 19.312 0.00 0.00 WT1 O
+ATOM 2867 H1 TIP3X1088 -9.966 -7.831 19.034 0.00 0.00 WT1 H
+ATOM 2868 H2 TIP3X1088 -11.443 -7.435 19.106 0.00 0.00 WT1 H
+ATOM 2869 OH2 TIP3X1090 -19.270 -7.461 8.633 0.00 0.00 WT1 O
+ATOM 2870 H1 TIP3X1090 -19.294 -8.438 8.634 0.00 0.00 WT1 H
+ATOM 2871 H2 TIP3X1090 -18.335 -7.311 8.978 0.00 0.00 WT1 H
+ATOM 2872 OH2 TIP3X1091 -19.024 -3.746 20.035 0.00 0.00 WT1 O
+ATOM 2873 H1 TIP3X1091 -18.633 -4.168 20.770 0.00 0.00 WT1 H
+ATOM 2874 H2 TIP3X1091 -19.711 -4.353 19.771 0.00 0.00 WT1 H
+ATOM 2875 OH2 TIP3X1092 25.972 10.199 -27.357 0.00 0.00 WT1 O
+ATOM 2876 H1 TIP3X1092 25.921 9.684 -26.562 0.00 0.00 WT1 H
+ATOM 2877 H2 TIP3X1092 25.189 10.786 -27.275 0.00 0.00 WT1 H
+ATOM 2878 OH2 TIP3X1094 27.227 -9.412 -12.255 0.00 0.00 WT1 O
+ATOM 2879 H1 TIP3X1094 26.629 -8.855 -11.789 0.00 0.00 WT1 H
+ATOM 2880 H2 TIP3X1094 27.731 -8.806 -12.764 0.00 0.00 WT1 H
+ATOM 2881 OH2 TIP3X1095 -22.368 3.772 30.777 0.00 0.00 WT1 O
+ATOM 2882 H1 TIP3X1095 -22.408 2.959 30.365 0.00 0.00 WT1 H
+ATOM 2883 H2 TIP3X1095 -23.304 4.020 30.837 0.00 0.00 WT1 H
+ATOM 2884 OH2 TIP3X1096 -12.168 -2.208 -26.480 0.00 0.00 WT1 O
+ATOM 2885 H1 TIP3X1096 -11.727 -1.638 -25.807 0.00 0.00 WT1 H
+ATOM 2886 H2 TIP3X1096 -12.633 -2.817 -25.951 0.00 0.00 WT1 H
+ATOM 2887 OH2 TIP3X1097 -22.265 0.833 2.356 0.00 0.00 WT1 O
+ATOM 2888 H1 TIP3X1097 -21.333 0.961 2.414 0.00 0.00 WT1 H
+ATOM 2889 H2 TIP3X1097 -22.520 0.294 3.174 0.00 0.00 WT1 H
+ATOM 2890 OH2 TIP3X1098 -28.741 -2.245 -21.522 0.00 0.00 WT1 O
+ATOM 2891 H1 TIP3X1098 -28.623 -1.686 -22.277 0.00 0.00 WT1 H
+ATOM 2892 H2 TIP3X1098 -29.502 -2.776 -21.857 0.00 0.00 WT1 H
+ATOM 2893 OH2 TIP3X1099 -19.151 3.375 -5.347 0.00 0.00 WT1 O
+ATOM 2894 H1 TIP3X1099 -18.424 2.867 -5.650 0.00 0.00 WT1 H
+ATOM 2895 H2 TIP3X1099 -19.757 2.708 -4.996 0.00 0.00 WT1 H
+ATOM 2896 OH2 TIP3X1100 -25.262 -8.288 -5.822 0.00 0.00 WT1 O
+ATOM 2897 H1 TIP3X1100 -24.917 -7.780 -6.559 0.00 0.00 WT1 H
+ATOM 2898 H2 TIP3X1100 -26.093 -8.619 -6.157 0.00 0.00 WT1 H
+ATOM 2899 OH2 TIP3X1101 -20.171 5.598 -10.691 0.00 0.00 WT1 O
+ATOM 2900 H1 TIP3X1101 -20.803 5.629 -9.926 0.00 0.00 WT1 H
+ATOM 2901 H2 TIP3X1101 -20.386 6.399 -11.160 0.00 0.00 WT1 H
+ATOM 2902 OH2 TIP3X1102 -24.306 -7.226 11.865 0.00 0.00 WT1 O
+ATOM 2903 H1 TIP3X1102 -25.138 -7.589 12.138 0.00 0.00 WT1 H
+ATOM 2904 H2 TIP3X1102 -24.447 -6.318 12.012 0.00 0.00 WT1 H
+ATOM 2905 OH2 TIP3X1103 -22.408 -1.345 7.417 0.00 0.00 WT1 O
+ATOM 2906 H1 TIP3X1103 -21.658 -1.348 8.024 0.00 0.00 WT1 H
+ATOM 2907 H2 TIP3X1103 -22.829 -2.150 7.671 0.00 0.00 WT1 H
+ATOM 2908 OH2 TIP3X1104 -30.622 -0.282 -0.873 0.00 0.00 WT1 O
+ATOM 2909 H1 TIP3X1104 -29.850 0.172 -0.446 0.00 0.00 WT1 H
+ATOM 2910 H2 TIP3X1104 -30.943 -0.939 -0.226 0.00 0.00 WT1 H
+ATOM 2911 OH2 TIP3X1105 -22.120 7.166 3.174 0.00 0.00 WT1 O
+ATOM 2912 H1 TIP3X1105 -22.720 6.846 3.891 0.00 0.00 WT1 H
+ATOM 2913 H2 TIP3X1105 -21.266 7.097 3.577 0.00 0.00 WT1 H
+ATOM 2914 OH2 TIP3X1106 25.000 1.184 4.078 0.00 0.00 WT1 O
+ATOM 2915 H1 TIP3X1106 24.839 0.246 4.291 0.00 0.00 WT1 H
+ATOM 2916 H2 TIP3X1106 25.297 1.507 4.969 0.00 0.00 WT1 H
+ATOM 2917 OH2 TIP3X1107 -25.117 -5.173 3.132 0.00 0.00 WT1 O
+ATOM 2918 H1 TIP3X1107 -25.335 -5.499 2.198 0.00 0.00 WT1 H
+ATOM 2919 H2 TIP3X1107 -25.990 -5.280 3.589 0.00 0.00 WT1 H
+ATOM 2920 OH2 TIP3X1109 -22.594 9.620 24.930 0.00 0.00 WT1 O
+ATOM 2921 H1 TIP3X1109 -23.469 9.338 25.268 0.00 0.00 WT1 H
+ATOM 2922 H2 TIP3X1109 -22.270 8.779 24.564 0.00 0.00 WT1 H
+ATOM 2923 OH2 TIP3X1110 -20.648 5.007 25.325 0.00 0.00 WT1 O
+ATOM 2924 H1 TIP3X1110 -21.026 5.693 24.775 0.00 0.00 WT1 H
+ATOM 2925 H2 TIP3X1110 -21.423 4.531 25.758 0.00 0.00 WT1 H
+ATOM 2926 OH2 TIP3X1111 -25.523 5.319 23.466 0.00 0.00 WT1 O
+ATOM 2927 H1 TIP3X1111 -25.964 6.109 23.584 0.00 0.00 WT1 H
+ATOM 2928 H2 TIP3X1111 -25.737 4.866 24.300 0.00 0.00 WT1 H
+ATOM 2929 OH2 TIP3X1112 -25.297 -5.407 -27.152 0.00 0.00 WT1 O
+ATOM 2930 H1 TIP3X1112 -24.593 -4.793 -27.239 0.00 0.00 WT1 H
+ATOM 2931 H2 TIP3X1112 -25.284 -5.932 -27.987 0.00 0.00 WT1 H
+ATOM 2932 OH2 TIP3X1113 -6.653 11.388 -19.030 0.00 0.00 WT1 O
+ATOM 2933 H1 TIP3X1113 -6.252 10.482 -19.049 0.00 0.00 WT1 H
+ATOM 2934 H2 TIP3X1113 -7.561 11.130 -19.111 0.00 0.00 WT1 H
+ATOM 2935 OH2 TIP3X1114 -18.395 13.245 20.352 0.00 0.00 WT1 O
+ATOM 2936 H1 TIP3X1114 -18.866 13.768 19.707 0.00 0.00 WT1 H
+ATOM 2937 H2 TIP3X1114 -19.099 13.086 21.039 0.00 0.00 WT1 H
+ATOM 2938 OH2 TIP3X1115 -10.629 -14.115 -26.125 0.00 0.00 WT1 O
+ATOM 2939 H1 TIP3X1115 -11.269 -14.810 -25.799 0.00 0.00 WT1 H
+ATOM 2940 H2 TIP3X1115 -9.843 -14.229 -25.621 0.00 0.00 WT1 H
+ATOM 2941 OH2 TIP3X1116 -14.604 8.320 -4.082 0.00 0.00 WT1 O
+ATOM 2942 H1 TIP3X1116 -14.572 9.015 -3.446 0.00 0.00 WT1 H
+ATOM 2943 H2 TIP3X1116 -13.717 8.032 -4.094 0.00 0.00 WT1 H
+ATOM 2944 OH2 TIP3X1117 -10.948 -17.510 -27.708 0.00 0.00 WT1 O
+ATOM 2945 H1 TIP3X1117 -11.336 -17.975 -26.991 0.00 0.00 WT1 H
+ATOM 2946 H2 TIP3X1117 -10.209 -16.994 -27.253 0.00 0.00 WT1 H
+ATOM 2947 OH2 TIP3X1118 -20.935 -3.184 -7.472 0.00 0.00 WT1 O
+ATOM 2948 H1 TIP3X1118 -21.687 -3.475 -6.999 0.00 0.00 WT1 H
+ATOM 2949 H2 TIP3X1118 -20.280 -3.921 -7.397 0.00 0.00 WT1 H
+ATOM 2950 OH2 TIP3X1119 25.244 -1.694 -24.605 0.00 0.00 WT1 O
+ATOM 2951 H1 TIP3X1119 25.606 -2.172 -25.401 0.00 0.00 WT1 H
+ATOM 2952 H2 TIP3X1119 24.646 -0.970 -24.937 0.00 0.00 WT1 H
+ATOM 2953 OH2 TIP3X1120 -23.893 -2.643 -6.821 0.00 0.00 WT1 O
+ATOM 2954 H1 TIP3X1120 -24.419 -2.271 -6.105 0.00 0.00 WT1 H
+ATOM 2955 H2 TIP3X1120 -23.572 -3.586 -6.454 0.00 0.00 WT1 H
+ATOM 2956 OH2 TIP3X1121 -20.926 5.222 -4.733 0.00 0.00 WT1 O
+ATOM 2957 H1 TIP3X1121 -20.769 5.549 -3.779 0.00 0.00 WT1 H
+ATOM 2958 H2 TIP3X1121 -20.247 4.451 -4.928 0.00 0.00 WT1 H
+ATOM 2959 OH2 TIP3X1122 -30.269 -0.521 -10.995 0.00 0.00 WT1 O
+ATOM 2960 H1 TIP3X1122 -30.118 -1.138 -11.652 0.00 0.00 WT1 H
+ATOM 2961 H2 TIP3X1122 -30.239 -1.024 -10.147 0.00 0.00 WT1 H
+ATOM 2962 OH2 TIP3X1123 -21.954 2.395 7.461 0.00 0.00 WT1 O
+ATOM 2963 H1 TIP3X1123 -22.645 2.832 7.998 0.00 0.00 WT1 H
+ATOM 2964 H2 TIP3X1123 -21.688 1.682 8.065 0.00 0.00 WT1 H
+ATOM 2965 OH2 TIP3X1125 -29.445 13.240 7.648 0.00 0.00 WT1 O
+ATOM 2966 H1 TIP3X1125 -29.123 13.747 8.453 0.00 0.00 WT1 H
+ATOM 2967 H2 TIP3X1125 -30.360 12.896 7.903 0.00 0.00 WT1 H
+ATOM 2968 OH2 TIP3X1126 21.669 -5.145 -0.161 0.00 0.00 WT1 O
+ATOM 2969 H1 TIP3X1126 21.737 -6.075 -0.407 0.00 0.00 WT1 H
+ATOM 2970 H2 TIP3X1126 20.753 -5.023 0.195 0.00 0.00 WT1 H
+ATOM 2971 OH2 TIP3X1127 -2.845 -4.719 15.623 0.00 0.00 WT1 O
+ATOM 2972 H1 TIP3X1127 -3.001 -3.778 15.343 0.00 0.00 WT1 H
+ATOM 2973 H2 TIP3X1127 -3.740 -5.153 15.449 0.00 0.00 WT1 H
+ATOM 2974 OH2 TIP3X1128 -9.713 8.019 5.473 0.00 0.00 WT1 O
+ATOM 2975 H1 TIP3X1128 -9.217 8.821 5.554 0.00 0.00 WT1 H
+ATOM 2976 H2 TIP3X1128 -9.923 7.827 6.357 0.00 0.00 WT1 H
+ATOM 2977 OH2 TIP3X1129 -15.698 -12.241 19.056 0.00 0.00 WT1 O
+ATOM 2978 H1 TIP3X1129 -15.454 -11.413 19.600 0.00 0.00 WT1 H
+ATOM 2979 H2 TIP3X1129 -15.315 -12.933 19.622 0.00 0.00 WT1 H
+ATOM 2980 OH2 TIP3X1130 -16.139 1.783 21.730 0.00 0.00 WT1 O
+ATOM 2981 H1 TIP3X1130 -15.963 1.783 20.786 0.00 0.00 WT1 H
+ATOM 2982 H2 TIP3X1130 -15.291 1.894 22.116 0.00 0.00 WT1 H
+ATOM 2983 OH2 TIP3X1131 -22.129 -5.186 22.862 0.00 0.00 WT1 O
+ATOM 2984 H1 TIP3X1131 -22.986 -5.293 23.403 0.00 0.00 WT1 H
+ATOM 2985 H2 TIP3X1131 -22.260 -5.855 22.091 0.00 0.00 WT1 H
+ATOM 2986 OH2 TIP3X1133 -24.679 1.162 16.138 0.00 0.00 WT1 O
+ATOM 2987 H1 TIP3X1133 -24.650 0.350 16.639 0.00 0.00 WT1 H
+ATOM 2988 H2 TIP3X1133 -24.175 0.943 15.333 0.00 0.00 WT1 H
+ATOM 2989 OH2 TIP3X1134 -11.042 10.715 -28.403 0.00 0.00 WT1 O
+ATOM 2990 H1 TIP3X1134 -10.839 11.671 -28.649 0.00 0.00 WT1 H
+ATOM 2991 H2 TIP3X1134 -12.016 10.759 -28.472 0.00 0.00 WT1 H
+ATOM 2992 OH2 TIP3X1135 -21.741 17.203 -20.423 0.00 0.00 WT1 O
+ATOM 2993 H1 TIP3X1135 -21.390 17.789 -21.149 0.00 0.00 WT1 H
+ATOM 2994 H2 TIP3X1135 -20.979 16.593 -20.288 0.00 0.00 WT1 H
+ATOM 2995 OH2 TIP3X1137 12.892 -2.246 -18.313 0.00 0.00 WT1 O
+ATOM 2996 H1 TIP3X1137 12.525 -1.489 -17.787 0.00 0.00 WT1 H
+ATOM 2997 H2 TIP3X1137 12.991 -3.031 -17.688 0.00 0.00 WT1 H
+ATOM 2998 OH2 TIP3X1139 -24.182 15.343 -17.565 0.00 0.00 WT1 O
+ATOM 2999 H1 TIP3X1139 -24.738 16.099 -17.487 0.00 0.00 WT1 H
+ATOM 3000 H2 TIP3X1139 -23.552 15.497 -16.819 0.00 0.00 WT1 H
+ATOM 3001 OH2 TIP3X1140 -21.822 10.338 -19.369 0.00 0.00 WT1 O
+ATOM 3002 H1 TIP3X1140 -22.385 10.051 -18.616 0.00 0.00 WT1 H
+ATOM 3003 H2 TIP3X1140 -22.350 9.952 -20.123 0.00 0.00 WT1 H
+ATOM 3004 OH2 TIP3X1141 27.504 7.348 -6.645 0.00 0.00 WT1 O
+ATOM 3005 H1 TIP3X1141 28.132 7.837 -6.150 0.00 0.00 WT1 H
+ATOM 3006 H2 TIP3X1141 27.854 6.448 -6.580 0.00 0.00 WT1 H
+ATOM 3007 OH2 TIP3X1142 -12.846 11.580 -6.283 0.00 0.00 WT1 O
+ATOM 3008 H1 TIP3X1142 -12.663 10.739 -6.811 0.00 0.00 WT1 H
+ATOM 3009 H2 TIP3X1142 -12.289 12.270 -6.673 0.00 0.00 WT1 H
+ATOM 3010 OH2 TIP3X1143 -24.736 8.692 -2.082 0.00 0.00 WT1 O
+ATOM 3011 H1 TIP3X1143 -23.842 8.402 -2.368 0.00 0.00 WT1 H
+ATOM 3012 H2 TIP3X1143 -25.128 9.128 -2.844 0.00 0.00 WT1 H
+ATOM 3013 OH2 TIP3X1144 -21.722 12.430 1.052 0.00 0.00 WT1 O
+ATOM 3014 H1 TIP3X1144 -21.226 11.597 0.796 0.00 0.00 WT1 H
+ATOM 3015 H2 TIP3X1144 -22.599 12.350 0.520 0.00 0.00 WT1 H
+ATOM 3016 OH2 TIP3X1146 30.380 6.240 -8.603 0.00 0.00 WT1 O
+ATOM 3017 H1 TIP3X1146 29.655 5.712 -8.287 0.00 0.00 WT1 H
+ATOM 3018 H2 TIP3X1146 31.112 5.596 -8.545 0.00 0.00 WT1 H
+ATOM 3019 OH2 TIP3X1147 -17.856 -4.288 3.317 0.00 0.00 WT1 O
+ATOM 3020 H1 TIP3X1147 -18.487 -4.357 4.062 0.00 0.00 WT1 H
+ATOM 3021 H2 TIP3X1147 -18.061 -4.989 2.727 0.00 0.00 WT1 H
+ATOM 3022 OH2 TIP3X1148 -24.910 -9.387 5.614 0.00 0.00 WT1 O
+ATOM 3023 H1 TIP3X1148 -25.894 -9.565 5.632 0.00 0.00 WT1 H
+ATOM 3024 H2 TIP3X1148 -24.600 -10.009 6.307 0.00 0.00 WT1 H
+ATOM 3025 OH2 TIP3X1149 20.408 6.394 13.047 0.00 0.00 WT1 O
+ATOM 3026 H1 TIP3X1149 20.233 5.942 12.187 0.00 0.00 WT1 H
+ATOM 3027 H2 TIP3X1149 21.334 6.256 13.308 0.00 0.00 WT1 H
+ATOM 3028 OH2 TIP3X1150 -11.112 10.242 8.542 0.00 0.00 WT1 O
+ATOM 3029 H1 TIP3X1150 -10.485 10.612 7.844 0.00 0.00 WT1 H
+ATOM 3030 H2 TIP3X1150 -10.468 9.818 9.159 0.00 0.00 WT1 H
+ATOM 3031 OH2 TIP3X1151 -16.390 -0.121 17.695 0.00 0.00 WT1 O
+ATOM 3032 H1 TIP3X1151 -16.054 -0.993 17.443 0.00 0.00 WT1 H
+ATOM 3033 H2 TIP3X1151 -16.949 -0.245 18.449 0.00 0.00 WT1 H
+ATOM 3034 OH2 TIP3X1152 30.481 11.778 22.964 0.00 0.00 WT1 O
+ATOM 3035 H1 TIP3X1152 29.878 12.537 23.193 0.00 0.00 WT1 H
+ATOM 3036 H2 TIP3X1152 30.014 11.049 23.361 0.00 0.00 WT1 H
+ATOM 3037 OH2 TIP3X1153 -30.136 3.609 15.264 0.00 0.00 WT1 O
+ATOM 3038 H1 TIP3X1153 -30.027 3.633 14.330 0.00 0.00 WT1 H
+ATOM 3039 H2 TIP3X1153 -30.006 2.683 15.472 0.00 0.00 WT1 H
+ATOM 3040 OH2 TIP3X1154 -30.527 5.566 19.526 0.00 0.00 WT1 O
+ATOM 3041 H1 TIP3X1154 -30.572 5.553 20.464 0.00 0.00 WT1 H
+ATOM 3042 H2 TIP3X1154 -30.009 4.739 19.398 0.00 0.00 WT1 H
+ATOM 3043 OH2 TIP3X1155 -24.177 18.430 -29.675 0.00 0.00 WT1 O
+ATOM 3044 H1 TIP3X1155 -24.237 18.407 -28.697 0.00 0.00 WT1 H
+ATOM 3045 H2 TIP3X1155 -24.351 19.353 -29.885 0.00 0.00 WT1 H
+ATOM 3046 OH2 TIP3X1156 -15.058 5.788 28.575 0.00 0.00 WT1 O
+ATOM 3047 H1 TIP3X1156 -14.403 6.529 28.619 0.00 0.00 WT1 H
+ATOM 3048 H2 TIP3X1156 -15.381 5.851 27.614 0.00 0.00 WT1 H
+ATOM 3049 OH2 TIP3X1157 -23.752 22.464 -15.481 0.00 0.00 WT1 O
+ATOM 3050 H1 TIP3X1157 -24.572 22.389 -16.106 0.00 0.00 WT1 H
+ATOM 3051 H2 TIP3X1157 -23.898 23.368 -15.139 0.00 0.00 WT1 H
+ATOM 3052 OH2 TIP3X1158 -24.889 5.051 -15.520 0.00 0.00 WT1 O
+ATOM 3053 H1 TIP3X1158 -25.741 4.733 -15.249 0.00 0.00 WT1 H
+ATOM 3054 H2 TIP3X1158 -24.803 5.960 -15.232 0.00 0.00 WT1 H
+ATOM 3055 OH2 TIP3X1159 18.170 28.229 -19.634 0.00 0.00 WT1 O
+ATOM 3056 H1 TIP3X1159 18.978 27.998 -19.219 0.00 0.00 WT1 H
+ATOM 3057 H2 TIP3X1159 18.371 29.101 -20.008 0.00 0.00 WT1 H
+ATOM 3058 OH2 TIP3X1160 -18.981 17.101 -18.047 0.00 0.00 WT1 O
+ATOM 3059 H1 TIP3X1160 -18.465 17.559 -18.707 0.00 0.00 WT1 H
+ATOM 3060 H2 TIP3X1160 -18.569 17.180 -17.167 0.00 0.00 WT1 H
+ATOM 3061 OH2 TIP3X1161 -21.662 28.728 -3.740 0.00 0.00 WT1 O
+ATOM 3062 H1 TIP3X1161 -22.127 29.526 -3.978 0.00 0.00 WT1 H
+ATOM 3063 H2 TIP3X1161 -22.255 28.460 -3.015 0.00 0.00 WT1 H
+ATOM 3064 OH2 TIP3X1162 -12.478 18.434 -22.395 0.00 0.00 WT1 O
+ATOM 3065 H1 TIP3X1162 -11.733 18.985 -22.728 0.00 0.00 WT1 H
+ATOM 3066 H2 TIP3X1162 -12.501 18.596 -21.427 0.00 0.00 WT1 H
+ATOM 3067 OH2 TIP3X1163 -28.673 15.424 -12.888 0.00 0.00 WT1 O
+ATOM 3068 H1 TIP3X1163 -28.983 16.267 -12.565 0.00 0.00 WT1 H
+ATOM 3069 H2 TIP3X1163 -27.755 15.385 -12.714 0.00 0.00 WT1 H
+ATOM 3070 OH2 TIP3X1164 -16.220 -10.926 2.906 0.00 0.00 WT1 O
+ATOM 3071 H1 TIP3X1164 -16.321 -11.138 3.797 0.00 0.00 WT1 H
+ATOM 3072 H2 TIP3X1164 -15.250 -10.691 2.791 0.00 0.00 WT1 H
+ATOM 3073 OH2 TIP3X1165 30.113 -3.227 -1.412 0.00 0.00 WT1 O
+ATOM 3074 H1 TIP3X1165 29.660 -4.012 -1.106 0.00 0.00 WT1 H
+ATOM 3075 H2 TIP3X1165 30.168 -2.712 -0.589 0.00 0.00 WT1 H
+ATOM 3076 OH2 TIP3X1166 -13.561 16.648 4.343 0.00 0.00 WT1 O
+ATOM 3077 H1 TIP3X1166 -13.782 15.726 4.340 0.00 0.00 WT1 H
+ATOM 3078 H2 TIP3X1166 -13.767 17.004 5.267 0.00 0.00 WT1 H
+ATOM 3079 OH2 TIP3X1167 -26.740 5.933 8.936 0.00 0.00 WT1 O
+ATOM 3080 H1 TIP3X1167 -26.223 6.687 8.667 0.00 0.00 WT1 H
+ATOM 3081 H2 TIP3X1167 -26.402 5.214 8.396 0.00 0.00 WT1 H
+ATOM 3082 OH2 TIP3X1168 -27.465 2.703 12.746 0.00 0.00 WT1 O
+ATOM 3083 H1 TIP3X1168 -26.990 2.361 11.968 0.00 0.00 WT1 H
+ATOM 3084 H2 TIP3X1168 -28.277 3.081 12.349 0.00 0.00 WT1 H
+ATOM 3085 OH2 TIP3X1169 -15.761 4.630 23.159 0.00 0.00 WT1 O
+ATOM 3086 H1 TIP3X1169 -16.115 4.347 22.248 0.00 0.00 WT1 H
+ATOM 3087 H2 TIP3X1169 -15.883 3.812 23.633 0.00 0.00 WT1 H
+ATOM 3088 OH2 TIP3X1170 -26.087 2.531 19.668 0.00 0.00 WT1 O
+ATOM 3089 H1 TIP3X1170 -26.131 2.690 20.622 0.00 0.00 WT1 H
+ATOM 3090 H2 TIP3X1170 -25.651 1.691 19.656 0.00 0.00 WT1 H
+ATOM 3091 OH2 TIP3X1171 -15.435 6.057 25.586 0.00 0.00 WT1 O
+ATOM 3092 H1 TIP3X1171 -15.312 6.938 25.198 0.00 0.00 WT1 H
+ATOM 3093 H2 TIP3X1171 -15.275 5.468 24.801 0.00 0.00 WT1 H
+ATOM 3094 OH2 TIP3X1172 -16.406 10.419 28.582 0.00 0.00 WT1 O
+ATOM 3095 H1 TIP3X1172 -15.497 10.758 28.643 0.00 0.00 WT1 H
+ATOM 3096 H2 TIP3X1172 -16.327 9.524 28.837 0.00 0.00 WT1 H
+ATOM 3097 OH2 TIP3X1173 -30.198 22.208 27.654 0.00 0.00 WT1 O
+ATOM 3098 H1 TIP3X1173 -30.035 21.997 26.708 0.00 0.00 WT1 H
+ATOM 3099 H2 TIP3X1173 -31.147 22.390 27.680 0.00 0.00 WT1 H
+ATOM 3100 OH2 TIP3X1174 29.276 5.660 20.244 0.00 0.00 WT1 O
+ATOM 3101 H1 TIP3X1174 28.984 6.237 20.952 0.00 0.00 WT1 H
+ATOM 3102 H2 TIP3X1174 29.823 6.129 19.625 0.00 0.00 WT1 H
+ATOM 3103 OH2 TIP3X1175 19.289 4.661 16.611 0.00 0.00 WT1 O
+ATOM 3104 H1 TIP3X1175 20.236 4.600 16.444 0.00 0.00 WT1 H
+ATOM 3105 H2 TIP3X1175 19.209 5.600 16.945 0.00 0.00 WT1 H
+ATOM 3106 OH2 TIP3X1176 -20.700 10.011 27.524 0.00 0.00 WT1 O
+ATOM 3107 H1 TIP3X1176 -21.337 10.581 27.199 0.00 0.00 WT1 H
+ATOM 3108 H2 TIP3X1176 -20.840 9.112 27.051 0.00 0.00 WT1 H
+ATOM 3109 OH2 TIP3X1177 -7.030 14.445 -19.844 0.00 0.00 WT1 O
+ATOM 3110 H1 TIP3X1177 -7.290 14.794 -19.036 0.00 0.00 WT1 H
+ATOM 3111 H2 TIP3X1177 -7.182 13.451 -19.737 0.00 0.00 WT1 H
+ATOM 3112 OH2 TIP3X1178 -23.767 6.772 -28.664 0.00 0.00 WT1 O
+ATOM 3113 H1 TIP3X1178 -23.201 6.275 -28.113 0.00 0.00 WT1 H
+ATOM 3114 H2 TIP3X1178 -24.082 7.471 -28.044 0.00 0.00 WT1 H
+ATOM 3115 OH2 TIP3X1179 -23.112 10.202 -23.638 0.00 0.00 WT1 O
+ATOM 3116 H1 TIP3X1179 -23.105 10.665 -24.546 0.00 0.00 WT1 H
+ATOM 3117 H2 TIP3X1179 -22.444 10.751 -23.201 0.00 0.00 WT1 H
+ATOM 3118 OH2 TIP3X1180 -23.868 13.549 -22.312 0.00 0.00 WT1 O
+ATOM 3119 H1 TIP3X1180 -24.721 13.725 -22.755 0.00 0.00 WT1 H
+ATOM 3120 H2 TIP3X1180 -23.797 14.280 -21.667 0.00 0.00 WT1 H
+ATOM 3121 OH2 TIP3X1181 -22.962 12.421 -15.754 0.00 0.00 WT1 O
+ATOM 3122 H1 TIP3X1181 -22.150 12.890 -15.743 0.00 0.00 WT1 H
+ATOM 3123 H2 TIP3X1181 -22.582 11.614 -16.104 0.00 0.00 WT1 H
+ATOM 3124 OH2 TIP3X1182 -27.666 7.078 -3.034 0.00 0.00 WT1 O
+ATOM 3125 H1 TIP3X1182 -26.895 7.164 -3.533 0.00 0.00 WT1 H
+ATOM 3126 H2 TIP3X1182 -28.080 6.301 -3.420 0.00 0.00 WT1 H
+ATOM 3127 OH2 TIP3X1183 -25.849 4.124 -20.843 0.00 0.00 WT1 O
+ATOM 3128 H1 TIP3X1183 -25.748 4.551 -19.967 0.00 0.00 WT1 H
+ATOM 3129 H2 TIP3X1183 -25.363 4.696 -21.489 0.00 0.00 WT1 H
+ATOM 3130 OH2 TIP3X1184 -25.127 23.366 7.747 0.00 0.00 WT1 O
+ATOM 3131 H1 TIP3X1184 -24.438 22.727 7.432 0.00 0.00 WT1 H
+ATOM 3132 H2 TIP3X1184 -24.794 24.205 7.590 0.00 0.00 WT1 H
+ATOM 3133 OH2 TIP3X1186 -26.056 -1.995 5.555 0.00 0.00 WT1 O
+ATOM 3134 H1 TIP3X1186 -26.565 -2.279 6.312 0.00 0.00 WT1 H
+ATOM 3135 H2 TIP3X1186 -25.501 -2.737 5.322 0.00 0.00 WT1 H
+ATOM 3136 OH2 TIP3X1187 -9.717 7.312 8.228 0.00 0.00 WT1 O
+ATOM 3137 H1 TIP3X1187 -9.459 6.429 8.546 0.00 0.00 WT1 H
+ATOM 3138 H2 TIP3X1187 -10.249 7.712 8.940 0.00 0.00 WT1 H
+ATOM 3139 OH2 TIP3X1188 -22.497 7.714 -3.343 0.00 0.00 WT1 O
+ATOM 3140 H1 TIP3X1188 -22.010 7.551 -4.219 0.00 0.00 WT1 H
+ATOM 3141 H2 TIP3X1188 -21.798 7.991 -2.666 0.00 0.00 WT1 H
+ATOM 3142 OH2 TIP3X1190 22.657 -2.297 9.463 0.00 0.00 WT1 O
+ATOM 3143 H1 TIP3X1190 23.247 -2.845 8.891 0.00 0.00 WT1 H
+ATOM 3144 H2 TIP3X1190 22.137 -1.744 8.861 0.00 0.00 WT1 H
+ATOM 3145 OH2 TIP3X1191 -15.566 4.492 20.427 0.00 0.00 WT1 O
+ATOM 3146 H1 TIP3X1191 -15.544 5.268 19.776 0.00 0.00 WT1 H
+ATOM 3147 H2 TIP3X1191 -16.238 3.850 20.007 0.00 0.00 WT1 H
+ATOM 3148 OH2 TIP3X1192 -26.919 9.348 16.076 0.00 0.00 WT1 O
+ATOM 3149 H1 TIP3X1192 -27.814 9.568 16.208 0.00 0.00 WT1 H
+ATOM 3150 H2 TIP3X1192 -26.935 8.568 15.529 0.00 0.00 WT1 H
+ATOM 3151 OH2 TIP3X1193 -10.832 6.237 17.909 0.00 0.00 WT1 O
+ATOM 3152 H1 TIP3X1193 -11.739 5.875 17.776 0.00 0.00 WT1 H
+ATOM 3153 H2 TIP3X1193 -10.755 6.710 17.067 0.00 0.00 WT1 H
+ATOM 3154 OH2 TIP3X1194 -27.074 6.691 5.583 0.00 0.00 WT1 O
+ATOM 3155 H1 TIP3X1194 -27.526 7.517 5.888 0.00 0.00 WT1 H
+ATOM 3156 H2 TIP3X1194 -27.789 6.140 5.209 0.00 0.00 WT1 H
+ATOM 3157 OH2 TIP3X1195 -27.891 13.226 14.196 0.00 0.00 WT1 O
+ATOM 3158 H1 TIP3X1195 -27.484 13.299 13.320 0.00 0.00 WT1 H
+ATOM 3159 H2 TIP3X1195 -27.133 12.890 14.696 0.00 0.00 WT1 H
+ATOM 3160 OH2 TIP3X1197 -20.107 1.506 -21.559 0.00 0.00 WT1 O
+ATOM 3161 H1 TIP3X1197 -20.901 1.627 -21.090 0.00 0.00 WT1 H
+ATOM 3162 H2 TIP3X1197 -19.648 2.369 -21.549 0.00 0.00 WT1 H
+ATOM 3163 OH2 TIP3X1198 30.009 7.642 29.806 0.00 0.00 WT1 O
+ATOM 3164 H1 TIP3X1198 29.680 7.977 30.687 0.00 0.00 WT1 H
+ATOM 3165 H2 TIP3X1198 29.360 6.913 29.541 0.00 0.00 WT1 H
+ATOM 3166 OH2 TIP3X1199 -22.742 12.986 30.675 0.00 0.00 WT1 O
+ATOM 3167 H1 TIP3X1199 -23.501 12.438 30.349 0.00 0.00 WT1 H
+ATOM 3168 H2 TIP3X1199 -22.898 13.823 30.230 0.00 0.00 WT1 H
+ATOM 3169 OH2 TIP3X1200 -25.364 6.508 -22.693 0.00 0.00 WT1 O
+ATOM 3170 H1 TIP3X1200 -26.034 6.183 -23.177 0.00 0.00 WT1 H
+ATOM 3171 H2 TIP3X1200 -25.662 7.353 -22.245 0.00 0.00 WT1 H
+ATOM 3172 OH2 TIP3X1201 -26.659 -2.042 -19.817 0.00 0.00 WT1 O
+ATOM 3173 H1 TIP3X1201 -27.489 -2.194 -20.267 0.00 0.00 WT1 H
+ATOM 3174 H2 TIP3X1201 -26.243 -1.360 -20.384 0.00 0.00 WT1 H
+ATOM 3175 OH2 TIP3X1202 -14.734 1.646 -11.515 0.00 0.00 WT1 O
+ATOM 3176 H1 TIP3X1202 -14.323 0.967 -10.937 0.00 0.00 WT1 H
+ATOM 3177 H2 TIP3X1202 -14.479 2.453 -11.014 0.00 0.00 WT1 H
+ATOM 3178 OH2 TIP3X1204 -27.092 9.178 -7.351 0.00 0.00 WT1 O
+ATOM 3179 H1 TIP3X1204 -26.668 8.335 -7.091 0.00 0.00 WT1 H
+ATOM 3180 H2 TIP3X1204 -27.770 8.929 -8.018 0.00 0.00 WT1 H
+ATOM 3181 OH2 TIP3X1205 30.582 5.037 -11.245 0.00 0.00 WT1 O
+ATOM 3182 H1 TIP3X1205 29.680 4.783 -11.545 0.00 0.00 WT1 H
+ATOM 3183 H2 TIP3X1205 30.348 5.554 -10.428 0.00 0.00 WT1 H
+ATOM 3184 OH2 TIP3X1206 -26.168 12.516 -8.162 0.00 0.00 WT1 O
+ATOM 3185 H1 TIP3X1206 -25.719 11.721 -8.366 0.00 0.00 WT1 H
+ATOM 3186 H2 TIP3X1206 -27.002 12.235 -7.831 0.00 0.00 WT1 H
+ATOM 3187 OH2 TIP3X1207 -30.977 23.210 -5.229 0.00 0.00 WT1 O
+ATOM 3188 H1 TIP3X1207 -30.968 23.938 -5.808 0.00 0.00 WT1 H
+ATOM 3189 H2 TIP3X1207 -30.235 22.646 -5.498 0.00 0.00 WT1 H
+ATOM 3190 OH2 TIP3X1208 -11.521 13.359 -13.042 0.00 0.00 WT1 O
+ATOM 3191 H1 TIP3X1208 -11.061 12.830 -13.726 0.00 0.00 WT1 H
+ATOM 3192 H2 TIP3X1208 -10.813 13.429 -12.318 0.00 0.00 WT1 H
+ATOM 3193 OH2 TIP3X1209 -28.661 5.976 16.535 0.00 0.00 WT1 O
+ATOM 3194 H1 TIP3X1209 -28.316 5.128 16.269 0.00 0.00 WT1 H
+ATOM 3195 H2 TIP3X1209 -28.353 6.034 17.404 0.00 0.00 WT1 H
+ATOM 3196 OH2 TIP3X1210 -22.432 13.629 14.807 0.00 0.00 WT1 O
+ATOM 3197 H1 TIP3X1210 -22.056 13.072 14.135 0.00 0.00 WT1 H
+ATOM 3198 H2 TIP3X1210 -22.701 12.999 15.451 0.00 0.00 WT1 H
+ATOM 3199 OH2 TIP3X1211 -24.362 9.502 1.138 0.00 0.00 WT1 O
+ATOM 3200 H1 TIP3X1211 -24.040 8.676 0.727 0.00 0.00 WT1 H
+ATOM 3201 H2 TIP3X1211 -24.499 9.264 2.038 0.00 0.00 WT1 H
+ATOM 3202 OH2 TIP3X1212 -20.028 17.695 -0.738 0.00 0.00 WT1 O
+ATOM 3203 H1 TIP3X1212 -20.118 16.724 -0.723 0.00 0.00 WT1 H
+ATOM 3204 H2 TIP3X1212 -19.431 17.940 -1.444 0.00 0.00 WT1 H
+ATOM 3205 OH2 TIP3X1213 -31.218 10.001 25.392 0.00 0.00 WT1 O
+ATOM 3206 H1 TIP3X1213 -31.763 10.682 25.797 0.00 0.00 WT1 H
+ATOM 3207 H2 TIP3X1213 -31.307 10.299 24.444 0.00 0.00 WT1 H
+ATOM 3208 OH2 TIP3X1214 -20.744 12.945 8.483 0.00 0.00 WT1 O
+ATOM 3209 H1 TIP3X1214 -21.479 12.790 7.892 0.00 0.00 WT1 H
+ATOM 3210 H2 TIP3X1214 -20.600 12.086 8.899 0.00 0.00 WT1 H
+ATOM 3211 OH2 TIP3X1215 -19.550 10.343 9.407 0.00 0.00 WT1 O
+ATOM 3212 H1 TIP3X1215 -18.947 9.799 8.847 0.00 0.00 WT1 H
+ATOM 3213 H2 TIP3X1215 -19.017 10.549 10.153 0.00 0.00 WT1 H
+ATOM 3214 OH2 TIP3X1216 -31.797 15.192 22.233 0.00 0.00 WT1 O
+ATOM 3215 H1 TIP3X1216 -31.085 15.752 22.530 0.00 0.00 WT1 H
+ATOM 3216 H2 TIP3X1216 -31.253 14.499 21.743 0.00 0.00 WT1 H
+ATOM 3217 OH2 TIP3X1217 -27.624 12.094 3.106 0.00 0.00 WT1 O
+ATOM 3218 H1 TIP3X1217 -27.376 11.383 3.680 0.00 0.00 WT1 H
+ATOM 3219 H2 TIP3X1217 -28.286 12.529 3.664 0.00 0.00 WT1 H
+ATOM 3220 OH2 TIP3X1218 -13.523 15.551 30.686 0.00 0.00 WT1 O
+ATOM 3221 H1 TIP3X1218 -12.911 16.104 30.038 0.00 0.00 WT1 H
+ATOM 3222 H2 TIP3X1218 -14.397 15.942 30.507 0.00 0.00 WT1 H
+ATOM 3223 OH2 TIP3X1219 -22.984 24.785 -21.154 0.00 0.00 WT1 O
+ATOM 3224 H1 TIP3X1219 -23.706 24.799 -20.479 0.00 0.00 WT1 H
+ATOM 3225 H2 TIP3X1219 -22.360 25.455 -20.840 0.00 0.00 WT1 H
+ATOM 3226 OH2 TIP3X1220 -16.718 21.691 -30.041 0.00 0.00 WT1 O
+ATOM 3227 H1 TIP3X1220 -16.678 21.333 -30.979 0.00 0.00 WT1 H
+ATOM 3228 H2 TIP3X1220 -17.231 21.077 -29.571 0.00 0.00 WT1 H
+ATOM 3229 OH2 TIP3X1221 -24.866 14.348 19.850 0.00 0.00 WT1 O
+ATOM 3230 H1 TIP3X1221 -23.991 14.239 20.260 0.00 0.00 WT1 H
+ATOM 3231 H2 TIP3X1221 -25.156 13.425 19.741 0.00 0.00 WT1 H
+ATOM 3232 OH2 TIP3X1222 -20.544 13.866 -15.705 0.00 0.00 WT1 O
+ATOM 3233 H1 TIP3X1222 -20.698 14.844 -15.733 0.00 0.00 WT1 H
+ATOM 3234 H2 TIP3X1222 -19.737 13.790 -15.177 0.00 0.00 WT1 H
+ATOM 3235 OH2 TIP3X1223 -16.279 12.011 -27.815 0.00 0.00 WT1 O
+ATOM 3236 H1 TIP3X1223 -15.688 12.709 -27.445 0.00 0.00 WT1 H
+ATOM 3237 H2 TIP3X1223 -16.450 12.419 -28.666 0.00 0.00 WT1 H
+ATOM 3238 OH2 TIP3X1224 -14.268 13.776 -18.757 0.00 0.00 WT1 O
+ATOM 3239 H1 TIP3X1224 -13.440 13.755 -19.255 0.00 0.00 WT1 H
+ATOM 3240 H2 TIP3X1224 -14.975 13.914 -19.362 0.00 0.00 WT1 H
+ATOM 3241 OH2 TIP3X1225 -23.512 28.274 -13.232 0.00 0.00 WT1 O
+ATOM 3242 H1 TIP3X1225 -23.715 27.654 -13.894 0.00 0.00 WT1 H
+ATOM 3243 H2 TIP3X1225 -23.744 27.819 -12.339 0.00 0.00 WT1 H
+ATOM 3244 OH2 TIP3X1226 -21.436 26.782 -18.075 0.00 0.00 WT1 O
+ATOM 3245 H1 TIP3X1226 -21.296 26.074 -17.462 0.00 0.00 WT1 H
+ATOM 3246 H2 TIP3X1226 -21.184 26.357 -18.920 0.00 0.00 WT1 H
+ATOM 3247 OH2 TIP3X1227 27.334 5.563 -26.096 0.00 0.00 WT1 O
+ATOM 3248 H1 TIP3X1227 28.033 6.234 -26.229 0.00 0.00 WT1 H
+ATOM 3249 H2 TIP3X1227 26.690 5.684 -26.860 0.00 0.00 WT1 H
+ATOM 3250 OH2 TIP3X1228 25.271 18.036 -2.691 0.00 0.00 WT1 O
+ATOM 3251 H1 TIP3X1228 24.717 17.679 -3.434 0.00 0.00 WT1 H
+ATOM 3252 H2 TIP3X1228 25.893 18.629 -3.180 0.00 0.00 WT1 H
+ATOM 3253 OH2 TIP3X1229 -13.529 22.420 1.038 0.00 0.00 WT1 O
+ATOM 3254 H1 TIP3X1229 -13.298 22.930 0.253 0.00 0.00 WT1 H
+ATOM 3255 H2 TIP3X1229 -14.184 23.028 1.435 0.00 0.00 WT1 H
+ATOM 3256 OH2 TIP3X1230 -24.328 17.059 7.897 0.00 0.00 WT1 O
+ATOM 3257 H1 TIP3X1230 -25.226 16.733 7.747 0.00 0.00 WT1 H
+ATOM 3258 H2 TIP3X1230 -24.323 17.500 8.770 0.00 0.00 WT1 H
+ATOM 3259 OH2 TIP3X1231 -18.908 28.037 16.574 0.00 0.00 WT1 O
+ATOM 3260 H1 TIP3X1231 -19.361 28.590 17.262 0.00 0.00 WT1 H
+ATOM 3261 H2 TIP3X1231 -18.528 28.647 15.958 0.00 0.00 WT1 H
+ATOM 3262 OH2 TIP3X1232 -13.004 13.691 14.078 0.00 0.00 WT1 O
+ATOM 3263 H1 TIP3X1232 -12.116 14.025 14.239 0.00 0.00 WT1 H
+ATOM 3264 H2 TIP3X1232 -13.254 13.403 14.988 0.00 0.00 WT1 H
+ATOM 3265 OH2 TIP3X1233 25.410 8.081 12.114 0.00 0.00 WT1 O
+ATOM 3266 H1 TIP3X1233 25.710 8.039 11.189 0.00 0.00 WT1 H
+ATOM 3267 H2 TIP3X1233 24.411 8.105 12.092 0.00 0.00 WT1 H
+ATOM 3268 OH2 TIP3X1234 -19.579 6.058 12.042 0.00 0.00 WT1 O
+ATOM 3269 H1 TIP3X1234 -20.012 5.347 11.506 0.00 0.00 WT1 H
+ATOM 3270 H2 TIP3X1234 -20.157 5.948 12.878 0.00 0.00 WT1 H
+ATOM 3271 OH2 TIP3X1235 -27.839 19.698 24.718 0.00 0.00 WT1 O
+ATOM 3272 H1 TIP3X1235 -27.050 20.204 24.978 0.00 0.00 WT1 H
+ATOM 3273 H2 TIP3X1235 -27.436 18.887 24.356 0.00 0.00 WT1 H
+ATOM 3274 OH2 TIP3X1236 30.413 19.141 25.632 0.00 0.00 WT1 O
+ATOM 3275 H1 TIP3X1236 31.368 19.278 26.025 0.00 0.00 WT1 H
+ATOM 3276 H2 TIP3X1236 29.836 19.083 26.362 0.00 0.00 WT1 H
+ATOM 3277 OH2 TIP3X1237 -21.845 7.266 26.898 0.00 0.00 WT1 O
+ATOM 3278 H1 TIP3X1237 -21.462 6.531 27.368 0.00 0.00 WT1 H
+ATOM 3279 H2 TIP3X1237 -22.200 6.871 26.047 0.00 0.00 WT1 H
+ATOM 3280 OH2 TIP3X1238 -4.383 5.973 30.446 0.00 0.00 WT1 O
+ATOM 3281 H1 TIP3X1238 -3.793 5.675 29.791 0.00 0.00 WT1 H
+ATOM 3282 H2 TIP3X1238 -4.773 6.752 29.970 0.00 0.00 WT1 H
+ATOM 3283 OH2 TIP3X1239 -22.918 20.986 25.070 0.00 0.00 WT1 O
+ATOM 3284 H1 TIP3X1239 -23.206 21.902 25.054 0.00 0.00 WT1 H
+ATOM 3285 H2 TIP3X1239 -22.044 20.882 25.575 0.00 0.00 WT1 H
+ATOM 3286 OH2 TIP3X1240 -28.548 31.049 -19.638 0.00 0.00 WT1 O
+ATOM 3287 H1 TIP3X1240 -28.899 30.733 -20.458 0.00 0.00 WT1 H
+ATOM 3288 H2 TIP3X1240 -29.283 31.546 -19.253 0.00 0.00 WT1 H
+ATOM 3289 OH2 TIP3X1242 -15.762 18.352 -28.319 0.00 0.00 WT1 O
+ATOM 3290 H1 TIP3X1242 -16.480 18.780 -28.794 0.00 0.00 WT1 H
+ATOM 3291 H2 TIP3X1242 -15.567 18.992 -27.614 0.00 0.00 WT1 H
+ATOM 3292 OH2 TIP3X1244 -16.602 28.419 -10.127 0.00 0.00 WT1 O
+ATOM 3293 H1 TIP3X1244 -17.268 27.712 -9.946 0.00 0.00 WT1 H
+ATOM 3294 H2 TIP3X1244 -15.781 28.107 -9.696 0.00 0.00 WT1 H
+ATOM 3295 OH2 TIP3X1247 -25.759 31.181 -13.046 0.00 0.00 WT1 O
+ATOM 3296 H1 TIP3X1247 -25.098 31.894 -13.221 0.00 0.00 WT1 H
+ATOM 3297 H2 TIP3X1247 -26.678 31.626 -13.087 0.00 0.00 WT1 H
+ATOM 3298 OH2 TIP3X1248 -26.066 15.362 -9.101 0.00 0.00 WT1 O
+ATOM 3299 H1 TIP3X1248 -26.728 15.718 -8.618 0.00 0.00 WT1 H
+ATOM 3300 H2 TIP3X1248 -25.997 14.410 -8.871 0.00 0.00 WT1 H
+ATOM 3301 OH2 TIP3X1249 -26.455 20.237 2.703 0.00 0.00 WT1 O
+ATOM 3302 H1 TIP3X1249 -26.089 19.954 3.575 0.00 0.00 WT1 H
+ATOM 3303 H2 TIP3X1249 -26.004 19.537 2.187 0.00 0.00 WT1 H
+ATOM 3304 OH2 TIP3X1251 -15.387 25.812 12.095 0.00 0.00 WT1 O
+ATOM 3305 H1 TIP3X1251 -16.356 25.785 12.177 0.00 0.00 WT1 H
+ATOM 3306 H2 TIP3X1251 -15.221 26.154 11.188 0.00 0.00 WT1 H
+ATOM 3307 OH2 TIP3X1253 -27.815 -16.421 26.090 0.00 0.00 WT1 O
+ATOM 3308 H1 TIP3X1253 -26.984 -15.949 26.110 0.00 0.00 WT1 H
+ATOM 3309 H2 TIP3X1253 -27.760 -16.990 25.316 0.00 0.00 WT1 H
+ATOM 3310 OH2 TIP3X1255 -18.698 25.134 18.140 0.00 0.00 WT1 O
+ATOM 3311 H1 TIP3X1255 -17.996 25.462 18.719 0.00 0.00 WT1 H
+ATOM 3312 H2 TIP3X1255 -18.662 25.824 17.506 0.00 0.00 WT1 H
+ATOM 3313 OH2 TIP3X1257 -25.935 9.564 18.608 0.00 0.00 WT1 O
+ATOM 3314 H1 TIP3X1257 -26.059 9.622 17.628 0.00 0.00 WT1 H
+ATOM 3315 H2 TIP3X1257 -26.724 9.061 18.906 0.00 0.00 WT1 H
+ATOM 3316 OH2 TIP3X1258 -29.924 28.875 -28.852 0.00 0.00 WT1 O
+ATOM 3317 H1 TIP3X1258 -30.879 28.997 -29.154 0.00 0.00 WT1 H
+ATOM 3318 H2 TIP3X1258 -29.388 28.630 -29.676 0.00 0.00 WT1 H
+ATOM 3319 OH2 TIP3X1261 -23.818 26.206 28.261 0.00 0.00 WT1 O
+ATOM 3320 H1 TIP3X1261 -24.184 26.540 27.354 0.00 0.00 WT1 H
+ATOM 3321 H2 TIP3X1261 -24.530 26.353 28.848 0.00 0.00 WT1 H
+ATOM 3322 OH2 TIP3X1263 -14.256 16.146 -20.545 0.00 0.00 WT1 O
+ATOM 3323 H1 TIP3X1263 -14.911 16.850 -20.517 0.00 0.00 WT1 H
+ATOM 3324 H2 TIP3X1263 -13.760 16.175 -19.687 0.00 0.00 WT1 H
+ATOM 3325 OH2 TIP3X1264 -29.900 21.528 24.599 0.00 0.00 WT1 O
+ATOM 3326 H1 TIP3X1264 -29.031 22.031 24.474 0.00 0.00 WT1 H
+ATOM 3327 H2 TIP3X1264 -29.648 20.603 24.469 0.00 0.00 WT1 H
+ATOM 3328 OH2 TIP3X1265 -25.347 21.563 -23.459 0.00 0.00 WT1 O
+ATOM 3329 H1 TIP3X1265 -25.759 21.423 -22.600 0.00 0.00 WT1 H
+ATOM 3330 H2 TIP3X1265 -24.503 22.039 -23.242 0.00 0.00 WT1 H
+ATOM 3331 OH2 TIP3X1266 -24.401 25.197 -14.122 0.00 0.00 WT1 O
+ATOM 3332 H1 TIP3X1266 -25.166 25.271 -13.559 0.00 0.00 WT1 H
+ATOM 3333 H2 TIP3X1266 -24.559 25.778 -14.832 0.00 0.00 WT1 H
+ATOM 3334 OH2 TIP3X1267 -20.572 14.867 -27.270 0.00 0.00 WT1 O
+ATOM 3335 H1 TIP3X1267 -20.111 14.683 -26.437 0.00 0.00 WT1 H
+ATOM 3336 H2 TIP3X1267 -19.936 14.638 -27.942 0.00 0.00 WT1 H
+ATOM 3337 OH2 TIP3X1268 26.342 8.633 -15.237 0.00 0.00 WT1 O
+ATOM 3338 H1 TIP3X1268 26.714 9.528 -15.183 0.00 0.00 WT1 H
+ATOM 3339 H2 TIP3X1268 27.090 8.112 -14.899 0.00 0.00 WT1 H
+ATOM 3340 OH2 TIP3X1269 -28.349 27.758 -9.583 0.00 0.00 WT1 O
+ATOM 3341 H1 TIP3X1269 -28.281 28.654 -9.876 0.00 0.00 WT1 H
+ATOM 3342 H2 TIP3X1269 -28.640 27.247 -10.377 0.00 0.00 WT1 H
+ATOM 3343 OH2 TIP3X1270 -24.644 24.776 -2.214 0.00 0.00 WT1 O
+ATOM 3344 H1 TIP3X1270 -24.382 25.542 -2.691 0.00 0.00 WT1 H
+ATOM 3345 H2 TIP3X1270 -25.094 24.190 -2.785 0.00 0.00 WT1 H
+ATOM 3346 OH2 TIP3X1271 -17.909 9.705 -10.644 0.00 0.00 WT1 O
+ATOM 3347 H1 TIP3X1271 -17.287 10.078 -11.226 0.00 0.00 WT1 H
+ATOM 3348 H2 TIP3X1271 -17.715 8.716 -10.647 0.00 0.00 WT1 H
+ATOM 3349 OH2 TIP3X1272 -23.212 -28.706 -7.373 0.00 0.00 WT1 O
+ATOM 3350 H1 TIP3X1272 -24.126 -28.430 -7.250 0.00 0.00 WT1 H
+ATOM 3351 H2 TIP3X1272 -22.829 -28.091 -7.981 0.00 0.00 WT1 H
+ATOM 3352 OH2 TIP3X1273 -26.464 23.602 15.608 0.00 0.00 WT1 O
+ATOM 3353 H1 TIP3X1273 -26.644 23.841 16.506 0.00 0.00 WT1 H
+ATOM 3354 H2 TIP3X1273 -25.706 22.953 15.678 0.00 0.00 WT1 H
+ATOM 3355 OH2 TIP3X1274 -24.561 -30.940 2.760 0.00 0.00 WT1 O
+ATOM 3356 H1 TIP3X1274 -24.143 -30.084 2.514 0.00 0.00 WT1 H
+ATOM 3357 H2 TIP3X1274 -24.552 -31.454 1.976 0.00 0.00 WT1 H
+ATOM 3358 OH2 TIP3X1275 -27.153 14.235 22.297 0.00 0.00 WT1 O
+ATOM 3359 H1 TIP3X1275 -26.768 14.673 23.091 0.00 0.00 WT1 H
+ATOM 3360 H2 TIP3X1275 -26.321 13.986 21.836 0.00 0.00 WT1 H
+ATOM 3361 OH2 TIP3X1277 -26.762 28.868 14.234 0.00 0.00 WT1 O
+ATOM 3362 H1 TIP3X1277 -27.206 28.349 14.978 0.00 0.00 WT1 H
+ATOM 3363 H2 TIP3X1277 -27.309 28.620 13.491 0.00 0.00 WT1 H
+ATOM 3364 OH2 TIP3X1278 -28.908 16.300 10.597 0.00 0.00 WT1 O
+ATOM 3365 H1 TIP3X1278 -28.421 16.727 11.322 0.00 0.00 WT1 H
+ATOM 3366 H2 TIP3X1278 -29.737 16.768 10.450 0.00 0.00 WT1 H
+ATOM 3367 OH2 TIP3X1279 17.596 23.026 19.140 0.00 0.00 WT1 O
+ATOM 3368 H1 TIP3X1279 17.248 22.451 19.894 0.00 0.00 WT1 H
+ATOM 3369 H2 TIP3X1279 18.166 22.408 18.671 0.00 0.00 WT1 H
+ATOM 3370 OH2 TIP3X1281 -28.799 21.629 -23.657 0.00 0.00 WT1 O
+ATOM 3371 H1 TIP3X1281 -28.994 22.293 -23.034 0.00 0.00 WT1 H
+ATOM 3372 H2 TIP3X1281 -28.839 22.082 -24.506 0.00 0.00 WT1 H
+ATOM 3373 OH2 TIP3X1284 -20.803 23.096 -30.009 0.00 0.00 WT1 O
+ATOM 3374 H1 TIP3X1284 -21.255 23.622 -29.386 0.00 0.00 WT1 H
+ATOM 3375 H2 TIP3X1284 -20.087 23.697 -30.310 0.00 0.00 WT1 H
+ATOM 3376 OH2 TIP3X1285 -27.476 24.702 -26.981 0.00 0.00 WT1 O
+ATOM 3377 H1 TIP3X1285 -27.499 24.666 -27.971 0.00 0.00 WT1 H
+ATOM 3378 H2 TIP3X1285 -27.412 25.678 -26.842 0.00 0.00 WT1 H
+ATOM 3379 OH2 TIP3X1286 31.821 25.514 -12.153 0.00 0.00 WT1 O
+ATOM 3380 H1 TIP3X1286 31.731 25.972 -12.969 0.00 0.00 WT1 H
+ATOM 3381 H2 TIP3X1286 31.838 24.567 -12.391 0.00 0.00 WT1 H
+ATOM 3382 OH2 TIP3X1287 -26.557 17.524 -1.520 0.00 0.00 WT1 O
+ATOM 3383 H1 TIP3X1287 -26.703 17.265 -2.438 0.00 0.00 WT1 H
+ATOM 3384 H2 TIP3X1287 -27.287 17.241 -1.074 0.00 0.00 WT1 H
+ATOM 3385 OH2 TIP3X1288 22.677 28.646 0.572 0.00 0.00 WT1 O
+ATOM 3386 H1 TIP3X1288 23.614 28.906 0.608 0.00 0.00 WT1 H
+ATOM 3387 H2 TIP3X1288 22.404 29.003 -0.291 0.00 0.00 WT1 H
+ATOM 3388 OH2 TIP3X1289 -10.846 24.724 -3.677 0.00 0.00 WT1 O
+ATOM 3389 H1 TIP3X1289 -9.977 24.359 -3.527 0.00 0.00 WT1 H
+ATOM 3390 H2 TIP3X1289 -11.084 24.300 -4.508 0.00 0.00 WT1 H
+ATOM 3391 OH2 TIP3X1290 -19.438 29.753 -7.779 0.00 0.00 WT1 O
+ATOM 3392 H1 TIP3X1290 -20.172 30.359 -7.724 0.00 0.00 WT1 H
+ATOM 3393 H2 TIP3X1290 -19.036 30.059 -8.622 0.00 0.00 WT1 H
+ATOM 3394 OH2 TIP3X1291 -24.467 28.257 -7.269 0.00 0.00 WT1 O
+ATOM 3395 H1 TIP3X1291 -24.036 27.416 -7.208 0.00 0.00 WT1 H
+ATOM 3396 H2 TIP3X1291 -25.308 27.974 -6.929 0.00 0.00 WT1 H
+ATOM 3397 OH2 TIP3X1293 -11.052 25.994 -0.957 0.00 0.00 WT1 O
+ATOM 3398 H1 TIP3X1293 -10.712 26.734 -1.408 0.00 0.00 WT1 H
+ATOM 3399 H2 TIP3X1293 -10.460 25.334 -1.194 0.00 0.00 WT1 H
+ATOM 3400 OH2 TIP3X1294 -11.398 21.341 16.621 0.00 0.00 WT1 O
+ATOM 3401 H1 TIP3X1294 -10.838 21.962 17.190 0.00 0.00 WT1 H
+ATOM 3402 H2 TIP3X1294 -10.771 20.904 16.016 0.00 0.00 WT1 H
+ATOM 3403 OH2 TIP3X1295 -27.094 17.291 7.381 0.00 0.00 WT1 O
+ATOM 3404 H1 TIP3X1295 -26.605 18.094 7.278 0.00 0.00 WT1 H
+ATOM 3405 H2 TIP3X1295 -26.920 16.822 6.608 0.00 0.00 WT1 H
+ATOM 3406 OH2 TIP3X1296 29.117 28.388 22.440 0.00 0.00 WT1 O
+ATOM 3407 H1 TIP3X1296 29.970 28.161 21.953 0.00 0.00 WT1 H
+ATOM 3408 H2 TIP3X1296 29.300 29.330 22.801 0.00 0.00 WT1 H
+ATOM 3409 OH2 TIP3X1297 -23.054 -21.729 11.693 0.00 0.00 WT1 O
+ATOM 3410 H1 TIP3X1297 -23.893 -22.115 12.038 0.00 0.00 WT1 H
+ATOM 3411 H2 TIP3X1297 -22.572 -22.500 11.429 0.00 0.00 WT1 H
+ATOM 3412 OH2 TIP3X1298 -31.148 -27.823 5.753 0.00 0.00 WT1 O
+ATOM 3413 H1 TIP3X1298 -30.276 -28.222 5.993 0.00 0.00 WT1 H
+ATOM 3414 H2 TIP3X1298 -31.768 -28.555 5.885 0.00 0.00 WT1 H
+ATOM 3415 OH2 TIP3X1299 19.646 23.453 24.983 0.00 0.00 WT1 O
+ATOM 3416 H1 TIP3X1299 20.358 22.720 25.087 0.00 0.00 WT1 H
+ATOM 3417 H2 TIP3X1299 20.128 24.139 24.625 0.00 0.00 WT1 H
+ATOM 3418 OH2 TIP3X1300 -18.139 22.618 16.193 0.00 0.00 WT1 O
+ATOM 3419 H1 TIP3X1300 -18.616 23.088 16.918 0.00 0.00 WT1 H
+ATOM 3420 H2 TIP3X1300 -17.393 23.170 15.960 0.00 0.00 WT1 H
+ATOM 3421 OH2 TIP3X1301 -28.680 -30.561 -28.307 0.00 0.00 WT1 O
+ATOM 3422 H1 TIP3X1301 -28.982 -30.737 -29.205 0.00 0.00 WT1 H
+ATOM 3423 H2 TIP3X1301 -27.782 -30.263 -28.467 0.00 0.00 WT1 H
+ATOM 3424 OH2 TIP3X1302 -24.154 10.641 28.055 0.00 0.00 WT1 O
+ATOM 3425 H1 TIP3X1302 -24.072 9.883 28.655 0.00 0.00 WT1 H
+ATOM 3426 H2 TIP3X1302 -24.572 10.182 27.197 0.00 0.00 WT1 H
+ATOM 3427 OH2 TIP3X1303 -29.937 30.836 -24.226 0.00 0.00 WT1 O
+ATOM 3428 H1 TIP3X1303 -29.203 30.461 -23.719 0.00 0.00 WT1 H
+ATOM 3429 H2 TIP3X1303 -29.474 31.225 -24.970 0.00 0.00 WT1 H
+ATOM 3430 OH2 TIP3X1305 31.803 -28.531 -27.224 0.00 0.00 WT1 O
+ATOM 3431 H1 TIP3X1305 31.854 -27.979 -26.453 0.00 0.00 WT1 H
+ATOM 3432 H2 TIP3X1305 30.855 -28.512 -27.424 0.00 0.00 WT1 H
+ATOM 3433 OH2 TIP3X1306 -22.300 30.774 -14.171 0.00 0.00 WT1 O
+ATOM 3434 H1 TIP3X1306 -22.704 29.929 -14.040 0.00 0.00 WT1 H
+ATOM 3435 H2 TIP3X1306 -22.643 31.327 -13.412 0.00 0.00 WT1 H
+ATOM 3436 OH2 TIP3X1307 -15.904 -23.595 -21.372 0.00 0.00 WT1 O
+ATOM 3437 H1 TIP3X1307 -15.915 -22.610 -21.285 0.00 0.00 WT1 H
+ATOM 3438 H2 TIP3X1307 -15.923 -23.652 -22.379 0.00 0.00 WT1 H
+ATOM 3439 OH2 TIP3X1308 -23.622 -9.164 -17.926 0.00 0.00 WT1 O
+ATOM 3440 H1 TIP3X1308 -22.873 -8.915 -18.522 0.00 0.00 WT1 H
+ATOM 3441 H2 TIP3X1308 -24.194 -8.348 -17.888 0.00 0.00 WT1 H
+ATOM 3442 OH2 TIP3X1309 -7.566 -27.226 1.071 0.00 0.00 WT1 O
+ATOM 3443 H1 TIP3X1309 -6.751 -27.245 0.565 0.00 0.00 WT1 H
+ATOM 3444 H2 TIP3X1309 -7.703 -28.185 1.213 0.00 0.00 WT1 H
+ATOM 3445 OH2 TIP3X1311 -20.145 -27.478 -2.161 0.00 0.00 WT1 O
+ATOM 3446 H1 TIP3X1311 -19.664 -28.276 -2.477 0.00 0.00 WT1 H
+ATOM 3447 H2 TIP3X1311 -20.668 -27.764 -1.433 0.00 0.00 WT1 H
+ATOM 3448 OH2 TIP3X1312 -27.266 30.913 0.208 0.00 0.00 WT1 O
+ATOM 3449 H1 TIP3X1312 -26.948 31.226 1.106 0.00 0.00 WT1 H
+ATOM 3450 H2 TIP3X1312 -27.855 31.686 0.010 0.00 0.00 WT1 H
+ATOM 3451 OH2 TIP3X1313 -21.574 -12.458 -4.936 0.00 0.00 WT1 O
+ATOM 3452 H1 TIP3X1313 -22.532 -12.612 -4.665 0.00 0.00 WT1 H
+ATOM 3453 H2 TIP3X1313 -21.347 -13.197 -5.571 0.00 0.00 WT1 H
+ATOM 3454 OH2 TIP3X1314 29.046 24.682 0.707 0.00 0.00 WT1 O
+ATOM 3455 H1 TIP3X1314 29.257 24.425 1.653 0.00 0.00 WT1 H
+ATOM 3456 H2 TIP3X1314 29.449 23.926 0.215 0.00 0.00 WT1 H
+ATOM 3457 OH2 TIP3X1316 -25.308 27.872 -3.550 0.00 0.00 WT1 O
+ATOM 3458 H1 TIP3X1316 -25.251 28.723 -4.092 0.00 0.00 WT1 H
+ATOM 3459 H2 TIP3X1316 -24.916 28.035 -2.679 0.00 0.00 WT1 H
+ATOM 3460 OH2 TIP3X1317 -22.921 -27.218 11.171 0.00 0.00 WT1 O
+ATOM 3461 H1 TIP3X1317 -22.091 -26.793 10.928 0.00 0.00 WT1 H
+ATOM 3462 H2 TIP3X1317 -22.716 -27.955 11.674 0.00 0.00 WT1 H
+ATOM 3463 OH2 TIP3X1319 29.176 26.307 6.505 0.00 0.00 WT1 O
+ATOM 3464 H1 TIP3X1319 28.618 27.088 6.771 0.00 0.00 WT1 H
+ATOM 3465 H2 TIP3X1319 28.903 26.026 5.621 0.00 0.00 WT1 H
+ATOM 3466 OH2 TIP3X1320 -21.534 26.878 17.365 0.00 0.00 WT1 O
+ATOM 3467 H1 TIP3X1320 -20.745 27.019 16.776 0.00 0.00 WT1 H
+ATOM 3468 H2 TIP3X1320 -22.140 27.646 17.225 0.00 0.00 WT1 H
+ATOM 3469 OH2 TIP3X1321 -16.380 -10.308 22.144 0.00 0.00 WT1 O
+ATOM 3470 H1 TIP3X1321 -17.215 -10.922 22.196 0.00 0.00 WT1 H
+ATOM 3471 H2 TIP3X1321 -16.808 -9.441 22.129 0.00 0.00 WT1 H
+ATOM 3472 OH2 TIP3X1324 -18.718 23.229 -23.987 0.00 0.00 WT1 O
+ATOM 3473 H1 TIP3X1324 -18.556 24.157 -24.243 0.00 0.00 WT1 H
+ATOM 3474 H2 TIP3X1324 -18.907 23.221 -22.987 0.00 0.00 WT1 H
+ATOM 3475 OH2 TIP3X1325 -11.535 21.285 19.881 0.00 0.00 WT1 O
+ATOM 3476 H1 TIP3X1325 -11.449 22.278 19.856 0.00 0.00 WT1 H
+ATOM 3477 H2 TIP3X1325 -10.781 21.063 20.430 0.00 0.00 WT1 H
+ATOM 3478 OH2 TIP3X1326 -13.521 -28.911 -30.622 0.00 0.00 WT1 O
+ATOM 3479 H1 TIP3X1326 -14.464 -28.792 -30.426 0.00 0.00 WT1 H
+ATOM 3480 H2 TIP3X1326 -13.398 -29.860 -30.803 0.00 0.00 WT1 H
+ATOM 3481 OH2 TIP3X1327 -16.471 -26.018 -23.481 0.00 0.00 WT1 O
+ATOM 3482 H1 TIP3X1327 -15.602 -26.368 -23.188 0.00 0.00 WT1 H
+ATOM 3483 H2 TIP3X1327 -16.777 -26.667 -24.133 0.00 0.00 WT1 H
+ATOM 3484 OH2 TIP3X1328 -27.461 -29.395 -23.705 0.00 0.00 WT1 O
+ATOM 3485 H1 TIP3X1328 -26.540 -29.298 -23.877 0.00 0.00 WT1 H
+ATOM 3486 H2 TIP3X1328 -27.566 -30.384 -23.637 0.00 0.00 WT1 H
+ATOM 3487 OH2 TIP3X1329 -11.972 -24.920 -22.978 0.00 0.00 WT1 O
+ATOM 3488 H1 TIP3X1329 -11.325 -24.285 -22.918 0.00 0.00 WT1 H
+ATOM 3489 H2 TIP3X1329 -12.615 -24.427 -23.473 0.00 0.00 WT1 H
+ATOM 3490 OH2 TIP3X1330 -9.990 -20.972 -13.553 0.00 0.00 WT1 O
+ATOM 3491 H1 TIP3X1330 -9.281 -20.939 -14.299 0.00 0.00 WT1 H
+ATOM 3492 H2 TIP3X1330 -9.410 -20.860 -12.780 0.00 0.00 WT1 H
+ATOM 3493 OH2 TIP3X1332 -17.323 -29.212 -2.699 0.00 0.00 WT1 O
+ATOM 3494 H1 TIP3X1332 -17.340 -28.370 -3.189 0.00 0.00 WT1 H
+ATOM 3495 H2 TIP3X1332 -17.459 -29.798 -3.447 0.00 0.00 WT1 H
+ATOM 3496 OH2 TIP3X1333 -13.650 -25.022 -14.385 0.00 0.00 WT1 O
+ATOM 3497 H1 TIP3X1333 -13.585 -24.709 -15.298 0.00 0.00 WT1 H
+ATOM 3498 H2 TIP3X1333 -14.602 -24.841 -14.216 0.00 0.00 WT1 H
+ATOM 3499 OH2 TIP3X1334 -13.328 -24.138 11.610 0.00 0.00 WT1 O
+ATOM 3500 H1 TIP3X1334 -12.390 -24.199 11.449 0.00 0.00 WT1 H
+ATOM 3501 H2 TIP3X1334 -13.774 -23.812 10.824 0.00 0.00 WT1 H
+ATOM 3502 OH2 TIP3X1335 -24.100 25.685 6.279 0.00 0.00 WT1 O
+ATOM 3503 H1 TIP3X1335 -23.657 25.964 7.090 0.00 0.00 WT1 H
+ATOM 3504 H2 TIP3X1335 -23.455 25.520 5.625 0.00 0.00 WT1 H
+ATOM 3505 OH2 TIP3X1336 -28.437 28.558 11.188 0.00 0.00 WT1 O
+ATOM 3506 H1 TIP3X1336 -27.622 28.856 10.686 0.00 0.00 WT1 H
+ATOM 3507 H2 TIP3X1336 -29.031 29.258 11.082 0.00 0.00 WT1 H
+ATOM 3508 OH2 TIP3X1337 -20.409 -23.497 11.201 0.00 0.00 WT1 O
+ATOM 3509 H1 TIP3X1337 -20.667 -24.449 11.264 0.00 0.00 WT1 H
+ATOM 3510 H2 TIP3X1337 -19.534 -23.551 11.534 0.00 0.00 WT1 H
+ATOM 3511 OH2 TIP3X1338 -13.065 18.367 26.193 0.00 0.00 WT1 O
+ATOM 3512 H1 TIP3X1338 -12.661 18.228 27.045 0.00 0.00 WT1 H
+ATOM 3513 H2 TIP3X1338 -13.937 18.646 26.459 0.00 0.00 WT1 H
+ATOM 3514 OH2 TIP3X1339 31.212 -29.167 13.212 0.00 0.00 WT1 O
+ATOM 3515 H1 TIP3X1339 31.793 -29.646 13.800 0.00 0.00 WT1 H
+ATOM 3516 H2 TIP3X1339 31.817 -29.080 12.400 0.00 0.00 WT1 H
+ATOM 3517 OH2 TIP3X1340 -22.027 -26.587 18.615 0.00 0.00 WT1 O
+ATOM 3518 H1 TIP3X1340 -22.385 -25.824 18.119 0.00 0.00 WT1 H
+ATOM 3519 H2 TIP3X1340 -21.956 -27.260 17.905 0.00 0.00 WT1 H
+ATOM 3520 OH2 TIP3X1342 -24.141 -21.071 20.516 0.00 0.00 WT1 O
+ATOM 3521 H1 TIP3X1342 -23.342 -21.236 20.956 0.00 0.00 WT1 H
+ATOM 3522 H2 TIP3X1342 -24.039 -20.163 20.103 0.00 0.00 WT1 H
+ATOM 3523 OH2 TIP3X1343 -20.630 -14.534 21.036 0.00 0.00 WT1 O
+ATOM 3524 H1 TIP3X1343 -20.286 -14.431 20.142 0.00 0.00 WT1 H
+ATOM 3525 H2 TIP3X1343 -21.073 -13.665 21.193 0.00 0.00 WT1 H
+ATOM 3526 OH2 TIP3X1344 -23.117 -10.419 -26.240 0.00 0.00 WT1 O
+ATOM 3527 H1 TIP3X1344 -23.295 -9.768 -25.554 0.00 0.00 WT1 H
+ATOM 3528 H2 TIP3X1344 -22.643 -9.992 -26.923 0.00 0.00 WT1 H
+ATOM 3529 OH2 TIP3X1346 -12.601 -19.636 -30.020 0.00 0.00 WT1 O
+ATOM 3530 H1 TIP3X1346 -12.285 -20.501 -30.402 0.00 0.00 WT1 H
+ATOM 3531 H2 TIP3X1346 -12.909 -19.941 -29.154 0.00 0.00 WT1 H
+ATOM 3532 OH2 TIP3X1347 -7.835 -25.181 -26.225 0.00 0.00 WT1 O
+ATOM 3533 H1 TIP3X1347 -8.133 -25.390 -27.127 0.00 0.00 WT1 H
+ATOM 3534 H2 TIP3X1347 -8.638 -24.823 -25.749 0.00 0.00 WT1 H
+ATOM 3535 OH2 TIP3X1348 -18.629 -25.658 29.582 0.00 0.00 WT1 O
+ATOM 3536 H1 TIP3X1348 -18.614 -25.321 28.661 0.00 0.00 WT1 H
+ATOM 3537 H2 TIP3X1348 -19.127 -26.505 29.533 0.00 0.00 WT1 H
+ATOM 3538 OH2 TIP3X1349 -19.207 -18.636 -19.832 0.00 0.00 WT1 O
+ATOM 3539 H1 TIP3X1349 -19.213 -18.452 -20.777 0.00 0.00 WT1 H
+ATOM 3540 H2 TIP3X1349 -20.005 -18.206 -19.601 0.00 0.00 WT1 H
+ATOM 3541 OH2 TIP3X1350 31.554 -23.014 -9.653 0.00 0.00 WT1 O
+ATOM 3542 H1 TIP3X1350 31.932 -22.768 -10.533 0.00 0.00 WT1 H
+ATOM 3543 H2 TIP3X1350 30.728 -22.490 -9.665 0.00 0.00 WT1 H
+ATOM 3544 OH2 TIP3X1352 -25.333 -24.453 -22.354 0.00 0.00 WT1 O
+ATOM 3545 H1 TIP3X1352 -25.897 -25.025 -21.704 0.00 0.00 WT1 H
+ATOM 3546 H2 TIP3X1352 -24.442 -24.708 -21.954 0.00 0.00 WT1 H
+ATOM 3547 OH2 TIP3X1353 -8.937 30.008 -13.967 0.00 0.00 WT1 O
+ATOM 3548 H1 TIP3X1353 -9.399 30.481 -13.297 0.00 0.00 WT1 H
+ATOM 3549 H2 TIP3X1353 -9.439 30.096 -14.795 0.00 0.00 WT1 H
+ATOM 3550 OH2 TIP3X1354 -31.818 -8.597 -10.639 0.00 0.00 WT1 O
+ATOM 3551 H1 TIP3X1354 -31.699 -8.415 -9.654 0.00 0.00 WT1 H
+ATOM 3552 H2 TIP3X1354 -30.999 -9.133 -10.780 0.00 0.00 WT1 H
+ATOM 3553 OH2 TIP3X1355 -20.653 -15.993 -8.852 0.00 0.00 WT1 O
+ATOM 3554 H1 TIP3X1355 -20.221 -16.874 -8.913 0.00 0.00 WT1 H
+ATOM 3555 H2 TIP3X1355 -21.414 -16.077 -9.419 0.00 0.00 WT1 H
+ATOM 3556 OH2 TIP3X1356 -26.219 -23.030 -6.064 0.00 0.00 WT1 O
+ATOM 3557 H1 TIP3X1356 -25.821 -22.823 -6.947 0.00 0.00 WT1 H
+ATOM 3558 H2 TIP3X1356 -25.529 -23.567 -5.637 0.00 0.00 WT1 H
+ATOM 3559 OH2 TIP3X1357 -18.572 -23.361 8.687 0.00 0.00 WT1 O
+ATOM 3560 H1 TIP3X1357 -19.100 -23.398 7.879 0.00 0.00 WT1 H
+ATOM 3561 H2 TIP3X1357 -19.199 -23.134 9.424 0.00 0.00 WT1 H
+ATOM 3562 OH2 TIP3X1359 -19.227 -23.902 24.015 0.00 0.00 WT1 O
+ATOM 3563 H1 TIP3X1359 -18.714 -23.071 23.947 0.00 0.00 WT1 H
+ATOM 3564 H2 TIP3X1359 -18.923 -24.360 23.212 0.00 0.00 WT1 H
+ATOM 3565 OH2 TIP3X1361 -14.743 -2.319 1.676 0.00 0.00 WT1 O
+ATOM 3566 H1 TIP3X1361 -14.802 -1.369 1.366 0.00 0.00 WT1 H
+ATOM 3567 H2 TIP3X1361 -15.648 -2.583 1.384 0.00 0.00 WT1 H
+ATOM 3568 OH2 TIP3X1362 -15.406 -29.702 30.603 0.00 0.00 WT1 O
+ATOM 3569 H1 TIP3X1362 -15.761 -30.516 31.031 0.00 0.00 WT1 H
+ATOM 3570 H2 TIP3X1362 -15.630 -29.779 29.630 0.00 0.00 WT1 H
+ATOM 3571 OH2 TIP3X1363 -6.322 -7.868 20.222 0.00 0.00 WT1 O
+ATOM 3572 H1 TIP3X1363 -6.790 -7.863 21.089 0.00 0.00 WT1 H
+ATOM 3573 H2 TIP3X1363 -6.392 -8.830 20.001 0.00 0.00 WT1 H
+ATOM 3574 OH2 TIP3X1364 -23.734 29.840 28.376 0.00 0.00 WT1 O
+ATOM 3575 H1 TIP3X1364 -23.376 30.596 28.771 0.00 0.00 WT1 H
+ATOM 3576 H2 TIP3X1364 -23.898 30.041 27.450 0.00 0.00 WT1 H
+ATOM 3577 OH2 TIP3X1365 -20.417 -21.549 26.551 0.00 0.00 WT1 O
+ATOM 3578 H1 TIP3X1365 -20.990 -22.158 26.129 0.00 0.00 WT1 H
+ATOM 3579 H2 TIP3X1365 -20.770 -21.361 27.421 0.00 0.00 WT1 H
+ATOM 3580 OH2 TIP3X1367 -21.871 -14.515 -25.450 0.00 0.00 WT1 O
+ATOM 3581 H1 TIP3X1367 -22.769 -14.533 -25.080 0.00 0.00 WT1 H
+ATOM 3582 H2 TIP3X1367 -21.892 -15.298 -26.015 0.00 0.00 WT1 H
+ATOM 3583 OH2 TIP3X1368 -9.588 -24.394 -19.335 0.00 0.00 WT1 O
+ATOM 3584 H1 TIP3X1368 -10.148 -24.020 -18.612 0.00 0.00 WT1 H
+ATOM 3585 H2 TIP3X1368 -10.042 -25.231 -19.507 0.00 0.00 WT1 H
+ATOM 3586 OH2 TIP3X1369 -2.920 -18.222 28.127 0.00 0.00 WT1 O
+ATOM 3587 H1 TIP3X1369 -2.234 -18.894 28.386 0.00 0.00 WT1 H
+ATOM 3588 H2 TIP3X1369 -2.737 -17.502 28.748 0.00 0.00 WT1 H
+ATOM 3589 OH2 TIP3X1370 -27.346 -26.283 -26.977 0.00 0.00 WT1 O
+ATOM 3590 H1 TIP3X1370 -26.941 -26.874 -27.605 0.00 0.00 WT1 H
+ATOM 3591 H2 TIP3X1370 -26.591 -26.215 -26.366 0.00 0.00 WT1 H
+ATOM 3592 OH2 TIP3X1371 -19.664 -17.095 -22.650 0.00 0.00 WT1 O
+ATOM 3593 H1 TIP3X1371 -20.151 -16.412 -23.117 0.00 0.00 WT1 H
+ATOM 3594 H2 TIP3X1371 -20.432 -17.625 -22.230 0.00 0.00 WT1 H
+ATOM 3595 OH2 TIP3X1372 -26.813 -30.301 -7.312 0.00 0.00 WT1 O
+ATOM 3596 H1 TIP3X1372 -26.504 -29.407 -7.261 0.00 0.00 WT1 H
+ATOM 3597 H2 TIP3X1372 -27.831 -30.127 -7.233 0.00 0.00 WT1 H
+ATOM 3598 OH2 TIP3X1373 -30.379 30.852 -12.519 0.00 0.00 WT1 O
+ATOM 3599 H1 TIP3X1373 -30.102 30.273 -13.245 0.00 0.00 WT1 H
+ATOM 3600 H2 TIP3X1373 -31.311 30.972 -12.739 0.00 0.00 WT1 H
+ATOM 3601 OH2 TIP3X1374 -26.512 -17.745 -18.788 0.00 0.00 WT1 O
+ATOM 3602 H1 TIP3X1374 -25.721 -17.874 -18.291 0.00 0.00 WT1 H
+ATOM 3603 H2 TIP3X1374 -27.136 -18.009 -18.122 0.00 0.00 WT1 H
+ATOM 3604 OH2 TIP3X1375 25.378 -21.841 -19.799 0.00 0.00 WT1 O
+ATOM 3605 H1 TIP3X1375 25.539 -22.610 -19.229 0.00 0.00 WT1 H
+ATOM 3606 H2 TIP3X1375 25.942 -21.141 -19.399 0.00 0.00 WT1 H
+ATOM 3607 OH2 TIP3X1376 -19.402 -18.842 -8.819 0.00 0.00 WT1 O
+ATOM 3608 H1 TIP3X1376 -19.831 -18.794 -7.931 0.00 0.00 WT1 H
+ATOM 3609 H2 TIP3X1376 -18.484 -18.977 -8.537 0.00 0.00 WT1 H
+ATOM 3610 OH2 TIP3X1377 28.412 26.397 -5.705 0.00 0.00 WT1 O
+ATOM 3611 H1 TIP3X1377 28.733 25.795 -6.306 0.00 0.00 WT1 H
+ATOM 3612 H2 TIP3X1377 29.179 27.061 -5.652 0.00 0.00 WT1 H
+ATOM 3613 OH2 TIP3X1378 -15.617 -21.866 19.911 0.00 0.00 WT1 O
+ATOM 3614 H1 TIP3X1378 -15.634 -22.748 19.418 0.00 0.00 WT1 H
+ATOM 3615 H2 TIP3X1378 -16.538 -21.822 20.239 0.00 0.00 WT1 H
+ATOM 3616 OH2 TIP3X1379 -20.536 -29.199 8.572 0.00 0.00 WT1 O
+ATOM 3617 H1 TIP3X1379 -20.776 -28.277 8.638 0.00 0.00 WT1 H
+ATOM 3618 H2 TIP3X1379 -19.611 -29.167 9.000 0.00 0.00 WT1 H
+ATOM 3619 OH2 TIP3X1380 -25.593 -13.995 11.745 0.00 0.00 WT1 O
+ATOM 3620 H1 TIP3X1380 -24.820 -14.049 11.226 0.00 0.00 WT1 H
+ATOM 3621 H2 TIP3X1380 -25.896 -13.033 11.615 0.00 0.00 WT1 H
+ATOM 3622 OH2 TIP3X1381 -27.178 -13.110 29.898 0.00 0.00 WT1 O
+ATOM 3623 H1 TIP3X1381 -27.202 -14.080 29.713 0.00 0.00 WT1 H
+ATOM 3624 H2 TIP3X1381 -26.941 -12.702 29.059 0.00 0.00 WT1 H
+ATOM 3625 OH2 TIP3X1382 -29.161 -28.827 24.293 0.00 0.00 WT1 O
+ATOM 3626 H1 TIP3X1382 -29.896 -28.306 23.913 0.00 0.00 WT1 H
+ATOM 3627 H2 TIP3X1382 -28.709 -28.122 24.790 0.00 0.00 WT1 H
+ATOM 3628 OH2 TIP3X1383 -31.514 -25.258 20.077 0.00 0.00 WT1 O
+ATOM 3629 H1 TIP3X1383 -31.898 -24.630 19.450 0.00 0.00 WT1 H
+ATOM 3630 H2 TIP3X1383 -31.690 -24.875 20.949 0.00 0.00 WT1 H
+ATOM 3631 OH2 TIP3X1384 -12.101 -21.062 28.513 0.00 0.00 WT1 O
+ATOM 3632 H1 TIP3X1384 -11.849 -21.985 28.738 0.00 0.00 WT1 H
+ATOM 3633 H2 TIP3X1384 -12.526 -20.777 29.354 0.00 0.00 WT1 H
+ATOM 3634 OH2 TIP3X1387 -28.314 -23.647 -28.599 0.00 0.00 WT1 O
+ATOM 3635 H1 TIP3X1387 -27.506 -24.070 -28.916 0.00 0.00 WT1 H
+ATOM 3636 H2 TIP3X1387 -28.959 -24.273 -28.803 0.00 0.00 WT1 H
+ATOM 3637 OH2 TIP3X1388 -16.995 -17.474 -12.867 0.00 0.00 WT1 O
+ATOM 3638 H1 TIP3X1388 -16.258 -18.059 -12.762 0.00 0.00 WT1 H
+ATOM 3639 H2 TIP3X1388 -17.254 -17.547 -13.812 0.00 0.00 WT1 H
+ATOM 3640 OH2 TIP3X1389 -16.573 -18.101 -18.582 0.00 0.00 WT1 O
+ATOM 3641 H1 TIP3X1389 -16.402 -17.297 -18.085 0.00 0.00 WT1 H
+ATOM 3642 H2 TIP3X1389 -17.431 -17.968 -19.006 0.00 0.00 WT1 H
+ATOM 3643 OH2 TIP3X1390 -5.153 -17.745 26.304 0.00 0.00 WT1 O
+ATOM 3644 H1 TIP3X1390 -5.607 -18.544 26.632 0.00 0.00 WT1 H
+ATOM 3645 H2 TIP3X1390 -4.413 -17.652 26.934 0.00 0.00 WT1 H
+ATOM 3646 OH2 TIP3X1392 -16.883 -15.658 -16.680 0.00 0.00 WT1 O
+ATOM 3647 H1 TIP3X1392 -17.810 -15.342 -16.765 0.00 0.00 WT1 H
+ATOM 3648 H2 TIP3X1392 -16.275 -14.920 -17.050 0.00 0.00 WT1 H
+ATOM 3649 OH2 TIP3X1394 -18.035 -24.670 -3.722 0.00 0.00 WT1 O
+ATOM 3650 H1 TIP3X1394 -18.373 -23.798 -3.346 0.00 0.00 WT1 H
+ATOM 3651 H2 TIP3X1394 -17.866 -25.292 -2.971 0.00 0.00 WT1 H
+ATOM 3652 OH2 TIP3X1395 -28.265 -23.501 8.666 0.00 0.00 WT1 O
+ATOM 3653 H1 TIP3X1395 -28.902 -23.998 8.103 0.00 0.00 WT1 H
+ATOM 3654 H2 TIP3X1395 -28.680 -23.583 9.540 0.00 0.00 WT1 H
+ATOM 3655 OH2 TIP3X1396 -23.536 -11.074 -1.357 0.00 0.00 WT1 O
+ATOM 3656 H1 TIP3X1396 -23.281 -10.687 -0.502 0.00 0.00 WT1 H
+ATOM 3657 H2 TIP3X1396 -23.523 -12.038 -1.190 0.00 0.00 WT1 H
+ATOM 3658 OH2 TIP3X1397 29.000 -17.677 -1.000 0.00 0.00 WT1 O
+ATOM 3659 H1 TIP3X1397 28.408 -18.005 -1.669 0.00 0.00 WT1 H
+ATOM 3660 H2 TIP3X1397 28.996 -16.792 -1.200 0.00 0.00 WT1 H
+ATOM 3661 OH2 TIP3X1398 -16.372 -28.112 -0.051 0.00 0.00 WT1 O
+ATOM 3662 H1 TIP3X1398 -16.305 -28.597 -0.833 0.00 0.00 WT1 H
+ATOM 3663 H2 TIP3X1398 -16.313 -28.773 0.622 0.00 0.00 WT1 H
+ATOM 3664 OH2 TIP3X1399 -29.371 -13.046 19.784 0.00 0.00 WT1 O
+ATOM 3665 H1 TIP3X1399 -29.418 -14.062 19.805 0.00 0.00 WT1 H
+ATOM 3666 H2 TIP3X1399 -28.854 -12.842 20.596 0.00 0.00 WT1 H
+ATOM 3667 OH2 TIP3X1400 -25.072 -18.507 15.945 0.00 0.00 WT1 O
+ATOM 3668 H1 TIP3X1400 -25.622 -17.660 15.773 0.00 0.00 WT1 H
+ATOM 3669 H2 TIP3X1400 -24.385 -18.560 15.188 0.00 0.00 WT1 H
+ATOM 3670 OH2 TIP3X1401 -30.473 -25.271 7.885 0.00 0.00 WT1 O
+ATOM 3671 H1 TIP3X1401 -30.116 -26.019 7.390 0.00 0.00 WT1 H
+ATOM 3672 H2 TIP3X1401 -30.952 -25.737 8.593 0.00 0.00 WT1 H
+ATOM 3673 OH2 TIP3X1402 -21.592 -9.535 17.592 0.00 0.00 WT1 O
+ATOM 3674 H1 TIP3X1402 -21.125 -9.632 18.477 0.00 0.00 WT1 H
+ATOM 3675 H2 TIP3X1402 -21.197 -10.153 16.985 0.00 0.00 WT1 H
+ATOM 3676 OH2 TIP3X1404 -25.262 -13.924 14.398 0.00 0.00 WT1 O
+ATOM 3677 H1 TIP3X1404 -25.566 -13.018 14.692 0.00 0.00 WT1 H
+ATOM 3678 H2 TIP3X1404 -25.277 -13.902 13.416 0.00 0.00 WT1 H
+ATOM 3679 OH2 TIP3X1405 -18.205 31.048 12.609 0.00 0.00 WT1 O
+ATOM 3680 H1 TIP3X1405 -17.322 30.722 12.422 0.00 0.00 WT1 H
+ATOM 3681 H2 TIP3X1405 -18.769 30.614 11.921 0.00 0.00 WT1 H
+ATOM 3682 OH2 TIP3X1406 -0.251 -21.122 25.592 0.00 0.00 WT1 O
+ATOM 3683 H1 TIP3X1406 0.576 -20.757 25.840 0.00 0.00 WT1 H
+ATOM 3684 H2 TIP3X1406 -0.768 -20.288 25.432 0.00 0.00 WT1 H
+ATOM 3685 OH2 TIP3X1407 -18.737 -8.487 -24.674 0.00 0.00 WT1 O
+ATOM 3686 H1 TIP3X1407 -17.917 -8.100 -24.311 0.00 0.00 WT1 H
+ATOM 3687 H2 TIP3X1407 -18.331 -9.197 -25.261 0.00 0.00 WT1 H
+ATOM 3688 OH2 TIP3X1408 -27.711 -6.325 -30.525 0.00 0.00 WT1 O
+ATOM 3689 H1 TIP3X1408 -26.986 -6.703 -30.091 0.00 0.00 WT1 H
+ATOM 3690 H2 TIP3X1408 -28.372 -6.973 -30.487 0.00 0.00 WT1 H
+ATOM 3691 OH2 TIP3X1409 -29.402 -25.580 23.952 0.00 0.00 WT1 O
+ATOM 3692 H1 TIP3X1409 -28.751 -26.074 24.543 0.00 0.00 WT1 H
+ATOM 3693 H2 TIP3X1409 -28.837 -24.927 23.475 0.00 0.00 WT1 H
+ATOM 3694 OH2 TIP3X1410 -12.669 -17.928 28.759 0.00 0.00 WT1 O
+ATOM 3695 H1 TIP3X1410 -11.905 -18.573 28.885 0.00 0.00 WT1 H
+ATOM 3696 H2 TIP3X1410 -12.832 -18.127 27.781 0.00 0.00 WT1 H
+ATOM 3697 OH2 TIP3X1411 -21.970 -20.559 -28.566 0.00 0.00 WT1 O
+ATOM 3698 H1 TIP3X1411 -22.726 -21.173 -28.578 0.00 0.00 WT1 H
+ATOM 3699 H2 TIP3X1411 -21.467 -20.638 -29.339 0.00 0.00 WT1 H
+ATOM 3700 OH2 TIP3X1412 -21.450 -22.456 -20.685 0.00 0.00 WT1 O
+ATOM 3701 H1 TIP3X1412 -21.945 -21.657 -20.604 0.00 0.00 WT1 H
+ATOM 3702 H2 TIP3X1412 -20.540 -22.154 -20.663 0.00 0.00 WT1 H
+ATOM 3703 OH2 TIP3X1413 -14.804 -13.962 -18.223 0.00 0.00 WT1 O
+ATOM 3704 H1 TIP3X1413 -14.508 -14.915 -18.250 0.00 0.00 WT1 H
+ATOM 3705 H2 TIP3X1413 -15.132 -13.918 -19.145 0.00 0.00 WT1 H
+ATOM 3706 OH2 TIP3X1414 -29.995 -14.204 -10.878 0.00 0.00 WT1 O
+ATOM 3707 H1 TIP3X1414 -29.227 -14.675 -10.402 0.00 0.00 WT1 H
+ATOM 3708 H2 TIP3X1414 -29.827 -13.242 -10.735 0.00 0.00 WT1 H
+ATOM 3709 OH2 TIP3X1415 -18.447 -16.760 -10.565 0.00 0.00 WT1 O
+ATOM 3710 H1 TIP3X1415 -17.897 -17.041 -11.274 0.00 0.00 WT1 H
+ATOM 3711 H2 TIP3X1415 -18.578 -17.530 -10.021 0.00 0.00 WT1 H
+ATOM 3712 OH2 TIP3X1416 -24.004 -15.094 -3.403 0.00 0.00 WT1 O
+ATOM 3713 H1 TIP3X1416 -24.612 -15.309 -4.144 0.00 0.00 WT1 H
+ATOM 3714 H2 TIP3X1416 -23.729 -14.162 -3.690 0.00 0.00 WT1 H
+ATOM 3715 OH2 TIP3X1417 -13.413 -16.224 -5.043 0.00 0.00 WT1 O
+ATOM 3716 H1 TIP3X1417 -14.159 -15.739 -5.521 0.00 0.00 WT1 H
+ATOM 3717 H2 TIP3X1417 -13.428 -17.174 -5.325 0.00 0.00 WT1 H
+ATOM 3718 OH2 TIP3X1418 -20.544 -29.650 -12.415 0.00 0.00 WT1 O
+ATOM 3719 H1 TIP3X1418 -21.269 -29.069 -12.270 0.00 0.00 WT1 H
+ATOM 3720 H2 TIP3X1418 -20.454 -30.138 -11.599 0.00 0.00 WT1 H
+ATOM 3721 OH2 TIP3X1419 -18.428 -10.325 8.023 0.00 0.00 WT1 O
+ATOM 3722 H1 TIP3X1419 -17.709 -9.832 7.548 0.00 0.00 WT1 H
+ATOM 3723 H2 TIP3X1419 -18.571 -11.182 7.608 0.00 0.00 WT1 H
+ATOM 3724 OH2 TIP3X1421 -16.360 -9.097 6.615 0.00 0.00 WT1 O
+ATOM 3725 H1 TIP3X1421 -15.757 -8.339 6.665 0.00 0.00 WT1 H
+ATOM 3726 H2 TIP3X1421 -15.746 -9.852 6.657 0.00 0.00 WT1 H
+ATOM 3727 OH2 TIP3X1422 27.078 -22.334 8.918 0.00 0.00 WT1 O
+ATOM 3728 H1 TIP3X1422 26.999 -22.396 7.890 0.00 0.00 WT1 H
+ATOM 3729 H2 TIP3X1422 26.172 -22.818 9.195 0.00 0.00 WT1 H
+ATOM 3730 OH2 TIP3X1423 22.727 -22.771 19.735 0.00 0.00 WT1 O
+ATOM 3731 H1 TIP3X1423 22.628 -23.604 19.259 0.00 0.00 WT1 H
+ATOM 3732 H2 TIP3X1423 21.923 -22.325 19.484 0.00 0.00 WT1 H
+ATOM 3733 OH2 TIP3X1424 -14.658 -22.632 16.016 0.00 0.00 WT1 O
+ATOM 3734 H1 TIP3X1424 -14.370 -22.218 15.216 0.00 0.00 WT1 H
+ATOM 3735 H2 TIP3X1424 -14.887 -23.544 15.720 0.00 0.00 WT1 H
+ATOM 3736 OH2 TIP3X1426 -21.206 -16.883 25.127 0.00 0.00 WT1 O
+ATOM 3737 H1 TIP3X1426 -21.695 -17.086 25.913 0.00 0.00 WT1 H
+ATOM 3738 H2 TIP3X1426 -20.821 -17.746 24.899 0.00 0.00 WT1 H
+ATOM 3739 OH2 TIP3X1428 -18.932 -29.086 -21.851 0.00 0.00 WT1 O
+ATOM 3740 H1 TIP3X1428 -19.197 -29.527 -22.705 0.00 0.00 WT1 H
+ATOM 3741 H2 TIP3X1428 -17.990 -29.151 -21.888 0.00 0.00 WT1 H
+ATOM 3742 OH2 TIP3X1429 -26.550 -22.933 -26.663 0.00 0.00 WT1 O
+ATOM 3743 H1 TIP3X1429 -27.278 -23.160 -27.289 0.00 0.00 WT1 H
+ATOM 3744 H2 TIP3X1429 -27.061 -23.230 -25.883 0.00 0.00 WT1 H
+ATOM 3745 OH2 TIP3X1430 -22.187 -6.381 -17.270 0.00 0.00 WT1 O
+ATOM 3746 H1 TIP3X1430 -21.344 -6.124 -16.836 0.00 0.00 WT1 H
+ATOM 3747 H2 TIP3X1430 -22.804 -5.855 -16.725 0.00 0.00 WT1 H
+ATOM 3748 OH2 TIP3X1431 -3.043 -10.278 -26.497 0.00 0.00 WT1 O
+ATOM 3749 H1 TIP3X1431 -3.865 -10.597 -26.937 0.00 0.00 WT1 H
+ATOM 3750 H2 TIP3X1431 -3.339 -9.507 -25.925 0.00 0.00 WT1 H
+ATOM 3751 OH2 TIP3X1433 -28.703 -13.229 -14.697 0.00 0.00 WT1 O
+ATOM 3752 H1 TIP3X1433 -28.087 -12.728 -14.175 0.00 0.00 WT1 H
+ATOM 3753 H2 TIP3X1433 -28.384 -13.065 -15.592 0.00 0.00 WT1 H
+ATOM 3754 OH2 TIP3X1435 -25.403 -16.046 -10.537 0.00 0.00 WT1 O
+ATOM 3755 H1 TIP3X1435 -24.843 -16.840 -10.800 0.00 0.00 WT1 H
+ATOM 3756 H2 TIP3X1435 -24.795 -15.549 -9.979 0.00 0.00 WT1 H
+ATOM 3757 OH2 TIP3X1436 -27.616 -5.624 4.209 0.00 0.00 WT1 O
+ATOM 3758 H1 TIP3X1436 -27.490 -6.171 5.007 0.00 0.00 WT1 H
+ATOM 3759 H2 TIP3X1436 -28.256 -4.951 4.456 0.00 0.00 WT1 H
+ATOM 3760 OH2 TIP3X1437 -17.082 -26.990 -4.540 0.00 0.00 WT1 O
+ATOM 3761 H1 TIP3X1437 -17.408 -26.066 -4.490 0.00 0.00 WT1 H
+ATOM 3762 H2 TIP3X1437 -16.171 -26.925 -4.860 0.00 0.00 WT1 H
+ATOM 3763 OH2 TIP3X1438 26.225 -17.858 -3.268 0.00 0.00 WT1 O
+ATOM 3764 H1 TIP3X1438 27.163 -17.770 -3.629 0.00 0.00 WT1 H
+ATOM 3765 H2 TIP3X1438 25.993 -16.962 -2.927 0.00 0.00 WT1 H
+ATOM 3766 OH2 TIP3X1439 -25.438 -2.844 -2.897 0.00 0.00 WT1 O
+ATOM 3767 H1 TIP3X1439 -24.443 -2.873 -2.753 0.00 0.00 WT1 H
+ATOM 3768 H2 TIP3X1439 -25.493 -2.259 -3.704 0.00 0.00 WT1 H
+ATOM 3769 OH2 TIP3X1440 -30.557 -28.020 -13.373 0.00 0.00 WT1 O
+ATOM 3770 H1 TIP3X1440 -30.464 -28.950 -13.753 0.00 0.00 WT1 H
+ATOM 3771 H2 TIP3X1440 -31.411 -27.718 -13.744 0.00 0.00 WT1 H
+ATOM 3772 OH2 TIP3X1442 -25.752 -18.495 -7.768 0.00 0.00 WT1 O
+ATOM 3773 H1 TIP3X1442 -24.943 -18.178 -8.129 0.00 0.00 WT1 H
+ATOM 3774 H2 TIP3X1442 -25.749 -18.199 -6.868 0.00 0.00 WT1 H
+ATOM 3775 OH2 TIP3X1443 -23.967 0.773 9.898 0.00 0.00 WT1 O
+ATOM 3776 H1 TIP3X1443 -23.942 1.707 9.692 0.00 0.00 WT1 H
+ATOM 3777 H2 TIP3X1443 -23.977 0.326 9.027 0.00 0.00 WT1 H
+ATOM 3778 OH2 TIP3X1444 -10.628 -23.328 14.399 0.00 0.00 WT1 O
+ATOM 3779 H1 TIP3X1444 -11.187 -23.268 15.184 0.00 0.00 WT1 H
+ATOM 3780 H2 TIP3X1444 -10.148 -24.141 14.546 0.00 0.00 WT1 H
+ATOM 3781 OH2 TIP3X1445 -30.856 -18.264 19.467 0.00 0.00 WT1 O
+ATOM 3782 H1 TIP3X1445 -29.996 -18.628 19.886 0.00 0.00 WT1 H
+ATOM 3783 H2 TIP3X1445 -30.823 -18.665 18.565 0.00 0.00 WT1 H
+ATOM 3784 OH2 TIP3X1446 -16.491 -6.893 25.217 0.00 0.00 WT1 O
+ATOM 3785 H1 TIP3X1446 -17.096 -6.945 26.024 0.00 0.00 WT1 H
+ATOM 3786 H2 TIP3X1446 -16.958 -6.258 24.648 0.00 0.00 WT1 H
+ATOM 3787 OH2 TIP3X1447 -31.177 7.642 26.846 0.00 0.00 WT1 O
+ATOM 3788 H1 TIP3X1447 -30.953 6.719 26.523 0.00 0.00 WT1 H
+ATOM 3789 H2 TIP3X1447 -31.572 8.057 26.114 0.00 0.00 WT1 H
+ATOM 3790 OH2 TIP3X1448 -22.003 -12.785 18.074 0.00 0.00 WT1 O
+ATOM 3791 H1 TIP3X1448 -21.400 -12.933 17.345 0.00 0.00 WT1 H
+ATOM 3792 H2 TIP3X1448 -22.867 -12.895 17.663 0.00 0.00 WT1 H
+ATOM 3793 OH2 TIP3X1449 -23.303 -22.843 23.577 0.00 0.00 WT1 O
+ATOM 3794 H1 TIP3X1449 -22.804 -23.276 24.252 0.00 0.00 WT1 H
+ATOM 3795 H2 TIP3X1449 -23.930 -22.345 24.086 0.00 0.00 WT1 H
+ATOM 3796 OH2 TIP3X1450 -11.745 -6.017 -28.871 0.00 0.00 WT1 O
+ATOM 3797 H1 TIP3X1450 -11.528 -5.589 -28.046 0.00 0.00 WT1 H
+ATOM 3798 H2 TIP3X1450 -12.132 -6.902 -28.674 0.00 0.00 WT1 H
+ATOM 3799 OH2 TIP3X1451 -28.752 -9.124 -28.299 0.00 0.00 WT1 O
+ATOM 3800 H1 TIP3X1451 -29.338 -9.666 -27.752 0.00 0.00 WT1 H
+ATOM 3801 H2 TIP3X1451 -27.894 -9.590 -28.219 0.00 0.00 WT1 H
+ATOM 3802 OH2 TIP3X1453 -14.095 -3.857 -25.552 0.00 0.00 WT1 O
+ATOM 3803 H1 TIP3X1453 -14.826 -3.494 -26.038 0.00 0.00 WT1 H
+ATOM 3804 H2 TIP3X1453 -14.526 -4.528 -25.020 0.00 0.00 WT1 H
+ATOM 3805 OH2 TIP3X1454 -23.057 -12.393 -22.607 0.00 0.00 WT1 O
+ATOM 3806 H1 TIP3X1454 -22.110 -12.334 -22.826 0.00 0.00 WT1 H
+ATOM 3807 H2 TIP3X1454 -23.449 -12.798 -23.414 0.00 0.00 WT1 H
+ATOM 3808 OH2 TIP3X1455 -24.466 -8.687 -9.990 0.00 0.00 WT1 O
+ATOM 3809 H1 TIP3X1455 -24.691 -9.223 -9.262 0.00 0.00 WT1 H
+ATOM 3810 H2 TIP3X1455 -25.303 -8.597 -10.468 0.00 0.00 WT1 H
+ATOM 3811 OH2 TIP3X1456 -24.712 -16.787 9.715 0.00 0.00 WT1 O
+ATOM 3812 H1 TIP3X1456 -24.015 -17.285 10.185 0.00 0.00 WT1 H
+ATOM 3813 H2 TIP3X1456 -25.532 -17.042 10.137 0.00 0.00 WT1 H
+ATOM 3814 OH2 TIP3X1457 -18.660 -18.440 -15.523 0.00 0.00 WT1 O
+ATOM 3815 H1 TIP3X1457 -18.600 -18.432 -16.458 0.00 0.00 WT1 H
+ATOM 3816 H2 TIP3X1457 -19.148 -17.594 -15.367 0.00 0.00 WT1 H
+ATOM 3817 OH2 TIP3X1458 -23.656 -24.155 -11.571 0.00 0.00 WT1 O
+ATOM 3818 H1 TIP3X1458 -23.521 -23.708 -10.764 0.00 0.00 WT1 H
+ATOM 3819 H2 TIP3X1458 -22.898 -23.941 -12.100 0.00 0.00 WT1 H
+ATOM 3820 OH2 TIP3X1459 -26.562 -0.446 -9.181 0.00 0.00 WT1 O
+ATOM 3821 H1 TIP3X1459 -27.377 -0.212 -8.665 0.00 0.00 WT1 H
+ATOM 3822 H2 TIP3X1459 -26.989 -1.086 -9.821 0.00 0.00 WT1 H
+ATOM 3823 OH2 TIP3X1460 -10.335 -6.680 7.978 0.00 0.00 WT1 O
+ATOM 3824 H1 TIP3X1460 -10.948 -7.001 8.604 0.00 0.00 WT1 H
+ATOM 3825 H2 TIP3X1460 -9.549 -6.463 8.512 0.00 0.00 WT1 H
+ATOM 3826 OH2 TIP3X1461 -19.688 -23.207 6.101 0.00 0.00 WT1 O
+ATOM 3827 H1 TIP3X1461 -20.485 -22.954 5.539 0.00 0.00 WT1 H
+ATOM 3828 H2 TIP3X1461 -19.086 -23.483 5.387 0.00 0.00 WT1 H
+ATOM 3829 OH2 TIP3X1462 -26.216 -9.843 24.006 0.00 0.00 WT1 O
+ATOM 3830 H1 TIP3X1462 -25.586 -9.891 24.681 0.00 0.00 WT1 H
+ATOM 3831 H2 TIP3X1462 -27.037 -9.801 24.522 0.00 0.00 WT1 H
+ATOM 3832 OH2 TIP3X1463 -24.804 -8.090 9.236 0.00 0.00 WT1 O
+ATOM 3833 H1 TIP3X1463 -24.513 -7.516 10.029 0.00 0.00 WT1 H
+ATOM 3834 H2 TIP3X1463 -24.268 -7.778 8.514 0.00 0.00 WT1 H
+ATOM 3835 OH2 TIP3X1464 -21.983 -12.703 13.891 0.00 0.00 WT1 O
+ATOM 3836 H1 TIP3X1464 -21.872 -12.812 12.960 0.00 0.00 WT1 H
+ATOM 3837 H2 TIP3X1464 -22.893 -12.306 14.025 0.00 0.00 WT1 H
+ATOM 3838 OH2 TIP3X1465 -13.715 -1.366 11.542 0.00 0.00 WT1 O
+ATOM 3839 H1 TIP3X1465 -13.441 -0.832 10.867 0.00 0.00 WT1 H
+ATOM 3840 H2 TIP3X1465 -12.960 -1.554 12.095 0.00 0.00 WT1 H
+ATOM 3841 OH2 TIP3X1466 -28.118 1.117 -30.731 0.00 0.00 WT1 O
+ATOM 3842 H1 TIP3X1466 -27.703 1.920 -30.369 0.00 0.00 WT1 H
+ATOM 3843 H2 TIP3X1466 -27.370 0.476 -30.741 0.00 0.00 WT1 H
+ATOM 3844 OH2 TIP3X1467 -21.173 -12.344 25.723 0.00 0.00 WT1 O
+ATOM 3845 H1 TIP3X1467 -21.603 -11.608 26.267 0.00 0.00 WT1 H
+ATOM 3846 H2 TIP3X1467 -21.750 -13.147 25.935 0.00 0.00 WT1 H
+ATOM 3847 OH2 TIP3X1469 -21.381 5.325 28.692 0.00 0.00 WT1 O
+ATOM 3848 H1 TIP3X1469 -21.406 4.692 27.965 0.00 0.00 WT1 H
+ATOM 3849 H2 TIP3X1469 -21.659 4.854 29.472 0.00 0.00 WT1 H
+ATOM 3850 OH2 TIP3X1470 -18.906 -15.608 22.791 0.00 0.00 WT1 O
+ATOM 3851 H1 TIP3X1470 -19.479 -15.087 22.210 0.00 0.00 WT1 H
+ATOM 3852 H2 TIP3X1470 -19.535 -16.072 23.375 0.00 0.00 WT1 H
+ATOM 3853 OH2 TIP3X1471 -10.108 -22.510 -29.046 0.00 0.00 WT1 O
+ATOM 3854 H1 TIP3X1471 -9.338 -23.035 -28.993 0.00 0.00 WT1 H
+ATOM 3855 H2 TIP3X1471 -10.721 -23.090 -29.442 0.00 0.00 WT1 H
+ATOM 3856 OH2 TIP3X1472 -12.962 3.368 30.831 0.00 0.00 WT1 O
+ATOM 3857 H1 TIP3X1472 -12.895 2.568 31.416 0.00 0.00 WT1 H
+ATOM 3858 H2 TIP3X1472 -12.592 4.071 31.400 0.00 0.00 WT1 H
+ATOM 3859 OH2 TIP3X1473 -27.710 7.340 26.558 0.00 0.00 WT1 O
+ATOM 3860 H1 TIP3X1473 -27.211 6.949 27.270 0.00 0.00 WT1 H
+ATOM 3861 H2 TIP3X1473 -28.203 8.048 27.085 0.00 0.00 WT1 H
+ATOM 3862 OH2 TIP3X1474 -25.099 -10.443 -22.674 0.00 0.00 WT1 O
+ATOM 3863 H1 TIP3X1474 -24.590 -11.256 -22.616 0.00 0.00 WT1 H
+ATOM 3864 H2 TIP3X1474 -24.526 -9.923 -23.241 0.00 0.00 WT1 H
+ATOM 3865 OH2 TIP3X1475 -15.739 -10.211 -9.848 0.00 0.00 WT1 O
+ATOM 3866 H1 TIP3X1475 -15.316 -11.127 -10.122 0.00 0.00 WT1 H
+ATOM 3867 H2 TIP3X1475 -15.212 -9.990 -9.127 0.00 0.00 WT1 H
+ATOM 3868 OH2 TIP3X1476 -27.942 -13.794 -3.115 0.00 0.00 WT1 O
+ATOM 3869 H1 TIP3X1476 -28.725 -14.400 -3.120 0.00 0.00 WT1 H
+ATOM 3870 H2 TIP3X1476 -27.164 -14.347 -2.746 0.00 0.00 WT1 H
+ATOM 3871 OH2 TIP3X1477 -27.471 2.567 -10.107 0.00 0.00 WT1 O
+ATOM 3872 H1 TIP3X1477 -27.650 1.803 -10.661 0.00 0.00 WT1 H
+ATOM 3873 H2 TIP3X1477 -27.992 3.319 -10.554 0.00 0.00 WT1 H
+ATOM 3874 OH2 TIP3X1478 -15.922 -3.781 -15.537 0.00 0.00 WT1 O
+ATOM 3875 H1 TIP3X1478 -16.730 -3.394 -15.810 0.00 0.00 WT1 H
+ATOM 3876 H2 TIP3X1478 -15.513 -3.893 -16.419 0.00 0.00 WT1 H
+ATOM 3877 OH2 TIP3X1479 -21.939 -6.774 4.361 0.00 0.00 WT1 O
+ATOM 3878 H1 TIP3X1479 -21.809 -5.915 3.854 0.00 0.00 WT1 H
+ATOM 3879 H2 TIP3X1479 -20.950 -7.003 4.510 0.00 0.00 WT1 H
+ATOM 3880 OH2 TIP3X1480 -30.159 -3.444 -12.519 0.00 0.00 WT1 O
+ATOM 3881 H1 TIP3X1480 -29.414 -3.848 -12.929 0.00 0.00 WT1 H
+ATOM 3882 H2 TIP3X1480 -30.762 -3.277 -13.259 0.00 0.00 WT1 H
+ATOM 3883 OH2 TIP3X1482 25.870 -13.720 -7.481 0.00 0.00 WT1 O
+ATOM 3884 H1 TIP3X1482 26.782 -13.684 -7.559 0.00 0.00 WT1 H
+ATOM 3885 H2 TIP3X1482 25.709 -14.680 -7.300 0.00 0.00 WT1 H
+ATOM 3886 OH2 TIP3X1483 -29.741 9.189 8.909 0.00 0.00 WT1 O
+ATOM 3887 H1 TIP3X1483 -30.616 9.103 9.295 0.00 0.00 WT1 H
+ATOM 3888 H2 TIP3X1483 -29.158 8.664 9.509 0.00 0.00 WT1 H
+ATOM 3889 OH2 TIP3X1484 -15.939 -19.268 22.082 0.00 0.00 WT1 O
+ATOM 3890 H1 TIP3X1484 -15.053 -19.593 21.956 0.00 0.00 WT1 H
+ATOM 3891 H2 TIP3X1484 -15.816 -18.440 22.587 0.00 0.00 WT1 H
+ATOM 3892 OH2 TIP3X1485 -17.028 3.969 10.484 0.00 0.00 WT1 O
+ATOM 3893 H1 TIP3X1485 -17.684 3.267 10.562 0.00 0.00 WT1 H
+ATOM 3894 H2 TIP3X1485 -16.245 3.501 10.808 0.00 0.00 WT1 H
+ATOM 3895 OH2 TIP3X1486 -29.752 -6.753 18.135 0.00 0.00 WT1 O
+ATOM 3896 H1 TIP3X1486 -30.503 -6.580 18.772 0.00 0.00 WT1 H
+ATOM 3897 H2 TIP3X1486 -30.149 -6.627 17.252 0.00 0.00 WT1 H
+ATOM 3898 OH2 TIP3X1487 -24.528 -11.886 30.102 0.00 0.00 WT1 O
+ATOM 3899 H1 TIP3X1487 -24.639 -11.188 30.743 0.00 0.00 WT1 H
+ATOM 3900 H2 TIP3X1487 -25.375 -12.386 30.322 0.00 0.00 WT1 H
+ATOM 3901 OH2 TIP3X1488 -20.740 0.407 18.880 0.00 0.00 WT1 O
+ATOM 3902 H1 TIP3X1488 -19.896 -0.140 18.887 0.00 0.00 WT1 H
+ATOM 3903 H2 TIP3X1488 -21.341 -0.151 19.365 0.00 0.00 WT1 H
+ATOM 3904 OH2 TIP3X1489 -14.876 -20.335 17.864 0.00 0.00 WT1 O
+ATOM 3905 H1 TIP3X1489 -14.798 -20.720 18.746 0.00 0.00 WT1 H
+ATOM 3906 H2 TIP3X1489 -14.838 -21.086 17.254 0.00 0.00 WT1 H
+ATOM 3907 OH2 TIP3X1490 -9.206 21.300 29.400 0.00 0.00 WT1 O
+ATOM 3908 H1 TIP3X1490 -8.512 20.693 29.642 0.00 0.00 WT1 H
+ATOM 3909 H2 TIP3X1490 -9.329 21.716 30.279 0.00 0.00 WT1 H
+ATOM 3910 OH2 TIP3X1491 -22.156 -6.831 30.952 0.00 0.00 WT1 O
+ATOM 3911 H1 TIP3X1491 -22.865 -7.121 31.530 0.00 0.00 WT1 H
+ATOM 3912 H2 TIP3X1491 -22.041 -5.860 31.063 0.00 0.00 WT1 H
+ATOM 3913 OH2 TIP3X1492 -27.471 9.068 -30.632 0.00 0.00 WT1 O
+ATOM 3914 H1 TIP3X1492 -27.201 8.167 -30.907 0.00 0.00 WT1 H
+ATOM 3915 H2 TIP3X1492 -28.481 8.998 -30.808 0.00 0.00 WT1 H
+ATOM 3916 OH2 TIP3X1493 -26.404 -8.120 -13.238 0.00 0.00 WT1 O
+ATOM 3917 H1 TIP3X1493 -26.273 -7.238 -12.815 0.00 0.00 WT1 H
+ATOM 3918 H2 TIP3X1493 -25.496 -8.396 -13.569 0.00 0.00 WT1 H
+ATOM 3919 OH2 TIP3X1494 -17.597 -24.185 -16.788 0.00 0.00 WT1 O
+ATOM 3920 H1 TIP3X1494 -18.468 -23.794 -17.089 0.00 0.00 WT1 H
+ATOM 3921 H2 TIP3X1494 -17.115 -24.319 -17.627 0.00 0.00 WT1 H
+ATOM 3922 OH2 TIP3X1495 -3.326 -9.089 21.088 0.00 0.00 WT1 O
+ATOM 3923 H1 TIP3X1495 -3.305 -9.982 20.583 0.00 0.00 WT1 H
+ATOM 3924 H2 TIP3X1495 -4.187 -9.101 21.529 0.00 0.00 WT1 H
+ATOM 3925 OH2 TIP3X1496 28.461 -19.150 -11.282 0.00 0.00 WT1 O
+ATOM 3926 H1 TIP3X1496 29.429 -19.001 -11.189 0.00 0.00 WT1 H
+ATOM 3927 H2 TIP3X1496 28.465 -20.162 -11.521 0.00 0.00 WT1 H
+ATOM 3928 OH2 TIP3X1497 -25.143 -20.862 -25.171 0.00 0.00 WT1 O
+ATOM 3929 H1 TIP3X1497 -25.893 -20.250 -25.200 0.00 0.00 WT1 H
+ATOM 3930 H2 TIP3X1497 -25.520 -21.613 -25.647 0.00 0.00 WT1 H
+ATOM 3931 OH2 TIP3X1498 -21.537 21.338 -8.420 0.00 0.00 WT1 O
+ATOM 3932 H1 TIP3X1498 -21.156 21.468 -9.338 0.00 0.00 WT1 H
+ATOM 3933 H2 TIP3X1498 -22.467 21.084 -8.650 0.00 0.00 WT1 H
+ATOM 3934 OH2 TIP3X1499 -20.243 -5.231 -11.652 0.00 0.00 WT1 O
+ATOM 3935 H1 TIP3X1499 -20.536 -4.504 -11.126 0.00 0.00 WT1 H
+ATOM 3936 H2 TIP3X1499 -21.014 -5.779 -11.713 0.00 0.00 WT1 H
+ATOM 3937 OH2 TIP3X1500 -15.797 1.061 4.285 0.00 0.00 WT1 O
+ATOM 3938 H1 TIP3X1500 -16.660 0.808 4.599 0.00 0.00 WT1 H
+ATOM 3939 H2 TIP3X1500 -15.356 1.638 4.927 0.00 0.00 WT1 H
+ATOM 3940 OH2 TIP3X1501 -26.593 -18.037 2.866 0.00 0.00 WT1 O
+ATOM 3941 H1 TIP3X1501 -26.345 -17.437 3.653 0.00 0.00 WT1 H
+ATOM 3942 H2 TIP3X1501 -26.797 -18.854 3.256 0.00 0.00 WT1 H
+ATOM 3943 OH2 TIP3X1502 -21.617 -4.236 10.137 0.00 0.00 WT1 O
+ATOM 3944 H1 TIP3X1502 -22.232 -3.482 10.049 0.00 0.00 WT1 H
+ATOM 3945 H2 TIP3X1502 -22.225 -4.895 9.816 0.00 0.00 WT1 H
+ATOM 3946 OH2 TIP3X1505 -24.308 -6.789 15.683 0.00 0.00 WT1 O
+ATOM 3947 H1 TIP3X1505 -23.894 -7.636 15.417 0.00 0.00 WT1 H
+ATOM 3948 H2 TIP3X1505 -23.857 -6.134 15.138 0.00 0.00 WT1 H
+ATOM 3949 OH2 TIP3X1506 -14.533 1.017 6.975 0.00 0.00 WT1 O
+ATOM 3950 H1 TIP3X1506 -14.452 0.147 6.669 0.00 0.00 WT1 H
+ATOM 3951 H2 TIP3X1506 -13.613 1.298 7.206 0.00 0.00 WT1 H
+ATOM 3952 OH2 TIP3X1507 -13.662 14.776 7.340 0.00 0.00 WT1 O
+ATOM 3953 H1 TIP3X1507 -12.752 14.765 6.953 0.00 0.00 WT1 H
+ATOM 3954 H2 TIP3X1507 -13.583 15.317 8.156 0.00 0.00 WT1 H
+ATOM 3955 OH2 TIP3X1508 -29.425 0.603 18.441 0.00 0.00 WT1 O
+ATOM 3956 H1 TIP3X1508 -28.954 -0.051 18.981 0.00 0.00 WT1 H
+ATOM 3957 H2 TIP3X1508 -29.727 0.091 17.640 0.00 0.00 WT1 H
+ATOM 3958 OH2 TIP3X1509 -26.797 -8.614 31.676 0.00 0.00 WT1 O
+ATOM 3959 H1 TIP3X1509 -26.577 -8.924 30.754 0.00 0.00 WT1 H
+ATOM 3960 H2 TIP3X1509 -27.420 -7.924 31.463 0.00 0.00 WT1 H
+ATOM 3961 OH2 TIP3X1510 28.909 -5.288 19.637 0.00 0.00 WT1 O
+ATOM 3962 H1 TIP3X1510 28.349 -5.063 20.415 0.00 0.00 WT1 H
+ATOM 3963 H2 TIP3X1510 29.413 -4.439 19.551 0.00 0.00 WT1 H
+ATOM 3964 OH2 TIP3X1511 -24.212 -3.155 31.036 0.00 0.00 WT1 O
+ATOM 3965 H1 TIP3X1511 -24.706 -3.394 30.216 0.00 0.00 WT1 H
+ATOM 3966 H2 TIP3X1511 -23.444 -3.736 31.114 0.00 0.00 WT1 H
+ATOM 3967 OH2 TIP3X1512 -21.691 -10.500 -20.519 0.00 0.00 WT1 O
+ATOM 3968 H1 TIP3X1512 -20.986 -11.072 -20.815 0.00 0.00 WT1 H
+ATOM 3969 H2 TIP3X1512 -22.405 -11.039 -20.817 0.00 0.00 WT1 H
+ATOM 3970 OH2 TIP3X1513 -20.327 -3.316 23.362 0.00 0.00 WT1 O
+ATOM 3971 H1 TIP3X1513 -20.690 -2.368 23.223 0.00 0.00 WT1 H
+ATOM 3972 H2 TIP3X1513 -21.078 -3.911 23.101 0.00 0.00 WT1 H
+ATOM 3973 OH2 TIP3X1514 -26.767 1.186 -19.181 0.00 0.00 WT1 O
+ATOM 3974 H1 TIP3X1514 -25.894 1.436 -19.294 0.00 0.00 WT1 H
+ATOM 3975 H2 TIP3X1514 -27.217 1.261 -20.046 0.00 0.00 WT1 H
+ATOM 3976 OH2 TIP3X1515 -15.311 -5.771 -23.711 0.00 0.00 WT1 O
+ATOM 3977 H1 TIP3X1515 -14.808 -6.209 -23.000 0.00 0.00 WT1 H
+ATOM 3978 H2 TIP3X1515 -15.998 -5.326 -23.148 0.00 0.00 WT1 H
+ATOM 3979 OH2 TIP3X1516 -11.423 -7.045 29.767 0.00 0.00 WT1 O
+ATOM 3980 H1 TIP3X1516 -10.610 -6.778 29.241 0.00 0.00 WT1 H
+ATOM 3981 H2 TIP3X1516 -11.972 -6.234 29.645 0.00 0.00 WT1 H
+ATOM 3982 OH2 TIP3X1518 -27.671 -4.994 -5.469 0.00 0.00 WT1 O
+ATOM 3983 H1 TIP3X1518 -27.907 -4.075 -5.583 0.00 0.00 WT1 H
+ATOM 3984 H2 TIP3X1518 -27.237 -4.957 -4.607 0.00 0.00 WT1 H
+ATOM 3985 OH2 TIP3X1519 -19.629 -2.347 -20.110 0.00 0.00 WT1 O
+ATOM 3986 H1 TIP3X1519 -18.690 -2.109 -20.015 0.00 0.00 WT1 H
+ATOM 3987 H2 TIP3X1519 -20.022 -1.619 -19.593 0.00 0.00 WT1 H
+ATOM 3988 OH2 TIP3X1520 -21.511 -2.588 4.667 0.00 0.00 WT1 O
+ATOM 3989 H1 TIP3X1520 -21.677 -1.652 4.799 0.00 0.00 WT1 H
+ATOM 3990 H2 TIP3X1520 -22.082 -2.788 3.870 0.00 0.00 WT1 H
+ATOM 3991 OH2 TIP3X1522 -26.728 -0.955 1.344 0.00 0.00 WT1 O
+ATOM 3992 H1 TIP3X1522 -25.963 -0.972 0.684 0.00 0.00 WT1 H
+ATOM 3993 H2 TIP3X1522 -27.335 -1.619 0.941 0.00 0.00 WT1 H
+ATOM 3994 OH2 TIP3X1523 -14.958 -2.368 -2.320 0.00 0.00 WT1 O
+ATOM 3995 H1 TIP3X1523 -15.300 -1.557 -1.817 0.00 0.00 WT1 H
+ATOM 3996 H2 TIP3X1523 -15.187 -3.095 -1.642 0.00 0.00 WT1 H
+ATOM 3997 OH2 TIP3X1524 -30.653 -1.830 8.977 0.00 0.00 WT1 O
+ATOM 3998 H1 TIP3X1524 -30.616 -2.678 8.555 0.00 0.00 WT1 H
+ATOM 3999 H2 TIP3X1524 -31.443 -1.477 8.594 0.00 0.00 WT1 H
+ATOM 4000 OH2 TIP3X1525 18.929 -2.531 -3.750 0.00 0.00 WT1 O
+ATOM 4001 H1 TIP3X1525 18.578 -1.959 -3.039 0.00 0.00 WT1 H
+ATOM 4002 H2 TIP3X1525 19.940 -2.471 -3.669 0.00 0.00 WT1 H
+ATOM 4003 OH2 TIP3X1526 -5.584 0.715 9.698 0.00 0.00 WT1 O
+ATOM 4004 H1 TIP3X1526 -5.089 1.448 9.271 0.00 0.00 WT1 H
+ATOM 4005 H2 TIP3X1526 -4.976 0.363 10.392 0.00 0.00 WT1 H
+ATOM 4006 OH2 TIP3X1527 -30.987 1.497 10.445 0.00 0.00 WT1 O
+ATOM 4007 H1 TIP3X1527 -31.643 0.814 10.457 0.00 0.00 WT1 H
+ATOM 4008 H2 TIP3X1527 -31.457 2.297 10.801 0.00 0.00 WT1 H
+ATOM 4009 OH2 TIP3X1528 -8.799 12.942 15.070 0.00 0.00 WT1 O
+ATOM 4010 H1 TIP3X1528 -8.094 12.748 15.656 0.00 0.00 WT1 H
+ATOM 4011 H2 TIP3X1528 -8.955 13.861 15.155 0.00 0.00 WT1 H
+ATOM 4012 OH2 TIP3X1529 -0.841 -4.226 17.742 0.00 0.00 WT1 O
+ATOM 4013 H1 TIP3X1529 -0.106 -4.680 17.241 0.00 0.00 WT1 H
+ATOM 4014 H2 TIP3X1529 -1.607 -4.380 17.148 0.00 0.00 WT1 H
+ATOM 4015 OH2 TIP3X1530 -17.317 -7.838 21.304 0.00 0.00 WT1 O
+ATOM 4016 H1 TIP3X1530 -17.461 -7.949 20.286 0.00 0.00 WT1 H
+ATOM 4017 H2 TIP3X1530 -18.238 -7.719 21.644 0.00 0.00 WT1 H
+ATOM 4018 OH2 TIP3X1531 -18.622 4.017 -21.909 0.00 0.00 WT1 O
+ATOM 4019 H1 TIP3X1531 -18.156 4.623 -21.399 0.00 0.00 WT1 H
+ATOM 4020 H2 TIP3X1531 -19.042 4.567 -22.595 0.00 0.00 WT1 H
+ATOM 4021 OH2 TIP3X1532 -18.765 -9.057 -16.367 0.00 0.00 WT1 O
+ATOM 4022 H1 TIP3X1532 -19.387 -9.475 -15.806 0.00 0.00 WT1 H
+ATOM 4023 H2 TIP3X1532 -17.973 -9.019 -15.820 0.00 0.00 WT1 H
+ATOM 4024 OH2 TIP3X1533 -25.664 -15.249 24.074 0.00 0.00 WT1 O
+ATOM 4025 H1 TIP3X1533 -26.228 -15.566 23.358 0.00 0.00 WT1 H
+ATOM 4026 H2 TIP3X1533 -24.746 -15.289 23.695 0.00 0.00 WT1 H
+ATOM 4027 OH2 TIP3X1534 -12.764 0.819 -22.109 0.00 0.00 WT1 O
+ATOM 4028 H1 TIP3X1534 -12.893 0.085 -22.646 0.00 0.00 WT1 H
+ATOM 4029 H2 TIP3X1534 -12.913 0.479 -21.243 0.00 0.00 WT1 H
+ATOM 4030 OH2 TIP3X1536 -16.707 13.569 -30.219 0.00 0.00 WT1 O
+ATOM 4031 H1 TIP3X1536 -16.002 14.191 -30.500 0.00 0.00 WT1 H
+ATOM 4032 H2 TIP3X1536 -17.282 14.190 -29.713 0.00 0.00 WT1 H
+ATOM 4033 OH2 TIP3X1537 -16.414 3.909 -19.076 0.00 0.00 WT1 O
+ATOM 4034 H1 TIP3X1537 -16.308 4.788 -19.440 0.00 0.00 WT1 H
+ATOM 4035 H2 TIP3X1537 -16.326 3.267 -19.850 0.00 0.00 WT1 H
+ATOM 4036 OH2 TIP3X1538 -16.999 0.510 -18.474 0.00 0.00 WT1 O
+ATOM 4037 H1 TIP3X1538 -16.923 1.137 -19.235 0.00 0.00 WT1 H
+ATOM 4038 H2 TIP3X1538 -16.144 0.607 -18.037 0.00 0.00 WT1 H
+ATOM 4039 OH2 TIP3X1539 28.196 3.976 -11.914 0.00 0.00 WT1 O
+ATOM 4040 H1 TIP3X1539 27.436 4.472 -12.259 0.00 0.00 WT1 H
+ATOM 4041 H2 TIP3X1539 27.840 3.075 -11.912 0.00 0.00 WT1 H
+ATOM 4042 OH2 TIP3X1540 -14.268 2.385 -14.122 0.00 0.00 WT1 O
+ATOM 4043 H1 TIP3X1540 -14.152 3.369 -13.849 0.00 0.00 WT1 H
+ATOM 4044 H2 TIP3X1540 -14.436 1.930 -13.255 0.00 0.00 WT1 H
+ATOM 4045 OH2 TIP3X1542 -18.426 -7.640 -7.380 0.00 0.00 WT1 O
+ATOM 4046 H1 TIP3X1542 -17.835 -7.188 -8.041 0.00 0.00 WT1 H
+ATOM 4047 H2 TIP3X1542 -18.198 -8.592 -7.567 0.00 0.00 WT1 H
+ATOM 4048 OH2 TIP3X1543 -5.509 7.767 3.452 0.00 0.00 WT1 O
+ATOM 4049 H1 TIP3X1543 -4.801 7.779 4.123 0.00 0.00 WT1 H
+ATOM 4050 H2 TIP3X1543 -6.317 7.538 3.992 0.00 0.00 WT1 H
+ATOM 4051 OH2 TIP3X1544 -9.816 -24.187 6.081 0.00 0.00 WT1 O
+ATOM 4052 H1 TIP3X1544 -10.507 -24.247 5.334 0.00 0.00 WT1 H
+ATOM 4053 H2 TIP3X1544 -9.120 -23.697 5.673 0.00 0.00 WT1 H
+ATOM 4054 OH2 TIP3X1545 -15.285 0.366 1.648 0.00 0.00 WT1 O
+ATOM 4055 H1 TIP3X1545 -15.649 0.423 2.592 0.00 0.00 WT1 H
+ATOM 4056 H2 TIP3X1545 -15.620 1.270 1.287 0.00 0.00 WT1 H
+ATOM 4057 OH2 TIP3X1546 -30.333 2.715 -2.218 0.00 0.00 WT1 O
+ATOM 4058 H1 TIP3X1546 -30.821 1.940 -2.519 0.00 0.00 WT1 H
+ATOM 4059 H2 TIP3X1546 -29.750 2.347 -1.522 0.00 0.00 WT1 H
+ATOM 4060 OH2 TIP3X1547 -5.729 -7.047 7.980 0.00 0.00 WT1 O
+ATOM 4061 H1 TIP3X1547 -4.742 -6.848 7.893 0.00 0.00 WT1 H
+ATOM 4062 H2 TIP3X1547 -6.126 -6.264 8.272 0.00 0.00 WT1 H
+ATOM 4063 OH2 TIP3X1548 -21.597 -7.562 11.638 0.00 0.00 WT1 O
+ATOM 4064 H1 TIP3X1548 -22.455 -7.208 11.421 0.00 0.00 WT1 H
+ATOM 4065 H2 TIP3X1548 -21.664 -7.575 12.601 0.00 0.00 WT1 H
+ATOM 4066 OH2 TIP3X1549 -21.722 7.149 16.846 0.00 0.00 WT1 O
+ATOM 4067 H1 TIP3X1549 -22.677 7.160 16.621 0.00 0.00 WT1 H
+ATOM 4068 H2 TIP3X1549 -21.587 6.437 17.562 0.00 0.00 WT1 H
+ATOM 4069 OH2 TIP3X1550 -16.306 -16.396 22.166 0.00 0.00 WT1 O
+ATOM 4070 H1 TIP3X1550 -15.763 -16.202 22.928 0.00 0.00 WT1 H
+ATOM 4071 H2 TIP3X1550 -17.217 -16.309 22.535 0.00 0.00 WT1 H
+ATOM 4072 OH2 TIP3X1551 23.631 -7.803 -31.360 0.00 0.00 WT1 O
+ATOM 4073 H1 TIP3X1551 23.588 -8.793 -31.235 0.00 0.00 WT1 H
+ATOM 4074 H2 TIP3X1551 22.840 -7.581 -31.947 0.00 0.00 WT1 H
+ATOM 4075 OH2 TIP3X1552 -26.000 0.305 -24.945 0.00 0.00 WT1 O
+ATOM 4076 H1 TIP3X1552 -26.577 0.996 -25.267 0.00 0.00 WT1 H
+ATOM 4077 H2 TIP3X1552 -25.194 0.807 -24.633 0.00 0.00 WT1 H
+ATOM 4078 OH2 TIP3X1553 -20.103 1.019 22.968 0.00 0.00 WT1 O
+ATOM 4079 H1 TIP3X1553 -19.717 1.911 23.155 0.00 0.00 WT1 H
+ATOM 4080 H2 TIP3X1553 -19.416 0.406 22.614 0.00 0.00 WT1 H
+ATOM 4081 OH2 TIP3X1554 -23.826 -0.101 26.836 0.00 0.00 WT1 O
+ATOM 4082 H1 TIP3X1554 -23.715 0.541 27.651 0.00 0.00 WT1 H
+ATOM 4083 H2 TIP3X1554 -23.195 0.273 26.213 0.00 0.00 WT1 H
+ATOM 4084 OH2 TIP3X1555 -17.683 8.999 -15.842 0.00 0.00 WT1 O
+ATOM 4085 H1 TIP3X1555 -18.053 9.195 -16.714 0.00 0.00 WT1 H
+ATOM 4086 H2 TIP3X1555 -17.667 8.011 -15.855 0.00 0.00 WT1 H
+ATOM 4087 OH2 TIP3X1556 30.141 6.261 25.692 0.00 0.00&nb
Code Review / namd.git / commitdiff