ATOM 1 N GLY A 1 1.208 2.041 -0.840 1.00 25.00 N ATOM 2 CA GLY A 1 1.540 0.968 -1.783 1.00 25.00 C ATOM 3 C GLY A 1 0.818 1.061 -3.138 1.00 25.00 C ATOM 4 O GLY A 1 -0.389 1.305 -3.299 1.00 25.00 O ATOM 5 H1 GLY A 1 0.280 1.849 -0.417 1.00 25.00 H ATOM 6 H2 GLY A 1 1.851 2.041 -0.021 1.00 25.00 H ATOM 7 HA2 GLY A 1 2.629 1.004 -2.000 1.00 25.00 H ATOM 8 HA3 GLY A 1 1.300 0.021 -1.322 1.00 25.00 H ATOM 9 N ILE A 2 1.605 0.759 -4.196 1.00 25.00 N ATOM 10 CA ILE A 2 1.117 0.894 -5.548 1.00 25.00 C ATOM 11 C ILE A 2 0.294 -0.352 -6.013 1.00 25.00 C ATOM 12 O ILE A 2 -0.530 -0.265 -6.881 1.00 25.00 O ATOM 13 CB ILE A 2 2.325 1.214 -6.489 1.00 25.00 C ATOM 14 CG1 ILE A 2 1.863 1.989 -7.720 1.00 25.00 C ATOM 15 CG2 ILE A 2 3.039 -0.079 -6.975 1.00 25.00 C ATOM 16 CD1 ILE A 2 1.387 3.432 -7.430 1.00 25.00 C ATOM 17 H ILE A 2 2.579 0.542 -4.019 1.00 25.00 H ATOM 18 HA ILE A 2 0.457 1.761 -5.559 1.00 25.00 H ATOM 19 HB ILE A 2 3.051 1.835 -5.953 1.00 25.00 H ATOM 20 HG12 ILE A 2 2.714 2.066 -8.406 1.00 25.00 H ATOM 21 HG13 ILE A 2 1.073 1.436 -8.227 1.00 25.00 H ATOM 22 HG21 ILE A 2 3.257 -0.736 -6.138 1.00 25.00 H ATOM 23 HG22 ILE A 2 2.390 -0.603 -7.681 1.00 25.00 H ATOM 24 HG23 ILE A 2 3.951 0.180 -7.485 1.00 25.00 H ATOM 25 HD11 ILE A 2 0.468 3.414 -6.836 1.00 25.00 H ATOM 26 HD12 ILE A 2 2.177 3.961 -6.889 1.00 25.00 H ATOM 27 HD13 ILE A 2 1.179 3.931 -8.388 1.00 25.00 H ATOM 28 N VAL A 3 0.462 -1.482 -5.353 1.00 25.00 N ATOM 29 CA VAL A 3 -0.270 -2.718 -5.670 1.00 25.00 C ATOM 30 C VAL A 3 -1.748 -2.568 -5.346 1.00 25.00 C ATOM 31 O VAL A 3 -2.622 -2.729 -6.237 1.00 25.00 O ATOM 32 CB VAL A 3 0.306 -3.966 -4.890 1.00 25.00 C ATOM 33 CG1 VAL A 3 -0.428 -5.268 -5.368 1.00 25.00 C ATOM 34 CG2 VAL A 3 1.804 -4.154 -5.126 1.00 25.00 C ATOM 35 H VAL A 3 1.178 -1.529 -4.633 1.00 25.00 H ATOM 36 HA VAL A 3 -0.210 -2.894 -6.729 1.00 25.00 H ATOM 37 HB VAL A 3 0.136 -3.831 -3.817 1.00 25.00 H ATOM 38 HG11 VAL A 3 -0.177 -5.463 -6.406 1.00 50.00 H ATOM 39 HG12 VAL A 3 -0.098 -6.106 -4.742 1.00 50.00 H ATOM 40 HG13 VAL A 3 -1.505 -5.131 -5.263 1.00 50.00 H ATOM 41 HG21 VAL A 3 1.990 -4.275 -6.186 1.00 50.00 H ATOM 42 HG22 VAL A 3 2.364 -3.310 -4.733 1.00 50.00 H ATOM 43 HG23 VAL A 3 2.123 -5.061 -4.591 1.00 50.00 H ATOM 44 N GLU A 4 -2.037 -2.123 -4.120 1.00 25.00 N ATOM 45 CA GLU A 4 -3.455 -1.863 -3.723 1.00 25.00 C ATOM 46 C GLU A 4 -4.044 -0.718 -4.537 1.00 25.00 C ATOM 47 O GLU A 4 -5.231 -0.749 -4.844 1.00 25.00 O ATOM 48 CB GLU A 4 -3.603 -1.585 -2.201 1.00 25.00 C ATOM 49 CG GLU A 4 -3.220 -0.193 -1.767 1.00 25.00 C ATOM 50 CD GLU A 4 -3.148 -0.031 -0.256 1.00 25.00 C ATOM 51 OE1 GLU A 4 -2.130 0.253 0.358 1.00 25.00 O ATOM 52 OE2 GLU A 4 -4.274 -0.223 0.357 1.00 25.00 O ATOM 53 H GLU A 4 -1.285 -1.956 -3.466 1.00 25.00 H ATOM 54 HA GLU A 4 -4.043 -2.733 -3.955 1.00 25.00 H ATOM 55 HB2 GLU A 4 -4.646 -1.749 -1.936 1.00 25.00 H ATOM 56 HB3 GLU A 4 -2.990 -2.300 -1.653 1.00 25.00 H ATOM 57 HG2 GLU A 4 -2.240 0.048 -2.167 1.00 25.00 H ATOM 58 HG3 GLU A 4 -3.958 0.492 -2.195 1.00 25.00 H ATOM 59 HE2 GLU A 4 -4.979 -0.425 -0.213 1.00 25.00 H ATOM 60 N GLN A 5 -3.226 0.214 -4.988 1.00 25.00 N ATOM 61 CA GLN A 5 -3.723 1.311 -5.838 1.00 25.00 C ATOM 62 C GLN A 5 -4.209 0.755 -7.202 1.00 25.00 C ATOM 63 O GLN A 5 -5.311 1.072 -7.646 1.00 25.00 O ATOM 64 CB GLN A 5 -2.597 2.343 -6.030 1.00 25.00 C ATOM 65 CG GLN A 5 -3.023 3.679 -6.648 1.00 25.00 C ATOM 66 CD GLN A 5 -3.457 4.670 -5.592 1.00 25.00 C ATOM 67 OE1 GLN A 5 -4.452 4.473 -4.900 1.00 25.00 O ATOM 68 NE2 GLN A 5 -2.674 5.697 -5.398 1.00 25.00 N ATOM 69 H GLN A 5 -2.238 0.224 -4.704 1.00 25.00 H ATOM 70 HA GLN A 5 -4.540 1.781 -5.319 1.00 25.00 H ATOM 71 HB2 GLN A 5 -2.086 2.538 -5.079 1.00 50.00 H ATOM 72 HB3 GLN A 5 -1.887 1.853 -6.688 1.00 50.00 H ATOM 73 HG2 GLN A 5 -2.178 4.086 -7.200 1.00 50.00 H ATOM 74 HG3 GLN A 5 -3.854 3.530 -7.328 1.00 50.00 H ATOM 75 HE21 GLN A 5 -1.837 5.819 -5.992 1.00 25.00 H ATOM 76 HE22 GLN A 5 -2.890 6.368 -4.695 1.00 25.00 H ATOM 77 N CYS A 6 -3.447 -0.121 -7.813 1.00 25.00 N ATOM 78 CA CYS A 6 -3.884 -0.760 -9.083 1.00 25.00 C ATOM 79 C CYS A 6 -4.997 -1.802 -8.888 1.00 25.00 C ATOM 80 O CYS A 6 -5.727 -2.131 -9.811 1.00 25.00 O ATOM 81 CB CYS A 6 -2.702 -1.424 -9.771 1.00 25.00 C ATOM 82 SG CYS A 6 -2.433 -0.694 -11.427 1.00 25.00 S ATOM 83 H CYS A 6 -2.529 -0.378 -7.397 1.00 25.00 H ATOM 84 HA CYS A 6 -4.275 -0.007 -9.762 1.00 25.00 H ATOM 85 HB2 CYS A 6 -1.800 -1.286 -9.165 1.00 50.00 H ATOM 86 HB3 CYS A 6 -2.919 -2.488 -9.844 1.00 50.00 H ATOM 87 N CYS A 7 -5.126 -2.266 -7.674 1.00 25.00 N ATOM 88 CA CYS A 7 -6.231 -3.126 -7.299 1.00 25.00 C ATOM 89 C CYS A 7 -7.539 -2.339 -7.113 1.00 25.00 C ATOM 90 O CYS A 7 -8.564 -2.707 -7.677 1.00 25.00 O ATOM 91 CB CYS A 7 -5.915 -3.903 -6.047 1.00 25.00 C ATOM 92 SG CYS A 7 -7.118 -5.276 -5.765 1.00 25.00 S ATOM 93 H CYS A 7 -4.435 -1.989 -6.962 1.00 25.00 H ATOM 94 HA CYS A 7 -6.378 -3.838 -8.110 1.00 25.00 H ATOM 95 HB2 CYS A 7 -4.894 -4.261 -6.134 1.00 50.00 H ATOM 96 HB3 CYS A 7 -5.986 -3.270 -5.183 1.00 50.00 H ATOM 97 N THR A 8 -7.521 -1.285 -6.296 1.00 25.00 N ATOM 98 CA THR A 8 -8.760 -0.549 -5.918 1.00 25.00 C ATOM 99 C THR A 8 -9.237 0.366 -7.041 1.00 25.00 C ATOM 100 O THR A 8 -10.452 0.575 -7.221 1.00 25.00 O ATOM 101 CB THR A 8 -8.574 0.262 -4.565 1.00 25.00 C ATOM 102 OG1 THR A 8 -9.862 0.577 -3.998 1.00 25.00 O ATOM 103 CG2 THR A 8 -7.783 1.549 -4.767 1.00 25.00 C ATOM 104 H THR A 8 -6.635 -1.009 -5.830 1.00 25.00 H ATOM 105 HA THR A 8 -9.528 -1.296 -5.755 1.00 25.00 H ATOM 106 HB THR A 8 -8.028 -0.365 -3.858 1.00 25.00 H ATOM 107 HG1 THR A 8 -10.374 -0.227 -3.924 1.00 25.00 H ATOM 108 HG21 THR A 8 -8.348 2.255 -5.399 1.00 25.00 H ATOM 109 HG22 THR A 8 -6.838 1.313 -5.214 1.00 25.00 H ATOM 110 HG23 THR A 8 -7.629 1.992 -3.787 1.00 25.00 H ATOM 111 N SER A 9 -8.306 0.912 -7.845 1.00 25.00 N ATOM 112 CA SER A 9 -8.666 1.786 -8.950 1.00 25.00 C ATOM 113 C SER A 9 -8.239 1.017 -10.194 1.00 25.00 C ATOM 114 O SER A 9 -7.767 -0.092 -10.083 1.00 25.00 O ATOM 115 CB SER A 9 -7.914 3.132 -8.856 1.00 25.00 C ATOM 116 OG SER A 9 -8.383 3.928 -7.762 1.00 25.00 O ATOM 117 H SER A 9 -7.311 0.772 -7.661 1.00 25.00 H ATOM 118 HA SER A 9 -9.751 1.939 -8.965 1.00 25.00 H ATOM 119 HB2 SER A 9 -6.830 2.939 -8.783 1.00 50.00 H ATOM 120 HB3 SER A 9 -8.121 3.712 -9.753 1.00 50.00 H ATOM 121 HG SER A 9 -7.696 4.565 -7.518 1.00 25.00 H ATOM 122 N ILE A 10 -8.454 1.595 -11.372 1.00 25.00 N ATOM 123 CA ILE A 10 -8.139 0.918 -12.608 1.00 25.00 C ATOM 124 C ILE A 10 -6.808 1.441 -13.152 1.00 25.00 C ATOM 125 O ILE A 10 -6.553 2.660 -13.198 1.00 25.00 O ATOM 126 CB ILE A 10 -9.300 1.089 -13.658 1.00 25.00 C ATOM 127 CG1 ILE A 10 -10.467 0.135 -13.264 1.00 25.00 C ATOM 128 CG2 ILE A 10 -8.839 0.770 -15.109 1.00 25.00 C ATOM 129 CD1 ILE A 10 -11.714 0.154 -14.167 1.00 25.00 C ATOM 130 H ILE A 10 -8.800 2.522 -11.417 1.00 25.00 H ATOM 131 HA ILE A 10 -8.003 -0.144 -12.407 1.00 25.00 H ATOM 132 HB ILE A 10 -9.678 2.112 -13.645 1.00 25.00 H ATOM 133 HG12 ILE A 10 -10.063 -0.881 -13.264 1.00 50.00 H ATOM 134 HG13 ILE A 10 -10.788 0.379 -12.248 1.00 50.00 H ATOM 135 HG21 ILE A 10 -9.663 0.910 -15.819 1.00 25.00 H ATOM 136 HG22 ILE A 10 -8.034 1.470 -15.393 1.00 25.00 H ATOM 137 HG23 ILE A 10 -8.479 -0.259 -15.155 1.00 25.00 H ATOM 138 HD11 ILE A 10 -12.034 1.177 -14.339 1.00 25.00 H ATOM 139 HD12 ILE A 10 -11.487 -0.290 -15.139 1.00 25.00 H ATOM 140 HD13 ILE A 10 -12.519 -0.430 -13.724 1.00 25.00 H ATOM 141 N CYS A 11 -5.974 0.500 -13.565 1.00 25.00 N ATOM 142 CA CYS A 11 -4.642 0.768 -14.120 1.00 25.00 C ATOM 143 C CYS A 11 -4.716 1.295 -15.533 1.00 25.00 C ATOM 144 O CYS A 11 -5.603 0.910 -16.325 1.00 25.00 O ATOM 145 CB CYS A 11 -3.855 -0.519 -14.107 1.00 25.00 C ATOM 146 SG CYS A 11 -3.916 -1.494 -12.540 1.00 25.00 S ATOM 147 H CYS A 11 -6.239 -0.457 -13.495 1.00 25.00 H ATOM 148 HA CYS A 11 -4.143 1.500 -13.502 1.00 25.00 H ATOM 149 HB2 CYS A 11 -4.245 -1.158 -14.900 1.00 25.00 H ATOM 150 HB3 CYS A 11 -2.813 -0.282 -14.336 1.00 25.00 H ATOM 151 N SER A 12 -3.757 2.122 -15.904 1.00 25.00 N ATOM 152 CA SER A 12 -3.664 2.636 -17.290 1.00 25.00 C ATOM 153 C SER A 12 -2.274 2.325 -17.884 1.00 25.00 C ATOM 154 O SER A 12 -1.331 2.146 -17.115 1.00 25.00 O ATOM 155 CB SER A 12 -3.913 4.148 -17.293 1.00 25.00 C ATOM 156 OG SER A 12 -4.906 4.555 -16.360 1.00 25.00 O ATOM 157 H SER A 12 -3.047 2.374 -15.235 1.00 25.00 H ATOM 158 HA SER A 12 -4.421 2.155 -17.893 1.00 25.00 H ATOM 159 HB2 SER A 12 -2.976 4.661 -17.057 1.00 50.00 H ATOM 160 HB3 SER A 12 -4.256 4.477 -18.264 1.00 50.00 H ATOM 161 HG SER A 12 -5.783 4.371 -16.734 1.00 25.00 H ATOM 162 N LEU A 13 -2.131 2.349 -19.200 1.00 25.00 N ATOM 163 CA LEU A 13 -0.863 2.036 -19.839 1.00 25.00 C ATOM 164 C LEU A 13 0.246 2.954 -19.283 1.00 25.00 C ATOM 165 O LEU A 13 1.296 2.481 -18.910 1.00 25.00 O ATOM 166 CB LEU A 13 -0.984 2.247 -21.388 1.00 25.00 C ATOM 167 CG LEU A 13 -1.785 1.188 -22.146 1.00 25.00 C ATOM 168 CD1 LEU A 13 -2.113 1.682 -23.525 1.00 25.00 C ATOM 169 CD2 LEU A 13 -1.037 -0.115 -22.202 1.00 25.00 C ATOM 170 H LEU A 13 -2.916 2.558 -19.813 1.00 25.00 H ATOM 171 HA LEU A 13 -0.579 1.010 -19.621 1.00 25.00 H ATOM 172 HB2 LEU A 13 -1.451 3.218 -21.519 1.00 25.00 H ATOM 173 HB3 LEU A 13 0.031 2.325 -21.778 1.00 25.00 H ATOM 174 HG LEU A 13 -2.711 1.000 -21.613 1.00 25.00 H ATOM 175 HD11 LEU A 13 -2.652 2.619 -23.452 1.00 50.00 H ATOM 176 HD12 LEU A 13 -2.734 0.944 -24.054 1.00 50.00 H ATOM 177 HD13 LEU A 13 -1.190 1.867 -24.081 1.00 50.00 H ATOM 178 HD21 LEU A 13 -1.558 -0.819 -22.841 1.00 50.00 H ATOM 179 HD22 LEU A 13 -0.978 -0.534 -21.190 1.00 50.00 H ATOM 180 HD23 LEU A 13 -0.020 0.043 -22.578 1.00 50.00 H ATOM 181 N TYR A 14 -0.033 4.241 -19.174 1.00 25.00 N ATOM 182 CA TYR A 14 0.942 5.207 -18.631 1.00 25.00 C ATOM 183 C TYR A 14 1.410 4.867 -17.219 1.00 25.00 C ATOM 184 O TYR A 14 2.601 4.879 -16.938 1.00 25.00 O ATOM 185 CB TYR A 14 0.371 6.583 -18.636 1.00 25.00 C ATOM 186 CG TYR A 14 -0.757 6.730 -19.584 1.00 25.00 C ATOM 187 CD1 TYR A 14 -0.531 6.701 -20.961 1.00 25.00 C ATOM 188 CD2 TYR A 14 -2.073 6.860 -19.112 1.00 25.00 C ATOM 189 CE1 TYR A 14 -1.618 6.830 -21.899 1.00 25.00 C ATOM 190 CE2 TYR A 14 -3.160 6.906 -20.001 1.00 25.00 C ATOM 191 CZ TYR A 14 -2.937 6.891 -21.402 1.00 25.00 C ATOM 192 OH TYR A 14 -4.010 6.963 -22.230 1.00 25.00 O ATOM 193 H TYR A 14 -0.965 4.585 -19.441 1.00 25.00 H ATOM 194 HA TYR A 14 1.817 5.222 -19.287 1.00 25.00 H ATOM 195 HB2 TYR A 14 0.035 6.842 -17.608 1.00 50.00 H ATOM 196 HB3 TYR A 14 1.164 7.266 -18.929 1.00 50.00 H ATOM 197 HD1 TYR A 14 0.490 6.596 -21.337 1.00 25.00 H ATOM 198 HD2 TYR A 14 -2.281 6.875 -18.046 1.00 25.00 H ATOM 199 HE1 TYR A 14 -1.423 6.825 -22.952 1.00 25.00 H ATOM 200 HE2 TYR A 14 -4.174 6.975 -19.640 1.00 25.00 H ATOM 201 HH TYR A 14 -3.803 6.967 -23.166 1.00 25.00 H ATOM 202 N GLN A 15 0.470 4.491 -16.368 1.00 25.00 N ATOM 203 CA GLN A 15 0.775 4.173 -14.962 1.00 25.00 C ATOM 204 C GLN A 15 1.677 2.938 -14.889 1.00 25.00 C ATOM 205 O GLN A 15 2.638 2.940 -14.163 1.00 25.00 O ATOM 206 CB GLN A 15 -0.493 3.869 -14.112 1.00 25.00 C ATOM 207 CG GLN A 15 -1.519 5.014 -14.112 1.00 25.00 C ATOM 208 CD GLN A 15 -2.632 4.800 -13.093 1.00 25.00 C ATOM 209 OE1 GLN A 15 -2.440 4.877 -11.909 1.00 25.00 O ATOM 210 NE2 GLN A 15 -3.821 4.584 -13.584 1.00 25.00 N ATOM 211 H GLN A 15 -0.474 4.464 -16.666 1.00 25.00 H ATOM 212 HA GLN A 15 1.313 5.008 -14.513 1.00 25.00 H ATOM 213 HB2 GLN A 15 -0.969 2.967 -14.493 1.00 50.00 H ATOM 214 HB3 GLN A 15 -0.147 3.695 -13.079 1.00 50.00 H ATOM 215 HG2 GLN A 15 -1.015 5.938 -13.850 1.00 50.00 H ATOM 216 HG3 GLN A 15 -1.944 5.090 -15.124 1.00 50.00 H ATOM 217 HE21 GLN A 15 -3.971 4.555 -14.587 1.00 25.00 H ATOM 218 HE22 GLN A 15 -4.585 4.470 -12.954 1.00 25.00 H ATOM 219 N LEU A 16 1.306 1.905 -15.595 1.00 25.00 N ATOM 220 CA LEU A 16 2.096 0.701 -15.589 1.00 25.00 C ATOM 221 C LEU A 16 3.486 0.931 -16.149 1.00 25.00 C ATOM 222 O LEU A 16 4.469 0.426 -15.573 1.00 25.00 O ATOM 223 CB LEU A 16 1.372 -0.409 -16.399 1.00 25.00 C ATOM 224 CG LEU A 16 0.004 -0.872 -15.866 1.00 25.00 C ATOM 225 CD1 LEU A 16 -0.734 -1.555 -16.958 1.00 25.00 C ATOM 226 CD2 LEU A 16 0.207 -1.841 -14.664 1.00 25.00 C ATOM 227 H LEU A 16 0.456 1.955 -16.196 1.00 25.00 H ATOM 228 HA LEU A 16 2.209 0.360 -14.557 1.00 25.00 H ATOM 229 HB2 LEU A 16 1.224 -0.054 -17.420 1.00 50.00 H ATOM 230 HB3 LEU A 16 2.081 -1.234 -16.437 1.00 50.00 H ATOM 231 HG LEU A 16 -0.601 -0.006 -15.566 1.00 25.00 H ATOM 232 HD11 LEU A 16 -1.741 -1.765 -16.638 1.00 50.00 H ATOM 233 HD12 LEU A 16 -0.249 -2.497 -17.207 1.00 50.00 H ATOM 234 HD13 LEU A 16 -0.765 -0.925 -17.845 1.00 50.00 H ATOM 235 HD21 LEU A 16 0.901 -1.373 -13.958 1.00 50.00 H ATOM 236 HD22 LEU A 16 0.616 -2.787 -15.015 1.00 50.00 H ATOM 237 HD23 LEU A 16 -0.750 -2.023 -14.174 1.00 50.00 H ATOM 238 N GLU A 17 3.596 1.683 -17.242 1.00 25.00 N ATOM 239 CA GLU A 17 4.921 1.974 -17.802 1.00 25.00 C ATOM 240 C GLU A 17 5.782 2.821 -16.866 1.00 25.00 C ATOM 241 O GLU A 17 6.986 2.653 -16.868 1.00 25.00 O ATOM 242 CB GLU A 17 4.759 2.685 -19.137 1.00 25.00 C ATOM 243 CG GLU A 17 4.479 1.674 -20.286 1.00 25.00 C ATOM 244 CD GLU A 17 4.606 2.278 -21.645 1.00 25.00 C ATOM 245 OE1 GLU A 17 3.686 2.433 -22.394 1.00 25.00 O ATOM 246 OE2 GLU A 17 5.809 2.680 -21.937 1.00 25.00 O ATOM 247 H GLU A 17 2.795 2.066 -17.678 1.00 25.00 H ATOM 248 HA GLU A 17 5.418 1.014 -17.986 1.00 25.00 H ATOM 249 HB2 GLU A 17 3.983 3.442 -19.101 1.00 50.00 H ATOM 250 HB3 GLU A 17 5.704 3.162 -19.367 1.00 50.00 H ATOM 251 HG2 GLU A 17 5.161 0.847 -20.208 1.00 50.00 H ATOM 252 HG3 GLU A 17 3.451 1.296 -20.174 1.00 50.00 H ATOM 253 HE2 GLU A 17 6.438 2.531 -21.221 1.00 25.00 H ATOM 254 N ASN A 18 5.156 3.634 -16.020 1.00 25.00 N ATOM 255 CA ASN A 18 5.924 4.378 -15.041 1.00 25.00 C ATOM 256 C ASN A 18 6.586 3.472 -13.977 1.00 25.00 C ATOM 257 O ASN A 18 7.523 3.898 -13.293 1.00 25.00 O ATOM 258 CB ASN A 18 5.012 5.382 -14.323 1.00 25.00 C ATOM 259 CG ASN A 18 4.489 6.452 -15.212 1.00 25.00 C ATOM 260 OD1 ASN A 18 4.959 6.663 -16.313 1.00 25.00 O ATOM 261 ND2 ASN A 18 3.556 7.214 -14.697 1.00 25.00 N ATOM 262 H ASN A 18 4.148 3.736 -16.042 1.00 25.00 H ATOM 263 HA ASN A 18 6.707 4.915 -15.572 1.00 25.00 H ATOM 264 HB2 ASN A 18 4.159 4.841 -13.893 1.00 50.00 H ATOM 265 HB3 ASN A 18 5.560 5.819 -13.510 1.00 50.00 H ATOM 266 HD21 ASN A 18 3.236 7.012 -13.796 1.00 50.00 H ATOM 267 HD22 ASN A 18 3.174 7.990 -15.265 1.00 50.00 H ATOM 268 N TYR A 19 6.082 2.259 -13.778 1.00 25.00 N ATOM 269 CA TYR A 19 6.629 1.383 -12.734 1.00 25.00 C ATOM 270 C TYR A 19 7.956 0.744 -13.171 1.00 25.00 C ATOM 271 O TYR A 19 8.798 0.391 -12.344 1.00 25.00 O ATOM 272 CB TYR A 19 5.652 0.240 -12.424 1.00 25.00 C ATOM 273 CG TYR A 19 4.246 0.653 -11.971 1.00 25.00 C ATOM 274 CD1 TYR A 19 3.999 1.949 -11.457 1.00 25.00 C ATOM 275 CD2 TYR A 19 3.201 -0.269 -12.037 1.00 25.00 C ATOM 276 CE1 TYR A 19 2.691 2.350 -11.097 1.00 25.00 C ATOM 277 CE2 TYR A 19 1.904 0.137 -11.646 1.00 25.00 C ATOM 278 CZ TYR A 19 1.641 1.443 -11.211 1.00 25.00 C ATOM 279 OH TYR A 19 0.360 1.760 -10.891 1.00 25.00 O ATOM 280 H TYR A 19 5.273 1.922 -14.353 1.00 25.00 H ATOM 281 HA TYR A 19 6.800 1.965 -11.819 1.00 25.00 H ATOM 282 HB2 TYR A 19 5.548 -0.377 -13.307 1.00 50.00 H ATOM 283 HB3 TYR A 19 6.104 -0.390 -11.659 1.00 50.00 H ATOM 284 HD1 TYR A 19 4.804 2.659 -11.351 1.00 25.00 H ATOM 285 HD2 TYR A 19 3.381 -1.296 -12.388 1.00 25.00 H ATOM 286 HE1 TYR A 19 2.505 3.365 -10.738 1.00 25.00 H ATOM 287 HE2 TYR A 19 1.091 -0.575 -11.676 1.00 25.00 H ATOM 288 HH TYR A 19 -0.233 1.025 -11.027 1.00 25.00 H ATOM 289 N CYS A 20 8.092 0.570 -14.477 1.00 25.00 N ATOM 290 CA CYS A 20 9.308 0.000 -15.072 1.00 25.00 C ATOM 291 C CYS A 20 10.270 1.088 -15.451 1.00 25.00 C ATOM 292 O CYS A 20 9.898 2.235 -15.651 1.00 25.00 O ATOM 293 CB CYS A 20 8.930 -0.767 -16.319 1.00 25.00 C ATOM 294 SG CYS A 20 7.565 -1.925 -16.083 1.00 25.00 S ATOM 295 H CYS A 20 7.373 0.863 -15.088 1.00 25.00 H ATOM 296 HA CYS A 20 9.781 -0.683 -14.365 1.00 25.00 H ATOM 297 HB2 CYS A 20 8.630 0.009 -17.034 1.00 50.00 H ATOM 298 HB3 CYS A 20 9.781 -1.299 -16.733 1.00 50.00 H ATOM 299 N ASN A 21 11.586 0.739 -15.620 1.00 25.00 N ATOM 300 CA ASN A 21 12.590 1.751 -16.050 1.00 25.00 C ATOM 301 C ASN A 21 12.619 1.906 -17.573 1.00 25.00 C ATOM 302 O ASN A 21 12.681 1.005 -18.401 1.00 25.00 O ATOM 303 CB ASN A 21 13.997 1.427 -15.500 1.00 25.00 C ATOM 304 CG ASN A 21 15.017 2.436 -15.974 1.00 25.00 C ATOM 305 OD1 ASN A 21 15.895 2.188 -16.781 1.00 25.00 O ATOM 306 ND2 ASN A 21 14.876 3.672 -15.498 1.00 25.00 N ATOM 307 OXT ASN A 21 12.731 3.160 -17.960 1.00 25.00 O ATOM 308 H ASN A 21 11.836 -0.220 -15.526 1.00 25.00 H ATOM 309 HA ASN A 21 12.282 2.754 -15.640 1.00 25.00 H ATOM 310 HB2 ASN A 21 14.000 1.409 -14.408 1.00 50.00 H ATOM 311 HB3 ASN A 21 14.305 0.449 -15.818 1.00 50.00 H ATOM 312 HD21 ASN A 21 14.133 3.906 -14.845 1.00 50.00 H ATOM 313 HD22 ASN A 21 15.511 4.391 -15.836 1.00 50.00 H ATOM 314 HXT ASN A 21 12.529 3.118 -18.871 1.00 25.00 H TER 315 ASN A 21 ATOM 316 N PHE B 1 -5.064 -3.911 -25.404 1.00 25.00 N ATOM 317 CA PHE B 1 -5.106 -3.738 -23.932 1.00 25.00 C ATOM 318 C PHE B 1 -6.459 -3.451 -23.344 1.00 25.00 C ATOM 319 O PHE B 1 -7.276 -2.835 -23.957 1.00 25.00 O ATOM 320 CB PHE B 1 -4.157 -2.556 -23.574 1.00 25.00 C ATOM 321 CG PHE B 1 -3.872 -2.427 -22.110 1.00 25.00 C ATOM 322 CD1 PHE B 1 -4.739 -1.676 -21.337 1.00 25.00 C ATOM 323 CD2 PHE B 1 -2.731 -2.959 -21.552 1.00 25.00 C ATOM 324 CE1 PHE B 1 -4.493 -1.450 -19.999 1.00 25.00 C ATOM 325 CE2 PHE B 1 -2.465 -2.756 -20.175 1.00 25.00 C ATOM 326 CZ PHE B 1 -3.371 -2.001 -19.393 1.00 25.00 C ATOM 327 H1 PHE B 1 -4.174 -4.378 -25.623 1.00 25.00 H ATOM 328 H2 PHE B 1 -5.845 -4.538 -25.694 1.00 25.00 H ATOM 329 HA PHE B 1 -4.768 -4.663 -23.477 1.00 25.00 H ATOM 330 HB2 PHE B 1 -3.248 -2.667 -24.125 1.00 25.00 H ATOM 331 HB3 PHE B 1 -4.639 -1.601 -23.921 1.00 25.00 H ATOM 332 HD1 PHE B 1 -5.640 -1.209 -21.740 1.00 25.00 H ATOM 333 HD2 PHE B 1 -2.074 -3.550 -22.194 1.00 25.00 H ATOM 334 HE1 PHE B 1 -5.152 -0.858 -19.432 1.00 25.00 H ATOM 335 HE2 PHE B 1 -1.565 -3.149 -19.712 1.00 25.00 H ATOM 336 HZ PHE B 1 -3.118 -1.818 -18.357 1.00 25.00 H ATOM 337 N VAL B 2 -6.754 -3.909 -22.133 1.00 25.00 N ATOM 338 CA VAL B 2 -8.038 -3.721 -21.510 1.00 25.00 C ATOM 339 C VAL B 2 -7.852 -3.057 -20.125 1.00 25.00 C ATOM 340 O VAL B 2 -7.231 -3.626 -19.202 1.00 25.00 O ATOM 341 CB VAL B 2 -8.833 -5.101 -21.383 1.00 25.00 C ATOM 342 CG1 VAL B 2 -10.308 -4.856 -20.957 1.00 25.00 C ATOM 343 CG2 VAL B 2 -8.818 -5.799 -22.741 1.00 25.00 C ATOM 344 H VAL B 2 -6.000 -4.362 -21.593 1.00 25.00 H ATOM 345 HA VAL B 2 -8.631 -3.062 -22.129 1.00 25.00 H ATOM 346 HB VAL B 2 -8.339 -5.732 -20.644 1.00 25.00 H ATOM 347 HG11 VAL B 2 -10.321 -4.289 -20.027 1.00 25.00 H ATOM 348 HG12 VAL B 2 -10.832 -4.279 -21.727 1.00 25.00 H ATOM 349 HG13 VAL B 2 -10.806 -5.818 -20.814 1.00 25.00 H ATOM 350 HG21 VAL B 2 -9.556 -6.591 -22.729 1.00 25.00 H ATOM 351 HG22 VAL B 2 -9.071 -5.067 -23.532 1.00 25.00 H ATOM 352 HG23 VAL B 2 -7.834 -6.201 -22.918 1.00 25.00 H ATOM 353 N ASN B 3 -8.440 -1.909 -19.937 1.00 25.00 N ATOM 354 CA ASN B 3 -8.437 -1.204 -18.638 1.00 25.00 C ATOM 355 C ASN B 3 -9.300 -1.948 -17.594 1.00 25.00 C ATOM 356 O ASN B 3 -10.501 -1.928 -17.660 1.00 25.00 O ATOM 357 CB ASN B 3 -8.929 0.253 -18.822 1.00 25.00 C ATOM 358 CG ASN B 3 -8.023 1.036 -19.717 1.00 25.00 C ATOM 359 OD1 ASN B 3 -8.342 1.288 -20.869 1.00 25.00 O ATOM 360 ND2 ASN B 3 -6.896 1.511 -19.193 1.00 25.00 N ATOM 361 H ASN B 3 -8.955 -1.498 -20.715 1.00 25.00 H ATOM 362 HA ASN B 3 -7.417 -1.154 -18.265 1.00 25.00 H ATOM 363 HB2 ASN B 3 -9.925 0.235 -19.236 1.00 25.00 H ATOM 364 HB3 ASN B 3 -8.968 0.754 -17.855 1.00 25.00 H ATOM 365 HD21 ASN B 3 -6.636 1.275 -18.261 1.00 50.00 H ATOM 366 HD22 ASN B 3 -6.272 2.038 -19.801 1.00 50.00 H ATOM 367 N GLN B 4 -8.647 -2.606 -16.632 1.00 25.00 N ATOM 368 CA GLN B 4 -9.319 -3.364 -15.597 1.00 25.00 C ATOM 369 C GLN B 4 -8.603 -3.110 -14.217 1.00 25.00 C ATOM 370 O GLN B 4 -7.470 -2.623 -14.135 1.00 25.00 O ATOM 371 CB GLN B 4 -9.211 -4.862 -15.933 1.00 25.00 C ATOM 372 CG GLN B 4 -9.927 -5.277 -17.194 1.00 25.00 C ATOM 373 CD GLN B 4 -10.153 -6.797 -17.325 1.00 25.00 C ATOM 374 OE1 GLN B 4 -11.260 -7.284 -17.380 1.00 25.00 O ATOM 375 NE2 GLN B 4 -9.059 -7.537 -17.440 1.00 25.00 N ATOM 376 H GLN B 4 -7.647 -2.602 -16.625 1.00 25.00 H ATOM 377 HA GLN B 4 -10.370 -3.071 -15.502 1.00 25.00 H ATOM 378 HB2 GLN B 4 -8.164 -5.149 -16.007 1.00 50.00 H ATOM 379 HB3 GLN B 4 -9.655 -5.459 -15.136 1.00 50.00 H ATOM 380 HG2 GLN B 4 -10.892 -4.777 -17.246 1.00 50.00 H ATOM 381 HG3 GLN B 4 -9.306 -4.929 -18.021 1.00 50.00 H ATOM 382 HE21 GLN B 4 -8.142 -7.107 -17.462 1.00 25.00 H ATOM 383 HE22 GLN B 4 -9.174 -8.546 -17.606 1.00 25.00 H ATOM 384 N HIS B 5 -9.190 -3.628 -13.144 1.00 25.00 N ATOM 385 CA HIS B 5 -8.494 -3.709 -11.869 1.00 25.00 C ATOM 386 C HIS B 5 -7.509 -4.889 -11.972 1.00 25.00 C ATOM 387 O HIS B 5 -7.859 -5.955 -12.556 1.00 25.00 O ATOM 388 CB HIS B 5 -9.513 -3.924 -10.734 1.00 25.00 C ATOM 389 CG HIS B 5 -10.475 -2.788 -10.633 1.00 25.00 C ATOM 390 ND1 HIS B 5 -10.153 -1.599 -9.982 1.00 25.00 N ATOM 391 CD2 HIS B 5 -11.727 -2.600 -11.094 1.00 25.00 C ATOM 392 CE1 HIS B 5 -11.185 -0.760 -10.047 1.00 25.00 C ATOM 393 NE2 HIS B 5 -12.152 -1.357 -10.717 1.00 25.00 N ATOM 394 H HIS B 5 -10.044 -4.053 -13.209 1.00 25.00 H ATOM 395 HA HIS B 5 -7.956 -2.789 -11.678 1.00 25.00 H ATOM 396 HB2 HIS B 5 -10.056 -4.839 -10.906 1.00 50.00 H ATOM 397 HB3 HIS B 5 -8.939 -4.022 -9.799 1.00 50.00 H ATOM 398 HD1 HIS B 5 -9.258 -1.411 -9.573 1.00 25.00 H ATOM 399 HD2 HIS B 5 -12.306 -3.314 -11.729 1.00 25.00 H ATOM 400 HE1 HIS B 5 -11.213 0.258 -9.626 1.00 25.00 H ATOM 401 HE2 HIS B 5 -13.033 -0.953 -10.951 1.00 25.00 H ATOM 402 N LEU B 6 -6.296 -4.693 -11.441 1.00 25.00 N ATOM 403 CA LEU B 6 -5.241 -5.690 -11.517 1.00 25.00 C ATOM 404 C LEU B 6 -4.652 -5.759 -10.113 1.00 25.00 C ATOM 405 O LEU B 6 -4.139 -4.756 -9.643 1.00 25.00 O ATOM 406 CB LEU B 6 -4.163 -5.233 -12.520 1.00 25.00 C ATOM 407 CG LEU B 6 -4.624 -4.815 -13.910 1.00 25.00 C ATOM 408 CD1 LEU B 6 -3.391 -4.265 -14.664 1.00 25.00 C ATOM 409 CD2 LEU B 6 -5.246 -5.933 -14.739 1.00 25.00 C ATOM 410 H LEU B 6 -6.090 -3.853 -10.994 1.00 25.00 H ATOM 411 HA LEU B 6 -5.670 -6.633 -11.837 1.00 25.00 H ATOM 412 HB2 LEU B 6 -3.671 -4.382 -12.057 1.00 50.00 H ATOM 413 HB3 LEU B 6 -3.428 -6.042 -12.631 1.00 50.00 H ATOM 414 HG LEU B 6 -5.369 -4.013 -13.807 1.00 25.00 H ATOM 415 HD11 LEU B 6 -2.948 -3.447 -14.101 1.00 50.00 H ATOM 416 HD12 LEU B 6 -3.699 -3.921 -15.650 1.00 50.00 H ATOM 417 HD13 LEU B 6 -2.642 -5.038 -14.789 1.00 50.00 H ATOM 418 HD21 LEU B 6 -5.937 -6.483 -14.120 1.00 50.00 H ATOM 419 HD22 LEU B 6 -4.447 -6.589 -15.138 1.00 50.00 H ATOM 420 HD23 LEU B 6 -5.776 -5.475 -15.575 1.00 50.00 H ATOM 421 N CYS B 7 -4.734 -6.906 -9.441 1.00 25.00 N ATOM 422 CA CYS B 7 -4.233 -7.009 -8.061 1.00 25.00 C ATOM 423 C CYS B 7 -3.081 -8.000 -7.872 1.00 25.00 C ATOM 424 O CYS B 7 -2.018 -7.659 -7.411 1.00 25.00 O ATOM 425 CB CYS B 7 -5.345 -7.388 -7.094 1.00 25.00 C ATOM 426 SG CYS B 7 -6.871 -6.489 -7.360 1.00 25.00 S ATOM 427 H CYS B 7 -5.172 -7.701 -9.876 1.00 25.00 H ATOM 428 HA CYS B 7 -3.888 -6.029 -7.768 1.00 25.00 H ATOM 429 HB2 CYS B 7 -5.581 -8.441 -7.245 1.00 50.00 H ATOM 430 HB3 CYS B 7 -4.982 -7.243 -6.076 1.00 50.00 H ATOM 431 N GLY B 8 -3.351 -9.241 -8.231 1.00 25.00 N ATOM 432 CA GLY B 8 -2.406 -10.316 -8.079 1.00 25.00 C ATOM 433 C GLY B 8 -1.691 -10.578 -9.399 1.00 25.00 C ATOM 434 O GLY B 8 -1.153 -9.675 -9.983 1.00 25.00 O ATOM 435 H GLY B 8 -4.289 -9.473 -8.594 1.00 25.00 H ATOM 436 HA2 GLY B 8 -1.680 -10.068 -7.286 1.00 50.00 H ATOM 437 HA3 GLY B 8 -2.959 -11.198 -7.782 1.00 50.00 H ATOM 438 N SER B 9 -1.776 -11.829 -9.888 1.00 25.00 N ATOM 439 CA SER B 9 -1.110 -12.225 -11.147 1.00 25.00 C ATOM 440 C SER B 9 -1.458 -11.294 -12.303 1.00 25.00 C ATOM 441 O SER B 9 -0.699 -11.170 -13.256 1.00 25.00 O ATOM 442 CB SER B 9 -1.499 -13.694 -11.509 1.00 25.00 C ATOM 443 OG SER B 9 -1.479 -14.503 -10.333 1.00 25.00 O ATOM 444 H SER B 9 -2.246 -12.538 -9.373 1.00 25.00 H ATOM 445 HA SER B 9 -0.029 -12.183 -10.973 1.00 25.00 H ATOM 446 HB2 SER B 9 -2.518 -13.723 -11.905 1.00 25.00 H ATOM 447 HB3 SER B 9 -0.797 -14.057 -12.254 1.00 25.00 H ATOM 448 HG SER B 9 -1.221 -15.400 -10.604 1.00 25.00 H ATOM 449 N HIS B 10 -2.630 -10.659 -12.266 1.00 25.00 N ATOM 450 CA HIS B 10 -3.038 -9.728 -13.339 1.00 25.00 C ATOM 451 C HIS B 10 -2.063 -8.586 -13.469 1.00 25.00 C ATOM 452 O HIS B 10 -1.820 -8.145 -14.586 1.00 25.00 O ATOM 453 CB HIS B 10 -4.437 -9.225 -13.002 1.00 25.00 C ATOM 454 CG HIS B 10 -5.524 -10.099 -13.526 1.00 25.00 C ATOM 455 ND1 HIS B 10 -6.427 -9.716 -14.548 1.00 25.00 N ATOM 456 CD2 HIS B 10 -5.846 -11.387 -13.223 1.00 25.00 C ATOM 457 CE1 HIS B 10 -7.206 -10.772 -14.844 1.00 25.00 C ATOM 458 NE2 HIS B 10 -6.897 -11.774 -14.044 1.00 25.00 N ATOM 459 H HIS B 10 -3.231 -10.786 -11.497 1.00 25.00 H ATOM 460 HA HIS B 10 -3.077 -10.266 -14.302 1.00 25.00 H ATOM 461 HB2 HIS B 10 -4.526 -9.070 -11.936 1.00 50.00 H ATOM 462 HB3 HIS B 10 -4.521 -8.266 -13.455 1.00 50.00 H ATOM 463 HD1 HIS B 10 -6.442 -8.834 -15.020 1.00 25.00 H ATOM 464 HD2 HIS B 10 -5.383 -12.002 -12.490 1.00 25.00 H ATOM 465 HE1 HIS B 10 -7.969 -10.750 -15.609 1.00 25.00 H ATOM 466 HE2 HIS B 10 -7.358 -12.655 -14.017 1.00 25.00 H ATOM 467 N LEU B 11 -1.556 -8.096 -12.355 1.00 25.00 N ATOM 468 CA LEU B 11 -0.716 -6.903 -12.371 1.00 25.00 C ATOM 469 C LEU B 11 0.599 -7.142 -13.075 1.00 25.00 C ATOM 470 O LEU B 11 1.026 -6.402 -13.957 1.00 25.00 O ATOM 471 CB LEU B 11 -0.470 -6.416 -10.946 1.00 25.00 C ATOM 472 CG LEU B 11 -0.563 -4.893 -10.729 1.00 25.00 C ATOM 473 CD1 LEU B 11 -0.644 -4.602 -9.229 1.00 25.00 C ATOM 474 CD2 LEU B 11 0.647 -4.136 -11.291 1.00 25.00 C ATOM 475 H LEU B 11 -1.724 -8.519 -11.487 1.00 25.00 H ATOM 476 HA LEU B 11 -1.250 -6.127 -12.896 1.00 25.00 H ATOM 477 HB2 LEU B 11 -1.223 -6.874 -10.319 1.00 50.00 H ATOM 478 HB3 LEU B 11 0.521 -6.736 -10.589 1.00 50.00 H ATOM 479 HG LEU B 11 -1.448 -4.533 -11.233 1.00 25.00 H ATOM 480 HD11 LEU B 11 0.214 -4.991 -8.690 1.00 50.00 H ATOM 481 HD12 LEU B 11 -1.529 -5.074 -8.809 1.00 50.00 H ATOM 482 HD13 LEU B 11 -0.683 -3.528 -9.039 1.00 50.00 H ATOM 483 HD21 LEU B 11 0.716 -4.274 -12.384 1.00 50.00 H ATOM 484 HD22 LEU B 11 1.551 -4.516 -10.809 1.00 50.00 H ATOM 485 HD23 LEU B 11 0.540 -3.072 -11.099 1.00 50.00 H ATOM 486 N VAL B 12 1.197 -8.251 -12.692 1.00 25.00 N ATOM 487 CA VAL B 12 2.482 -8.650 -13.240 1.00 25.00 C ATOM 488 C VAL B 12 2.368 -9.168 -14.650 1.00 25.00 C ATOM 489 O VAL B 12 3.299 -9.026 -15.452 1.00 25.00 O ATOM 490 CB VAL B 12 3.221 -9.695 -12.321 1.00 25.00 C ATOM 491 CG1 VAL B 12 3.602 -9.011 -10.939 1.00 25.00 C ATOM 492 CG2 VAL B 12 2.336 -10.918 -12.037 1.00 25.00 C ATOM 493 H VAL B 12 0.789 -8.832 -11.974 1.00 25.00 H ATOM 494 HA VAL B 12 3.130 -7.761 -13.278 1.00 25.00 H ATOM 495 HB VAL B 12 4.153 -9.990 -12.809 1.00 25.00 H ATOM 496 HG11 VAL B 12 4.187 -9.696 -10.324 1.00 50.00 H ATOM 497 HG12 VAL B 12 4.198 -8.116 -11.107 1.00 50.00 H ATOM 498 HG13 VAL B 12 2.691 -8.762 -10.379 1.00 50.00 H ATOM 499 HG21 VAL B 12 1.456 -10.632 -11.473 1.00 50.00 H ATOM 500 HG22 VAL B 12 2.046 -11.379 -12.971 1.00 50.00 H ATOM 501 HG23 VAL B 12 2.892 -11.631 -11.451 1.00 50.00 H ATOM 502 N GLU B 13 1.209 -9.678 -15.026 1.00 25.00 N ATOM 503 CA GLU B 13 1.003 -10.040 -16.436 1.00 25.00 C ATOM 504 C GLU B 13 0.856 -8.836 -17.357 1.00 25.00 C ATOM 505 O GLU B 13 1.414 -8.819 -18.440 1.00 25.00 O ATOM 506 CB GLU B 13 -0.158 -10.980 -16.619 1.00 25.00 C ATOM 507 CG GLU B 13 0.068 -12.437 -16.344 1.00 25.00 C ATOM 508 CD GLU B 13 -1.125 -13.266 -16.776 1.00 25.00 C ATOM 509 OE1 GLU B 13 -2.183 -12.756 -17.104 1.00 25.00 O ATOM 510 OE2 GLU B 13 -0.923 -14.558 -16.778 1.00 25.00 O ATOM 511 H GLU B 13 0.460 -9.834 -14.338 1.00 25.00 H ATOM 512 HA GLU B 13 1.890 -10.570 -16.777 1.00 25.00 H ATOM 513 HB2 GLU B 13 -0.964 -10.607 -16.001 1.00 50.00 H ATOM 514 HB3 GLU B 13 -0.443 -10.923 -17.665 1.00 50.00 H ATOM 515 HG2 GLU B 13 0.953 -12.750 -16.884 1.00 25.00 H ATOM 516 HG3 GLU B 13 0.207 -12.568 -15.264 1.00 25.00 H ATOM 517 HE2 GLU B 13 -0.005 -14.793 -16.590 1.00 25.00 H ATOM 518 N ALA B 14 0.199 -7.781 -16.855 1.00 25.00 N ATOM 519 CA ALA B 14 0.126 -6.509 -17.577 1.00 25.00 C ATOM 520 C ALA B 14 1.481 -5.907 -17.777 1.00 25.00 C ATOM 521 O ALA B 14 1.783 -5.368 -18.837 1.00 25.00 O ATOM 522 CB ALA B 14 -0.795 -5.534 -16.793 1.00 25.00 C ATOM 523 H ALA B 14 -0.237 -7.843 -15.917 1.00 25.00 H ATOM 524 HA ALA B 14 -0.308 -6.686 -18.563 1.00 25.00 H ATOM 525 HB1 ALA B 14 -1.722 -6.046 -16.547 1.00 25.00 H ATOM 526 HB2 ALA B 14 -0.296 -5.202 -15.868 1.00 25.00 H ATOM 527 HB3 ALA B 14 -1.016 -4.666 -17.400 1.00 25.00 H ATOM 528 N LEU B 15 2.301 -5.949 -16.709 1.00 25.00 N ATOM 529 CA LEU B 15 3.647 -5.391 -16.804 1.00 25.00 C ATOM 530 C LEU B 15 4.481 -6.192 -17.789 1.00 25.00 C ATOM 531 O LEU B 15 5.223 -5.646 -18.556 1.00 25.00 O ATOM 532 CB LEU B 15 4.352 -5.396 -15.442 1.00 25.00 C ATOM 533 CG LEU B 15 3.677 -4.482 -14.417 1.00 25.00 C ATOM 534 CD1 LEU B 15 4.347 -4.694 -13.071 1.00 25.00 C ATOM 535 CD2 LEU B 15 3.723 -3.024 -14.833 1.00 25.00 C ATOM 536 H LEU B 15 1.995 -6.367 -15.846 1.00 25.00 H ATOM 537 HA LEU B 15 3.556 -4.366 -17.174 1.00 25.00 H ATOM 538 HB2 LEU B 15 4.329 -6.413 -15.035 1.00 50.00 H ATOM 539 HB3 LEU B 15 5.390 -5.075 -15.583 1.00 50.00 H ATOM 540 HG LEU B 15 2.650 -4.771 -14.338 1.00 25.00 H ATOM 541 HD11 LEU B 15 4.136 -5.708 -12.710 1.00 50.00 H ATOM 542 HD12 LEU B 15 3.954 -3.989 -12.347 1.00 50.00 H ATOM 543 HD13 LEU B 15 5.426 -4.559 -13.149 1.00 50.00 H ATOM 544 HD21 LEU B 15 3.106 -2.859 -15.718 1.00 50.00 H ATOM 545 HD22 LEU B 15 4.738 -2.726 -15.068 1.00 50.00 H ATOM 546 HD23 LEU B 15 3.331 -2.412 -14.031 1.00 50.00 H ATOM 547 N TYR B 16 4.335 -7.512 -17.764 1.00 25.00 N ATOM 548 CA TYR B 16 5.033 -8.372 -18.697 1.00 25.00 C ATOM 549 C TYR B 16 4.664 -8.046 -20.138 1.00 25.00 C ATOM 550 O TYR B 16 5.520 -8.005 -21.021 1.00 25.00 O ATOM 551 CB TYR B 16 4.765 -9.834 -18.400 1.00 25.00 C ATOM 552 CG TYR B 16 5.214 -10.789 -19.536 1.00 25.00 C ATOM 553 CD1 TYR B 16 6.573 -11.189 -19.673 1.00 25.00 C ATOM 554 CD2 TYR B 16 4.297 -11.253 -20.496 1.00 25.00 C ATOM 555 CE1 TYR B 16 6.974 -12.062 -20.737 1.00 25.00 C ATOM 556 CE2 TYR B 16 4.706 -12.097 -21.564 1.00 25.00 C ATOM 557 CZ TYR B 16 6.040 -12.491 -21.643 1.00 25.00 C ATOM 558 OH TYR B 16 6.456 -13.281 -22.701 1.00 25.00 O ATOM 559 H TYR B 16 3.778 -7.922 -17.076 1.00 25.00 H ATOM 560 HA TYR B 16 6.107 -8.195 -18.569 1.00 25.00 H ATOM 561 HB2 TYR B 16 5.229 -10.173 -17.463 1.00 25.00 H ATOM 562 HB3 TYR B 16 3.708 -9.958 -18.268 1.00 25.00 H ATOM 563 HD1 TYR B 16 7.286 -10.854 -18.968 1.00 25.00 H ATOM 564 HD2 TYR B 16 3.222 -10.961 -20.365 1.00 25.00 H ATOM 565 HE1 TYR B 16 8.005 -12.403 -20.814 1.00 25.00 H ATOM 566 HE2 TYR B 16 3.979 -12.427 -22.269 1.00 25.00 H ATOM 567 HH TYR B 16 5.750 -13.531 -23.331 1.00 25.00 H ATOM 568 N LEU B 17 3.416 -7.684 -20.332 1.00 25.00 N ATOM 569 CA LEU B 17 2.954 -7.278 -21.631 1.00 25.00 C ATOM 570 C LEU B 17 3.419 -5.887 -22.071 1.00 25.00 C ATOM 571 O LEU B 17 3.603 -5.640 -23.251 1.00 25.00 O ATOM 572 CB LEU B 17 1.411 -7.263 -21.679 1.00 25.00 C ATOM 573 CG LEU B 17 0.650 -8.580 -21.879 1.00 25.00 C ATOM 574 CD1 LEU B 17 -0.838 -8.345 -21.607 1.00 25.00 C ATOM 575 CD2 LEU B 17 0.831 -8.999 -23.342 1.00 25.00 C ATOM 576 H LEU B 17 2.771 -7.697 -19.555 1.00 25.00 H ATOM 577 HA LEU B 17 3.315 -8.001 -22.362 1.00 25.00 H ATOM 578 HB2 LEU B 17 1.083 -6.848 -20.724 1.00 50.00 H ATOM 579 HB3 LEU B 17 1.106 -6.558 -22.477 1.00 50.00 H ATOM 580 HG LEU B 17 1.038 -9.323 -21.206 1.00 25.00 H ATOM 581 HD11 LEU B 17 -0.962 -7.945 -20.588 1.00 50.00 H ATOM 582 HD12 LEU B 17 -1.367 -9.301 -21.696 1.00 50.00 H ATOM 583 HD13 LEU B 17 -1.237 -7.645 -22.331 1.00 50.00 H ATOM 584 HD21 LEU B 17 0.472 -8.220 -23.999 1.00 50.00 H ATOM 585 HD22 LEU B 17 0.259 -9.902 -23.538 1.00 50.00 H ATOM 586 HD23 LEU B 17 1.892 -9.183 -23.531 1.00 50.00 H ATOM 587 N VAL B 18 3.488 -4.956 -21.123 1.00 25.00 N ATOM 588 CA VAL B 18 3.748 -3.533 -21.421 1.00 25.00 C ATOM 589 C VAL B 18 5.253 -3.177 -21.355 1.00 25.00 C ATOM 590 O VAL B 18 5.724 -2.359 -22.115 1.00 25.00 O ATOM 591 CB VAL B 18 2.845 -2.526 -20.521 1.00 25.00 C ATOM 592 CG1 VAL B 18 3.558 -2.101 -19.196 1.00 25.00 C ATOM 593 CG2 VAL B 18 2.448 -1.269 -21.301 1.00 25.00 C ATOM 594 H VAL B 18 3.334 -5.229 -20.122 1.00 25.00 H ATOM 595 HA VAL B 18 3.435 -3.398 -22.454 1.00 25.00 H ATOM 596 HB VAL B 18 1.926 -3.049 -20.255 1.00 25.00 H ATOM 597 HG11 VAL B 18 2.831 -1.716 -18.506 1.00 50.00 H ATOM 598 HG12 VAL B 18 4.019 -2.970 -18.761 1.00 50.00 H ATOM 599 HG13 VAL B 18 4.288 -1.324 -19.420 1.00 50.00 H ATOM 600 HG21 VAL B 18 3.304 -0.918 -21.856 1.00 50.00 H ATOM 601 HG22 VAL B 18 1.649 -1.522 -21.988 1.00 50.00 H ATOM 602 HG23 VAL B 18 2.117 -0.517 -20.607 1.00 50.00 H ATOM 603 N CYS B 19 6.016 -3.826 -20.447 1.00 25.00 N ATOM 604 CA CYS B 19 7.433 -3.507 -20.254 1.00 25.00 C ATOM 605 C CYS B 19 8.366 -4.564 -20.874 1.00 25.00 C ATOM 606 O CYS B 19 9.584 -4.336 -20.978 1.00 25.00 O ATOM 607 CB CYS B 19 7.721 -3.375 -18.759 1.00 25.00 C ATOM 608 SG CYS B 19 6.830 -1.990 -17.993 1.00 25.00 S ATOM 609 H CYS B 19 5.601 -4.507 -19.832 1.00 25.00 H ATOM 610 HA CYS B 19 7.640 -2.566 -20.733 1.00 25.00 H ATOM 611 HB2 CYS B 19 7.393 -4.305 -18.266 1.00 50.00 H ATOM 612 HB3 CYS B 19 8.796 -3.214 -18.629 1.00 50.00 H ATOM 613 N GLY B 20 7.796 -5.707 -21.326 1.00 25.00 N ATOM 614 CA GLY B 20 8.565 -6.702 -22.051 1.00 25.00 C ATOM 615 C GLY B 20 9.805 -7.225 -21.302 1.00 25.00 C ATOM 616 O GLY B 20 9.790 -7.625 -20.158 1.00 25.00 O ATOM 617 H GLY B 20 6.819 -5.908 -21.154 1.00 25.00 H ATOM 618 HA2 GLY B 20 7.915 -7.528 -22.356 1.00 25.00 H ATOM 619 HA3 GLY B 20 8.891 -6.216 -22.970 1.00 25.00 H ATOM 620 N GLU B 21 10.942 -7.165 -21.994 1.00 25.00 N ATOM 621 CA GLU B 21 12.213 -7.706 -21.556 1.00 25.00 C ATOM 622 C GLU B 21 12.818 -7.038 -20.334 1.00 25.00 C ATOM 623 O GLU B 21 13.643 -7.638 -19.658 1.00 25.00 O ATOM 624 CB GLU B 21 13.206 -7.671 -22.706 1.00 25.00 C ATOM 625 CG GLU B 21 13.623 -6.276 -23.180 1.00 25.00 C ATOM 626 CD GLU B 21 14.478 -6.341 -24.396 1.00 25.00 C ATOM 627 OE1 GLU B 21 15.637 -6.225 -24.353 1.00 25.00 O ATOM 628 OE2 GLU B 21 13.818 -6.610 -25.486 1.00 25.00 O ATOM 629 H GLU B 21 10.904 -6.804 -22.927 1.00 25.00 H ATOM 630 HA GLU B 21 12.077 -8.758 -21.283 1.00 25.00 H ATOM 631 HB2 GLU B 21 14.131 -8.178 -22.401 1.00 50.00 H ATOM 632 HB3 GLU B 21 12.776 -8.190 -23.521 1.00 50.00 H ATOM 633 HG2 GLU B 21 12.744 -5.666 -23.412 1.00 25.00 H ATOM 634 HG3 GLU B 21 14.180 -5.808 -22.380 1.00 25.00 H ATOM 635 HE2 GLU B 21 12.870 -6.723 -25.328 1.00 25.00 H ATOM 636 N ARG B 22 12.445 -5.806 -20.053 1.00 25.00 N ATOM 637 CA ARG B 22 13.088 -5.110 -18.937 1.00 25.00 C ATOM 638 C ARG B 22 12.454 -5.650 -17.635 1.00 25.00 C ATOM 639 O ARG B 22 13.053 -5.531 -16.589 1.00 25.00 O ATOM 640 CB ARG B 22 13.007 -3.599 -19.100 1.00 25.00 C ATOM 641 CG ARG B 22 13.710 -3.130 -20.391 1.00 25.00 C ATOM 642 CD ARG B 22 14.154 -1.688 -20.318 1.00 25.00 C ATOM 643 NE ARG B 22 15.204 -1.465 -19.269 1.00 25.00 N ATOM 644 CZ ARG B 22 15.963 -0.387 -19.148 1.00 25.00 C ATOM 645 NH1 ARG B 22 15.830 0.634 -19.977 1.00 25.00 N ATOM 646 NH2 ARG B 22 16.842 -0.325 -18.212 1.00 25.00 N ATOM 647 H ARG B 22 11.757 -5.368 -20.569 1.00 25.00 H ATOM 648 HA ARG B 22 14.130 -5.363 -18.904 1.00 25.00 H ATOM 649 HB2 ARG B 22 11.959 -3.302 -19.116 1.00 25.00 H ATOM 650 HB3 ARG B 22 13.496 -3.136 -18.245 1.00 25.00 H ATOM 651 HG2 ARG B 22 14.581 -3.767 -20.571 1.00 25.00 H ATOM 652 HG3 ARG B 22 13.021 -3.235 -21.229 1.00 25.00 H ATOM 653 HD2 ARG B 22 14.512 -1.435 -21.313 1.00 25.00 H ATOM 654 HD3 ARG B 22 13.302 -1.066 -20.108 1.00 25.00 H ATOM 655 HE ARG B 22 15.336 -2.239 -18.612 1.00 25.00 H ATOM 656 HH11 ARG B 22 15.118 0.611 -20.708 1.00 25.00 H ATOM 657 HH12 ARG B 22 16.403 1.453 -19.861 1.00 25.00 H ATOM 658 HH21 ARG B 22 16.930 -1.081 -17.577 1.00 25.00 H ATOM 659 HH22 ARG B 22 17.441 0.505 -18.121 1.00 25.00 H ATOM 660 N GLY B 23 11.260 -6.193 -17.705 1.00 25.00 N ATOM 661 CA GLY B 23 10.601 -6.678 -16.467 1.00 25.00 C ATOM 662 C GLY B 23 10.261 -5.559 -15.520 1.00 25.00 C ATOM 663 O GLY B 23 10.115 -4.416 -15.935 1.00 25.00 O ATOM 664 H GLY B 23 10.783 -6.270 -18.594 1.00 25.00 H ATOM 665 HA2 GLY B 23 9.680 -7.212 -16.711 1.00 50.00 H ATOM 666 HA3 GLY B 23 11.264 -7.387 -15.961 1.00 50.00 H ATOM 667 N PHE B 24 10.141 -5.889 -14.231 1.00 25.00 N ATOM 668 CA PHE B 24 9.751 -4.940 -13.165 1.00 25.00 C ATOM 669 C PHE B 24 10.477 -5.360 -11.872 1.00 25.00 C ATOM 670 O PHE B 24 10.926 -6.467 -11.756 1.00 25.00 O ATOM 671 CB PHE B 24 8.218 -4.997 -12.961 1.00 25.00 C ATOM 672 CG PHE B 24 7.649 -6.381 -12.991 1.00 25.00 C ATOM 673 CD1 PHE B 24 7.646 -7.156 -11.834 1.00 25.00 C ATOM 674 CD2 PHE B 24 7.091 -6.868 -14.168 1.00 25.00 C ATOM 675 CE1 PHE B 24 7.133 -8.509 -11.871 1.00 25.00 C ATOM 676 CE2 PHE B 24 6.539 -8.190 -14.243 1.00 25.00 C ATOM 677 CZ PHE B 24 6.581 -9.015 -13.081 1.00 25.00 C ATOM 678 H PHE B 24 10.373 -6.820 -13.967 1.00 25.00 H ATOM 679 HA PHE B 24 10.031 -3.910 -13.407 1.00 25.00 H ATOM 680 HB2 PHE B 24 7.985 -4.568 -11.987 1.00 50.00 H ATOM 681 HB3 PHE B 24 7.712 -4.425 -13.750 1.00 50.00 H ATOM 682 HD1 PHE B 24 8.061 -6.773 -10.914 1.00 25.00 H ATOM 683 HD2 PHE B 24 7.088 -6.227 -15.060 1.00 25.00 H ATOM 684 HE1 PHE B 24 7.143 -9.129 -10.968 1.00 25.00 H ATOM 685 HE2 PHE B 24 6.102 -8.573 -15.143 1.00 25.00 H ATOM 686 HZ PHE B 24 6.193 -10.024 -13.153 1.00 25.00 H ATOM 687 N PHE B 25 10.531 -4.497 -10.861 1.00 25.00 N ATOM 688 CA PHE B 25 11.239 -4.822 -9.596 1.00 25.00 C ATOM 689 C PHE B 25 10.244 -5.544 -8.687 1.00 25.00 C ATOM 690 O PHE B 25 9.353 -4.961 -8.069 1.00 25.00 O ATOM 691 CB PHE B 25 11.815 -3.532 -8.909 1.00 25.00 C ATOM 692 CG PHE B 25 12.338 -3.792 -7.475 1.00 25.00 C ATOM 693 CD1 PHE B 25 13.175 -4.881 -7.196 1.00 25.00 C ATOM 694 CD2 PHE B 25 11.952 -2.942 -6.412 1.00 25.00 C ATOM 695 CE1 PHE B 25 13.583 -5.145 -5.868 1.00 25.00 C ATOM 696 CE2 PHE B 25 12.396 -3.188 -5.092 1.00 25.00 C ATOM 697 CZ PHE B 25 13.173 -4.301 -4.802 1.00 25.00 C ATOM 698 H PHE B 25 10.073 -3.592 -10.938 1.00 25.00 H ATOM 699 HA PHE B 25 12.059 -5.511 -9.792 1.00 25.00 H ATOM 700 HB2 PHE B 25 12.592 -3.133 -9.550 1.00 25.00 H ATOM 701 HB3 PHE B 25 11.009 -2.785 -8.877 1.00 25.00 H ATOM 702 HD1 PHE B 25 13.474 -5.529 -7.997 1.00 25.00 H ATOM 703 HD2 PHE B 25 11.324 -2.091 -6.632 1.00 25.00 H ATOM 704 HE1 PHE B 25 14.189 -6.022 -5.679 1.00 25.00 H ATOM 705 HE2 PHE B 25 12.120 -2.532 -4.272 1.00 25.00 H ATOM 706 HZ PHE B 25 13.466 -4.506 -3.794 1.00 25.00 H HETATM 707 N NVA B 26 10.428 -6.870 -8.605 1.00 25.00 N HETATM 708 CA NVA B 26 9.723 -7.708 -7.641 1.00 25.00 C HETATM 709 CB NVA B 26 9.230 -9.064 -8.234 1.00 25.00 C HETATM 710 CG NVA B 26 8.283 -9.785 -7.201 1.00 25.00 C HETATM 711 CD NVA B 26 8.033 -11.226 -7.598 1.00 25.00 C HETATM 712 C NVA B 26 10.645 -7.926 -6.433 1.00 25.00 C HETATM 713 O NVA B 26 11.782 -8.381 -6.502 1.00 25.00 O HETATM 714 H NVA B 26 11.103 -7.315 -9.178 1.00 25.00 H HETATM 715 HA NVA B 26 8.836 -7.125 -7.263 1.00 25.00 H HETATM 716 HB2 NVA B 26 8.665 -8.883 -9.173 1.00 25.00 H HETATM 717 HB3 NVA B 26 10.084 -9.702 -8.502 1.00 25.00 H HETATM 718 HG2 NVA B 26 8.726 -9.745 -6.204 1.00 25.00 H HETATM 719 HG3 NVA B 26 7.314 -9.260 -7.143 1.00 25.00 H HETATM 720 HD2 NVA B 26 7.191 -11.266 -8.266 1.00 75.00 H HETATM 721 HD3 NVA B 26 8.913 -11.595 -8.155 1.00 75.00 H ATOM 722 N THR B 27 10.119 -7.596 -5.221 1.00 25.00 N ATOM 723 CA THR B 27 10.793 -7.838 -3.972 1.00 25.00 C ATOM 724 C THR B 27 10.902 -9.342 -3.730 1.00 25.00 C ATOM 725 O THR B 27 10.011 -10.078 -4.148 1.00 25.00 O ATOM 726 CB THR B 27 10.081 -7.160 -2.763 1.00 25.00 C ATOM 727 OG1 THR B 27 8.652 -7.398 -2.867 1.00 25.00 O ATOM 728 CG2 THR B 27 10.301 -5.636 -2.792 1.00 25.00 C ATOM 729 H THR B 27 9.189 -7.179 -5.174 1.00 25.00 H ATOM 730 HA THR B 27 11.810 -7.452 -4.094 1.00 25.00 H ATOM 731 HB THR B 27 10.489 -7.588 -1.829 1.00 25.00 H ATOM 732 HG1 THR B 27 8.399 -8.066 -2.229 1.00 25.00 H ATOM 733 HG21 THR B 27 10.045 -5.210 -3.781 1.00 25.00 H ATOM 734 HG22 THR B 27 11.310 -5.384 -2.572 1.00 25.00 H ATOM 735 HG23 THR B 27 9.636 -5.161 -2.047 1.00 25.00 H ATOM 736 N PRO B 28 11.950 -9.791 -3.040 1.00 25.00 N ATOM 737 CA PRO B 28 12.042 -11.252 -2.876 1.00 25.00 C ATOM 738 C PRO B 28 10.825 -11.919 -2.250 1.00 25.00 C ATOM 739 O PRO B 28 10.346 -11.467 -1.232 1.00 25.00 O ATOM 740 CB PRO B 28 13.245 -11.423 -1.956 1.00 25.00 C ATOM 741 CG PRO B 28 14.083 -10.242 -2.219 1.00 25.00 C ATOM 742 CD PRO B 28 13.104 -9.118 -2.435 1.00 25.00 C ATOM 743 HA PRO B 28 12.274 -11.708 -3.836 1.00 25.00 H ATOM 744 HB2 PRO B 28 12.927 -11.412 -0.889 1.00 50.00 H ATOM 745 HB3 PRO B 28 13.784 -12.332 -2.225 1.00 50.00 H ATOM 746 HG2 PRO B 28 14.692 -10.025 -1.329 1.00 25.00 H ATOM 747 HG3 PRO B 28 14.680 -10.387 -3.133 1.00 25.00 H ATOM 748 HD2 PRO B 28 12.826 -8.625 -1.508 1.00 50.00 H ATOM 749 HD3 PRO B 28 13.511 -8.391 -3.141 1.00 50.00 H HETATM 750 N HIX B 29 10.340 -12.977 -2.925 1.00 25.00 N HETATM 751 CA HIX B 29 9.159 -13.753 -2.556 1.00 25.00 C HETATM 752 C HIX B 29 9.453 -14.797 -1.448 1.00 25.00 C HETATM 753 O HIX B 29 9.933 -15.913 -1.661 1.00 25.00 O HETATM 754 CB HIX B 29 8.589 -14.473 -3.815 1.00 25.00 C HETATM 755 CG HIX B 29 8.035 -13.518 -4.822 1.00 25.00 C HETATM 756 CD2 HIX B 29 8.784 -12.896 -5.804 1.00 25.00 C HETATM 757 ND1 HIX B 29 6.732 -13.000 -4.927 1.00 25.00 N HETATM 758 NE1 HIX B 29 6.523 -12.108 -5.967 1.00 25.00 N HETATM 759 NE2 HIX B 29 7.835 -12.136 -6.463 1.00 25.00 N HETATM 760 H HIX B 29 10.792 -13.238 -3.776 1.00 25.00 H HETATM 761 HA HIX B 29 8.360 -13.042 -2.174 1.00 25.00 H HETATM 762 HB1 HIX B 29 9.344 -15.061 -4.253 1.00 50.00 H HETATM 763 HB2 HIX B 29 7.784 -15.136 -3.498 1.00 50.00 H HETATM 764 HD2 HIX B 29 9.841 -12.922 -6.087 1.00 25.00 H HETATM 765 HD1 HIX B 29 5.977 -13.235 -4.341 1.00 25.00 H ATOM 766 N THR B 30 9.167 -14.331 -0.201 1.00 25.00 N ATOM 767 CA THR B 30 9.361 -15.067 1.085 1.00 25.00 C ATOM 768 C THR B 30 8.743 -14.325 2.303 1.00 25.00 C ATOM 769 O THR B 30 8.516 -13.139 2.333 1.00 25.00 O ATOM 770 CB THR B 30 10.851 -15.418 1.360 1.00 25.00 C ATOM 771 OG1 THR B 30 10.950 -16.359 2.425 1.00 25.00 O ATOM 772 CG2 THR B 30 11.721 -14.211 1.657 1.00 25.00 C ATOM 773 OXT THR B 30 8.405 -15.092 3.267 1.00 25.00 O ATOM 774 H THR B 30 8.804 -13.416 -0.144 1.00 25.00 H ATOM 775 HA THR B 30 8.807 -16.020 0.955 1.00 25.00 H ATOM 776 HB THR B 30 11.246 -15.867 0.459 1.00 25.00 H ATOM 777 HG1 THR B 30 10.935 -17.245 2.079 1.00 25.00 H ATOM 778 HG21 THR B 30 11.690 -13.525 0.828 1.00 25.00 H ATOM 779 HG22 THR B 30 12.721 -14.539 1.849 1.00 25.00 H ATOM 780 HG23 THR B 30 11.380 -13.689 2.527 1.00 25.00 H ATOM 781 HXT THR B 30 8.200 -14.505 3.952 1.00 25.00 H TER 782 THR B 30