ATOM 1 N VAL A 22 11.614 -1.437 -9.521 1.00 1.27 N ATOM 2 CA VAL A 22 10.271 -2.028 -9.627 1.00 1.13 C ATOM 3 C VAL A 22 9.279 -0.879 -9.762 1.00 0.84 C ATOM 4 O VAL A 22 9.413 0.103 -9.035 1.00 1.08 O ATOM 5 CB VAL A 22 9.959 -2.910 -8.402 1.00 1.14 C ATOM 6 CG1 VAL A 22 8.469 -3.250 -8.331 1.00 1.57 C ATOM 7 CG2 VAL A 22 10.756 -4.221 -8.438 1.00 1.11 C ATOM 8 H1 VAL A 22 11.788 -0.882 -10.345 1.00 1.41 H ATOM 9 H2 VAL A 22 11.598 -0.818 -8.719 1.00 1.26 H ATOM 10 H3 VAL A 22 12.316 -2.153 -9.417 1.00 1.41 H ATOM 11 HA VAL A 22 10.228 -2.641 -10.528 1.00 1.60 H ATOM 12 HB VAL A 22 10.214 -2.374 -7.486 1.00 1.32 H ATOM 13 HG11 VAL A 22 8.114 -3.643 -9.283 1.00 2.39 H ATOM 14 HG12 VAL A 22 8.298 -3.995 -7.555 1.00 2.25 H ATOM 15 HG13 VAL A 22 7.914 -2.348 -8.073 1.00 1.91 H ATOM 16 HG21 VAL A 22 10.462 -4.852 -7.598 1.00 2.05 H ATOM 17 HG22 VAL A 22 10.553 -4.757 -9.366 1.00 1.78 H ATOM 18 HG23 VAL A 22 11.824 -4.022 -8.360 1.00 1.36 H ATOM 19 N ASP A 23 8.337 -0.986 -10.697 1.00 0.68 N ATOM 20 CA ASP A 23 7.350 0.043 -10.963 1.00 0.56 C ATOM 21 C ASP A 23 6.309 0.039 -9.853 1.00 0.57 C ATOM 22 O ASP A 23 5.439 -0.831 -9.823 1.00 1.04 O ATOM 23 CB ASP A 23 6.703 -0.213 -12.327 1.00 0.67 C ATOM 24 CG ASP A 23 7.645 0.180 -13.450 1.00 1.14 C ATOM 25 OD1 ASP A 23 8.598 -0.600 -13.669 1.00 2.11 O ATOM 26 OD2 ASP A 23 7.413 1.259 -14.032 1.00 2.14 O ATOM 27 H ASP A 23 8.323 -1.782 -11.320 1.00 0.93 H ATOM 28 HA ASP A 23 7.834 1.021 -11.003 1.00 0.53 H ATOM 29 HB2 ASP A 23 6.454 -1.267 -12.440 1.00 1.05 H ATOM 30 HB3 ASP A 23 5.791 0.377 -12.421 1.00 1.01 H ATOM 31 N ALA A 24 6.394 1.023 -8.953 1.00 0.33 N ATOM 32 CA ALA A 24 5.428 1.238 -7.885 1.00 0.27 C ATOM 33 C ALA A 24 4.003 1.022 -8.389 1.00 0.26 C ATOM 34 O ALA A 24 3.269 0.197 -7.850 1.00 0.26 O ATOM 35 CB ALA A 24 5.588 2.656 -7.331 1.00 0.33 C ATOM 36 H ALA A 24 7.174 1.659 -9.027 1.00 0.62 H ATOM 37 HA ALA A 24 5.630 0.525 -7.084 1.00 0.27 H ATOM 38 HB1 ALA A 24 4.839 2.822 -6.559 1.00 1.43 H ATOM 39 HB2 ALA A 24 6.580 2.780 -6.899 1.00 1.56 H ATOM 40 HB3 ALA A 24 5.449 3.394 -8.122 1.00 1.66 H ATOM 41 N GLU A 25 3.624 1.736 -9.451 1.00 0.32 N ATOM 42 CA GLU A 25 2.275 1.657 -9.984 1.00 0.28 C ATOM 43 C GLU A 25 1.943 0.225 -10.415 1.00 0.25 C ATOM 44 O GLU A 25 0.841 -0.243 -10.156 1.00 0.31 O ATOM 45 CB GLU A 25 2.042 2.675 -11.113 1.00 0.32 C ATOM 46 CG GLU A 25 2.836 3.985 -10.934 1.00 1.05 C ATOM 47 CD GLU A 25 2.117 5.230 -11.457 1.00 1.66 C ATOM 48 OE1 GLU A 25 1.103 5.070 -12.168 1.00 1.94 O ATOM 49 OE2 GLU A 25 2.569 6.334 -11.078 1.00 3.09 O ATOM 50 H GLU A 25 4.261 2.398 -9.868 1.00 0.40 H ATOM 51 HA GLU A 25 1.601 1.930 -9.170 1.00 0.26 H ATOM 52 HB2 GLU A 25 2.300 2.246 -12.079 1.00 1.04 H ATOM 53 HB3 GLU A 25 0.971 2.885 -11.125 1.00 1.11 H ATOM 54 HG2 GLU A 25 3.022 4.147 -9.879 1.00 1.44 H ATOM 55 HG3 GLU A 25 3.795 3.906 -11.445 1.00 1.53 H ATOM 56 N ALA A 26 2.888 -0.491 -11.037 1.00 0.27 N ATOM 57 CA ALA A 26 2.675 -1.871 -11.459 1.00 0.31 C ATOM 58 C ALA A 26 2.435 -2.774 -10.250 1.00 0.29 C ATOM 59 O ALA A 26 1.528 -3.605 -10.257 1.00 0.34 O ATOM 60 CB ALA A 26 3.860 -2.384 -12.277 1.00 0.42 C ATOM 61 H ALA A 26 3.822 -0.111 -11.106 1.00 0.40 H ATOM 62 HA ALA A 26 1.801 -1.899 -12.110 1.00 0.31 H ATOM 63 HB1 ALA A 26 4.079 -1.695 -13.094 1.00 1.35 H ATOM 64 HB2 ALA A 26 4.737 -2.495 -11.641 1.00 1.53 H ATOM 65 HB3 ALA A 26 3.613 -3.360 -12.694 1.00 1.81 H ATOM 66 N VAL A 27 3.243 -2.613 -9.201 1.00 0.30 N ATOM 67 CA VAL A 27 3.045 -3.364 -7.970 1.00 0.35 C ATOM 68 C VAL A 27 1.656 -3.074 -7.427 1.00 0.32 C ATOM 69 O VAL A 27 0.892 -3.998 -7.170 1.00 0.41 O ATOM 70 CB VAL A 27 4.104 -3.003 -6.926 1.00 0.39 C ATOM 71 CG1 VAL A 27 3.843 -3.739 -5.609 1.00 0.42 C ATOM 72 CG2 VAL A 27 5.483 -3.395 -7.440 1.00 0.44 C ATOM 73 H VAL A 27 3.972 -1.904 -9.248 1.00 0.30 H ATOM 74 HA VAL A 27 3.104 -4.433 -8.192 1.00 0.43 H ATOM 75 HB VAL A 27 4.093 -1.932 -6.739 1.00 0.38 H ATOM 76 HG11 VAL A 27 3.863 -4.806 -5.796 1.00 1.47 H ATOM 77 HG12 VAL A 27 4.618 -3.489 -4.889 1.00 1.28 H ATOM 78 HG13 VAL A 27 2.881 -3.467 -5.174 1.00 1.63 H ATOM 79 HG21 VAL A 27 5.715 -2.842 -8.345 1.00 1.35 H ATOM 80 HG22 VAL A 27 6.217 -3.152 -6.672 1.00 1.59 H ATOM 81 HG23 VAL A 27 5.511 -4.461 -7.663 1.00 1.63 H ATOM 82 N VAL A 28 1.324 -1.797 -7.254 1.00 0.27 N ATOM 83 CA VAL A 28 0.018 -1.407 -6.760 1.00 0.37 C ATOM 84 C VAL A 28 -1.084 -2.067 -7.594 1.00 0.32 C ATOM 85 O VAL A 28 -1.965 -2.732 -7.037 1.00 0.38 O ATOM 86 CB VAL A 28 -0.049 0.126 -6.644 1.00 0.42 C ATOM 87 CG1 VAL A 28 -1.475 0.591 -6.363 1.00 0.52 C ATOM 88 CG2 VAL A 28 0.893 0.574 -5.515 1.00 0.46 C ATOM 89 H VAL A 28 1.995 -1.074 -7.497 1.00 0.24 H ATOM 90 HA VAL A 28 -0.090 -1.830 -5.767 1.00 0.47 H ATOM 91 HB VAL A 28 0.271 0.598 -7.573 1.00 0.40 H ATOM 92 HG11 VAL A 28 -2.047 0.598 -7.290 1.00 1.78 H ATOM 93 HG12 VAL A 28 -1.930 -0.099 -5.665 1.00 1.23 H ATOM 94 HG13 VAL A 28 -1.488 1.592 -5.934 1.00 1.68 H ATOM 95 HG21 VAL A 28 0.952 -0.177 -4.732 1.00 1.32 H ATOM 96 HG22 VAL A 28 1.887 0.740 -5.916 1.00 1.52 H ATOM 97 HG23 VAL A 28 0.563 1.500 -5.056 1.00 1.73 H ATOM 98 N GLN A 29 -0.957 -1.961 -8.919 1.00 0.24 N ATOM 99 CA GLN A 29 -1.811 -2.591 -9.914 1.00 0.24 C ATOM 100 C GLN A 29 -1.926 -4.114 -9.765 1.00 0.25 C ATOM 101 O GLN A 29 -2.861 -4.690 -10.319 1.00 0.33 O ATOM 102 CB GLN A 29 -1.353 -2.237 -11.330 1.00 0.32 C ATOM 103 CG GLN A 29 -1.719 -0.798 -11.718 1.00 0.41 C ATOM 104 CD GLN A 29 -3.182 -0.668 -12.134 1.00 0.49 C ATOM 105 OE1 GLN A 29 -3.531 -0.943 -13.276 1.00 0.60 O ATOM 106 NE2 GLN A 29 -4.054 -0.244 -11.223 1.00 0.49 N ATOM 107 H GLN A 29 -0.174 -1.421 -9.269 1.00 0.24 H ATOM 108 HA GLN A 29 -2.794 -2.151 -9.815 1.00 0.28 H ATOM 109 HB2 GLN A 29 -0.279 -2.367 -11.403 1.00 0.29 H ATOM 110 HB3 GLN A 29 -1.820 -2.927 -12.034 1.00 0.38 H ATOM 111 HG2 GLN A 29 -1.511 -0.108 -10.901 1.00 0.40 H ATOM 112 HG3 GLN A 29 -1.099 -0.516 -12.568 1.00 0.48 H ATOM 113 HE21 GLN A 29 -3.756 0.009 -10.293 1.00 0.44 H ATOM 114 HE22 GLN A 29 -5.019 -0.131 -11.491 1.00 0.56 H ATOM 115 N GLN A 30 -1.017 -4.788 -9.050 1.00 0.25 N ATOM 116 CA GLN A 30 -1.110 -6.230 -8.871 1.00 0.29 C ATOM 117 C GLN A 30 -0.504 -6.700 -7.543 1.00 0.30 C ATOM 118 O GLN A 30 0.271 -7.654 -7.501 1.00 0.49 O ATOM 119 CB GLN A 30 -0.525 -6.937 -10.103 1.00 0.43 C ATOM 120 CG GLN A 30 -1.127 -8.339 -10.253 1.00 1.13 C ATOM 121 CD GLN A 30 -0.738 -9.007 -11.569 1.00 1.34 C ATOM 122 OE1 GLN A 30 -0.447 -8.348 -12.560 1.00 2.11 O ATOM 123 NE2 GLN A 30 -0.740 -10.336 -11.598 1.00 2.24 N ATOM 124 H GLN A 30 -0.228 -4.296 -8.642 1.00 0.25 H ATOM 125 HA GLN A 30 -2.173 -6.471 -8.817 1.00 0.41 H ATOM 126 HB2 GLN A 30 -0.782 -6.362 -10.993 1.00 1.26 H ATOM 127 HB3 GLN A 30 0.562 -6.992 -10.032 1.00 0.95 H ATOM 128 HG2 GLN A 30 -0.797 -8.957 -9.419 1.00 2.13 H ATOM 129 HG3 GLN A 30 -2.215 -8.265 -10.231 1.00 2.27 H ATOM 130 HE21 GLN A 30 -0.981 -10.870 -10.779 1.00 2.84 H ATOM 131 HE22 GLN A 30 -0.500 -10.789 -12.466 1.00 2.82 H ATOM 132 N LYS A 31 -0.919 -6.056 -6.450 1.00 0.25 N ATOM 133 CA LYS A 31 -0.650 -6.446 -5.068 1.00 0.28 C ATOM 134 C LYS A 31 -1.543 -5.654 -4.117 1.00 0.33 C ATOM 135 O LYS A 31 -1.967 -6.216 -3.114 1.00 0.63 O ATOM 136 CB LYS A 31 0.835 -6.307 -4.656 1.00 0.32 C ATOM 137 CG LYS A 31 1.657 -7.603 -4.830 1.00 0.56 C ATOM 138 CD LYS A 31 2.856 -7.402 -5.767 1.00 0.74 C ATOM 139 CE LYS A 31 3.400 -8.729 -6.319 1.00 0.78 C ATOM 140 NZ LYS A 31 4.442 -9.323 -5.455 1.00 1.21 N ATOM 141 H LYS A 31 -1.549 -5.284 -6.617 1.00 0.35 H ATOM 142 HA LYS A 31 -0.956 -7.486 -4.946 1.00 0.31 H ATOM 143 HB2 LYS A 31 1.297 -5.470 -5.174 1.00 0.41 H ATOM 144 HB3 LYS A 31 0.870 -6.065 -3.592 1.00 0.36 H ATOM 145 HG2 LYS A 31 2.020 -7.936 -3.855 1.00 1.23 H ATOM 146 HG3 LYS A 31 1.013 -8.386 -5.229 1.00 1.06 H ATOM 147 HD2 LYS A 31 2.532 -6.798 -6.618 1.00 1.41 H ATOM 148 HD3 LYS A 31 3.644 -6.867 -5.239 1.00 1.42 H ATOM 149 HE2 LYS A 31 2.582 -9.432 -6.478 1.00 1.09 H ATOM 150 HE3 LYS A 31 3.864 -8.530 -7.288 1.00 1.36 H ATOM 151 HZ1 LYS A 31 4.329 -9.087 -4.476 1.00 1.87 H ATOM 152 HZ2 LYS A 31 4.523 -10.317 -5.584 1.00 1.95 H ATOM 153 HZ3 LYS A 31 5.333 -8.898 -5.714 1.00 1.81 H ATOM 154 N CYS A 32 -1.813 -4.370 -4.384 1.00 0.15 N ATOM 155 CA CYS A 32 -2.598 -3.542 -3.475 1.00 0.13 C ATOM 156 C CYS A 32 -4.051 -3.442 -3.927 1.00 0.12 C ATOM 157 O CYS A 32 -4.980 -3.726 -3.161 1.00 0.12 O ATOM 158 CB CYS A 32 -1.946 -2.170 -3.297 1.00 0.18 C ATOM 159 SG CYS A 32 -0.131 -2.242 -3.139 1.00 0.18 S ATOM 160 H CYS A 32 -1.418 -3.918 -5.200 1.00 0.23 H ATOM 161 HA CYS A 32 -2.635 -3.993 -2.497 1.00 0.13 H ATOM 162 HB2 CYS A 32 -2.178 -1.566 -4.166 1.00 0.27 H ATOM 163 HB3 CYS A 32 -2.384 -1.692 -2.422 1.00 0.21 H ATOM 164 N ILE A 33 -4.243 -3.054 -5.190 1.00 0.14 N ATOM 165 CA ILE A 33 -5.568 -2.848 -5.764 1.00 0.16 C ATOM 166 C ILE A 33 -6.451 -4.084 -5.608 1.00 0.16 C ATOM 167 O ILE A 33 -7.671 -3.960 -5.533 1.00 0.18 O ATOM 168 CB ILE A 33 -5.464 -2.467 -7.244 1.00 0.20 C ATOM 169 CG1 ILE A 33 -4.890 -3.617 -8.087 1.00 0.26 C ATOM 170 CG2 ILE A 33 -4.694 -1.148 -7.439 1.00 0.24 C ATOM 171 CD1 ILE A 33 -5.946 -4.262 -8.989 1.00 0.48 C ATOM 172 H ILE A 33 -3.431 -2.868 -5.773 1.00 0.14 H ATOM 173 HA ILE A 33 -6.034 -2.023 -5.220 1.00 0.18 H ATOM 174 HB ILE A 33 -6.475 -2.297 -7.598 1.00 0.26 H ATOM 175 HG12 ILE A 33 -4.153 -3.205 -8.746 1.00 0.58 H ATOM 176 HG13 ILE A 33 -4.391 -4.375 -7.486 1.00 0.58 H ATOM 177 HG21 ILE A 33 -5.322 -0.311 -7.157 1.00 1.57 H ATOM 178 HG22 ILE A 33 -3.801 -1.107 -6.822 1.00 1.47 H ATOM 179 HG23 ILE A 33 -4.414 -1.014 -8.481 1.00 1.62 H ATOM 180 HD11 ILE A 33 -6.765 -4.667 -8.397 1.00 1.47 H ATOM 181 HD12 ILE A 33 -6.332 -3.516 -9.684 1.00 1.79 H ATOM 182 HD13 ILE A 33 -5.485 -5.067 -9.561 1.00 1.47 H ATOM 183 N SER A 34 -5.831 -5.267 -5.537 1.00 0.17 N ATOM 184 CA SER A 34 -6.451 -6.547 -5.264 1.00 0.18 C ATOM 185 C SER A 34 -7.528 -6.445 -4.183 1.00 0.16 C ATOM 186 O SER A 34 -8.547 -7.125 -4.279 1.00 0.21 O ATOM 187 CB SER A 34 -5.341 -7.518 -4.854 1.00 0.22 C ATOM 188 OG SER A 34 -4.196 -7.292 -5.663 1.00 1.19 O ATOM 189 H SER A 34 -4.828 -5.316 -5.655 1.00 0.18 H ATOM 190 HA SER A 34 -6.906 -6.903 -6.189 1.00 0.19 H ATOM 191 HB2 SER A 34 -5.070 -7.348 -3.811 1.00 0.93 H ATOM 192 HB3 SER A 34 -5.702 -8.542 -4.960 1.00 0.86 H ATOM 193 HG SER A 34 -3.569 -8.007 -5.521 1.00 1.82 H ATOM 194 N CYS A 35 -7.298 -5.603 -3.167 1.00 0.13 N ATOM 195 CA CYS A 35 -8.293 -5.295 -2.147 1.00 0.14 C ATOM 196 C CYS A 35 -8.653 -3.810 -2.131 1.00 0.13 C ATOM 197 O CYS A 35 -9.812 -3.456 -1.924 1.00 0.16 O ATOM 198 CB CYS A 35 -7.778 -5.693 -0.769 1.00 0.16 C ATOM 199 SG CYS A 35 -7.077 -7.363 -0.756 1.00 0.17 S ATOM 200 H CYS A 35 -6.424 -5.087 -3.158 1.00 0.13 H ATOM 201 HA CYS A 35 -9.204 -5.854 -2.350 1.00 0.17 H ATOM 202 HB2 CYS A 35 -7.027 -4.963 -0.472 1.00 0.16 H ATOM 203 HB3 CYS A 35 -8.605 -5.661 -0.063 1.00 0.18 H ATOM 204 N HIS A 36 -7.660 -2.933 -2.300 1.00 0.11 N ATOM 205 CA HIS A 36 -7.849 -1.493 -2.211 1.00 0.12 C ATOM 206 C HIS A 36 -8.604 -0.914 -3.419 1.00 0.16 C ATOM 207 O HIS A 36 -9.000 0.254 -3.395 1.00 0.23 O ATOM 208 CB HIS A 36 -6.476 -0.855 -1.960 1.00 0.11 C ATOM 209 CG HIS A 36 -5.999 -1.111 -0.548 1.00 0.10 C ATOM 210 ND1 HIS A 36 -6.643 -0.663 0.572 1.00 0.30 N ATOM 211 CD2 HIS A 36 -4.912 -1.830 -0.125 1.00 0.16 C ATOM 212 CE1 HIS A 36 -5.954 -1.063 1.649 1.00 0.28 C ATOM 213 NE2 HIS A 36 -4.891 -1.791 1.284 1.00 0.08 N ATOM 214 H HIS A 36 -6.711 -3.269 -2.431 1.00 0.13 H ATOM 215 HA HIS A 36 -8.483 -1.271 -1.350 1.00 0.13 H ATOM 216 HB2 HIS A 36 -5.747 -1.219 -2.684 1.00 0.12 H ATOM 217 HB3 HIS A 36 -6.567 0.221 -2.090 1.00 0.15 H ATOM 218 HD1 HIS A 36 -7.462 -0.066 0.586 1.00 0.44 H ATOM 219 HD2 HIS A 36 -4.206 -2.327 -0.772 1.00 0.34 H ATOM 220 HE1 HIS A 36 -6.225 -0.811 2.663 1.00 0.44 H ATOM 221 N GLY A 37 -8.850 -1.733 -4.446 1.00 0.18 N ATOM 222 CA GLY A 37 -9.549 -1.349 -5.659 1.00 0.28 C ATOM 223 C GLY A 37 -8.556 -0.749 -6.644 1.00 0.55 C ATOM 224 O GLY A 37 -7.560 -0.169 -6.220 1.00 1.51 O ATOM 225 H GLY A 37 -8.449 -2.663 -4.444 1.00 0.19 H ATOM 226 HA2 GLY A 37 -9.995 -2.244 -6.094 1.00 0.42 H ATOM 227 HA3 GLY A 37 -10.335 -0.625 -5.447 1.00 0.21 H ATOM 228 N GLY A 38 -8.829 -0.875 -7.950 1.00 0.43 N ATOM 229 CA GLY A 38 -8.007 -0.339 -9.035 1.00 0.31 C ATOM 230 C GLY A 38 -7.500 1.074 -8.755 1.00 0.25 C ATOM 231 O GLY A 38 -6.372 1.407 -9.116 1.00 0.29 O ATOM 232 H GLY A 38 -9.667 -1.370 -8.215 1.00 1.17 H ATOM 233 HA2 GLY A 38 -7.157 -0.991 -9.231 1.00 0.29 H ATOM 234 HA3 GLY A 38 -8.615 -0.302 -9.940 1.00 0.44 H ATOM 235 N ASP A 39 -8.345 1.879 -8.107 1.00 0.35 N ATOM 236 CA ASP A 39 -8.126 3.293 -7.877 1.00 0.48 C ATOM 237 C ASP A 39 -7.681 3.588 -6.438 1.00 0.42 C ATOM 238 O ASP A 39 -7.506 4.758 -6.108 1.00 0.48 O ATOM 239 CB ASP A 39 -9.412 4.054 -8.238 1.00 0.69 C ATOM 240 CG ASP A 39 -9.841 3.823 -9.682 1.00 1.12 C ATOM 241 OD1 ASP A 39 -9.080 4.245 -10.578 1.00 2.01 O ATOM 242 OD2 ASP A 39 -10.915 3.210 -9.861 1.00 2.18 O ATOM 243 H ASP A 39 -9.244 1.511 -7.835 1.00 0.41 H ATOM 244 HA ASP A 39 -7.337 3.658 -8.538 1.00 0.60 H ATOM 245 HB2 ASP A 39 -10.222 3.743 -7.579 1.00 1.06 H ATOM 246 HB3 ASP A 39 -9.247 5.124 -8.110 1.00 1.13 H ATOM 247 N LEU A 40 -7.508 2.582 -5.555 1.00 0.32 N ATOM 248 CA LEU A 40 -7.080 2.796 -4.180 1.00 0.32 C ATOM 249 C LEU A 40 -8.116 3.600 -3.391 1.00 0.21 C ATOM 250 O LEU A 40 -7.811 4.165 -2.336 1.00 0.23 O ATOM 251 CB LEU A 40 -5.674 3.410 -4.113 1.00 0.49 C ATOM 252 CG LEU A 40 -4.571 2.594 -4.813 1.00 1.05 C ATOM 253 CD1 LEU A 40 -4.568 1.136 -4.341 1.00 3.43 C ATOM 254 CD2 LEU A 40 -4.601 2.659 -6.346 1.00 1.60 C ATOM 255 H LEU A 40 -7.644 1.602 -5.788 1.00 0.29 H ATOM 256 HA LEU A 40 -7.040 1.820 -3.706 1.00 0.40 H ATOM 257 HB2 LEU A 40 -5.684 4.429 -4.490 1.00 0.45 H ATOM 258 HB3 LEU A 40 -5.411 3.475 -3.061 1.00 0.57 H ATOM 259 HG LEU A 40 -3.630 3.047 -4.509 1.00 2.52 H ATOM 260 HD11 LEU A 40 -5.412 0.589 -4.757 1.00 4.35 H ATOM 261 HD12 LEU A 40 -3.653 0.650 -4.658 1.00 4.11 H ATOM 262 HD13 LEU A 40 -4.612 1.094 -3.257 1.00 4.45 H ATOM 263 HD21 LEU A 40 -3.643 2.330 -6.746 1.00 2.23 H ATOM 264 HD22 LEU A 40 -5.367 2.004 -6.750 1.00 2.52 H ATOM 265 HD23 LEU A 40 -4.780 3.681 -6.680 1.00 2.79 H ATOM 266 N THR A 41 -9.353 3.572 -3.890 1.00 0.20 N ATOM 267 CA THR A 41 -10.537 4.222 -3.361 1.00 0.19 C ATOM 268 C THR A 41 -11.180 3.345 -2.290 1.00 0.19 C ATOM 269 O THR A 41 -12.151 3.756 -1.660 1.00 0.20 O ATOM 270 CB THR A 41 -11.509 4.421 -4.531 1.00 0.24 C ATOM 271 OG1 THR A 41 -11.534 3.235 -5.307 1.00 0.32 O ATOM 272 CG2 THR A 41 -11.060 5.587 -5.417 1.00 0.26 C ATOM 273 H THR A 41 -9.531 2.975 -4.686 1.00 0.25 H ATOM 274 HA THR A 41 -10.281 5.188 -2.924 1.00 0.20 H ATOM 275 HB THR A 41 -12.512 4.644 -4.158 1.00 0.28 H ATOM 276 HG1 THR A 41 -12.150 2.613 -4.906 1.00 1.19 H ATOM 277 HG21 THR A 41 -11.726 5.671 -6.278 1.00 1.50 H ATOM 278 HG22 THR A 41 -11.093 6.518 -4.851 1.00 1.44 H ATOM 279 HG23 THR A 41 -10.043 5.428 -5.771 1.00 1.43 H ATOM 280 N GLY A 42 -10.646 2.136 -2.097 1.00 0.19 N ATOM 281 CA GLY A 42 -11.155 1.169 -1.160 1.00 0.20 C ATOM 282 C GLY A 42 -12.217 0.323 -1.850 1.00 0.27 C ATOM 283 O GLY A 42 -13.100 0.846 -2.528 1.00 0.55 O ATOM 284 H GLY A 42 -9.920 1.801 -2.721 1.00 0.20 H ATOM 285 HA2 GLY A 42 -10.302 0.553 -0.882 1.00 0.17 H ATOM 286 HA3 GLY A 42 -11.560 1.642 -0.267 1.00 0.22 H ATOM 287 N ALA A 43 -12.100 -0.995 -1.701 1.00 0.13 N ATOM 288 CA ALA A 43 -13.050 -1.964 -2.235 1.00 0.15 C ATOM 289 C ALA A 43 -13.298 -3.060 -1.196 1.00 0.17 C ATOM 290 O ALA A 43 -14.281 -3.002 -0.464 1.00 0.25 O ATOM 291 CB ALA A 43 -12.559 -2.501 -3.586 1.00 0.17 C ATOM 292 H ALA A 43 -11.331 -1.305 -1.124 1.00 0.30 H ATOM 293 HA ALA A 43 -14.013 -1.480 -2.408 1.00 0.19 H ATOM 294 HB1 ALA A 43 -12.645 -1.714 -4.336 1.00 1.66 H ATOM 295 HB2 ALA A 43 -11.520 -2.817 -3.535 1.00 1.55 H ATOM 296 HB3 ALA A 43 -13.174 -3.348 -3.896 1.00 1.66 H ATOM 297 N SER A 44 -12.387 -4.029 -1.090 1.00 0.17 N ATOM 298 CA SER A 44 -12.380 -5.020 -0.015 1.00 0.18 C ATOM 299 C SER A 44 -11.571 -4.529 1.194 1.00 0.20 C ATOM 300 O SER A 44 -11.341 -5.291 2.130 1.00 0.23 O ATOM 301 CB SER A 44 -11.844 -6.358 -0.534 1.00 0.19 C ATOM 302 OG SER A 44 -12.741 -6.909 -1.479 1.00 1.18 O ATOM 303 H SER A 44 -11.557 -3.964 -1.672 1.00 0.18 H ATOM 304 HA SER A 44 -13.399 -5.197 0.333 1.00 0.22 H ATOM 305 HB2 SER A 44 -10.868 -6.215 -0.990 1.00 0.99 H ATOM 306 HB3 SER A 44 -11.732 -7.058 0.296 1.00 1.02 H ATOM 307 HG SER A 44 -12.930 -6.253 -2.153 1.00 2.38 H ATOM 308 N ALA A 45 -11.071 -3.290 1.155 1.00 0.18 N ATOM 309 CA ALA A 45 -10.135 -2.733 2.116 1.00 0.19 C ATOM 310 C ALA A 45 -10.286 -1.206 2.088 1.00 0.16 C ATOM 311 O ALA A 45 -10.855 -0.706 1.117 1.00 0.17 O ATOM 312 CB ALA A 45 -8.738 -3.190 1.690 1.00 0.21 C ATOM 313 H ALA A 45 -11.325 -2.674 0.398 1.00 0.18 H ATOM 314 HA ALA A 45 -10.370 -3.104 3.114 1.00 0.23 H ATOM 315 HB1 ALA A 45 -8.525 -2.845 0.678 1.00 1.45 H ATOM 316 HB2 ALA A 45 -7.975 -2.809 2.353 1.00 1.37 H ATOM 317 HB3 ALA A 45 -8.701 -4.277 1.712 1.00 1.41 H ATOM 318 N PRO A 46 -9.828 -0.465 3.115 1.00 0.16 N ATOM 319 CA PRO A 46 -10.007 0.982 3.199 1.00 0.16 C ATOM 320 C PRO A 46 -9.211 1.701 2.109 1.00 0.15 C ATOM 321 O PRO A 46 -8.267 1.147 1.561 1.00 0.19 O ATOM 322 CB PRO A 46 -9.526 1.381 4.600 1.00 0.19 C ATOM 323 CG PRO A 46 -8.535 0.280 4.971 1.00 0.20 C ATOM 324 CD PRO A 46 -9.130 -0.955 4.294 1.00 0.23 C ATOM 325 HA PRO A 46 -11.062 1.231 3.091 1.00 0.18 H ATOM 326 HB2 PRO A 46 -9.059 2.368 4.627 1.00 0.20 H ATOM 327 HB3 PRO A 46 -10.365 1.347 5.294 1.00 0.23 H ATOM 328 HG2 PRO A 46 -7.562 0.506 4.534 1.00 0.26 H ATOM 329 HG3 PRO A 46 -8.437 0.160 6.051 1.00 0.26 H ATOM 330 HD2 PRO A 46 -8.322 -1.633 4.051 1.00 0.38 H ATOM 331 HD3 PRO A 46 -9.838 -1.444 4.965 1.00 0.35 H ATOM 332 N ALA A 47 -9.573 2.940 1.784 1.00 0.14 N ATOM 333 CA ALA A 47 -8.938 3.677 0.699 1.00 0.14 C ATOM 334 C ALA A 47 -7.538 4.137 1.108 1.00 0.16 C ATOM 335 O ALA A 47 -7.388 4.788 2.141 1.00 0.25 O ATOM 336 CB ALA A 47 -9.822 4.872 0.352 1.00 0.16 C ATOM 337 H ALA A 47 -10.330 3.383 2.282 1.00 0.16 H ATOM 338 HA ALA A 47 -8.865 3.038 -0.183 1.00 0.15 H ATOM 339 HB1 ALA A 47 -10.844 4.522 0.223 1.00 1.45 H ATOM 340 HB2 ALA A 47 -9.802 5.604 1.160 1.00 1.43 H ATOM 341 HB3 ALA A 47 -9.471 5.338 -0.568 1.00 1.45 H ATOM 342 N ILE A 48 -6.521 3.817 0.298 1.00 0.15 N ATOM 343 CA ILE A 48 -5.141 4.245 0.534 1.00 0.17 C ATOM 344 C ILE A 48 -4.732 5.372 -0.414 1.00 0.16 C ATOM 345 O ILE A 48 -3.602 5.842 -0.329 1.00 0.18 O ATOM 346 CB ILE A 48 -4.153 3.062 0.521 1.00 0.21 C ATOM 347 CG1 ILE A 48 -3.959 2.453 -0.875 1.00 0.38 C ATOM 348 CG2 ILE A 48 -4.601 2.015 1.545 1.00 0.40 C ATOM 349 CD1 ILE A 48 -2.764 1.497 -0.933 1.00 0.49 C ATOM 350 H ILE A 48 -6.738 3.353 -0.576 1.00 0.20 H ATOM 351 HA ILE A 48 -5.065 4.674 1.534 1.00 0.17 H ATOM 352 HB ILE A 48 -3.182 3.436 0.842 1.00 0.20 H ATOM 353 HG12 ILE A 48 -4.869 1.936 -1.175 1.00 0.50 H ATOM 354 HG13 ILE A 48 -3.743 3.250 -1.584 1.00 0.45 H ATOM 355 HG21 ILE A 48 -3.897 1.190 1.572 1.00 1.66 H ATOM 356 HG22 ILE A 48 -4.655 2.463 2.537 1.00 1.28 H ATOM 357 HG23 ILE A 48 -5.582 1.633 1.279 1.00 1.71 H ATOM 358 HD11 ILE A 48 -2.543 1.252 -1.972 1.00 1.51 H ATOM 359 HD12 ILE A 48 -1.885 1.973 -0.498 1.00 1.70 H ATOM 360 HD13 ILE A 48 -2.986 0.575 -0.400 1.00 1.17 H ATOM 361 N ASP A 49 -5.639 5.824 -1.288 1.00 0.16 N ATOM 362 CA ASP A 49 -5.472 6.993 -2.148 1.00 0.22 C ATOM 363 C ASP A 49 -4.666 8.130 -1.493 1.00 0.22 C ATOM 364 O ASP A 49 -3.723 8.635 -2.099 1.00 0.29 O ATOM 365 CB ASP A 49 -6.867 7.463 -2.573 1.00 0.31 C ATOM 366 CG ASP A 49 -6.827 8.856 -3.180 1.00 1.21 C ATOM 367 OD1 ASP A 49 -6.428 8.955 -4.360 1.00 2.46 O ATOM 368 OD2 ASP A 49 -7.191 9.791 -2.436 1.00 2.23 O ATOM 369 H ASP A 49 -6.519 5.327 -1.389 1.00 0.17 H ATOM 370 HA ASP A 49 -4.934 6.686 -3.046 1.00 0.33 H ATOM 371 HB2 ASP A 49 -7.277 6.771 -3.311 1.00 0.81 H ATOM 372 HB3 ASP A 49 -7.533 7.492 -1.711 1.00 0.89 H ATOM 373 N LYS A 50 -5.002 8.498 -0.249 1.00 0.21 N ATOM 374 CA LYS A 50 -4.379 9.600 0.475 1.00 0.28 C ATOM 375 C LYS A 50 -3.451 9.104 1.588 1.00 0.41 C ATOM 376 O LYS A 50 -3.179 9.822 2.556 1.00 0.63 O ATOM 377 CB LYS A 50 -5.468 10.538 1.015 1.00 0.31 C ATOM 378 CG LYS A 50 -6.545 9.806 1.831 1.00 1.64 C ATOM 379 CD LYS A 50 -7.173 10.794 2.820 1.00 2.49 C ATOM 380 CE LYS A 50 -8.449 10.225 3.453 1.00 3.21 C ATOM 381 NZ LYS A 50 -9.016 11.155 4.449 1.00 4.17 N ATOM 382 H LYS A 50 -5.719 7.980 0.228 1.00 0.26 H ATOM 383 HA LYS A 50 -3.760 10.183 -0.205 1.00 0.34 H ATOM 384 HB2 LYS A 50 -4.993 11.307 1.623 1.00 1.34 H ATOM 385 HB3 LYS A 50 -5.953 11.034 0.171 1.00 1.23 H ATOM 386 HG2 LYS A 50 -7.297 9.419 1.140 1.00 2.30 H ATOM 387 HG3 LYS A 50 -6.107 8.977 2.386 1.00 2.63 H ATOM 388 HD2 LYS A 50 -6.431 11.012 3.593 1.00 3.51 H ATOM 389 HD3 LYS A 50 -7.407 11.716 2.283 1.00 2.73 H ATOM 390 HE2 LYS A 50 -9.187 10.047 2.667 1.00 3.16 H ATOM 391 HE3 LYS A 50 -8.225 9.273 3.940 1.00 4.10 H ATOM 392 HZ1 LYS A 50 -8.361 11.285 5.209 1.00 4.97 H ATOM 393 HZ2 LYS A 50 -9.205 12.050 4.019 1.00 4.19 H ATOM 394 HZ3 LYS A 50 -9.880 10.782 4.819 1.00 4.78 H ATOM 395 N ALA A 51 -2.962 7.865 1.477 1.00 0.28 N ATOM 396 CA ALA A 51 -2.131 7.275 2.509 1.00 0.28 C ATOM 397 C ALA A 51 -0.935 8.173 2.801 1.00 0.30 C ATOM 398 O ALA A 51 -0.641 8.396 3.967 1.00 0.38 O ATOM 399 CB ALA A 51 -1.704 5.858 2.140 1.00 0.26 C ATOM 400 H ALA A 51 -3.170 7.318 0.648 1.00 0.21 H ATOM 401 HA ALA A 51 -2.731 7.202 3.415 1.00 0.30 H ATOM 402 HB1 ALA A 51 -1.123 5.865 1.219 1.00 1.60 H ATOM 403 HB2 ALA A 51 -1.104 5.440 2.949 1.00 1.34 H ATOM 404 HB3 ALA A 51 -2.590 5.240 2.019 1.00 1.44 H ATOM 405 N GLY A 52 -0.292 8.730 1.769 1.00 0.29 N ATOM 406 CA GLY A 52 0.850 9.619 1.937 1.00 0.30 C ATOM 407 C GLY A 52 0.591 10.824 2.842 1.00 0.36 C ATOM 408 O GLY A 52 1.535 11.375 3.404 1.00 0.51 O ATOM 409 H GLY A 52 -0.581 8.523 0.820 1.00 0.30 H ATOM 410 HA2 GLY A 52 1.678 9.044 2.352 1.00 0.34 H ATOM 411 HA3 GLY A 52 1.138 10.015 0.967 1.00 0.32 H ATOM 412 N ALA A 53 -0.666 11.267 2.964 1.00 0.35 N ATOM 413 CA ALA A 53 -1.026 12.298 3.931 1.00 0.49 C ATOM 414 C ALA A 53 -1.284 11.657 5.287 1.00 0.53 C ATOM 415 O ALA A 53 -0.843 12.176 6.309 1.00 0.85 O ATOM 416 CB ALA A 53 -2.266 13.070 3.476 1.00 0.61 C ATOM 417 H ALA A 53 -1.413 10.753 2.512 1.00 0.31 H ATOM 418 HA ALA A 53 -0.212 13.016 4.045 1.00 0.74 H ATOM 419 HB1 ALA A 53 -3.029 12.388 3.102 1.00 1.24 H ATOM 420 HB2 ALA A 53 -2.671 13.628 4.320 1.00 1.57 H ATOM 421 HB3 ALA A 53 -1.994 13.786 2.704 1.00 1.68 H ATOM 422 N ASN A 54 -2.034 10.552 5.298 1.00 0.53 N ATOM 423 CA ASN A 54 -2.386 9.870 6.538 1.00 0.83 C ATOM 424 C ASN A 54 -1.132 9.487 7.330 1.00 0.70 C ATOM 425 O ASN A 54 -1.098 9.682 8.543 1.00 1.07 O ATOM 426 CB ASN A 54 -3.227 8.614 6.264 1.00 1.08 C ATOM 427 CG ASN A 54 -4.596 8.881 5.639 1.00 1.46 C ATOM 428 OD1 ASN A 54 -5.181 9.953 5.773 1.00 2.24 O ATOM 429 ND2 ASN A 54 -5.145 7.881 4.953 1.00 1.97 N ATOM 430 H ASN A 54 -2.348 10.170 4.412 1.00 0.58 H ATOM 431 HA ASN A 54 -2.976 10.551 7.154 1.00 1.09 H ATOM 432 HB2 ASN A 54 -2.657 7.941 5.624 1.00 1.14 H ATOM 433 HB3 ASN A 54 -3.399 8.108 7.215 1.00 1.35 H ATOM 434 HD21 ASN A 54 -4.652 7.007 4.862 1.00 2.60 H ATOM 435 HD22 ASN A 54 -6.069 7.991 4.575 1.00 2.25 H ATOM 436 N TYR A 55 -0.137 8.902 6.654 1.00 0.29 N ATOM 437 CA TYR A 55 1.050 8.296 7.242 1.00 0.26 C ATOM 438 C TYR A 55 2.243 8.530 6.298 1.00 0.25 C ATOM 439 O TYR A 55 2.040 8.643 5.090 1.00 0.38 O ATOM 440 CB TYR A 55 0.791 6.789 7.421 1.00 0.40 C ATOM 441 CG TYR A 55 -0.564 6.384 7.975 1.00 0.37 C ATOM 442 CD1 TYR A 55 -0.935 6.757 9.280 1.00 0.52 C ATOM 443 CD2 TYR A 55 -1.445 5.616 7.192 1.00 0.40 C ATOM 444 CE1 TYR A 55 -2.204 6.411 9.776 1.00 0.60 C ATOM 445 CE2 TYR A 55 -2.698 5.238 7.705 1.00 0.47 C ATOM 446 CZ TYR A 55 -3.074 5.629 9.001 1.00 0.54 C ATOM 447 OH TYR A 55 -4.289 5.279 9.507 1.00 0.67 O ATOM 448 H TYR A 55 -0.202 8.834 5.644 1.00 0.29 H ATOM 449 HA TYR A 55 1.253 8.754 8.211 1.00 0.36 H ATOM 450 HB2 TYR A 55 0.918 6.307 6.454 1.00 0.50 H ATOM 451 HB3 TYR A 55 1.540 6.393 8.094 1.00 0.62 H ATOM 452 HD1 TYR A 55 -0.262 7.347 9.887 1.00 0.62 H ATOM 453 HD2 TYR A 55 -1.166 5.316 6.192 1.00 0.48 H ATOM 454 HE1 TYR A 55 -2.504 6.732 10.762 1.00 0.78 H ATOM 455 HE2 TYR A 55 -3.378 4.665 7.096 1.00 0.58 H ATOM 456 HH TYR A 55 -4.696 4.532 9.036 1.00 1.32 H ATOM 457 N SER A 56 3.477 8.606 6.807 1.00 0.25 N ATOM 458 CA SER A 56 4.669 8.824 5.982 1.00 0.27 C ATOM 459 C SER A 56 5.112 7.534 5.288 1.00 0.23 C ATOM 460 O SER A 56 4.637 6.448 5.625 1.00 0.23 O ATOM 461 CB SER A 56 5.805 9.370 6.852 1.00 0.39 C ATOM 462 OG SER A 56 6.246 8.369 7.751 1.00 2.45 O ATOM 463 H SER A 56 3.602 8.470 7.815 1.00 0.37 H ATOM 464 HA SER A 56 4.439 9.570 5.219 1.00 0.30 H ATOM 465 HB2 SER A 56 6.638 9.679 6.215 1.00 1.51 H ATOM 466 HB3 SER A 56 5.447 10.239 7.407 1.00 1.72 H ATOM 467 HG SER A 56 6.748 8.780 8.461 1.00 3.03 H ATOM 468 N GLU A 57 6.070 7.625 4.357 1.00 0.26 N ATOM 469 CA GLU A 57 6.666 6.462 3.717 1.00 0.27 C ATOM 470 C GLU A 57 7.112 5.425 4.745 1.00 0.27 C ATOM 471 O GLU A 57 6.843 4.248 4.545 1.00 0.26 O ATOM 472 CB GLU A 57 7.807 6.813 2.753 1.00 0.35 C ATOM 473 CG GLU A 57 8.852 7.776 3.310 1.00 1.20 C ATOM 474 CD GLU A 57 8.499 9.241 3.068 1.00 1.82 C ATOM 475 OE1 GLU A 57 7.604 9.734 3.791 1.00 3.05 O ATOM 476 OE2 GLU A 57 9.105 9.827 2.149 1.00 2.27 O ATOM 477 H GLU A 57 6.482 8.534 4.150 1.00 0.34 H ATOM 478 HA GLU A 57 5.905 5.998 3.098 1.00 0.28 H ATOM 479 HB2 GLU A 57 8.306 5.878 2.490 1.00 1.11 H ATOM 480 HB3 GLU A 57 7.424 7.237 1.832 1.00 1.04 H ATOM 481 HG2 GLU A 57 9.017 7.593 4.366 1.00 1.83 H ATOM 482 HG3 GLU A 57 9.770 7.552 2.776 1.00 1.60 H ATOM 483 N GLU A 58 7.762 5.836 5.836 1.00 0.36 N ATOM 484 CA GLU A 58 8.191 4.905 6.871 1.00 0.41 C ATOM 485 C GLU A 58 6.994 4.117 7.412 1.00 0.36 C ATOM 486 O GLU A 58 7.045 2.890 7.499 1.00 0.45 O ATOM 487 CB GLU A 58 8.950 5.648 7.983 1.00 0.56 C ATOM 488 CG GLU A 58 10.405 5.921 7.569 1.00 1.15 C ATOM 489 CD GLU A 58 11.202 6.585 8.686 1.00 1.60 C ATOM 490 OE1 GLU A 58 11.290 5.964 9.767 1.00 2.31 O ATOM 491 OE2 GLU A 58 11.714 7.698 8.441 1.00 2.40 O ATOM 492 H GLU A 58 7.932 6.823 5.965 1.00 0.50 H ATOM 493 HA GLU A 58 8.872 4.180 6.422 1.00 0.44 H ATOM 494 HB2 GLU A 58 8.453 6.586 8.234 1.00 1.22 H ATOM 495 HB3 GLU A 58 8.973 5.024 8.880 1.00 1.10 H ATOM 496 HG2 GLU A 58 10.896 4.975 7.342 1.00 1.81 H ATOM 497 HG3 GLU A 58 10.432 6.553 6.682 1.00 1.90 H ATOM 498 N GLU A 59 5.901 4.807 7.744 1.00 0.35 N ATOM 499 CA GLU A 59 4.752 4.182 8.372 1.00 0.33 C ATOM 500 C GLU A 59 4.063 3.268 7.359 1.00 0.27 C ATOM 501 O GLU A 59 3.737 2.119 7.651 1.00 0.26 O ATOM 502 CB GLU A 59 3.808 5.285 8.851 1.00 0.36 C ATOM 503 CG GLU A 59 4.402 6.141 9.977 1.00 0.48 C ATOM 504 CD GLU A 59 3.472 7.300 10.311 1.00 1.83 C ATOM 505 OE1 GLU A 59 3.416 8.231 9.478 1.00 3.27 O ATOM 506 OE2 GLU A 59 2.813 7.223 11.369 1.00 2.58 O ATOM 507 H GLU A 59 5.800 5.775 7.458 1.00 0.43 H ATOM 508 HA GLU A 59 5.071 3.588 9.230 1.00 0.36 H ATOM 509 HB2 GLU A 59 3.604 5.940 8.005 1.00 0.36 H ATOM 510 HB3 GLU A 59 2.878 4.840 9.207 1.00 0.43 H ATOM 511 HG2 GLU A 59 4.546 5.529 10.867 1.00 1.43 H ATOM 512 HG3 GLU A 59 5.362 6.557 9.676 1.00 1.19 H ATOM 513 N ILE A 60 3.843 3.782 6.148 1.00 0.23 N ATOM 514 CA ILE A 60 3.208 3.041 5.074 1.00 0.17 C ATOM 515 C ILE A 60 4.025 1.791 4.775 1.00 0.17 C ATOM 516 O ILE A 60 3.480 0.695 4.666 1.00 0.17 O ATOM 517 CB ILE A 60 3.053 3.927 3.831 1.00 0.20 C ATOM 518 CG1 ILE A 60 2.068 5.041 4.184 1.00 0.16 C ATOM 519 CG2 ILE A 60 2.554 3.119 2.624 1.00 0.33 C ATOM 520 CD1 ILE A 60 1.791 5.959 2.996 1.00 0.17 C ATOM 521 H ILE A 60 4.178 4.721 5.957 1.00 0.26 H ATOM 522 HA ILE A 60 2.210 2.763 5.405 1.00 0.16 H ATOM 523 HB ILE A 60 4.016 4.375 3.585 1.00 0.32 H ATOM 524 HG12 ILE A 60 1.144 4.623 4.567 1.00 0.15 H ATOM 525 HG13 ILE A 60 2.488 5.627 4.990 1.00 0.21 H ATOM 526 HG21 ILE A 60 1.591 2.661 2.848 1.00 1.32 H ATOM 527 HG22 ILE A 60 2.455 3.755 1.745 1.00 1.63 H ATOM 528 HG23 ILE A 60 3.271 2.343 2.376 1.00 1.64 H ATOM 529 HD11 ILE A 60 1.290 6.847 3.365 1.00 1.39 H ATOM 530 HD12 ILE A 60 2.725 6.254 2.517 1.00 1.43 H ATOM 531 HD13 ILE A 60 1.143 5.457 2.279 1.00 1.35 H ATOM 532 N LEU A 61 5.337 1.964 4.630 1.00 0.18 N ATOM 533 CA LEU A 61 6.264 0.885 4.370 1.00 0.17 C ATOM 534 C LEU A 61 6.103 -0.180 5.447 1.00 0.15 C ATOM 535 O LEU A 61 5.901 -1.348 5.120 1.00 0.16 O ATOM 536 CB LEU A 61 7.698 1.429 4.275 1.00 0.20 C ATOM 537 CG LEU A 61 8.752 0.356 3.978 1.00 0.26 C ATOM 538 CD1 LEU A 61 8.411 -0.425 2.705 1.00 0.27 C ATOM 539 CD2 LEU A 61 10.122 1.022 3.820 1.00 0.36 C ATOM 540 H LEU A 61 5.718 2.893 4.753 1.00 0.20 H ATOM 541 HA LEU A 61 5.975 0.463 3.411 1.00 0.18 H ATOM 542 HB2 LEU A 61 7.741 2.167 3.474 1.00 0.23 H ATOM 543 HB3 LEU A 61 7.960 1.918 5.213 1.00 0.20 H ATOM 544 HG LEU A 61 8.804 -0.332 4.820 1.00 0.28 H ATOM 545 HD11 LEU A 61 8.204 0.267 1.890 1.00 1.51 H ATOM 546 HD12 LEU A 61 9.245 -1.069 2.431 1.00 1.46 H ATOM 547 HD13 LEU A 61 7.536 -1.047 2.879 1.00 1.37 H ATOM 548 HD21 LEU A 61 10.124 1.683 2.952 1.00 1.41 H ATOM 549 HD22 LEU A 61 10.354 1.605 4.711 1.00 1.56 H ATOM 550 HD23 LEU A 61 10.891 0.261 3.689 1.00 1.26 H ATOM 551 N ASP A 62 6.127 0.220 6.722 1.00 0.18 N ATOM 552 CA ASP A 62 5.893 -0.705 7.823 1.00 0.20 C ATOM 553 C ASP A 62 4.551 -1.429 7.635 1.00 0.19 C ATOM 554 O ASP A 62 4.486 -2.654 7.709 1.00 0.25 O ATOM 555 CB ASP A 62 5.977 0.036 9.175 1.00 0.26 C ATOM 556 CG ASP A 62 6.875 -0.622 10.223 1.00 0.78 C ATOM 557 OD1 ASP A 62 7.659 -1.534 9.869 1.00 2.28 O ATOM 558 OD2 ASP A 62 6.740 -0.219 11.396 1.00 1.65 O ATOM 559 H ASP A 62 6.320 1.197 6.939 1.00 0.20 H ATOM 560 HA ASP A 62 6.678 -1.455 7.748 1.00 0.24 H ATOM 561 HB2 ASP A 62 6.364 1.044 9.038 1.00 0.57 H ATOM 562 HB3 ASP A 62 4.979 0.127 9.603 1.00 0.71 H ATOM 563 N ILE A 63 3.473 -0.699 7.331 1.00 0.16 N ATOM 564 CA ILE A 63 2.162 -1.309 7.101 1.00 0.18 C ATOM 565 C ILE A 63 2.184 -2.275 5.910 1.00 0.27 C ATOM 566 O ILE A 63 1.483 -3.278 5.919 1.00 0.61 O ATOM 567 CB ILE A 63 1.074 -0.224 6.953 1.00 0.23 C ATOM 568 CG1 ILE A 63 0.871 0.555 8.258 1.00 0.22 C ATOM 569 CG2 ILE A 63 -0.261 -0.844 6.514 1.00 0.32 C ATOM 570 CD1 ILE A 63 0.275 1.949 8.022 1.00 0.38 C ATOM 571 H ILE A 63 3.565 0.315 7.266 1.00 0.15 H ATOM 572 HA ILE A 63 1.919 -1.934 7.963 1.00 0.19 H ATOM 573 HB ILE A 63 1.394 0.496 6.211 1.00 0.31 H ATOM 574 HG12 ILE A 63 0.226 -0.020 8.920 1.00 0.31 H ATOM 575 HG13 ILE A 63 1.833 0.698 8.742 1.00 0.35 H ATOM 576 HG21 ILE A 63 -0.477 -1.727 7.115 1.00 1.48 H ATOM 577 HG22 ILE A 63 -1.071 -0.135 6.654 1.00 1.76 H ATOM 578 HG23 ILE A 63 -0.223 -1.124 5.462 1.00 1.67 H ATOM 579 HD11 ILE A 63 -0.036 2.377 8.976 1.00 1.60 H ATOM 580 HD12 ILE A 63 1.025 2.601 7.577 1.00 1.68 H ATOM 581 HD13 ILE A 63 -0.587 1.904 7.361 1.00 1.24 H ATOM 582 N ILE A 64 2.969 -2.018 4.868 1.00 0.12 N ATOM 583 CA ILE A 64 3.105 -2.957 3.760 1.00 0.13 C ATOM 584 C ILE A 64 3.854 -4.206 4.252 1.00 0.16 C ATOM 585 O ILE A 64 3.419 -5.342 4.038 1.00 0.23 O ATOM 586 CB ILE A 64 3.754 -2.245 2.553 1.00 0.14 C ATOM 587 CG1 ILE A 64 2.784 -1.179 2.008 1.00 0.15 C ATOM 588 CG2 ILE A 64 4.100 -3.246 1.444 1.00 0.18 C ATOM 589 CD1 ILE A 64 3.481 -0.155 1.106 1.00 0.19 C ATOM 590 H ILE A 64 3.516 -1.163 4.879 1.00 0.26 H ATOM 591 HA ILE A 64 2.115 -3.280 3.442 1.00 0.14 H ATOM 592 HB ILE A 64 4.672 -1.754 2.871 1.00 0.15 H ATOM 593 HG12 ILE A 64 1.976 -1.665 1.462 1.00 0.20 H ATOM 594 HG13 ILE A 64 2.335 -0.621 2.829 1.00 0.16 H ATOM 595 HG21 ILE A 64 4.442 -2.719 0.554 1.00 1.58 H ATOM 596 HG22 ILE A 64 4.898 -3.914 1.769 1.00 1.64 H ATOM 597 HG23 ILE A 64 3.221 -3.837 1.193 1.00 1.55 H ATOM 598 HD11 ILE A 64 3.830 -0.613 0.183 1.00 1.47 H ATOM 599 HD12 ILE A 64 2.779 0.641 0.858 1.00 1.41 H ATOM 600 HD13 ILE A 64 4.326 0.282 1.633 1.00 1.36 H ATOM 601 N LEU A 65 4.972 -3.994 4.945 1.00 0.15 N ATOM 602 CA LEU A 65 5.856 -5.045 5.420 1.00 0.17 C ATOM 603 C LEU A 65 5.240 -5.891 6.541 1.00 0.20 C ATOM 604 O LEU A 65 5.559 -7.076 6.628 1.00 0.25 O ATOM 605 CB LEU A 65 7.182 -4.433 5.890 1.00 0.22 C ATOM 606 CG LEU A 65 8.042 -3.835 4.760 1.00 0.28 C ATOM 607 CD1 LEU A 65 9.211 -3.063 5.381 1.00 0.37 C ATOM 608 CD2 LEU A 65 8.609 -4.900 3.813 1.00 0.34 C ATOM 609 H LEU A 65 5.246 -3.032 5.127 1.00 0.16 H ATOM 610 HA LEU A 65 6.060 -5.721 4.592 1.00 0.20 H ATOM 611 HB2 LEU A 65 6.954 -3.653 6.618 1.00 0.23 H ATOM 612 HB3 LEU A 65 7.757 -5.203 6.404 1.00 0.24 H ATOM 613 HG LEU A 65 7.445 -3.137 4.172 1.00 0.31 H ATOM 614 HD11 LEU A 65 8.832 -2.300 6.061 1.00 1.47 H ATOM 615 HD12 LEU A 65 9.857 -3.742 5.938 1.00 1.37 H ATOM 616 HD13 LEU A 65 9.796 -2.580 4.598 1.00 1.51 H ATOM 617 HD21 LEU A 65 7.808 -5.398 3.268 1.00 1.62 H ATOM 618 HD22 LEU A 65 9.269 -4.425 3.087 1.00 1.63 H ATOM 619 HD23 LEU A 65 9.178 -5.638 4.379 1.00 1.62 H ATOM 620 N ASN A 66 4.373 -5.326 7.392 1.00 0.21 N ATOM 621 CA ASN A 66 3.924 -5.967 8.639 1.00 0.27 C ATOM 622 C ASN A 66 2.404 -6.116 8.624 1.00 0.23 C ATOM 623 O ASN A 66 1.771 -6.396 9.638 1.00 0.36 O ATOM 624 CB ASN A 66 4.325 -5.124 9.856 1.00 0.45 C ATOM 625 CG ASN A 66 5.783 -4.678 9.852 1.00 0.72 C ATOM 626 OD1 ASN A 66 6.660 -5.355 9.321 1.00 1.77 O ATOM 627 ND2 ASN A 66 6.033 -3.519 10.445 1.00 0.88 N ATOM 628 H ASN A 66 3.965 -4.411 7.180 1.00 0.22 H ATOM 629 HA ASN A 66 4.364 -6.959 8.751 1.00 0.36 H ATOM 630 HB2 ASN A 66 3.692 -4.233 9.873 1.00 1.01 H ATOM 631 HB3 ASN A 66 4.137 -5.695 10.765 1.00 0.79 H ATOM 632 HD21 ASN A 66 5.285 -2.984 10.854 1.00 1.48 H ATOM 633 HD22 ASN A 66 6.923 -3.030 10.285 1.00 1.05 H ATOM 634 N GLY A 67 1.850 -5.924 7.432 1.00 0.18 N ATOM 635 CA GLY A 67 0.425 -5.778 7.121 1.00 0.13 C ATOM 636 C GLY A 67 -0.295 -4.923 8.181 1.00 0.26 C ATOM 637 O GLY A 67 0.315 -3.997 8.712 1.00 0.63 O ATOM 638 H GLY A 67 2.544 -5.923 6.696 1.00 0.19 H ATOM 639 HA2 GLY A 67 0.327 -5.264 6.173 1.00 0.23 H ATOM 640 HA3 GLY A 67 -0.030 -6.744 6.917 1.00 0.18 H ATOM 641 N GLN A 68 -1.573 -5.204 8.478 1.00 0.28 N ATOM 642 CA GLN A 68 -2.409 -4.447 9.428 1.00 0.36 C ATOM 643 C GLN A 68 -3.816 -5.068 9.446 1.00 0.30 C ATOM 644 O GLN A 68 -4.338 -5.380 8.383 1.00 0.30 O ATOM 645 CB GLN A 68 -2.436 -2.940 9.070 1.00 0.52 C ATOM 646 CG GLN A 68 -3.439 -2.107 9.890 1.00 0.73 C ATOM 647 CD GLN A 68 -2.947 -0.690 10.182 1.00 0.81 C ATOM 648 OE1 GLN A 68 -1.895 -0.512 10.788 1.00 1.13 O ATOM 649 NE2 GLN A 68 -3.691 0.339 9.778 1.00 1.02 N ATOM 650 H GLN A 68 -1.998 -6.017 8.035 1.00 0.52 H ATOM 651 HA GLN A 68 -1.968 -4.556 10.421 1.00 0.39 H ATOM 652 HB2 GLN A 68 -1.450 -2.524 9.269 1.00 0.52 H ATOM 653 HB3 GLN A 68 -2.648 -2.805 8.008 1.00 0.56 H ATOM 654 HG2 GLN A 68 -4.370 -2.033 9.341 1.00 1.02 H ATOM 655 HG3 GLN A 68 -3.630 -2.585 10.850 1.00 0.94 H ATOM 656 HE21 GLN A 68 -4.586 0.221 9.310 1.00 1.17 H ATOM 657 HE22 GLN A 68 -3.382 1.271 10.009 1.00 1.25 H ATOM 658 N GLY A 69 -4.440 -5.274 10.615 1.00 0.33 N ATOM 659 CA GLY A 69 -5.704 -5.992 10.751 1.00 0.34 C ATOM 660 C GLY A 69 -5.825 -7.194 9.807 1.00 0.37 C ATOM 661 O GLY A 69 -5.078 -8.161 9.929 1.00 0.40 O ATOM 662 H GLY A 69 -4.081 -4.870 11.465 1.00 0.43 H ATOM 663 HA2 GLY A 69 -5.773 -6.361 11.774 1.00 0.39 H ATOM 664 HA3 GLY A 69 -6.531 -5.303 10.585 1.00 0.46 H ATOM 665 N GLY A 70 -6.767 -7.131 8.860 1.00 0.48 N ATOM 666 CA GLY A 70 -7.005 -8.199 7.895 1.00 0.59 C ATOM 667 C GLY A 70 -5.937 -8.267 6.800 1.00 0.47 C ATOM 668 O GLY A 70 -5.801 -9.287 6.129 1.00 0.56 O ATOM 669 H GLY A 70 -7.341 -6.302 8.810 1.00 0.53 H ATOM 670 HA2 GLY A 70 -7.050 -9.160 8.410 1.00 0.72 H ATOM 671 HA3 GLY A 70 -7.969 -8.021 7.418 1.00 0.72 H ATOM 672 N MET A 71 -5.202 -7.176 6.581 1.00 0.32 N ATOM 673 CA MET A 71 -4.147 -7.087 5.588 1.00 0.26 C ATOM 674 C MET A 71 -2.969 -7.988 5.969 1.00 0.33 C ATOM 675 O MET A 71 -2.339 -7.736 6.999 1.00 0.42 O ATOM 676 CB MET A 71 -3.667 -5.639 5.517 1.00 0.24 C ATOM 677 CG MET A 71 -2.713 -5.424 4.358 1.00 0.18 C ATOM 678 SD MET A 71 -2.229 -3.696 4.165 1.00 0.14 S ATOM 679 CE MET A 71 -0.680 -4.075 3.304 1.00 0.19 C ATOM 680 H MET A 71 -5.307 -6.388 7.211 1.00 0.31 H ATOM 681 HA MET A 71 -4.586 -7.343 4.626 1.00 0.27 H ATOM 682 HB2 MET A 71 -4.514 -4.974 5.473 1.00 0.38 H ATOM 683 HB3 MET A 71 -3.102 -5.377 6.404 1.00 0.30 H ATOM 684 HG2 MET A 71 -1.807 -5.986 4.593 1.00 0.27 H ATOM 685 HG3 MET A 71 -3.110 -5.828 3.432 1.00 0.34 H ATOM 686 HE1 MET A 71 -0.005 -4.594 3.982 1.00 1.53 H ATOM 687 HE2 MET A 71 -0.898 -4.737 2.465 1.00 1.69 H ATOM 688 HE3 MET A 71 -0.212 -3.157 2.956 1.00 1.56 H ATOM 689 N PRO A 72 -2.615 -8.981 5.137 1.00 0.35 N ATOM 690 CA PRO A 72 -1.519 -9.881 5.417 1.00 0.54 C ATOM 691 C PRO A 72 -0.186 -9.202 5.163 1.00 0.84 C ATOM 692 O PRO A 72 0.086 -8.695 4.077 1.00 2.15 O ATOM 693 CB PRO A 72 -1.701 -11.084 4.506 1.00 0.34 C ATOM 694 CG PRO A 72 -2.537 -10.557 3.337 1.00 0.28 C ATOM 695 CD PRO A 72 -3.263 -9.324 3.886 1.00 0.27 C ATOM 696 HA PRO A 72 -1.578 -10.217 6.455 1.00 0.69 H ATOM 697 HB2 PRO A 72 -0.751 -11.503 4.169 1.00 0.39 H ATOM 698 HB3 PRO A 72 -2.233 -11.817 5.102 1.00 0.39 H ATOM 699 HG2 PRO A 72 -1.865 -10.255 2.535 1.00 0.45 H ATOM 700 HG3 PRO A 72 -3.234 -11.310 2.965 1.00 0.32 H ATOM 701 HD2 PRO A 72 -3.204 -8.498 3.181 1.00 0.36 H ATOM 702 HD3 PRO A 72 -4.303 -9.555 4.074 1.00 0.22 H ATOM 703 N GLY A 73 0.651 -9.190 6.189 1.00 0.61 N ATOM 704 CA GLY A 73 1.924 -8.516 6.130 1.00 0.50 C ATOM 705 C GLY A 73 2.915 -9.089 5.141 1.00 0.42 C ATOM 706 O GLY A 73 3.031 -10.300 4.969 1.00 0.57 O ATOM 707 H GLY A 73 0.284 -9.479 7.079 1.00 1.59 H ATOM 708 HA2 GLY A 73 1.709 -7.531 5.734 1.00 0.43 H ATOM 709 HA3 GLY A 73 2.377 -8.477 7.121 1.00 0.56 H ATOM 710 N GLY A 74 3.642 -8.169 4.505 1.00 0.26 N ATOM 711 CA GLY A 74 4.707 -8.542 3.586 1.00 0.26 C ATOM 712 C GLY A 74 4.136 -8.967 2.238 1.00 0.22 C ATOM 713 O GLY A 74 4.701 -9.822 1.559 1.00 0.35 O ATOM 714 H GLY A 74 3.420 -7.178 4.665 1.00 0.20 H ATOM 715 HA2 GLY A 74 5.366 -7.691 3.431 1.00 0.27 H ATOM 716 HA3 GLY A 74 5.291 -9.365 4.004 1.00 0.34 H ATOM 717 N ILE A 75 3.025 -8.337 1.847 1.00 0.16 N ATOM 718 CA ILE A 75 2.405 -8.499 0.543 1.00 0.17 C ATOM 719 C ILE A 75 3.435 -8.161 -0.547 1.00 0.19 C ATOM 720 O ILE A 75 3.636 -8.933 -1.484 1.00 0.26 O ATOM 721 CB ILE A 75 1.113 -7.646 0.524 1.00 0.17 C ATOM 722 CG1 ILE A 75 -0.087 -8.550 0.835 1.00 0.27 C ATOM 723 CG2 ILE A 75 0.883 -7.001 -0.860 1.00 0.22 C ATOM 724 CD1 ILE A 75 -1.282 -7.726 1.317 1.00 1.02 C ATOM 725 H ILE A 75 2.628 -7.658 2.479 1.00 0.22 H ATOM 726 HA ILE A 75 2.144 -9.550 0.406 1.00 0.21 H ATOM 727 HB ILE A 75 1.142 -6.897 1.337 1.00 0.18 H ATOM 728 HG12 ILE A 75 -0.365 -9.111 -0.059 1.00 0.97 H ATOM 729 HG13 ILE A 75 0.175 -9.264 1.616 1.00 1.03 H ATOM 730 HG21 ILE A 75 1.681 -6.309 -1.114 1.00 1.48 H ATOM 731 HG22 ILE A 75 0.836 -7.777 -1.625 1.00 1.50 H ATOM 732 HG23 ILE A 75 -0.048 -6.444 -0.889 1.00 1.35 H ATOM 733 HD11 ILE A 75 -2.190 -8.317 1.215 1.00 1.77 H ATOM 734 HD12 ILE A 75 -1.146 -7.428 2.354 1.00 2.02 H ATOM 735 HD13 ILE A 75 -1.388 -6.825 0.729 1.00 2.09 H ATOM 736 N ALA A 76 4.090 -7.005 -0.405 1.00 0.20 N ATOM 737 CA ALA A 76 5.295 -6.627 -1.122 1.00 0.24 C ATOM 738 C ALA A 76 6.490 -6.557 -0.161 1.00 0.34 C ATOM 739 O ALA A 76 6.300 -6.332 1.035 1.00 0.39 O ATOM 740 CB ALA A 76 5.045 -5.281 -1.796 1.00 0.19 C ATOM 741 H ALA A 76 3.762 -6.358 0.290 1.00 0.18 H ATOM 742 HA ALA A 76 5.517 -7.373 -1.878 1.00 0.30 H ATOM 743 HB1 ALA A 76 5.937 -4.989 -2.339 1.00 1.41 H ATOM 744 HB2 ALA A 76 4.213 -5.362 -2.495 1.00 1.43 H ATOM 745 HB3 ALA A 76 4.818 -4.522 -1.048 1.00 1.50 H ATOM 746 N LYS A 77 7.713 -6.752 -0.674 1.00 0.42 N ATOM 747 CA LYS A 77 8.977 -6.719 0.066 1.00 0.51 C ATOM 748 C LYS A 77 10.049 -5.993 -0.762 1.00 0.63 C ATOM 749 O LYS A 77 9.941 -5.901 -1.983 1.00 0.70 O ATOM 750 CB LYS A 77 9.429 -8.160 0.369 1.00 0.59 C ATOM 751 CG LYS A 77 8.631 -8.808 1.514 1.00 0.75 C ATOM 752 CD LYS A 77 9.289 -8.599 2.891 1.00 1.89 C ATOM 753 CE LYS A 77 9.899 -9.918 3.395 1.00 2.02 C ATOM 754 NZ LYS A 77 10.597 -9.768 4.689 1.00 3.05 N ATOM 755 H LYS A 77 7.788 -6.923 -1.669 1.00 0.39 H ATOM 756 HA LYS A 77 8.854 -6.176 1.005 1.00 0.52 H ATOM 757 HB2 LYS A 77 9.289 -8.752 -0.538 1.00 0.85 H ATOM 758 HB3 LYS A 77 10.492 -8.182 0.611 1.00 0.83 H ATOM 759 HG2 LYS A 77 7.619 -8.408 1.534 1.00 1.63 H ATOM 760 HG3 LYS A 77 8.539 -9.876 1.304 1.00 1.67 H ATOM 761 HD2 LYS A 77 10.051 -7.819 2.827 1.00 3.24 H ATOM 762 HD3 LYS A 77 8.519 -8.264 3.590 1.00 2.82 H ATOM 763 HE2 LYS A 77 9.095 -10.650 3.517 1.00 2.06 H ATOM 764 HE3 LYS A 77 10.603 -10.300 2.653 1.00 2.97 H ATOM 765 HZ1 LYS A 77 10.928 -10.671 5.000 1.00 3.46 H ATOM 766 HZ2 LYS A 77 11.390 -9.149 4.592 1.00 3.95 H ATOM 767 HZ3 LYS A 77 9.968 -9.397 5.389 1.00 3.60 H ATOM 768 N GLY A 78 11.102 -5.488 -0.108 1.00 0.70 N ATOM 769 CA GLY A 78 12.207 -4.814 -0.782 1.00 0.75 C ATOM 770 C GLY A 78 11.706 -3.644 -1.628 1.00 0.53 C ATOM 771 O GLY A 78 10.763 -2.961 -1.231 1.00 0.59 O ATOM 772 H GLY A 78 11.133 -5.552 0.898 1.00 0.70 H ATOM 773 HA2 GLY A 78 12.906 -4.432 -0.038 1.00 0.99 H ATOM 774 HA3 GLY A 78 12.726 -5.535 -1.415 1.00 0.82 H ATOM 775 N ALA A 79 12.292 -3.444 -2.815 1.00 0.44 N ATOM 776 CA ALA A 79 11.870 -2.407 -3.753 1.00 0.64 C ATOM 777 C ALA A 79 10.365 -2.465 -4.014 1.00 0.60 C ATOM 778 O ALA A 79 9.728 -1.426 -4.161 1.00 0.77 O ATOM 779 CB ALA A 79 12.632 -2.544 -5.074 1.00 0.93 C ATOM 780 H ALA A 79 13.058 -4.041 -3.086 1.00 0.49 H ATOM 781 HA ALA A 79 12.109 -1.430 -3.326 1.00 0.84 H ATOM 782 HB1 ALA A 79 13.704 -2.457 -4.899 1.00 1.18 H ATOM 783 HB2 ALA A 79 12.414 -3.506 -5.538 1.00 2.08 H ATOM 784 HB3 ALA A 79 12.320 -1.746 -5.751 1.00 1.85 H ATOM 785 N GLU A 80 9.799 -3.674 -4.066 1.00 0.54 N ATOM 786 CA GLU A 80 8.375 -3.870 -4.275 1.00 0.63 C ATOM 787 C GLU A 80 7.577 -3.132 -3.188 1.00 0.67 C ATOM 788 O GLU A 80 6.522 -2.570 -3.463 1.00 1.11 O ATOM 789 CB GLU A 80 8.080 -5.381 -4.334 1.00 0.60 C ATOM 790 CG GLU A 80 6.812 -5.699 -5.124 1.00 0.89 C ATOM 791 CD GLU A 80 6.498 -7.182 -5.168 1.00 1.25 C ATOM 792 OE1 GLU A 80 6.179 -7.764 -4.113 1.00 2.41 O ATOM 793 OE2 GLU A 80 6.428 -7.751 -6.277 1.00 2.19 O ATOM 794 H GLU A 80 10.354 -4.489 -3.847 1.00 0.51 H ATOM 795 HA GLU A 80 8.126 -3.429 -5.240 1.00 0.71 H ATOM 796 HB2 GLU A 80 8.901 -5.907 -4.823 1.00 0.62 H ATOM 797 HB3 GLU A 80 7.958 -5.778 -3.332 1.00 0.82 H ATOM 798 HG2 GLU A 80 5.968 -5.202 -4.658 1.00 1.06 H ATOM 799 HG3 GLU A 80 6.929 -5.350 -6.145 1.00 1.01 H ATOM 800 N ALA A 81 8.082 -3.115 -1.951 1.00 0.27 N ATOM 801 CA ALA A 81 7.464 -2.394 -0.847 1.00 0.25 C ATOM 802 C ALA A 81 7.871 -0.918 -0.875 1.00 0.17 C ATOM 803 O ALA A 81 7.014 -0.036 -0.918 1.00 0.21 O ATOM 804 CB ALA A 81 7.846 -3.058 0.480 1.00 0.35 C ATOM 805 H ALA A 81 9.008 -3.501 -1.806 1.00 0.25 H ATOM 806 HA ALA A 81 6.379 -2.454 -0.940 1.00 0.38 H ATOM 807 HB1 ALA A 81 7.259 -2.619 1.284 1.00 1.37 H ATOM 808 HB2 ALA A 81 7.623 -4.119 0.435 1.00 1.30 H ATOM 809 HB3 ALA A 81 8.907 -2.927 0.693 1.00 1.59 H ATOM 810 N GLU A 82 9.182 -0.658 -0.847 1.00 0.18 N ATOM 811 CA GLU A 82 9.758 0.679 -0.790 1.00 0.19 C ATOM 812 C GLU A 82 9.199 1.592 -1.880 1.00 0.20 C ATOM 813 O GLU A 82 8.739 2.694 -1.592 1.00 0.23 O ATOM 814 CB GLU A 82 11.282 0.575 -0.907 1.00 0.24 C ATOM 815 CG GLU A 82 11.917 -0.036 0.352 1.00 0.54 C ATOM 816 CD GLU A 82 13.020 0.861 0.899 1.00 1.44 C ATOM 817 OE1 GLU A 82 12.668 1.977 1.335 1.00 3.06 O ATOM 818 OE2 GLU A 82 14.188 0.421 0.846 1.00 1.58 O ATOM 819 H GLU A 82 9.826 -1.441 -0.824 1.00 0.21 H ATOM 820 HA GLU A 82 9.518 1.137 0.170 1.00 0.22 H ATOM 821 HB2 GLU A 82 11.553 -0.021 -1.773 1.00 0.37 H ATOM 822 HB3 GLU A 82 11.690 1.573 -1.070 1.00 0.40 H ATOM 823 HG2 GLU A 82 11.178 -0.158 1.140 1.00 1.17 H ATOM 824 HG3 GLU A 82 12.341 -1.013 0.118 1.00 1.20 H ATOM 825 N ALA A 83 9.244 1.141 -3.137 1.00 0.24 N ATOM 826 CA ALA A 83 8.799 1.945 -4.264 1.00 0.26 C ATOM 827 C ALA A 83 7.340 2.344 -4.065 1.00 0.20 C ATOM 828 O ALA A 83 6.988 3.511 -4.216 1.00 0.22 O ATOM 829 CB ALA A 83 8.996 1.177 -5.575 1.00 0.31 C ATOM 830 H ALA A 83 9.566 0.196 -3.316 1.00 0.29 H ATOM 831 HA ALA A 83 9.407 2.849 -4.303 1.00 0.30 H ATOM 832 HB1 ALA A 83 8.357 0.293 -5.601 1.00 1.52 H ATOM 833 HB2 ALA A 83 8.744 1.820 -6.417 1.00 1.36 H ATOM 834 HB3 ALA A 83 10.039 0.870 -5.670 1.00 1.37 H ATOM 835 N VAL A 84 6.495 1.375 -3.704 1.00 0.17 N ATOM 836 CA VAL A 84 5.086 1.613 -3.446 1.00 0.16 C ATOM 837 C VAL A 84 4.912 2.634 -2.324 1.00 0.13 C ATOM 838 O VAL A 84 4.252 3.649 -2.524 1.00 0.19 O ATOM 839 CB VAL A 84 4.382 0.285 -3.145 1.00 0.20 C ATOM 840 CG1 VAL A 84 2.942 0.517 -2.687 1.00 0.23 C ATOM 841 CG2 VAL A 84 4.355 -0.567 -4.413 1.00 0.27 C ATOM 842 H VAL A 84 6.865 0.450 -3.533 1.00 0.19 H ATOM 843 HA VAL A 84 4.638 2.038 -4.345 1.00 0.19 H ATOM 844 HB VAL A 84 4.909 -0.262 -2.364 1.00 0.22 H ATOM 845 HG11 VAL A 84 2.437 1.173 -3.392 1.00 1.61 H ATOM 846 HG12 VAL A 84 2.420 -0.437 -2.648 1.00 1.48 H ATOM 847 HG13 VAL A 84 2.924 0.974 -1.699 1.00 1.49 H ATOM 848 HG21 VAL A 84 3.823 -1.490 -4.196 1.00 1.48 H ATOM 849 HG22 VAL A 84 3.841 -0.035 -5.209 1.00 1.58 H ATOM 850 HG23 VAL A 84 5.364 -0.798 -4.750 1.00 1.42 H ATOM 851 N ALA A 85 5.492 2.364 -1.154 1.00 0.13 N ATOM 852 CA ALA A 85 5.461 3.274 -0.014 1.00 0.14 C ATOM 853 C ALA A 85 5.828 4.697 -0.430 1.00 0.15 C ATOM 854 O ALA A 85 5.059 5.625 -0.204 1.00 0.17 O ATOM 855 CB ALA A 85 6.403 2.792 1.093 1.00 0.18 C ATOM 856 H ALA A 85 5.965 1.472 -1.060 1.00 0.17 H ATOM 857 HA ALA A 85 4.444 3.282 0.379 1.00 0.16 H ATOM 858 HB1 ALA A 85 7.438 2.800 0.752 1.00 1.34 H ATOM 859 HB2 ALA A 85 6.320 3.463 1.952 1.00 1.26 H ATOM 860 HB3 ALA A 85 6.135 1.782 1.396 1.00 1.26 H ATOM 861 N ALA A 86 7.001 4.866 -1.041 1.00 0.18 N ATOM 862 CA ALA A 86 7.520 6.169 -1.432 1.00 0.23 C ATOM 863 C ALA A 86 6.594 6.843 -2.446 1.00 0.27 C ATOM 864 O ALA A 86 6.262 8.018 -2.315 1.00 0.36 O ATOM 865 CB ALA A 86 8.937 6.008 -1.986 1.00 0.31 C ATOM 866 H ALA A 86 7.565 4.042 -1.227 1.00 0.18 H ATOM 867 HA ALA A 86 7.576 6.802 -0.546 1.00 0.23 H ATOM 868 HB1 ALA A 86 9.335 6.985 -2.261 1.00 1.24 H ATOM 869 HB2 ALA A 86 9.579 5.567 -1.223 1.00 1.45 H ATOM 870 HB3 ALA A 86 8.930 5.362 -2.865 1.00 1.28 H ATOM 871 N TRP A 87 6.149 6.098 -3.457 1.00 0.27 N ATOM 872 CA TRP A 87 5.219 6.601 -4.455 1.00 0.33 C ATOM 873 C TRP A 87 3.946 7.108 -3.767 1.00 0.38 C ATOM 874 O TRP A 87 3.533 8.254 -3.954 1.00 0.50 O ATOM 875 CB TRP A 87 4.952 5.475 -5.454 1.00 0.29 C ATOM 876 CG TRP A 87 3.951 5.729 -6.533 1.00 0.35 C ATOM 877 CD1 TRP A 87 4.176 6.431 -7.665 1.00 0.50 C ATOM 878 CD2 TRP A 87 2.602 5.191 -6.657 1.00 0.37 C ATOM 879 NE1 TRP A 87 3.071 6.338 -8.487 1.00 0.53 N ATOM 880 CE2 TRP A 87 2.077 5.572 -7.923 1.00 0.44 C ATOM 881 CE3 TRP A 87 1.777 4.390 -5.843 1.00 0.53 C ATOM 882 CZ2 TRP A 87 0.820 5.147 -8.379 1.00 0.46 C ATOM 883 CZ3 TRP A 87 0.485 4.019 -6.260 1.00 0.60 C ATOM 884 CH2 TRP A 87 0.032 4.337 -7.551 1.00 0.47 C ATOM 885 H TRP A 87 6.427 5.121 -3.512 1.00 0.23 H ATOM 886 HA TRP A 87 5.685 7.434 -4.983 1.00 0.40 H ATOM 887 HB2 TRP A 87 5.899 5.227 -5.937 1.00 0.30 H ATOM 888 HB3 TRP A 87 4.620 4.595 -4.906 1.00 0.25 H ATOM 889 HD1 TRP A 87 5.105 6.922 -7.910 1.00 0.64 H ATOM 890 HE1 TRP A 87 3.039 6.662 -9.460 1.00 0.62 H ATOM 891 HE3 TRP A 87 2.155 4.066 -4.888 1.00 0.67 H ATOM 892 HZ2 TRP A 87 0.459 5.438 -9.354 1.00 0.54 H ATOM 893 HZ3 TRP A 87 -0.168 3.489 -5.588 1.00 0.79 H ATOM 894 HH2 TRP A 87 -0.914 3.962 -7.913 1.00 0.51 H ATOM 895 N LEU A 88 3.337 6.272 -2.926 1.00 0.32 N ATOM 896 CA LEU A 88 2.174 6.674 -2.149 1.00 0.41 C ATOM 897 C LEU A 88 2.475 7.823 -1.193 1.00 0.38 C ATOM 898 O LEU A 88 1.599 8.648 -0.975 1.00 0.47 O ATOM 899 CB LEU A 88 1.508 5.487 -1.442 1.00 0.49 C ATOM 900 CG LEU A 88 0.372 4.904 -2.307 1.00 0.92 C ATOM 901 CD1 LEU A 88 0.561 3.409 -2.498 1.00 1.57 C ATOM 902 CD2 LEU A 88 -0.993 5.136 -1.660 1.00 1.89 C ATOM 903 H LEU A 88 3.734 5.349 -2.791 1.00 0.27 H ATOM 904 HA LEU A 88 1.467 7.093 -2.855 1.00 0.59 H ATOM 905 HB2 LEU A 88 2.255 4.731 -1.202 1.00 0.54 H ATOM 906 HB3 LEU A 88 1.082 5.830 -0.498 1.00 0.44 H ATOM 907 HG LEU A 88 0.360 5.351 -3.302 1.00 2.41 H ATOM 908 HD11 LEU A 88 0.509 2.904 -1.535 1.00 2.00 H ATOM 909 HD12 LEU A 88 -0.225 3.043 -3.158 1.00 2.41 H ATOM 910 HD13 LEU A 88 1.533 3.243 -2.949 1.00 2.98 H ATOM 911 HD21 LEU A 88 -1.056 4.569 -0.730 1.00 2.85 H ATOM 912 HD22 LEU A 88 -1.134 6.200 -1.458 1.00 2.93 H ATOM 913 HD23 LEU A 88 -1.781 4.796 -2.331 1.00 2.47 H ATOM 914 N ALA A 89 3.696 7.939 -0.670 1.00 0.33 N ATOM 915 CA ALA A 89 4.086 9.098 0.122 1.00 0.36 C ATOM 916 C ALA A 89 3.904 10.396 -0.658 1.00 0.44 C ATOM 917 O ALA A 89 3.680 11.439 -0.046 1.00 0.75 O ATOM 918 CB ALA A 89 5.509 8.957 0.646 1.00 0.40 C ATOM 919 H ALA A 89 4.381 7.208 -0.828 1.00 0.29 H ATOM 920 HA ALA A 89 3.440 9.136 0.997 1.00 0.36 H ATOM 921 HB1 ALA A 89 5.682 9.682 1.444 1.00 1.29 H ATOM 922 HB2 ALA A 89 5.613 7.954 1.045 1.00 1.41 H ATOM 923 HB3 ALA A 89 6.239 9.134 -0.142 1.00 1.49 H ATOM 924 N GLU A 90 3.969 10.341 -1.993 1.00 0.31 N ATOM 925 CA GLU A 90 3.636 11.466 -2.850 1.00 0.41 C ATOM 926 C GLU A 90 2.164 11.484 -3.265 1.00 0.51 C ATOM 927 O GLU A 90 1.622 12.568 -3.467 1.00 1.07 O ATOM 928 CB GLU A 90 4.603 11.531 -4.037 1.00 0.60 C ATOM 929 CG GLU A 90 5.995 11.981 -3.560 1.00 1.81 C ATOM 930 CD GLU A 90 6.013 13.445 -3.110 1.00 3.36 C ATOM 931 OE1 GLU A 90 5.658 13.723 -1.936 1.00 4.93 O ATOM 932 OE2 GLU A 90 6.345 14.285 -3.972 1.00 3.74 O ATOM 933 H GLU A 90 4.213 9.465 -2.442 1.00 0.35 H ATOM 934 HA GLU A 90 3.749 12.382 -2.285 1.00 0.53 H ATOM 935 HB2 GLU A 90 4.667 10.555 -4.517 1.00 1.05 H ATOM 936 HB3 GLU A 90 4.240 12.256 -4.768 1.00 1.43 H ATOM 937 HG2 GLU A 90 6.348 11.337 -2.754 1.00 2.98 H ATOM 938 HG3 GLU A 90 6.685 11.875 -4.399 1.00 2.16 H ATOM 939 N LYS A 91 1.493 10.333 -3.378 1.00 0.44 N ATOM 940 CA LYS A 91 0.057 10.336 -3.650 1.00 0.47 C ATOM 941 C LYS A 91 -0.730 10.734 -2.395 1.00 0.48 C ATOM 942 O LYS A 91 -0.881 9.951 -1.458 1.00 0.66 O ATOM 943 CB LYS A 91 -0.391 8.996 -4.236 1.00 0.61 C ATOM 944 CG LYS A 91 0.353 8.740 -5.556 1.00 0.81 C ATOM 945 CD LYS A 91 -0.416 7.751 -6.439 1.00 0.87 C ATOM 946 CE LYS A 91 -1.615 8.381 -7.166 1.00 1.23 C ATOM 947 NZ LYS A 91 -1.218 9.025 -8.437 1.00 3.04 N ATOM 948 H LYS A 91 1.958 9.453 -3.172 1.00 0.75 H ATOM 949 HA LYS A 91 -0.149 11.086 -4.416 1.00 0.49 H ATOM 950 HB2 LYS A 91 -0.208 8.194 -3.527 1.00 0.66 H ATOM 951 HB3 LYS A 91 -1.466 9.022 -4.397 1.00 0.78 H ATOM 952 HG2 LYS A 91 0.515 9.673 -6.095 1.00 1.02 H ATOM 953 HG3 LYS A 91 1.333 8.321 -5.320 1.00 1.13 H ATOM 954 HD2 LYS A 91 0.279 7.357 -7.174 1.00 1.76 H ATOM 955 HD3 LYS A 91 -0.756 6.923 -5.813 1.00 1.32 H ATOM 956 HE2 LYS A 91 -2.336 7.594 -7.394 1.00 1.53 H ATOM 957 HE3 LYS A 91 -2.109 9.114 -6.527 1.00 2.21 H ATOM 958 HZ1 LYS A 91 -0.508 9.724 -8.271 1.00 3.88 H ATOM 959 HZ2 LYS A 91 -0.856 8.333 -9.080 1.00 3.76 H ATOM 960 HZ3 LYS A 91 -2.024 9.469 -8.857 1.00 3.67 H ATOM 961 N LYS A 92 -1.215 11.978 -2.381 1.00 0.70 N ATOM 962 CA LYS A 92 -1.904 12.616 -1.281 1.00 0.90 C ATOM 963 C LYS A 92 -2.525 13.893 -1.845 1.00 1.69 C ATOM 964 O LYS A 92 -3.296 14.537 -1.101 1.00 2.52 O ATOM 965 CB LYS A 92 -0.910 12.920 -0.153 1.00 1.56 C ATOM 966 CG LYS A 92 0.142 13.961 -0.577 1.00 1.19 C ATOM 967 CD LYS A 92 1.443 13.808 0.223 1.00 1.79 C ATOM 968 CE LYS A 92 2.589 14.596 -0.447 1.00 1.69 C ATOM 969 NZ LYS A 92 3.927 14.107 -0.046 1.00 2.75 N ATOM 970 OXT LYS A 92 -2.177 14.207 -3.008 1.00 2.50 O ATOM 971 H LYS A 92 -1.121 12.605 -3.175 1.00 1.04 H ATOM 972 HA LYS A 92 -2.700 11.969 -0.919 1.00 0.73 H ATOM 973 HB2 LYS A 92 -1.468 13.307 0.693 1.00 2.60 H ATOM 974 HB3 LYS A 92 -0.434 11.988 0.145 1.00 2.99 H ATOM 975 HG2 LYS A 92 0.360 13.819 -1.634 1.00 2.58 H ATOM 976 HG3 LYS A 92 -0.277 14.961 -0.455 1.00 2.15 H ATOM 977 HD2 LYS A 92 1.285 14.128 1.255 1.00 2.71 H ATOM 978 HD3 LYS A 92 1.687 12.747 0.226 1.00 3.07 H ATOM 979 HE2 LYS A 92 2.524 14.464 -1.528 1.00 2.81 H ATOM 980 HE3 LYS A 92 2.487 15.659 -0.225 1.00 2.26 H ATOM 981 HZ1 LYS A 92 3.934 13.093 -0.063 1.00 3.51 H ATOM 982 HZ2 LYS A 92 4.649 14.352 -0.735 1.00 3.44 H ATOM 983 HZ3 LYS A 92 4.191 14.413 0.876 1.00 3.34 H TER 984 LYS A 92 HETATM 985 FE HEC A 93 -3.586 -2.613 2.507 1.00 0.09 FE HETATM 986 CHA HEC A 93 -4.668 -1.052 5.494 1.00 0.13 C HETATM 987 CHB HEC A 93 -1.317 -0.076 2.038 1.00 0.11 C HETATM 988 CHC HEC A 93 -2.335 -4.433 -0.029 1.00 0.11 C HETATM 989 CHD HEC A 93 -6.189 -4.947 2.948 1.00 0.12 C HETATM 990 NA HEC A 93 -3.071 -0.892 3.577 1.00 0.10 N HETATM 991 C1A HEC A 93 -3.638 -0.467 4.746 1.00 0.11 C HETATM 992 C2A HEC A 93 -3.012 0.786 5.098 1.00 0.12 C HETATM 993 C3A HEC A 93 -2.063 1.070 4.140 1.00 0.12 C HETATM 994 C4A HEC A 93 -2.118 -0.002 3.172 1.00 0.11 C HETATM 995 CMA HEC A 93 -1.095 2.236 4.136 1.00 0.14 C HETATM 996 CAA HEC A 93 -3.386 1.623 6.294 1.00 0.17 C HETATM 997 CBA HEC A 93 -4.795 2.217 6.191 1.00 0.84 C HETATM 998 CGA HEC A 93 -5.465 2.165 7.554 1.00 1.39 C HETATM 999 O1A HEC A 93 -5.273 3.135 8.315 1.00 2.23 O HETATM 1000 O2A HEC A 93 -6.099 1.125 7.830 1.00 2.49 O HETATM 1001 NB HEC A 93 -2.132 -2.278 1.196 1.00 0.10 N HETATM 1002 C1B HEC A 93 -1.338 -1.166 1.159 1.00 0.11 C HETATM 1003 C2B HEC A 93 -0.493 -1.295 -0.001 1.00 0.12 C HETATM 1004 C3B HEC A 93 -0.671 -2.575 -0.495 1.00 0.12 C HETATM 1005 C4B HEC A 93 -1.770 -3.170 0.233 1.00 0.10 C HETATM 1006 CMB HEC A 93 0.367 -0.202 -0.595 1.00 0.13 C HETATM 1007 CAB HEC A 93 0.089 -3.216 -1.636 1.00 0.12 C HETATM 1008 CBB HEC A 93 1.576 -3.442 -1.352 1.00 0.14 C HETATM 1009 NC HEC A 93 -4.150 -4.390 1.635 1.00 0.10 N HETATM 1010 C1C HEC A 93 -3.474 -4.935 0.606 1.00 0.11 C HETATM 1011 C2C HEC A 93 -4.173 -6.135 0.209 1.00 0.14 C HETATM 1012 C3C HEC A 93 -5.282 -6.264 1.017 1.00 0.14 C HETATM 1013 C4C HEC A 93 -5.252 -5.152 1.940 1.00 0.12 C HETATM 1014 CMC HEC A 93 -3.846 -6.961 -1.006 1.00 0.19 C HETATM 1015 CAC HEC A 93 -6.369 -7.324 0.911 1.00 0.15 C HETATM 1016 CBC HEC A 93 -5.921 -8.720 1.345 1.00 0.18 C HETATM 1017 ND HEC A 93 -5.152 -2.940 3.963 1.00 0.10 N HETATM 1018 C1D HEC A 93 -6.087 -3.929 3.884 1.00 0.11 C HETATM 1019 C2D HEC A 93 -6.975 -3.796 5.010 1.00 0.12 C HETATM 1020 C3D HEC A 93 -6.521 -2.742 5.768 1.00 0.13 C HETATM 1021 C4D HEC A 93 -5.377 -2.178 5.079 1.00 0.12 C HETATM 1022 CMD HEC A 93 -8.165 -4.678 5.309 1.00 0.14 C HETATM 1023 CAD HEC A 93 -7.110 -2.315 7.095 1.00 0.16 C HETATM 1024 CBD HEC A 93 -6.750 -3.295 8.208 1.00 0.41 C HETATM 1025 CGD HEC A 93 -7.327 -2.869 9.549 1.00 0.99 C HETATM 1026 O1D HEC A 93 -6.521 -2.666 10.481 1.00 2.30 O HETATM 1027 O2D HEC A 93 -8.571 -2.783 9.617 1.00 1.90 O HETATM 1028 HHA HEC A 93 -4.971 -0.563 6.406 1.00 0.15 H HETATM 1029 HHB HEC A 93 -0.609 0.719 1.882 1.00 0.12 H HETATM 1030 HHC HEC A 93 -1.919 -5.045 -0.806 1.00 0.12 H HETATM 1031 HHD HEC A 93 -6.998 -5.645 3.072 1.00 0.14 H HETATM 1032 HMA1 HEC A 93 -0.979 2.647 3.133 1.00 1.47 H HETATM 1033 HMA2 HEC A 93 -1.445 3.044 4.775 1.00 1.50 H HETATM 1034 HMA3 HEC A 93 -0.123 1.900 4.505 1.00 1.51 H HETATM 1035 HAA1 HEC A 93 -2.678 2.429 6.469 1.00 0.60 H HETATM 1036 HAA2 HEC A 93 -3.334 0.974 7.168 1.00 0.62 H HETATM 1037 HBA1 HEC A 93 -5.408 1.657 5.487 1.00 1.60 H HETATM 1038 HBA2 HEC A 93 -4.744 3.246 5.837 1.00 1.65 H HETATM 1039 HMB1 HEC A 93 1.399 -0.529 -0.620 1.00 1.09 H HETATM 1040 HMB2 HEC A 93 0.028 0.030 -1.604 1.00 1.17 H HETATM 1041 HMB3 HEC A 93 0.322 0.729 -0.034 1.00 1.12 H HETATM 1042 HAB HEC A 93 -0.312 -4.196 -1.865 1.00 0.13 H HETATM 1043 HBB1 HEC A 93 2.045 -3.918 -2.214 1.00 1.59 H HETATM 1044 HBB2 HEC A 93 2.095 -2.509 -1.151 1.00 1.62 H HETATM 1045 HBB3 HEC A 93 1.676 -4.094 -0.486 1.00 1.66 H HETATM 1046 HMC1 HEC A 93 -4.090 -6.360 -1.882 1.00 1.62 H HETATM 1047 HMC2 HEC A 93 -2.789 -7.217 -1.022 1.00 1.42 H HETATM 1048 HMC3 HEC A 93 -4.409 -7.888 -1.038 1.00 1.50 H HETATM 1049 HAC HEC A 93 -7.215 -7.069 1.542 1.00 0.16 H HETATM 1050 HBC1 HEC A 93 -5.674 -8.695 2.405 1.00 1.49 H HETATM 1051 HBC2 HEC A 93 -6.738 -9.428 1.196 1.00 1.52 H HETATM 1052 HBC3 HEC A 93 -5.052 -9.052 0.781 1.00 1.45 H HETATM 1053 HMD1 HEC A 93 -8.609 -4.435 6.273 1.00 1.42 H HETATM 1054 HMD2 HEC A 93 -8.925 -4.540 4.540 1.00 1.49 H HETATM 1055 HMD3 HEC A 93 -7.856 -5.723 5.326 1.00 1.45 H HETATM 1056 HAD1 HEC A 93 -8.196 -2.264 7.017 1.00 0.23 H HETATM 1057 HAD2 HEC A 93 -6.768 -1.324 7.391 1.00 0.28 H HETATM 1058 HBD1 HEC A 93 -5.670 -3.344 8.269 1.00 0.78 H HETATM 1059 HBD2 HEC A 93 -7.121 -4.290 7.978 1.00 0.82 H