ATOM 1 N VAL A 1 -8.168 8.767 -18.547 1.00 5.48 N ATOM 2 CA VAL A 1 -8.306 7.417 -19.156 1.00 5.58 C ATOM 3 C VAL A 1 -7.610 6.308 -18.360 1.00 4.62 C ATOM 4 O VAL A 1 -8.157 5.209 -18.249 1.00 4.76 O ATOM 5 CB VAL A 1 -7.909 7.364 -20.641 1.00 6.58 C ATOM 6 CG1 VAL A 1 -8.841 8.242 -21.483 1.00 7.71 C ATOM 7 CG2 VAL A 1 -6.462 7.785 -20.932 1.00 7.02 C ATOM 8 H1 VAL A 1 -8.547 8.757 -17.606 1.00 5.91 H ATOM 9 H2 VAL A 1 -8.688 9.459 -19.077 1.00 5.92 H ATOM 10 H3 VAL A 1 -7.200 9.070 -18.522 1.00 5.33 H ATOM 11 HA VAL A 1 -9.365 7.167 -19.115 1.00 6.61 H ATOM 12 HB VAL A 1 -8.038 6.337 -20.983 1.00 7.15 H ATOM 13 HG11 VAL A 1 -8.673 9.296 -21.267 1.00 7.68 H ATOM 14 HG12 VAL A 1 -8.647 8.066 -22.541 1.00 8.78 H ATOM 15 HG13 VAL A 1 -9.882 7.986 -21.277 1.00 8.08 H ATOM 16 HG21 VAL A 1 -6.291 8.823 -20.649 1.00 6.92 H ATOM 17 HG22 VAL A 1 -5.764 7.144 -20.398 1.00 7.21 H ATOM 18 HG23 VAL A 1 -6.264 7.678 -21.999 1.00 8.04 H ATOM 19 N THR A 2 -6.405 6.543 -17.834 1.00 4.14 N ATOM 20 CA THR A 2 -5.548 5.549 -17.157 1.00 3.66 C ATOM 21 C THR A 2 -5.967 5.312 -15.696 1.00 3.23 C ATOM 22 O THR A 2 -6.421 6.243 -15.026 1.00 3.76 O ATOM 23 CB THR A 2 -4.074 5.995 -17.227 1.00 4.31 C ATOM 24 OG1 THR A 2 -3.736 6.288 -18.568 1.00 5.13 O ATOM 25 CG2 THR A 2 -3.075 4.937 -16.760 1.00 4.53 C ATOM 26 H THR A 2 -5.991 7.461 -17.956 1.00 4.52 H ATOM 27 HA THR A 2 -5.630 4.605 -17.694 1.00 3.80 H ATOM 28 HB THR A 2 -3.944 6.898 -16.630 1.00 4.70 H ATOM 29 HG1 THR A 2 -3.317 7.173 -18.558 1.00 5.73 H ATOM 30 HG21 THR A 2 -3.242 4.002 -17.294 1.00 4.50 H ATOM 31 HG22 THR A 2 -2.060 5.285 -16.955 1.00 5.25 H ATOM 32 HG23 THR A 2 -3.175 4.773 -15.687 1.00 4.87 H ATOM 33 N LYS A 3 -5.794 4.075 -15.203 1.00 2.80 N ATOM 34 CA LYS A 3 -6.043 3.668 -13.804 1.00 2.38 C ATOM 35 C LYS A 3 -5.048 2.595 -13.332 1.00 2.02 C ATOM 36 O LYS A 3 -4.815 1.625 -14.066 1.00 2.04 O ATOM 37 CB LYS A 3 -7.492 3.138 -13.688 1.00 2.49 C ATOM 38 CG LYS A 3 -8.229 3.561 -12.408 1.00 2.63 C ATOM 39 CD LYS A 3 -8.662 5.034 -12.472 1.00 3.57 C ATOM 40 CE LYS A 3 -9.650 5.411 -11.363 1.00 3.89 C ATOM 41 NZ LYS A 3 -9.018 5.467 -10.029 1.00 4.47 N ATOM 42 H LYS A 3 -5.458 3.364 -15.844 1.00 3.17 H ATOM 43 HA LYS A 3 -5.913 4.544 -13.163 1.00 2.43 H ATOM 44 HB2 LYS A 3 -8.083 3.471 -14.544 1.00 2.85 H ATOM 45 HB3 LYS A 3 -7.479 2.048 -13.728 1.00 2.45 H ATOM 46 HG2 LYS A 3 -9.124 2.944 -12.320 1.00 3.13 H ATOM 47 HG3 LYS A 3 -7.597 3.385 -11.538 1.00 2.47 H ATOM 48 HD2 LYS A 3 -7.788 5.687 -12.429 1.00 3.90 H ATOM 49 HD3 LYS A 3 -9.161 5.206 -13.427 1.00 4.37 H ATOM 50 HE2 LYS A 3 -10.062 6.395 -11.600 1.00 5.00 H ATOM 51 HE3 LYS A 3 -10.479 4.696 -11.356 1.00 3.69 H ATOM 52 HZ1 LYS A 3 -9.629 5.881 -9.328 1.00 4.96 H ATOM 53 HZ2 LYS A 3 -8.774 4.541 -9.673 1.00 4.44 H ATOM 54 HZ3 LYS A 3 -8.181 6.039 -10.046 1.00 5.47 H ATOM 55 N LYS A 4 -4.517 2.693 -12.104 1.00 1.82 N ATOM 56 CA LYS A 4 -3.671 1.655 -11.474 1.00 1.52 C ATOM 57 C LYS A 4 -4.408 0.352 -11.196 1.00 1.30 C ATOM 58 O LYS A 4 -5.627 0.242 -11.333 1.00 1.39 O ATOM 59 CB LYS A 4 -3.030 2.192 -10.175 1.00 1.50 C ATOM 60 CG LYS A 4 -1.862 3.111 -10.504 1.00 1.81 C ATOM 61 CD LYS A 4 -0.559 2.398 -10.885 1.00 2.13 C ATOM 62 CE LYS A 4 0.450 3.491 -11.224 1.00 2.90 C ATOM 63 NZ LYS A 4 1.600 2.989 -12.013 1.00 3.33 N ATOM 64 H LYS A 4 -4.698 3.541 -11.573 1.00 2.00 H ATOM 65 HA LYS A 4 -2.879 1.398 -12.177 1.00 1.64 H ATOM 66 HB2 LYS A 4 -3.779 2.738 -9.599 1.00 1.59 H ATOM 67 HB3 LYS A 4 -2.650 1.390 -9.543 1.00 1.38 H ATOM 68 HG2 LYS A 4 -2.158 3.686 -11.365 1.00 2.02 H ATOM 69 HG3 LYS A 4 -1.696 3.779 -9.661 1.00 1.93 H ATOM 70 HD2 LYS A 4 -0.186 1.804 -10.054 1.00 2.43 H ATOM 71 HD3 LYS A 4 -0.725 1.763 -11.755 1.00 2.71 H ATOM 72 HE2 LYS A 4 -0.069 4.270 -11.767 1.00 3.53 H ATOM 73 HE3 LYS A 4 0.779 3.953 -10.295 1.00 3.39 H ATOM 74 HZ1 LYS A 4 2.173 3.753 -12.360 1.00 4.02 H ATOM 75 HZ2 LYS A 4 2.170 2.354 -11.459 1.00 3.49 H ATOM 76 HZ3 LYS A 4 1.276 2.471 -12.825 1.00 3.76 H ATOM 77 N ALA A 5 -3.613 -0.634 -10.805 1.00 1.12 N ATOM 78 CA ALA A 5 -4.094 -1.933 -10.320 1.00 0.94 C ATOM 79 C ALA A 5 -4.888 -1.788 -9.011 1.00 0.82 C ATOM 80 O ALA A 5 -4.650 -0.855 -8.236 1.00 0.85 O ATOM 81 CB ALA A 5 -2.913 -2.894 -10.137 1.00 0.89 C ATOM 82 H ALA A 5 -2.648 -0.360 -10.675 1.00 1.22 H ATOM 83 HA ALA A 5 -4.764 -2.357 -11.067 1.00 1.02 H ATOM 84 HB1 ALA A 5 -2.221 -2.499 -9.390 1.00 1.33 H ATOM 85 HB2 ALA A 5 -3.285 -3.864 -9.796 1.00 1.34 H ATOM 86 HB3 ALA A 5 -2.390 -3.029 -11.084 1.00 1.60 H ATOM 87 N SER A 6 -5.797 -2.724 -8.719 1.00 0.76 N ATOM 88 CA SER A 6 -6.424 -2.737 -7.398 1.00 0.74 C ATOM 89 C SER A 6 -5.443 -3.224 -6.330 1.00 0.66 C ATOM 90 O SER A 6 -4.591 -4.089 -6.543 1.00 0.56 O ATOM 91 CB SER A 6 -7.763 -3.479 -7.364 1.00 0.80 C ATOM 92 OG SER A 6 -7.602 -4.880 -7.340 1.00 0.77 O ATOM 93 H SER A 6 -5.944 -3.512 -9.342 1.00 0.77 H ATOM 94 HA SER A 6 -6.673 -1.703 -7.155 1.00 0.84 H ATOM 95 HB2 SER A 6 -8.310 -3.181 -6.469 1.00 0.93 H ATOM 96 HB3 SER A 6 -8.351 -3.186 -8.233 1.00 0.89 H ATOM 97 HG SER A 6 -8.377 -5.261 -7.807 1.00 1.07 H ATOM 98 N HIS A 7 -5.595 -2.650 -5.145 1.00 0.81 N ATOM 99 CA HIS A 7 -4.913 -3.029 -3.902 1.00 0.81 C ATOM 100 C HIS A 7 -5.120 -4.514 -3.557 1.00 0.65 C ATOM 101 O HIS A 7 -4.197 -5.197 -3.111 1.00 0.65 O ATOM 102 CB HIS A 7 -5.440 -2.083 -2.809 1.00 1.15 C ATOM 103 CG HIS A 7 -6.898 -1.714 -2.975 1.00 1.20 C ATOM 104 ND1 HIS A 7 -7.967 -2.614 -2.959 1.00 1.47 N ATOM 105 CD2 HIS A 7 -7.345 -0.512 -3.447 1.00 1.32 C ATOM 106 CE1 HIS A 7 -9.048 -1.916 -3.345 1.00 1.70 C ATOM 107 NE2 HIS A 7 -8.699 -0.656 -3.652 1.00 1.58 N ATOM 108 H HIS A 7 -6.342 -1.975 -5.061 1.00 0.95 H ATOM 109 HA HIS A 7 -3.841 -2.885 -4.004 1.00 0.82 H ATOM 110 HB2 HIS A 7 -5.287 -2.529 -1.834 1.00 1.37 H ATOM 111 HB3 HIS A 7 -4.858 -1.163 -2.845 1.00 1.44 H ATOM 112 HD2 HIS A 7 -6.740 0.357 -3.679 1.00 1.39 H ATOM 113 HE1 HIS A 7 -10.052 -2.315 -3.421 1.00 2.05 H ATOM 114 HE2 HIS A 7 -9.343 0.067 -3.970 1.00 1.79 H ATOM 115 N LYS A 8 -6.309 -5.035 -3.867 1.00 0.75 N ATOM 116 CA LYS A 8 -6.674 -6.455 -3.809 1.00 0.81 C ATOM 117 C LYS A 8 -5.830 -7.331 -4.739 1.00 0.64 C ATOM 118 O LYS A 8 -5.195 -8.274 -4.266 1.00 0.70 O ATOM 119 CB LYS A 8 -8.172 -6.577 -4.102 1.00 1.03 C ATOM 120 CG LYS A 8 -8.701 -7.996 -3.882 1.00 1.55 C ATOM 121 CD LYS A 8 -8.713 -8.408 -2.400 1.00 2.24 C ATOM 122 CE LYS A 8 -9.472 -9.722 -2.221 1.00 3.03 C ATOM 123 NZ LYS A 8 -9.448 -10.180 -0.813 1.00 3.92 N ATOM 124 H LYS A 8 -7.014 -4.359 -4.125 1.00 0.91 H ATOM 125 HA LYS A 8 -6.498 -6.813 -2.801 1.00 0.93 H ATOM 126 HB2 LYS A 8 -8.727 -5.890 -3.460 1.00 1.67 H ATOM 127 HB3 LYS A 8 -8.364 -6.290 -5.137 1.00 1.47 H ATOM 128 HG2 LYS A 8 -9.706 -7.997 -4.279 1.00 2.10 H ATOM 129 HG3 LYS A 8 -8.121 -8.715 -4.461 1.00 1.99 H ATOM 130 HD2 LYS A 8 -7.689 -8.539 -2.047 1.00 2.33 H ATOM 131 HD3 LYS A 8 -9.201 -7.632 -1.808 1.00 2.58 H ATOM 132 HE2 LYS A 8 -10.507 -9.580 -2.548 1.00 3.19 H ATOM 133 HE3 LYS A 8 -9.024 -10.485 -2.866 1.00 3.50 H ATOM 134 HZ1 LYS A 8 -8.513 -10.490 -0.547 1.00 4.39 H ATOM 135 HZ2 LYS A 8 -9.734 -9.456 -0.161 1.00 4.57 H ATOM 136 HZ3 LYS A 8 -10.050 -10.992 -0.692 1.00 4.28 H ATOM 137 N ASP A 9 -5.790 -7.015 -6.035 1.00 0.53 N ATOM 138 CA ASP A 9 -4.929 -7.683 -7.038 1.00 0.52 C ATOM 139 C ASP A 9 -3.448 -7.697 -6.600 1.00 0.52 C ATOM 140 O ASP A 9 -2.761 -8.722 -6.664 1.00 0.79 O ATOM 141 CB ASP A 9 -5.067 -6.952 -8.387 1.00 0.59 C ATOM 142 CG ASP A 9 -4.858 -7.822 -9.629 1.00 1.07 C ATOM 143 OD1 ASP A 9 -5.502 -7.514 -10.661 1.00 2.00 O ATOM 144 OD2 ASP A 9 -4.033 -8.768 -9.630 1.00 2.38 O ATOM 145 H ASP A 9 -6.407 -6.269 -6.337 1.00 0.57 H ATOM 146 HA ASP A 9 -5.263 -8.710 -7.168 1.00 0.67 H ATOM 147 HB2 ASP A 9 -6.059 -6.517 -8.470 1.00 0.83 H ATOM 148 HB3 ASP A 9 -4.359 -6.127 -8.419 1.00 0.93 H ATOM 149 N ALA A 10 -2.991 -6.565 -6.058 1.00 0.39 N ATOM 150 CA ALA A 10 -1.657 -6.343 -5.507 1.00 0.43 C ATOM 151 C ALA A 10 -1.379 -7.021 -4.148 1.00 0.45 C ATOM 152 O ALA A 10 -0.284 -6.875 -3.602 1.00 0.56 O ATOM 153 CB ALA A 10 -1.469 -4.828 -5.426 1.00 0.45 C ATOM 154 H ALA A 10 -3.617 -5.764 -6.073 1.00 0.39 H ATOM 155 HA ALA A 10 -0.926 -6.744 -6.206 1.00 0.58 H ATOM 156 HB1 ALA A 10 -2.262 -4.401 -4.815 1.00 0.65 H ATOM 157 HB2 ALA A 10 -0.514 -4.583 -4.965 1.00 0.76 H ATOM 158 HB3 ALA A 10 -1.512 -4.397 -6.427 1.00 0.84 H ATOM 159 N GLY A 11 -2.338 -7.757 -3.580 1.00 0.48 N ATOM 160 CA GLY A 11 -2.141 -8.523 -2.351 1.00 0.63 C ATOM 161 C GLY A 11 -1.975 -7.671 -1.092 1.00 0.57 C ATOM 162 O GLY A 11 -1.120 -7.979 -0.258 1.00 0.70 O ATOM 163 H GLY A 11 -3.231 -7.833 -4.054 1.00 0.49 H ATOM 164 HA2 GLY A 11 -3.018 -9.144 -2.199 1.00 0.75 H ATOM 165 HA3 GLY A 11 -1.270 -9.170 -2.458 1.00 0.75 H ATOM 166 N TYR A 12 -2.752 -6.594 -0.947 1.00 0.50 N ATOM 167 CA TYR A 12 -2.767 -5.782 0.278 1.00 0.53 C ATOM 168 C TYR A 12 -3.364 -6.472 1.511 1.00 0.61 C ATOM 169 O TYR A 12 -4.156 -7.419 1.416 1.00 0.78 O ATOM 170 CB TYR A 12 -3.341 -4.376 0.044 1.00 0.57 C ATOM 171 CG TYR A 12 -4.843 -4.184 0.191 1.00 1.12 C ATOM 172 CD1 TYR A 12 -5.760 -5.134 -0.308 1.00 1.95 C ATOM 173 CD2 TYR A 12 -5.326 -2.986 0.756 1.00 2.64 C ATOM 174 CE1 TYR A 12 -7.143 -4.870 -0.278 1.00 2.43 C ATOM 175 CE2 TYR A 12 -6.707 -2.710 0.770 1.00 3.30 C ATOM 176 CZ TYR A 12 -7.619 -3.647 0.237 1.00 2.71 C ATOM 177 OH TYR A 12 -8.950 -3.375 0.212 1.00 3.54 O ATOM 178 H TYR A 12 -3.341 -6.312 -1.726 1.00 0.47 H ATOM 179 HA TYR A 12 -1.734 -5.624 0.545 1.00 0.53 H ATOM 180 HB2 TYR A 12 -2.853 -3.716 0.762 1.00 1.08 H ATOM 181 HB3 TYR A 12 -3.039 -4.026 -0.944 1.00 0.58 H ATOM 182 HD1 TYR A 12 -5.406 -6.055 -0.745 1.00 3.03 H ATOM 183 HD2 TYR A 12 -4.627 -2.246 1.126 1.00 3.68 H ATOM 184 HE1 TYR A 12 -7.845 -5.585 -0.674 1.00 3.41 H ATOM 185 HE2 TYR A 12 -7.066 -1.772 1.164 1.00 4.65 H ATOM 186 HH TYR A 12 -9.135 -2.482 0.549 1.00 3.59 H ATOM 187 N GLN A 13 -2.959 -5.973 2.677 1.00 0.59 N ATOM 188 CA GLN A 13 -3.480 -6.325 4.001 1.00 0.63 C ATOM 189 C GLN A 13 -3.793 -5.058 4.821 1.00 0.62 C ATOM 190 O GLN A 13 -3.527 -3.932 4.393 1.00 0.73 O ATOM 191 CB GLN A 13 -2.503 -7.284 4.716 1.00 0.62 C ATOM 192 CG GLN A 13 -1.048 -6.805 4.763 1.00 0.69 C ATOM 193 CD GLN A 13 -0.154 -7.686 5.608 1.00 0.79 C ATOM 194 OE1 GLN A 13 -0.404 -8.858 5.875 1.00 0.99 O ATOM 195 NE2 GLN A 13 0.930 -7.135 6.084 1.00 0.73 N ATOM 196 H GLN A 13 -2.272 -5.226 2.644 1.00 0.58 H ATOM 197 HA GLN A 13 -4.422 -6.857 3.877 1.00 0.69 H ATOM 198 HB2 GLN A 13 -2.849 -7.452 5.736 1.00 0.71 H ATOM 199 HB3 GLN A 13 -2.519 -8.245 4.208 1.00 0.63 H ATOM 200 HG2 GLN A 13 -0.630 -6.755 3.758 1.00 0.76 H ATOM 201 HG3 GLN A 13 -1.003 -5.824 5.217 1.00 0.82 H ATOM 202 HE21 GLN A 13 1.100 -6.148 5.933 1.00 0.60 H ATOM 203 HE22 GLN A 13 1.343 -7.616 6.848 1.00 0.93 H ATOM 204 N GLU A 14 -4.356 -5.221 6.019 1.00 0.63 N ATOM 205 CA GLU A 14 -4.655 -4.108 6.943 1.00 0.67 C ATOM 206 C GLU A 14 -3.419 -3.564 7.699 1.00 0.58 C ATOM 207 O GLU A 14 -3.527 -2.604 8.469 1.00 0.67 O ATOM 208 CB GLU A 14 -5.791 -4.524 7.896 1.00 0.88 C ATOM 209 CG GLU A 14 -5.423 -5.638 8.892 1.00 0.99 C ATOM 210 CD GLU A 14 -6.574 -5.944 9.861 1.00 1.26 C ATOM 211 OE1 GLU A 14 -7.647 -6.436 9.427 1.00 1.85 O ATOM 212 OE2 GLU A 14 -6.403 -5.703 11.082 1.00 2.11 O ATOM 213 H GLU A 14 -4.616 -6.163 6.296 1.00 0.70 H ATOM 214 HA GLU A 14 -5.033 -3.276 6.348 1.00 0.73 H ATOM 215 HB2 GLU A 14 -6.116 -3.646 8.454 1.00 0.99 H ATOM 216 HB3 GLU A 14 -6.626 -4.865 7.288 1.00 0.95 H ATOM 217 HG2 GLU A 14 -5.161 -6.545 8.346 1.00 0.96 H ATOM 218 HG3 GLU A 14 -4.544 -5.328 9.463 1.00 1.10 H ATOM 219 N SER A 15 -2.253 -4.184 7.500 1.00 0.53 N ATOM 220 CA SER A 15 -1.070 -4.073 8.370 1.00 0.48 C ATOM 221 C SER A 15 0.280 -3.934 7.641 1.00 0.56 C ATOM 222 O SER A 15 0.421 -4.318 6.477 1.00 0.96 O ATOM 223 CB SER A 15 -0.987 -5.312 9.277 1.00 0.85 C ATOM 224 OG SER A 15 -1.415 -6.474 8.579 1.00 1.24 O ATOM 225 H SER A 15 -2.276 -4.987 6.886 1.00 0.50 H ATOM 226 HA SER A 15 -1.201 -3.203 9.008 1.00 0.53 H ATOM 227 HB2 SER A 15 0.036 -5.459 9.627 1.00 0.96 H ATOM 228 HB3 SER A 15 -1.601 -5.135 10.158 1.00 1.01 H ATOM 229 HG SER A 15 -1.348 -7.253 9.166 1.00 1.49 H ATOM 230 N PRO A 16 1.328 -3.470 8.346 1.00 0.37 N ATOM 231 CA PRO A 16 2.713 -3.636 7.913 1.00 0.36 C ATOM 232 C PRO A 16 3.148 -5.109 7.956 1.00 0.39 C ATOM 233 O PRO A 16 2.670 -5.898 8.783 1.00 0.50 O ATOM 234 CB PRO A 16 3.569 -2.790 8.863 1.00 0.36 C ATOM 235 CG PRO A 16 2.568 -1.957 9.665 1.00 0.44 C ATOM 236 CD PRO A 16 1.279 -2.779 9.622 1.00 0.39 C ATOM 237 HA PRO A 16 2.819 -3.251 6.897 1.00 0.40 H ATOM 238 HB2 PRO A 16 4.136 -3.429 9.534 1.00 0.36 H ATOM 239 HB3 PRO A 16 4.260 -2.155 8.312 1.00 0.45 H ATOM 240 HG2 PRO A 16 2.907 -1.786 10.687 1.00 0.51 H ATOM 241 HG3 PRO A 16 2.411 -1.010 9.147 1.00 0.56 H ATOM 242 HD2 PRO A 16 1.232 -3.517 10.426 1.00 0.46 H ATOM 243 HD3 PRO A 16 0.419 -2.113 9.691 1.00 0.54 H ATOM 244 N ASN A 17 4.113 -5.464 7.110 1.00 0.43 N ATOM 245 CA ASN A 17 4.806 -6.750 7.105 1.00 0.51 C ATOM 246 C ASN A 17 6.303 -6.514 7.353 1.00 0.41 C ATOM 247 O ASN A 17 7.015 -6.117 6.434 1.00 0.46 O ATOM 248 CB ASN A 17 4.555 -7.438 5.751 1.00 0.69 C ATOM 249 CG ASN A 17 5.292 -8.766 5.646 1.00 0.98 C ATOM 250 OD1 ASN A 17 5.560 -9.434 6.639 1.00 1.20 O ATOM 251 ND2 ASN A 17 5.621 -9.213 4.459 1.00 1.12 N ATOM 252 H ASN A 17 4.505 -4.741 6.511 1.00 0.45 H ATOM 253 HA ASN A 17 4.425 -7.394 7.900 1.00 0.74 H ATOM 254 HB2 ASN A 17 3.497 -7.612 5.613 1.00 0.83 H ATOM 255 HB3 ASN A 17 4.857 -6.772 4.946 1.00 0.63 H ATOM 256 HD21 ASN A 17 5.368 -8.699 3.629 1.00 1.07 H ATOM 257 HD22 ASN A 17 6.184 -10.058 4.422 1.00 1.38 H ATOM 258 N GLY A 18 6.776 -6.732 8.583 1.00 0.68 N ATOM 259 CA GLY A 18 8.185 -6.584 8.955 1.00 0.92 C ATOM 260 C GLY A 18 8.789 -5.246 8.514 1.00 1.07 C ATOM 261 O GLY A 18 8.349 -4.176 8.943 1.00 1.29 O ATOM 262 H GLY A 18 6.156 -7.132 9.276 1.00 0.88 H ATOM 263 HA2 GLY A 18 8.286 -6.664 10.036 1.00 1.20 H ATOM 264 HA3 GLY A 18 8.752 -7.400 8.508 1.00 0.91 H ATOM 265 N ALA A 19 9.776 -5.297 7.623 1.00 1.13 N ATOM 266 CA ALA A 19 10.470 -4.128 7.083 1.00 1.41 C ATOM 267 C ALA A 19 9.659 -3.323 6.037 1.00 1.32 C ATOM 268 O ALA A 19 10.185 -2.347 5.496 1.00 1.87 O ATOM 269 CB ALA A 19 11.823 -4.599 6.534 1.00 1.67 C ATOM 270 H ALA A 19 10.020 -6.210 7.251 1.00 1.10 H ATOM 271 HA ALA A 19 10.670 -3.444 7.909 1.00 1.59 H ATOM 272 HB1 ALA A 19 12.375 -5.131 7.310 1.00 1.60 H ATOM 273 HB2 ALA A 19 11.674 -5.265 5.687 1.00 2.82 H ATOM 274 HB3 ALA A 19 12.413 -3.739 6.212 1.00 2.38 H ATOM 275 N LYS A 20 8.411 -3.711 5.719 1.00 0.71 N ATOM 276 CA LYS A 20 7.606 -3.115 4.644 1.00 0.68 C ATOM 277 C LYS A 20 6.232 -2.634 5.134 1.00 0.44 C ATOM 278 O LYS A 20 5.509 -3.351 5.826 1.00 0.28 O ATOM 279 CB LYS A 20 7.460 -4.109 3.474 1.00 0.78 C ATOM 280 CG LYS A 20 8.764 -4.793 3.016 1.00 1.03 C ATOM 281 CD LYS A 20 9.018 -6.154 3.691 1.00 0.82 C ATOM 282 CE LYS A 20 10.439 -6.671 3.453 1.00 0.99 C ATOM 283 NZ LYS A 20 10.692 -7.037 2.045 1.00 1.97 N ATOM 284 H LYS A 20 8.030 -4.556 6.143 1.00 0.45 H ATOM 285 HA LYS A 20 8.132 -2.241 4.256 1.00 0.89 H ATOM 286 HB2 LYS A 20 6.725 -4.875 3.732 1.00 0.69 H ATOM 287 HB3 LYS A 20 7.073 -3.543 2.626 1.00 0.85 H ATOM 288 HG2 LYS A 20 8.690 -4.969 1.947 1.00 1.44 H ATOM 289 HG3 LYS A 20 9.606 -4.123 3.190 1.00 1.26 H ATOM 290 HD2 LYS A 20 8.896 -6.059 4.765 1.00 0.74 H ATOM 291 HD3 LYS A 20 8.289 -6.885 3.337 1.00 1.05 H ATOM 292 HE2 LYS A 20 11.151 -5.903 3.763 1.00 1.64 H ATOM 293 HE3 LYS A 20 10.603 -7.544 4.092 1.00 2.08 H ATOM 294 HZ1 LYS A 20 10.579 -6.249 1.422 1.00 2.86 H ATOM 295 HZ2 LYS A 20 11.652 -7.361 1.945 1.00 2.51 H ATOM 296 HZ3 LYS A 20 10.074 -7.783 1.739 1.00 2.74 H ATOM 297 N ARG A 21 5.847 -1.423 4.724 1.00 0.52 N ATOM 298 CA ARG A 21 4.508 -0.816 4.889 1.00 0.37 C ATOM 299 C ARG A 21 4.216 0.080 3.683 1.00 0.42 C ATOM 300 O ARG A 21 5.124 0.321 2.886 1.00 0.70 O ATOM 301 CB ARG A 21 4.407 -0.116 6.274 1.00 0.47 C ATOM 302 CG ARG A 21 4.295 1.422 6.332 1.00 0.43 C ATOM 303 CD ARG A 21 4.202 1.904 7.784 1.00 0.57 C ATOM 304 NE ARG A 21 3.565 3.229 7.844 1.00 0.60 N ATOM 305 CZ ARG A 21 3.629 4.108 8.823 1.00 1.22 C ATOM 306 NH1 ARG A 21 4.237 3.880 9.949 1.00 1.95 N ATOM 307 NH2 ARG A 21 3.049 5.258 8.680 1.00 1.40 N ATOM 308 H ARG A 21 6.500 -0.912 4.145 1.00 0.78 H ATOM 309 HA ARG A 21 3.761 -1.606 4.878 1.00 0.34 H ATOM 310 HB2 ARG A 21 3.522 -0.517 6.767 1.00 0.64 H ATOM 311 HB3 ARG A 21 5.260 -0.412 6.888 1.00 0.69 H ATOM 312 HG2 ARG A 21 5.170 1.875 5.867 1.00 0.57 H ATOM 313 HG3 ARG A 21 3.397 1.763 5.808 1.00 0.49 H ATOM 314 HD2 ARG A 21 3.602 1.203 8.368 1.00 0.80 H ATOM 315 HD3 ARG A 21 5.206 1.940 8.208 1.00 0.80 H ATOM 316 HE ARG A 21 2.956 3.483 7.075 1.00 0.66 H ATOM 317 HH11 ARG A 21 4.656 2.973 10.125 1.00 1.93 H ATOM 318 HH12 ARG A 21 4.263 4.600 10.660 1.00 2.55 H ATOM 319 HH21 ARG A 21 2.670 5.531 7.791 1.00 1.06 H ATOM 320 HH22 ARG A 21 3.107 5.957 9.408 1.00 1.97 H ATOM 321 N CYS A 22 3.009 0.638 3.586 1.00 0.33 N ATOM 322 CA CYS A 22 2.770 1.859 2.815 1.00 0.45 C ATOM 323 C CYS A 22 3.548 3.061 3.418 1.00 0.78 C ATOM 324 O CYS A 22 4.766 2.991 3.544 1.00 1.60 O ATOM 325 CB CYS A 22 1.258 2.051 2.634 1.00 0.36 C ATOM 326 SG CYS A 22 0.487 0.602 1.912 1.00 0.30 S ATOM 327 H CYS A 22 2.246 0.260 4.127 1.00 0.38 H ATOM 328 HA CYS A 22 3.176 1.700 1.817 1.00 0.52 H ATOM 329 HB2 CYS A 22 0.762 2.253 3.582 1.00 0.44 H ATOM 330 HB3 CYS A 22 1.076 2.875 1.951 1.00 0.37 H ATOM 331 N GLY A 23 2.883 4.137 3.845 1.00 0.87 N ATOM 332 CA GLY A 23 3.428 5.295 4.593 1.00 1.14 C ATOM 333 C GLY A 23 4.414 6.214 3.847 1.00 1.82 C ATOM 334 O GLY A 23 4.233 7.429 3.787 1.00 2.50 O ATOM 335 H GLY A 23 1.887 4.018 3.894 1.00 1.21 H ATOM 336 HA2 GLY A 23 2.599 5.913 4.936 1.00 1.84 H ATOM 337 HA3 GLY A 23 3.943 4.912 5.473 1.00 0.73 H ATOM 338 N THR A 24 5.425 5.608 3.236 1.00 1.99 N ATOM 339 CA THR A 24 6.300 6.135 2.180 1.00 2.89 C ATOM 340 C THR A 24 6.546 5.050 1.125 1.00 2.63 C ATOM 341 O THR A 24 6.476 5.347 -0.072 1.00 3.70 O ATOM 342 CB THR A 24 7.653 6.627 2.725 1.00 3.67 C ATOM 343 OG1 THR A 24 8.279 5.626 3.497 1.00 3.54 O ATOM 344 CG2 THR A 24 7.526 7.866 3.607 1.00 4.52 C ATOM 345 H THR A 24 5.513 4.622 3.445 1.00 1.66 H ATOM 346 HA THR A 24 5.809 6.974 1.685 1.00 3.39 H ATOM 347 HB THR A 24 8.296 6.872 1.879 1.00 4.29 H ATOM 348 HG1 THR A 24 9.241 5.804 3.437 1.00 4.15 H ATOM 349 HG21 THR A 24 6.962 7.632 4.510 1.00 4.58 H ATOM 350 HG22 THR A 24 8.519 8.216 3.891 1.00 4.80 H ATOM 351 HG23 THR A 24 7.015 8.658 3.059 1.00 5.45 H ATOM 352 N CYS A 25 6.741 3.789 1.552 1.00 1.49 N ATOM 353 CA CYS A 25 7.054 2.622 0.716 1.00 1.13 C ATOM 354 C CYS A 25 8.265 2.953 -0.179 1.00 0.98 C ATOM 355 O CYS A 25 9.171 3.676 0.250 1.00 2.09 O ATOM 356 CB CYS A 25 5.737 2.169 0.042 1.00 1.10 C ATOM 357 SG CYS A 25 5.760 0.846 -1.191 1.00 0.66 S ATOM 358 H CYS A 25 6.831 3.652 2.552 1.00 1.45 H ATOM 359 HA CYS A 25 7.383 1.805 1.359 1.00 1.46 H ATOM 360 HB2 CYS A 25 5.067 1.844 0.839 1.00 1.79 H ATOM 361 HB3 CYS A 25 5.245 3.032 -0.405 1.00 1.68 H ATOM 362 N ARG A 26 8.257 2.515 -1.435 1.00 1.19 N ATOM 363 CA ARG A 26 8.646 3.417 -2.538 1.00 1.46 C ATOM 364 C ARG A 26 7.425 4.166 -3.090 1.00 1.05 C ATOM 365 O ARG A 26 7.571 5.207 -3.723 1.00 1.39 O ATOM 366 CB ARG A 26 9.410 2.614 -3.608 1.00 2.07 C ATOM 367 CG ARG A 26 9.820 3.456 -4.829 1.00 3.43 C ATOM 368 CD ARG A 26 10.694 2.656 -5.796 1.00 4.36 C ATOM 369 NE ARG A 26 11.276 3.526 -6.834 1.00 5.66 N ATOM 370 CZ ARG A 26 12.388 3.317 -7.509 1.00 6.85 C ATOM 371 NH1 ARG A 26 13.099 2.234 -7.423 1.00 7.31 N ATOM 372 NH2 ARG A 26 12.828 4.235 -8.309 1.00 7.99 N ATOM 373 H ARG A 26 7.613 1.754 -1.638 1.00 1.95 H ATOM 374 HA ARG A 26 9.324 4.187 -2.163 1.00 1.88 H ATOM 375 HB2 ARG A 26 10.312 2.209 -3.145 1.00 2.23 H ATOM 376 HB3 ARG A 26 8.801 1.776 -3.939 1.00 3.04 H ATOM 377 HG2 ARG A 26 8.935 3.787 -5.370 1.00 4.68 H ATOM 378 HG3 ARG A 26 10.373 4.329 -4.485 1.00 3.75 H ATOM 379 HD2 ARG A 26 11.495 2.195 -5.222 1.00 4.25 H ATOM 380 HD3 ARG A 26 10.100 1.870 -6.264 1.00 4.85 H ATOM 381 HE ARG A 26 10.835 4.418 -7.015 1.00 5.93 H ATOM 382 HH11 ARG A 26 12.791 1.468 -6.829 1.00 6.79 H ATOM 383 HH12 ARG A 26 13.968 2.186 -7.934 1.00 8.41 H ATOM 384 HH21 ARG A 26 12.298 5.098 -8.381 1.00 8.04 H ATOM 385 HH22 ARG A 26 13.711 4.090 -8.779 1.00 8.94 H ATOM 386 N GLN A 27 6.221 3.639 -2.865 1.00 0.68 N ATOM 387 CA GLN A 27 5.061 3.885 -3.721 1.00 0.93 C ATOM 388 C GLN A 27 3.864 4.547 -3.013 1.00 0.96 C ATOM 389 O GLN A 27 2.849 4.764 -3.664 1.00 1.90 O ATOM 390 CB GLN A 27 4.662 2.532 -4.339 1.00 1.47 C ATOM 391 CG GLN A 27 5.753 1.861 -5.197 1.00 2.08 C ATOM 392 CD GLN A 27 5.825 2.390 -6.623 1.00 2.24 C ATOM 393 OE1 GLN A 27 6.650 3.227 -6.973 1.00 2.26 O ATOM 394 NE2 GLN A 27 4.973 1.895 -7.489 1.00 3.21 N ATOM 395 H GLN A 27 6.179 2.805 -2.293 1.00 0.69 H ATOM 396 HA GLN A 27 5.342 4.554 -4.536 1.00 1.17 H ATOM 397 HB2 GLN A 27 4.426 1.863 -3.514 1.00 1.86 H ATOM 398 HB3 GLN A 27 3.758 2.646 -4.940 1.00 1.74 H ATOM 399 HG2 GLN A 27 6.730 1.959 -4.735 1.00 2.42 H ATOM 400 HG3 GLN A 27 5.546 0.793 -5.241 1.00 2.83 H ATOM 401 HE21 GLN A 27 4.270 1.236 -7.176 1.00 3.78 H ATOM 402 HE22 GLN A 27 5.055 2.138 -8.473 1.00 3.67 H ATOM 403 N PHE A 28 3.926 4.901 -1.723 1.00 0.65 N ATOM 404 CA PHE A 28 2.754 5.486 -1.053 1.00 0.59 C ATOM 405 C PHE A 28 2.515 6.938 -1.486 1.00 0.60 C ATOM 406 O PHE A 28 3.469 7.673 -1.754 1.00 0.82 O ATOM 407 CB PHE A 28 2.850 5.389 0.474 1.00 0.58 C ATOM 408 CG PHE A 28 1.553 5.768 1.176 1.00 0.56 C ATOM 409 CD1 PHE A 28 0.378 5.032 0.935 1.00 1.86 C ATOM 410 CD2 PHE A 28 1.501 6.874 2.045 1.00 1.52 C ATOM 411 CE1 PHE A 28 -0.821 5.371 1.586 1.00 2.05 C ATOM 412 CE2 PHE A 28 0.304 7.207 2.705 1.00 1.46 C ATOM 413 CZ PHE A 28 -0.860 6.459 2.470 1.00 0.95 C ATOM 414 H PHE A 28 4.803 4.832 -1.226 1.00 1.30 H ATOM 415 HA PHE A 28 1.881 4.907 -1.362 1.00 0.59 H ATOM 416 HB2 PHE A 28 3.108 4.369 0.754 1.00 0.73 H ATOM 417 HB3 PHE A 28 3.654 6.042 0.815 1.00 0.58 H ATOM 418 HD1 PHE A 28 0.392 4.192 0.251 1.00 2.98 H ATOM 419 HD2 PHE A 28 2.381 7.476 2.203 1.00 2.73 H ATOM 420 HE1 PHE A 28 -1.714 4.790 1.406 1.00 3.29 H ATOM 421 HE2 PHE A 28 0.274 8.042 3.391 1.00 2.55 H ATOM 422 HZ PHE A 28 -1.783 6.714 2.971 1.00 1.16 H ATOM 423 N ARG A 29 1.251 7.374 -1.512 1.00 0.50 N ATOM 424 CA ARG A 29 0.857 8.732 -1.905 1.00 0.57 C ATOM 425 C ARG A 29 -0.218 9.281 -0.944 1.00 0.58 C ATOM 426 O ARG A 29 -1.409 9.052 -1.163 1.00 0.60 O ATOM 427 CB ARG A 29 0.444 8.670 -3.391 1.00 0.66 C ATOM 428 CG ARG A 29 0.159 10.026 -4.041 1.00 0.89 C ATOM 429 CD ARG A 29 1.384 10.942 -3.958 1.00 1.16 C ATOM 430 NE ARG A 29 1.208 12.186 -4.722 1.00 1.38 N ATOM 431 CZ ARG A 29 1.945 13.275 -4.598 1.00 1.92 C ATOM 432 NH1 ARG A 29 2.933 13.379 -3.755 1.00 2.45 N ATOM 433 NH2 ARG A 29 1.724 14.315 -5.340 1.00 2.19 N ATOM 434 H ARG A 29 0.503 6.716 -1.299 1.00 0.49 H ATOM 435 HA ARG A 29 1.731 9.377 -1.833 1.00 0.68 H ATOM 436 HB2 ARG A 29 1.246 8.193 -3.957 1.00 0.75 H ATOM 437 HB3 ARG A 29 -0.439 8.047 -3.500 1.00 0.61 H ATOM 438 HG2 ARG A 29 -0.095 9.853 -5.085 1.00 1.06 H ATOM 439 HG3 ARG A 29 -0.691 10.490 -3.542 1.00 0.83 H ATOM 440 HD2 ARG A 29 1.555 11.179 -2.910 1.00 1.15 H ATOM 441 HD3 ARG A 29 2.257 10.411 -4.345 1.00 1.44 H ATOM 442 HE ARG A 29 0.560 12.164 -5.499 1.00 1.46 H ATOM 443 HH11 ARG A 29 3.193 12.592 -3.167 1.00 2.41 H ATOM 444 HH12 ARG A 29 3.510 14.209 -3.768 1.00 2.97 H ATOM 445 HH21 ARG A 29 1.012 14.297 -6.064 1.00 2.10 H ATOM 446 HH22 ARG A 29 2.356 15.096 -5.262 1.00 2.69 H ATOM 447 N PRO A 30 0.168 9.983 0.143 1.00 0.80 N ATOM 448 CA PRO A 30 -0.766 10.431 1.181 1.00 0.93 C ATOM 449 C PRO A 30 -1.884 11.355 0.655 1.00 0.91 C ATOM 450 O PRO A 30 -1.644 12.095 -0.305 1.00 0.96 O ATOM 451 CB PRO A 30 0.087 11.165 2.225 1.00 1.22 C ATOM 452 CG PRO A 30 1.500 10.630 2.017 1.00 1.64 C ATOM 453 CD PRO A 30 1.538 10.303 0.525 1.00 1.05 C ATOM 454 HA PRO A 30 -1.199 9.541 1.635 1.00 0.92 H ATOM 455 HB2 PRO A 30 0.080 12.238 2.026 1.00 1.25 H ATOM 456 HB3 PRO A 30 -0.267 10.970 3.237 1.00 1.49 H ATOM 457 HG2 PRO A 30 2.253 11.369 2.289 1.00 2.17 H ATOM 458 HG3 PRO A 30 1.643 9.724 2.602 1.00 2.17 H ATOM 459 HD2 PRO A 30 1.868 11.179 -0.034 1.00 1.18 H ATOM 460 HD3 PRO A 30 2.217 9.467 0.351 1.00 0.94 H ATOM 461 N PRO A 31 -3.074 11.391 1.292 1.00 0.93 N ATOM 462 CA PRO A 31 -3.446 10.624 2.484 1.00 1.04 C ATOM 463 C PRO A 31 -3.892 9.176 2.216 1.00 0.96 C ATOM 464 O PRO A 31 -3.776 8.357 3.127 1.00 1.14 O ATOM 465 CB PRO A 31 -4.574 11.433 3.137 1.00 1.20 C ATOM 466 CG PRO A 31 -5.258 12.106 1.950 1.00 1.06 C ATOM 467 CD PRO A 31 -4.087 12.404 1.018 1.00 1.02 C ATOM 468 HA PRO A 31 -2.613 10.590 3.186 1.00 1.20 H ATOM 469 HB2 PRO A 31 -5.265 10.806 3.702 1.00 1.28 H ATOM 470 HB3 PRO A 31 -4.143 12.197 3.787 1.00 1.42 H ATOM 471 HG2 PRO A 31 -5.946 11.406 1.471 1.00 0.95 H ATOM 472 HG3 PRO A 31 -5.776 13.018 2.246 1.00 1.21 H ATOM 473 HD2 PRO A 31 -4.417 12.376 -0.018 1.00 0.95 H ATOM 474 HD3 PRO A 31 -3.680 13.390 1.248 1.00 1.24 H ATOM 475 N SER A 32 -4.392 8.823 1.024 1.00 0.84 N ATOM 476 CA SER A 32 -4.973 7.485 0.778 1.00 0.95 C ATOM 477 C SER A 32 -4.781 6.918 -0.640 1.00 0.90 C ATOM 478 O SER A 32 -5.533 6.036 -1.050 1.00 1.13 O ATOM 479 CB SER A 32 -6.440 7.438 1.256 1.00 1.21 C ATOM 480 OG SER A 32 -7.306 8.343 0.588 1.00 1.54 O ATOM 481 H SER A 32 -4.496 9.523 0.296 1.00 0.80 H ATOM 482 HA SER A 32 -4.432 6.779 1.406 1.00 0.99 H ATOM 483 HB2 SER A 32 -6.827 6.425 1.145 1.00 1.73 H ATOM 484 HB3 SER A 32 -6.457 7.674 2.321 1.00 1.56 H ATOM 485 HG SER A 32 -8.106 8.425 1.153 1.00 1.75 H ATOM 486 N SER A 33 -3.761 7.362 -1.381 1.00 0.76 N ATOM 487 CA SER A 33 -3.414 6.877 -2.731 1.00 0.79 C ATOM 488 C SER A 33 -2.086 6.102 -2.769 1.00 0.65 C ATOM 489 O SER A 33 -1.334 6.066 -1.792 1.00 0.52 O ATOM 490 CB SER A 33 -3.372 8.053 -3.715 1.00 0.86 C ATOM 491 OG SER A 33 -4.621 8.713 -3.780 1.00 1.01 O ATOM 492 H SER A 33 -3.129 8.045 -0.978 1.00 0.73 H ATOM 493 HA SER A 33 -4.180 6.186 -3.079 1.00 0.94 H ATOM 494 HB2 SER A 33 -2.610 8.769 -3.406 1.00 0.80 H ATOM 495 HB3 SER A 33 -3.121 7.685 -4.711 1.00 0.94 H ATOM 496 HG SER A 33 -4.736 9.207 -2.940 1.00 1.24 H ATOM 497 N CYS A 34 -1.772 5.491 -3.916 1.00 0.73 N ATOM 498 CA CYS A 34 -0.500 4.805 -4.169 1.00 0.61 C ATOM 499 C CYS A 34 -0.044 4.936 -5.634 1.00 0.76 C ATOM 500 O CYS A 34 -0.804 5.346 -6.515 1.00 0.97 O ATOM 501 CB CYS A 34 -0.673 3.350 -3.723 1.00 0.46 C ATOM 502 SG CYS A 34 0.722 2.259 -4.016 1.00 0.44 S ATOM 503 H CYS A 34 -2.426 5.531 -4.689 1.00 0.90 H ATOM 504 HA CYS A 34 0.287 5.249 -3.558 1.00 0.60 H ATOM 505 HB2 CYS A 34 -0.868 3.346 -2.654 1.00 0.51 H ATOM 506 HB3 CYS A 34 -1.555 2.935 -4.207 1.00 0.44 H ATOM 507 N ILE A 35 1.222 4.609 -5.882 1.00 0.74 N ATOM 508 CA ILE A 35 1.890 4.559 -7.193 1.00 0.97 C ATOM 509 C ILE A 35 1.939 3.112 -7.729 1.00 0.93 C ATOM 510 O ILE A 35 2.156 2.901 -8.920 1.00 1.25 O ATOM 511 CB ILE A 35 3.284 5.240 -7.108 1.00 1.25 C ATOM 512 CG1 ILE A 35 3.267 6.647 -6.453 1.00 1.44 C ATOM 513 CG2 ILE A 35 3.961 5.349 -8.488 1.00 1.55 C ATOM 514 CD1 ILE A 35 2.355 7.688 -7.114 1.00 1.74 C ATOM 515 H ILE A 35 1.762 4.323 -5.070 1.00 0.66 H ATOM 516 HA ILE A 35 1.296 5.128 -7.908 1.00 1.10 H ATOM 517 HB ILE A 35 3.921 4.612 -6.485 1.00 1.34 H ATOM 518 HG12 ILE A 35 2.964 6.561 -5.412 1.00 2.56 H ATOM 519 HG13 ILE A 35 4.284 7.041 -6.444 1.00 2.55 H ATOM 520 HG21 ILE A 35 4.219 4.360 -8.865 1.00 2.50 H ATOM 521 HG22 ILE A 35 3.299 5.839 -9.202 1.00 1.59 H ATOM 522 HG23 ILE A 35 4.887 5.920 -8.410 1.00 2.40 H ATOM 523 HD11 ILE A 35 1.316 7.364 -7.071 1.00 2.93 H ATOM 524 HD12 ILE A 35 2.443 8.634 -6.579 1.00 2.30 H ATOM 525 HD13 ILE A 35 2.648 7.845 -8.150 1.00 2.48 H ATOM 526 N THR A 36 1.655 2.103 -6.896 1.00 0.71 N ATOM 527 CA THR A 36 1.349 0.732 -7.351 1.00 0.79 C ATOM 528 C THR A 36 -0.160 0.507 -7.476 1.00 0.68 C ATOM 529 O THR A 36 -0.597 -0.121 -8.446 1.00 0.95 O ATOM 530 CB THR A 36 1.914 -0.322 -6.388 1.00 1.06 C ATOM 531 OG1 THR A 36 3.292 -0.131 -6.162 1.00 1.35 O ATOM 532 CG2 THR A 36 1.766 -1.750 -6.904 1.00 2.08 C ATOM 533 H THR A 36 1.499 2.317 -5.914 1.00 0.61 H ATOM 534 HA THR A 36 1.795 0.559 -8.331 1.00 0.99 H ATOM 535 HB THR A 36 1.397 -0.234 -5.435 1.00 1.00 H ATOM 536 HG1 THR A 36 3.355 -0.162 -5.189 1.00 1.35 H ATOM 537 HG21 THR A 36 2.223 -2.431 -6.189 1.00 3.19 H ATOM 538 HG22 THR A 36 0.714 -2.017 -6.990 1.00 2.98 H ATOM 539 HG23 THR A 36 2.242 -1.857 -7.878 1.00 2.19 H ATOM 540 N VAL A 37 -0.944 1.005 -6.508 1.00 0.54 N ATOM 541 CA VAL A 37 -2.356 0.622 -6.314 1.00 0.62 C ATOM 542 C VAL A 37 -3.338 1.800 -6.247 1.00 0.63 C ATOM 543 O VAL A 37 -2.959 2.967 -6.161 1.00 0.67 O ATOM 544 CB VAL A 37 -2.543 -0.320 -5.101 1.00 0.73 C ATOM 545 CG1 VAL A 37 -1.588 -1.515 -5.150 1.00 1.99 C ATOM 546 CG2 VAL A 37 -2.378 0.344 -3.734 1.00 1.82 C ATOM 547 H VAL A 37 -0.502 1.520 -5.753 1.00 0.54 H ATOM 548 HA VAL A 37 -2.656 0.042 -7.184 1.00 0.79 H ATOM 549 HB VAL A 37 -3.556 -0.716 -5.148 1.00 2.00 H ATOM 550 HG11 VAL A 37 -0.560 -1.187 -5.018 1.00 2.81 H ATOM 551 HG12 VAL A 37 -1.806 -2.194 -4.329 1.00 1.84 H ATOM 552 HG13 VAL A 37 -1.697 -2.032 -6.102 1.00 3.23 H ATOM 553 HG21 VAL A 37 -3.055 1.190 -3.631 1.00 2.95 H ATOM 554 HG22 VAL A 37 -2.598 -0.374 -2.945 1.00 1.87 H ATOM 555 HG23 VAL A 37 -1.350 0.671 -3.601 1.00 2.58 H ATOM 556 N GLU A 38 -4.625 1.473 -6.310 1.00 0.70 N ATOM 557 CA GLU A 38 -5.773 2.380 -6.179 1.00 0.78 C ATOM 558 C GLU A 38 -5.964 3.065 -4.808 1.00 0.71 C ATOM 559 O GLU A 38 -5.362 2.684 -3.809 1.00 0.82 O ATOM 560 CB GLU A 38 -7.034 1.565 -6.517 1.00 0.99 C ATOM 561 CG GLU A 38 -7.308 1.510 -8.020 1.00 1.29 C ATOM 562 CD GLU A 38 -7.883 2.833 -8.538 1.00 2.59 C ATOM 563 OE1 GLU A 38 -7.170 3.865 -8.567 1.00 4.14 O ATOM 564 OE2 GLU A 38 -9.079 2.877 -8.905 1.00 2.86 O ATOM 565 H GLU A 38 -4.829 0.507 -6.533 1.00 0.73 H ATOM 566 HA GLU A 38 -5.643 3.182 -6.901 1.00 0.91 H ATOM 567 HB2 GLU A 38 -6.919 0.547 -6.142 1.00 0.96 H ATOM 568 HB3 GLU A 38 -7.897 1.991 -6.012 1.00 1.08 H ATOM 569 HG2 GLU A 38 -6.378 1.268 -8.533 1.00 1.51 H ATOM 570 HG3 GLU A 38 -8.020 0.704 -8.212 1.00 1.66 H ATOM 571 N SER A 39 -6.879 4.043 -4.763 1.00 0.71 N ATOM 572 CA SER A 39 -7.369 4.751 -3.565 1.00 0.79 C ATOM 573 C SER A 39 -8.854 4.441 -3.271 1.00 0.99 C ATOM 574 O SER A 39 -9.604 4.162 -4.215 1.00 1.16 O ATOM 575 CB SER A 39 -7.192 6.268 -3.750 1.00 0.92 C ATOM 576 OG SER A 39 -7.899 6.743 -4.889 1.00 1.51 O ATOM 577 H SER A 39 -7.333 4.288 -5.631 1.00 0.77 H ATOM 578 HA SER A 39 -6.769 4.442 -2.709 1.00 0.76 H ATOM 579 HB2 SER A 39 -7.548 6.789 -2.862 1.00 1.62 H ATOM 580 HB3 SER A 39 -6.134 6.490 -3.879 1.00 1.35 H ATOM 581 HG SER A 39 -7.353 6.498 -5.668 1.00 2.22 H ATOM 582 N PRO A 40 -9.337 4.514 -2.011 1.00 1.03 N ATOM 583 CA PRO A 40 -8.594 4.809 -0.781 1.00 0.89 C ATOM 584 C PRO A 40 -7.917 3.572 -0.153 1.00 0.84 C ATOM 585 O PRO A 40 -8.557 2.535 0.050 1.00 1.24 O ATOM 586 CB PRO A 40 -9.634 5.416 0.167 1.00 1.06 C ATOM 587 CG PRO A 40 -10.928 4.705 -0.224 1.00 1.40 C ATOM 588 CD PRO A 40 -10.771 4.514 -1.732 1.00 1.31 C ATOM 589 HA PRO A 40 -7.846 5.571 -0.973 1.00 0.83 H ATOM 590 HB2 PRO A 40 -9.384 5.257 1.218 1.00 1.08 H ATOM 591 HB3 PRO A 40 -9.733 6.483 -0.039 1.00 1.22 H ATOM 592 HG2 PRO A 40 -10.982 3.731 0.267 1.00 1.56 H ATOM 593 HG3 PRO A 40 -11.808 5.301 0.018 1.00 1.77 H ATOM 594 HD2 PRO A 40 -11.240 3.582 -2.049 1.00 1.41 H ATOM 595 HD3 PRO A 40 -11.237 5.353 -2.253 1.00 1.46 H ATOM 596 N ILE A 41 -6.646 3.711 0.238 1.00 0.59 N ATOM 597 CA ILE A 41 -5.863 2.741 1.030 1.00 0.73 C ATOM 598 C ILE A 41 -5.333 3.339 2.348 1.00 0.68 C ATOM 599 O ILE A 41 -5.385 4.553 2.579 1.00 0.75 O ATOM 600 CB ILE A 41 -4.698 2.135 0.212 1.00 0.98 C ATOM 601 CG1 ILE A 41 -3.726 3.206 -0.327 1.00 1.86 C ATOM 602 CG2 ILE A 41 -5.206 1.208 -0.898 1.00 3.23 C ATOM 603 CD1 ILE A 41 -2.304 2.658 -0.467 1.00 2.86 C ATOM 604 H ILE A 41 -6.177 4.574 -0.019 1.00 0.64 H ATOM 605 HA ILE A 41 -6.513 1.912 1.313 1.00 0.93 H ATOM 606 HB ILE A 41 -4.136 1.495 0.887 1.00 2.65 H ATOM 607 HG12 ILE A 41 -4.075 3.580 -1.290 1.00 2.75 H ATOM 608 HG13 ILE A 41 -3.678 4.046 0.363 1.00 3.06 H ATOM 609 HG21 ILE A 41 -5.748 0.368 -0.466 1.00 4.47 H ATOM 610 HG22 ILE A 41 -5.868 1.751 -1.567 1.00 3.94 H ATOM 611 HG23 ILE A 41 -4.356 0.824 -1.466 1.00 3.94 H ATOM 612 HD11 ILE A 41 -2.260 1.900 -1.247 1.00 2.99 H ATOM 613 HD12 ILE A 41 -1.639 3.481 -0.718 1.00 4.38 H ATOM 614 HD13 ILE A 41 -1.969 2.228 0.477 1.00 3.18 H ATOM 615 N SER A 42 -4.799 2.479 3.219 1.00 0.69 N ATOM 616 CA SER A 42 -4.207 2.856 4.507 1.00 0.72 C ATOM 617 C SER A 42 -2.723 3.210 4.395 1.00 0.63 C ATOM 618 O SER A 42 -2.003 2.668 3.558 1.00 0.58 O ATOM 619 CB SER A 42 -4.376 1.711 5.501 1.00 0.81 C ATOM 620 OG SER A 42 -4.343 2.223 6.817 1.00 1.09 O ATOM 621 H SER A 42 -4.678 1.517 2.924 1.00 0.78 H ATOM 622 HA SER A 42 -4.744 3.717 4.903 1.00 0.83 H ATOM 623 HB2 SER A 42 -5.337 1.242 5.330 1.00 0.92 H ATOM 624 HB3 SER A 42 -3.592 0.966 5.358 1.00 0.82 H ATOM 625 HG SER A 42 -3.836 1.594 7.372 1.00 0.99 H ATOM 626 N GLU A 43 -2.218 4.046 5.300 1.00 0.71 N ATOM 627 CA GLU A 43 -0.800 4.430 5.355 1.00 0.65 C ATOM 628 C GLU A 43 0.116 3.383 6.017 1.00 0.55 C ATOM 629 O GLU A 43 1.325 3.588 6.120 1.00 0.62 O ATOM 630 CB GLU A 43 -0.648 5.816 5.990 1.00 0.78 C ATOM 631 CG GLU A 43 -1.023 5.846 7.472 1.00 0.85 C ATOM 632 CD GLU A 43 -0.821 7.232 8.106 1.00 1.38 C ATOM 633 OE1 GLU A 43 -0.156 7.324 9.169 1.00 2.08 O ATOM 634 OE2 GLU A 43 -1.321 8.241 7.549 1.00 2.60 O ATOM 635 H GLU A 43 -2.846 4.435 5.989 1.00 0.87 H ATOM 636 HA GLU A 43 -0.447 4.520 4.327 1.00 0.65 H ATOM 637 HB2 GLU A 43 0.386 6.119 5.865 1.00 0.80 H ATOM 638 HB3 GLU A 43 -1.282 6.522 5.463 1.00 0.89 H ATOM 639 HG2 GLU A 43 -2.065 5.538 7.557 1.00 1.20 H ATOM 640 HG3 GLU A 43 -0.411 5.116 7.994 1.00 0.75 H ATOM 641 N ASN A 44 -0.434 2.253 6.460 1.00 0.53 N ATOM 642 CA ASN A 44 0.298 1.122 7.044 1.00 0.54 C ATOM 643 C ASN A 44 0.130 -0.203 6.268 1.00 0.64 C ATOM 644 O ASN A 44 1.020 -1.049 6.331 1.00 1.45 O ATOM 645 CB ASN A 44 -0.101 0.998 8.530 1.00 0.68 C ATOM 646 CG ASN A 44 -1.577 0.843 8.808 1.00 1.08 C ATOM 647 OD1 ASN A 44 -2.419 0.705 7.931 1.00 1.77 O ATOM 648 ND2 ASN A 44 -1.928 0.951 10.060 1.00 1.43 N ATOM 649 H ASN A 44 -1.442 2.194 6.423 1.00 0.62 H ATOM 650 HA ASN A 44 1.364 1.338 7.021 1.00 0.58 H ATOM 651 HB2 ASN A 44 0.423 0.161 8.981 1.00 1.07 H ATOM 652 HB3 ASN A 44 0.181 1.900 9.068 1.00 0.98 H ATOM 653 HD21 ASN A 44 -1.225 1.092 10.778 1.00 1.71 H ATOM 654 HD22 ASN A 44 -2.906 1.095 10.238 1.00 1.75 H ATOM 655 N GLY A 45 -0.971 -0.383 5.535 1.00 0.69 N ATOM 656 CA GLY A 45 -1.391 -1.650 4.927 1.00 0.78 C ATOM 657 C GLY A 45 -0.669 -2.073 3.652 1.00 0.93 C ATOM 658 O GLY A 45 -1.246 -1.988 2.570 1.00 2.14 O ATOM 659 H GLY A 45 -1.632 0.375 5.493 1.00 1.33 H ATOM 660 HA2 GLY A 45 -1.213 -2.446 5.636 1.00 0.99 H ATOM 661 HA3 GLY A 45 -2.456 -1.611 4.728 1.00 1.28 H ATOM 662 N TRP A 46 0.561 -2.562 3.820 1.00 0.58 N ATOM 663 CA TRP A 46 1.438 -3.102 2.776 1.00 0.44 C ATOM 664 C TRP A 46 0.712 -3.951 1.719 1.00 0.40 C ATOM 665 O TRP A 46 -0.093 -4.822 2.067 1.00 0.38 O ATOM 666 CB TRP A 46 2.476 -3.991 3.473 1.00 0.47 C ATOM 667 CG TRP A 46 3.476 -4.686 2.602 1.00 0.51 C ATOM 668 CD1 TRP A 46 4.454 -4.087 1.887 1.00 0.64 C ATOM 669 CD2 TRP A 46 3.594 -6.116 2.314 1.00 0.55 C ATOM 670 NE1 TRP A 46 5.202 -5.045 1.234 1.00 0.68 N ATOM 671 CE2 TRP A 46 4.730 -6.316 1.475 1.00 0.61 C ATOM 672 CE3 TRP A 46 2.849 -7.265 2.662 1.00 0.66 C ATOM 673 CZ2 TRP A 46 5.133 -7.589 1.043 1.00 0.71 C ATOM 674 CZ3 TRP A 46 3.225 -8.543 2.206 1.00 0.82 C ATOM 675 CH2 TRP A 46 4.370 -8.709 1.408 1.00 0.82 C ATOM 676 H TRP A 46 0.892 -2.609 4.775 1.00 1.40 H ATOM 677 HA TRP A 46 1.938 -2.276 2.274 1.00 0.50 H ATOM 678 HB2 TRP A 46 3.021 -3.408 4.209 1.00 0.53 H ATOM 679 HB3 TRP A 46 1.934 -4.756 4.025 1.00 0.48 H ATOM 680 HD1 TRP A 46 4.620 -3.016 1.824 1.00 0.76 H ATOM 681 HE1 TRP A 46 5.920 -4.814 0.555 1.00 0.81 H ATOM 682 HE3 TRP A 46 1.960 -7.148 3.264 1.00 0.69 H ATOM 683 HZ2 TRP A 46 6.004 -7.700 0.416 1.00 0.77 H ATOM 684 HZ3 TRP A 46 2.625 -9.405 2.459 1.00 0.97 H ATOM 685 HH2 TRP A 46 4.650 -9.693 1.058 1.00 0.96 H ATOM 686 N CYS A 47 1.070 -3.767 0.444 1.00 0.53 N ATOM 687 CA CYS A 47 0.732 -4.683 -0.642 1.00 0.49 C ATOM 688 C CYS A 47 1.921 -5.559 -1.029 1.00 0.52 C ATOM 689 O CYS A 47 3.079 -5.142 -1.021 1.00 0.50 O ATOM 690 CB CYS A 47 0.148 -3.909 -1.829 1.00 0.43 C ATOM 691 SG CYS A 47 1.424 -3.155 -2.842 1.00 0.37 S ATOM 692 H CYS A 47 1.744 -3.040 0.229 1.00 0.63 H ATOM 693 HA CYS A 47 -0.023 -5.373 -0.294 1.00 0.62 H ATOM 694 HB2 CYS A 47 -0.431 -4.580 -2.465 1.00 0.45 H ATOM 695 HB3 CYS A 47 -0.513 -3.116 -1.468 1.00 0.52 H ATOM 696 N ARG A 48 1.640 -6.797 -1.433 1.00 0.77 N ATOM 697 CA ARG A 48 2.676 -7.720 -1.901 1.00 0.96 C ATOM 698 C ARG A 48 3.342 -7.241 -3.200 1.00 0.97 C ATOM 699 O ARG A 48 4.465 -7.660 -3.489 1.00 1.18 O ATOM 700 CB ARG A 48 2.075 -9.137 -1.958 1.00 1.24 C ATOM 701 CG ARG A 48 3.147 -10.219 -2.042 1.00 1.33 C ATOM 702 CD ARG A 48 3.418 -10.695 -3.476 1.00 2.22 C ATOM 703 NE ARG A 48 4.618 -11.547 -3.545 1.00 2.89 N ATOM 704 CZ ARG A 48 5.869 -11.152 -3.676 1.00 4.09 C ATOM 705 NH1 ARG A 48 6.216 -9.896 -3.689 1.00 5.21 N ATOM 706 NH2 ARG A 48 6.789 -12.055 -3.789 1.00 4.78 N ATOM 707 H ARG A 48 0.670 -7.083 -1.480 1.00 0.90 H ATOM 708 HA ARG A 48 3.464 -7.712 -1.146 1.00 1.01 H ATOM 709 HB2 ARG A 48 1.551 -9.309 -1.020 1.00 2.52 H ATOM 710 HB3 ARG A 48 1.366 -9.227 -2.781 1.00 1.92 H ATOM 711 HG2 ARG A 48 4.041 -9.804 -1.583 1.00 1.58 H ATOM 712 HG3 ARG A 48 2.832 -11.081 -1.452 1.00 2.31 H ATOM 713 HD2 ARG A 48 2.557 -11.268 -3.822 1.00 2.65 H ATOM 714 HD3 ARG A 48 3.532 -9.846 -4.148 1.00 3.03 H ATOM 715 HE ARG A 48 4.482 -12.551 -3.585 1.00 3.16 H ATOM 716 HH11 ARG A 48 5.500 -9.184 -3.635 1.00 5.12 H ATOM 717 HH12 ARG A 48 7.182 -9.621 -3.818 1.00 6.47 H ATOM 718 HH21 ARG A 48 6.490 -13.025 -3.830 1.00 4.59 H ATOM 719 HH22 ARG A 48 7.758 -11.811 -3.962 1.00 5.85 H ATOM 720 N LEU A 49 2.712 -6.322 -3.937 1.00 0.92 N ATOM 721 CA LEU A 49 3.209 -5.721 -5.182 1.00 1.01 C ATOM 722 C LEU A 49 4.043 -4.431 -4.972 1.00 0.99 C ATOM 723 O LEU A 49 4.440 -3.797 -5.954 1.00 1.20 O ATOM 724 CB LEU A 49 2.011 -5.540 -6.134 1.00 1.18 C ATOM 725 CG LEU A 49 2.327 -5.481 -7.641 1.00 1.15 C ATOM 726 CD1 LEU A 49 2.961 -6.779 -8.145 1.00 2.09 C ATOM 727 CD2 LEU A 49 1.024 -5.266 -8.415 1.00 1.90 C ATOM 728 H LEU A 49 1.806 -6.012 -3.605 1.00 0.94 H ATOM 729 HA LEU A 49 3.885 -6.444 -5.632 1.00 1.15 H ATOM 730 HB2 LEU A 49 1.323 -6.372 -5.981 1.00 1.78 H ATOM 731 HB3 LEU A 49 1.499 -4.624 -5.849 1.00 1.70 H ATOM 732 HG LEU A 49 2.992 -4.648 -7.859 1.00 2.01 H ATOM 733 HD11 LEU A 49 2.348 -7.631 -7.853 1.00 2.91 H ATOM 734 HD12 LEU A 49 3.040 -6.759 -9.230 1.00 2.37 H ATOM 735 HD13 LEU A 49 3.965 -6.891 -7.739 1.00 2.95 H ATOM 736 HD21 LEU A 49 0.346 -6.104 -8.254 1.00 2.71 H ATOM 737 HD22 LEU A 49 0.546 -4.344 -8.086 1.00 2.87 H ATOM 738 HD23 LEU A 49 1.240 -5.183 -9.480 1.00 2.69 H ATOM 739 N TYR A 50 4.354 -4.062 -3.721 1.00 0.94 N ATOM 740 CA TYR A 50 5.263 -2.962 -3.351 1.00 0.93 C ATOM 741 C TYR A 50 6.612 -2.977 -4.103 1.00 1.25 C ATOM 742 O TYR A 50 7.006 -3.984 -4.703 1.00 1.79 O ATOM 743 CB TYR A 50 5.544 -3.008 -1.835 1.00 1.18 C ATOM 744 CG TYR A 50 6.656 -3.971 -1.436 1.00 1.53 C ATOM 745 CD1 TYR A 50 6.508 -5.357 -1.637 1.00 3.03 C ATOM 746 CD2 TYR A 50 7.877 -3.466 -0.947 1.00 1.94 C ATOM 747 CE1 TYR A 50 7.587 -6.234 -1.406 1.00 3.77 C ATOM 748 CE2 TYR A 50 8.956 -4.339 -0.700 1.00 2.66 C ATOM 749 CZ TYR A 50 8.818 -5.722 -0.944 1.00 3.27 C ATOM 750 OH TYR A 50 9.868 -6.557 -0.713 1.00 4.22 O ATOM 751 H TYR A 50 3.856 -4.510 -2.960 1.00 1.01 H ATOM 752 HA TYR A 50 4.753 -2.024 -3.571 1.00 1.18 H ATOM 753 HB2 TYR A 50 5.829 -2.004 -1.522 1.00 1.62 H ATOM 754 HB3 TYR A 50 4.633 -3.246 -1.292 1.00 1.97 H ATOM 755 HD1 TYR A 50 5.564 -5.746 -1.989 1.00 3.97 H ATOM 756 HD2 TYR A 50 7.992 -2.400 -0.783 1.00 2.73 H ATOM 757 HE1 TYR A 50 7.475 -7.291 -1.590 1.00 5.09 H ATOM 758 HE2 TYR A 50 9.900 -3.951 -0.347 1.00 3.47 H ATOM 759 HH TYR A 50 9.713 -7.454 -1.046 1.00 5.04 H ATOM 760 N ALA A 51 7.359 -1.874 -4.025 1.00 1.40 N ATOM 761 CA ALA A 51 8.744 -1.787 -4.499 1.00 2.05 C ATOM 762 C ALA A 51 9.683 -1.327 -3.368 1.00 2.49 C ATOM 763 O ALA A 51 9.298 -0.505 -2.535 1.00 2.73 O ATOM 764 CB ALA A 51 8.794 -0.884 -5.738 1.00 2.43 C ATOM 765 H ALA A 51 7.026 -1.112 -3.449 1.00 1.47 H ATOM 766 HA ALA A 51 9.083 -2.778 -4.805 1.00 3.00 H ATOM 767 HB1 ALA A 51 8.448 0.117 -5.490 1.00 2.59 H ATOM 768 HB2 ALA A 51 9.816 -0.830 -6.113 1.00 3.04 H ATOM 769 HB3 ALA A 51 8.157 -1.295 -6.522 1.00 3.26 H ATOM 770 N GLY A 52 10.906 -1.867 -3.334 1.00 3.55 N ATOM 771 CA GLY A 52 11.877 -1.631 -2.259 1.00 4.60 C ATOM 772 C GLY A 52 12.412 -0.194 -2.174 1.00 4.55 C ATOM 773 O GLY A 52 12.466 0.527 -3.178 1.00 4.66 O ATOM 774 H GLY A 52 11.144 -2.555 -4.037 1.00 4.00 H ATOM 775 HA2 GLY A 52 11.403 -1.879 -1.309 1.00 5.00 H ATOM 776 HA3 GLY A 52 12.728 -2.301 -2.385 1.00 5.47 H ATOM 777 N LYS A 53 12.857 0.213 -0.979 1.00 4.77 N ATOM 778 CA LYS A 53 13.507 1.486 -0.686 1.00 4.89 C ATOM 779 C LYS A 53 14.886 1.549 -1.346 1.00 4.97 C ATOM 780 O LYS A 53 15.525 0.536 -1.653 1.00 4.94 O ATOM 781 CB LYS A 53 13.641 1.703 0.844 1.00 5.29 C ATOM 782 CG LYS A 53 12.378 2.157 1.603 1.00 6.03 C ATOM 783 CD LYS A 53 11.271 1.096 1.634 1.00 6.84 C ATOM 784 CE LYS A 53 10.132 1.377 2.636 1.00 8.19 C ATOM 785 NZ LYS A 53 10.571 1.364 4.057 1.00 9.83 N ATOM 786 H LYS A 53 12.932 -0.478 -0.249 1.00 5.10 H ATOM 787 HA LYS A 53 12.904 2.296 -1.104 1.00 5.13 H ATOM 788 HB2 LYS A 53 14.029 0.792 1.305 1.00 5.47 H ATOM 789 HB3 LYS A 53 14.388 2.480 1.016 1.00 5.34 H ATOM 790 HG2 LYS A 53 12.675 2.389 2.626 1.00 6.70 H ATOM 791 HG3 LYS A 53 11.990 3.069 1.151 1.00 5.86 H ATOM 792 HD2 LYS A 53 10.844 1.044 0.632 1.00 6.57 H ATOM 793 HD3 LYS A 53 11.715 0.127 1.862 1.00 7.12 H ATOM 794 HE2 LYS A 53 9.667 2.339 2.402 1.00 8.02 H ATOM 795 HE3 LYS A 53 9.371 0.603 2.498 1.00 8.54 H ATOM 796 HZ1 LYS A 53 9.796 1.192 4.695 1.00 10.70 H ATOM 797 HZ2 LYS A 53 11.289 0.664 4.227 1.00 10.31 H ATOM 798 HZ3 LYS A 53 10.971 2.257 4.338 1.00 10.08 H ATOM 799 N ALA A 54 15.302 2.794 -1.495 1.00 5.74 N ATOM 800 CA ALA A 54 16.601 3.291 -1.983 1.00 6.53 C ATOM 801 C ALA A 54 17.101 2.651 -3.300 1.00 6.69 C ATOM 802 O ALA A 54 16.275 2.471 -4.226 1.00 6.92 O ATOM 803 CB ALA A 54 17.590 3.216 -0.807 1.00 7.51 C ATOM 804 H ALA A 54 14.607 3.448 -1.159 1.00 6.17 H ATOM 805 HA ALA A 54 16.469 4.347 -2.218 1.00 7.13 H ATOM 806 HB1 ALA A 54 17.791 2.174 -0.553 1.00 7.48 H ATOM 807 HB2 ALA A 54 18.525 3.712 -1.068 1.00 8.12 H ATOM 808 HB3 ALA A 54 17.166 3.712 0.065 1.00 8.20 H TER 809 ALA A 54 HETATM 810 FE1 SF4 A 101 1.112 1.208 -2.141 1.00 0.24 FE HETATM 811 FE2 SF4 A 101 3.565 0.343 -1.248 1.00 0.33 FE HETATM 812 FE3 SF4 A 101 1.417 0.148 0.091 1.00 0.24 FE HETATM 813 FE4 SF4 A 101 1.821 -1.407 -1.646 1.00 0.40 FE HETATM 814 S1 SF4 A 101 3.078 -1.344 0.159 1.00 0.37 S HETATM 815 S2 SF4 A 101 -0.157 -0.434 -1.217 1.00 0.31 S HETATM 816 S3 SF4 A 101 2.751 -0.078 -3.209 1.00 0.38 S HETATM 817 S4 SF4 A 101 2.319 2.120 -0.540 1.00 0.28 S