ATOM 43 N GLY A 5 -2.576 10.821 -7.954 1.00 1.59 N ATOM 44 CA GLY A 5 -2.946 10.972 -6.566 1.00 1.14 C ATOM 45 C GLY A 5 -3.406 9.674 -5.947 1.00 0.91 C ATOM 46 O GLY A 5 -3.875 8.778 -6.644 1.00 1.01 O ATOM 47 H GLY A 5 -3.155 10.316 -8.564 1.00 2.14 H ATOM 48 HA2 GLY A 5 -2.091 11.338 -6.018 1.00 1.45 H ATOM 49 HA3 GLY A 5 -3.743 11.698 -6.496 1.00 1.83 H ATOM 50 N LEU A 6 -3.254 9.571 -4.638 1.00 0.81 N ATOM 51 CA LEU A 6 -3.714 8.407 -3.899 1.00 0.66 C ATOM 52 C LEU A 6 -4.882 8.782 -2.987 1.00 0.62 C ATOM 53 O LEU A 6 -5.119 9.966 -2.742 1.00 0.75 O ATOM 54 CB LEU A 6 -2.557 7.793 -3.096 1.00 0.80 C ATOM 55 CG LEU A 6 -1.601 8.782 -2.409 1.00 0.66 C ATOM 56 CD1 LEU A 6 -2.284 9.553 -1.288 1.00 1.53 C ATOM 57 CD2 LEU A 6 -0.391 8.039 -1.873 1.00 1.45 C ATOM 58 H LEU A 6 -2.825 10.301 -4.149 1.00 0.97 H ATOM 59 HA LEU A 6 -4.061 7.681 -4.617 1.00 0.67 H ATOM 60 HB2 LEU A 6 -2.982 7.156 -2.335 1.00 1.46 H ATOM 61 HB3 LEU A 6 -1.974 7.179 -3.766 1.00 1.26 H ATOM 62 HG LEU A 6 -1.253 9.497 -3.140 1.00 1.20 H ATOM 63 HD11 LEU A 6 -1.594 10.275 -0.880 1.00 1.97 H ATOM 64 HD12 LEU A 6 -2.587 8.868 -0.510 1.00 2.08 H ATOM 65 HD13 LEU A 6 -3.152 10.066 -1.676 1.00 2.19 H ATOM 66 HD21 LEU A 6 -0.716 7.273 -1.185 1.00 1.97 H ATOM 67 HD22 LEU A 6 0.258 8.732 -1.362 1.00 1.76 H ATOM 68 HD23 LEU A 6 0.142 7.584 -2.694 1.00 2.11 H ATOM 69 N PRO A 7 -5.647 7.788 -2.501 1.00 0.52 N ATOM 70 CA PRO A 7 -6.743 8.032 -1.563 1.00 0.58 C ATOM 71 C PRO A 7 -6.228 8.540 -0.219 1.00 0.57 C ATOM 72 O PRO A 7 -5.101 8.232 0.176 1.00 0.45 O ATOM 73 CB PRO A 7 -7.409 6.652 -1.398 1.00 0.60 C ATOM 74 CG PRO A 7 -6.888 5.823 -2.520 1.00 0.58 C ATOM 75 CD PRO A 7 -5.518 6.356 -2.822 1.00 0.52 C ATOM 76 HA PRO A 7 -7.457 8.735 -1.963 1.00 0.73 H ATOM 77 HB2 PRO A 7 -7.136 6.232 -0.442 1.00 0.59 H ATOM 78 HB3 PRO A 7 -8.483 6.760 -1.455 1.00 0.76 H ATOM 79 HG2 PRO A 7 -6.829 4.788 -2.216 1.00 0.64 H ATOM 80 HG3 PRO A 7 -7.527 5.926 -3.382 1.00 0.69 H ATOM 81 HD2 PRO A 7 -4.782 5.883 -2.189 1.00 0.50 H ATOM 82 HD3 PRO A 7 -5.277 6.213 -3.863 1.00 0.66 H ATOM 83 N PRO A 8 -7.038 9.339 0.489 1.00 0.76 N ATOM 84 CA PRO A 8 -6.684 9.856 1.813 1.00 0.80 C ATOM 85 C PRO A 8 -6.391 8.733 2.805 1.00 0.63 C ATOM 86 O PRO A 8 -7.256 7.897 3.091 1.00 0.73 O ATOM 87 CB PRO A 8 -7.924 10.643 2.245 1.00 1.09 C ATOM 88 CG PRO A 8 -8.642 10.956 0.977 1.00 1.18 C ATOM 89 CD PRO A 8 -8.365 9.806 0.053 1.00 0.99 C ATOM 90 HA PRO A 8 -5.830 10.519 1.765 1.00 0.84 H ATOM 91 HB2 PRO A 8 -8.530 10.036 2.901 1.00 1.18 H ATOM 92 HB3 PRO A 8 -7.622 11.543 2.758 1.00 1.29 H ATOM 93 HG2 PRO A 8 -9.702 11.039 1.165 1.00 1.40 H ATOM 94 HG3 PRO A 8 -8.261 11.875 0.556 1.00 1.38 H ATOM 95 HD2 PRO A 8 -9.107 9.031 0.183 1.00 1.07 H ATOM 96 HD3 PRO A 8 -8.340 10.142 -0.972 1.00 1.09 H ATOM 97 N GLY A 9 -5.173 8.725 3.324 1.00 0.47 N ATOM 98 CA GLY A 9 -4.754 7.675 4.227 1.00 0.43 C ATOM 99 C GLY A 9 -3.859 6.652 3.557 1.00 0.36 C ATOM 100 O GLY A 9 -3.570 5.603 4.133 1.00 0.49 O ATOM 101 H GLY A 9 -4.551 9.449 3.095 1.00 0.49 H ATOM 102 HA2 GLY A 9 -4.213 8.122 5.047 1.00 0.44 H ATOM 103 HA3 GLY A 9 -5.627 7.172 4.615 1.00 0.56 H ATOM 104 N TRP A 10 -3.416 6.957 2.348 1.00 0.29 N ATOM 105 CA TRP A 10 -2.478 6.096 1.637 1.00 0.27 C ATOM 106 C TRP A 10 -1.116 6.773 1.518 1.00 0.28 C ATOM 107 O TRP A 10 -1.034 7.979 1.286 1.00 0.41 O ATOM 108 CB TRP A 10 -3.004 5.756 0.236 1.00 0.28 C ATOM 109 CG TRP A 10 -4.085 4.722 0.224 1.00 0.36 C ATOM 110 CD1 TRP A 10 -5.153 4.635 1.069 1.00 0.51 C ATOM 111 CD2 TRP A 10 -4.207 3.631 -0.694 1.00 0.52 C ATOM 112 NE1 TRP A 10 -5.928 3.552 0.735 1.00 0.56 N ATOM 113 CE2 TRP A 10 -5.365 2.917 -0.342 1.00 0.55 C ATOM 114 CE3 TRP A 10 -3.444 3.187 -1.780 1.00 0.79 C ATOM 115 CZ2 TRP A 10 -5.783 1.785 -1.038 1.00 0.73 C ATOM 116 CZ3 TRP A 10 -3.856 2.059 -2.470 1.00 1.02 C ATOM 117 CH2 TRP A 10 -5.015 1.369 -2.097 1.00 0.96 C ATOM 118 H TRP A 10 -3.732 7.776 1.913 1.00 0.35 H ATOM 119 HA TRP A 10 -2.365 5.185 2.204 1.00 0.33 H ATOM 120 HB2 TRP A 10 -3.401 6.650 -0.221 1.00 0.27 H ATOM 121 HB3 TRP A 10 -2.186 5.387 -0.366 1.00 0.33 H ATOM 122 HD1 TRP A 10 -5.345 5.321 1.880 1.00 0.68 H ATOM 123 HE1 TRP A 10 -6.749 3.278 1.196 1.00 0.69 H ATOM 124 HE3 TRP A 10 -2.549 3.706 -2.082 1.00 0.86 H ATOM 125 HZ2 TRP A 10 -6.677 1.244 -0.763 1.00 0.76 H ATOM 126 HZ3 TRP A 10 -3.278 1.701 -3.314 1.00 1.27 H ATOM 127 HH2 TRP A 10 -5.300 0.494 -2.663 1.00 1.14 H ATOM 128 N GLU A 11 -0.055 5.996 1.709 1.00 0.28 N ATOM 129 CA GLU A 11 1.308 6.470 1.473 1.00 0.36 C ATOM 130 C GLU A 11 1.959 5.620 0.391 1.00 0.32 C ATOM 131 O GLU A 11 1.683 4.420 0.297 1.00 0.33 O ATOM 132 CB GLU A 11 2.164 6.370 2.741 1.00 0.55 C ATOM 133 CG GLU A 11 1.605 7.094 3.946 1.00 1.23 C ATOM 134 CD GLU A 11 1.427 8.582 3.738 1.00 1.31 C ATOM 135 OE1 GLU A 11 2.366 9.219 3.215 1.00 1.29 O ATOM 136 OE2 GLU A 11 0.342 9.111 4.050 1.00 1.91 O ATOM 137 H GLU A 11 -0.191 5.073 2.018 1.00 0.35 H ATOM 138 HA GLU A 11 1.263 7.498 1.145 1.00 0.41 H ATOM 139 HB2 GLU A 11 2.263 5.330 3.006 1.00 0.82 H ATOM 140 HB3 GLU A 11 3.144 6.773 2.530 1.00 1.14 H ATOM 141 HG2 GLU A 11 0.644 6.667 4.185 1.00 1.86 H ATOM 142 HG3 GLU A 11 2.278 6.941 4.779 1.00 1.89 H ATOM 143 N GLU A 12 2.813 6.223 -0.426 1.00 0.44 N ATOM 144 CA GLU A 12 3.595 5.455 -1.380 1.00 0.49 C ATOM 145 C GLU A 12 5.066 5.436 -0.968 1.00 0.44 C ATOM 146 O GLU A 12 5.692 6.481 -0.791 1.00 0.59 O ATOM 147 CB GLU A 12 3.441 5.984 -2.820 1.00 0.81 C ATOM 148 CG GLU A 12 3.956 7.403 -3.056 1.00 1.06 C ATOM 149 CD GLU A 12 2.984 8.481 -2.608 1.00 1.60 C ATOM 150 OE1 GLU A 12 3.024 8.875 -1.420 1.00 2.00 O ATOM 151 OE2 GLU A 12 2.196 8.956 -3.451 1.00 2.15 O ATOM 152 H GLU A 12 2.915 7.205 -0.394 1.00 0.59 H ATOM 153 HA GLU A 12 3.225 4.440 -1.347 1.00 0.49 H ATOM 154 HB2 GLU A 12 3.981 5.325 -3.486 1.00 1.47 H ATOM 155 HB3 GLU A 12 2.396 5.959 -3.086 1.00 1.44 H ATOM 156 HG2 GLU A 12 4.879 7.529 -2.511 1.00 1.48 H ATOM 157 HG3 GLU A 12 4.145 7.527 -4.112 1.00 1.74 H ATOM 158 N LYS A 13 5.598 4.236 -0.782 1.00 0.40 N ATOM 159 CA LYS A 13 7.019 4.058 -0.505 1.00 0.47 C ATOM 160 C LYS A 13 7.537 2.898 -1.347 1.00 0.43 C ATOM 161 O LYS A 13 6.863 2.472 -2.275 1.00 0.60 O ATOM 162 CB LYS A 13 7.287 3.815 0.992 1.00 0.61 C ATOM 163 CG LYS A 13 6.603 2.585 1.566 1.00 0.95 C ATOM 164 CD LYS A 13 7.303 2.103 2.828 1.00 1.45 C ATOM 165 CE LYS A 13 6.658 0.842 3.392 1.00 2.24 C ATOM 166 NZ LYS A 13 7.522 0.182 4.408 1.00 3.20 N ATOM 167 H LYS A 13 5.022 3.444 -0.854 1.00 0.45 H ATOM 168 HA LYS A 13 7.527 4.962 -0.812 1.00 0.60 H ATOM 169 HB2 LYS A 13 8.352 3.703 1.137 1.00 1.30 H ATOM 170 HB3 LYS A 13 6.951 4.678 1.549 1.00 1.06 H ATOM 171 HG2 LYS A 13 5.579 2.833 1.807 1.00 1.43 H ATOM 172 HG3 LYS A 13 6.622 1.798 0.830 1.00 1.60 H ATOM 173 HD2 LYS A 13 8.334 1.889 2.594 1.00 1.83 H ATOM 174 HD3 LYS A 13 7.257 2.883 3.574 1.00 1.74 H ATOM 175 HE2 LYS A 13 5.718 1.111 3.853 1.00 2.33 H ATOM 176 HE3 LYS A 13 6.475 0.150 2.582 1.00 2.60 H ATOM 177 HZ1 LYS A 13 7.061 -0.669 4.775 1.00 3.78 H ATOM 178 HZ2 LYS A 13 7.706 0.837 5.202 1.00 3.54 H ATOM 179 HZ3 LYS A 13 8.437 -0.095 3.981 1.00 3.46 H ATOM 180 N GLN A 14 8.717 2.391 -1.043 1.00 0.39 N ATOM 181 CA GLN A 14 9.286 1.301 -1.826 1.00 0.37 C ATOM 182 C GLN A 14 9.345 0.011 -1.010 1.00 0.33 C ATOM 183 O GLN A 14 9.529 0.052 0.211 1.00 0.31 O ATOM 184 CB GLN A 14 10.688 1.669 -2.337 1.00 0.44 C ATOM 185 CG GLN A 14 11.784 1.682 -1.275 1.00 0.62 C ATOM 186 CD GLN A 14 11.569 2.712 -0.181 1.00 0.92 C ATOM 187 OE1 GLN A 14 11.990 3.864 -0.297 1.00 1.59 O ATOM 188 NE2 GLN A 14 10.917 2.301 0.896 1.00 1.33 N ATOM 189 H GLN A 14 9.218 2.746 -0.276 1.00 0.52 H ATOM 190 HA GLN A 14 8.640 1.138 -2.677 1.00 0.40 H ATOM 191 HB2 GLN A 14 10.973 0.956 -3.096 1.00 0.50 H ATOM 192 HB3 GLN A 14 10.640 2.650 -2.783 1.00 0.55 H ATOM 193 HG2 GLN A 14 11.837 0.706 -0.818 1.00 1.33 H ATOM 194 HG3 GLN A 14 12.722 1.896 -1.762 1.00 1.35 H ATOM 195 HE21 GLN A 14 10.606 1.361 0.922 1.00 1.22 H ATOM 196 HE22 GLN A 14 10.774 2.945 1.626 1.00 2.03 H ATOM 197 N ASP A 15 9.168 -1.128 -1.674 1.00 0.39 N ATOM 198 CA ASP A 15 9.308 -2.423 -1.013 1.00 0.44 C ATOM 199 C ASP A 15 10.786 -2.811 -0.979 1.00 0.48 C ATOM 200 O ASP A 15 11.661 -1.970 -1.189 1.00 0.52 O ATOM 201 CB ASP A 15 8.489 -3.518 -1.720 1.00 0.50 C ATOM 202 CG ASP A 15 9.124 -4.029 -2.998 1.00 0.79 C ATOM 203 OD1 ASP A 15 9.459 -3.214 -3.869 1.00 1.03 O ATOM 204 OD2 ASP A 15 9.299 -5.260 -3.129 1.00 1.25 O ATOM 205 H ASP A 15 8.945 -1.095 -2.632 1.00 0.45 H ATOM 206 HA ASP A 15 8.939 -2.322 -0.002 1.00 0.49 H ATOM 207 HB2 ASP A 15 8.375 -4.355 -1.046 1.00 0.96 H ATOM 208 HB3 ASP A 15 7.512 -3.122 -1.957 1.00 0.73 H ATOM 209 N ASP A 16 11.054 -4.084 -0.742 1.00 0.57 N ATOM 210 CA ASP A 16 12.420 -4.592 -0.674 1.00 0.65 C ATOM 211 C ASP A 16 13.091 -4.526 -2.041 1.00 0.66 C ATOM 212 O ASP A 16 14.299 -4.336 -2.148 1.00 0.82 O ATOM 213 CB ASP A 16 12.400 -6.034 -0.157 1.00 0.85 C ATOM 214 CG ASP A 16 13.763 -6.694 -0.158 1.00 1.37 C ATOM 215 OD1 ASP A 16 14.569 -6.399 0.753 1.00 1.36 O ATOM 216 OD2 ASP A 16 14.042 -7.479 -1.087 1.00 2.16 O ATOM 217 H ASP A 16 10.313 -4.708 -0.625 1.00 0.66 H ATOM 218 HA ASP A 16 12.971 -3.978 0.020 1.00 0.66 H ATOM 219 HB2 ASP A 16 12.028 -6.037 0.858 1.00 1.19 H ATOM 220 HB3 ASP A 16 11.736 -6.622 -0.775 1.00 1.16 H ATOM 221 N ARG A 17 12.291 -4.644 -3.092 1.00 0.60 N ATOM 222 CA ARG A 17 12.815 -4.677 -4.452 1.00 0.65 C ATOM 223 C ARG A 17 12.860 -3.286 -5.080 1.00 0.59 C ATOM 224 O ARG A 17 13.280 -3.127 -6.230 1.00 0.82 O ATOM 225 CB ARG A 17 11.977 -5.622 -5.310 1.00 0.70 C ATOM 226 CG ARG A 17 11.953 -7.032 -4.756 1.00 0.82 C ATOM 227 CD ARG A 17 11.084 -7.959 -5.583 1.00 1.42 C ATOM 228 NE ARG A 17 11.036 -9.305 -5.012 1.00 2.09 N ATOM 229 CZ ARG A 17 10.943 -10.420 -5.735 1.00 2.94 C ATOM 230 NH1 ARG A 17 10.893 -10.353 -7.063 1.00 3.29 N ATOM 231 NH2 ARG A 17 10.891 -11.602 -5.130 1.00 3.86 N ATOM 232 H ARG A 17 11.319 -4.719 -2.951 1.00 0.59 H ATOM 233 HA ARG A 17 13.821 -5.058 -4.401 1.00 0.77 H ATOM 234 HB2 ARG A 17 10.962 -5.252 -5.359 1.00 0.67 H ATOM 235 HB3 ARG A 17 12.391 -5.653 -6.308 1.00 0.74 H ATOM 236 HG2 ARG A 17 12.961 -7.417 -4.744 1.00 1.22 H ATOM 237 HG3 ARG A 17 11.569 -6.999 -3.746 1.00 0.97 H ATOM 238 HD2 ARG A 17 10.082 -7.558 -5.612 1.00 1.82 H ATOM 239 HD3 ARG A 17 11.481 -8.015 -6.586 1.00 2.07 H ATOM 240 HE ARG A 17 11.077 -9.374 -4.028 1.00 2.35 H ATOM 241 HH11 ARG A 17 10.934 -9.463 -7.528 1.00 3.11 H ATOM 242 HH12 ARG A 17 10.820 -11.195 -7.609 1.00 4.02 H ATOM 243 HH21 ARG A 17 10.924 -11.662 -4.122 1.00 4.10 H ATOM 244 HH22 ARG A 17 10.837 -12.445 -5.674 1.00 4.51 H ATOM 245 N GLY A 18 12.443 -2.283 -4.322 1.00 0.45 N ATOM 246 CA GLY A 18 12.518 -0.917 -4.803 1.00 0.45 C ATOM 247 C GLY A 18 11.332 -0.524 -5.657 1.00 0.36 C ATOM 248 O GLY A 18 11.434 0.374 -6.496 1.00 0.44 O ATOM 249 H GLY A 18 12.087 -2.471 -3.429 1.00 0.51 H ATOM 250 HA2 GLY A 18 12.568 -0.251 -3.955 1.00 0.49 H ATOM 251 HA3 GLY A 18 13.419 -0.806 -5.387 1.00 0.58 H ATOM 252 N ARG A 19 10.211 -1.194 -5.462 1.00 0.25 N ATOM 253 CA ARG A 19 8.993 -0.857 -6.178 1.00 0.24 C ATOM 254 C ARG A 19 8.164 0.105 -5.354 1.00 0.26 C ATOM 255 O ARG A 19 8.006 -0.083 -4.147 1.00 0.35 O ATOM 256 CB ARG A 19 8.182 -2.115 -6.455 1.00 0.34 C ATOM 257 CG ARG A 19 8.964 -3.179 -7.183 1.00 0.77 C ATOM 258 CD ARG A 19 8.189 -4.478 -7.247 1.00 1.40 C ATOM 259 NE ARG A 19 8.107 -5.129 -5.938 1.00 1.97 N ATOM 260 CZ ARG A 19 7.324 -6.173 -5.668 1.00 2.87 C ATOM 261 NH1 ARG A 19 6.482 -6.643 -6.587 1.00 3.42 N ATOM 262 NH2 ARG A 19 7.383 -6.739 -4.469 1.00 3.66 N ATOM 263 H ARG A 19 10.194 -1.939 -4.814 1.00 0.26 H ATOM 264 HA ARG A 19 9.261 -0.391 -7.112 1.00 0.29 H ATOM 265 HB2 ARG A 19 7.848 -2.527 -5.516 1.00 0.81 H ATOM 266 HB3 ARG A 19 7.321 -1.854 -7.054 1.00 0.77 H ATOM 267 HG2 ARG A 19 9.181 -2.839 -8.187 1.00 1.41 H ATOM 268 HG3 ARG A 19 9.882 -3.345 -6.648 1.00 1.54 H ATOM 269 HD2 ARG A 19 7.191 -4.265 -7.595 1.00 2.02 H ATOM 270 HD3 ARG A 19 8.679 -5.145 -7.939 1.00 1.88 H ATOM 271 HE ARG A 19 8.691 -4.776 -5.221 1.00 2.19 H ATOM 272 HH11 ARG A 19 6.426 -6.206 -7.490 1.00 3.31 H ATOM 273 HH12 ARG A 19 5.911 -7.444 -6.386 1.00 4.23 H ATOM 274 HH21 ARG A 19 8.016 -6.375 -3.770 1.00 3.79 H ATOM 275 HH22 ARG A 19 6.797 -7.531 -4.252 1.00 4.36 H ATOM 276 N SER A 20 7.638 1.136 -5.993 1.00 0.35 N ATOM 277 CA SER A 20 6.789 2.076 -5.297 1.00 0.41 C ATOM 278 C SER A 20 5.416 1.447 -5.100 1.00 0.41 C ATOM 279 O SER A 20 4.651 1.277 -6.052 1.00 0.54 O ATOM 280 CB SER A 20 6.693 3.386 -6.079 1.00 0.60 C ATOM 281 OG SER A 20 7.989 3.896 -6.343 1.00 1.04 O ATOM 282 H SER A 20 7.803 1.252 -6.956 1.00 0.46 H ATOM 283 HA SER A 20 7.230 2.274 -4.327 1.00 0.38 H ATOM 284 HB2 SER A 20 6.186 3.216 -7.017 1.00 0.82 H ATOM 285 HB3 SER A 20 6.146 4.116 -5.499 1.00 0.82 H ATOM 286 HG SER A 20 8.637 3.374 -5.859 1.00 1.55 H ATOM 287 N TYR A 21 5.124 1.077 -3.868 1.00 0.35 N ATOM 288 CA TYR A 21 3.871 0.435 -3.548 1.00 0.42 C ATOM 289 C TYR A 21 3.111 1.262 -2.519 1.00 0.39 C ATOM 290 O TYR A 21 3.664 2.199 -1.931 1.00 0.41 O ATOM 291 CB TYR A 21 4.102 -1.014 -3.068 1.00 0.49 C ATOM 292 CG TYR A 21 4.863 -1.180 -1.763 1.00 0.48 C ATOM 293 CD1 TYR A 21 5.508 -0.119 -1.144 1.00 0.80 C ATOM 294 CD2 TYR A 21 4.930 -2.419 -1.153 1.00 0.71 C ATOM 295 CE1 TYR A 21 6.184 -0.291 0.044 1.00 0.86 C ATOM 296 CE2 TYR A 21 5.607 -2.602 0.035 1.00 0.80 C ATOM 297 CZ TYR A 21 6.236 -1.535 0.628 1.00 0.66 C ATOM 298 OH TYR A 21 6.899 -1.706 1.818 1.00 0.82 O ATOM 299 H TYR A 21 5.768 1.249 -3.149 1.00 0.31 H ATOM 300 HA TYR A 21 3.288 0.404 -4.457 1.00 0.53 H ATOM 301 HB2 TYR A 21 3.141 -1.490 -2.931 1.00 0.56 H ATOM 302 HB3 TYR A 21 4.657 -1.550 -3.838 1.00 0.56 H ATOM 303 HD1 TYR A 21 5.470 0.861 -1.602 1.00 1.18 H ATOM 304 HD2 TYR A 21 4.440 -3.255 -1.621 1.00 1.06 H ATOM 305 HE1 TYR A 21 6.682 0.550 0.510 1.00 1.23 H ATOM 306 HE2 TYR A 21 5.646 -3.582 0.488 1.00 1.17 H ATOM 307 HH TYR A 21 7.329 -2.576 1.824 1.00 1.27 H ATOM 308 N TYR A 22 1.855 0.922 -2.291 1.00 0.39 N ATOM 309 CA TYR A 22 0.994 1.751 -1.464 1.00 0.38 C ATOM 310 C TYR A 22 0.632 1.054 -0.162 1.00 0.35 C ATOM 311 O TYR A 22 0.470 -0.167 -0.119 1.00 0.45 O ATOM 312 CB TYR A 22 -0.274 2.116 -2.236 1.00 0.48 C ATOM 313 CG TYR A 22 -0.008 2.965 -3.459 1.00 0.59 C ATOM 314 CD1 TYR A 22 0.321 2.382 -4.673 1.00 0.72 C ATOM 315 CD2 TYR A 22 -0.089 4.350 -3.396 1.00 0.74 C ATOM 316 CE1 TYR A 22 0.563 3.149 -5.794 1.00 0.86 C ATOM 317 CE2 TYR A 22 0.151 5.127 -4.514 1.00 0.88 C ATOM 318 CZ TYR A 22 0.477 4.522 -5.709 1.00 0.90 C ATOM 319 OH TYR A 22 0.716 5.289 -6.825 1.00 1.07 O ATOM 320 H TYR A 22 1.501 0.089 -2.667 1.00 0.42 H ATOM 321 HA TYR A 22 1.534 2.660 -1.236 1.00 0.37 H ATOM 322 HB2 TYR A 22 -0.762 1.210 -2.565 1.00 0.55 H ATOM 323 HB3 TYR A 22 -0.939 2.663 -1.587 1.00 0.50 H ATOM 324 HD1 TYR A 22 0.389 1.305 -4.735 1.00 0.82 H ATOM 325 HD2 TYR A 22 -0.345 4.822 -2.458 1.00 0.83 H ATOM 326 HE1 TYR A 22 0.816 2.674 -6.728 1.00 1.02 H ATOM 327 HE2 TYR A 22 0.084 6.204 -4.447 1.00 1.06 H ATOM 328 HH TYR A 22 1.215 6.077 -6.566 1.00 1.38 H ATOM 329 N VAL A 23 0.518 1.831 0.901 1.00 0.34 N ATOM 330 CA VAL A 23 0.129 1.298 2.192 1.00 0.38 C ATOM 331 C VAL A 23 -0.970 2.150 2.815 1.00 0.24 C ATOM 332 O VAL A 23 -0.893 3.383 2.820 1.00 0.24 O ATOM 333 CB VAL A 23 1.340 1.185 3.149 1.00 0.54 C ATOM 334 CG1 VAL A 23 2.048 2.521 3.313 1.00 0.58 C ATOM 335 CG2 VAL A 23 0.907 0.640 4.504 1.00 0.66 C ATOM 336 H VAL A 23 0.699 2.794 0.815 1.00 0.40 H ATOM 337 HA VAL A 23 -0.260 0.301 2.028 1.00 0.48 H ATOM 338 HB VAL A 23 2.041 0.483 2.716 1.00 0.63 H ATOM 339 HG11 VAL A 23 2.419 2.852 2.354 1.00 1.15 H ATOM 340 HG12 VAL A 23 2.874 2.408 3.999 1.00 1.12 H ATOM 341 HG13 VAL A 23 1.354 3.251 3.700 1.00 1.19 H ATOM 342 HG21 VAL A 23 0.497 -0.350 4.379 1.00 1.05 H ATOM 343 HG22 VAL A 23 0.159 1.288 4.930 1.00 1.17 H ATOM 344 HG23 VAL A 23 1.763 0.594 5.166 1.00 1.07 H ATOM 345 N ASP A 24 -1.998 1.481 3.317 1.00 0.29 N ATOM 346 CA ASP A 24 -3.127 2.153 3.945 1.00 0.33 C ATOM 347 C ASP A 24 -2.889 2.330 5.444 1.00 0.37 C ATOM 348 O ASP A 24 -2.446 1.401 6.123 1.00 0.61 O ATOM 349 CB ASP A 24 -4.412 1.353 3.699 1.00 0.53 C ATOM 350 CG ASP A 24 -5.555 1.793 4.594 1.00 1.32 C ATOM 351 OD1 ASP A 24 -5.822 3.010 4.680 1.00 1.97 O ATOM 352 OD2 ASP A 24 -6.183 0.922 5.225 1.00 1.68 O ATOM 353 H ASP A 24 -1.994 0.500 3.269 1.00 0.43 H ATOM 354 HA ASP A 24 -3.230 3.126 3.488 1.00 0.35 H ATOM 355 HB2 ASP A 24 -4.718 1.482 2.673 1.00 0.95 H ATOM 356 HB3 ASP A 24 -4.217 0.307 3.885 1.00 0.86 H ATOM 357 N HIS A 25 -3.183 3.523 5.958 1.00 0.44 N ATOM 358 CA HIS A 25 -2.999 3.821 7.378 1.00 0.54 C ATOM 359 C HIS A 25 -4.074 3.150 8.230 1.00 0.49 C ATOM 360 O HIS A 25 -3.872 2.898 9.419 1.00 0.60 O ATOM 361 CB HIS A 25 -3.042 5.333 7.634 1.00 0.74 C ATOM 362 CG HIS A 25 -1.848 6.095 7.146 1.00 0.82 C ATOM 363 ND1 HIS A 25 -0.658 6.158 7.837 1.00 1.00 N ATOM 364 CD2 HIS A 25 -1.685 6.876 6.056 1.00 0.84 C ATOM 365 CE1 HIS A 25 0.178 6.944 7.191 1.00 1.09 C ATOM 366 NE2 HIS A 25 -0.424 7.393 6.109 1.00 0.98 N ATOM 367 H HIS A 25 -3.542 4.222 5.360 1.00 0.56 H ATOM 368 HA HIS A 25 -2.032 3.444 7.677 1.00 0.59 H ATOM 369 HB2 HIS A 25 -3.907 5.744 7.136 1.00 0.77 H ATOM 370 HB3 HIS A 25 -3.132 5.505 8.694 1.00 0.88 H ATOM 371 HD1 HIS A 25 -0.449 5.681 8.676 1.00 1.10 H ATOM 372 HD2 HIS A 25 -2.412 7.053 5.281 1.00 0.85 H ATOM 373 HE1 HIS A 25 1.185 7.178 7.495 1.00 1.27 H ATOM 374 HE2 HIS A 25 -0.058 8.072 5.488 1.00 1.06 H ATOM 375 N ASN A 26 -5.210 2.857 7.620 1.00 0.57 N ATOM 376 CA ASN A 26 -6.361 2.342 8.353 1.00 0.71 C ATOM 377 C ASN A 26 -6.206 0.863 8.687 1.00 0.66 C ATOM 378 O ASN A 26 -6.316 0.468 9.845 1.00 0.71 O ATOM 379 CB ASN A 26 -7.654 2.540 7.545 1.00 1.01 C ATOM 380 CG ASN A 26 -7.965 3.998 7.267 1.00 1.35 C ATOM 381 OD1 ASN A 26 -8.635 4.663 8.056 1.00 2.08 O ATOM 382 ND2 ASN A 26 -7.494 4.503 6.138 1.00 1.29 N ATOM 383 H ASN A 26 -5.276 2.979 6.646 1.00 0.65 H ATOM 384 HA ASN A 26 -6.441 2.900 9.273 1.00 0.75 H ATOM 385 HB2 ASN A 26 -7.559 2.026 6.601 1.00 1.05 H ATOM 386 HB3 ASN A 26 -8.478 2.115 8.100 1.00 1.36 H ATOM 387 HD21 ASN A 26 -6.973 3.907 5.539 1.00 1.33 H ATOM 388 HD22 ASN A 26 -7.671 5.445 5.945 1.00 1.60 H ATOM 389 N SER A 27 -5.941 0.060 7.669 1.00 0.74 N ATOM 390 CA SER A 27 -5.899 -1.386 7.814 1.00 0.83 C ATOM 391 C SER A 27 -4.462 -1.889 7.942 1.00 0.73 C ATOM 392 O SER A 27 -4.229 -3.097 7.966 1.00 0.92 O ATOM 393 CB SER A 27 -6.572 -2.028 6.597 1.00 1.09 C ATOM 394 OG SER A 27 -7.654 -1.224 6.144 1.00 1.53 O ATOM 395 H SER A 27 -5.801 0.452 6.772 1.00 0.86 H ATOM 396 HA SER A 27 -6.446 -1.653 8.704 1.00 0.95 H ATOM 397 HB2 SER A 27 -5.852 -2.127 5.797 1.00 1.10 H ATOM 398 HB3 SER A 27 -6.952 -3.004 6.865 1.00 1.24 H ATOM 399 HG SER A 27 -7.300 -0.457 5.662 1.00 1.92 H ATOM 400 N LYS A 28 -3.502 -0.956 7.997 1.00 0.58 N ATOM 401 CA LYS A 28 -2.079 -1.293 8.146 1.00 0.67 C ATOM 402 C LYS A 28 -1.608 -2.201 7.011 1.00 0.71 C ATOM 403 O LYS A 28 -0.569 -2.852 7.107 1.00 1.02 O ATOM 404 CB LYS A 28 -1.807 -1.987 9.493 1.00 0.87 C ATOM 405 CG LYS A 28 -1.907 -1.086 10.720 1.00 0.96 C ATOM 406 CD LYS A 28 -3.334 -0.656 11.013 1.00 1.52 C ATOM 407 CE LYS A 28 -3.449 -0.040 12.398 1.00 2.26 C ATOM 408 NZ LYS A 28 -3.206 -1.044 13.469 1.00 2.89 N ATOM 409 H LYS A 28 -3.757 -0.015 7.936 1.00 0.56 H ATOM 410 HA LYS A 28 -1.516 -0.371 8.106 1.00 0.69 H ATOM 411 HB2 LYS A 28 -2.516 -2.790 9.613 1.00 0.92 H ATOM 412 HB3 LYS A 28 -0.809 -2.412 9.470 1.00 1.04 H ATOM 413 HG2 LYS A 28 -1.526 -1.623 11.575 1.00 1.60 H ATOM 414 HG3 LYS A 28 -1.301 -0.204 10.553 1.00 1.38 H ATOM 415 HD2 LYS A 28 -3.637 0.073 10.278 1.00 2.04 H ATOM 416 HD3 LYS A 28 -3.981 -1.519 10.959 1.00 1.96 H ATOM 417 HE2 LYS A 28 -2.718 0.752 12.486 1.00 2.45 H ATOM 418 HE3 LYS A 28 -4.442 0.370 12.515 1.00 2.90 H ATOM 419 HZ1 LYS A 28 -3.218 -0.583 14.405 1.00 3.47 H ATOM 420 HZ2 LYS A 28 -2.273 -1.500 13.335 1.00 3.23 H ATOM 421 HZ3 LYS A 28 -3.946 -1.778 13.448 1.00 3.04 H ATOM 422 N THR A 29 -2.364 -2.227 5.928 1.00 0.62 N ATOM 423 CA THR A 29 -2.111 -3.168 4.860 1.00 0.75 C ATOM 424 C THR A 29 -1.328 -2.522 3.723 1.00 0.68 C ATOM 425 O THR A 29 -1.721 -1.483 3.189 1.00 0.83 O ATOM 426 CB THR A 29 -3.439 -3.753 4.332 1.00 0.92 C ATOM 427 OG1 THR A 29 -4.157 -4.369 5.411 1.00 1.41 O ATOM 428 CG2 THR A 29 -3.194 -4.777 3.234 1.00 1.77 C ATOM 429 H THR A 29 -3.108 -1.594 5.846 1.00 0.69 H ATOM 430 HA THR A 29 -1.524 -3.980 5.268 1.00 0.91 H ATOM 431 HB THR A 29 -4.039 -2.947 3.927 1.00 1.34 H ATOM 432 HG1 THR A 29 -3.895 -3.964 6.250 1.00 1.78 H ATOM 433 HG21 THR A 29 -4.142 -5.172 2.895 1.00 2.37 H ATOM 434 HG22 THR A 29 -2.584 -5.581 3.620 1.00 2.06 H ATOM 435 HG23 THR A 29 -2.687 -4.303 2.409 1.00 2.37 H ATOM 436 N THR A 30 -0.202 -3.130 3.386 1.00 0.63 N ATOM 437 CA THR A 30 0.610 -2.670 2.280 1.00 0.64 C ATOM 438 C THR A 30 0.422 -3.594 1.081 1.00 0.68 C ATOM 439 O THR A 30 0.675 -4.798 1.172 1.00 0.96 O ATOM 440 CB THR A 30 2.099 -2.634 2.666 1.00 0.89 C ATOM 441 OG1 THR A 30 2.247 -2.146 4.006 1.00 1.55 O ATOM 442 CG2 THR A 30 2.878 -1.751 1.710 1.00 1.38 C ATOM 443 H THR A 30 0.089 -3.920 3.896 1.00 0.74 H ATOM 444 HA THR A 30 0.295 -1.670 2.017 1.00 0.62 H ATOM 445 HB THR A 30 2.495 -3.635 2.613 1.00 1.36 H ATOM 446 HG1 THR A 30 1.379 -1.928 4.362 1.00 2.11 H ATOM 447 HG21 THR A 30 2.774 -2.134 0.703 1.00 1.85 H ATOM 448 HG22 THR A 30 3.923 -1.748 1.987 1.00 1.85 H ATOM 449 HG23 THR A 30 2.491 -0.745 1.754 1.00 1.93 H ATOM 450 N THR A 31 -0.033 -3.041 -0.036 1.00 0.56 N ATOM 451 CA THR A 31 -0.269 -3.837 -1.226 1.00 0.70 C ATOM 452 C THR A 31 0.029 -3.016 -2.474 1.00 0.52 C ATOM 453 O THR A 31 0.114 -1.786 -2.415 1.00 0.73 O ATOM 454 CB THR A 31 -1.727 -4.366 -1.267 1.00 1.13 C ATOM 455 OG1 THR A 31 -1.909 -5.252 -2.380 1.00 1.79 O ATOM 456 CG2 THR A 31 -2.723 -3.214 -1.358 1.00 1.44 C ATOM 457 H THR A 31 -0.208 -2.071 -0.066 1.00 0.53 H ATOM 458 HA THR A 31 0.403 -4.682 -1.197 1.00 0.90 H ATOM 459 HB THR A 31 -1.918 -4.911 -0.355 1.00 1.69 H ATOM 460 HG1 THR A 31 -2.564 -5.922 -2.149 1.00 2.42 H ATOM 461 HG21 THR A 31 -2.533 -2.645 -2.256 1.00 1.80 H ATOM 462 HG22 THR A 31 -2.613 -2.573 -0.497 1.00 1.86 H ATOM 463 HG23 THR A 31 -3.731 -3.605 -1.390 1.00 1.99 H ATOM 464 N TRP A 32 0.203 -3.685 -3.601 1.00 0.51 N ATOM 465 CA TRP A 32 0.482 -2.979 -4.830 1.00 0.51 C ATOM 466 C TRP A 32 -0.817 -2.786 -5.600 1.00 1.01 C ATOM 467 O TRP A 32 -1.297 -3.704 -6.267 1.00 1.61 O ATOM 468 CB TRP A 32 1.502 -3.734 -5.689 1.00 0.75 C ATOM 469 CG TRP A 32 2.323 -2.827 -6.563 1.00 1.63 C ATOM 470 CD1 TRP A 32 3.661 -2.586 -6.451 1.00 2.54 C ATOM 471 CD2 TRP A 32 1.863 -2.020 -7.662 1.00 2.20 C ATOM 472 NE1 TRP A 32 4.063 -1.694 -7.412 1.00 3.61 N ATOM 473 CE2 TRP A 32 2.981 -1.332 -8.167 1.00 3.42 C ATOM 474 CE3 TRP A 32 0.620 -1.820 -8.272 1.00 1.94 C ATOM 475 CZ2 TRP A 32 2.894 -0.458 -9.245 1.00 4.29 C ATOM 476 CZ3 TRP A 32 0.533 -0.949 -9.340 1.00 2.79 C ATOM 477 CH2 TRP A 32 1.664 -0.279 -9.818 1.00 3.93 C ATOM 478 H TRP A 32 0.107 -4.662 -3.609 1.00 0.76 H ATOM 479 HA TRP A 32 0.885 -2.015 -4.567 1.00 0.90 H ATOM 480 HB2 TRP A 32 2.177 -4.276 -5.042 1.00 1.49 H ATOM 481 HB3 TRP A 32 0.979 -4.434 -6.323 1.00 1.07 H ATOM 482 HD1 TRP A 32 4.300 -3.042 -5.708 1.00 2.49 H ATOM 483 HE1 TRP A 32 4.978 -1.364 -7.536 1.00 4.42 H ATOM 484 HE3 TRP A 32 -0.266 -2.329 -7.917 1.00 1.33 H ATOM 485 HZ2 TRP A 32 3.760 0.066 -9.626 1.00 5.25 H ATOM 486 HZ3 TRP A 32 -0.419 -0.778 -9.820 1.00 2.69 H ATOM 487 HH2 TRP A 32 1.547 0.394 -10.655 1.00 4.59 H ATOM 488 N SER A 33 -1.394 -1.603 -5.481 1.00 1.63 N ATOM 489 CA SER A 33 -2.623 -1.287 -6.178 1.00 2.24 C ATOM 490 C SER A 33 -2.501 0.064 -6.867 1.00 1.53 C ATOM 491 O SER A 33 -1.973 1.015 -6.289 1.00 1.63 O ATOM 492 CB SER A 33 -3.802 -1.287 -5.200 1.00 3.57 C ATOM 493 OG SER A 33 -5.031 -1.117 -5.883 1.00 4.34 O ATOM 494 H SER A 33 -0.980 -0.923 -4.909 1.00 2.06 H ATOM 495 HA SER A 33 -2.785 -2.045 -6.928 1.00 2.66 H ATOM 496 HB2 SER A 33 -3.828 -2.229 -4.674 1.00 3.95 H ATOM 497 HB3 SER A 33 -3.685 -0.481 -4.490 1.00 4.03 H ATOM 498 HG SER A 33 -5.509 -1.961 -5.898 1.00 4.71 H ATOM 499 N LYS A 34 -2.951 0.142 -8.109 1.00 1.77 N ATOM 500 CA LYS A 34 -2.974 1.408 -8.825 1.00 1.47 C ATOM 501 C LYS A 34 -4.385 1.988 -8.774 1.00 1.59 C ATOM 502 O LYS A 34 -5.277 1.509 -9.475 1.00 2.57 O ATOM 503 CB LYS A 34 -2.523 1.220 -10.278 1.00 2.63 C ATOM 504 CG LYS A 34 -2.348 2.528 -11.049 1.00 3.48 C ATOM 505 CD LYS A 34 -0.946 3.120 -10.886 1.00 3.93 C ATOM 506 CE LYS A 34 -0.685 3.653 -9.484 1.00 4.11 C ATOM 507 NZ LYS A 34 0.707 4.168 -9.344 1.00 5.34 N ATOM 508 H LYS A 34 -3.295 -0.666 -8.545 1.00 2.58 H ATOM 509 HA LYS A 34 -2.297 2.086 -8.326 1.00 1.26 H ATOM 510 HB2 LYS A 34 -1.578 0.697 -10.285 1.00 3.25 H ATOM 511 HB3 LYS A 34 -3.257 0.621 -10.795 1.00 2.87 H ATOM 512 HG2 LYS A 34 -2.528 2.342 -12.098 1.00 3.83 H ATOM 513 HG3 LYS A 34 -3.074 3.242 -10.685 1.00 4.03 H ATOM 514 HD2 LYS A 34 -0.221 2.350 -11.097 1.00 4.01 H ATOM 515 HD3 LYS A 34 -0.823 3.928 -11.595 1.00 4.57 H ATOM 516 HE2 LYS A 34 -1.380 4.455 -9.282 1.00 3.63 H ATOM 517 HE3 LYS A 34 -0.838 2.853 -8.771 1.00 4.20 H ATOM 518 HZ1 LYS A 34 0.859 4.988 -9.971 1.00 5.75 H ATOM 519 HZ2 LYS A 34 1.393 3.423 -9.602 1.00 5.74 H ATOM 520 HZ3 LYS A 34 0.884 4.464 -8.361 1.00 5.70 H ATOM 521 N PRO A 35 -4.600 3.012 -7.930 1.00 1.21 N ATOM 522 CA PRO A 35 -5.928 3.601 -7.707 1.00 1.89 C ATOM 523 C PRO A 35 -6.526 4.210 -8.973 1.00 2.45 C ATOM 524 O PRO A 35 -5.898 5.038 -9.635 1.00 2.49 O ATOM 525 CB PRO A 35 -5.664 4.696 -6.654 1.00 1.88 C ATOM 526 CG PRO A 35 -4.357 4.333 -6.035 1.00 1.58 C ATOM 527 CD PRO A 35 -3.565 3.677 -7.127 1.00 1.33 C ATOM 528 HA PRO A 35 -6.616 2.873 -7.306 1.00 2.57 H ATOM 529 HB2 PRO A 35 -5.614 5.660 -7.142 1.00 2.00 H ATOM 530 HB3 PRO A 35 -6.459 4.696 -5.926 1.00 2.57 H ATOM 531 HG2 PRO A 35 -3.854 5.226 -5.691 1.00 1.72 H ATOM 532 HG3 PRO A 35 -4.513 3.646 -5.217 1.00 2.00 H ATOM 533 HD2 PRO A 35 -3.036 4.418 -7.710 1.00 1.84 H ATOM 534 HD3 PRO A 35 -2.874 2.955 -6.716 1.00 1.76 H