ATOM 30 N CYS A 3 0.121 -5.486 -2.528 1.00 11.43 N ATOM 31 CA CYS A 3 -1.145 -6.082 -2.137 1.00 30.21 C ATOM 32 C CYS A 3 -1.229 -6.073 -0.609 1.00 52.12 C ATOM 33 O CYS A 3 -0.454 -5.412 0.083 1.00 74.24 O ATOM 34 CB CYS A 3 -1.306 -7.492 -2.709 1.00 34.23 C ATOM 35 SG CYS A 3 -2.966 -7.858 -3.393 1.00 43.25 S ATOM 36 H CYS A 3 0.766 -6.112 -2.965 1.00 61.01 H ATOM 37 HA CYS A 3 -1.930 -5.464 -2.572 1.00 11.44 H ATOM 38 HB2 CYS A 3 -0.581 -7.655 -3.506 1.00 33.41 H ATOM 39 HB3 CYS A 3 -1.102 -8.233 -1.935 1.00 40.34 H ATOM 40 N TRP A 4 -2.195 -6.826 -0.096 1.00 24.43 N ATOM 41 CA TRP A 4 -2.404 -6.923 1.344 1.00 14.14 C ATOM 42 C TRP A 4 -2.054 -8.317 1.853 1.00 12.24 C ATOM 43 O TRP A 4 -1.784 -8.506 3.040 1.00 70.04 O ATOM 44 CB TRP A 4 -3.856 -6.589 1.693 1.00 61.14 C ATOM 45 CG TRP A 4 -4.848 -7.506 1.044 1.00 53.23 C ATOM 46 CD1 TRP A 4 -5.276 -7.465 -0.253 1.00 12.15 C ATOM 47 CD2 TRP A 4 -5.538 -8.598 1.662 1.00 44.03 C ATOM 48 NE1 TRP A 4 -6.190 -8.466 -0.478 1.00 12.14 N ATOM 49 CE2 TRP A 4 -6.367 -9.176 0.681 1.00 52.44 C ATOM 50 CE3 TRP A 4 -5.533 -9.146 2.947 1.00 14.53 C ATOM 51 CZ2 TRP A 4 -7.183 -10.271 0.948 1.00 74.54 C ATOM 52 CZ3 TRP A 4 -6.344 -10.233 3.211 1.00 73.02 C ATOM 53 CH2 TRP A 4 -7.159 -10.787 2.215 1.00 74.21 C ATOM 54 H TRP A 4 -2.781 -7.330 -0.699 1.00 24.20 H ATOM 55 HA TRP A 4 -1.755 -6.204 1.822 1.00 63.21 H ATOM 56 HB2 TRP A 4 -3.988 -6.658 2.762 1.00 51.00 H ATOM 57 HB3 TRP A 4 -4.072 -5.581 1.371 1.00 55.41 H ATOM 58 HD1 TRP A 4 -4.939 -6.744 -0.982 1.00 24.43 H ATOM 59 HE1 TRP A 4 -6.641 -8.643 -1.330 1.00 63.52 H ATOM 60 HE3 TRP A 4 -4.912 -8.733 3.728 1.00 0.52 H ATOM 61 HZ2 TRP A 4 -7.817 -10.710 0.191 1.00 62.34 H ATOM 62 HZ3 TRP A 4 -6.355 -10.669 4.199 1.00 64.41 H ATOM 63 HH2 TRP A 4 -7.777 -11.636 2.466 1.00 43.05 H ATOM 64 N LYS A 5 -2.060 -9.291 0.950 1.00 52.33 N ATOM 65 CA LYS A 5 -1.742 -10.668 1.306 1.00 24.14 C ATOM 66 C LYS A 5 -0.623 -11.214 0.425 1.00 42.33 C ATOM 67 O LYS A 5 0.181 -12.038 0.862 1.00 14.14 O ATOM 68 CB LYS A 5 -2.985 -11.551 1.176 1.00 63.11 C ATOM 69 CG LYS A 5 -3.323 -11.917 -0.259 1.00 21.11 C ATOM 70 CD LYS A 5 -3.864 -10.723 -1.026 1.00 52.53 C ATOM 71 CE LYS A 5 -5.124 -11.081 -1.800 1.00 64.41 C ATOM 72 NZ LYS A 5 -4.940 -12.312 -2.619 1.00 0.33 N1+ ATOM 73 H LYS A 5 -2.284 -9.078 0.019 1.00 43.51 H ATOM 74 HA LYS A 5 -1.411 -10.677 2.334 1.00 44.32 H ATOM 75 HB2 LYS A 5 -2.823 -12.464 1.730 1.00 41.02 H ATOM 76 HB3 LYS A 5 -3.829 -11.028 1.600 1.00 14.53 H ATOM 77 HG2 LYS A 5 -2.429 -12.272 -0.751 1.00 35.14 H ATOM 78 HG3 LYS A 5 -4.069 -12.699 -0.255 1.00 21.10 H ATOM 79 HD2 LYS A 5 -4.097 -9.932 -0.328 1.00 74.42 H ATOM 80 HD3 LYS A 5 -3.110 -10.380 -1.721 1.00 73.43 H ATOM 81 HE2 LYS A 5 -5.928 -11.243 -1.099 1.00 4.23 H ATOM 82 HE3 LYS A 5 -5.375 -10.259 -2.453 1.00 55.22 H ATOM 83 HZ1 LYS A 5 -5.540 -12.269 -3.467 1.00 54.00 H ATOM 84 HZ2 LYS A 5 -5.202 -13.152 -2.065 1.00 0.22 H ATOM 85 HZ3 LYS A 5 -3.947 -12.400 -2.914 1.00 2.12 H ATOM 86 N CYS A 6 -0.575 -10.748 -0.819 1.00 13.11 N ATOM 87 CA CYS A 6 0.445 -11.188 -1.762 1.00 44.23 C ATOM 88 C CYS A 6 1.841 -10.821 -1.264 1.00 74.43 C ATOM 89 O CYS A 6 2.066 -9.716 -0.773 1.00 75.21 O ATOM 90 CB CYS A 6 0.202 -10.563 -3.137 1.00 43.53 C ATOM 91 SG CYS A 6 -1.420 -10.967 -3.862 1.00 5.13 S ATOM 92 H CYS A 6 -1.244 -10.092 -1.110 1.00 2.30 H ATOM 93 HA CYS A 6 0.378 -12.262 -1.848 1.00 12.42 H ATOM 94 HB2 CYS A 6 0.264 -9.487 -3.051 1.00 73.32 H ATOM 95 HB3 CYS A 6 0.964 -10.908 -3.821 1.00 53.30 H ATOM 96 N GLY A 7 2.775 -11.758 -1.395 1.00 71.45 N ATOM 97 CA GLY A 7 4.136 -11.516 -0.955 1.00 1.53 C ATOM 98 C GLY A 7 4.894 -10.598 -1.893 1.00 64.25 C ATOM 99 O GLY A 7 5.488 -9.609 -1.463 1.00 32.12 O ATOM 100 H GLY A 7 2.538 -12.622 -1.795 1.00 12.33 H ATOM 101 HA2 GLY A 7 4.110 -11.067 0.027 1.00 24.32 H ATOM 102 HA3 GLY A 7 4.657 -12.460 -0.895 1.00 33.02 H ATOM 103 N LYS A 8 4.877 -10.927 -3.181 1.00 5.42 N ATOM 104 CA LYS A 8 5.569 -10.126 -4.184 1.00 72.03 C ATOM 105 C LYS A 8 5.194 -8.653 -4.058 1.00 54.12 C ATOM 106 O LYS A 8 6.038 -7.773 -4.221 1.00 55.54 O ATOM 107 CB LYS A 8 5.232 -10.630 -5.589 1.00 63.44 C ATOM 108 CG LYS A 8 3.758 -10.937 -5.789 1.00 21.03 C ATOM 109 CD LYS A 8 3.382 -10.936 -7.261 1.00 64.31 C ATOM 110 CE LYS A 8 2.034 -10.272 -7.492 1.00 33.22 C ATOM 111 NZ LYS A 8 2.030 -8.853 -7.041 1.00 50.23 N1+ ATOM 112 H LYS A 8 4.387 -11.727 -3.463 1.00 72.42 H ATOM 113 HA LYS A 8 6.630 -10.230 -4.018 1.00 63.23 H ATOM 114 HB2 LYS A 8 5.523 -9.878 -6.308 1.00 74.31 H ATOM 115 HB3 LYS A 8 5.795 -11.533 -5.779 1.00 71.30 H ATOM 116 HG2 LYS A 8 3.543 -11.911 -5.374 1.00 13.50 H ATOM 117 HG3 LYS A 8 3.171 -10.188 -5.276 1.00 45.44 H ATOM 118 HD2 LYS A 8 4.136 -10.397 -7.816 1.00 32.11 H ATOM 119 HD3 LYS A 8 3.336 -11.958 -7.612 1.00 50.53 H ATOM 120 HE2 LYS A 8 1.806 -10.307 -8.546 1.00 53.31 H ATOM 121 HE3 LYS A 8 1.280 -10.817 -6.943 1.00 22.43 H ATOM 122 HZ1 LYS A 8 1.317 -8.717 -6.296 1.00 51.43 H ATOM 123 HZ2 LYS A 8 1.805 -8.225 -7.839 1.00 71.22 H ATOM 124 HZ3 LYS A 8 2.964 -8.595 -6.664 1.00 30.02 H ATOM 125 N GLU A 9 3.923 -8.393 -3.765 1.00 60.55 N ATOM 126 CA GLU A 9 3.438 -7.026 -3.617 1.00 31.41 C ATOM 127 C GLU A 9 3.829 -6.176 -4.822 1.00 62.22 C ATOM 128 O GLU A 9 4.877 -5.531 -4.827 1.00 31.40 O ATOM 129 CB GLU A 9 3.993 -6.401 -2.336 1.00 5.22 C ATOM 130 CG GLU A 9 3.320 -6.905 -1.071 1.00 12.14 C ATOM 131 CD GLU A 9 3.743 -6.132 0.163 1.00 24.24 C ATOM 132 OE1 GLU A 9 4.828 -6.429 0.706 1.00 1.54 O ATOM 133 OE2 GLU A 9 2.990 -5.230 0.586 1.00 75.42 O ATOM 134 H GLU A 9 3.298 -9.138 -3.647 1.00 75.52 H ATOM 135 HA GLU A 9 2.361 -7.062 -3.551 1.00 40.03 H ATOM 136 HB2 GLU A 9 5.049 -6.621 -2.270 1.00 73.30 H ATOM 137 HB3 GLU A 9 3.861 -5.330 -2.386 1.00 65.14 H ATOM 138 HG2 GLU A 9 2.250 -6.811 -1.185 1.00 64.14 H ATOM 139 HG3 GLU A 9 3.576 -7.945 -0.932 1.00 32.04 H ATOM 140 N GLY A 10 2.978 -6.181 -5.844 1.00 64.42 N ATOM 141 CA GLY A 10 3.252 -5.408 -7.041 1.00 64.44 C ATOM 142 C GLY A 10 2.016 -4.717 -7.581 1.00 31.40 C ATOM 143 O GLY A 10 2.028 -3.511 -7.827 1.00 55.13 O ATOM 144 H GLY A 10 2.158 -6.715 -5.785 1.00 1.45 H ATOM 145 HA2 GLY A 10 3.998 -4.662 -6.812 1.00 1.00 H ATOM 146 HA3 GLY A 10 3.642 -6.070 -7.802 1.00 15.33 H ATOM 147 N HIS A 11 0.945 -5.483 -7.767 1.00 65.42 N ATOM 148 CA HIS A 11 -0.305 -4.937 -8.283 1.00 30.44 C ATOM 149 C HIS A 11 -1.169 -4.394 -7.148 1.00 71.35 C ATOM 150 O HIS A 11 -0.742 -4.356 -5.995 1.00 31.31 O ATOM 151 CB HIS A 11 -1.073 -6.009 -9.057 1.00 33.05 C ATOM 152 CG HIS A 11 -1.314 -7.260 -8.269 1.00 23.01 C ATOM 153 ND1 HIS A 11 -0.580 -8.414 -8.447 1.00 0.14 N ATOM 154 CD2 HIS A 11 -2.212 -7.533 -7.294 1.00 20.51 C ATOM 155 CE1 HIS A 11 -1.018 -9.344 -7.616 1.00 44.52 C ATOM 156 NE2 HIS A 11 -2.008 -8.835 -6.905 1.00 45.52 N ATOM 157 H HIS A 11 0.998 -6.438 -7.552 1.00 51.15 H ATOM 158 HA HIS A 11 -0.062 -4.127 -8.953 1.00 3.23 H ATOM 159 HB2 HIS A 11 -2.034 -5.612 -9.350 1.00 32.52 H ATOM 160 HB3 HIS A 11 -0.514 -6.276 -9.942 1.00 2.53 H ATOM 161 HD1 HIS A 11 0.151 -8.534 -9.087 1.00 43.01 H ATOM 162 HD2 HIS A 11 -2.953 -6.855 -6.895 1.00 50.32 H ATOM 163 HE1 HIS A 11 -0.632 -10.348 -7.532 1.00 60.50 H ATOM 164 N GLN A 12 -2.384 -3.975 -7.486 1.00 34.05 N ATOM 165 CA GLN A 12 -3.307 -3.433 -6.495 1.00 41.20 C ATOM 166 C GLN A 12 -4.293 -4.499 -6.029 1.00 1.24 C ATOM 167 O GLN A 12 -4.696 -5.367 -6.803 1.00 4.44 O ATOM 168 CB GLN A 12 -4.066 -2.238 -7.074 1.00 42.33 C ATOM 169 CG GLN A 12 -5.256 -1.807 -6.233 1.00 34.22 C ATOM 170 CD GLN A 12 -5.536 -0.321 -6.335 1.00 54.22 C ATOM 171 OE1 GLN A 12 -6.422 0.106 -7.077 1.00 3.21 O ATOM 172 NE2 GLN A 12 -4.781 0.477 -5.589 1.00 35.12 N ATOM 173 H GLN A 12 -2.667 -4.031 -8.422 1.00 21.24 H ATOM 174 HA GLN A 12 -2.726 -3.102 -5.647 1.00 71.14 H ATOM 175 HB2 GLN A 12 -3.388 -1.401 -7.156 1.00 31.14 H ATOM 176 HB3 GLN A 12 -4.424 -2.497 -8.059 1.00 73.44 H ATOM 177 HG2 GLN A 12 -6.131 -2.346 -6.567 1.00 2.13 H ATOM 178 HG3 GLN A 12 -5.057 -2.051 -5.200 1.00 34.23 H ATOM 179 HE21 GLN A 12 -4.094 0.066 -5.023 1.00 12.35 H ATOM 180 HE22 GLN A 12 -4.940 1.442 -5.636 1.00 72.20 H ATOM 181 N MET A 13 -4.677 -4.427 -4.758 1.00 54.14 N ATOM 182 CA MET A 13 -5.617 -5.386 -4.189 1.00 53.24 C ATOM 183 C MET A 13 -6.914 -5.418 -4.992 1.00 61.02 C ATOM 184 O MET A 13 -7.469 -6.486 -5.252 1.00 50.22 O ATOM 185 CB MET A 13 -5.916 -5.036 -2.730 1.00 43.44 C ATOM 186 CG MET A 13 -6.466 -3.631 -2.543 1.00 33.21 C ATOM 187 SD MET A 13 -6.524 -3.133 -0.811 1.00 23.21 S ATOM 188 CE MET A 13 -6.396 -1.353 -0.966 1.00 61.40 C ATOM 189 H MET A 13 -4.322 -3.712 -4.190 1.00 43.00 H ATOM 190 HA MET A 13 -5.159 -6.362 -4.229 1.00 64.42 H ATOM 191 HB2 MET A 13 -6.640 -5.738 -2.345 1.00 1.51 H ATOM 192 HB3 MET A 13 -5.004 -5.120 -2.158 1.00 61.41 H ATOM 193 HG2 MET A 13 -5.838 -2.937 -3.081 1.00 20.30 H ATOM 194 HG3 MET A 13 -7.467 -3.595 -2.947 1.00 71.33 H ATOM 195 HE1 MET A 13 -6.845 -0.883 -0.103 1.00 63.55 H ATOM 196 HE2 MET A 13 -5.355 -1.072 -1.029 1.00 12.32 H ATOM 197 HE3 MET A 13 -6.911 -1.032 -1.860 1.00 30.41 H ATOM 198 N LYS A 14 -7.392 -4.241 -5.382 1.00 73.44 N ATOM 199 CA LYS A 14 -8.623 -4.134 -6.157 1.00 32.14 C ATOM 200 C LYS A 14 -8.521 -4.929 -7.454 1.00 42.04 C ATOM 201 O LYS A 14 -9.506 -5.499 -7.924 1.00 21.25 O ATOM 202 CB LYS A 14 -8.928 -2.667 -6.467 1.00 52.04 C ATOM 203 CG LYS A 14 -10.335 -2.436 -6.992 1.00 64.13 C ATOM 204 CD LYS A 14 -10.422 -2.697 -8.487 1.00 2.42 C ATOM 205 CE LYS A 14 -11.390 -1.738 -9.164 1.00 65.31 C ATOM 206 NZ LYS A 14 -10.737 -0.446 -9.512 1.00 54.43 N1+ ATOM 207 H LYS A 14 -6.905 -3.425 -5.144 1.00 44.44 H ATOM 208 HA LYS A 14 -9.426 -4.542 -5.561 1.00 52.43 H ATOM 209 HB2 LYS A 14 -8.803 -2.087 -5.565 1.00 53.20 H ATOM 210 HB3 LYS A 14 -8.227 -2.316 -7.211 1.00 0.22 H ATOM 211 HG2 LYS A 14 -11.014 -3.102 -6.482 1.00 22.44 H ATOM 212 HG3 LYS A 14 -10.618 -1.411 -6.798 1.00 30.45 H ATOM 213 HD2 LYS A 14 -9.442 -2.569 -8.924 1.00 35.54 H ATOM 214 HD3 LYS A 14 -10.761 -3.710 -8.647 1.00 62.35 H ATOM 215 HE2 LYS A 14 -11.760 -2.199 -10.067 1.00 22.53 H ATOM 216 HE3 LYS A 14 -12.214 -1.547 -8.493 1.00 52.24 H ATOM 217 HZ1 LYS A 14 -9.748 -0.608 -9.790 1.00 33.21 H ATOM 218 HZ2 LYS A 14 -10.755 0.195 -8.694 1.00 2.33 H ATOM 219 HZ3 LYS A 14 -11.239 0.006 -10.304 1.00 3.05 H ATOM 220 N ASP A 15 -7.323 -4.964 -8.029 1.00 14.54 N ATOM 221 CA ASP A 15 -7.092 -5.691 -9.271 1.00 61.11 C ATOM 222 C ASP A 15 -6.522 -7.078 -8.991 1.00 33.14 C ATOM 223 O ASP A 15 -6.272 -7.856 -9.912 1.00 23.13 O ATOM 224 CB ASP A 15 -6.139 -4.908 -10.176 1.00 20.14 C ATOM 225 CG ASP A 15 -6.746 -3.610 -10.670 1.00 2.31 C ATOM 226 OD1 ASP A 15 -7.679 -3.669 -11.498 1.00 3.43 O ATOM 227 OD2 ASP A 15 -6.287 -2.535 -10.230 1.00 11.53 O ATOM 228 H ASP A 15 -6.577 -4.489 -7.606 1.00 42.12 H ATOM 229 HA ASP A 15 -8.041 -5.801 -9.773 1.00 53.51 H ATOM 230 HB2 ASP A 15 -5.239 -4.676 -9.625 1.00 30.14 H ATOM 231 HB3 ASP A 15 -5.885 -5.515 -11.032 1.00 35.51 H ATOM 232 N CYS A 16 -6.319 -7.381 -7.713 1.00 22.30 N ATOM 233 CA CYS A 16 -5.777 -8.673 -7.310 1.00 32.50 C ATOM 234 C CYS A 16 -6.691 -9.810 -7.759 1.00 31.22 C ATOM 235 O CYS A 16 -7.911 -9.652 -7.827 1.00 24.21 O ATOM 236 CB CYS A 16 -5.593 -8.722 -5.792 1.00 1.31 C ATOM 237 SG CYS A 16 -4.820 -10.255 -5.185 1.00 65.52 S ATOM 238 H CYS A 16 -6.538 -6.719 -7.023 1.00 72.23 H ATOM 239 HA CYS A 16 -4.815 -8.793 -7.785 1.00 13.24 H ATOM 240 HB2 CYS A 16 -4.966 -7.896 -5.487 1.00 15.02 H ATOM 241 HB3 CYS A 16 -6.558 -8.629 -5.317 1.00 31.24 H ATOM 242 N THR A 17 -6.093 -10.958 -8.064 1.00 50.41 N ATOM 243 CA THR A 17 -6.851 -12.121 -8.507 1.00 55.41 C ATOM 244 C THR A 17 -8.000 -12.425 -7.552 1.00 4.24 C ATOM 245 O THR A 17 -9.082 -12.828 -7.976 1.00 64.34 O ATOM 246 CB THR A 17 -5.953 -13.366 -8.624 1.00 63.05 C ATOM 247 OG1 THR A 17 -5.572 -13.820 -7.321 1.00 5.31 O ATOM 248 CG2 THR A 17 -4.708 -13.060 -9.444 1.00 74.14 C ATOM 249 H THR A 17 -5.118 -11.022 -7.990 1.00 10.40 H ATOM 250 HA THR A 17 -7.257 -11.902 -9.484 1.00 52.22 H ATOM 251 HB THR A 17 -6.510 -14.148 -9.121 1.00 2.21 H ATOM 252 HG1 THR A 17 -6.177 -14.506 -7.031 1.00 74.20 H ATOM 253 HG21 THR A 17 -4.997 -12.597 -10.376 1.00 63.42 H ATOM 254 HG22 THR A 17 -4.177 -13.978 -9.648 1.00 4.30 H ATOM 255 HG23 THR A 17 -4.069 -12.388 -8.891 1.00 71.32 H