ATOM 55 N GLN A 49 -5.367 0.345 -10.289 1.00 0.00 N ATOM 56 CA GLN A 49 -5.189 -0.175 -8.901 1.00 0.00 C ATOM 57 C GLN A 49 -3.922 0.463 -8.266 1.00 0.00 C ATOM 58 O GLN A 49 -3.763 0.465 -7.060 1.00 0.00 O ATOM 59 CB GLN A 49 -4.940 -1.716 -8.953 1.00 0.00 C ATOM 60 CG GLN A 49 -5.947 -2.448 -9.900 1.00 0.00 C ATOM 61 CD GLN A 49 -5.414 -2.422 -11.376 1.00 0.00 C ATOM 62 OE1 GLN A 49 -4.629 -1.580 -11.757 1.00 0.00 O ATOM 63 NE2 GLN A 49 -5.926 -3.394 -12.109 1.00 0.00 N ATOM 64 H GLN A 49 -5.189 -0.220 -11.081 1.00 0.00 H ATOM 65 HA GLN A 49 -6.020 0.086 -8.291 1.00 0.00 H ATOM 66 HB2 GLN A 49 -3.893 -1.868 -9.284 1.00 0.00 H ATOM 67 HB3 GLN A 49 -5.055 -2.094 -7.956 1.00 0.00 H ATOM 68 HG2 GLN A 49 -6.066 -3.565 -9.580 1.00 0.00 H ATOM 69 HG3 GLN A 49 -6.920 -1.944 -9.848 1.00 0.00 H ATOM 70 HE21 GLN A 49 -6.439 -4.167 -11.920 1.00 0.00 H ATOM 71 HE22 GLN A 49 -5.428 -3.880 -12.908 1.00 0.00 H ATOM 72 N CYS A 50 -2.980 0.868 -9.124 1.00 0.00 N ATOM 73 CA CYS A 50 -1.771 1.479 -8.512 1.00 0.00 C ATOM 74 C CYS A 50 -1.256 2.635 -9.381 1.00 0.00 C ATOM 75 O CYS A 50 -0.155 3.152 -9.160 1.00 0.00 O ATOM 76 CB CYS A 50 -0.647 0.402 -8.441 1.00 0.00 C ATOM 77 SG CYS A 50 0.955 0.900 -7.735 1.00 0.00 S ATOM 78 H CYS A 50 -3.054 0.776 -10.127 1.00 0.00 H ATOM 79 HA CYS A 50 -1.996 1.839 -7.509 1.00 0.00 H ATOM 80 HB2 CYS A 50 -1.025 -0.453 -7.876 1.00 0.00 H ATOM 81 HB3 CYS A 50 -0.467 0.052 -9.451 1.00 0.00 H ATOM 82 N GLU A 51 -2.119 3.141 -10.217 1.00 0.00 N ATOM 83 CA GLU A 51 -1.618 4.257 -11.069 1.00 0.00 C ATOM 84 C GLU A 51 -1.659 5.584 -10.310 1.00 0.00 C ATOM 85 O GLU A 51 -1.220 6.619 -10.818 1.00 0.00 O ATOM 86 CB GLU A 51 -2.523 4.370 -12.299 1.00 0.00 C ATOM 87 CG GLU A 51 -1.941 5.328 -13.315 1.00 0.00 C ATOM 88 CD GLU A 51 -2.772 5.309 -14.564 1.00 0.00 C ATOM 89 OE1 GLU A 51 -3.648 6.132 -14.614 1.00 0.00 O ATOM 90 OE2 GLU A 51 -2.304 4.638 -15.491 1.00 0.00 O ATOM 91 H GLU A 51 -3.049 2.834 -10.280 1.00 0.00 H ATOM 92 HA GLU A 51 -0.576 4.019 -11.377 1.00 0.00 H ATOM 93 HB2 GLU A 51 -2.633 3.381 -12.776 1.00 0.00 H ATOM 94 HB3 GLU A 51 -3.503 4.729 -12.009 1.00 0.00 H ATOM 95 HG2 GLU A 51 -1.930 6.338 -12.895 1.00 0.00 H ATOM 96 HG3 GLU A 51 -0.919 5.002 -13.562 1.00 0.00 H ATOM 97 N GLY A 52 -2.152 5.542 -9.080 1.00 0.00 N ATOM 98 CA GLY A 52 -2.208 6.829 -8.411 1.00 0.00 C ATOM 99 C GLY A 52 -1.576 6.754 -7.056 1.00 0.00 C ATOM 100 O GLY A 52 -1.737 7.641 -6.238 1.00 0.00 O ATOM 101 H GLY A 52 -2.468 4.689 -8.635 1.00 0.00 H ATOM 102 HA2 GLY A 52 -1.694 7.566 -9.005 1.00 0.00 H ATOM 103 HA3 GLY A 52 -3.249 7.117 -8.305 1.00 0.00 H ATOM 104 N HIS A 53 -0.753 5.697 -6.868 1.00 0.00 N ATOM 105 CA HIS A 53 -0.089 5.619 -5.531 1.00 0.00 C ATOM 106 C HIS A 53 -1.163 5.752 -4.396 1.00 0.00 C ATOM 107 O HIS A 53 -1.375 6.823 -3.858 1.00 0.00 O ATOM 108 CB HIS A 53 0.911 6.766 -5.402 1.00 0.00 C ATOM 109 CG HIS A 53 1.505 6.819 -3.994 1.00 0.00 C ATOM 110 ND1 HIS A 53 2.068 5.743 -3.605 1.00 0.00 N ATOM 111 CD2 HIS A 53 1.918 7.952 -3.450 1.00 0.00 C ATOM 112 CE1 HIS A 53 3.022 6.185 -2.763 1.00 0.00 C ATOM 113 NE2 HIS A 53 2.908 7.555 -2.647 1.00 0.00 N ATOM 114 H HIS A 53 -0.557 5.012 -7.614 1.00 0.00 H ATOM 115 HA HIS A 53 0.429 4.687 -5.439 1.00 0.00 H ATOM 116 HB2 HIS A 53 1.695 6.629 -6.119 1.00 0.00 H ATOM 117 HB3 HIS A 53 0.388 7.716 -5.614 1.00 0.00 H ATOM 118 HD1 HIS A 53 1.650 4.787 -3.644 1.00 0.00 H ATOM 119 HD2 HIS A 53 1.996 8.858 -4.026 1.00 0.00 H ATOM 120 HE1 HIS A 53 3.280 5.597 -1.903 1.00 0.00 H ATOM 121 HE2 HIS A 53 3.581 8.187 -2.157 1.00 0.00 H ATOM 122 N PRO A 54 -1.709 4.607 -3.960 1.00 0.00 N ATOM 123 CA PRO A 54 -2.810 4.609 -2.998 1.00 0.00 C ATOM 124 C PRO A 54 -2.278 4.350 -1.596 1.00 0.00 C ATOM 125 O PRO A 54 -2.888 4.786 -0.617 1.00 0.00 O ATOM 126 CB PRO A 54 -3.700 3.427 -3.395 1.00 0.00 C ATOM 127 CG PRO A 54 -2.915 2.579 -4.408 1.00 0.00 C ATOM 128 CD PRO A 54 -1.714 3.422 -4.842 1.00 0.00 C ATOM 129 HA PRO A 54 -3.363 5.539 -3.049 1.00 0.00 H ATOM 130 HB2 PRO A 54 -3.913 2.823 -2.509 1.00 0.00 H ATOM 131 HB3 PRO A 54 -4.631 3.766 -3.854 1.00 0.00 H ATOM 132 HG2 PRO A 54 -2.573 1.688 -3.936 1.00 0.00 H ATOM 133 HG3 PRO A 54 -3.511 2.321 -5.239 1.00 0.00 H ATOM 134 HD2 PRO A 54 -0.800 2.844 -4.725 1.00 0.00 H ATOM 135 HD3 PRO A 54 -1.834 3.714 -5.904 1.00 0.00 H ATOM 136 N CYS A 55 -1.154 3.666 -1.512 1.00 0.00 N ATOM 137 CA CYS A 55 -0.692 3.336 -0.112 1.00 0.00 C ATOM 138 C CYS A 55 -0.029 4.585 0.540 1.00 0.00 C ATOM 139 O CYS A 55 0.749 5.288 -0.082 1.00 0.00 O ATOM 140 CB CYS A 55 0.330 2.233 -0.203 1.00 0.00 C ATOM 141 SG CYS A 55 -0.192 0.688 -1.005 1.00 0.00 S ATOM 142 H CYS A 55 -0.648 3.369 -2.345 1.00 0.00 H ATOM 143 HA CYS A 55 -1.533 3.010 0.491 1.00 0.00 H ATOM 144 HB2 CYS A 55 1.198 2.615 -0.750 1.00 0.00 H ATOM 145 HB3 CYS A 55 0.648 1.999 0.800 1.00 0.00 H ATOM 146 N LEU A 56 -0.298 4.749 1.812 1.00 0.00 N ATOM 147 CA LEU A 56 0.285 5.911 2.479 1.00 0.00 C ATOM 148 C LEU A 56 1.688 5.563 3.030 1.00 0.00 C ATOM 149 O LEU A 56 2.161 4.457 2.885 1.00 0.00 O ATOM 150 CB LEU A 56 -0.595 6.287 3.685 1.00 0.00 C ATOM 151 CG LEU A 56 -1.886 6.989 3.295 1.00 0.00 C ATOM 152 CD1 LEU A 56 -2.779 7.038 4.533 1.00 0.00 C ATOM 153 CD2 LEU A 56 -1.626 8.409 2.741 1.00 0.00 C ATOM 154 H LEU A 56 -0.872 4.102 2.304 1.00 0.00 H ATOM 155 HA LEU A 56 0.368 6.754 1.797 1.00 0.00 H ATOM 156 HB2 LEU A 56 -0.858 5.392 4.224 1.00 0.00 H ATOM 157 HB3 LEU A 56 -0.045 6.944 4.338 1.00 0.00 H ATOM 158 HG LEU A 56 -2.375 6.412 2.516 1.00 0.00 H ATOM 159 HD11 LEU A 56 -2.255 7.580 5.324 1.00 0.00 H ATOM 160 HD12 LEU A 56 -3.702 7.473 4.298 1.00 0.00 H ATOM 161 HD13 LEU A 56 -2.992 6.017 4.874 1.00 0.00 H ATOM 162 HD21 LEU A 56 -1.233 8.329 1.724 1.00 0.00 H ATOM 163 HD22 LEU A 56 -2.564 8.960 2.727 1.00 0.00 H ATOM 164 HD23 LEU A 56 -0.927 8.940 3.399 1.00 0.00 H ATOM 165 N ASN A 57 2.306 6.594 3.606 1.00 0.00 N ATOM 166 CA ASN A 57 3.669 6.426 4.159 1.00 0.00 C ATOM 167 C ASN A 57 4.545 5.636 3.207 1.00 0.00 C ATOM 168 O ASN A 57 5.169 4.648 3.580 1.00 0.00 O ATOM 169 CB ASN A 57 3.596 5.689 5.541 1.00 0.00 C ATOM 170 CG ASN A 57 2.837 4.410 5.426 1.00 0.00 C ATOM 171 OD1 ASN A 57 3.390 3.335 5.171 1.00 0.00 O ATOM 172 ND2 ASN A 57 1.540 4.561 5.611 1.00 0.00 N ATOM 173 H ASN A 57 1.895 7.466 3.627 1.00 0.00 H ATOM 174 HA ASN A 57 4.099 7.445 4.317 1.00 0.00 H ATOM 175 HB2 ASN A 57 4.565 5.472 5.889 1.00 0.00 H ATOM 176 HB3 ASN A 57 3.102 6.319 6.279 1.00 0.00 H ATOM 177 HD21 ASN A 57 1.059 5.399 5.851 1.00 0.00 H ATOM 178 HD22 ASN A 57 0.822 3.852 5.540 1.00 0.00 H ATOM 179 N GLN A 58 4.668 6.127 1.987 1.00 0.00 N ATOM 180 CA GLN A 58 5.574 5.480 1.143 1.00 0.00 C ATOM 181 C GLN A 58 5.359 3.935 1.118 1.00 0.00 C ATOM 182 O GLN A 58 6.300 3.194 0.829 1.00 0.00 O ATOM 183 CB GLN A 58 7.001 5.758 1.659 1.00 0.00 C ATOM 184 CG GLN A 58 8.048 5.806 0.540 1.00 0.00 C ATOM 185 CD GLN A 58 9.465 6.092 1.085 1.00 0.00 C ATOM 186 OE1 GLN A 58 9.858 7.097 1.472 1.00 0.00 O ATOM 187 NE2 GLN A 58 10.155 4.976 1.145 1.00 0.00 N ATOM 188 H GLN A 58 4.179 6.900 1.701 1.00 0.00 H ATOM 189 HA GLN A 58 5.460 5.895 0.179 1.00 0.00 H ATOM 190 HB2 GLN A 58 7.003 6.809 2.200 1.00 0.00 H ATOM 191 HB3 GLN A 58 7.317 5.016 2.383 1.00 0.00 H ATOM 192 HG2 GLN A 58 8.073 4.803 0.034 1.00 0.00 H ATOM 193 HG3 GLN A 58 7.885 6.563 -0.301 1.00 0.00 H ATOM 194 HE21 GLN A 58 10.010 3.899 0.886 1.00 0.00 H ATOM 195 HE22 GLN A 58 11.153 4.855 1.540 1.00 0.00 H ATOM 196 N GLY A 59 4.123 3.496 1.336 1.00 0.00 N ATOM 197 CA GLY A 59 3.962 2.057 1.240 1.00 0.00 C ATOM 198 C GLY A 59 4.107 1.574 -0.211 1.00 0.00 C ATOM 199 O GLY A 59 4.527 2.269 -1.110 1.00 0.00 O ATOM 200 H GLY A 59 3.378 4.094 1.585 1.00 0.00 H ATOM 201 HA2 GLY A 59 4.733 1.556 1.868 1.00 0.00 H ATOM 202 HA3 GLY A 59 2.967 1.781 1.603 1.00 0.00 H ATOM 203 N HIS A 60 3.889 0.285 -0.334 1.00 0.00 N ATOM 204 CA HIS A 60 4.095 -0.307 -1.698 1.00 0.00 C ATOM 205 C HIS A 60 2.742 -0.698 -2.286 1.00 0.00 C ATOM 206 O HIS A 60 1.832 -1.105 -1.559 1.00 0.00 O ATOM 207 CB HIS A 60 4.921 -1.594 -1.562 1.00 0.00 C ATOM 208 CG HIS A 60 5.268 -2.171 -2.945 1.00 0.00 C ATOM 209 ND1 HIS A 60 4.386 -2.921 -3.478 1.00 0.00 N ATOM 210 CD2 HIS A 60 6.184 -1.622 -3.726 1.00 0.00 C ATOM 211 CE1 HIS A 60 4.726 -2.885 -4.786 1.00 0.00 C ATOM 212 NE2 HIS A 60 5.848 -2.077 -4.938 1.00 0.00 N ATOM 213 H HIS A 60 3.567 -0.259 0.437 1.00 0.00 H ATOM 214 HA HIS A 60 4.600 0.401 -2.335 1.00 0.00 H ATOM 215 HB2 HIS A 60 5.868 -1.384 -1.015 1.00 0.00 H ATOM 216 HB3 HIS A 60 4.368 -2.343 -1.004 1.00 0.00 H ATOM 217 HD1 HIS A 60 3.876 -3.692 -3.001 1.00 0.00 H ATOM 218 HD2 HIS A 60 6.475 -0.594 -3.576 1.00 0.00 H ATOM 219 HE1 HIS A 60 4.585 -3.746 -5.428 1.00 0.00 H ATOM 220 HE2 HIS A 60 6.448 -2.045 -5.778 1.00 0.00 H ATOM 221 N CYS A 61 2.607 -0.592 -3.622 1.00 0.00 N ATOM 222 CA CYS A 61 1.332 -1.098 -4.191 1.00 0.00 C ATOM 223 C CYS A 61 1.653 -2.071 -5.335 1.00 0.00 C ATOM 224 O CYS A 61 2.133 -1.674 -6.391 1.00 0.00 O ATOM 225 CB CYS A 61 0.543 0.051 -4.759 1.00 0.00 C ATOM 226 SG CYS A 61 1.426 1.159 -5.896 1.00 0.00 S ATOM 227 H CYS A 61 3.346 -0.232 -4.206 1.00 0.00 H ATOM 228 HA CYS A 61 0.763 -1.607 -3.428 1.00 0.00 H ATOM 229 HB2 CYS A 61 -0.316 -0.366 -5.269 1.00 0.00 H ATOM 230 HB3 CYS A 61 0.182 0.648 -3.934 1.00 0.00 H ATOM 231 N LYS A 62 1.433 -3.353 -5.092 1.00 0.00 N ATOM 232 CA LYS A 62 1.720 -4.278 -6.220 1.00 0.00 C ATOM 233 C LYS A 62 0.450 -4.483 -7.034 1.00 0.00 C ATOM 234 O LYS A 62 -0.593 -4.963 -6.521 1.00 0.00 O ATOM 235 CB LYS A 62 2.164 -5.654 -5.677 1.00 0.00 C ATOM 236 CG LYS A 62 2.504 -6.667 -6.839 1.00 0.00 C ATOM 237 CD LYS A 62 3.885 -6.326 -7.482 1.00 0.00 C ATOM 238 CE LYS A 62 4.179 -7.314 -8.650 1.00 0.00 C ATOM 239 NZ LYS A 62 5.613 -7.159 -9.059 1.00 0.00 N ATOM 240 H LYS A 62 1.117 -3.661 -4.228 1.00 0.00 H ATOM 241 HA LYS A 62 2.497 -3.882 -6.837 1.00 0.00 H ATOM 242 HB2 LYS A 62 3.042 -5.517 -5.062 1.00 0.00 H ATOM 243 HB3 LYS A 62 1.372 -6.058 -5.057 1.00 0.00 H ATOM 244 HG2 LYS A 62 2.539 -7.676 -6.434 1.00 0.00 H ATOM 245 HG3 LYS A 62 1.726 -6.612 -7.609 1.00 0.00 H ATOM 246 HD2 LYS A 62 3.861 -5.299 -7.880 1.00 0.00 H ATOM 247 HD3 LYS A 62 4.662 -6.422 -6.731 1.00 0.00 H ATOM 248 HE2 LYS A 62 4.002 -8.348 -8.308 1.00 0.00 H ATOM 249 HE3 LYS A 62 3.529 -7.090 -9.490 1.00 0.00 H ATOM 250 HZ1 LYS A 62 5.852 -7.864 -9.778 1.00 0.00 H ATOM 251 HZ2 LYS A 62 5.761 -6.211 -9.455 1.00 0.00 H ATOM 252 HZ3 LYS A 62 6.210 -7.287 -8.241 1.00 0.00 H ATOM 253 N ASP A 63 0.555 -4.150 -8.296 1.00 0.00 N ATOM 254 CA ASP A 63 -0.667 -4.322 -9.110 1.00 0.00 C ATOM 255 C ASP A 63 -0.826 -5.814 -9.519 1.00 0.00 C ATOM 256 O ASP A 63 0.173 -6.553 -9.695 1.00 0.00 O ATOM 257 CB ASP A 63 -0.498 -3.496 -10.434 1.00 0.00 C ATOM 258 CG ASP A 63 -1.702 -3.721 -11.379 1.00 0.00 C ATOM 259 OD1 ASP A 63 -2.790 -3.567 -10.897 1.00 0.00 O ATOM 260 OD2 ASP A 63 -1.444 -4.135 -12.496 1.00 0.00 O ATOM 261 H ASP A 63 1.447 -3.796 -8.726 1.00 0.00 H ATOM 262 HA ASP A 63 -1.591 -3.979 -8.546 1.00 0.00 H ATOM 263 HB2 ASP A 63 -0.361 -2.437 -10.176 1.00 0.00 H ATOM 264 N GLY A 64 -2.084 -6.220 -9.746 1.00 0.00 N ATOM 265 CA GLY A 64 -2.252 -7.578 -10.243 1.00 0.00 C ATOM 266 C GLY A 64 -3.752 -7.846 -10.509 1.00 0.00 C ATOM 267 O GLY A 64 -4.279 -7.593 -11.617 1.00 0.00 O ATOM 268 H GLY A 64 -2.840 -5.629 -9.576 1.00 0.00 H ATOM 269 HA2 GLY A 64 -1.707 -7.705 -11.172 1.00 0.00 H ATOM 270 HA3 GLY A 64 -1.876 -8.332 -9.510 1.00 0.00 H ATOM 271 N ILE A 65 -4.408 -8.411 -9.444 1.00 0.00 N ATOM 272 CA ILE A 65 -5.862 -8.621 -9.592 1.00 0.00 C ATOM 273 C ILE A 65 -6.591 -7.272 -9.707 1.00 0.00 C ATOM 274 O ILE A 65 -5.952 -6.217 -9.646 1.00 0.00 O ATOM 275 CB ILE A 65 -6.330 -9.390 -8.272 1.00 0.00 C ATOM 276 CG1 ILE A 65 -5.575 -10.736 -8.133 1.00 0.00 C ATOM 277 CG2 ILE A 65 -7.827 -9.665 -8.423 1.00 0.00 C ATOM 278 CD1 ILE A 65 -5.903 -11.349 -6.717 1.00 0.00 C ATOM 279 H ILE A 65 -3.941 -8.681 -8.657 1.00 0.00 H ATOM 280 HA ILE A 65 -6.049 -9.218 -10.441 1.00 0.00 H ATOM 281 HB ILE A 65 -6.160 -8.765 -7.387 1.00 0.00 H ATOM 282 HG12 ILE A 65 -5.886 -11.428 -8.918 1.00 0.00 H ATOM 283 HG13 ILE A 65 -4.523 -10.564 -8.208 1.00 0.00 H ATOM 284 HG21 ILE A 65 -7.999 -10.208 -9.367 1.00 0.00 H ATOM 285 HG22 ILE A 65 -8.189 -10.274 -7.596 1.00 0.00 H ATOM 286 HG23 ILE A 65 -8.361 -8.731 -8.451 1.00 0.00 H ATOM 287 HD11 ILE A 65 -5.210 -12.161 -6.498 1.00 0.00 H ATOM 288 HD12 ILE A 65 -5.800 -10.575 -5.958 1.00 0.00 H ATOM 289 HD13 ILE A 65 -6.930 -11.743 -6.703 1.00 0.00 H ATOM 290 N GLY A 66 -7.891 -7.322 -9.976 1.00 0.00 N ATOM 291 CA GLY A 66 -8.513 -5.993 -10.088 1.00 0.00 C ATOM 292 C GLY A 66 -8.218 -5.132 -8.855 1.00 0.00 C ATOM 293 O GLY A 66 -8.340 -3.883 -8.877 1.00 0.00 O ATOM 294 H GLY A 66 -8.403 -8.181 -10.130 1.00 0.00 H ATOM 295 HA2 GLY A 66 -8.128 -5.501 -10.961 1.00 0.00 H ATOM 296 HA3 GLY A 66 -9.597 -6.097 -10.195 1.00 0.00 H ATOM 297 N ASP A 67 -7.904 -5.819 -7.783 1.00 0.00 N ATOM 298 CA ASP A 67 -7.460 -5.034 -6.623 1.00 0.00 C ATOM 299 C ASP A 67 -5.954 -5.217 -6.446 1.00 0.00 C ATOM 300 O ASP A 67 -5.427 -6.347 -6.469 1.00 0.00 O ATOM 301 CB ASP A 67 -8.134 -5.554 -5.417 1.00 0.00 C ATOM 302 CG ASP A 67 -9.633 -5.206 -5.470 1.00 0.00 C ATOM 303 OD1 ASP A 67 -9.883 -4.018 -5.338 1.00 0.00 O ATOM 304 OD2 ASP A 67 -10.388 -6.114 -5.605 1.00 0.00 O ATOM 305 H ASP A 67 -7.951 -6.829 -7.789 1.00 0.00 H ATOM 306 HA ASP A 67 -7.680 -3.968 -6.756 1.00 0.00 H ATOM 307 HB2 ASP A 67 -7.997 -6.637 -5.358 1.00 0.00 H ATOM 308 HB3 ASP A 67 -7.696 -5.058 -4.532 1.00 0.00 H ATOM 309 N TYR A 68 -5.267 -4.090 -6.196 1.00 0.00 N ATOM 310 CA TYR A 68 -3.834 -4.240 -6.004 1.00 0.00 C ATOM 311 C TYR A 68 -3.571 -4.782 -4.607 1.00 0.00 C ATOM 312 O TYR A 68 -4.494 -5.212 -3.933 1.00 0.00 O ATOM 313 CB TYR A 68 -3.197 -2.883 -6.060 1.00 0.00 C ATOM 314 CG TYR A 68 -3.863 -1.978 -5.078 1.00 0.00 C ATOM 315 CD1 TYR A 68 -5.129 -1.431 -5.362 1.00 0.00 C ATOM 316 CD2 TYR A 68 -3.356 -1.843 -3.757 1.00 0.00 C ATOM 317 CE1 TYR A 68 -5.863 -0.831 -4.369 1.00 0.00 C ATOM 318 CE2 TYR A 68 -4.157 -1.309 -2.739 1.00 0.00 C ATOM 319 CZ TYR A 68 -5.395 -0.807 -3.043 1.00 0.00 C ATOM 320 OH TYR A 68 -6.190 -0.312 -2.021 1.00 0.00 O ATOM 321 H TYR A 68 -5.706 -3.171 -6.197 1.00 0.00 H ATOM 322 HA TYR A 68 -3.416 -4.923 -6.769 1.00 0.00 H ATOM 323 HB2 TYR A 68 -2.140 -2.968 -5.843 1.00 0.00 H ATOM 324 HB3 TYR A 68 -3.297 -2.512 -7.051 1.00 0.00 H ATOM 325 HD1 TYR A 68 -5.562 -1.512 -6.371 1.00 0.00 H ATOM 326 HD2 TYR A 68 -2.406 -2.310 -3.474 1.00 0.00 H ATOM 327 HE1 TYR A 68 -6.835 -0.433 -4.596 1.00 0.00 H ATOM 328 HE2 TYR A 68 -3.782 -1.316 -1.708 1.00 0.00 H ATOM 329 HH TYR A 68 -6.679 -1.041 -1.643 1.00 0.00 H ATOM 330 N THR A 69 -2.314 -4.711 -4.168 1.00 0.00 N ATOM 331 CA THR A 69 -2.172 -5.076 -2.741 1.00 0.00 C ATOM 332 C THR A 69 -1.259 -4.069 -2.072 1.00 0.00 C ATOM 333 O THR A 69 -0.155 -3.768 -2.587 1.00 0.00 O ATOM 334 CB THR A 69 -1.494 -6.451 -2.629 1.00 0.00 C ATOM 335 OG1 THR A 69 -0.609 -6.518 -3.755 1.00 0.00 O ATOM 336 CG2 THR A 69 -2.543 -7.566 -2.658 1.00 0.00 C ATOM 337 H THR A 69 -1.554 -4.381 -4.745 1.00 0.00 H ATOM 338 HA THR A 69 -3.163 -5.076 -2.233 1.00 0.00 H ATOM 339 HB THR A 69 -0.932 -6.528 -1.706 1.00 0.00 H ATOM 340 HG1 THR A 69 -0.326 -7.429 -3.883 1.00 0.00 H ATOM 341 HG21 THR A 69 -2.062 -8.525 -2.592 1.00 0.00 H ATOM 342 HG22 THR A 69 -3.231 -7.427 -1.806 1.00 0.00 H ATOM 343 HG23 THR A 69 -3.101 -7.515 -3.606 1.00 0.00 H ATOM 344 N CYS A 70 -1.687 -3.594 -0.885 1.00 0.00 N ATOM 345 CA CYS A 70 -0.815 -2.602 -0.250 1.00 0.00 C ATOM 346 C CYS A 70 0.165 -3.316 0.654 1.00 0.00 C ATOM 347 O CYS A 70 -0.223 -3.928 1.652 1.00 0.00 O ATOM 348 CB CYS A 70 -1.622 -1.630 0.601 1.00 0.00 C ATOM 349 SG CYS A 70 -2.340 -0.222 -0.299 1.00 0.00 S ATOM 350 H CYS A 70 -2.540 -3.919 -0.456 1.00 0.00 H ATOM 351 HA CYS A 70 -0.283 -2.031 -0.989 1.00 0.00 H ATOM 352 HB2 CYS A 70 -2.419 -2.183 1.035 1.00 0.00 H ATOM 353 HB3 CYS A 70 -0.993 -1.224 1.390 1.00 0.00 H ATOM 354 N THR A 71 1.439 -3.308 0.267 1.00 0.00 N ATOM 355 CA THR A 71 2.373 -3.948 1.190 1.00 0.00 C ATOM 356 C THR A 71 3.019 -2.865 2.074 1.00 0.00 C ATOM 357 O THR A 71 3.743 -1.996 1.568 1.00 0.00 O ATOM 358 CB THR A 71 3.480 -4.658 0.392 1.00 0.00 C ATOM 359 OG1 THR A 71 2.732 -5.626 -0.383 1.00 0.00 O ATOM 360 CG2 THR A 71 4.442 -5.331 1.372 1.00 0.00 C ATOM 361 H THR A 71 1.739 -2.870 -0.581 1.00 0.00 H ATOM 362 HA THR A 71 1.826 -4.667 1.811 1.00 0.00 H ATOM 363 HB THR A 71 3.988 -3.967 -0.263 1.00 0.00 H ATOM 364 HG1 THR A 71 3.342 -6.292 -0.723 1.00 0.00 H ATOM 365 HG21 THR A 71 5.161 -5.922 0.807 1.00 0.00 H ATOM 366 HG22 THR A 71 4.956 -4.580 1.968 1.00 0.00 H ATOM 367 HG23 THR A 71 3.870 -6.006 2.071 1.00 0.00 H ATOM 368 N CYS A 72 2.821 -2.961 3.383 1.00 0.00 N ATOM 369 CA CYS A 72 3.337 -1.793 4.172 1.00 0.00 C ATOM 370 C CYS A 72 4.772 -2.036 4.539 1.00 0.00 C ATOM 371 O CYS A 72 5.232 -3.225 4.584 1.00 0.00 O ATOM 372 CB CYS A 72 2.536 -1.684 5.457 1.00 0.00 C ATOM 373 SG CYS A 72 0.748 -1.533 5.243 1.00 0.00 S ATOM 374 H CYS A 72 2.413 -3.779 3.820 1.00 0.00 H ATOM 375 HA CYS A 72 3.226 -0.832 3.577 1.00 0.00 H ATOM 376 HB2 CYS A 72 2.722 -2.564 6.020 1.00 0.00 H ATOM 377 HB3 CYS A 72 2.890 -0.800 6.039 1.00 0.00 H ATOM 378 N ALA A 73 5.499 -0.940 4.804 1.00 0.00 N ATOM 379 CA ALA A 73 6.858 -1.189 5.220 1.00 0.00 C ATOM 380 C ALA A 73 6.898 -1.575 6.656 1.00 0.00 C ATOM 381 O ALA A 73 5.857 -1.745 7.314 1.00 0.00 O ATOM 382 CB ALA A 73 7.676 0.081 5.095 1.00 0.00 C ATOM 383 H ALA A 73 5.166 -0.045 4.681 1.00 0.00 H ATOM 384 HA ALA A 73 7.265 -1.921 4.654 1.00 0.00 H ATOM 385 HB1 ALA A 73 8.693 -0.109 5.458 1.00 0.00 H ATOM 386 HB2 ALA A 73 7.647 0.428 4.086 1.00 0.00 H ATOM 387 HB3 ALA A 73 7.305 0.847 5.759 1.00 0.00 H ATOM 388 N GLU A 74 8.093 -1.903 7.114 1.00 0.00 N ATOM 389 CA GLU A 74 8.152 -2.290 8.495 1.00 0.00 C ATOM 390 C GLU A 74 7.637 -1.137 9.392 1.00 0.00 C ATOM 391 O GLU A 74 8.055 0.045 9.217 1.00 0.00 O ATOM 392 CB GLU A 74 9.606 -2.561 8.862 1.00 0.00 C ATOM 393 CG GLU A 74 9.690 -3.206 10.241 1.00 0.00 C ATOM 394 CD GLU A 74 11.158 -3.493 10.589 1.00 0.00 C ATOM 395 OE1 GLU A 74 11.612 -4.525 10.127 1.00 0.00 O ATOM 396 OE2 GLU A 74 11.755 -2.598 11.191 1.00 0.00 O ATOM 397 H GLU A 74 8.908 -1.893 6.547 1.00 0.00 H ATOM 398 HA GLU A 74 7.577 -3.193 8.644 1.00 0.00 H ATOM 399 HB2 GLU A 74 10.040 -3.227 8.167 1.00 0.00 H ATOM 400 HB3 GLU A 74 10.149 -1.621 8.897 1.00 0.00 H ATOM 401 HG2 GLU A 74 9.272 -2.537 11.003 1.00 0.00 H ATOM 402 HG3 GLU A 74 9.153 -4.121 10.231 1.00 0.00 H ATOM 403 N GLY A 75 6.772 -1.491 10.361 1.00 0.00 N ATOM 404 CA GLY A 75 6.267 -0.367 11.220 1.00 0.00 C ATOM 405 C GLY A 75 5.161 0.391 10.504 1.00 0.00 C ATOM 406 O GLY A 75 4.854 1.543 10.806 1.00 0.00 O ATOM 407 H GLY A 75 6.453 -2.427 10.455 1.00 0.00 H ATOM 408 HA2 GLY A 75 5.858 -0.747 12.129 1.00 0.00 H ATOM 409 HA3 GLY A 75 7.105 0.311 11.436 1.00 0.00 H ATOM 410 N PHE A 76 4.517 -0.312 9.590 1.00 0.00 N ATOM 411 CA PHE A 76 3.323 0.323 9.035 1.00 0.00 C ATOM 412 C PHE A 76 2.278 -0.723 8.825 1.00 0.00 C ATOM 413 O PHE A 76 2.573 -1.855 8.433 1.00 0.00 O ATOM 414 CB PHE A 76 3.624 0.969 7.710 1.00 0.00 C ATOM 415 CG PHE A 76 4.680 2.022 7.920 1.00 0.00 C ATOM 416 CD1 PHE A 76 4.344 3.300 8.391 1.00 0.00 C ATOM 417 CD2 PHE A 76 6.015 1.703 7.776 1.00 0.00 C ATOM 418 CE1 PHE A 76 5.353 4.228 8.690 1.00 0.00 C ATOM 419 CE2 PHE A 76 7.017 2.616 8.063 1.00 0.00 C ATOM 420 CZ PHE A 76 6.683 3.899 8.500 1.00 0.00 C ATOM 421 H PHE A 76 4.796 -1.254 9.322 1.00 0.00 H ATOM 422 HA PHE A 76 2.969 1.074 9.694 1.00 0.00 H ATOM 423 HB2 PHE A 76 3.958 0.227 7.007 1.00 0.00 H ATOM 424 HB3 PHE A 76 2.706 1.442 7.316 1.00 0.00 H ATOM 425 HD1 PHE A 76 3.312 3.537 8.605 1.00 0.00 H ATOM 426 HD2 PHE A 76 6.285 0.713 7.462 1.00 0.00 H ATOM 427 HE1 PHE A 76 5.085 5.227 9.090 1.00 0.00 H ATOM 428 HE2 PHE A 76 8.051 2.352 7.923 1.00 0.00 H ATOM 429 HZ PHE A 76 7.440 4.630 8.684 1.00 0.00 H ATOM 430 N GLU A 77 1.063 -0.352 9.112 1.00 0.00 N ATOM 431 CA GLU A 77 -0.002 -1.400 8.963 1.00 0.00 C ATOM 432 C GLU A 77 -1.269 -0.738 8.469 1.00 0.00 C ATOM 433 O GLU A 77 -1.363 0.491 8.381 1.00 0.00 O ATOM 434 CB GLU A 77 -0.351 -2.073 10.326 1.00 0.00 C ATOM 435 CG GLU A 77 0.889 -2.523 11.111 1.00 0.00 C ATOM 436 CD GLU A 77 1.581 -3.679 10.431 1.00 0.00 C ATOM 437 OE1 GLU A 77 0.858 -4.415 9.706 1.00 0.00 O ATOM 438 OE2 GLU A 77 2.772 -3.808 10.694 1.00 0.00 O ATOM 439 H GLU A 77 0.848 0.604 9.341 1.00 0.00 H ATOM 440 HA GLU A 77 0.314 -2.157 8.253 1.00 0.00 H ATOM 441 HB2 GLU A 77 -0.877 -1.374 10.926 1.00 0.00 H ATOM 442 HB3 GLU A 77 -0.983 -2.938 10.156 1.00 0.00 H ATOM 443 HG2 GLU A 77 1.597 -1.660 11.198 1.00 0.00 H ATOM 444 HG3 GLU A 77 0.567 -2.844 12.143 1.00 0.00 H ATOM 445 N GLY A 78 -2.304 -1.523 8.451 1.00 0.00 N ATOM 446 CA GLY A 78 -3.526 -0.939 7.930 1.00 0.00 C ATOM 447 C GLY A 78 -3.615 -1.128 6.415 1.00 0.00 C ATOM 448 O GLY A 78 -2.662 -1.499 5.723 1.00 0.00 O ATOM 449 H GLY A 78 -2.252 -2.462 8.735 1.00 0.00 H ATOM 450 HA2 GLY A 78 -4.363 -1.383 8.409 1.00 0.00 H ATOM 451 HA3 GLY A 78 -3.531 0.147 8.168 1.00 0.00 H ATOM 452 N LYS A 79 -4.788 -0.754 5.887 1.00 0.00 N ATOM 453 CA LYS A 79 -4.906 -0.904 4.446 1.00 0.00 C ATOM 454 C LYS A 79 -3.925 0.027 3.755 1.00 0.00 C ATOM 455 O LYS A 79 -3.172 -0.394 2.852 1.00 0.00 O ATOM 456 CB LYS A 79 -6.330 -0.487 4.034 1.00 0.00 C ATOM 457 CG LYS A 79 -6.600 -0.690 2.559 1.00 0.00 C ATOM 458 CD LYS A 79 -6.683 -2.187 2.267 1.00 0.00 C ATOM 459 CE LYS A 79 -7.194 -2.437 0.823 1.00 0.00 C ATOM 460 NZ LYS A 79 -7.398 -3.889 0.606 1.00 0.00 N ATOM 461 H LYS A 79 -5.539 -0.378 6.455 1.00 0.00 H ATOM 462 HA LYS A 79 -4.733 -1.871 4.176 1.00 0.00 H ATOM 463 HB2 LYS A 79 -7.067 -1.055 4.612 1.00 0.00 H ATOM 464 HB3 LYS A 79 -6.443 0.557 4.257 1.00 0.00 H ATOM 465 HG2 LYS A 79 -7.570 -0.195 2.292 1.00 0.00 H ATOM 466 HG3 LYS A 79 -5.793 -0.241 1.997 1.00 0.00 H ATOM 467 HD2 LYS A 79 -5.692 -2.626 2.385 1.00 0.00 H ATOM 468 HD3 LYS A 79 -7.367 -2.655 2.972 1.00 0.00 H ATOM 469 HE2 LYS A 79 -8.146 -1.904 0.706 1.00 0.00 H ATOM 470 HE3 LYS A 79 -6.466 -2.058 0.114 1.00 0.00 H ATOM 471 HZ1 LYS A 79 -8.330 -4.044 0.288 1.00 0.00 H ATOM 472 HZ2 LYS A 79 -6.703 -4.221 -0.089 1.00 0.00 H ATOM 473 HZ3 LYS A 79 -7.277 -4.404 1.517 1.00 0.00 H ATOM 474 N ASN A 80 -3.909 1.237 4.195 1.00 0.00 N ATOM 475 CA ASN A 80 -2.959 2.127 3.556 1.00 0.00 C ATOM 476 C ASN A 80 -1.571 1.897 4.123 1.00 0.00 C ATOM 477 O ASN A 80 -0.604 2.451 3.621 1.00 0.00 O ATOM 478 CB ASN A 80 -3.292 3.495 3.938 1.00 0.00 C ATOM 479 CG ASN A 80 -4.578 3.916 3.390 1.00 0.00 C ATOM 480 OD1 ASN A 80 -5.669 3.652 3.892 1.00 0.00 O ATOM 481 ND2 ASN A 80 -4.385 4.859 2.600 1.00 0.00 N ATOM 482 H ASN A 80 -4.552 1.574 4.843 1.00 0.00 H ATOM 483 HA ASN A 80 -2.963 2.019 2.515 1.00 0.00 H ATOM 484 HB2 ASN A 80 -3.332 3.574 4.991 1.00 0.00 H ATOM 485 HB3 ASN A 80 -2.539 4.170 3.593 1.00 0.00 H ATOM 486 HD21 ASN A 80 -3.494 5.149 2.300 1.00 0.00 H ATOM 487 HD22 ASN A 80 -5.003 5.642 2.479 1.00 0.00 H ATOM 488 N CYS A 81 -1.498 1.244 5.284 1.00 0.00 N ATOM 489 CA CYS A 81 -0.207 1.334 5.983 1.00 0.00 C ATOM 490 C CYS A 81 -0.230 2.621 6.847 1.00 0.00 C ATOM 491 O CYS A 81 0.806 3.102 7.269 1.00 0.00 O ATOM 492 CB CYS A 81 0.961 1.400 4.968 1.00 0.00 C ATOM 493 SG CYS A 81 0.880 0.216 3.620 1.00 0.00 S ATOM 494 H CYS A 81 -2.292 0.769 5.676 1.00 0.00 H ATOM 495 HA CYS A 81 -0.089 0.464 6.621 1.00 0.00 H ATOM 496 HB2 CYS A 81 0.974 2.374 4.530 1.00 0.00 H ATOM 497 HB3 CYS A 81 1.867 1.251 5.493 1.00 0.00 H ATOM 498 N GLU A 82 -1.451 3.112 7.086 1.00 0.00 N ATOM 499 CA GLU A 82 -1.541 4.330 7.827 1.00 0.00 C ATOM 500 C GLU A 82 -0.831 4.230 9.190 1.00 0.00 C ATOM 501 O GLU A 82 -0.454 5.271 9.752 1.00 0.00 O ATOM 502 CB GLU A 82 -3.006 4.625 8.090 1.00 0.00 C ATOM 503 CG GLU A 82 -3.770 3.442 8.648 1.00 0.00 C ATOM 504 CD GLU A 82 -5.206 3.857 8.944 1.00 0.00 C ATOM 505 OE1 GLU A 82 -5.386 4.361 10.023 1.00 0.00 O ATOM 506 OE2 GLU A 82 -5.996 3.732 8.035 1.00 0.00 O ATOM 507 H GLU A 82 -2.283 2.633 6.795 1.00 0.00 H ATOM 508 HA GLU A 82 -1.121 5.139 7.245 1.00 0.00 H ATOM 509 HB2 GLU A 82 -3.053 5.441 8.775 1.00 0.00 H ATOM 510 HB3 GLU A 82 -3.468 4.932 7.162 1.00 0.00 H ATOM 511 HG2 GLU A 82 -3.775 2.615 7.954 1.00 0.00 H ATOM 512 HG3 GLU A 82 -3.277 3.103 9.578 1.00 0.00 H ATOM 513 N PHE A 83 -0.796 3.024 9.748 1.00 0.00 N ATOM 514 CA PHE A 83 -0.217 2.981 11.126 1.00 0.00 C ATOM 515 C PHE A 83 1.290 3.023 11.056 1.00 0.00 C ATOM 516 O PHE A 83 1.872 2.817 9.995 1.00 0.00 O ATOM 517 CB PHE A 83 -0.579 1.670 11.809 1.00 0.00 C ATOM 518 CG PHE A 83 -2.042 1.611 12.141 1.00 0.00 C ATOM 519 CD1 PHE A 83 -2.572 2.415 13.124 1.00 0.00 C ATOM 520 CD2 PHE A 83 -2.882 0.755 11.451 1.00 0.00 C ATOM 521 CE1 PHE A 83 -3.915 2.346 13.429 1.00 0.00 C ATOM 522 CE2 PHE A 83 -4.208 0.643 11.788 1.00 0.00 C ATOM 523 CZ PHE A 83 -4.723 1.424 12.794 1.00 0.00 C ATOM 524 H PHE A 83 -1.089 2.185 9.302 1.00 0.00 H ATOM 525 HA PHE A 83 -0.579 3.821 11.700 1.00 0.00 H ATOM 526 HB2 PHE A 83 -0.333 0.851 11.136 1.00 0.00 H ATOM 527 HB3 PHE A 83 0.006 1.595 12.741 1.00 0.00 H ATOM 528 HD1 PHE A 83 -1.924 3.138 13.609 1.00 0.00 H ATOM 529 HD2 PHE A 83 -2.478 0.144 10.653 1.00 0.00 H ATOM 530 HE1 PHE A 83 -4.309 3.013 14.186 1.00 0.00 H ATOM 531 HE2 PHE A 83 -4.841 -0.077 11.277 1.00 0.00 H ATOM 532 HZ PHE A 83 -5.793 1.332 13.064 1.00 0.00 H ATOM 533 N SER A 84 1.906 3.347 12.171 1.00 0.00 N ATOM 534 CA SER A 84 3.344 3.174 12.155 1.00 0.00 C ATOM 535 C SER A 84 3.720 2.201 13.298 1.00 0.00 C ATOM 536 O SER A 84 4.852 2.202 13.766 1.00 0.00 O ATOM 537 CB SER A 84 4.016 4.538 12.378 1.00 0.00 C ATOM 538 OG SER A 84 5.445 4.388 12.303 1.00 0.00 O ATOM 539 H SER A 84 1.411 3.637 12.991 1.00 0.00 H ATOM 540 HA SER A 84 3.647 2.777 11.183 1.00 0.00 H ATOM 541 HB2 SER A 84 3.672 5.224 11.595 1.00 0.00 H ATOM 542 HB3 SER A 84 3.738 4.928 13.376 1.00 0.00 H ATOM 543 HG SER A 84 5.683 3.914 11.494 1.00 0.00 H ATOM 544 N THR A 85 2.778 1.304 13.602 1.00 0.00 N ATOM 545 CA THR A 85 3.039 0.387 14.814 1.00 0.00 C ATOM 546 C THR A 85 3.599 1.175 15.989 1.00 0.00 C ATOM 547 O THR A 85 4.105 0.573 16.950 1.00 0.00 O ATOM 548 CB THR A 85 4.058 -0.691 14.385 1.00 0.00 C ATOM 549 OG1 THR A 85 5.295 0.025 14.264 1.00 0.00 O ATOM 550 CG2 THR A 85 3.562 -1.250 13.040 1.00 0.00 C ATOM 551 H THR A 85 1.913 1.220 13.032 1.00 0.00 H ATOM 552 HA THR A 85 2.077 -0.098 15.123 1.00 0.00 H ATOM 553 HB THR A 85 4.138 -1.473 15.139 1.00 0.00 H ATOM 554 HG1 THR A 85 5.652 0.162 15.124 1.00 0.00 H ATOM 555 HG21 THR A 85 3.576 -0.462 12.307 1.00 0.00 H ATOM 556 HG22 THR A 85 4.195 -2.033 12.715 1.00 0.00 H ATOM 557 HG23 THR A 85 2.528 -1.601 13.154 1.00 0.00 H ATOM 558 N ARG A 86 3.392 2.445 15.953 1.00 0.00 N ATOM 559 CA ARG A 86 3.798 3.210 17.140 1.00 0.00 C ATOM 560 C ARG A 86 3.289 2.514 18.464 1.00 0.00 C ATOM 561 O ARG A 86 2.163 2.098 18.454 1.00 0.00 O ATOM 562 CB ARG A 86 3.168 4.602 17.051 1.00 0.00 C ATOM 563 CG ARG A 86 3.484 5.443 18.283 1.00 0.00 C ATOM 564 CD ARG A 86 2.867 6.828 18.145 1.00 0.00 C ATOM 565 NE ARG A 86 2.962 7.525 19.413 1.00 0.00 N ATOM 566 CZ ARG A 86 4.119 7.956 19.935 1.00 0.00 C ATOM 567 NH1 ARG A 86 5.233 7.819 19.239 1.00 0.00 N ATOM 568 NH2 ARG A 86 4.123 8.401 21.173 1.00 0.00 N ATOM 569 OXT ARG A 86 4.034 2.567 19.428 1.00 0.00 O ATOM 570 H ARG A 86 2.971 2.888 15.145 1.00 0.00 H ATOM 571 HA ARG A 86 4.872 3.319 17.159 1.00 0.00 H ATOM 572 HB2 ARG A 86 3.569 5.118 16.156 1.00 0.00 H ATOM 573 HB3 ARG A 86 2.099 4.485 16.972 1.00 0.00 H ATOM 574 HG2 ARG A 86 3.089 4.947 19.192 1.00 0.00 H ATOM 575 HG3 ARG A 86 4.551 5.530 18.362 1.00 0.00 H ATOM 576 HD2 ARG A 86 3.426 7.375 17.397 1.00 0.00 H ATOM 577 HD3 ARG A 86 1.778 6.748 17.898 1.00 0.00 H ATOM 578 HE ARG A 86 2.078 7.640 19.926 1.00 0.00 H ATOM 579 HH11 ARG A 86 5.403 8.094 18.189 1.00 0.00 H ATOM 580 HH12 ARG A 86 6.177 7.768 19.626 1.00 0.00 H ATOM 581 HH21 ARG A 86 3.580 7.825 21.837 1.00 0.00 H ATOM 582 HH22 ARG A 86 4.557 9.392 21.285 1.00 0.00 H