NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
635700 | 6g99 | 34258 | cing | 1-original | 6 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 GLY 414 H1 GLY 414 -3.511 2.187 -20.416 2 H2 GLY 414 H2 GLY 414 -2.175 1.317 -20.011 3 H3 GLY 414 H3 GLY 414 -2.574 2.657 -19.148 4 HA2 GLY 414 HA2 GLY 414 -4.143 0.172 -19.289 5 HA3 GLY 414 HA3 GLY 414 -3.144 0.680 -17.914 6 HA PRO 415 HA PRO 415 -7.559 2.345 -17.602 7 HB2 PRO 415 HB2 PRO 415 -8.474 0.769 -15.554 8 HB3 PRO 415 HB3 PRO 415 -8.563 0.282 -17.279 9 HG2 PRO 415 HG2 PRO 415 -6.516 -0.518 -15.198 10 HG3 PRO 415 HG3 PRO 415 -7.347 -1.554 -16.406 11 HD2 PRO 415 HD2 PRO 415 -4.813 -0.556 -16.783 12 HD3 PRO 415 HD3 PRO 415 -5.956 -0.831 -18.137 13 H LEU 416 H LEU 416 -4.783 1.825 -15.587 14 HA LEU 416 HA LEU 416 -5.725 3.203 -13.227 15 HB2 LEU 416 HB2 LEU 416 -2.915 2.668 -14.249 16 HB3 LEU 416 HB3 LEU 416 -3.326 3.188 -12.607 17 HG LEU 416 HG LEU 416 -4.243 0.578 -13.905 18 HD11 LEU 416 HD11 LEU 416 -2.168 1.132 -11.746 19 HD12 LEU 416 HD12 LEU 416 -2.678 -0.477 -12.317 20 HD13 LEU 416 HD13 LEU 416 -1.818 0.622 -13.416 21 HD21 LEU 416 HD21 LEU 416 -4.952 0.011 -11.580 22 HD22 LEU 416 HD22 LEU 416 -4.548 1.665 -11.066 23 HD23 LEU 416 HD23 LEU 416 -5.861 1.388 -12.236 24 H GLY 417 H GLY 417 -4.759 5.250 -12.426 25 HA2 GLY 417 HA2 GLY 417 -3.574 7.145 -14.221 26 HA3 GLY 417 HA3 GLY 417 -5.323 7.421 -14.098 27 H SER 418 H SER 418 -4.006 9.498 -13.242 28 HA SER 418 HA SER 418 -3.099 9.366 -10.506 29 HB2 SER 418 HB2 SER 418 -3.873 11.706 -12.294 30 HB3 SER 418 HB3 SER 418 -3.077 11.840 -10.705 31 HG SER 418 HG SER 418 -1.581 11.845 -12.440 32 H GLY 419 H GLY 419 -6.214 9.083 -11.746 33 HA2 GLY 419 HA2 GLY 419 -7.667 10.830 -9.966 34 HA3 GLY 419 HA3 GLY 419 -8.326 9.483 -10.906 35 H GLN 420 H GLN 420 -8.915 10.261 -8.133 36 HA GLN 420 HA GLN 420 -8.414 7.656 -6.830 37 HB2 GLN 420 HB2 GLN 420 -7.741 10.329 -5.534 38 HB3 GLN 420 HB3 GLN 420 -7.720 8.749 -4.729 39 HG2 GLN 420 HG2 GLN 420 -5.993 7.988 -6.406 40 HG3 GLN 420 HG3 GLN 420 -5.922 9.650 -7.010 41 HE21 GLN 420 HE21 GLN 420 -3.163 9.736 -4.701 42 HE22 GLN 420 HE22 GLN 420 -3.584 9.343 -6.355 43 H GLN 421 H GLN 421 -9.714 7.530 -4.746 44 HA GLN 421 HA GLN 421 -12.003 9.372 -4.579 45 HB2 GLN 421 HB2 GLN 421 -12.822 7.679 -6.134 46 HB3 GLN 421 HB3 GLN 421 -12.258 6.380 -5.069 47 HG2 GLN 421 HG2 GLN 421 -14.645 6.633 -4.772 48 HG3 GLN 421 HG3 GLN 421 -13.837 7.169 -3.301 49 HE21 GLN 421 HE21 GLN 421 -16.224 9.832 -3.640 50 HE22 GLN 421 HE22 GLN 421 -15.959 8.250 -2.933 51 H ARG 422 H ARG 422 -12.620 9.665 -2.457 52 HA ARG 422 HA ARG 422 -11.646 7.738 -0.421 53 HB2 ARG 422 HB2 ARG 422 -11.053 10.723 -0.402 54 HB3 ARG 422 HB3 ARG 422 -10.713 9.598 0.926 55 HG2 ARG 422 HG2 ARG 422 -9.207 8.295 -0.583 56 HG3 ARG 422 HG3 ARG 422 -9.508 9.478 -1.874 57 HD2 ARG 422 HD2 ARG 422 -8.677 11.277 -0.310 58 HD3 ARG 422 HD3 ARG 422 -8.216 10.000 0.827 59 HE ARG 422 HE ARG 422 -7.146 10.056 -1.967 60 HH11 ARG 422 HH11 ARG 422 -6.587 10.171 1.527 61 HH12 ARG 422 HH12 ARG 422 -4.861 9.947 1.370 62 HH21 ARG 422 HH21 ARG 422 -4.906 9.715 -2.129 63 HH22 ARG 422 HH22 ARG 422 -3.910 9.668 -0.693 64 H ALA 423 H ALA 423 -12.731 7.876 1.602 65 HA ALA 423 HA ALA 423 -15.499 8.523 1.387 66 HB1 ALA 423 HB1 ALA 423 -13.766 8.049 3.852 67 HB2 ALA 423 HB2 ALA 423 -15.545 8.003 3.805 68 HB3 ALA 423 HB3 ALA 423 -14.602 6.796 2.905 69 H GLY 424 H GLY 424 -16.564 10.388 1.685 70 HA2 GLY 424 HA2 GLY 424 -16.985 12.399 2.941 71 HA3 GLY 424 HA3 GLY 424 -15.236 12.596 3.176 72 H ASP 425 H ASP 425 -15.160 11.613 0.112 73 HA ASP 425 HA ASP 425 -14.954 14.173 -1.093 74 HB2 ASP 425 HB2 ASP 425 -15.361 11.406 -2.258 75 HB3 ASP 425 HB3 ASP 425 -15.072 12.846 -3.236 76 H TRP 426 H TRP 426 -16.282 15.067 -2.893 77 HA TRP 426 HA TRP 426 -19.114 14.281 -2.806 78 HB2 TRP 426 HB2 TRP 426 -19.876 16.465 -2.077 79 HB3 TRP 426 HB3 TRP 426 -18.855 15.706 -0.855 80 HD1 TRP 426 HD1 TRP 426 -16.450 16.780 -0.413 81 HE1 TRP 426 HE1 TRP 426 -15.498 19.114 -0.787 82 HE3 TRP 426 HE3 TRP 426 -19.958 18.560 -3.666 83 HZ2 TRP 426 HZ2 TRP 426 -16.164 21.473 -2.327 84 HZ3 TRP 426 HZ3 TRP 426 -19.769 20.855 -4.579 85 HH2 TRP 426 HH2 TRP 426 -17.897 22.320 -3.908 86 H LYS 427 H LYS 427 -20.324 15.048 -4.551 87 HA LYS 427 HA LYS 427 -18.657 16.006 -6.801 88 HB2 LYS 427 HB2 LYS 427 -20.215 13.920 -6.847 89 HB3 LYS 427 HB3 LYS 427 -21.540 15.095 -6.941 90 HG2 LYS 427 HG2 LYS 427 -20.203 16.155 -8.903 91 HG3 LYS 427 HG3 LYS 427 -19.223 14.678 -8.862 92 HD2 LYS 427 HD2 LYS 427 -20.958 14.368 -10.520 93 HD3 LYS 427 HD3 LYS 427 -21.379 13.360 -9.120 94 HE2 LYS 427 HE2 LYS 427 -22.915 15.155 -8.323 95 HE3 LYS 427 HE3 LYS 427 -22.478 16.145 -9.724 96 HZ1 LYS 427 HZ1 LYS 427 -24.512 14.973 -10.101 97 HZ2 LYS 427 HZ2 LYS 427 -23.369 14.400 -11.132 98 HZ3 LYS 427 HZ3 LYS 427 -23.799 13.518 -9.812 99 H CYS 428 H CYS 428 -19.219 17.819 -8.042 100 HA CYS 428 HA CYS 428 -20.251 20.033 -6.632 101 HB2 CYS 428 HB2 CYS 428 -18.652 20.099 -8.534 102 HB3 CYS 428 HB3 CYS 428 -19.973 19.638 -9.635 103 HA PRO 429 HA PRO 429 -24.599 19.177 -7.188 104 HB2 PRO 429 HB2 PRO 429 -25.629 21.472 -6.120 105 HB3 PRO 429 HB3 PRO 429 -24.855 20.200 -5.120 106 HG2 PRO 429 HG2 PRO 429 -23.651 22.782 -6.150 107 HG3 PRO 429 HG3 PRO 429 -23.542 22.074 -4.504 108 HD2 PRO 429 HD2 PRO 429 -21.563 21.784 -6.397 109 HD3 PRO 429 HD3 PRO 429 -21.917 20.520 -5.180 110 H ASN 430 H ASN 430 -22.808 21.731 -8.724 111 HA ASN 430 HA ASN 430 -24.980 23.016 -10.094 112 HB2 ASN 430 HB2 ASN 430 -22.323 23.541 -9.681 113 HB3 ASN 430 HB3 ASN 430 -22.271 22.917 -11.340 114 HD21 ASN 430 HD21 ASN 430 -22.649 26.585 -11.548 115 HD22 ASN 430 HD22 ASN 430 -21.468 25.453 -10.920 116 HA PRO 431 HA PRO 431 -25.557 19.596 -12.982 117 HB2 PRO 431 HB2 PRO 431 -27.367 20.827 -14.664 118 HB3 PRO 431 HB3 PRO 431 -27.803 20.124 -13.069 119 HG2 PRO 431 HG2 PRO 431 -27.230 23.010 -13.774 120 HG3 PRO 431 HG3 PRO 431 -28.536 22.347 -12.732 121 HD2 PRO 431 HD2 PRO 431 -26.236 23.415 -11.724 122 HD3 PRO 431 HD3 PRO 431 -27.074 22.042 -10.930 123 H THR 432 H THR 432 -24.436 22.831 -13.630 124 HA THR 432 HA THR 432 -23.529 22.135 -16.327 125 HB THR 432 HB THR 432 -23.061 24.373 -16.681 126 HG1 THR 432 HG1 THR 432 -22.773 25.827 -14.966 127 HG21 THR 432 HG21 THR 432 -25.288 24.485 -14.599 128 HG22 THR 432 HG22 THR 432 -25.009 25.622 -15.937 129 HG23 THR 432 HG23 THR 432 -25.507 23.951 -16.283 130 H CYS 433 H CYS 433 -22.412 21.337 -13.375 131 HA CYS 433 HA CYS 433 -19.546 21.637 -14.154 132 HB2 CYS 433 HB2 CYS 433 -20.258 23.073 -12.243 133 HB3 CYS 433 HB3 CYS 433 -20.767 21.603 -11.374 134 H GLU 434 H GLU 434 -21.458 19.803 -11.737 135 HA GLU 434 HA GLU 434 -21.332 17.661 -11.012 136 HB2 GLU 434 HB2 GLU 434 -21.082 17.135 -13.995 137 HB3 GLU 434 HB3 GLU 434 -21.453 15.912 -12.763 138 HG2 GLU 434 HG2 GLU 434 -23.434 17.230 -12.056 139 HG3 GLU 434 HG3 GLU 434 -23.108 18.396 -13.354 140 H ASN 435 H ASN 435 -18.656 19.188 -11.523 141 HA ASN 435 HA ASN 435 -16.714 17.119 -11.998 142 HB2 ASN 435 HB2 ASN 435 -16.255 19.557 -12.258 143 HB3 ASN 435 HB3 ASN 435 -16.461 19.771 -10.514 144 HD21 ASN 435 HD21 ASN 435 -13.070 19.124 -9.928 145 HD22 ASN 435 HD22 ASN 435 -14.529 19.999 -9.512 146 H MET 436 H MET 436 -15.501 15.885 -10.504 147 HA MET 436 HA MET 436 -16.799 15.502 -7.903 148 HB2 MET 436 HB2 MET 436 -15.860 13.666 -9.478 149 HB3 MET 436 HB3 MET 436 -14.264 14.164 -8.888 150 HG2 MET 436 HG2 MET 436 -15.019 12.367 -7.467 151 HG3 MET 436 HG3 MET 436 -15.143 13.857 -6.528 152 HE1 MET 436 HE1 MET 436 -16.587 11.732 -5.135 153 HE2 MET 436 HE2 MET 436 -16.807 13.467 -4.783 154 HE3 MET 436 HE3 MET 436 -18.223 12.405 -4.931 155 H ASN 437 H ASN 437 -15.941 16.152 -5.902 156 HA ASN 437 HA ASN 437 -13.456 17.790 -6.065 157 HB2 ASN 437 HB2 ASN 437 -15.964 18.354 -4.445 158 HB3 ASN 437 HB3 ASN 437 -14.500 19.340 -4.467 159 HD21 ASN 437 HD21 ASN 437 -17.352 20.039 -7.182 160 HD22 ASN 437 HD22 ASN 437 -17.572 19.106 -5.714 161 H PHE 438 H PHE 438 -12.044 17.712 -4.346 162 HA PHE 438 HA PHE 438 -12.004 15.312 -2.803 163 HB2 PHE 438 HB2 PHE 438 -10.373 17.864 -2.607 164 HB3 PHE 438 HB3 PHE 438 -10.078 16.430 -1.636 165 HD1 PHE 438 HD1 PHE 438 -8.102 17.786 -3.468 166 HD2 PHE 438 HD2 PHE 438 -10.820 14.528 -4.177 167 HE1 PHE 438 HE1 PHE 438 -6.548 16.858 -5.171 168 HE2 PHE 438 HE2 PHE 438 -9.288 13.626 -5.890 169 HZ PHE 438 HZ PHE 438 -7.137 14.792 -6.384 170 H SER 439 H SER 439 -11.947 15.062 -0.478 171 HA SER 439 HA SER 439 -14.400 15.963 0.592 172 HB2 SER 439 HB2 SER 439 -13.359 13.847 1.228 173 HB3 SER 439 HB3 SER 439 -11.960 14.704 1.911 174 HG SER 439 HG SER 439 -14.646 14.906 2.805 175 H TRP 440 H TRP 440 -11.107 17.292 0.911 176 HA TRP 440 HA TRP 440 -11.836 18.875 3.238 177 HB2 TRP 440 HB2 TRP 440 -9.540 19.843 2.898 178 HB3 TRP 440 HB3 TRP 440 -9.623 18.107 3.193 179 HD1 TRP 440 HD1 TRP 440 -8.746 16.502 1.337 180 HE1 TRP 440 HE1 TRP 440 -7.417 16.807 -0.806 181 HE3 TRP 440 HE3 TRP 440 -9.352 21.543 0.761 182 HZ2 TRP 440 HZ2 TRP 440 -6.613 19.015 -2.530 183 HZ3 TRP 440 HZ3 TRP 440 -8.306 22.716 -1.132 184 HH2 TRP 440 HH2 TRP 440 -6.908 21.464 -2.779 185 H ARG 441 H ARG 441 -12.378 19.279 -0.113 186 HA ARG 441 HA ARG 441 -12.200 22.190 -0.087 187 HB2 ARG 441 HB2 ARG 441 -13.456 20.205 -2.021 188 HB3 ARG 441 HB3 ARG 441 -13.491 21.960 -2.244 189 HG2 ARG 441 HG2 ARG 441 -10.986 21.994 -2.108 190 HG3 ARG 441 HG3 ARG 441 -11.005 20.214 -2.063 191 HD2 ARG 441 HD2 ARG 441 -12.215 20.190 -4.240 192 HD3 ARG 441 HD3 ARG 441 -12.199 21.954 -4.271 193 HE ARG 441 HE ARG 441 -10.039 20.139 -4.949 194 HH11 ARG 441 HH11 ARG 441 -10.785 23.391 -3.796 195 HH12 ARG 441 HH12 ARG 441 -9.249 24.058 -4.306 196 HH21 ARG 441 HH21 ARG 441 -8.056 21.018 -5.607 197 HH22 ARG 441 HH22 ARG 441 -7.709 22.716 -5.360 198 H ASN 442 H ASN 442 -13.879 23.676 0.055 199 HA ASN 442 HA ASN 442 -16.487 22.591 1.018 200 HB2 ASN 442 HB2 ASN 442 -15.111 25.249 1.558 201 HB3 ASN 442 HB3 ASN 442 -16.759 24.849 2.065 202 HD21 ASN 442 HD21 ASN 442 -14.149 24.127 4.779 203 HD22 ASN 442 HD22 ASN 442 -14.374 25.505 3.720 204 H GLU 443 H GLU 443 -14.953 23.907 -1.663 205 HA GLU 443 HA GLU 443 -17.565 24.655 -2.825 206 HB2 GLU 443 HB2 GLU 443 -15.052 26.355 -3.018 207 HB3 GLU 443 HB3 GLU 443 -16.571 26.637 -3.897 208 HG2 GLU 443 HG2 GLU 443 -17.764 26.906 -1.739 209 HG3 GLU 443 HG3 GLU 443 -16.231 26.688 -0.874 210 H CYS 444 H CYS 444 -17.497 24.692 -5.189 211 HA CYS 444 HA CYS 444 -16.281 22.336 -6.195 212 HB2 CYS 444 HB2 CYS 444 -18.390 23.295 -7.026 213 HB3 CYS 444 HB3 CYS 444 -17.508 24.698 -7.665 214 H ASN 445 H ASN 445 -14.637 22.025 -7.714 215 HA ASN 445 HA ASN 445 -12.405 23.864 -7.399 216 HB2 ASN 445 HB2 ASN 445 -12.588 21.185 -7.550 217 HB3 ASN 445 HB3 ASN 445 -12.392 21.501 -9.272 218 HD21 ASN 445 HD21 ASN 445 -8.976 20.977 -8.172 219 HD22 ASN 445 HD22 ASN 445 -10.414 20.142 -8.728 220 H GLN 446 H GLN 446 -15.067 23.935 -9.455 221 HA GLN 446 HA GLN 446 -13.448 25.085 -11.683 222 HB2 GLN 446 HB2 GLN 446 -15.785 23.159 -12.002 223 HB3 GLN 446 HB3 GLN 446 -14.808 23.894 -13.293 224 HG2 GLN 446 HG2 GLN 446 -12.795 22.782 -12.017 225 HG3 GLN 446 HG3 GLN 446 -14.033 21.783 -11.253 226 HE21 GLN 446 HE21 GLN 446 -12.884 19.835 -14.166 227 HE22 GLN 446 HE22 GLN 446 -12.292 20.337 -12.593 228 H CYS 447 H CYS 447 -16.628 24.825 -10.078 229 HA CYS 447 HA CYS 447 -17.384 27.389 -11.403 230 HB2 CYS 447 HB2 CYS 447 -19.720 26.644 -11.247 231 HB3 CYS 447 HB3 CYS 447 -18.737 25.508 -12.193 232 H LYS 448 H LYS 448 -16.294 26.230 -8.544 233 HA LYS 448 HA LYS 448 -16.254 27.022 -6.425 234 HB2 LYS 448 HB2 LYS 448 -17.356 29.560 -7.681 235 HB3 LYS 448 HB3 LYS 448 -16.557 29.432 -6.109 236 HG2 LYS 448 HG2 LYS 448 -15.258 28.737 -8.778 237 HG3 LYS 448 HG3 LYS 448 -15.051 30.267 -7.913 238 HD2 LYS 448 HD2 LYS 448 -14.116 29.042 -5.962 239 HD3 LYS 448 HD3 LYS 448 -14.288 27.512 -6.846 240 HE2 LYS 448 HE2 LYS 448 -11.988 28.311 -7.028 241 HE3 LYS 448 HE3 LYS 448 -12.776 28.354 -8.615 242 HZ1 LYS 448 HZ1 LYS 448 -12.418 30.660 -6.821 243 HZ2 LYS 448 HZ2 LYS 448 -11.531 30.348 -8.166 244 HZ3 LYS 448 HZ3 LYS 448 -13.131 30.700 -8.307 245 H ALA 449 H ALA 449 -18.957 25.913 -7.611 246 HA ALA 449 HA ALA 449 -21.000 27.078 -5.983 247 HB1 ALA 449 HB1 ALA 449 -21.493 25.679 -7.944 248 HB2 ALA 449 HB2 ALA 449 -20.750 24.273 -7.146 249 HB3 ALA 449 HB3 ALA 449 -22.229 24.989 -6.479 250 HA PRO 450 HA PRO 450 -19.689 25.598 -2.069 251 HB2 PRO 450 HB2 PRO 450 -22.034 25.721 -0.636 252 HB3 PRO 450 HB3 PRO 450 -21.113 27.169 -1.148 253 HG2 PRO 450 HG2 PRO 450 -23.542 25.933 -2.466 254 HG3 PRO 450 HG3 PRO 450 -23.202 27.664 -2.154 255 HD2 PRO 450 HD2 PRO 450 -22.766 26.471 -4.587 256 HD3 PRO 450 HD3 PRO 450 -21.731 27.802 -3.978 257 H LYS 451 H LYS 451 -19.594 23.714 -0.825 258 HA LYS 451 HA LYS 451 -20.691 21.303 -1.927 259 HB2 LYS 451 HB2 LYS 451 -18.576 21.278 -0.756 260 HB3 LYS 451 HB3 LYS 451 -19.297 21.941 0.699 261 HG2 LYS 451 HG2 LYS 451 -20.861 19.730 0.458 262 HG3 LYS 451 HG3 LYS 451 -19.423 19.159 -0.401 263 HD2 LYS 451 HD2 LYS 451 -19.585 20.213 2.453 264 HD3 LYS 451 HD3 LYS 451 -19.194 18.558 1.932 265 HE2 LYS 451 HE2 LYS 451 -17.156 19.437 0.791 266 HE3 LYS 451 HE3 LYS 451 -17.549 21.062 1.372 267 HZ1 LYS 451 HZ1 LYS 451 -15.947 19.984 2.778 268 HZ2 LYS 451 HZ2 LYS 451 -17.341 20.244 3.616 269 HZ3 LYS 451 HZ3 LYS 451 -16.967 18.732 3.074 270 HA PRO 452 HA PRO 452 -23.900 21.545 1.663 271 HB2 PRO 452 HB2 PRO 452 -24.147 23.927 3.030 272 HB3 PRO 452 HB3 PRO 452 -23.104 22.572 3.571 273 HG2 PRO 452 HG2 PRO 452 -22.309 25.060 2.028 274 HG3 PRO 452 HG3 PRO 452 -21.488 24.313 3.436 275 HD2 PRO 452 HD2 PRO 452 -20.642 23.883 0.896 276 HD3 PRO 452 HD3 PRO 452 -20.599 22.587 2.129 277 H ASP 453 H ASP 453 -26.055 22.708 1.749 278 HA ASP 453 HA ASP 453 -26.702 23.652 -0.885 279 HB2 ASP 453 HB2 ASP 453 -28.333 23.399 1.656 280 HB3 ASP 453 HB3 ASP 453 -29.004 23.911 0.101 281 H GLY 454 H GLY 454 -25.319 25.320 1.660 282 HA2 GLY 454 HA2 GLY 454 -25.585 27.867 0.433 283 HA3 GLY 454 HA3 GLY 454 -26.747 27.759 1.766 284 H5' U 1 H5' U 1 -0.086 17.368 -0.471 285 H5'' U 1 H5'' U 1 -0.806 18.970 -0.736 286 H4' U 1 H4' U 1 -1.553 17.138 1.592 287 H3' U 1 H3' U 1 -2.137 16.410 -0.949 288 H2' U 1 H2' U 1 -2.852 18.568 -1.672 289 HO2' U 1 HO2' U 1 -4.532 17.276 -2.278 290 H1' U 1 H1' U 1 -4.584 18.870 0.774 291 H3 U 1 H3 U 1 -3.282 23.564 0.911 292 H5 U 1 H5 U 1 -4.215 22.323 -2.990 293 H6 U 1 H6 U 1 -4.195 20.038 -2.220 294 H5' G 2 H5' G 2 -1.971 12.549 -0.871 295 H5'' G 2 H5'' G 2 -1.745 14.255 -1.326 296 H4' G 2 H4' G 2 -2.321 12.689 -3.252 297 H3' G 2 H3' G 2 -3.898 15.158 -2.562 298 H2' G 2 H2' G 2 -5.369 14.751 -4.390 299 HO2' G 2 HO2' G 2 -3.763 14.082 -5.919 300 H1' G 2 H1' G 2 -5.699 12.092 -3.953 301 H8 G 2 H8 G 2 -5.259 14.933 -1.282 302 H1 G 2 H1 G 2 -11.162 12.512 -1.902 303 H21 G 2 H21 G 2 -11.226 11.124 -3.603 304 H22 G 2 H22 G 2 -9.793 10.683 -4.512 305 H5' G 3 H5' G 3 -2.965 17.627 -7.324 306 H5'' G 3 H5'' G 3 -4.615 17.621 -6.673 307 H4' G 3 H4' G 3 -3.808 15.404 -8.569 308 H3' G 3 H3' G 3 -3.162 17.821 -9.524 309 H2' G 3 H2' G 3 -5.039 18.928 -8.486 310 HO2' G 3 HO2' G 3 -4.896 19.559 -10.711 311 H1' G 3 H1' G 3 -6.877 16.915 -9.802 312 H8 G 3 H8 G 3 -6.286 19.431 -6.952 313 H1 G 3 H1 G 3 -12.178 16.925 -7.217 314 H21 G 3 H21 G 3 -12.250 15.294 -8.697 315 H22 G 3 H22 G 3 -10.837 14.799 -9.608 316 H5' U 4 H5' U 4 -3.729 15.922 -14.601 317 H5'' U 4 H5'' U 4 -4.452 17.029 -13.408 318 H4' U 4 H4' U 4 -5.859 14.587 -14.575 319 H3' U 4 H3' U 4 -5.578 17.372 -15.526 320 H2' U 4 H2' U 4 -7.598 18.086 -14.753 321 HO2' U 4 HO2' U 4 -8.299 17.325 -16.846 322 H1' U 4 H1' U 4 -8.554 15.306 -14.136 323 H3 U 4 H3 U 4 -11.892 17.171 -11.727 324 H5 U 4 H5 U 4 -8.559 19.510 -10.685 325 H6 U 4 H6 U 4 -7.241 18.231 -12.269 326 H5' G 5 H5' G 5 -5.223 12.471 -17.869 327 H5'' G 5 H5'' G 5 -6.397 12.905 -16.605 328 H4' G 5 H4' G 5 -3.712 11.636 -15.942 329 H3' G 5 H3' G 5 -5.417 10.285 -17.557 330 H2' G 5 H2' G 5 -7.391 10.723 -16.299 331 HO2' G 5 HO2' G 5 -7.885 8.758 -15.206 332 H1' G 5 H1' G 5 -5.961 10.022 -13.738 333 H8 G 5 H8 G 5 -9.178 10.663 -15.023 334 H1 G 5 H1 G 5 -8.255 14.447 -9.925 335 H21 G 5 H21 G 5 -6.094 14.573 -9.448 336 H22 G 5 H22 G 5 -4.883 13.766 -10.415 Start of MODEL 2 1 H1 GLY 414 H1 NGL 414 -22.344 14.944 -17.683 2 H2 GLY 414 H2 NGL 414 -23.157 14.915 -16.247 3 H3 GLY 414 H3 NGL 414 -23.612 13.917 -17.475 4 HA2 GLY 414 HA2 NGL 414 -22.436 12.685 -15.808 5 HA3 GLY 414 HA3 NGL 414 -21.551 12.715 -17.348 6 HA PRO 415 HA PRO 415 -19.275 14.847 -13.659 7 HB2 PRO 415 HB2 PRO 415 -18.008 12.745 -12.406 8 HB3 PRO 415 HB3 PRO 415 -19.622 13.363 -11.920 9 HG2 PRO 415 HG2 PRO 415 -18.967 10.975 -13.668 10 HG3 PRO 415 HG3 PRO 415 -20.176 11.098 -12.352 11 HD2 PRO 415 HD2 PRO 415 -20.838 11.336 -15.000 12 HD3 PRO 415 HD3 PRO 415 -21.689 12.258 -13.725 13 H LEU 416 H LEU 416 -16.924 15.102 -13.535 14 HA LEU 416 HA LEU 416 -15.665 14.685 -16.074 15 HB2 LEU 416 HB2 LEU 416 -15.173 16.631 -14.698 16 HB3 LEU 416 HB3 LEU 416 -14.603 15.597 -13.378 17 HG LEU 416 HG LEU 416 -12.740 14.793 -14.813 18 HD11 LEU 416 HD11 LEU 416 -13.835 16.846 -16.786 19 HD12 LEU 416 HD12 LEU 416 -12.278 16.008 -16.946 20 HD13 LEU 416 HD13 LEU 416 -13.789 15.081 -17.039 21 HD21 LEU 416 HD21 LEU 416 -12.462 16.764 -13.333 22 HD22 LEU 416 HD22 LEU 416 -11.465 16.890 -14.796 23 HD23 LEU 416 HD23 LEU 416 -12.973 17.827 -14.668 24 H GLY 417 H GLY 417 -14.305 13.113 -16.788 25 HA2 GLY 417 HA2 GLY 417 -14.139 10.658 -15.208 26 HA3 GLY 417 HA3 GLY 417 -13.600 10.893 -16.875 27 H SER 418 H SER 418 -12.007 9.420 -15.379 28 HA SER 418 HA SER 418 -9.894 9.117 -14.654 29 HB2 SER 418 HB2 SER 418 -9.475 11.713 -16.170 30 HB3 SER 418 HB3 SER 418 -8.160 10.694 -15.543 31 HG SER 418 HG SER 418 -8.714 10.216 -17.716 32 H GLY 419 H GLY 419 -11.814 11.117 -13.074 33 HA2 GLY 419 HA2 GLY 419 -9.864 12.614 -11.497 34 HA3 GLY 419 HA3 GLY 419 -11.616 12.541 -11.243 35 H GLN 420 H GLN 420 -9.380 12.265 -9.293 36 HA GLN 420 HA GLN 420 -9.371 9.493 -8.419 37 HB2 GLN 420 HB2 GLN 420 -8.600 12.056 -6.948 38 HB3 GLN 420 HB3 GLN 420 -8.258 10.404 -6.422 39 HG2 GLN 420 HG2 GLN 420 -6.251 11.106 -7.412 40 HG3 GLN 420 HG3 GLN 420 -7.013 10.106 -8.658 41 HE21 GLN 420 HE21 GLN 420 -5.940 12.896 -10.676 42 HE22 GLN 420 HE22 GLN 420 -5.419 11.352 -10.027 43 H GLN 421 H GLN 421 -10.244 8.823 -6.266 44 HA GLN 421 HA GLN 421 -12.459 10.436 -5.224 45 HB2 GLN 421 HB2 GLN 421 -13.528 9.244 -7.069 46 HB3 GLN 421 HB3 GLN 421 -12.912 7.698 -6.454 47 HG2 GLN 421 HG2 GLN 421 -14.236 7.924 -4.406 48 HG3 GLN 421 HG3 GLN 421 -14.738 9.554 -4.868 49 HE21 GLN 421 HE21 GLN 421 -17.633 7.514 -5.755 50 HE22 GLN 421 HE22 GLN 421 -16.847 8.190 -4.343 51 H ARG 422 H ARG 422 -12.813 10.111 -3.110 52 HA ARG 422 HA ARG 422 -11.869 7.667 -1.757 53 HB2 ARG 422 HB2 ARG 422 -10.929 10.482 -1.057 54 HB3 ARG 422 HB3 ARG 422 -10.745 9.081 0.002 55 HG2 ARG 422 HG2 ARG 422 -9.361 7.942 -1.728 56 HG3 ARG 422 HG3 ARG 422 -9.537 9.357 -2.783 57 HD2 ARG 422 HD2 ARG 422 -8.559 10.754 -0.882 58 HD3 ARG 422 HD3 ARG 422 -8.191 9.229 -0.060 59 HE ARG 422 HE ARG 422 -7.188 9.431 -2.810 60 HH11 ARG 422 HH11 ARG 422 -6.491 10.026 0.605 61 HH12 ARG 422 HH12 ARG 422 -4.757 9.980 0.375 62 HH21 ARG 422 HH21 ARG 422 -4.928 9.349 -3.072 63 HH22 ARG 422 HH22 ARG 422 -3.875 9.595 -1.700 64 H ALA 423 H ALA 423 -12.739 7.492 0.440 65 HA ALA 423 HA ALA 423 -15.462 8.274 0.589 66 HB1 ALA 423 HB1 ALA 423 -13.553 7.367 2.782 67 HB2 ALA 423 HB2 ALA 423 -15.328 7.405 2.898 68 HB3 ALA 423 HB3 ALA 423 -14.531 6.308 1.745 69 H GLY 424 H GLY 424 -16.399 10.128 1.184 70 HA2 GLY 424 HA2 GLY 424 -16.649 11.912 2.803 71 HA3 GLY 424 HA3 GLY 424 -14.880 12.048 2.889 72 H ASP 425 H ASP 425 -15.113 11.547 -0.265 73 HA ASP 425 HA ASP 425 -14.943 14.272 -1.068 74 HB2 ASP 425 HB2 ASP 425 -15.449 11.721 -2.619 75 HB3 ASP 425 HB3 ASP 425 -15.217 13.300 -3.378 76 H TRP 426 H TRP 426 -16.347 15.263 -2.822 77 HA TRP 426 HA TRP 426 -19.172 14.484 -2.678 78 HB2 TRP 426 HB2 TRP 426 -19.922 16.653 -1.897 79 HB3 TRP 426 HB3 TRP 426 -18.866 15.883 -0.704 80 HD1 TRP 426 HD1 TRP 426 -16.515 17.012 -0.234 81 HE1 TRP 426 HE1 TRP 426 -15.594 19.359 -0.618 82 HE3 TRP 426 HE3 TRP 426 -19.996 18.699 -3.565 83 HZ2 TRP 426 HZ2 TRP 426 -16.259 21.677 -2.222 84 HZ3 TRP 426 HZ3 TRP 426 -19.829 20.985 -4.496 85 HH2 TRP 426 HH2 TRP 426 -17.969 22.479 -3.833 86 H LYS 427 H LYS 427 -20.317 15.066 -4.474 87 HA LYS 427 HA LYS 427 -18.696 16.135 -6.686 88 HB2 LYS 427 HB2 LYS 427 -20.063 14.045 -6.887 89 HB3 LYS 427 HB3 LYS 427 -21.523 15.038 -6.679 90 HG2 LYS 427 HG2 LYS 427 -20.628 16.422 -8.698 91 HG3 LYS 427 HG3 LYS 427 -19.494 15.081 -8.943 92 HD2 LYS 427 HD2 LYS 427 -21.406 14.666 -10.353 93 HD3 LYS 427 HD3 LYS 427 -21.530 13.533 -8.990 94 HE2 LYS 427 HE2 LYS 427 -23.084 15.123 -7.850 95 HE3 LYS 427 HE3 LYS 427 -22.941 16.234 -9.216 96 HZ1 LYS 427 HZ1 LYS 427 -24.022 13.497 -9.346 97 HZ2 LYS 427 HZ2 LYS 427 -24.905 14.882 -9.378 98 HZ3 LYS 427 HZ3 LYS 427 -23.885 14.526 -10.620 99 H CYS 428 H CYS 428 -19.212 17.963 -7.881 100 HA CYS 428 HA CYS 428 -20.328 20.155 -6.502 101 HB2 CYS 428 HB2 CYS 428 -18.674 20.244 -8.368 102 HB3 CYS 428 HB3 CYS 428 -19.956 19.753 -9.496 103 HA PRO 429 HA PRO 429 -24.637 19.261 -7.112 104 HB2 PRO 429 HB2 PRO 429 -25.697 21.620 -6.182 105 HB3 PRO 429 HB3 PRO 429 -24.967 20.384 -5.108 106 HG2 PRO 429 HG2 PRO 429 -23.707 22.911 -6.205 107 HG3 PRO 429 HG3 PRO 429 -23.644 22.264 -4.529 108 HD2 PRO 429 HD2 PRO 429 -21.622 21.896 -6.349 109 HD3 PRO 429 HD3 PRO 429 -22.027 20.676 -5.101 110 H ASN 430 H ASN 430 -22.841 21.755 -8.737 111 HA ASN 430 HA ASN 430 -24.995 22.927 -10.236 112 HB2 ASN 430 HB2 ASN 430 -22.364 23.524 -9.782 113 HB3 ASN 430 HB3 ASN 430 -22.234 22.787 -11.382 114 HD21 ASN 430 HD21 ASN 430 -22.645 26.418 -11.899 115 HD22 ASN 430 HD22 ASN 430 -21.477 25.358 -11.137 116 HA PRO 431 HA PRO 431 -25.441 19.305 -12.892 117 HB2 PRO 431 HB2 PRO 431 -27.186 20.389 -14.739 118 HB3 PRO 431 HB3 PRO 431 -27.688 19.814 -13.120 119 HG2 PRO 431 HG2 PRO 431 -27.081 22.641 -14.018 120 HG3 PRO 431 HG3 PRO 431 -28.437 22.059 -12.991 121 HD2 PRO 431 HD2 PRO 431 -26.176 23.201 -11.952 122 HD3 PRO 431 HD3 PRO 431 -27.047 21.883 -11.102 123 H THR 432 H THR 432 -24.318 22.490 -13.773 124 HA THR 432 HA THR 432 -23.289 21.559 -16.357 125 HB THR 432 HB THR 432 -22.850 23.759 -16.900 126 HG1 THR 432 HG1 THR 432 -22.617 25.374 -15.339 127 HG21 THR 432 HG21 THR 432 -25.150 24.017 -14.911 128 HG22 THR 432 HG22 THR 432 -24.839 25.038 -16.332 129 HG23 THR 432 HG23 THR 432 -25.297 23.333 -16.547 130 H CYS 433 H CYS 433 -22.289 21.044 -13.302 131 HA CYS 433 HA CYS 433 -19.401 21.343 -13.991 132 HB2 CYS 433 HB2 CYS 433 -20.187 22.863 -12.197 133 HB3 CYS 433 HB3 CYS 433 -20.740 21.451 -11.268 134 H GLU 434 H GLU 434 -21.355 19.602 -11.534 135 HA GLU 434 HA GLU 434 -21.244 17.496 -10.727 136 HB2 GLU 434 HB2 GLU 434 -20.975 16.884 -13.692 137 HB3 GLU 434 HB3 GLU 434 -21.334 15.674 -12.438 138 HG2 GLU 434 HG2 GLU 434 -23.320 17.022 -11.752 139 HG3 GLU 434 HG3 GLU 434 -22.989 18.151 -13.079 140 H ASN 435 H ASN 435 -18.583 18.989 -11.111 141 HA ASN 435 HA ASN 435 -16.603 16.949 -11.564 142 HB2 ASN 435 HB2 ASN 435 -16.194 19.393 -11.790 143 HB3 ASN 435 HB3 ASN 435 -16.444 19.582 -10.045 144 HD21 ASN 435 HD21 ASN 435 -13.047 19.048 -9.417 145 HD22 ASN 435 HD22 ASN 435 -14.549 19.850 -9.010 146 H MET 436 H MET 436 -15.511 15.632 -10.106 147 HA MET 436 HA MET 436 -16.749 15.241 -7.477 148 HB2 MET 436 HB2 MET 436 -16.041 13.320 -8.883 149 HB3 MET 436 HB3 MET 436 -14.371 13.909 -8.836 150 HG2 MET 436 HG2 MET 436 -14.130 12.576 -7.046 151 HG3 MET 436 HG3 MET 436 -14.994 13.837 -6.154 152 HE1 MET 436 HE1 MET 436 -17.304 13.725 -5.281 153 HE2 MET 436 HE2 MET 436 -17.941 13.663 -6.945 154 HE3 MET 436 HE3 MET 436 -18.536 12.516 -5.716 155 H ASN 437 H ASN 437 -16.283 16.910 -6.093 156 HA ASN 437 HA ASN 437 -13.566 18.017 -5.982 157 HB2 ASN 437 HB2 ASN 437 -16.061 18.598 -4.347 158 HB3 ASN 437 HB3 ASN 437 -14.567 19.541 -4.302 159 HD21 ASN 437 HD21 ASN 437 -17.342 20.596 -6.918 160 HD22 ASN 437 HD22 ASN 437 -17.584 19.712 -5.418 161 H PHE 438 H PHE 438 -12.171 17.907 -4.181 162 HA PHE 438 HA PHE 438 -12.304 15.399 -2.778 163 HB2 PHE 438 HB2 PHE 438 -10.384 17.730 -2.571 164 HB3 PHE 438 HB3 PHE 438 -10.220 16.235 -1.662 165 HD1 PHE 438 HD1 PHE 438 -8.265 17.490 -3.713 166 HD2 PHE 438 HD2 PHE 438 -11.271 14.422 -4.060 167 HE1 PHE 438 HE1 PHE 438 -6.965 16.413 -5.516 168 HE2 PHE 438 HE2 PHE 438 -9.998 13.396 -5.903 169 HZ PHE 438 HZ PHE 438 -7.830 14.375 -6.622 170 H SER 439 H SER 439 -12.027 15.112 -0.438 171 HA SER 439 HA SER 439 -14.429 15.982 0.755 172 HB2 SER 439 HB2 SER 439 -13.287 13.867 1.282 173 HB3 SER 439 HB3 SER 439 -11.923 14.761 1.977 174 HG SER 439 HG SER 439 -14.614 14.789 2.894 175 H TRP 440 H TRP 440 -11.161 17.391 0.886 176 HA TRP 440 HA TRP 440 -11.805 18.945 3.268 177 HB2 TRP 440 HB2 TRP 440 -9.524 19.938 2.793 178 HB3 TRP 440 HB3 TRP 440 -9.599 18.216 3.180 179 HD1 TRP 440 HD1 TRP 440 -8.827 16.509 1.375 180 HE1 TRP 440 HE1 TRP 440 -7.578 16.692 -0.828 181 HE3 TRP 440 HE3 TRP 440 -9.344 21.529 0.592 182 HZ2 TRP 440 HZ2 TRP 440 -6.844 18.776 -2.707 183 HZ3 TRP 440 HZ3 TRP 440 -8.379 22.585 -1.416 184 HH2 TRP 440 HH2 TRP 440 -7.095 21.223 -3.064 185 H ARG 441 H ARG 441 -12.449 19.359 -0.072 186 HA ARG 441 HA ARG 441 -12.255 22.270 -0.040 187 HB2 ARG 441 HB2 ARG 441 -13.523 20.303 -1.981 188 HB3 ARG 441 HB3 ARG 441 -13.567 22.064 -2.181 189 HG2 ARG 441 HG2 ARG 441 -11.060 22.099 -2.034 190 HG3 ARG 441 HG3 ARG 441 -11.078 20.317 -2.054 191 HD2 ARG 441 HD2 ARG 441 -12.257 20.352 -4.235 192 HD3 ARG 441 HD3 ARG 441 -12.272 22.121 -4.210 193 HE ARG 441 HE ARG 441 -10.054 20.355 -4.887 194 HH11 ARG 441 HH11 ARG 441 -10.929 23.589 -3.749 195 HH12 ARG 441 HH12 ARG 441 -9.417 24.307 -4.258 196 HH21 ARG 441 HH21 ARG 441 -8.112 21.311 -5.555 197 HH22 ARG 441 HH22 ARG 441 -7.823 23.022 -5.290 198 H ASN 442 H ASN 442 -13.956 23.757 0.114 199 HA ASN 442 HA ASN 442 -16.573 22.656 1.049 200 HB2 ASN 442 HB2 ASN 442 -15.214 25.300 1.688 201 HB3 ASN 442 HB3 ASN 442 -16.860 24.864 2.174 202 HD21 ASN 442 HD21 ASN 442 -14.212 24.090 4.849 203 HD22 ASN 442 HD22 ASN 442 -14.442 25.486 3.813 204 H GLU 443 H GLU 443 -14.956 24.119 -1.520 205 HA GLU 443 HA GLU 443 -17.542 24.911 -2.732 206 HB2 GLU 443 HB2 GLU 443 -14.959 26.475 -3.133 207 HB3 GLU 443 HB3 GLU 443 -16.581 26.870 -3.707 208 HG2 GLU 443 HG2 GLU 443 -16.463 28.261 -1.880 209 HG3 GLU 443 HG3 GLU 443 -17.203 26.836 -1.141 210 H CYS 444 H CYS 444 -17.495 24.855 -5.085 211 HA CYS 444 HA CYS 444 -16.287 22.463 -6.029 212 HB2 CYS 444 HB2 CYS 444 -18.420 23.378 -6.874 213 HB3 CYS 444 HB3 CYS 444 -17.555 24.763 -7.564 214 H ASN 445 H ASN 445 -14.682 22.137 -7.612 215 HA ASN 445 HA ASN 445 -12.487 24.076 -7.365 216 HB2 ASN 445 HB2 ASN 445 -12.444 21.475 -7.012 217 HB3 ASN 445 HB3 ASN 445 -12.414 21.394 -8.779 218 HD21 ASN 445 HD21 ASN 445 -8.894 21.306 -8.097 219 HD22 ASN 445 HD22 ASN 445 -10.317 20.345 -8.446 220 H GLN 446 H GLN 446 -15.077 23.935 -9.355 221 HA GLN 446 HA GLN 446 -13.517 24.668 -11.792 222 HB2 GLN 446 HB2 GLN 446 -15.908 22.791 -11.653 223 HB3 GLN 446 HB3 GLN 446 -15.077 23.308 -13.126 224 HG2 GLN 446 HG2 GLN 446 -13.764 21.759 -10.838 225 HG3 GLN 446 HG3 GLN 446 -14.415 21.015 -12.292 226 HE21 GLN 446 HE21 GLN 446 -10.719 21.584 -12.712 227 HE22 GLN 446 HE22 GLN 446 -11.704 20.755 -11.523 228 H CYS 447 H CYS 447 -16.543 24.844 -9.926 229 HA CYS 447 HA CYS 447 -17.226 27.306 -11.457 230 HB2 CYS 447 HB2 CYS 447 -19.609 26.645 -11.324 231 HB3 CYS 447 HB3 CYS 447 -18.639 25.485 -12.256 232 H LYS 448 H LYS 448 -16.263 26.169 -8.542 233 HA LYS 448 HA LYS 448 -16.237 27.000 -6.446 234 HB2 LYS 448 HB2 LYS 448 -17.153 29.559 -7.801 235 HB3 LYS 448 HB3 LYS 448 -16.454 29.428 -6.176 236 HG2 LYS 448 HG2 LYS 448 -14.399 28.398 -7.167 237 HG3 LYS 448 HG3 LYS 448 -15.070 28.661 -8.785 238 HD2 LYS 448 HD2 LYS 448 -14.501 30.844 -6.737 239 HD3 LYS 448 HD3 LYS 448 -13.504 30.460 -8.153 240 HE2 LYS 448 HE2 LYS 448 -15.423 30.976 -9.635 241 HE3 LYS 448 HE3 LYS 448 -16.410 31.378 -8.221 242 HZ1 LYS 448 HZ1 LYS 448 -15.448 33.327 -9.226 243 HZ2 LYS 448 HZ2 LYS 448 -14.858 33.119 -7.703 244 HZ3 LYS 448 HZ3 LYS 448 -13.925 32.745 -9.007 245 H ALA 449 H ALA 449 -18.957 25.974 -7.628 246 HA ALA 449 HA ALA 449 -20.963 27.247 -6.023 247 HB1 ALA 449 HB1 ALA 449 -20.803 24.406 -7.106 248 HB2 ALA 449 HB2 ALA 449 -22.270 25.197 -6.479 249 HB3 ALA 449 HB3 ALA 449 -21.487 25.809 -7.957 250 HA PRO 450 HA PRO 450 -19.720 25.797 -2.072 251 HB2 PRO 450 HB2 PRO 450 -22.077 25.971 -0.666 252 HB3 PRO 450 HB3 PRO 450 -21.118 27.400 -1.180 253 HG2 PRO 450 HG2 PRO 450 -23.560 26.197 -2.505 254 HG3 PRO 450 HG3 PRO 450 -23.181 27.929 -2.211 255 HD2 PRO 450 HD2 PRO 450 -22.755 26.703 -4.627 256 HD3 PRO 450 HD3 PRO 450 -21.701 28.014 -4.018 257 H LYS 451 H LYS 451 -19.687 23.935 -0.780 258 HA LYS 451 HA LYS 451 -20.786 21.519 -1.881 259 HB2 LYS 451 HB2 LYS 451 -18.684 21.487 -0.692 260 HB3 LYS 451 HB3 LYS 451 -19.413 22.165 0.750 261 HG2 LYS 451 HG2 LYS 451 -20.994 19.958 0.495 262 HG3 LYS 451 HG3 LYS 451 -19.541 19.368 -0.313 263 HD2 LYS 451 HD2 LYS 451 -19.767 20.452 2.519 264 HD3 LYS 451 HD3 LYS 451 -19.380 18.793 2.029 265 HE2 LYS 451 HE2 LYS 451 -17.298 19.626 0.937 266 HE3 LYS 451 HE3 LYS 451 -17.695 21.266 1.467 267 HZ1 LYS 451 HZ1 LYS 451 -16.150 20.218 2.950 268 HZ2 LYS 451 HZ2 LYS 451 -17.566 20.492 3.739 269 HZ3 LYS 451 HZ3 LYS 451 -17.178 18.968 3.233 270 HA PRO 452 HA PRO 452 -24.039 21.846 1.666 271 HB2 PRO 452 HB2 PRO 452 -24.252 24.237 3.013 272 HB3 PRO 452 HB3 PRO 452 -23.242 22.868 3.581 273 HG2 PRO 452 HG2 PRO 452 -22.379 25.328 2.035 274 HG3 PRO 452 HG3 PRO 452 -21.591 24.574 3.460 275 HD2 PRO 452 HD2 PRO 452 -20.724 24.110 0.924 276 HD3 PRO 452 HD3 PRO 452 -20.716 22.822 2.166 277 H ASP 453 H ASP 453 -26.165 23.058 1.709 278 HA ASP 453 HA ASP 453 -26.734 24.013 -0.944 279 HB2 ASP 453 HB2 ASP 453 -28.428 23.789 1.559 280 HB3 ASP 453 HB3 ASP 453 -29.057 24.294 -0.018 281 H GLY 454 H GLY 454 -25.360 25.642 1.614 282 HA2 GLY 454 HA2 GLY 454 -25.527 28.191 0.414 283 HA3 GLY 454 HA3 GLY 454 -26.767 28.110 1.686 284 H5' U 1 H5' U 1 -3.328 17.689 3.682 285 H5'' U 1 H5'' U 1 -3.072 19.425 3.401 286 H4' U 1 H4' U 1 -5.246 17.791 2.019 287 H3' U 1 H3' U 1 -2.408 18.471 1.207 288 H2' U 1 H2' U 1 -3.158 18.637 -1.040 289 HO2' U 1 HO2' U 1 -4.405 16.698 -1.023 290 H1' U 1 H1' U 1 -5.643 19.746 -0.399 291 H3 U 1 H3 U 1 -1.598 23.039 0.519 292 H5 U 1 H5 U 1 -3.682 22.840 -3.130 293 H6 U 1 H6 U 1 -4.833 20.883 -2.284 294 H5' G 2 H5' G 2 -1.655 13.485 -1.247 295 H5'' G 2 H5'' G 2 -1.265 14.847 -2.319 296 H4' G 2 H4' G 2 -2.385 13.149 -3.613 297 H3' G 2 H3' G 2 -4.120 15.553 -3.019 298 H2' G 2 H2' G 2 -5.773 14.573 -4.447 299 HO2' G 2 HO2' G 2 -4.190 13.831 -6.042 300 H1' G 2 H1' G 2 -5.500 12.019 -3.483 301 H8 G 2 H8 G 2 -5.119 14.913 -0.964 302 H1 G 2 H1 G 2 -11.105 12.756 -1.753 303 H21 G 2 H21 G 2 -11.210 11.523 -3.597 304 H22 G 2 H22 G 2 -9.776 11.076 -4.501 305 H5' G 3 H5' G 3 -4.860 14.383 -7.515 306 H5'' G 3 H5'' G 3 -3.249 15.114 -7.653 307 H4' G 3 H4' G 3 -4.584 15.306 -9.739 308 H3' G 3 H3' G 3 -3.020 17.282 -8.607 309 H2' G 3 H2' G 3 -4.766 18.440 -7.523 310 HO2' G 3 HO2' G 3 -3.834 19.900 -9.083 311 H1' G 3 H1' G 3 -6.594 18.036 -9.882 312 H8 G 3 H8 G 3 -6.314 19.854 -6.904 313 H1 G 3 H1 G 3 -11.956 16.798 -6.857 314 H21 G 3 H21 G 3 -11.926 15.123 -8.291 315 H22 G 3 H22 G 3 -10.527 14.777 -9.294 316 H5' U 4 H5' U 4 -4.069 15.468 -14.004 317 H5'' U 4 H5'' U 4 -4.846 16.829 -13.176 318 H4' U 4 H4' U 4 -5.835 13.951 -12.982 319 H3' U 4 H3' U 4 -6.224 16.024 -15.042 320 H2' U 4 H2' U 4 -8.228 16.759 -14.310 321 HO2' U 4 HO2' U 4 -8.997 15.024 -15.678 322 H1' U 4 H1' U 4 -8.598 14.506 -12.359 323 H3 U 4 H3 U 4 -11.988 17.113 -10.820 324 H5 U 4 H5 U 4 -8.693 19.718 -10.879 325 H6 U 4 H6 U 4 -7.390 17.961 -11.909 326 H5' G 5 H5' G 5 -6.494 11.371 -14.379 327 H5'' G 5 H5'' G 5 -5.259 11.195 -13.124 328 H4' G 5 H4' G 5 -4.697 10.411 -16.020 329 H3' G 5 H3' G 5 -6.720 9.164 -14.748 330 H2' G 5 H2' G 5 -5.776 8.693 -12.677 331 HO2' G 5 HO2' G 5 -4.744 6.636 -14.346 332 H1' G 5 H1' G 5 -3.002 8.117 -13.462 333 H8 G 5 H8 G 5 -4.540 8.151 -10.696 334 H1 G 5 H1 G 5 -1.690 13.891 -10.434 335 H21 G 5 H21 G 5 -0.948 14.469 -12.436 336 H22 G 5 H22 G 5 -1.173 13.445 -13.839 Start of MODEL 3 1 H1 GLY 414 H1 NGL 414 -17.509 12.537 -20.677 2 H2 GLY 414 H2 NGL 414 -17.709 10.913 -20.490 3 H3 GLY 414 H3 NGL 414 -16.401 11.660 -19.826 4 HA2 GLY 414 HA2 NGL 414 -19.201 12.099 -19.046 5 HA3 GLY 414 HA3 NGL 414 -18.019 11.147 -18.130 6 HA PRO 415 HA PRO 415 -17.920 15.653 -16.782 7 HB2 PRO 415 HB2 PRO 415 -18.715 15.269 -14.177 8 HB3 PRO 415 HB3 PRO 415 -19.868 15.533 -15.527 9 HG2 PRO 415 HG2 PRO 415 -19.019 12.920 -14.258 10 HG3 PRO 415 HG3 PRO 415 -20.669 13.459 -14.719 11 HD2 PRO 415 HD2 PRO 415 -19.159 11.800 -16.295 12 HD3 PRO 415 HD3 PRO 415 -20.296 12.995 -16.987 13 H LEU 416 H LEU 416 -16.539 16.530 -14.979 14 HA LEU 416 HA LEU 416 -14.037 15.143 -14.848 15 HB2 LEU 416 HB2 LEU 416 -15.140 17.509 -13.279 16 HB3 LEU 416 HB3 LEU 416 -13.440 17.012 -13.286 17 HG LEU 416 HG LEU 416 -15.011 17.867 -15.759 18 HD11 LEU 416 HD11 LEU 416 -12.922 19.342 -14.098 19 HD12 LEU 416 HD12 LEU 416 -13.639 19.918 -15.624 20 HD13 LEU 416 HD13 LEU 416 -14.657 19.729 -14.176 21 HD21 LEU 416 HD21 LEU 416 -13.165 16.339 -16.313 22 HD22 LEU 416 HD22 LEU 416 -12.735 17.995 -16.783 23 HD23 LEU 416 HD23 LEU 416 -12.049 17.290 -15.301 24 H GLY 417 H GLY 417 -12.899 14.442 -12.907 25 HA2 GLY 417 HA2 GLY 417 -14.184 13.998 -10.422 26 HA3 GLY 417 HA3 GLY 417 -14.372 12.543 -11.415 27 H SER 418 H SER 418 -12.932 12.520 -9.007 28 HA SER 418 HA SER 418 -10.113 12.919 -9.418 29 HB2 SER 418 HB2 SER 418 -11.075 13.028 -7.188 30 HB3 SER 418 HB3 SER 418 -11.695 11.370 -7.342 31 HG SER 418 HG SER 418 -8.982 12.191 -7.266 32 H GLY 419 H GLY 419 -8.466 11.417 -9.722 33 HA2 GLY 419 HA2 GLY 419 -9.211 8.990 -11.204 34 HA3 GLY 419 HA3 GLY 419 -7.582 9.669 -10.988 35 H GLN 420 H GLN 420 -9.080 9.647 -7.976 36 HA GLN 420 HA GLN 420 -8.147 6.895 -7.330 37 HB2 GLN 420 HB2 GLN 420 -6.284 8.365 -6.820 38 HB3 GLN 420 HB3 GLN 420 -7.354 9.513 -5.996 39 HG2 GLN 420 HG2 GLN 420 -6.145 8.224 -4.340 40 HG3 GLN 420 HG3 GLN 420 -7.861 7.815 -4.264 41 HE21 GLN 420 HE21 GLN 420 -6.495 4.493 -4.067 42 HE22 GLN 420 HE22 GLN 420 -7.006 5.867 -3.107 43 H GLN 421 H GLN 421 -9.991 9.788 -6.413 44 HA GLN 421 HA GLN 421 -11.824 10.141 -5.160 45 HB2 GLN 421 HB2 GLN 421 -12.403 7.218 -5.732 46 HB3 GLN 421 HB3 GLN 421 -13.564 8.417 -5.123 47 HG2 GLN 421 HG2 GLN 421 -13.245 9.783 -7.156 48 HG3 GLN 421 HG3 GLN 421 -12.047 8.628 -7.762 49 HE21 GLN 421 HE21 GLN 421 -14.998 7.601 -9.584 50 HE22 GLN 421 HE22 GLN 421 -13.695 8.769 -9.614 51 H ARG 422 H ARG 422 -12.771 10.007 -3.102 52 HA ARG 422 HA ARG 422 -11.718 8.016 -1.190 53 HB2 ARG 422 HB2 ARG 422 -11.471 11.022 -0.781 54 HB3 ARG 422 HB3 ARG 422 -11.211 9.805 0.471 55 HG2 ARG 422 HG2 ARG 422 -9.392 8.790 -0.927 56 HG3 ARG 422 HG3 ARG 422 -9.605 10.120 -2.094 57 HD2 ARG 422 HD2 ARG 422 -9.195 11.734 -0.184 58 HD3 ARG 422 HD3 ARG 422 -8.765 10.336 0.814 59 HE ARG 422 HE ARG 422 -7.316 10.656 -1.746 60 HH11 ARG 422 HH11 ARG 422 -7.338 11.126 1.757 61 HH12 ARG 422 HH12 ARG 422 -5.595 11.261 1.866 62 HH21 ARG 422 HH21 ARG 422 -5.042 10.832 -1.568 63 HH22 ARG 422 HH22 ARG 422 -4.304 11.095 -0.010 64 H ALA 423 H ALA 423 -13.005 7.932 0.791 65 HA ALA 423 HA ALA 423 -15.785 8.026 0.094 66 HB1 ALA 423 HB1 ALA 423 -16.101 7.067 2.348 67 HB2 ALA 423 HB2 ALA 423 -14.765 6.261 1.498 68 HB3 ALA 423 HB3 ALA 423 -14.415 7.464 2.761 69 H GLY 424 H GLY 424 -13.836 10.555 1.054 70 HA2 GLY 424 HA2 GLY 424 -15.976 11.876 2.655 71 HA3 GLY 424 HA3 GLY 424 -14.274 12.360 2.583 72 H ASP 425 H ASP 425 -14.892 11.606 -0.542 73 HA ASP 425 HA ASP 425 -14.844 14.314 -1.405 74 HB2 ASP 425 HB2 ASP 425 -15.430 11.740 -2.881 75 HB3 ASP 425 HB3 ASP 425 -15.183 13.307 -3.660 76 H TRP 426 H TRP 426 -16.380 15.309 -2.974 77 HA TRP 426 HA TRP 426 -19.181 14.451 -2.693 78 HB2 TRP 426 HB2 TRP 426 -19.913 16.613 -1.846 79 HB3 TRP 426 HB3 TRP 426 -18.822 15.811 -0.719 80 HD1 TRP 426 HD1 TRP 426 -16.490 16.943 -0.242 81 HE1 TRP 426 HE1 TRP 426 -15.554 19.281 -0.607 82 HE3 TRP 426 HE3 TRP 426 -19.977 18.684 -3.541 83 HZ2 TRP 426 HZ2 TRP 426 -16.205 21.624 -2.192 84 HZ3 TRP 426 HZ3 TRP 426 -19.797 20.974 -4.458 85 HH2 TRP 426 HH2 TRP 426 -17.936 22.455 -3.776 86 H LYS 427 H LYS 427 -20.420 15.009 -4.436 87 HA LYS 427 HA LYS 427 -18.927 16.034 -6.735 88 HB2 LYS 427 HB2 LYS 427 -20.505 14.027 -6.766 89 HB3 LYS 427 HB3 LYS 427 -21.837 15.194 -6.602 90 HG2 LYS 427 HG2 LYS 427 -20.827 16.374 -8.678 91 HG3 LYS 427 HG3 LYS 427 -19.810 14.935 -8.857 92 HD2 LYS 427 HD2 LYS 427 -21.730 14.609 -10.266 93 HD3 LYS 427 HD3 LYS 427 -21.971 13.566 -8.846 94 HE2 LYS 427 HE2 LYS 427 -23.387 15.339 -7.814 95 HE3 LYS 427 HE3 LYS 427 -23.138 16.358 -9.240 96 HZ1 LYS 427 HZ1 LYS 427 -24.207 14.645 -10.557 97 HZ2 LYS 427 HZ2 LYS 427 -24.454 13.719 -9.219 98 HZ3 LYS 427 HZ3 LYS 427 -25.207 15.173 -9.362 99 H CYS 428 H CYS 428 -19.353 17.898 -7.885 100 HA CYS 428 HA CYS 428 -20.360 20.141 -6.501 101 HB2 CYS 428 HB2 CYS 428 -18.706 20.165 -8.359 102 HB3 CYS 428 HB3 CYS 428 -19.996 19.697 -9.489 103 HA PRO 429 HA PRO 429 -24.706 19.409 -7.128 104 HB2 PRO 429 HB2 PRO 429 -25.685 21.823 -6.253 105 HB3 PRO 429 HB3 PRO 429 -25.006 20.580 -5.149 106 HG2 PRO 429 HG2 PRO 429 -23.649 23.039 -6.280 107 HG3 PRO 429 HG3 PRO 429 -23.624 22.424 -4.591 108 HD2 PRO 429 HD2 PRO 429 -21.595 21.940 -6.377 109 HD3 PRO 429 HD3 PRO 429 -22.064 20.758 -5.123 110 H ASN 430 H ASN 430 -22.812 21.776 -8.803 111 HA ASN 430 HA ASN 430 -24.930 22.974 -10.342 112 HB2 ASN 430 HB2 ASN 430 -22.301 23.558 -9.874 113 HB3 ASN 430 HB3 ASN 430 -22.153 22.762 -11.441 114 HD21 ASN 430 HD21 ASN 430 -22.526 26.383 -12.075 115 HD22 ASN 430 HD22 ASN 430 -21.384 25.342 -11.242 116 HA PRO 431 HA PRO 431 -25.409 19.315 -12.956 117 HB2 PRO 431 HB2 PRO 431 -27.131 20.422 -14.816 118 HB3 PRO 431 HB3 PRO 431 -27.642 19.854 -13.196 119 HG2 PRO 431 HG2 PRO 431 -27.003 22.678 -14.091 120 HG3 PRO 431 HG3 PRO 431 -28.372 22.104 -13.077 121 HD2 PRO 431 HD2 PRO 431 -26.123 23.218 -11.995 122 HD3 PRO 431 HD3 PRO 431 -27.003 21.892 -11.182 123 H THR 432 H THR 432 -24.228 22.487 -13.822 124 HA THR 432 HA THR 432 -23.180 21.545 -16.388 125 HB THR 432 HB THR 432 -22.702 23.735 -16.928 126 HG1 THR 432 HG1 THR 432 -22.468 25.349 -15.365 127 HG21 THR 432 HG21 THR 432 -25.015 24.045 -14.964 128 HG22 THR 432 HG22 THR 432 -24.662 25.055 -16.384 129 HG23 THR 432 HG23 THR 432 -25.169 23.364 -16.597 130 H CYS 433 H CYS 433 -22.231 20.978 -13.350 131 HA CYS 433 HA CYS 433 -19.328 21.216 -14.001 132 HB2 CYS 433 HB2 CYS 433 -20.122 22.783 -12.226 133 HB3 CYS 433 HB3 CYS 433 -20.687 21.380 -11.291 134 H GLU 434 H GLU 434 -21.387 19.559 -11.576 135 HA GLU 434 HA GLU 434 -21.351 17.469 -10.729 136 HB2 GLU 434 HB2 GLU 434 -20.974 16.791 -13.665 137 HB3 GLU 434 HB3 GLU 434 -21.417 15.621 -12.402 138 HG2 GLU 434 HG2 GLU 434 -23.394 17.033 -11.825 139 HG3 GLU 434 HG3 GLU 434 -22.998 18.104 -13.182 140 H ASN 435 H ASN 435 -18.627 18.897 -11.103 141 HA ASN 435 HA ASN 435 -16.690 16.786 -11.411 142 HB2 ASN 435 HB2 ASN 435 -16.151 19.165 -11.779 143 HB3 ASN 435 HB3 ASN 435 -16.555 19.527 -10.093 144 HD21 ASN 435 HD21 ASN 435 -13.166 19.171 -9.266 145 HD22 ASN 435 HD22 ASN 435 -14.627 20.133 -9.209 146 H MET 436 H MET 436 -15.822 15.395 -9.896 147 HA MET 436 HA MET 436 -17.002 15.386 -7.216 148 HB2 MET 436 HB2 MET 436 -16.588 13.266 -8.346 149 HB3 MET 436 HB3 MET 436 -14.858 13.648 -8.497 150 HG2 MET 436 HG2 MET 436 -14.431 12.963 -6.411 151 HG3 MET 436 HG3 MET 436 -15.721 13.971 -5.745 152 HE1 MET 436 HE1 MET 436 -18.829 11.786 -5.690 153 HE2 MET 436 HE2 MET 436 -18.034 13.317 -5.215 154 HE3 MET 436 HE3 MET 436 -18.353 12.970 -6.928 155 H ASN 437 H ASN 437 -16.330 16.884 -5.811 156 HA ASN 437 HA ASN 437 -13.625 17.993 -5.984 157 HB2 ASN 437 HB2 ASN 437 -15.988 18.627 -4.178 158 HB3 ASN 437 HB3 ASN 437 -14.498 19.566 -4.268 159 HD21 ASN 437 HD21 ASN 437 -17.482 20.240 -6.901 160 HD22 ASN 437 HD22 ASN 437 -17.633 19.229 -5.474 161 H PHE 438 H PHE 438 -12.103 17.956 -4.278 162 HA PHE 438 HA PHE 438 -11.968 15.528 -2.803 163 HB2 PHE 438 HB2 PHE 438 -10.396 18.108 -2.566 164 HB3 PHE 438 HB3 PHE 438 -10.046 16.654 -1.644 165 HD1 PHE 438 HD1 PHE 438 -10.895 14.912 -4.338 166 HD2 PHE 438 HD2 PHE 438 -8.046 17.986 -3.349 167 HE1 PHE 438 HE1 PHE 438 -9.377 14.084 -6.100 168 HE2 PHE 438 HE2 PHE 438 -6.523 17.139 -5.113 169 HZ PHE 438 HZ PHE 438 -7.179 15.186 -6.480 170 H SER 439 H SER 439 -11.840 15.195 -0.509 171 HA SER 439 HA SER 439 -14.294 15.941 0.672 172 HB2 SER 439 HB2 SER 439 -13.445 14.731 2.619 173 HB3 SER 439 HB3 SER 439 -13.003 13.859 1.125 174 HG SER 439 HG SER 439 -10.937 14.660 1.305 175 H TRP 440 H TRP 440 -11.135 17.507 0.824 176 HA TRP 440 HA TRP 440 -11.876 18.953 3.267 177 HB2 TRP 440 HB2 TRP 440 -9.593 19.946 3.000 178 HB3 TRP 440 HB3 TRP 440 -9.668 18.194 3.237 179 HD1 TRP 440 HD1 TRP 440 -8.719 16.663 1.366 180 HE1 TRP 440 HE1 TRP 440 -7.365 17.048 -0.753 181 HE3 TRP 440 HE3 TRP 440 -9.398 21.705 0.909 182 HZ2 TRP 440 HZ2 TRP 440 -6.590 19.305 -2.415 183 HZ3 TRP 440 HZ3 TRP 440 -8.340 22.945 -0.946 184 HH2 TRP 440 HH2 TRP 440 -6.916 21.753 -2.609 185 H ARG 441 H ARG 441 -12.404 19.414 -0.063 186 HA ARG 441 HA ARG 441 -12.224 22.322 -0.005 187 HB2 ARG 441 HB2 ARG 441 -13.475 20.359 -1.964 188 HB3 ARG 441 HB3 ARG 441 -13.491 22.122 -2.181 189 HG2 ARG 441 HG2 ARG 441 -10.993 22.131 -2.030 190 HG3 ARG 441 HG3 ARG 441 -11.021 20.351 -1.984 191 HD2 ARG 441 HD2 ARG 441 -12.226 20.351 -4.176 192 HD3 ARG 441 HD3 ARG 441 -12.148 22.111 -4.211 193 HE ARG 441 HE ARG 441 -10.049 20.228 -4.870 194 HH11 ARG 441 HH11 ARG 441 -10.641 23.482 -3.626 195 HH12 ARG 441 HH12 ARG 441 -9.076 24.086 -4.130 196 HH21 ARG 441 HH21 ARG 441 -8.032 21.027 -5.502 197 HH22 ARG 441 HH22 ARG 441 -7.595 22.696 -5.194 198 H ASN 442 H ASN 442 -13.910 23.806 0.146 199 HA ASN 442 HA ASN 442 -16.506 22.709 1.122 200 HB2 ASN 442 HB2 ASN 442 -15.142 25.369 1.648 201 HB3 ASN 442 HB3 ASN 442 -16.785 24.964 2.174 202 HD21 ASN 442 HD21 ASN 442 -14.132 24.265 4.852 203 HD22 ASN 442 HD22 ASN 442 -14.379 25.636 3.794 204 H GLU 443 H GLU 443 -14.989 24.033 -1.561 205 HA GLU 443 HA GLU 443 -17.599 24.777 -2.726 206 HB2 GLU 443 HB2 GLU 443 -15.089 26.493 -2.931 207 HB3 GLU 443 HB3 GLU 443 -16.624 26.777 -3.777 208 HG2 GLU 443 HG2 GLU 443 -17.776 27.007 -1.580 209 HG3 GLU 443 HG3 GLU 443 -16.223 26.817 -0.754 210 H CYS 444 H CYS 444 -17.526 24.800 -5.088 211 HA CYS 444 HA CYS 444 -16.262 22.444 -6.054 212 HB2 CYS 444 HB2 CYS 444 -18.407 23.335 -6.906 213 HB3 CYS 444 HB3 CYS 444 -17.554 24.746 -7.571 214 H ASN 445 H ASN 445 -14.615 22.146 -7.554 215 HA ASN 445 HA ASN 445 -12.476 24.134 -7.307 216 HB2 ASN 445 HB2 ASN 445 -12.417 21.506 -7.020 217 HB3 ASN 445 HB3 ASN 445 -12.329 21.494 -8.790 218 HD21 ASN 445 HD21 ASN 445 -8.831 21.418 -7.998 219 HD22 ASN 445 HD22 ASN 445 -10.232 20.450 -8.410 220 H GLN 446 H GLN 446 -15.055 23.948 -9.321 221 HA GLN 446 HA GLN 446 -13.494 24.721 -11.745 222 HB2 GLN 446 HB2 GLN 446 -15.852 22.806 -11.645 223 HB3 GLN 446 HB3 GLN 446 -14.983 23.320 -13.101 224 HG2 GLN 446 HG2 GLN 446 -13.724 21.802 -10.765 225 HG3 GLN 446 HG3 GLN 446 -14.317 21.048 -12.233 226 HE21 GLN 446 HE21 GLN 446 -10.592 21.698 -12.484 227 HE22 GLN 446 HE22 GLN 446 -11.609 20.888 -11.310 228 H CYS 447 H CYS 447 -16.528 24.853 -9.889 229 HA CYS 447 HA CYS 447 -17.229 27.311 -11.416 230 HB2 CYS 447 HB2 CYS 447 -19.615 26.633 -11.291 231 HB3 CYS 447 HB3 CYS 447 -18.628 25.519 -12.265 232 H LYS 448 H LYS 448 -16.276 26.171 -8.510 233 HA LYS 448 HA LYS 448 -16.261 27.002 -6.414 234 HB2 LYS 448 HB2 LYS 448 -17.199 29.544 -7.779 235 HB3 LYS 448 HB3 LYS 448 -16.517 29.431 -6.143 236 HG2 LYS 448 HG2 LYS 448 -14.432 28.456 -7.088 237 HG3 LYS 448 HG3 LYS 448 -15.099 28.652 -8.724 238 HD2 LYS 448 HD2 LYS 448 -15.282 31.096 -8.362 239 HD3 LYS 448 HD3 LYS 448 -14.612 30.898 -6.723 240 HE2 LYS 448 HE2 LYS 448 -12.537 29.960 -7.683 241 HE3 LYS 448 HE3 LYS 448 -13.204 30.133 -9.315 242 HZ1 LYS 448 HZ1 LYS 448 -11.762 31.965 -8.744 243 HZ2 LYS 448 HZ2 LYS 448 -13.298 32.501 -8.963 244 HZ3 LYS 448 HZ3 LYS 448 -12.692 32.347 -7.442 245 H ALA 449 H ALA 449 -18.972 25.940 -7.603 246 HA ALA 449 HA ALA 449 -20.991 27.184 -6.000 247 HB1 ALA 449 HB1 ALA 449 -20.795 24.348 -7.110 248 HB2 ALA 449 HB2 ALA 449 -22.269 25.114 -6.474 249 HB3 ALA 449 HB3 ALA 449 -21.495 25.752 -7.946 250 HA PRO 450 HA PRO 450 -19.730 25.740 -2.054 251 HB2 PRO 450 HB2 PRO 450 -22.082 25.865 -0.643 252 HB3 PRO 450 HB3 PRO 450 -21.163 27.314 -1.150 253 HG2 PRO 450 HG2 PRO 450 -23.570 26.045 -2.486 254 HG3 PRO 450 HG3 PRO 450 -23.248 27.787 -2.181 255 HD2 PRO 450 HD2 PRO 450 -22.799 26.584 -4.604 256 HD3 PRO 450 HD3 PRO 450 -21.771 27.917 -3.997 257 H LYS 451 H LYS 451 -19.662 23.882 -0.763 258 HA LYS 451 HA LYS 451 -20.750 21.449 -1.834 259 HB2 LYS 451 HB2 LYS 451 -18.637 21.443 -0.646 260 HB3 LYS 451 HB3 LYS 451 -19.370 22.121 0.793 261 HG2 LYS 451 HG2 LYS 451 -20.936 19.906 0.546 262 HG3 LYS 451 HG3 LYS 451 -19.486 19.327 -0.273 263 HD2 LYS 451 HD2 LYS 451 -19.684 20.417 2.567 264 HD3 LYS 451 HD3 LYS 451 -19.295 18.755 2.078 265 HE2 LYS 451 HE2 LYS 451 -17.229 19.571 0.980 266 HE3 LYS 451 HE3 LYS 451 -17.621 21.229 1.479 267 HZ1 LYS 451 HZ1 LYS 451 -17.089 18.969 3.284 268 HZ2 LYS 451 HZ2 LYS 451 -16.080 20.230 2.985 269 HZ3 LYS 451 HZ3 LYS 451 -17.508 20.487 3.762 270 HA PRO 452 HA PRO 452 -23.986 21.801 1.719 271 HB2 PRO 452 HB2 PRO 452 -24.208 24.226 3.021 272 HB3 PRO 452 HB3 PRO 452 -23.212 22.859 3.621 273 HG2 PRO 452 HG2 PRO 452 -22.320 25.294 2.044 274 HG3 PRO 452 HG3 PRO 452 -21.547 24.545 3.480 275 HD2 PRO 452 HD2 PRO 452 -20.679 24.055 0.945 276 HD3 PRO 452 HD3 PRO 452 -20.671 22.787 2.213 277 H ASP 453 H ASP 453 -26.121 23.004 1.736 278 HA ASP 453 HA ASP 453 -26.727 23.875 -0.932 279 HB2 ASP 453 HB2 ASP 453 -28.355 23.831 1.624 280 HB3 ASP 453 HB3 ASP 453 -29.004 24.246 0.030 281 H GLY 454 H GLY 454 -25.480 25.592 1.739 282 HA2 GLY 454 HA2 GLY 454 -25.004 27.839 1.960 283 HA3 GLY 454 HA3 GLY 454 -25.769 28.129 0.381 284 H5' U 1 H5' U 1 0.268 19.014 0.892 285 H5'' U 1 H5'' U 1 0.241 17.462 0.028 286 H4' U 1 H4' U 1 -1.549 17.478 1.675 287 H3' U 1 H3' U 1 -1.969 16.816 -0.973 288 H2' U 1 H2' U 1 -2.769 18.950 -1.636 289 HO2' U 1 HO2' U 1 -4.453 17.653 -2.227 290 H1' U 1 H1' U 1 -4.376 19.127 0.918 291 H3 U 1 H3 U 1 -3.567 23.897 1.066 292 H5 U 1 H5 U 1 -4.413 22.645 -2.856 293 H6 U 1 H6 U 1 -4.165 20.363 -2.132 294 H5' G 2 H5' G 2 -1.667 13.056 -1.120 295 H5'' G 2 H5'' G 2 -1.635 14.790 -1.510 296 H4' G 2 H4' G 2 -2.195 13.188 -3.434 297 H3' G 2 H3' G 2 -3.881 15.558 -2.645 298 H2' G 2 H2' G 2 -5.360 15.093 -4.481 299 HO2' G 2 HO2' G 2 -3.750 14.512 -6.024 300 H1' G 2 H1' G 2 -5.560 12.430 -4.000 301 H8 G 2 H8 G 2 -5.117 15.193 -1.246 302 H1 G 2 H1 G 2 -11.060 12.976 -2.090 303 H21 G 2 H21 G 2 -11.147 11.733 -3.920 304 H22 G 2 H22 G 2 -9.714 11.337 -4.847 305 H5' G 3 H5' G 3 -3.169 18.180 -7.362 306 H5'' G 3 H5'' G 3 -4.840 18.024 -6.788 307 H4' G 3 H4' G 3 -3.730 15.920 -8.660 308 H3' G 3 H3' G 3 -3.374 18.451 -9.496 309 H2' G 3 H2' G 3 -5.468 19.320 -8.880 310 HO2' G 3 HO2' G 3 -5.253 19.499 -11.241 311 H1' G 3 H1' G 3 -7.046 17.002 -9.909 312 H8 G 3 H8 G 3 -6.367 19.575 -7.098 313 H1 G 3 H1 G 3 -12.222 16.966 -7.088 314 H21 G 3 H21 G 3 -12.345 15.369 -8.593 315 H22 G 3 H22 G 3 -10.983 14.916 -9.599 316 H5' U 4 H5' U 4 -5.033 15.432 -13.085 317 H5'' U 4 H5'' U 4 -4.477 16.178 -14.596 318 H4' U 4 H4' U 4 -6.634 15.358 -15.099 319 H3' U 4 H3' U 4 -6.865 18.292 -14.356 320 H2' U 4 H2' U 4 -9.144 18.144 -14.966 321 HO2' U 4 HO2' U 4 -8.828 17.027 -16.942 322 H1' U 4 H1' U 4 -9.482 15.511 -14.034 323 H3 U 4 H3 U 4 -12.224 17.409 -11.017 324 H5 U 4 H5 U 4 -8.783 19.818 -10.778 325 H6 U 4 H6 U 4 -7.776 18.453 -12.492 326 H5' G 5 H5' G 5 -4.904 20.933 -16.603 327 H5'' G 5 H5'' G 5 -4.923 19.707 -15.321 328 H4' G 5 H4' G 5 -4.525 21.938 -14.369 329 H3' G 5 H3' G 5 -6.245 20.138 -13.308 330 H2' G 5 H2' G 5 -8.215 20.769 -14.397 331 HO2' G 5 HO2' G 5 -8.021 22.523 -12.167 332 H1' G 5 H1' G 5 -7.721 23.716 -14.207 333 H8 G 5 H8 G 5 -9.407 20.841 -15.875 334 H1 G 5 H1 G 5 -9.468 26.131 -19.502 335 H21 G 5 H21 G 5 -8.053 27.632 -18.682 336 H22 G 5 H22 G 5 -7.096 27.312 -17.250 Start of MODEL 4 1 H1 GLY 414 H1 NGL 414 -8.311 13.871 -18.731 2 H2 GLY 414 H2 NGL 414 -7.991 14.717 -17.352 3 H3 GLY 414 H3 NGL 414 -9.282 15.128 -18.282 4 HA2 GLY 414 HA2 NGL 414 -9.989 13.951 -16.324 5 HA3 GLY 414 HA3 NGL 414 -10.383 13.076 -17.818 6 HA PRO 415 HA PRO 415 -7.152 10.790 -15.024 7 HB2 PRO 415 HB2 PRO 415 -8.574 9.833 -12.869 8 HB3 PRO 415 HB3 PRO 415 -7.687 11.391 -12.852 9 HG2 PRO 415 HG2 PRO 415 -10.642 10.913 -13.317 10 HG3 PRO 415 HG3 PRO 415 -9.856 12.172 -12.313 11 HD2 PRO 415 HD2 PRO 415 -10.771 12.646 -14.864 12 HD3 PRO 415 HD3 PRO 415 -9.338 13.481 -14.191 13 H LEU 416 H LEU 416 -6.998 8.463 -15.011 14 HA LEU 416 HA LEU 416 -8.912 7.181 -16.796 15 HB2 LEU 416 HB2 LEU 416 -6.509 6.062 -15.302 16 HB3 LEU 416 HB3 LEU 416 -7.379 5.256 -16.613 17 HG LEU 416 HG LEU 416 -5.878 7.903 -16.865 18 HD11 LEU 416 HD11 LEU 416 -5.233 5.096 -17.868 19 HD12 LEU 416 HD12 LEU 416 -4.287 6.565 -18.209 20 HD13 LEU 416 HD13 LEU 416 -4.392 5.952 -16.544 21 HD21 LEU 416 HD21 LEU 416 -7.761 7.780 -18.442 22 HD22 LEU 416 HD22 LEU 416 -6.237 7.526 -19.310 23 HD23 LEU 416 HD23 LEU 416 -7.273 6.135 -18.927 24 H GLY 417 H GLY 417 -10.254 5.423 -16.339 25 HA2 GLY 417 HA2 GLY 417 -11.694 4.144 -15.074 26 HA3 GLY 417 HA3 GLY 417 -10.439 4.111 -13.824 27 H SER 418 H SER 418 -12.242 4.188 -12.285 28 HA SER 418 HA SER 418 -13.861 6.581 -12.075 29 HB2 SER 418 HB2 SER 418 -14.605 4.394 -11.246 30 HB3 SER 418 HB3 SER 418 -13.243 4.347 -10.103 31 HG SER 418 HG SER 418 -15.396 6.196 -10.159 32 H GLY 419 H GLY 419 -10.579 5.890 -11.415 33 HA2 GLY 419 HA2 GLY 419 -8.930 7.166 -10.452 34 HA3 GLY 419 HA3 GLY 419 -10.122 8.442 -10.158 35 H GLN 420 H GLN 420 -8.286 8.120 -8.230 36 HA GLN 420 HA GLN 420 -9.019 6.241 -6.186 37 HB2 GLN 420 HB2 GLN 420 -7.588 7.644 -4.738 38 HB3 GLN 420 HB3 GLN 420 -6.780 7.154 -6.226 39 HG2 GLN 420 HG2 GLN 420 -8.198 9.829 -6.159 40 HG3 GLN 420 HG3 GLN 420 -6.656 9.654 -5.317 41 HE21 GLN 420 HE21 GLN 420 -5.367 10.759 -8.465 42 HE22 GLN 420 HE22 GLN 420 -5.922 11.313 -6.900 43 H GLN 421 H GLN 421 -10.059 6.654 -4.169 44 HA GLN 421 HA GLN 421 -11.861 9.021 -4.098 45 HB2 GLN 421 HB2 GLN 421 -12.720 6.121 -3.751 46 HB3 GLN 421 HB3 GLN 421 -13.745 7.540 -3.497 47 HG2 GLN 421 HG2 GLN 421 -12.417 6.804 -6.145 48 HG3 GLN 421 HG3 GLN 421 -14.093 6.437 -5.731 49 HE21 GLN 421 HE21 GLN 421 -13.931 9.617 -7.755 50 HE22 GLN 421 HE22 GLN 421 -13.296 8.007 -7.991 51 H ARG 422 H ARG 422 -12.578 9.575 -1.990 52 HA ARG 422 HA ARG 422 -11.483 8.011 0.272 53 HB2 ARG 422 HB2 ARG 422 -11.052 10.999 -0.097 54 HB3 ARG 422 HB3 ARG 422 -10.653 10.065 1.355 55 HG2 ARG 422 HG2 ARG 422 -9.063 8.682 -0.013 56 HG3 ARG 422 HG3 ARG 422 -9.395 9.743 -1.401 57 HD2 ARG 422 HD2 ARG 422 -8.727 11.709 0.082 58 HD3 ARG 422 HD3 ARG 422 -8.210 10.530 1.292 59 HE ARG 422 HE ARG 422 -6.998 10.016 -1.290 60 HH11 ARG 422 HH11 ARG 422 -6.847 12.167 1.519 61 HH12 ARG 422 HH12 ARG 422 -5.137 12.479 1.333 62 HH21 ARG 422 HH21 ARG 422 -4.730 10.332 -1.409 63 HH22 ARG 422 HH22 ARG 422 -3.946 11.440 -0.309 64 H ALA 423 H ALA 423 -12.586 8.390 2.272 65 HA ALA 423 HA ALA 423 -15.378 8.835 1.983 66 HB1 ALA 423 HB1 ALA 423 -13.628 8.875 4.476 67 HB2 ALA 423 HB2 ALA 423 -15.401 8.715 4.440 68 HB3 ALA 423 HB3 ALA 423 -14.381 7.433 3.747 69 H GLY 424 H GLY 424 -16.550 10.656 1.945 70 HA2 GLY 424 HA2 GLY 424 -17.141 12.789 2.855 71 HA3 GLY 424 HA3 GLY 424 -15.422 13.134 3.143 72 H ASP 425 H ASP 425 -15.227 11.725 0.206 73 HA ASP 425 HA ASP 425 -14.997 14.075 -1.325 74 HB2 ASP 425 HB2 ASP 425 -15.525 11.201 -2.102 75 HB3 ASP 425 HB3 ASP 425 -15.253 12.480 -3.290 76 H TRP 426 H TRP 426 -16.324 14.957 -3.049 77 HA TRP 426 HA TRP 426 -19.163 14.212 -3.011 78 HB2 TRP 426 HB2 TRP 426 -19.931 16.389 -2.263 79 HB3 TRP 426 HB3 TRP 426 -18.944 15.610 -1.032 80 HD1 TRP 426 HD1 TRP 426 -16.510 16.652 -0.564 81 HE1 TRP 426 HE1 TRP 426 -15.563 19.000 -0.867 82 HE3 TRP 426 HE3 TRP 426 -20.014 18.516 -3.781 83 HZ2 TRP 426 HZ2 TRP 426 -16.220 21.397 -2.366 84 HZ3 TRP 426 HZ3 TRP 426 -19.814 20.831 -4.643 85 HH2 TRP 426 HH2 TRP 426 -17.950 22.277 -3.923 86 H LYS 427 H LYS 427 -20.308 14.938 -4.794 87 HA LYS 427 HA LYS 427 -18.618 15.997 -6.978 88 HB2 LYS 427 HB2 LYS 427 -20.139 13.908 -7.132 89 HB3 LYS 427 HB3 LYS 427 -21.492 15.063 -7.157 90 HG2 LYS 427 HG2 LYS 427 -20.204 16.220 -9.103 91 HG3 LYS 427 HG3 LYS 427 -19.183 14.764 -9.117 92 HD2 LYS 427 HD2 LYS 427 -20.926 14.477 -10.775 93 HD3 LYS 427 HD3 LYS 427 -21.311 13.402 -9.410 94 HE2 LYS 427 HE2 LYS 427 -22.875 15.134 -8.529 95 HE3 LYS 427 HE3 LYS 427 -22.473 16.180 -9.898 96 HZ1 LYS 427 HZ1 LYS 427 -23.357 14.492 -11.361 97 HZ2 LYS 427 HZ2 LYS 427 -23.733 13.526 -10.083 98 HZ3 LYS 427 HZ3 LYS 427 -24.501 14.963 -10.278 99 H CYS 428 H CYS 428 -19.216 17.848 -8.205 100 HA CYS 428 HA CYS 428 -20.266 20.011 -6.727 101 HB2 CYS 428 HB2 CYS 428 -18.671 20.133 -8.637 102 HB3 CYS 428 HB3 CYS 428 -19.995 19.702 -9.742 103 HA PRO 429 HA PRO 429 -24.606 19.161 -7.283 104 HB2 PRO 429 HB2 PRO 429 -25.626 21.441 -6.172 105 HB3 PRO 429 HB3 PRO 429 -24.857 20.144 -5.200 106 HG2 PRO 429 HG2 PRO 429 -23.638 22.743 -6.167 107 HG3 PRO 429 HG3 PRO 429 -23.524 21.988 -4.541 108 HD2 PRO 429 HD2 PRO 429 -21.562 21.743 -6.462 109 HD3 PRO 429 HD3 PRO 429 -21.903 20.461 -5.268 110 H ASN 430 H ASN 430 -22.821 21.726 -8.796 111 HA ASN 430 HA ASN 430 -25.015 23.012 -10.152 112 HB2 ASN 430 HB2 ASN 430 -22.356 23.565 -9.731 113 HB3 ASN 430 HB3 ASN 430 -22.307 22.973 -11.400 114 HD21 ASN 430 HD21 ASN 430 -22.736 26.645 -11.521 115 HD22 ASN 430 HD22 ASN 430 -21.539 25.520 -10.911 116 HA PRO 431 HA PRO 431 -25.545 19.607 -13.056 117 HB2 PRO 431 HB2 PRO 431 -27.364 20.825 -14.738 118 HB3 PRO 431 HB3 PRO 431 -27.790 20.117 -13.146 119 HG2 PRO 431 HG2 PRO 431 -27.237 23.011 -13.839 120 HG3 PRO 431 HG3 PRO 431 -28.546 22.339 -12.810 121 HD2 PRO 431 HD2 PRO 431 -26.249 23.414 -11.790 122 HD3 PRO 431 HD3 PRO 431 -27.075 22.035 -10.997 123 H THR 432 H THR 432 -24.442 22.857 -13.698 124 HA THR 432 HA THR 432 -23.538 22.162 -16.396 125 HB THR 432 HB THR 432 -23.118 24.402 -16.766 126 HG1 THR 432 HG1 THR 432 -22.864 25.878 -15.060 127 HG21 THR 432 HG21 THR 432 -25.329 24.496 -14.663 128 HG22 THR 432 HG22 THR 432 -25.085 25.614 -16.019 129 HG23 THR 432 HG23 THR 432 -25.560 23.934 -16.340 130 H CYS 433 H CYS 433 -22.403 21.419 -13.430 131 HA CYS 433 HA CYS 433 -19.546 21.787 -14.206 132 HB2 CYS 433 HB2 CYS 433 -20.282 23.166 -12.273 133 HB3 CYS 433 HB3 CYS 433 -20.782 21.677 -11.438 134 H GLU 434 H GLU 434 -21.439 19.850 -11.859 135 HA GLU 434 HA GLU 434 -21.273 17.704 -11.181 136 HB2 GLU 434 HB2 GLU 434 -20.979 17.264 -14.174 137 HB3 GLU 434 HB3 GLU 434 -21.335 15.990 -12.986 138 HG2 GLU 434 HG2 GLU 434 -23.351 17.241 -12.261 139 HG3 GLU 434 HG3 GLU 434 -23.029 18.464 -13.511 140 H ASN 435 H ASN 435 -18.613 19.282 -11.616 141 HA ASN 435 HA ASN 435 -16.609 17.297 -12.128 142 HB2 ASN 435 HB2 ASN 435 -16.207 19.729 -12.275 143 HB3 ASN 435 HB3 ASN 435 -16.494 19.880 -10.529 144 HD21 ASN 435 HD21 ASN 435 -13.142 19.239 -9.758 145 HD22 ASN 435 HD22 ASN 435 -14.672 19.971 -9.322 146 H MET 436 H MET 436 -15.404 16.008 -10.667 147 HA MET 436 HA MET 436 -16.733 15.509 -8.099 148 HB2 MET 436 HB2 MET 436 -15.806 13.717 -9.726 149 HB3 MET 436 HB3 MET 436 -14.201 14.197 -9.134 150 HG2 MET 436 HG2 MET 436 -14.951 12.355 -7.763 151 HG3 MET 436 HG3 MET 436 -15.076 13.820 -6.781 152 HE1 MET 436 HE1 MET 436 -16.536 11.835 -5.330 153 HE2 MET 436 HE2 MET 436 -16.779 13.584 -5.083 154 HE3 MET 436 HE3 MET 436 -18.185 12.502 -5.187 155 H ASN 437 H ASN 437 -16.070 16.330 -6.166 156 HA ASN 437 HA ASN 437 -13.504 17.843 -6.165 157 HB2 ASN 437 HB2 ASN 437 -16.045 18.340 -4.590 158 HB3 ASN 437 HB3 ASN 437 -14.587 19.324 -4.518 159 HD21 ASN 437 HD21 ASN 437 -17.347 20.222 -7.245 160 HD22 ASN 437 HD22 ASN 437 -17.608 19.255 -5.803 161 H PHE 438 H PHE 438 -12.148 17.709 -4.403 162 HA PHE 438 HA PHE 438 -12.230 15.199 -3.013 163 HB2 PHE 438 HB2 PHE 438 -10.365 17.570 -2.852 164 HB3 PHE 438 HB3 PHE 438 -10.160 16.121 -1.883 165 HD1 PHE 438 HD1 PHE 438 -11.073 14.098 -4.095 166 HD2 PHE 438 HD2 PHE 438 -8.341 17.435 -4.116 167 HE1 PHE 438 HE1 PHE 438 -9.792 13.049 -5.931 168 HE2 PHE 438 HE2 PHE 438 -7.042 16.345 -5.921 169 HZ PHE 438 HZ PHE 438 -7.776 14.168 -6.840 170 H SER 439 H SER 439 -11.931 14.904 -0.676 171 HA SER 439 HA SER 439 -14.311 15.762 0.572 172 HB2 SER 439 HB2 SER 439 -13.236 13.637 1.089 173 HB3 SER 439 HB3 SER 439 -11.779 14.472 1.664 174 HG SER 439 HG SER 439 -13.181 13.852 3.372 175 H TRP 440 H TRP 440 -11.025 17.116 0.672 176 HA TRP 440 HA TRP 440 -11.618 18.670 3.069 177 HB2 TRP 440 HB2 TRP 440 -9.346 19.661 2.573 178 HB3 TRP 440 HB3 TRP 440 -9.414 17.935 2.922 179 HD1 TRP 440 HD1 TRP 440 -8.663 16.276 1.052 180 HE1 TRP 440 HE1 TRP 440 -7.480 16.523 -1.183 181 HE3 TRP 440 HE3 TRP 440 -9.236 21.317 0.410 182 HZ2 TRP 440 HZ2 TRP 440 -6.834 18.656 -3.036 183 HZ3 TRP 440 HZ3 TRP 440 -8.361 22.419 -1.612 184 HH2 TRP 440 HH2 TRP 440 -7.120 21.109 -3.332 185 H ARG 441 H ARG 441 -12.348 19.096 -0.246 186 HA ARG 441 HA ARG 441 -12.207 22.013 -0.180 187 HB2 ARG 441 HB2 ARG 441 -13.453 20.040 -2.135 188 HB3 ARG 441 HB3 ARG 441 -13.540 21.801 -2.314 189 HG2 ARG 441 HG2 ARG 441 -11.030 21.885 -2.202 190 HG3 ARG 441 HG3 ARG 441 -11.014 20.107 -2.235 191 HD2 ARG 441 HD2 ARG 441 -12.226 20.141 -4.395 192 HD3 ARG 441 HD3 ARG 441 -12.283 21.905 -4.354 193 HE ARG 441 HE ARG 441 -10.032 20.195 -5.084 194 HH11 ARG 441 HH11 ARG 441 -10.938 23.406 -3.890 195 HH12 ARG 441 HH12 ARG 441 -9.455 24.150 -4.432 196 HH21 ARG 441 HH21 ARG 441 -8.110 21.188 -5.759 197 HH22 ARG 441 HH22 ARG 441 -7.855 22.901 -5.498 198 H ASN 442 H ASN 442 -13.927 23.460 -0.012 199 HA ASN 442 HA ASN 442 -16.503 22.290 0.935 200 HB2 ASN 442 HB2 ASN 442 -15.152 24.917 1.655 201 HB3 ASN 442 HB3 ASN 442 -16.804 24.474 2.127 202 HD21 ASN 442 HD21 ASN 442 -14.154 23.577 4.766 203 HD22 ASN 442 HD22 ASN 442 -14.356 25.010 3.783 204 H GLU 443 H GLU 443 -14.945 23.843 -1.610 205 HA GLU 443 HA GLU 443 -17.554 24.649 -2.760 206 HB2 GLU 443 HB2 GLU 443 -14.990 26.244 -3.133 207 HB3 GLU 443 HB3 GLU 443 -16.607 26.638 -3.716 208 HG2 GLU 443 HG2 GLU 443 -16.539 27.983 -1.851 209 HG3 GLU 443 HG3 GLU 443 -17.259 26.526 -1.153 210 H CYS 444 H CYS 444 -17.538 24.646 -5.124 211 HA CYS 444 HA CYS 444 -16.315 22.315 -6.183 212 HB2 CYS 444 HB2 CYS 444 -18.438 23.286 -6.993 213 HB3 CYS 444 HB3 CYS 444 -17.555 24.703 -7.603 214 H ASN 445 H ASN 445 -14.651 22.056 -7.715 215 HA ASN 445 HA ASN 445 -12.489 23.999 -7.348 216 HB2 ASN 445 HB2 ASN 445 -12.426 21.379 -7.210 217 HB3 ASN 445 HB3 ASN 445 -12.396 21.438 -8.972 218 HD21 ASN 445 HD21 ASN 445 -8.874 21.291 -8.179 219 HD22 ASN 445 HD22 ASN 445 -10.296 20.323 -8.535 220 H GLN 446 H GLN 446 -15.081 23.988 -9.357 221 HA GLN 446 HA GLN 446 -13.516 24.924 -11.716 222 HB2 GLN 446 HB2 GLN 446 -15.891 23.021 -11.763 223 HB3 GLN 446 HB3 GLN 446 -15.020 23.640 -13.173 224 HG2 GLN 446 HG2 GLN 446 -13.759 21.948 -10.965 225 HG3 GLN 446 HG3 GLN 446 -14.365 21.300 -12.482 226 HE21 GLN 446 HE21 GLN 446 -10.664 21.895 -12.782 227 HE22 GLN 446 HE22 GLN 446 -11.682 20.982 -11.680 228 H CYS 447 H CYS 447 -16.572 24.908 -9.879 229 HA CYS 447 HA CYS 447 -17.291 27.442 -11.287 230 HB2 CYS 447 HB2 CYS 447 -19.654 26.756 -11.204 231 HB3 CYS 447 HB3 CYS 447 -18.669 25.619 -12.149 232 H LYS 448 H LYS 448 -16.276 26.245 -8.424 233 HA LYS 448 HA LYS 448 -16.269 27.006 -6.299 234 HB2 LYS 448 HB2 LYS 448 -17.332 29.562 -7.561 235 HB3 LYS 448 HB3 LYS 448 -16.607 29.426 -5.952 236 HG2 LYS 448 HG2 LYS 448 -15.186 28.758 -8.564 237 HG3 LYS 448 HG3 LYS 448 -15.010 30.276 -7.658 238 HD2 LYS 448 HD2 LYS 448 -14.246 28.938 -5.669 239 HD3 LYS 448 HD3 LYS 448 -14.260 27.484 -6.687 240 HE2 LYS 448 HE2 LYS 448 -12.630 30.006 -7.209 241 HE3 LYS 448 HE3 LYS 448 -12.002 28.485 -6.538 242 HZ1 LYS 448 HZ1 LYS 448 -11.593 28.650 -8.884 243 HZ2 LYS 448 HZ2 LYS 448 -12.610 27.397 -8.582 244 HZ3 LYS 448 HZ3 LYS 448 -13.200 28.798 -9.209 245 H ALA 449 H ALA 449 -18.960 25.925 -7.531 246 HA ALA 449 HA ALA 449 -21.027 27.066 -5.914 247 HB1 ALA 449 HB1 ALA 449 -20.752 24.261 -7.064 248 HB2 ALA 449 HB2 ALA 449 -22.250 25.000 -6.453 249 HB3 ALA 449 HB3 ALA 449 -21.455 25.665 -7.897 250 HA PRO 450 HA PRO 450 -19.763 25.538 -1.993 251 HB2 PRO 450 HB2 PRO 450 -22.140 25.625 -0.602 252 HB3 PRO 450 HB3 PRO 450 -21.199 27.089 -1.056 253 HG2 PRO 450 HG2 PRO 450 -23.604 25.873 -2.433 254 HG3 PRO 450 HG3 PRO 450 -23.272 27.602 -2.093 255 HD2 PRO 450 HD2 PRO 450 -22.797 26.454 -4.545 256 HD3 PRO 450 HD3 PRO 450 -21.776 27.771 -3.897 257 H LYS 451 H LYS 451 -19.674 23.622 -0.800 258 HA LYS 451 HA LYS 451 -20.781 21.245 -1.966 259 HB2 LYS 451 HB2 LYS 451 -18.654 21.169 -0.831 260 HB3 LYS 451 HB3 LYS 451 -19.344 21.791 0.654 261 HG2 LYS 451 HG2 LYS 451 -20.937 19.591 0.347 262 HG3 LYS 451 HG3 LYS 451 -19.500 19.041 -0.516 263 HD2 LYS 451 HD2 LYS 451 -19.661 20.029 2.359 264 HD3 LYS 451 HD3 LYS 451 -19.286 18.380 1.802 265 HE2 LYS 451 HE2 LYS 451 -17.233 19.243 0.701 266 HE3 LYS 451 HE3 LYS 451 -17.606 20.869 1.297 267 HZ1 LYS 451 HZ1 LYS 451 -17.446 20.010 3.534 268 HZ2 LYS 451 HZ2 LYS 451 -17.063 18.507 2.972 269 HZ3 LYS 451 HZ3 LYS 451 -16.041 19.768 2.714 270 HA PRO 452 HA PRO 452 -23.943 21.357 1.666 271 HB2 PRO 452 HB2 PRO 452 -24.127 23.619 3.194 272 HB3 PRO 452 HB3 PRO 452 -23.060 22.238 3.616 273 HG2 PRO 452 HG2 PRO 452 -22.327 24.823 2.199 274 HG3 PRO 452 HG3 PRO 452 -21.467 24.003 3.547 275 HD2 PRO 452 HD2 PRO 452 -20.679 23.720 0.960 276 HD3 PRO 452 HD3 PRO 452 -20.599 22.363 2.118 277 H ASP 453 H ASP 453 -26.003 22.775 2.066 278 HA ASP 453 HA ASP 453 -26.781 23.903 -0.479 279 HB2 ASP 453 HB2 ASP 453 -28.972 24.265 0.749 280 HB3 ASP 453 HB3 ASP 453 -28.396 22.594 0.594 281 H GLY 454 H GLY 454 -25.213 25.262 2.204 282 HA2 GLY 454 HA2 GLY 454 -26.551 27.852 2.120 283 HA3 GLY 454 HA3 GLY 454 -25.133 27.407 3.089 284 H5' U 1 H5' U 1 0.109 18.572 0.180 285 H5'' U 1 H5'' U 1 0.152 17.012 -0.668 286 H4' U 1 H4' U 1 -1.643 16.956 0.968 287 H3' U 1 H3' U 1 -2.054 16.294 -1.685 288 H2' U 1 H2' U 1 -2.936 18.405 -2.328 289 HO2' U 1 HO2' U 1 -4.552 17.009 -2.895 290 H1' U 1 H1' U 1 -4.523 18.505 0.237 291 H3 U 1 H3 U 1 -3.954 23.283 0.461 292 H5 U 1 H5 U 1 -4.664 22.075 -3.501 293 H6 U 1 H6 U 1 -4.335 19.794 -2.815 294 H5' G 2 H5' G 2 -1.684 12.668 -1.990 295 H5'' G 2 H5'' G 2 -1.929 14.371 -2.444 296 H4' G 2 H4' G 2 -2.509 12.483 -4.182 297 H3' G 2 H3' G 2 -4.147 14.915 -3.498 298 H2' G 2 H2' G 2 -5.851 14.211 -5.030 299 HO2' G 2 HO2' G 2 -4.233 13.422 -6.622 300 H1' G 2 H1' G 2 -5.923 11.623 -4.262 301 H8 G 2 H8 G 2 -5.195 14.624 -1.849 302 H1 G 2 H1 G 2 -11.207 12.400 -1.893 303 H21 G 2 H21 G 2 -11.433 10.899 -3.513 304 H22 G 2 H22 G 2 -10.087 10.391 -4.507 305 H5' G 3 H5' G 3 -4.857 14.228 -8.083 306 H5'' G 3 H5'' G 3 -3.221 14.909 -8.172 307 H4' G 3 H4' G 3 -4.552 15.405 -10.198 308 H3' G 3 H3' G 3 -2.945 17.192 -8.812 309 H2' G 3 H2' G 3 -4.688 18.249 -7.621 310 HO2' G 3 HO2' G 3 -4.570 19.588 -10.138 311 H1' G 3 H1' G 3 -6.447 18.157 -10.073 312 H8 G 3 H8 G 3 -6.236 19.719 -6.958 313 H1 G 3 H1 G 3 -11.953 16.843 -7.342 314 H21 G 3 H21 G 3 -11.921 15.288 -8.922 315 H22 G 3 H22 G 3 -10.492 14.965 -9.878 316 H5' U 4 H5' U 4 -3.921 16.393 -14.466 317 H5'' U 4 H5'' U 4 -4.728 17.544 -13.383 318 H4' U 4 H4' U 4 -5.738 14.713 -13.913 319 H3' U 4 H3' U 4 -6.062 17.240 -15.412 320 H2' U 4 H2' U 4 -8.125 17.738 -14.648 321 HO2' U 4 HO2' U 4 -9.821 16.282 -15.175 322 H1' U 4 H1' U 4 -8.513 15.127 -13.230 323 H3 U 4 H3 U 4 -11.969 17.409 -11.348 324 H5 U 4 H5 U 4 -8.663 19.924 -10.716 325 H6 U 4 H6 U 4 -7.315 18.391 -12.006 326 H5' G 5 H5' G 5 -5.462 12.367 -16.913 327 H5'' G 5 H5'' G 5 -5.663 12.669 -15.171 328 H4' G 5 H4' G 5 -3.061 11.776 -16.495 329 H3' G 5 H3' G 5 -5.343 10.202 -16.198 330 H2' G 5 H2' G 5 -5.411 10.369 -13.828 331 HO2' G 5 HO2' G 5 -4.422 8.430 -13.016 332 H1' G 5 H1' G 5 -2.379 10.178 -13.864 333 H8 G 5 H8 G 5 -5.269 10.099 -11.648 334 H1 G 5 H1 G 5 -0.433 13.380 -8.998 335 H21 G 5 H21 G 5 1.082 13.883 -10.547 336 H22 G 5 H22 G 5 0.887 13.405 -12.218 Start of MODEL 5 1 H1 GLY 414 H1 NGL 414 -9.625 12.641 -17.598 2 H2 GLY 414 H2 NGL 414 -9.044 14.076 -18.160 3 H3 GLY 414 H3 NGL 414 -10.665 13.863 -17.967 4 HA2 GLY 414 HA2 NGL 414 -9.788 15.224 -16.208 5 HA3 GLY 414 HA3 NGL 414 -10.447 13.695 -15.599 6 HA PRO 415 HA PRO 415 -5.935 14.302 -14.312 7 HB2 PRO 415 HB2 PRO 415 -6.340 14.705 -11.618 8 HB3 PRO 415 HB3 PRO 415 -6.296 16.037 -12.814 9 HG2 PRO 415 HG2 PRO 415 -8.702 14.656 -11.603 10 HG3 PRO 415 HG3 PRO 415 -8.450 16.410 -11.895 11 HD2 PRO 415 HD2 PRO 415 -9.911 14.804 -13.579 12 HD3 PRO 415 HD3 PRO 415 -8.954 16.201 -14.170 13 H LEU 416 H LEU 416 -4.711 12.779 -12.990 14 HA LEU 416 HA LEU 416 -5.877 10.150 -12.971 15 HB2 LEU 416 HB2 LEU 416 -3.314 11.188 -11.695 16 HB3 LEU 416 HB3 LEU 416 -3.714 9.482 -11.982 17 HG LEU 416 HG LEU 416 -3.384 11.615 -14.144 18 HD11 LEU 416 HD11 LEU 416 -1.609 9.292 -13.298 19 HD12 LEU 416 HD12 LEU 416 -1.324 10.373 -14.685 20 HD13 LEU 416 HD13 LEU 416 -1.271 11.020 -13.027 21 HD21 LEU 416 HD21 LEU 416 -4.965 9.851 -14.836 22 HD22 LEU 416 HD22 LEU 416 -3.424 9.653 -15.686 23 HD23 LEU 416 HD23 LEU 416 -3.817 8.596 -14.307 24 H GLY 417 H GLY 417 -5.874 12.758 -10.680 25 HA2 GLY 417 HA2 GLY 417 -6.181 11.145 -8.291 26 HA3 GLY 417 HA3 GLY 417 -6.497 12.886 -8.460 27 H SER 418 H SER 418 -8.263 11.904 -10.945 28 HA SER 418 HA SER 418 -10.748 11.988 -9.461 29 HB2 SER 418 HB2 SER 418 -10.425 13.062 -11.673 30 HB3 SER 418 HB3 SER 418 -10.199 11.461 -12.409 31 HG SER 418 HG SER 418 -12.304 10.929 -11.775 32 H GLY 419 H GLY 419 -8.588 9.462 -10.453 33 HA2 GLY 419 HA2 GLY 419 -10.643 7.374 -10.547 34 HA3 GLY 419 HA3 GLY 419 -8.883 7.172 -10.676 35 H GLN 420 H GLN 420 -8.855 9.050 -8.117 36 HA GLN 420 HA GLN 420 -8.794 6.833 -6.208 37 HB2 GLN 420 HB2 GLN 420 -8.287 9.818 -5.831 38 HB3 GLN 420 HB3 GLN 420 -7.877 8.536 -4.679 39 HG2 GLN 420 HG2 GLN 420 -6.732 8.827 -7.488 40 HG3 GLN 420 HG3 GLN 420 -5.905 9.275 -5.991 41 HE21 GLN 420 HE21 GLN 420 -4.771 5.863 -7.106 42 HE22 GLN 420 HE22 GLN 420 -4.827 7.444 -7.857 43 H GLN 421 H GLN 421 -9.799 7.169 -4.001 44 HA GLN 421 HA GLN 421 -12.196 8.856 -3.954 45 HB2 GLN 421 HB2 GLN 421 -12.999 6.797 -5.013 46 HB3 GLN 421 HB3 GLN 421 -12.345 5.823 -3.691 47 HG2 GLN 421 HG2 GLN 421 -14.301 8.076 -3.136 48 HG3 GLN 421 HG3 GLN 421 -14.895 6.520 -3.719 49 HE21 GLN 421 HE21 GLN 421 -15.002 6.520 0.027 50 HE22 GLN 421 HE22 GLN 421 -15.668 7.550 -1.217 51 H ARG 422 H ARG 422 -12.694 9.519 -1.896 52 HA ARG 422 HA ARG 422 -11.506 8.095 0.414 53 HB2 ARG 422 HB2 ARG 422 -11.149 11.061 -0.129 54 HB3 ARG 422 HB3 ARG 422 -10.719 10.232 1.374 55 HG2 ARG 422 HG2 ARG 422 -9.142 8.773 0.058 56 HG3 ARG 422 HG3 ARG 422 -9.479 9.778 -1.373 57 HD2 ARG 422 HD2 ARG 422 -8.807 11.804 0.029 58 HD3 ARG 422 HD3 ARG 422 -8.269 10.672 1.273 59 HE ARG 422 HE ARG 422 -7.092 10.079 -1.312 60 HH11 ARG 422 HH11 ARG 422 -6.897 12.264 1.459 61 HH12 ARG 422 HH12 ARG 422 -5.183 12.550 1.261 62 HH21 ARG 422 HH21 ARG 422 -4.814 10.352 -1.444 63 HH22 ARG 422 HH22 ARG 422 -4.012 11.468 -0.366 64 H ALA 423 H ALA 423 -12.590 8.515 2.402 65 HA ALA 423 HA ALA 423 -15.401 8.922 2.136 66 HB1 ALA 423 HB1 ALA 423 -13.628 9.045 4.613 67 HB2 ALA 423 HB2 ALA 423 -15.396 8.859 4.604 68 HB3 ALA 423 HB3 ALA 423 -14.366 7.574 3.934 69 H GLY 424 H GLY 424 -16.546 10.747 1.976 70 HA2 GLY 424 HA2 GLY 424 -17.140 12.903 2.873 71 HA3 GLY 424 HA3 GLY 424 -15.418 13.263 3.103 72 H ASP 425 H ASP 425 -15.276 11.759 0.214 73 HA ASP 425 HA ASP 425 -15.047 14.067 -1.380 74 HB2 ASP 425 HB2 ASP 425 -15.546 11.166 -2.054 75 HB3 ASP 425 HB3 ASP 425 -15.324 12.402 -3.293 76 H TRP 426 H TRP 426 -16.369 14.969 -3.064 77 HA TRP 426 HA TRP 426 -19.214 14.241 -2.997 78 HB2 TRP 426 HB2 TRP 426 -19.945 16.430 -2.237 79 HB3 TRP 426 HB3 TRP 426 -18.948 15.630 -1.017 80 HD1 TRP 426 HD1 TRP 426 -16.498 16.640 -0.584 81 HE1 TRP 426 HE1 TRP 426 -15.524 18.980 -0.887 82 HE3 TRP 426 HE3 TRP 426 -20.024 18.577 -3.731 83 HZ2 TRP 426 HZ2 TRP 426 -16.177 21.398 -2.339 84 HZ3 TRP 426 HZ3 TRP 426 -19.820 20.905 -4.551 85 HH2 TRP 426 HH2 TRP 426 -17.916 22.316 -3.862 86 H LYS 427 H LYS 427 -20.323 14.853 -4.802 87 HA LYS 427 HA LYS 427 -18.693 15.935 -6.997 88 HB2 LYS 427 HB2 LYS 427 -20.282 13.889 -7.105 89 HB3 LYS 427 HB3 LYS 427 -21.595 15.084 -7.120 90 HG2 LYS 427 HG2 LYS 427 -20.319 16.207 -9.080 91 HG3 LYS 427 HG3 LYS 427 -19.327 14.732 -9.115 92 HD2 LYS 427 HD2 LYS 427 -21.093 14.481 -10.744 93 HD3 LYS 427 HD3 LYS 427 -21.482 13.412 -9.379 94 HE2 LYS 427 HE2 LYS 427 -23.006 15.160 -8.463 95 HE3 LYS 427 HE3 LYS 427 -22.597 16.219 -9.820 96 HZ1 LYS 427 HZ1 LYS 427 -24.649 15.038 -10.182 97 HZ2 LYS 427 HZ2 LYS 427 -23.526 14.560 -11.291 98 HZ3 LYS 427 HZ3 LYS 427 -23.901 13.584 -10.024 99 H CYS 428 H CYS 428 -19.245 17.805 -8.194 100 HA CYS 428 HA CYS 428 -20.246 19.989 -6.706 101 HB2 CYS 428 HB2 CYS 428 -18.634 20.111 -8.602 102 HB3 CYS 428 HB3 CYS 428 -19.947 19.695 -9.721 103 HA PRO 429 HA PRO 429 -24.587 19.185 -7.263 104 HB2 PRO 429 HB2 PRO 429 -25.593 21.488 -6.176 105 HB3 PRO 429 HB3 PRO 429 -24.841 20.202 -5.183 106 HG2 PRO 429 HG2 PRO 429 -23.596 22.779 -6.177 107 HG3 PRO 429 HG3 PRO 429 -23.491 22.035 -4.545 108 HD2 PRO 429 HD2 PRO 429 -21.528 21.760 -6.449 109 HD3 PRO 429 HD3 PRO 429 -21.898 20.483 -5.248 110 H ASN 430 H ASN 430 -22.795 21.739 -8.786 111 HA ASN 430 HA ASN 430 -24.983 23.010 -10.171 112 HB2 ASN 430 HB2 ASN 430 -22.321 23.568 -9.726 113 HB3 ASN 430 HB3 ASN 430 -22.263 22.984 -11.394 114 HD21 ASN 430 HD21 ASN 430 -22.709 26.639 -11.546 115 HD22 ASN 430 HD22 ASN 430 -21.501 25.522 -10.943 116 HA PRO 431 HA PRO 431 -25.455 19.571 -13.038 117 HB2 PRO 431 HB2 PRO 431 -27.277 20.733 -14.747 118 HB3 PRO 431 HB3 PRO 431 -27.714 20.059 -13.142 119 HG2 PRO 431 HG2 PRO 431 -27.195 22.947 -13.890 120 HG3 PRO 431 HG3 PRO 431 -28.486 22.271 -12.844 121 HD2 PRO 431 HD2 PRO 431 -26.202 23.394 -11.842 122 HD3 PRO 431 HD3 PRO 431 -27.025 22.027 -11.030 123 H THR 432 H THR 432 -24.385 22.819 -13.725 124 HA THR 432 HA THR 432 -23.452 22.085 -16.405 125 HB THR 432 HB THR 432 -23.045 24.329 -16.810 126 HG1 THR 432 HG1 THR 432 -22.819 25.834 -15.151 127 HG21 THR 432 HG21 THR 432 -25.489 23.824 -16.423 128 HG22 THR 432 HG22 THR 432 -25.302 24.425 -14.758 129 HG23 THR 432 HG23 THR 432 -25.050 25.518 -16.134 130 H CYS 433 H CYS 433 -22.336 21.408 -13.427 131 HA CYS 433 HA CYS 433 -19.473 21.786 -14.181 132 HB2 CYS 433 HB2 CYS 433 -20.228 23.176 -12.267 133 HB3 CYS 433 HB3 CYS 433 -20.738 21.692 -11.422 134 H GLU 434 H GLU 434 -21.369 19.856 -11.821 135 HA GLU 434 HA GLU 434 -21.194 17.715 -11.124 136 HB2 GLU 434 HB2 GLU 434 -20.866 17.228 -14.104 137 HB3 GLU 434 HB3 GLU 434 -21.233 15.984 -12.893 138 HG2 GLU 434 HG2 GLU 434 -23.261 17.268 -12.215 139 HG3 GLU 434 HG3 GLU 434 -22.928 18.442 -13.494 140 H ASN 435 H ASN 435 -18.526 19.310 -11.524 141 HA ASN 435 HA ASN 435 -16.515 17.329 -11.991 142 HB2 ASN 435 HB2 ASN 435 -16.120 19.787 -12.034 143 HB3 ASN 435 HB3 ASN 435 -16.415 19.844 -10.282 144 HD21 ASN 435 HD21 ASN 435 -13.047 19.199 -9.568 145 HD22 ASN 435 HD22 ASN 435 -14.565 19.948 -9.118 146 H MET 436 H MET 436 -15.474 15.897 -10.577 147 HA MET 436 HA MET 436 -16.890 15.362 -8.057 148 HB2 MET 436 HB2 MET 436 -16.115 13.576 -9.715 149 HB3 MET 436 HB3 MET 436 -14.455 13.947 -9.208 150 HG2 MET 436 HG2 MET 436 -15.178 12.128 -7.825 151 HG3 MET 436 HG3 MET 436 -15.218 13.574 -6.815 152 HE1 MET 436 HE1 MET 436 -16.900 13.682 -5.131 153 HE2 MET 436 HE2 MET 436 -18.309 12.596 -5.059 154 HE3 MET 436 HE3 MET 436 -16.665 11.915 -5.160 155 H ASN 437 H ASN 437 -16.355 16.711 -6.379 156 HA ASN 437 HA ASN 437 -13.643 17.840 -6.283 157 HB2 ASN 437 HB2 ASN 437 -16.092 18.363 -4.571 158 HB3 ASN 437 HB3 ASN 437 -14.595 19.300 -4.538 159 HD21 ASN 437 HD21 ASN 437 -17.472 20.365 -7.079 160 HD22 ASN 437 HD22 ASN 437 -17.673 19.366 -5.650 161 H PHE 438 H PHE 438 -12.228 17.665 -4.547 162 HA PHE 438 HA PHE 438 -12.268 15.166 -3.149 163 HB2 PHE 438 HB2 PHE 438 -10.465 17.583 -2.992 164 HB3 PHE 438 HB3 PHE 438 -10.222 16.143 -2.013 165 HD1 PHE 438 HD1 PHE 438 -11.114 14.127 -4.289 166 HD2 PHE 438 HD2 PHE 438 -8.363 17.446 -4.162 167 HE1 PHE 438 HE1 PHE 438 -9.768 13.091 -6.077 168 HE2 PHE 438 HE2 PHE 438 -6.993 16.363 -5.917 169 HZ PHE 438 HZ PHE 438 -7.700 14.200 -6.889 170 H SER 439 H SER 439 -12.038 14.836 -0.837 171 HA SER 439 HA SER 439 -14.403 15.731 0.427 172 HB2 SER 439 HB2 SER 439 -13.538 14.508 2.375 173 HB3 SER 439 HB3 SER 439 -13.273 13.576 0.884 174 HG SER 439 HG SER 439 -11.134 14.223 0.902 175 H TRP 440 H TRP 440 -11.116 17.055 0.509 176 HA TRP 440 HA TRP 440 -11.665 18.527 2.978 177 HB2 TRP 440 HB2 TRP 440 -9.361 19.431 2.562 178 HB3 TRP 440 HB3 TRP 440 -9.505 17.682 2.795 179 HD1 TRP 440 HD1 TRP 440 -8.757 16.123 0.857 180 HE1 TRP 440 HE1 TRP 440 -7.548 16.461 -1.352 181 HE3 TRP 440 HE3 TRP 440 -9.218 21.203 0.480 182 HZ2 TRP 440 HZ2 TRP 440 -6.823 18.694 -3.077 183 HZ3 TRP 440 HZ3 TRP 440 -8.278 22.399 -1.457 184 HH2 TRP 440 HH2 TRP 440 -7.047 21.161 -3.227 185 H ARG 441 H ARG 441 -12.351 19.069 -0.325 186 HA ARG 441 HA ARG 441 -12.146 21.979 -0.185 187 HB2 ARG 441 HB2 ARG 441 -13.470 20.082 -2.160 188 HB3 ARG 441 HB3 ARG 441 -13.452 21.849 -2.330 189 HG2 ARG 441 HG2 ARG 441 -10.965 21.811 -2.267 190 HG3 ARG 441 HG3 ARG 441 -11.009 20.033 -2.220 191 HD2 ARG 441 HD2 ARG 441 -12.256 20.021 -4.373 192 HD3 ARG 441 HD3 ARG 441 -12.194 21.783 -4.424 193 HE ARG 441 HE ARG 441 -10.086 19.916 -5.111 194 HH11 ARG 441 HH11 ARG 441 -10.722 23.199 -3.947 195 HH12 ARG 441 HH12 ARG 441 -9.175 23.812 -4.486 196 HH21 ARG 441 HH21 ARG 441 -8.082 20.741 -5.794 197 HH22 ARG 441 HH22 ARG 441 -7.680 22.422 -5.522 198 H ASN 442 H ASN 442 -13.847 23.456 -0.008 199 HA ASN 442 HA ASN 442 -16.436 22.324 0.957 200 HB2 ASN 442 HB2 ASN 442 -15.071 24.947 1.634 201 HB3 ASN 442 HB3 ASN 442 -16.706 24.497 2.152 202 HD21 ASN 442 HD21 ASN 442 -13.992 23.659 4.745 203 HD22 ASN 442 HD22 ASN 442 -14.238 25.075 3.754 204 H GLU 443 H GLU 443 -14.879 23.845 -1.606 205 HA GLU 443 HA GLU 443 -17.487 24.661 -2.746 206 HB2 GLU 443 HB2 GLU 443 -14.932 26.283 -3.116 207 HB3 GLU 443 HB3 GLU 443 -16.561 26.671 -3.671 208 HG2 GLU 443 HG2 GLU 443 -16.467 28.001 -1.806 209 HG3 GLU 443 HG3 GLU 443 -17.174 26.535 -1.107 210 H CYS 444 H CYS 444 -17.486 24.688 -5.095 211 HA CYS 444 HA CYS 444 -16.225 22.392 -6.190 212 HB2 CYS 444 HB2 CYS 444 -18.394 23.297 -6.954 213 HB3 CYS 444 HB3 CYS 444 -17.567 24.745 -7.575 214 H ASN 445 H ASN 445 -14.610 22.178 -7.747 215 HA ASN 445 HA ASN 445 -12.467 24.141 -7.455 216 HB2 ASN 445 HB2 ASN 445 -12.493 21.453 -7.523 217 HB3 ASN 445 HB3 ASN 445 -12.276 21.741 -9.255 218 HD21 ASN 445 HD21 ASN 445 -8.887 21.443 -7.881 219 HD22 ASN 445 HD22 ASN 445 -10.269 20.440 -8.280 220 H GLN 446 H GLN 446 -15.127 24.045 -9.473 221 HA GLN 446 HA GLN 446 -13.577 25.189 -11.755 222 HB2 GLN 446 HB2 GLN 446 -15.878 23.207 -11.961 223 HB3 GLN 446 HB3 GLN 446 -14.970 23.942 -13.296 224 HG2 GLN 446 HG2 GLN 446 -12.880 22.909 -12.041 225 HG3 GLN 446 HG3 GLN 446 -14.072 21.870 -11.269 226 HE21 GLN 446 HE21 GLN 446 -12.815 20.096 -14.301 227 HE22 GLN 446 HE22 GLN 446 -12.119 20.708 -12.815 228 H CYS 447 H CYS 447 -16.639 24.977 -9.972 229 HA CYS 447 HA CYS 447 -17.455 27.536 -11.279 230 HB2 CYS 447 HB2 CYS 447 -19.798 26.785 -11.101 231 HB3 CYS 447 HB3 CYS 447 -18.828 25.695 -12.118 232 H LYS 448 H LYS 448 -16.352 26.257 -8.465 233 HA LYS 448 HA LYS 448 -16.298 26.955 -6.324 234 HB2 LYS 448 HB2 LYS 448 -17.283 29.572 -7.520 235 HB3 LYS 448 HB3 LYS 448 -16.587 29.368 -5.903 236 HG2 LYS 448 HG2 LYS 448 -14.491 28.505 -6.916 237 HG3 LYS 448 HG3 LYS 448 -15.182 28.746 -8.536 238 HD2 LYS 448 HD2 LYS 448 -15.429 31.162 -8.089 239 HD3 LYS 448 HD3 LYS 448 -14.753 30.934 -6.457 240 HE2 LYS 448 HE2 LYS 448 -12.648 30.093 -7.447 241 HE3 LYS 448 HE3 LYS 448 -13.321 30.307 -9.074 242 HZ1 LYS 448 HZ1 LYS 448 -13.496 32.657 -8.629 243 HZ2 LYS 448 HZ2 LYS 448 -12.881 32.467 -7.118 244 HZ3 LYS 448 HZ3 LYS 448 -11.943 32.158 -8.442 245 H ALA 449 H ALA 449 -19.002 25.924 -7.510 246 HA ALA 449 HA ALA 449 -21.041 27.035 -5.846 247 HB1 ALA 449 HB1 ALA 449 -20.749 24.231 -7.004 248 HB2 ALA 449 HB2 ALA 449 -22.251 24.946 -6.369 249 HB3 ALA 449 HB3 ALA 449 -21.494 25.623 -7.827 250 HA PRO 450 HA PRO 450 -19.671 25.527 -1.956 251 HB2 PRO 450 HB2 PRO 450 -22.008 25.636 -0.501 252 HB3 PRO 450 HB3 PRO 450 -21.084 27.089 -0.998 253 HG2 PRO 450 HG2 PRO 450 -23.528 25.868 -2.306 254 HG3 PRO 450 HG3 PRO 450 -23.180 27.597 -1.977 255 HD2 PRO 450 HD2 PRO 450 -22.779 26.421 -4.433 256 HD3 PRO 450 HD3 PRO 450 -21.741 27.749 -3.826 257 H LYS 451 H LYS 451 -19.572 23.615 -0.741 258 HA LYS 451 HA LYS 451 -20.708 21.231 -1.877 259 HB2 LYS 451 HB2 LYS 451 -18.570 21.158 -0.748 260 HB3 LYS 451 HB3 LYS 451 -19.257 21.794 0.737 261 HG2 LYS 451 HG2 LYS 451 -20.850 19.610 0.451 262 HG3 LYS 451 HG3 LYS 451 -19.433 19.041 -0.438 263 HD2 LYS 451 HD2 LYS 451 -19.554 19.998 2.448 264 HD3 LYS 451 HD3 LYS 451 -19.170 18.364 1.857 265 HE2 LYS 451 HE2 LYS 451 -17.132 19.286 0.746 266 HE3 LYS 451 HE3 LYS 451 -17.533 20.886 1.395 267 HZ1 LYS 451 HZ1 LYS 451 -17.318 19.975 3.598 268 HZ2 LYS 451 HZ2 LYS 451 -16.943 18.487 2.994 269 HZ3 LYS 451 HZ3 LYS 451 -15.924 19.754 2.749 270 HA PRO 452 HA PRO 452 -23.839 21.394 1.774 271 HB2 PRO 452 HB2 PRO 452 -24.045 23.729 3.220 272 HB3 PRO 452 HB3 PRO 452 -22.984 22.361 3.695 273 HG2 PRO 452 HG2 PRO 452 -22.236 24.892 2.204 274 HG3 PRO 452 HG3 PRO 452 -21.379 24.106 3.572 275 HD2 PRO 452 HD2 PRO 452 -20.591 23.748 1.001 276 HD3 PRO 452 HD3 PRO 452 -20.517 22.418 2.195 277 H ASP 453 H ASP 453 -25.992 22.482 1.891 278 HA ASP 453 HA ASP 453 -26.686 23.607 -0.677 279 HB2 ASP 453 HB2 ASP 453 -28.088 22.038 0.709 280 HB3 ASP 453 HB3 ASP 453 -28.327 23.338 1.883 281 H GLY 454 H GLY 454 -25.454 24.949 2.222 282 HA2 GLY 454 HA2 GLY 454 -25.552 27.631 1.281 283 HA3 GLY 454 HA3 GLY 454 -26.842 27.390 2.479 284 H5' U 1 H5' U 1 -0.097 17.252 -1.430 285 H5'' U 1 H5'' U 1 -0.906 18.824 -1.608 286 H4' U 1 H4' U 1 -1.476 16.878 0.677 287 H3' U 1 H3' U 1 -2.102 16.192 -1.856 288 H2' U 1 H2' U 1 -2.929 18.322 -2.501 289 HO2' U 1 HO2' U 1 -4.554 16.935 -3.089 290 H1' U 1 H1' U 1 -4.613 18.489 -0.007 291 H3 U 1 H3 U 1 -3.570 23.227 0.227 292 H5 U 1 H5 U 1 -4.449 22.041 -3.704 293 H6 U 1 H6 U 1 -4.310 19.744 -2.991 294 H5' G 2 H5' G 2 -1.818 12.511 -2.061 295 H5'' G 2 H5'' G 2 -1.970 14.195 -2.599 296 H4' G 2 H4' G 2 -2.592 12.301 -4.284 297 H3' G 2 H3' G 2 -4.200 14.770 -3.693 298 H2' G 2 H2' G 2 -5.877 14.051 -5.252 299 HO2' G 2 HO2' G 2 -4.267 13.196 -6.788 300 H1' G 2 H1' G 2 -6.015 11.488 -4.399 301 H8 G 2 H8 G 2 -5.302 14.556 -2.066 302 H1 G 2 H1 G 2 -11.306 12.300 -2.096 303 H21 G 2 H21 G 2 -11.523 10.778 -3.671 304 H22 G 2 H22 G 2 -10.171 10.253 -4.660 305 H5' G 3 H5' G 3 -4.351 14.049 -8.017 306 H5'' G 3 H5'' G 3 -2.930 15.025 -8.428 307 H4' G 3 H4' G 3 -4.649 14.882 -10.256 308 H3' G 3 H3' G 3 -3.127 17.068 -9.451 309 H2' G 3 H2' G 3 -4.851 18.203 -8.344 310 HO2' G 3 HO2' G 3 -4.275 19.442 -10.305 311 H1' G 3 H1' G 3 -6.844 17.264 -10.415 312 H8 G 3 H8 G 3 -6.313 19.341 -7.476 313 H1 G 3 H1 G 3 -12.100 16.584 -7.319 314 H21 G 3 H21 G 3 -12.201 14.944 -8.785 315 H22 G 3 H22 G 3 -10.841 14.509 -9.800 316 H5' U 4 H5' U 4 -4.702 17.077 -14.230 317 H5'' U 4 H5'' U 4 -3.856 18.439 -14.998 318 H4' U 4 H4' U 4 -6.074 18.504 -15.867 319 H3' U 4 H3' U 4 -5.829 20.456 -13.560 320 H2' U 4 H2' U 4 -8.047 21.102 -13.995 321 HO2' U 4 HO2' U 4 -7.729 21.445 -16.252 322 H1' U 4 H1' U 4 -8.844 18.564 -15.039 323 H3 U 4 H3 U 4 -11.867 18.296 -11.738 324 H5 U 4 H5 U 4 -8.546 20.003 -9.807 325 H6 U 4 H6 U 4 -7.321 19.842 -11.891 326 H5' G 5 H5' G 5 -4.355 21.599 -12.834 327 H5'' G 5 H5'' G 5 -4.958 23.263 -12.702 328 H4' G 5 H4' G 5 -2.982 23.130 -11.343 329 H3' G 5 H3' G 5 -3.177 25.037 -13.256 330 H2' G 5 H2' G 5 -2.116 23.975 -15.049 331 HO2' G 5 HO2' G 5 -0.722 25.722 -14.582 332 H1' G 5 H1' G 5 0.003 22.616 -13.464 333 H8 G 5 H8 G 5 -2.312 22.677 -16.423 334 H1 G 5 H1 G 5 0.531 16.985 -15.621 335 H21 G 5 H21 G 5 1.509 16.898 -13.629 336 H22 G 5 H22 G 5 1.446 18.230 -12.497 Start of MODEL 6 1 H1 GLY 414 H1 NGL 414 -2.262 23.013 -18.263 2 H2 GLY 414 H2 NGL 414 -2.033 21.938 -17.043 3 H3 GLY 414 H3 NGL 414 -3.554 22.462 -17.397 4 HA2 GLY 414 HA2 NGL 414 -3.469 21.417 -19.553 5 HA3 GLY 414 HA3 NGL 414 -1.845 20.829 -19.135 6 HA PRO 415 HA PRO 415 -5.533 18.307 -17.237 7 HB2 PRO 415 HB2 PRO 415 -6.324 16.653 -19.299 8 HB3 PRO 415 HB3 PRO 415 -7.088 18.235 -18.938 9 HG2 PRO 415 HG2 PRO 415 -4.983 17.577 -21.015 10 HG3 PRO 415 HG3 PRO 415 -6.438 18.617 -21.184 11 HD2 PRO 415 HD2 PRO 415 -3.941 19.636 -20.742 12 HD3 PRO 415 HD3 PRO 415 -5.416 20.406 -20.068 13 H LEU 416 H LEU 416 -5.390 16.069 -16.624 14 HA LEU 416 HA LEU 416 -3.287 14.393 -17.737 15 HB2 LEU 416 HB2 LEU 416 -2.011 15.922 -16.248 16 HB3 LEU 416 HB3 LEU 416 -3.080 15.508 -14.905 17 HG LEU 416 HG LEU 416 -2.325 13.136 -15.048 18 HD11 LEU 416 HD11 LEU 416 -0.295 12.636 -16.407 19 HD12 LEU 416 HD12 LEU 416 -1.670 13.076 -17.440 20 HD13 LEU 416 HD13 LEU 416 -0.389 14.264 -17.128 21 HD21 LEU 416 HD21 LEU 416 -1.234 14.744 -13.526 22 HD22 LEU 416 HD22 LEU 416 -0.082 13.536 -14.133 23 HD23 LEU 416 HD23 LEU 416 -0.088 15.184 -14.813 24 H GLY 417 H GLY 417 -3.412 12.211 -16.891 25 HA2 GLY 417 HA2 GLY 417 -6.139 11.461 -16.290 26 HA3 GLY 417 HA3 GLY 417 -4.745 10.376 -16.493 27 H SER 418 H SER 418 -3.846 12.688 -14.235 28 HA SER 418 HA SER 418 -3.840 10.813 -12.080 29 HB2 SER 418 HB2 SER 418 -2.151 12.566 -12.317 30 HB3 SER 418 HB3 SER 418 -3.400 13.820 -12.125 31 HG SER 418 HG SER 418 -2.563 11.893 -10.220 32 H GLY 419 H GLY 419 -5.053 10.722 -10.177 33 HA2 GLY 419 HA2 GLY 419 -6.923 12.517 -9.217 34 HA3 GLY 419 HA3 GLY 419 -7.824 11.520 -10.374 35 H GLN 420 H GLN 420 -8.409 11.544 -7.617 36 HA GLN 420 HA GLN 420 -7.929 8.717 -6.923 37 HB2 GLN 420 HB2 GLN 420 -7.286 11.036 -5.052 38 HB3 GLN 420 HB3 GLN 420 -7.307 9.317 -4.610 39 HG2 GLN 420 HG2 GLN 420 -5.533 8.920 -6.369 40 HG3 GLN 420 HG3 GLN 420 -5.420 10.677 -6.575 41 HE21 GLN 420 HE21 GLN 420 -2.725 10.061 -4.226 42 HE22 GLN 420 HE22 GLN 420 -3.094 9.992 -5.937 43 H GLN 421 H GLN 421 -9.282 8.164 -4.908 44 HA GLN 421 HA GLN 421 -11.611 9.937 -4.537 45 HB2 GLN 421 HB2 GLN 421 -12.262 8.419 -6.336 46 HB3 GLN 421 HB3 GLN 421 -11.821 7.010 -5.360 47 HG2 GLN 421 HG2 GLN 421 -13.817 9.050 -4.322 48 HG3 GLN 421 HG3 GLN 421 -14.330 7.813 -5.470 49 HE21 GLN 421 HE21 GLN 421 -14.888 6.626 -1.924 50 HE22 GLN 421 HE22 GLN 421 -15.333 8.076 -2.801 51 H ARG 422 H ARG 422 -12.414 9.890 -2.462 52 HA ARG 422 HA ARG 422 -11.462 7.823 -0.575 53 HB2 ARG 422 HB2 ARG 422 -10.907 10.797 -0.217 54 HB3 ARG 422 HB3 ARG 422 -10.595 9.533 0.985 55 HG2 ARG 422 HG2 ARG 422 -8.991 8.448 -0.591 56 HG3 ARG 422 HG3 ARG 422 -9.268 9.770 -1.749 57 HD2 ARG 422 HD2 ARG 422 -8.585 11.391 0.081 58 HD3 ARG 422 HD3 ARG 422 -8.085 9.981 1.043 59 HE ARG 422 HE ARG 422 -6.952 10.151 -1.666 60 HH11 ARG 422 HH11 ARG 422 -6.544 10.963 1.752 61 HH12 ARG 422 HH12 ARG 422 -4.802 11.101 1.625 62 HH21 ARG 422 HH21 ARG 422 -4.687 10.290 -1.786 63 HH22 ARG 422 HH22 ARG 422 -3.750 10.723 -0.376 64 H ALA 423 H ALA 423 -12.607 7.847 1.451 65 HA ALA 423 HA ALA 423 -15.364 8.498 1.209 66 HB1 ALA 423 HB1 ALA 423 -13.681 7.945 3.691 67 HB2 ALA 423 HB2 ALA 423 -15.458 7.915 3.612 68 HB3 ALA 423 HB3 ALA 423 -14.510 6.726 2.693 69 H GLY 424 H GLY 424 -16.484 10.329 1.633 70 HA2 GLY 424 HA2 GLY 424 -16.885 12.321 2.920 71 HA3 GLY 424 HA3 GLY 424 -15.138 12.533 3.118 72 H ASP 425 H ASP 425 -15.081 11.597 0.049 73 HA ASP 425 HA ASP 425 -14.949 14.157 -1.139 74 HB2 ASP 425 HB2 ASP 425 -15.399 11.403 -2.305 75 HB3 ASP 425 HB3 ASP 425 -15.190 12.845 -3.299 76 H TRP 426 H TRP 426 -16.326 15.063 -2.878 77 HA TRP 426 HA TRP 426 -19.151 14.262 -2.761 78 HB2 TRP 426 HB2 TRP 426 -19.912 16.450 -2.016 79 HB3 TRP 426 HB3 TRP 426 -18.881 15.682 -0.805 80 HD1 TRP 426 HD1 TRP 426 -16.485 16.766 -0.359 81 HE1 TRP 426 HE1 TRP 426 -15.544 19.101 -0.728 82 HE3 TRP 426 HE3 TRP 426 -19.981 18.514 -3.634 83 HZ2 TRP 426 HZ2 TRP 426 -16.196 21.444 -2.304 84 HZ3 TRP 426 HZ3 TRP 426 -19.793 20.804 -4.563 85 HH2 TRP 426 HH2 TRP 426 -17.925 22.275 -3.895 86 H LYS 427 H LYS 427 -20.399 15.087 -4.477 87 HA LYS 427 HA LYS 427 -18.737 16.010 -6.746 88 HB2 LYS 427 HB2 LYS 427 -20.305 13.949 -6.792 89 HB3 LYS 427 HB3 LYS 427 -21.630 15.131 -6.848 90 HG2 LYS 427 HG2 LYS 427 -20.348 16.195 -8.840 91 HG3 LYS 427 HG3 LYS 427 -19.362 14.715 -8.825 92 HD2 LYS 427 HD2 LYS 427 -21.128 14.387 -10.438 93 HD3 LYS 427 HD3 LYS 427 -21.533 13.400 -9.021 94 HE2 LYS 427 HE2 LYS 427 -23.024 15.219 -8.199 95 HE3 LYS 427 HE3 LYS 427 -22.633 16.186 -9.627 96 HZ1 LYS 427 HZ1 LYS 427 -24.689 15.002 -9.908 97 HZ2 LYS 427 HZ2 LYS 427 -23.582 14.432 -10.981 98 HZ3 LYS 427 HZ3 LYS 427 -23.955 13.554 -9.645 99 H CYS 428 H CYS 428 -19.266 17.834 -7.986 100 HA CYS 428 HA CYS 428 -20.290 20.060 -6.590 101 HB2 CYS 428 HB2 CYS 428 -18.667 20.099 -8.492 102 HB3 CYS 428 HB3 CYS 428 -19.992 19.650 -9.592 103 HA PRO 429 HA PRO 429 -24.633 19.249 -7.159 104 HB2 PRO 429 HB2 PRO 429 -25.635 21.555 -6.089 105 HB3 PRO 429 HB3 PRO 429 -24.863 20.277 -5.087 106 HG2 PRO 429 HG2 PRO 429 -23.638 22.843 -6.136 107 HG3 PRO 429 HG3 PRO 429 -23.531 22.142 -4.483 108 HD2 PRO 429 HD2 PRO 429 -21.563 21.815 -6.370 109 HD3 PRO 429 HD3 PRO 429 -21.943 20.563 -5.148 110 H ASN 430 H ASN 430 -22.820 21.782 -8.704 111 HA ASN 430 HA ASN 430 -24.993 23.060 -10.071 112 HB2 ASN 430 HB2 ASN 430 -22.314 23.554 -9.682 113 HB3 ASN 430 HB3 ASN 430 -22.303 22.973 -11.350 114 HD21 ASN 430 HD21 ASN 430 -22.662 26.635 -11.511 115 HD22 ASN 430 HD22 ASN 430 -21.469 25.480 -10.943 116 HA PRO 431 HA PRO 431 -25.586 19.601 -12.891 117 HB2 PRO 431 HB2 PRO 431 -27.420 20.781 -14.586 118 HB3 PRO 431 HB3 PRO 431 -27.833 20.140 -12.965 119 HG2 PRO 431 HG2 PRO 431 -27.247 22.997 -13.771 120 HG3 PRO 431 HG3 PRO 431 -28.552 22.386 -12.703 121 HD2 PRO 431 HD2 PRO 431 -26.230 23.456 -11.730 122 HD3 PRO 431 HD3 PRO 431 -27.076 22.117 -10.899 123 H THR 432 H THR 432 -24.459 22.815 -13.646 124 HA THR 432 HA THR 432 -23.575 22.032 -16.332 125 HB THR 432 HB THR 432 -23.098 24.269 -16.750 126 HG1 THR 432 HG1 THR 432 -22.833 25.766 -15.072 127 HG21 THR 432 HG21 THR 432 -25.343 24.416 -14.688 128 HG22 THR 432 HG22 THR 432 -25.061 25.519 -16.054 129 HG23 THR 432 HG23 THR 432 -25.551 23.841 -16.359 130 H CYS 433 H CYS 433 -22.433 21.371 -13.333 131 HA CYS 433 HA CYS 433 -19.577 21.658 -14.156 132 HB2 CYS 433 HB2 CYS 433 -20.271 23.094 -12.247 133 HB3 CYS 433 HB3 CYS 433 -20.804 21.642 -11.374 134 H GLU 434 H GLU 434 -21.483 19.819 -11.735 135 HA GLU 434 HA GLU 434 -21.335 17.686 -10.995 136 HB2 GLU 434 HB2 GLU 434 -21.079 17.162 -13.975 137 HB3 GLU 434 HB3 GLU 434 -21.433 15.923 -12.749 138 HG2 GLU 434 HG2 GLU 434 -23.426 17.228 -12.028 139 HG3 GLU 434 HG3 GLU 434 -23.114 18.391 -13.327 140 H ASN 435 H ASN 435 -18.663 19.235 -11.497 141 HA ASN 435 HA ASN 435 -16.673 17.199 -11.924 142 HB2 ASN 435 HB2 ASN 435 -16.209 19.613 -12.172 143 HB3 ASN 435 HB3 ASN 435 -16.562 19.857 -10.451 144 HD21 ASN 435 HD21 ASN 435 -13.206 19.381 -9.613 145 HD22 ASN 435 HD22 ASN 435 -14.690 20.290 -9.424 146 H MET 436 H MET 436 -15.493 15.964 -10.416 147 HA MET 436 HA MET 436 -16.836 15.557 -7.841 148 HB2 MET 436 HB2 MET 436 -15.894 13.729 -9.419 149 HB3 MET 436 HB3 MET 436 -14.297 14.199 -8.783 150 HG2 MET 436 HG2 MET 436 -15.113 12.401 -7.416 151 HG3 MET 436 HG3 MET 436 -15.247 13.882 -6.458 152 HE1 MET 436 HE1 MET 436 -16.949 13.390 -4.757 153 HE2 MET 436 HE2 MET 436 -18.384 12.360 -4.996 154 HE3 MET 436 HE3 MET 436 -16.747 11.679 -5.196 155 H ASN 437 H ASN 437 -15.973 16.124 -5.831 156 HA ASN 437 HA ASN 437 -13.488 17.772 -5.921 157 HB2 ASN 437 HB2 ASN 437 -16.035 18.303 -4.355 158 HB3 ASN 437 HB3 ASN 437 -14.557 19.269 -4.266 159 HD21 ASN 437 HD21 ASN 437 -17.280 20.044 -7.119 160 HD22 ASN 437 HD22 ASN 437 -17.567 19.013 -5.729 161 H PHE 438 H PHE 438 -12.107 17.668 -4.164 162 HA PHE 438 HA PHE 438 -12.147 15.197 -2.715 163 HB2 PHE 438 HB2 PHE 438 -10.380 17.656 -2.460 164 HB3 PHE 438 HB3 PHE 438 -10.136 16.161 -1.572 165 HD1 PHE 438 HD1 PHE 438 -8.285 17.654 -3.617 166 HD2 PHE 438 HD2 PHE 438 -10.932 14.272 -3.978 167 HE1 PHE 438 HE1 PHE 438 -6.853 16.713 -5.394 168 HE2 PHE 438 HE2 PHE 438 -9.524 13.378 -5.802 169 HZ PHE 438 HZ PHE 438 -7.470 14.590 -6.502 170 H SER 439 H SER 439 -11.906 14.992 -0.332 171 HA SER 439 HA SER 439 -14.366 15.821 0.785 172 HB2 SER 439 HB2 SER 439 -13.227 13.743 1.402 173 HB3 SER 439 HB3 SER 439 -11.862 14.668 2.071 174 HG SER 439 HG SER 439 -13.320 14.041 3.696 175 H TRP 440 H TRP 440 -11.122 17.274 0.990 176 HA TRP 440 HA TRP 440 -11.849 18.862 3.326 177 HB2 TRP 440 HB2 TRP 440 -9.594 19.907 2.892 178 HB3 TRP 440 HB3 TRP 440 -9.617 18.178 3.252 179 HD1 TRP 440 HD1 TRP 440 -8.826 16.509 1.402 180 HE1 TRP 440 HE1 TRP 440 -7.534 16.763 -0.760 181 HE3 TRP 440 HE3 TRP 440 -9.388 21.551 0.729 182 HZ2 TRP 440 HZ2 TRP 440 -6.787 18.896 -2.574 183 HZ3 TRP 440 HZ3 TRP 440 -8.381 22.657 -1.234 184 HH2 TRP 440 HH2 TRP 440 -7.046 21.349 -2.879 185 H ARG 441 H ARG 441 -12.409 19.218 -0.047 186 HA ARG 441 HA ARG 441 -12.259 22.126 -0.080 187 HB2 ARG 441 HB2 ARG 441 -13.505 20.092 -1.961 188 HB3 ARG 441 HB3 ARG 441 -13.534 21.846 -2.232 189 HG2 ARG 441 HG2 ARG 441 -11.034 21.871 -2.082 190 HG3 ARG 441 HG3 ARG 441 -11.058 20.091 -1.996 191 HD2 ARG 441 HD2 ARG 441 -12.258 20.021 -4.173 192 HD3 ARG 441 HD3 ARG 441 -12.223 21.785 -4.256 193 HE ARG 441 HE ARG 441 -10.081 19.947 -4.890 194 HH11 ARG 441 HH11 ARG 441 -10.786 23.225 -3.774 195 HH12 ARG 441 HH12 ARG 441 -9.234 23.857 -4.281 196 HH21 ARG 441 HH21 ARG 441 -8.071 20.784 -5.518 197 HH22 ARG 441 HH22 ARG 441 -7.692 22.473 -5.277 198 H ASN 442 H ASN 442 -13.924 23.605 0.073 199 HA ASN 442 HA ASN 442 -16.550 22.543 1.014 200 HB2 ASN 442 HB2 ASN 442 -15.151 25.183 1.568 201 HB3 ASN 442 HB3 ASN 442 -16.806 24.805 2.066 202 HD21 ASN 442 HD21 ASN 442 -14.185 24.055 4.776 203 HD22 ASN 442 HD22 ASN 442 -14.367 25.419 3.691 204 H GLU 443 H GLU 443 -14.961 23.846 -1.637 205 HA GLU 443 HA GLU 443 -17.548 24.637 -2.840 206 HB2 GLU 443 HB2 GLU 443 -15.004 26.308 -2.982 207 HB3 GLU 443 HB3 GLU 443 -16.497 26.617 -3.882 208 HG2 GLU 443 HG2 GLU 443 -17.719 26.861 -1.710 209 HG3 GLU 443 HG3 GLU 443 -16.184 26.664 -0.848 210 H CYS 444 H CYS 444 -17.452 24.687 -5.191 211 HA CYS 444 HA CYS 444 -16.203 22.347 -6.218 212 HB2 CYS 444 HB2 CYS 444 -18.343 23.300 -7.024 213 HB3 CYS 444 HB3 CYS 444 -17.464 24.695 -7.685 214 H ASN 445 H ASN 445 -14.610 22.141 -7.854 215 HA ASN 445 HA ASN 445 -12.445 24.117 -7.549 216 HB2 ASN 445 HB2 ASN 445 -12.393 21.474 -7.350 217 HB3 ASN 445 HB3 ASN 445 -12.272 21.543 -9.116 218 HD21 ASN 445 HD21 ASN 445 -8.827 21.428 -7.695 219 HD22 ASN 445 HD22 ASN 445 -10.225 20.382 -7.803 220 H GLN 446 H GLN 446 -15.075 23.992 -9.488 221 HA GLN 446 HA GLN 446 -13.576 24.900 -11.901 222 HB2 GLN 446 HB2 GLN 446 -15.949 22.994 -11.856 223 HB3 GLN 446 HB3 GLN 446 -15.125 23.597 -13.294 224 HG2 GLN 446 HG2 GLN 446 -13.788 21.931 -11.109 225 HG3 GLN 446 HG3 GLN 446 -14.467 21.266 -12.589 226 HE21 GLN 446 HE21 GLN 446 -10.819 21.711 -13.157 227 HE22 GLN 446 HE22 GLN 446 -11.844 20.767 -12.089 228 H CYS 447 H CYS 447 -16.581 24.907 -9.987 229 HA CYS 447 HA CYS 447 -17.363 27.405 -11.421 230 HB2 CYS 447 HB2 CYS 447 -19.711 26.686 -11.217 231 HB3 CYS 447 HB3 CYS 447 -18.747 25.549 -12.196 232 H LYS 448 H LYS 448 -16.255 26.244 -8.565 233 HA LYS 448 HA LYS 448 -16.192 27.026 -6.445 234 HB2 LYS 448 HB2 LYS 448 -17.340 29.571 -7.630 235 HB3 LYS 448 HB3 LYS 448 -16.464 29.415 -6.103 236 HG2 LYS 448 HG2 LYS 448 -15.301 28.833 -8.857 237 HG3 LYS 448 HG3 LYS 448 -15.034 30.305 -7.910 238 HD2 LYS 448 HD2 LYS 448 -14.030 28.934 -6.082 239 HD3 LYS 448 HD3 LYS 448 -14.230 27.481 -7.093 240 HE2 LYS 448 HE2 LYS 448 -12.817 28.493 -8.845 241 HE3 LYS 448 HE3 LYS 448 -12.619 29.946 -7.852 242 HZ1 LYS 448 HZ1 LYS 448 -11.747 27.235 -7.108 243 HZ2 LYS 448 HZ2 LYS 448 -10.761 28.452 -7.621 244 HZ3 LYS 448 HZ3 LYS 448 -11.557 28.591 -6.191 245 H ALA 449 H ALA 449 -18.930 25.944 -7.625 246 HA ALA 449 HA ALA 449 -20.942 27.114 -5.971 247 HB1 ALA 449 HB1 ALA 449 -20.725 24.306 -7.129 248 HB2 ALA 449 HB2 ALA 449 -22.200 25.046 -6.468 249 HB3 ALA 449 HB3 ALA 449 -21.453 25.716 -7.937 250 HA PRO 450 HA PRO 450 -19.636 25.581 -2.067 251 HB2 PRO 450 HB2 PRO 450 -21.978 25.704 -0.634 252 HB3 PRO 450 HB3 PRO 450 -21.042 27.153 -1.129 253 HG2 PRO 450 HG2 PRO 450 -23.485 25.951 -2.451 254 HG3 PRO 450 HG3 PRO 450 -23.124 27.677 -2.115 255 HD2 PRO 450 HD2 PRO 450 -22.713 26.510 -4.571 256 HD3 PRO 450 HD3 PRO 450 -21.666 27.824 -3.951 257 H LYS 451 H LYS 451 -19.578 23.690 -0.831 258 HA LYS 451 HA LYS 451 -20.663 21.291 -1.954 259 HB2 LYS 451 HB2 LYS 451 -18.591 21.241 -0.724 260 HB3 LYS 451 HB3 LYS 451 -19.342 21.917 0.712 261 HG2 LYS 451 HG2 LYS 451 -20.920 19.731 0.461 262 HG3 LYS 451 HG3 LYS 451 -19.489 19.132 -0.386 263 HD2 LYS 451 HD2 LYS 451 -19.655 20.194 2.462 264 HD3 LYS 451 HD3 LYS 451 -19.273 18.533 1.946 265 HE2 LYS 451 HE2 LYS 451 -17.214 19.382 0.839 266 HE3 LYS 451 HE3 LYS 451 -17.606 21.019 1.394 267 HZ1 LYS 451 HZ1 LYS 451 -16.039 19.955 2.837 268 HZ2 LYS 451 HZ2 LYS 451 -17.445 20.226 3.648 269 HZ3 LYS 451 HZ3 LYS 451 -17.069 18.706 3.134 270 HA PRO 452 HA PRO 452 -23.993 21.561 1.515 271 HB2 PRO 452 HB2 PRO 452 -24.242 23.940 2.884 272 HB3 PRO 452 HB3 PRO 452 -23.250 22.565 3.465 273 HG2 PRO 452 HG2 PRO 452 -22.348 25.047 1.978 274 HG3 PRO 452 HG3 PRO 452 -21.598 24.250 3.409 275 HD2 PRO 452 HD2 PRO 452 -20.674 23.849 0.882 276 HD3 PRO 452 HD3 PRO 452 -20.679 22.547 2.109 277 H ASP 453 H ASP 453 -26.120 22.803 1.556 278 HA ASP 453 HA ASP 453 -26.708 23.721 -1.098 279 HB2 ASP 453 HB2 ASP 453 -28.335 23.711 1.460 280 HB3 ASP 453 HB3 ASP 453 -28.973 24.174 -0.123 281 H GLY 454 H GLY 454 -25.409 25.405 1.572 282 HA2 GLY 454 HA2 GLY 454 -24.894 27.641 1.810 283 HA3 GLY 454 HA3 GLY 454 -25.591 27.939 0.201 284 H5' U 1 H5' U 1 -3.203 17.929 3.806 285 H5'' U 1 H5'' U 1 -2.943 19.652 3.459 286 H4' U 1 H4' U 1 -5.147 17.980 2.159 287 H3' U 1 H3' U 1 -2.316 18.621 1.294 288 H2' U 1 H2' U 1 -3.088 18.719 -0.946 289 HO2' U 1 HO2' U 1 -5.088 17.860 -1.539 290 H1' U 1 H1' U 1 -5.573 19.853 -0.303 291 H3 U 1 H3 U 1 -1.507 23.175 0.418 292 H5 U 1 H5 U 1 -3.715 22.896 -3.150 293 H6 U 1 H6 U 1 -4.824 20.943 -2.236 294 H5' G 2 H5' G 2 -1.596 13.704 -1.241 295 H5'' G 2 H5'' G 2 -1.244 15.143 -2.218 296 H4' G 2 H4' G 2 -2.386 13.539 -3.625 297 H3' G 2 H3' G 2 -4.106 15.868 -2.769 298 H2' G 2 H2' G 2 -5.847 15.003 -4.159 299 HO2' G 2 HO2' G 2 -4.535 14.419 -5.954 300 H1' G 2 H1' G 2 -5.507 12.374 -3.456 301 H8 G 2 H8 G 2 -5.047 15.135 -0.789 302 H1 G 2 H1 G 2 -11.003 12.822 -1.343 303 H21 G 2 H21 G 2 -11.144 11.566 -3.151 304 H22 G 2 H22 G 2 -9.752 11.209 -4.150 305 H5' G 3 H5' G 3 -3.765 14.781 -7.199 306 H5'' G 3 H5'' G 3 -2.731 16.140 -7.654 307 H4' G 3 H4' G 3 -4.242 15.081 -9.475 308 H3' G 3 H3' G 3 -3.140 17.592 -9.206 309 H2' G 3 H2' G 3 -4.995 18.629 -8.241 310 HO2' G 3 HO2' G 3 -4.647 19.571 -10.414 311 H1' G 3 H1' G 3 -6.902 17.110 -10.021 312 H8 G 3 H8 G 3 -6.362 19.373 -7.083 313 H1 G 3 H1 G 3 -12.141 16.607 -7.096 314 H21 G 3 H21 G 3 -12.195 14.951 -8.567 315 H22 G 3 H22 G 3 -10.800 14.527 -9.536 316 H5' U 4 H5' U 4 -4.994 16.459 -13.693 317 H5'' U 4 H5'' U 4 -4.312 17.666 -14.805 318 H4' U 4 H4' U 4 -6.532 17.436 -15.550 319 H3' U 4 H3' U 4 -6.509 19.720 -13.550 320 H2' U 4 H2' U 4 -8.765 20.098 -14.198 321 HO2' U 4 HO2' U 4 -8.389 19.925 -16.474 322 H1' U 4 H1' U 4 -9.320 17.344 -14.549 323 H3 U 4 H3 U 4 -12.109 17.729 -11.073 324 H5 U 4 H5 U 4 -8.780 19.974 -9.827 325 H6 U 4 H6 U 4 -7.668 19.365 -11.882 326 H5' G 5 H5' G 5 -3.973 20.929 -14.265 327 H5'' G 5 H5'' G 5 -4.344 21.563 -12.649 328 H4' G 5 H4' G 5 -3.756 23.419 -14.999 329 H3' G 5 H3' G 5 -1.835 21.703 -14.204 330 H2' G 5 H2' G 5 -1.969 21.883 -11.886 331 HO2' G 5 HO2' G 5 0.097 22.742 -12.333 332 H1' G 5 H1' G 5 -2.525 24.761 -11.634 333 H8 G 5 H8 G 5 -2.156 22.205 -9.650 334 H1 G 5 H1 G 5 -8.468 23.293 -9.275 335 H21 G 5 H21 G 5 -9.134 24.534 -10.986 336 H22 G 5 H22 G 5 -8.017 25.093 -12.216 Start of MODEL 7 1 H1 GLY 414 H1 NGL 414 -22.621 14.712 -16.493 2 H2 GLY 414 H2 NGL 414 -22.551 13.823 -17.878 3 H3 GLY 414 H3 NGL 414 -21.948 15.354 -17.857 4 HA2 GLY 414 HA2 NGL 414 -20.151 13.791 -17.801 5 HA3 GLY 414 HA3 NGL 414 -20.248 14.739 -16.301 6 HA PRO 415 HA PRO 415 -20.304 10.120 -15.387 7 HB2 PRO 415 HB2 PRO 415 -17.987 10.028 -13.908 8 HB3 PRO 415 HB3 PRO 415 -18.028 9.829 -15.693 9 HG2 PRO 415 HG2 PRO 415 -17.376 12.307 -14.080 10 HG3 PRO 415 HG3 PRO 415 -16.527 11.667 -15.520 11 HD2 PRO 415 HD2 PRO 415 -18.363 13.697 -15.654 12 HD3 PRO 415 HD3 PRO 415 -18.171 12.504 -16.976 13 H LEU 416 H LEU 416 -20.441 9.133 -13.181 14 HA LEU 416 HA LEU 416 -21.859 10.921 -11.387 15 HB2 LEU 416 HB2 LEU 416 -20.995 8.016 -11.063 16 HB3 LEU 416 HB3 LEU 416 -22.167 8.868 -10.043 17 HG LEU 416 HG LEU 416 -22.474 8.359 -13.039 18 HD11 LEU 416 HD11 LEU 416 -23.848 7.090 -10.631 19 HD12 LEU 416 HD12 LEU 416 -24.214 6.760 -12.342 20 HD13 LEU 416 HD13 LEU 416 -22.633 6.306 -11.666 21 HD21 LEU 416 HD21 LEU 416 -23.655 10.403 -12.337 22 HD22 LEU 416 HD22 LEU 416 -24.826 9.101 -12.626 23 HD23 LEU 416 HD23 LEU 416 -24.374 9.534 -10.961 24 H GLY 417 H GLY 417 -18.553 10.227 -11.821 25 HA2 GLY 417 HA2 GLY 417 -17.682 11.884 -9.741 26 HA3 GLY 417 HA3 GLY 417 -17.661 10.236 -9.095 27 H SER 418 H SER 418 -15.273 11.431 -9.186 28 HA SER 418 HA SER 418 -13.794 9.840 -11.133 29 HB2 SER 418 HB2 SER 418 -12.610 11.731 -12.132 30 HB3 SER 418 HB3 SER 418 -14.353 11.868 -12.446 31 HG SER 418 HG SER 418 -13.347 13.830 -11.713 32 H GLY 419 H GLY 419 -11.310 10.454 -10.816 33 HA2 GLY 419 HA2 GLY 419 -9.512 10.728 -9.384 34 HA3 GLY 419 HA3 GLY 419 -10.591 11.506 -8.213 35 H GLN 420 H GLN 420 -9.322 10.261 -6.622 36 HA GLN 420 HA GLN 420 -9.449 7.374 -6.643 37 HB2 GLN 420 HB2 GLN 420 -8.663 9.333 -4.450 38 HB3 GLN 420 HB3 GLN 420 -8.365 7.585 -4.424 39 HG2 GLN 420 HG2 GLN 420 -7.266 9.539 -6.491 40 HG3 GLN 420 HG3 GLN 420 -6.362 8.876 -5.123 41 HE21 GLN 420 HE21 GLN 420 -5.584 6.883 -8.216 42 HE22 GLN 420 HE22 GLN 420 -5.469 8.574 -7.768 43 H GLN 421 H GLN 421 -11.792 9.701 -5.885 44 HA GLN 421 HA GLN 421 -13.727 9.680 -4.685 45 HB2 GLN 421 HB2 GLN 421 -13.571 6.754 -5.475 46 HB3 GLN 421 HB3 GLN 421 -15.030 7.581 -4.888 47 HG2 GLN 421 HG2 GLN 421 -14.891 9.181 -6.780 48 HG3 GLN 421 HG3 GLN 421 -13.437 8.361 -7.369 49 HE21 GLN 421 HE21 GLN 421 -16.063 6.929 -9.456 50 HE22 GLN 421 HE22 GLN 421 -15.103 8.384 -9.298 51 H ARG 422 H ARG 422 -12.074 10.063 -2.801 52 HA ARG 422 HA ARG 422 -11.835 7.860 -0.892 53 HB2 ARG 422 HB2 ARG 422 -11.098 10.807 -0.745 54 HB3 ARG 422 HB3 ARG 422 -10.734 9.615 0.519 55 HG2 ARG 422 HG2 ARG 422 -9.421 8.287 -1.133 56 HG3 ARG 422 HG3 ARG 422 -9.741 9.527 -2.362 57 HD2 ARG 422 HD2 ARG 422 -8.690 11.227 -0.806 58 HD3 ARG 422 HD3 ARG 422 -8.257 9.890 0.268 59 HE ARG 422 HE ARG 422 -7.342 9.817 -2.569 60 HH11 ARG 422 HH11 ARG 422 -6.558 10.243 0.858 61 HH12 ARG 422 HH12 ARG 422 -4.844 9.999 0.613 62 HH21 ARG 422 HH21 ARG 422 -5.108 9.469 -2.846 63 HH22 ARG 422 HH22 ARG 422 -4.029 9.545 -1.473 64 H ALA 423 H ALA 423 -12.560 8.069 1.367 65 HA ALA 423 HA ALA 423 -15.359 8.612 1.517 66 HB1 ALA 423 HB1 ALA 423 -13.291 8.278 3.727 67 HB2 ALA 423 HB2 ALA 423 -15.056 8.191 3.937 68 HB3 ALA 423 HB3 ALA 423 -14.215 6.969 2.950 69 H GLY 424 H GLY 424 -16.400 10.482 1.738 70 HA2 GLY 424 HA2 GLY 424 -16.809 12.509 2.988 71 HA3 GLY 424 HA3 GLY 424 -15.061 12.745 3.140 72 H ASP 425 H ASP 425 -15.148 11.710 0.089 73 HA ASP 425 HA ASP 425 -14.990 14.267 -1.140 74 HB2 ASP 425 HB2 ASP 425 -15.365 11.482 -2.254 75 HB3 ASP 425 HB3 ASP 425 -15.177 12.902 -3.280 76 H TRP 426 H TRP 426 -16.361 15.108 -2.924 77 HA TRP 426 HA TRP 426 -19.173 14.283 -2.822 78 HB2 TRP 426 HB2 TRP 426 -19.967 16.472 -2.092 79 HB3 TRP 426 HB3 TRP 426 -18.968 15.696 -0.860 80 HD1 TRP 426 HD1 TRP 426 -16.576 16.757 -0.357 81 HE1 TRP 426 HE1 TRP 426 -15.597 19.091 -0.704 82 HE3 TRP 426 HE3 TRP 426 -20.018 18.584 -3.654 83 HZ2 TRP 426 HZ2 TRP 426 -16.213 21.453 -2.252 84 HZ3 TRP 426 HZ3 TRP 426 -19.796 20.882 -4.552 85 HH2 TRP 426 HH2 TRP 426 -17.921 22.328 -3.840 86 H LYS 427 H LYS 427 -20.362 14.950 -4.612 87 HA LYS 427 HA LYS 427 -18.715 15.971 -6.827 88 HB2 LYS 427 HB2 LYS 427 -20.303 13.912 -6.902 89 HB3 LYS 427 HB3 LYS 427 -21.611 15.114 -6.959 90 HG2 LYS 427 HG2 LYS 427 -20.308 16.171 -8.936 91 HG3 LYS 427 HG3 LYS 427 -19.324 14.693 -8.923 92 HD2 LYS 427 HD2 LYS 427 -21.071 14.397 -10.553 93 HD3 LYS 427 HD3 LYS 427 -21.489 13.381 -9.156 94 HE2 LYS 427 HE2 LYS 427 -23.014 15.182 -8.340 95 HE3 LYS 427 HE3 LYS 427 -22.565 16.176 -9.734 96 HZ1 LYS 427 HZ1 LYS 427 -23.921 13.561 -9.847 97 HZ2 LYS 427 HZ2 LYS 427 -24.613 15.026 -10.127 98 HZ3 LYS 427 HZ3 LYS 427 -23.466 14.449 -11.155 99 H CYS 428 H CYS 428 -19.271 17.802 -8.080 100 HA CYS 428 HA CYS 428 -20.294 20.020 -6.643 101 HB2 CYS 428 HB2 CYS 428 -18.664 20.098 -8.541 102 HB3 CYS 428 HB3 CYS 428 -19.976 19.649 -9.651 103 HA PRO 429 HA PRO 429 -24.626 19.189 -7.221 104 HB2 PRO 429 HB2 PRO 429 -25.645 21.508 -6.184 105 HB3 PRO 429 HB3 PRO 429 -24.900 20.232 -5.164 106 HG2 PRO 429 HG2 PRO 429 -23.647 22.795 -6.185 107 HG3 PRO 429 HG3 PRO 429 -23.560 22.085 -4.540 108 HD2 PRO 429 HD2 PRO 429 -21.571 21.765 -6.414 109 HD3 PRO 429 HD3 PRO 429 -21.952 20.511 -5.200 110 H ASN 430 H ASN 430 -22.817 21.737 -8.762 111 HA ASN 430 HA ASN 430 -24.987 22.996 -10.167 112 HB2 ASN 430 HB2 ASN 430 -22.339 23.537 -9.731 113 HB3 ASN 430 HB3 ASN 430 -22.266 22.919 -11.387 114 HD21 ASN 430 HD21 ASN 430 -22.679 26.581 -11.616 115 HD22 ASN 430 HD22 ASN 430 -21.485 25.455 -10.994 116 HA PRO 431 HA PRO 431 -25.505 19.526 -13.012 117 HB2 PRO 431 HB2 PRO 431 -27.310 20.708 -14.729 118 HB3 PRO 431 HB3 PRO 431 -27.757 20.035 -13.131 119 HG2 PRO 431 HG2 PRO 431 -27.200 22.913 -13.875 120 HG3 PRO 431 HG3 PRO 431 -28.512 22.254 -12.837 121 HD2 PRO 431 HD2 PRO 431 -26.221 23.359 -11.821 122 HD3 PRO 431 HD3 PRO 431 -27.061 21.997 -11.014 123 H THR 432 H THR 432 -24.411 22.767 -13.722 124 HA THR 432 HA THR 432 -23.477 22.009 -16.389 125 HB THR 432 HB THR 432 -23.047 24.242 -16.807 126 HG1 THR 432 HG1 THR 432 -22.790 25.754 -15.143 127 HG21 THR 432 HG21 THR 432 -25.020 25.477 -16.102 128 HG22 THR 432 HG22 THR 432 -25.496 23.793 -16.400 129 HG23 THR 432 HG23 THR 432 -25.282 24.370 -14.732 130 H CYS 433 H CYS 433 -22.373 21.344 -13.394 131 HA CYS 433 HA CYS 433 -19.506 21.667 -14.164 132 HB2 CYS 433 HB2 CYS 433 -20.241 23.061 -12.251 133 HB3 CYS 433 HB3 CYS 433 -20.764 21.590 -11.397 134 H GLU 434 H GLU 434 -21.416 19.768 -11.794 135 HA GLU 434 HA GLU 434 -21.300 17.626 -11.120 136 HB2 GLU 434 HB2 GLU 434 -20.967 17.162 -14.103 137 HB3 GLU 434 HB3 GLU 434 -21.339 15.894 -12.918 138 HG2 GLU 434 HG2 GLU 434 -23.363 17.162 -12.213 139 HG3 GLU 434 HG3 GLU 434 -23.025 18.372 -13.460 140 H ASN 435 H ASN 435 -18.613 19.183 -11.574 141 HA ASN 435 HA ASN 435 -16.636 17.133 -11.981 142 HB2 ASN 435 HB2 ASN 435 -16.236 19.589 -12.221 143 HB3 ASN 435 HB3 ASN 435 -16.461 19.772 -10.472 144 HD21 ASN 435 HD21 ASN 435 -13.079 19.156 -9.834 145 HD22 ASN 435 HD22 ASN 435 -14.574 19.952 -9.392 146 H MET 436 H MET 436 -15.465 15.906 -10.449 147 HA MET 436 HA MET 436 -16.820 15.539 -7.869 148 HB2 MET 436 HB2 MET 436 -15.845 13.689 -9.412 149 HB3 MET 436 HB3 MET 436 -14.267 14.185 -8.752 150 HG2 MET 436 HG2 MET 436 -15.075 12.407 -7.350 151 HG3 MET 436 HG3 MET 436 -15.261 13.910 -6.440 152 HE1 MET 436 HE1 MET 436 -16.756 11.775 -5.109 153 HE2 MET 436 HE2 MET 436 -17.000 13.513 -4.779 154 HE3 MET 436 HE3 MET 436 -18.405 12.444 -4.987 155 H ASN 437 H ASN 437 -16.085 16.322 -5.920 156 HA ASN 437 HA ASN 437 -13.550 17.884 -6.016 157 HB2 ASN 437 HB2 ASN 437 -16.077 18.450 -4.430 158 HB3 ASN 437 HB3 ASN 437 -14.602 19.416 -4.398 159 HD21 ASN 437 HD21 ASN 437 -17.378 20.173 -7.178 160 HD22 ASN 437 HD22 ASN 437 -17.638 19.206 -5.736 161 H PHE 438 H PHE 438 -12.175 17.810 -4.274 162 HA PHE 438 HA PHE 438 -12.139 15.334 -2.843 163 HB2 PHE 438 HB2 PHE 438 -10.422 17.824 -2.701 164 HB3 PHE 438 HB3 PHE 438 -10.123 16.388 -1.737 165 HD1 PHE 438 HD1 PHE 438 -11.203 14.664 -4.401 166 HD2 PHE 438 HD2 PHE 438 -8.078 17.497 -3.523 167 HE1 PHE 438 HE1 PHE 438 -9.824 13.712 -6.208 168 HE2 PHE 438 HE2 PHE 438 -6.690 16.515 -5.320 169 HZ PHE 438 HZ PHE 438 -7.553 14.622 -6.665 170 H SER 439 H SER 439 -11.923 15.017 -0.550 171 HA SER 439 HA SER 439 -14.302 15.865 0.707 172 HB2 SER 439 HB2 SER 439 -13.402 14.679 2.671 173 HB3 SER 439 HB3 SER 439 -13.140 13.726 1.190 174 HG SER 439 HG SER 439 -11.019 14.397 1.175 175 H TRP 440 H TRP 440 -11.077 17.313 0.745 176 HA TRP 440 HA TRP 440 -11.665 18.794 3.201 177 HB2 TRP 440 HB2 TRP 440 -9.381 19.749 2.781 178 HB3 TRP 440 HB3 TRP 440 -9.476 17.999 3.030 179 HD1 TRP 440 HD1 TRP 440 -8.674 16.449 1.100 180 HE1 TRP 440 HE1 TRP 440 -7.462 16.806 -1.104 181 HE3 TRP 440 HE3 TRP 440 -9.263 21.507 0.696 182 HZ2 TRP 440 HZ2 TRP 440 -6.768 19.050 -2.830 183 HZ3 TRP 440 HZ3 TRP 440 -8.340 22.720 -1.236 184 HH2 TRP 440 HH2 TRP 440 -7.060 21.511 -2.995 185 H ARG 441 H ARG 441 -12.390 19.248 -0.092 186 HA ARG 441 HA ARG 441 -12.193 22.169 -0.021 187 HB2 ARG 441 HB2 ARG 441 -13.444 20.204 -1.976 188 HB3 ARG 441 HB3 ARG 441 -13.518 21.969 -2.173 189 HG2 ARG 441 HG2 ARG 441 -11.018 22.046 -2.066 190 HG3 ARG 441 HG3 ARG 441 -11.003 20.265 -2.049 191 HD2 ARG 441 HD2 ARG 441 -12.232 20.252 -4.212 192 HD3 ARG 441 HD3 ARG 441 -12.247 22.014 -4.222 193 HE ARG 441 HE ARG 441 -10.039 20.243 -4.907 194 HH11 ARG 441 HH11 ARG 441 -10.901 23.499 -3.841 195 HH12 ARG 441 HH12 ARG 441 -9.407 24.211 -4.398 196 HH21 ARG 441 HH21 ARG 441 -8.088 21.176 -5.593 197 HH22 ARG 441 HH22 ARG 441 -7.805 22.893 -5.399 198 H ASN 442 H ASN 442 -13.939 23.621 0.033 199 HA ASN 442 HA ASN 442 -16.511 22.491 1.047 200 HB2 ASN 442 HB2 ASN 442 -15.158 25.152 1.635 201 HB3 ASN 442 HB3 ASN 442 -16.809 24.735 2.133 202 HD21 ASN 442 HD21 ASN 442 -14.175 23.990 4.827 203 HD22 ASN 442 HD22 ASN 442 -14.408 25.377 3.783 204 H GLU 443 H GLU 443 -14.989 23.852 -1.603 205 HA GLU 443 HA GLU 443 -17.595 24.605 -2.776 206 HB2 GLU 443 HB2 GLU 443 -15.084 26.319 -2.964 207 HB3 GLU 443 HB3 GLU 443 -16.620 26.613 -3.806 208 HG2 GLU 443 HG2 GLU 443 -17.759 26.810 -1.593 209 HG3 GLU 443 HG3 GLU 443 -16.190 26.618 -0.786 210 H CYS 444 H CYS 444 -17.505 24.656 -5.141 211 HA CYS 444 HA CYS 444 -16.256 22.306 -6.136 212 HB2 CYS 444 HB2 CYS 444 -18.385 23.246 -6.970 213 HB3 CYS 444 HB3 CYS 444 -17.507 24.645 -7.627 214 H ASN 445 H ASN 445 -14.637 22.041 -7.704 215 HA ASN 445 HA ASN 445 -12.453 23.974 -7.380 216 HB2 ASN 445 HB2 ASN 445 -12.422 21.355 -7.150 217 HB3 ASN 445 HB3 ASN 445 -12.349 21.364 -8.919 218 HD21 ASN 445 HD21 ASN 445 -8.844 21.228 -8.060 219 HD22 ASN 445 HD22 ASN 445 -10.258 20.249 -8.413 220 H GLN 446 H GLN 446 -15.041 23.902 -9.383 221 HA GLN 446 HA GLN 446 -13.482 24.761 -11.775 222 HB2 GLN 446 HB2 GLN 446 -15.835 22.835 -11.723 223 HB3 GLN 446 HB3 GLN 446 -15.036 23.442 -13.179 224 HG2 GLN 446 HG2 GLN 446 -13.625 21.843 -10.986 225 HG3 GLN 446 HG3 GLN 446 -14.302 21.132 -12.441 226 HE21 GLN 446 HE21 GLN 446 -10.637 21.783 -12.972 227 HE22 GLN 446 HE22 GLN 446 -11.575 20.886 -11.797 228 H CYS 447 H CYS 447 -16.517 24.829 -9.909 229 HA CYS 447 HA CYS 447 -17.223 27.333 -11.364 230 HB2 CYS 447 HB2 CYS 447 -19.592 26.666 -11.239 231 HB3 CYS 447 HB3 CYS 447 -18.636 25.514 -12.189 232 H LYS 448 H LYS 448 -16.231 26.117 -8.484 233 HA LYS 448 HA LYS 448 -16.218 26.869 -6.367 234 HB2 LYS 448 HB2 LYS 448 -17.101 29.478 -7.654 235 HB3 LYS 448 HB3 LYS 448 -16.448 29.295 -6.013 236 HG2 LYS 448 HG2 LYS 448 -14.355 28.343 -6.962 237 HG3 LYS 448 HG3 LYS 448 -15.008 28.579 -8.602 238 HD2 LYS 448 HD2 LYS 448 -15.197 31.008 -8.183 239 HD3 LYS 448 HD3 LYS 448 -14.543 30.777 -6.545 240 HE2 LYS 448 HE2 LYS 448 -12.453 29.861 -7.509 241 HE3 LYS 448 HE3 LYS 448 -13.108 30.079 -9.142 242 HZ1 LYS 448 HZ1 LYS 448 -11.681 31.894 -8.513 243 HZ2 LYS 448 HZ2 LYS 448 -13.220 32.436 -8.711 244 HZ3 LYS 448 HZ3 LYS 448 -12.606 32.235 -7.197 245 H ALA 449 H ALA 449 -18.920 25.873 -7.584 246 HA ALA 449 HA ALA 449 -20.964 27.089 -5.993 247 HB1 ALA 449 HB1 ALA 449 -20.738 24.264 -7.111 248 HB2 ALA 449 HB2 ALA 449 -22.227 25.027 -6.502 249 HB3 ALA 449 HB3 ALA 449 -21.431 25.671 -7.955 250 HA PRO 450 HA PRO 450 -19.733 25.619 -2.047 251 HB2 PRO 450 HB2 PRO 450 -22.096 25.792 -0.652 252 HB3 PRO 450 HB3 PRO 450 -21.134 27.224 -1.155 253 HG2 PRO 450 HG2 PRO 450 -23.567 26.023 -2.492 254 HG3 PRO 450 HG3 PRO 450 -23.191 27.755 -2.191 255 HD2 PRO 450 HD2 PRO 450 -22.757 26.535 -4.615 256 HD3 PRO 450 HD3 PRO 450 -21.704 27.847 -3.999 257 H LYS 451 H LYS 451 -19.676 23.739 -0.805 258 HA LYS 451 HA LYS 451 -20.817 21.342 -1.895 259 HB2 LYS 451 HB2 LYS 451 -18.692 21.290 -0.754 260 HB3 LYS 451 HB3 LYS 451 -19.388 21.951 0.718 261 HG2 LYS 451 HG2 LYS 451 -20.979 19.748 0.456 262 HG3 LYS 451 HG3 LYS 451 -19.538 19.174 -0.381 263 HD2 LYS 451 HD2 LYS 451 -19.729 20.237 2.464 264 HD3 LYS 451 HD3 LYS 451 -19.330 18.582 1.958 265 HE2 LYS 451 HE2 LYS 451 -17.264 19.420 0.868 266 HE3 LYS 451 HE3 LYS 451 -17.668 21.068 1.381 267 HZ1 LYS 451 HZ1 LYS 451 -16.112 20.053 2.866 268 HZ2 LYS 451 HZ2 LYS 451 -17.529 20.326 3.651 269 HZ3 LYS 451 HZ3 LYS 451 -17.130 18.799 3.172 270 HA PRO 452 HA PRO 452 -23.975 21.614 1.723 271 HB2 PRO 452 HB2 PRO 452 -24.158 23.964 3.147 272 HB3 PRO 452 HB3 PRO 452 -23.118 22.590 3.643 273 HG2 PRO 452 HG2 PRO 452 -22.325 25.099 2.135 274 HG3 PRO 452 HG3 PRO 452 -21.486 24.311 3.515 275 HD2 PRO 452 HD2 PRO 452 -20.704 23.921 0.932 276 HD3 PRO 452 HD3 PRO 452 -20.635 22.606 2.146 277 H ASP 453 H ASP 453 -26.110 22.694 1.789 278 HA ASP 453 HA ASP 453 -26.691 23.913 -0.777 279 HB2 ASP 453 HB2 ASP 453 -28.423 23.190 1.604 280 HB3 ASP 453 HB3 ASP 453 -29.058 23.888 0.105 281 H GLY 454 H GLY 454 -25.531 25.276 2.030 282 HA2 GLY 454 HA2 GLY 454 -27.167 27.640 2.230 283 HA3 GLY 454 HA3 GLY 454 -25.572 27.380 2.957 284 H5' U 1 H5' U 1 0.021 17.695 -1.367 285 H5'' U 1 H5'' U 1 -0.798 19.260 -1.539 286 H4' U 1 H4' U 1 -1.253 17.354 0.805 287 H3' U 1 H3' U 1 -2.020 16.647 -1.690 288 H2' U 1 H2' U 1 -2.864 18.785 -2.305 289 HO2' U 1 HO2' U 1 -4.514 17.345 -2.763 290 H1' U 1 H1' U 1 -4.422 18.978 0.270 291 H3 U 1 H3 U 1 -3.296 23.720 0.384 292 H5 U 1 H5 U 1 -4.477 22.488 -3.454 293 H6 U 1 H6 U 1 -4.313 20.199 -2.715 294 H5' G 2 H5' G 2 -1.729 12.799 -1.674 295 H5'' G 2 H5'' G 2 -1.702 14.479 -2.261 296 H4' G 2 H4' G 2 -2.392 12.673 -3.964 297 H3' G 2 H3' G 2 -3.964 15.165 -3.372 298 H2' G 2 H2' G 2 -5.588 14.518 -5.021 299 HO2' G 2 HO2' G 2 -3.736 12.442 -5.699 300 H1' G 2 H1' G 2 -5.785 11.924 -4.245 301 H8 G 2 H8 G 2 -5.172 14.899 -1.774 302 H1 G 2 H1 G 2 -11.171 12.666 -2.134 303 H21 G 2 H21 G 2 -11.349 11.331 -3.896 304 H22 G 2 H22 G 2 -9.952 10.838 -4.836 305 H5' G 3 H5' G 3 -4.140 14.518 -7.700 306 H5'' G 3 H5'' G 3 -2.740 15.525 -8.123 307 H4' G 3 H4' G 3 -4.504 15.489 -9.897 308 H3' G 3 H3' G 3 -3.005 17.666 -9.013 309 H2' G 3 H2' G 3 -4.729 18.532 -7.606 310 HO2' G 3 HO2' G 3 -5.145 19.623 -10.209 311 H1' G 3 H1' G 3 -6.676 17.822 -9.825 312 H8 G 3 H8 G 3 -6.259 19.539 -6.597 313 H1 G 3 H1 G 3 -12.141 17.088 -7.254 314 H21 G 3 H21 G 3 -12.180 15.617 -8.894 315 H22 G 3 H22 G 3 -10.747 15.207 -9.810 316 H5' U 4 H5' U 4 -4.641 14.643 -11.668 317 H5'' U 4 H5'' U 4 -3.893 14.382 -13.255 318 H4' U 4 H4' U 4 -6.181 13.670 -13.455 319 H3' U 4 H3' U 4 -5.386 16.169 -14.829 320 H2' U 4 H2' U 4 -7.324 17.277 -14.420 321 HO2' U 4 HO2' U 4 -7.950 16.254 -16.419 322 H1' U 4 H1' U 4 -8.737 14.806 -13.458 323 H3 U 4 H3 U 4 -11.998 17.453 -11.808 324 H5 U 4 H5 U 4 -8.479 19.497 -10.738 325 H6 U 4 H6 U 4 -7.211 17.823 -11.938 326 H5' G 5 H5' G 5 -5.314 11.035 -16.523 327 H5'' G 5 H5'' G 5 -6.485 11.539 -15.286 328 H4' G 5 H4' G 5 -3.803 10.263 -14.571 329 H3' G 5 H3' G 5 -5.510 8.861 -16.111 330 H2' G 5 H2' G 5 -7.510 9.401 -14.992 331 HO2' G 5 HO2' G 5 -8.093 7.571 -13.734 332 H1' G 5 H1' G 5 -6.352 8.953 -12.262 333 H8 G 5 H8 G 5 -9.309 9.745 -13.966 334 H1 G 5 H1 G 5 -8.366 14.278 -9.528 335 H21 G 5 H21 G 5 -6.285 14.150 -8.744 336 H22 G 5 H22 G 5 -5.148 12.958 -9.336 Start of MODEL 8 1 H1 GLY 414 H1 NGL 414 -10.058 8.451 -16.564 2 H2 GLY 414 H2 NGL 414 -8.463 8.743 -16.268 3 H3 GLY 414 H3 NGL 414 -9.095 9.063 -17.753 4 HA2 GLY 414 HA2 NGL 414 -10.512 10.773 -16.864 5 HA3 GLY 414 HA3 NGL 414 -9.835 10.430 -15.260 6 HA PRO 415 HA PRO 415 -7.194 13.482 -17.808 7 HB2 PRO 415 HB2 PRO 415 -8.146 15.907 -16.940 8 HB3 PRO 415 HB3 PRO 415 -8.857 15.035 -18.332 9 HG2 PRO 415 HG2 PRO 415 -9.831 15.108 -15.463 10 HG3 PRO 415 HG3 PRO 415 -10.787 15.262 -16.971 11 HD2 PRO 415 HD2 PRO 415 -10.552 12.912 -15.574 12 HD3 PRO 415 HD3 PRO 415 -10.735 12.954 -17.357 13 H LEU 416 H LEU 416 -8.082 12.860 -14.538 14 HA LEU 416 HA LEU 416 -6.419 14.715 -13.159 15 HB2 LEU 416 HB2 LEU 416 -7.195 11.913 -12.281 16 HB3 LEU 416 HB3 LEU 416 -6.743 13.277 -11.245 17 HG LEU 416 HG LEU 416 -9.226 13.125 -13.019 18 HD11 LEU 416 HD11 LEU 416 -9.279 11.653 -11.018 19 HD12 LEU 416 HD12 LEU 416 -8.902 13.060 -9.991 20 HD13 LEU 416 HD13 LEU 416 -10.435 13.002 -10.892 21 HD21 LEU 416 HD21 LEU 416 -8.448 15.429 -12.830 22 HD22 LEU 416 HD22 LEU 416 -9.873 15.207 -11.791 23 HD23 LEU 416 HD23 LEU 416 -8.249 15.245 -11.066 24 H GLY 417 H GLY 417 -4.375 14.408 -12.123 25 HA2 GLY 417 HA2 GLY 417 -2.414 13.001 -13.696 26 HA3 GLY 417 HA3 GLY 417 -2.159 13.829 -12.140 27 H SER 418 H SER 418 -4.490 12.102 -11.036 28 HA SER 418 HA SER 418 -3.547 9.362 -11.168 29 HB2 SER 418 HB2 SER 418 -1.859 10.264 -9.636 30 HB3 SER 418 HB3 SER 418 -3.134 10.963 -8.611 31 HG SER 418 HG SER 418 -2.391 8.926 -7.854 32 H GLY 419 H GLY 419 -5.079 7.919 -10.298 33 HA2 GLY 419 HA2 GLY 419 -7.720 9.132 -9.721 34 HA3 GLY 419 HA3 GLY 419 -7.396 7.440 -10.130 35 H GLN 420 H GLN 420 -8.710 9.035 -7.748 36 HA GLN 420 HA GLN 420 -7.884 7.137 -5.713 37 HB2 GLN 420 HB2 GLN 420 -6.082 8.835 -5.544 38 HB3 GLN 420 HB3 GLN 420 -7.302 10.107 -5.348 39 HG2 GLN 420 HG2 GLN 420 -6.366 9.461 -3.167 40 HG3 GLN 420 HG3 GLN 420 -8.076 9.049 -3.247 41 HE21 GLN 420 HE21 GLN 420 -7.132 5.887 -1.957 42 HE22 GLN 420 HE22 GLN 420 -8.023 7.371 -1.717 43 H GLN 421 H GLN 421 -9.341 7.136 -3.896 44 HA GLN 421 HA GLN 421 -11.623 9.032 -4.024 45 HB2 GLN 421 HB2 GLN 421 -12.355 7.042 -5.215 46 HB3 GLN 421 HB3 GLN 421 -11.828 6.001 -3.879 47 HG2 GLN 421 HG2 GLN 421 -13.481 7.010 -2.379 48 HG3 GLN 421 HG3 GLN 421 -13.927 8.192 -3.617 49 HE21 GLN 421 HE21 GLN 421 -16.605 5.736 -3.872 50 HE22 GLN 421 HE22 GLN 421 -16.078 7.068 -2.865 51 H ARG 422 H ARG 422 -12.455 9.578 -1.993 52 HA ARG 422 HA ARG 422 -11.381 8.153 0.374 53 HB2 ARG 422 HB2 ARG 422 -11.104 11.155 -0.046 54 HB3 ARG 422 HB3 ARG 422 -10.732 10.275 1.441 55 HG2 ARG 422 HG2 ARG 422 -9.004 8.946 0.169 56 HG3 ARG 422 HG3 ARG 422 -9.325 9.968 -1.246 57 HD2 ARG 422 HD2 ARG 422 -8.818 11.986 0.204 58 HD3 ARG 422 HD3 ARG 422 -8.307 10.867 1.474 59 HE ARG 422 HE ARG 422 -6.949 10.334 -1.027 60 HH11 ARG 422 HH11 ARG 422 -7.009 12.579 1.715 61 HH12 ARG 422 HH12 ARG 422 -5.303 12.950 1.588 62 HH21 ARG 422 HH21 ARG 422 -4.689 10.736 -1.054 63 HH22 ARG 422 HH22 ARG 422 -4.008 11.912 0.049 64 H ALA 423 H ALA 423 -12.608 8.458 2.289 65 HA ALA 423 HA ALA 423 -15.402 8.851 1.887 66 HB1 ALA 423 HB1 ALA 423 -13.753 8.909 4.442 67 HB2 ALA 423 HB2 ALA 423 -15.521 8.725 4.339 68 HB3 ALA 423 HB3 ALA 423 -14.454 7.460 3.684 69 H GLY 424 H GLY 424 -16.592 10.659 1.804 70 HA2 GLY 424 HA2 GLY 424 -17.216 12.805 2.683 71 HA3 GLY 424 HA3 GLY 424 -15.508 13.155 3.003 72 H ASP 425 H ASP 425 -15.254 11.703 0.085 73 HA ASP 425 HA ASP 425 -15.009 14.020 -1.499 74 HB2 ASP 425 HB2 ASP 425 -15.620 11.144 -2.238 75 HB3 ASP 425 HB3 ASP 425 -15.307 12.404 -3.430 76 H TRP 426 H TRP 426 -16.342 15.001 -3.108 77 HA TRP 426 HA TRP 426 -19.193 14.268 -3.081 78 HB2 TRP 426 HB2 TRP 426 -19.931 16.415 -2.233 79 HB3 TRP 426 HB3 TRP 426 -18.903 15.605 -1.050 80 HD1 TRP 426 HD1 TRP 426 -16.488 16.653 -0.592 81 HE1 TRP 426 HE1 TRP 426 -15.533 18.996 -0.886 82 HE3 TRP 426 HE3 TRP 426 -20.030 18.570 -3.735 83 HZ2 TRP 426 HZ2 TRP 426 -16.205 21.410 -2.319 84 HZ3 TRP 426 HZ3 TRP 426 -19.842 20.899 -4.554 85 HH2 TRP 426 HH2 TRP 426 -17.953 22.328 -3.853 86 H LYS 427 H LYS 427 -20.312 14.991 -4.858 87 HA LYS 427 HA LYS 427 -18.625 16.156 -6.984 88 HB2 LYS 427 HB2 LYS 427 -19.935 14.048 -7.339 89 HB3 LYS 427 HB3 LYS 427 -21.424 14.982 -7.105 90 HG2 LYS 427 HG2 LYS 427 -20.524 16.504 -9.028 91 HG3 LYS 427 HG3 LYS 427 -19.365 15.196 -9.329 92 HD2 LYS 427 HD2 LYS 427 -21.239 14.805 -10.776 93 HD3 LYS 427 HD3 LYS 427 -21.390 13.626 -9.453 94 HE2 LYS 427 HE2 LYS 427 -22.978 15.160 -8.300 95 HE3 LYS 427 HE3 LYS 427 -22.811 16.322 -9.620 96 HZ1 LYS 427 HZ1 LYS 427 -23.860 13.583 -9.874 97 HZ2 LYS 427 HZ2 LYS 427 -24.759 14.963 -9.878 98 HZ3 LYS 427 HZ3 LYS 427 -23.707 14.660 -11.107 99 H CYS 428 H CYS 428 -19.187 18.026 -8.132 100 HA CYS 428 HA CYS 428 -20.300 20.137 -6.655 101 HB2 CYS 428 HB2 CYS 428 -18.684 20.316 -8.545 102 HB3 CYS 428 HB3 CYS 428 -19.981 19.861 -9.670 103 HA PRO 429 HA PRO 429 -24.624 19.255 -7.232 104 HB2 PRO 429 HB2 PRO 429 -25.667 21.580 -6.201 105 HB3 PRO 429 HB3 PRO 429 -24.938 20.299 -5.186 106 HG2 PRO 429 HG2 PRO 429 -23.671 22.869 -6.167 107 HG3 PRO 429 HG3 PRO 429 -23.583 22.136 -4.531 108 HD2 PRO 429 HD2 PRO 429 -21.594 21.852 -6.401 109 HD3 PRO 429 HD3 PRO 429 -21.981 20.574 -5.204 110 H ASN 430 H ASN 430 -22.850 21.796 -8.799 111 HA ASN 430 HA ASN 430 -25.039 23.011 -10.226 112 HB2 ASN 430 HB2 ASN 430 -22.402 23.630 -9.777 113 HB3 ASN 430 HB3 ASN 430 -22.292 22.957 -11.406 114 HD21 ASN 430 HD21 ASN 430 -22.763 26.591 -11.787 115 HD22 ASN 430 HD22 ASN 430 -21.562 25.514 -11.100 116 HA PRO 431 HA PRO 431 -25.474 19.508 -13.028 117 HB2 PRO 431 HB2 PRO 431 -27.258 20.650 -14.789 118 HB3 PRO 431 HB3 PRO 431 -27.716 19.977 -13.197 119 HG2 PRO 431 HG2 PRO 431 -27.199 22.860 -13.952 120 HG3 PRO 431 HG3 PRO 431 -28.514 22.189 -12.924 121 HD2 PRO 431 HD2 PRO 431 -26.260 23.337 -11.887 122 HD3 PRO 431 HD3 PRO 431 -27.081 21.970 -11.079 123 H THR 432 H THR 432 -24.373 22.739 -13.733 124 HA THR 432 HA THR 432 -23.396 21.977 -16.397 125 HB THR 432 HB THR 432 -22.951 24.217 -16.809 126 HG1 THR 432 HG1 THR 432 -22.762 25.736 -15.147 127 HG21 THR 432 HG21 THR 432 -24.961 25.440 -16.176 128 HG22 THR 432 HG22 THR 432 -25.406 23.750 -16.494 129 HG23 THR 432 HG23 THR 432 -25.263 24.339 -14.818 130 H CYS 433 H CYS 433 -22.341 21.301 -13.397 131 HA CYS 433 HA CYS 433 -19.464 21.671 -14.097 132 HB2 CYS 433 HB2 CYS 433 -20.259 23.087 -12.226 133 HB3 CYS 433 HB3 CYS 433 -20.782 21.617 -11.364 134 H GLU 434 H GLU 434 -21.408 19.780 -11.750 135 HA GLU 434 HA GLU 434 -21.273 17.632 -11.049 136 HB2 GLU 434 HB2 GLU 434 -20.957 17.176 -14.036 137 HB3 GLU 434 HB3 GLU 434 -21.335 15.912 -12.849 138 HG2 GLU 434 HG2 GLU 434 -23.342 17.205 -12.138 139 HG3 GLU 434 HG3 GLU 434 -23.002 18.401 -13.401 140 H ASN 435 H ASN 435 -18.615 19.166 -11.328 141 HA ASN 435 HA ASN 435 -16.618 17.162 -11.882 142 HB2 ASN 435 HB2 ASN 435 -16.242 19.632 -11.983 143 HB3 ASN 435 HB3 ASN 435 -16.448 19.703 -10.227 144 HD21 ASN 435 HD21 ASN 435 -13.043 19.112 -9.684 145 HD22 ASN 435 HD22 ASN 435 -14.535 19.886 -9.200 146 H MET 436 H MET 436 -15.630 15.703 -10.523 147 HA MET 436 HA MET 436 -16.858 15.183 -7.923 148 HB2 MET 436 HB2 MET 436 -16.170 13.346 -9.431 149 HB3 MET 436 HB3 MET 436 -14.503 13.939 -9.384 150 HG2 MET 436 HG2 MET 436 -14.302 12.355 -7.770 151 HG3 MET 436 HG3 MET 436 -14.877 13.666 -6.738 152 HE1 MET 436 HE1 MET 436 -16.703 13.453 -5.161 153 HE2 MET 436 HE2 MET 436 -17.715 13.982 -6.531 154 HE3 MET 436 HE3 MET 436 -18.248 12.634 -5.497 155 H ASN 437 H ASN 437 -16.352 16.736 -6.397 156 HA ASN 437 HA ASN 437 -13.646 17.873 -6.319 157 HB2 ASN 437 HB2 ASN 437 -16.108 18.402 -4.626 158 HB3 ASN 437 HB3 ASN 437 -14.610 19.332 -4.563 159 HD21 ASN 437 HD21 ASN 437 -17.387 20.589 -7.046 160 HD22 ASN 437 HD22 ASN 437 -17.612 19.699 -5.550 161 H PHE 438 H PHE 438 -12.205 17.728 -4.589 162 HA PHE 438 HA PHE 438 -12.223 15.244 -3.163 163 HB2 PHE 438 HB2 PHE 438 -10.442 17.685 -3.037 164 HB3 PHE 438 HB3 PHE 438 -10.209 16.285 -2.006 165 HD1 PHE 438 HD1 PHE 438 -11.064 14.219 -4.301 166 HD2 PHE 438 HD2 PHE 438 -8.271 17.491 -4.079 167 HE1 PHE 438 HE1 PHE 438 -9.666 13.149 -6.026 168 HE2 PHE 438 HE2 PHE 438 -6.844 16.373 -5.776 169 HZ PHE 438 HZ PHE 438 -7.538 14.211 -6.750 170 H SER 439 H SER 439 -11.975 14.941 -0.851 171 HA SER 439 HA SER 439 -14.367 15.787 0.387 172 HB2 SER 439 HB2 SER 439 -13.317 13.662 0.899 173 HB3 SER 439 HB3 SER 439 -11.848 14.473 1.480 174 HG SER 439 HG SER 439 -13.312 13.824 3.160 175 H TRP 440 H TRP 440 -11.045 17.101 0.603 176 HA TRP 440 HA TRP 440 -11.676 18.603 3.007 177 HB2 TRP 440 HB2 TRP 440 -9.406 19.607 2.589 178 HB3 TRP 440 HB3 TRP 440 -9.465 17.860 2.822 179 HD1 TRP 440 HD1 TRP 440 -8.699 16.335 0.841 180 HE1 TRP 440 HE1 TRP 440 -7.460 16.750 -1.340 181 HE3 TRP 440 HE3 TRP 440 -9.304 21.404 0.538 182 HZ2 TRP 440 HZ2 TRP 440 -6.782 19.022 -3.022 183 HZ3 TRP 440 HZ3 TRP 440 -8.359 22.657 -1.362 184 HH2 TRP 440 HH2 TRP 440 -7.072 21.486 -3.135 185 H ARG 441 H ARG 441 -12.338 19.120 -0.312 186 HA ARG 441 HA ARG 441 -12.180 22.031 -0.199 187 HB2 ARG 441 HB2 ARG 441 -13.468 20.104 -2.166 188 HB3 ARG 441 HB3 ARG 441 -13.470 21.871 -2.351 189 HG2 ARG 441 HG2 ARG 441 -10.990 21.874 -2.279 190 HG3 ARG 441 HG3 ARG 441 -11.004 20.090 -2.200 191 HD2 ARG 441 HD2 ARG 441 -12.246 20.028 -4.357 192 HD3 ARG 441 HD3 ARG 441 -12.193 21.789 -4.443 193 HE ARG 441 HE ARG 441 -10.087 19.914 -5.098 194 HH11 ARG 441 HH11 ARG 441 -10.699 23.197 -3.945 195 HH12 ARG 441 HH12 ARG 441 -9.173 23.817 -4.533 196 HH21 ARG 441 HH21 ARG 441 -8.108 20.736 -5.842 197 HH22 ARG 441 HH22 ARG 441 -7.692 22.420 -5.586 198 H ASN 442 H ASN 442 -13.837 23.487 0.123 199 HA ASN 442 HA ASN 442 -16.449 22.346 1.020 200 HB2 ASN 442 HB2 ASN 442 -15.065 24.963 1.712 201 HB3 ASN 442 HB3 ASN 442 -16.713 24.539 2.205 202 HD21 ASN 442 HD21 ASN 442 -14.135 23.646 4.881 203 HD22 ASN 442 HD22 ASN 442 -14.386 25.089 3.922 204 H GLU 443 H GLU 443 -14.925 23.793 -1.578 205 HA GLU 443 HA GLU 443 -17.532 24.629 -2.693 206 HB2 GLU 443 HB2 GLU 443 -14.993 26.301 -2.843 207 HB3 GLU 443 HB3 GLU 443 -16.517 26.646 -3.674 208 HG2 GLU 443 HG2 GLU 443 -17.661 26.804 -1.458 209 HG3 GLU 443 HG3 GLU 443 -16.099 26.558 -0.654 210 H CYS 444 H CYS 444 -17.475 24.755 -5.052 211 HA CYS 444 HA CYS 444 -16.294 22.406 -6.128 212 HB2 CYS 444 HB2 CYS 444 -18.417 23.420 -6.913 213 HB3 CYS 444 HB3 CYS 444 -17.510 24.802 -7.554 214 H ASN 445 H ASN 445 -14.698 22.143 -7.743 215 HA ASN 445 HA ASN 445 -12.481 24.042 -7.410 216 HB2 ASN 445 HB2 ASN 445 -12.496 21.403 -7.264 217 HB3 ASN 445 HB3 ASN 445 -12.411 21.480 -9.027 218 HD21 ASN 445 HD21 ASN 445 -8.922 21.263 -8.058 219 HD22 ASN 445 HD22 ASN 445 -10.337 20.288 -8.383 220 H GLN 446 H GLN 446 -15.117 24.038 -9.359 221 HA GLN 446 HA GLN 446 -13.599 24.930 -11.771 222 HB2 GLN 446 HB2 GLN 446 -16.021 23.084 -11.712 223 HB3 GLN 446 HB3 GLN 446 -15.207 23.689 -13.164 224 HG2 GLN 446 HG2 GLN 446 -13.875 21.964 -11.025 225 HG3 GLN 446 HG3 GLN 446 -14.593 21.333 -12.501 226 HE21 GLN 446 HE21 GLN 446 -10.941 21.739 -13.121 227 HE22 GLN 446 HE22 GLN 446 -11.956 20.781 -12.057 228 H CYS 447 H CYS 447 -16.580 25.018 -9.824 229 HA CYS 447 HA CYS 447 -17.290 27.556 -11.211 230 HB2 CYS 447 HB2 CYS 447 -19.674 26.882 -11.087 231 HB3 CYS 447 HB3 CYS 447 -18.697 25.817 -12.126 232 H LYS 448 H LYS 448 -16.258 26.343 -8.385 233 HA LYS 448 HA LYS 448 -16.243 27.068 -6.245 234 HB2 LYS 448 HB2 LYS 448 -17.339 29.636 -7.433 235 HB3 LYS 448 HB3 LYS 448 -16.558 29.472 -5.855 236 HG2 LYS 448 HG2 LYS 448 -15.215 28.875 -8.529 237 HG3 LYS 448 HG3 LYS 448 -15.039 30.373 -7.598 238 HD2 LYS 448 HD2 LYS 448 -14.121 29.062 -5.685 239 HD3 LYS 448 HD3 LYS 448 -14.252 27.580 -6.653 240 HE2 LYS 448 HE2 LYS 448 -11.971 28.426 -6.751 241 HE3 LYS 448 HE3 LYS 448 -12.732 28.539 -8.348 242 HZ1 LYS 448 HZ1 LYS 448 -13.141 30.855 -7.928 243 HZ2 LYS 448 HZ2 LYS 448 -12.447 30.762 -6.437 244 HZ3 LYS 448 HZ3 LYS 448 -11.540 30.537 -7.791 245 H ALA 449 H ALA 449 -18.945 26.005 -7.468 246 HA ALA 449 HA ALA 449 -20.988 27.125 -5.811 247 HB1 ALA 449 HB1 ALA 449 -20.741 24.327 -7.004 248 HB2 ALA 449 HB2 ALA 449 -22.228 25.060 -6.368 249 HB3 ALA 449 HB3 ALA 449 -21.448 25.749 -7.810 250 HA PRO 450 HA PRO 450 -19.669 25.532 -1.933 251 HB2 PRO 450 HB2 PRO 450 -22.006 25.627 -0.490 252 HB3 PRO 450 HB3 PRO 450 -21.069 27.085 -0.955 253 HG2 PRO 450 HG2 PRO 450 -23.510 25.898 -2.300 254 HG3 PRO 450 HG3 PRO 450 -23.165 27.623 -1.942 255 HD2 PRO 450 HD2 PRO 450 -22.756 26.498 -4.408 256 HD3 PRO 450 HD3 PRO 450 -21.703 27.803 -3.778 257 H LYS 451 H LYS 451 -19.590 23.623 -0.739 258 HA LYS 451 HA LYS 451 -20.696 21.239 -1.898 259 HB2 LYS 451 HB2 LYS 451 -18.580 21.169 -0.728 260 HB3 LYS 451 HB3 LYS 451 -19.297 21.792 0.746 261 HG2 LYS 451 HG2 LYS 451 -20.872 19.607 0.443 262 HG3 LYS 451 HG3 LYS 451 -19.459 19.049 -0.456 263 HD2 LYS 451 HD2 LYS 451 -19.570 19.988 2.439 264 HD3 LYS 451 HD3 LYS 451 -19.191 18.358 1.848 265 HE2 LYS 451 HE2 LYS 451 -17.162 19.271 0.722 266 HE3 LYS 451 HE3 LYS 451 -17.539 20.877 1.366 267 HZ1 LYS 451 HZ1 LYS 451 -15.934 19.745 2.715 268 HZ2 LYS 451 HZ2 LYS 451 -17.312 19.972 3.581 269 HZ3 LYS 451 HZ3 LYS 451 -16.950 18.483 2.983 270 HA PRO 452 HA PRO 452 -23.898 21.402 1.693 271 HB2 PRO 452 HB2 PRO 452 -24.107 23.731 3.149 272 HB3 PRO 452 HB3 PRO 452 -23.080 22.344 3.646 273 HG2 PRO 452 HG2 PRO 452 -22.257 24.877 2.210 274 HG3 PRO 452 HG3 PRO 452 -21.441 24.050 3.580 275 HD2 PRO 452 HD2 PRO 452 -20.617 23.731 1.006 276 HD3 PRO 452 HD3 PRO 452 -20.573 22.381 2.187 277 H ASP 453 H ASP 453 -26.027 22.576 1.825 278 HA ASP 453 HA ASP 453 -26.656 23.679 -0.765 279 HB2 ASP 453 HB2 ASP 453 -28.298 23.261 1.751 280 HB3 ASP 453 HB3 ASP 453 -28.967 23.886 0.240 281 H GLY 454 H GLY 454 -25.284 25.165 1.894 282 HA2 GLY 454 HA2 GLY 454 -25.506 27.784 0.829 283 HA3 GLY 454 HA3 GLY 454 -26.698 27.604 2.132 284 H5' U 1 H5' U 1 -0.123 17.617 -1.264 285 H5'' U 1 H5'' U 1 -0.979 19.156 -1.497 286 H4' U 1 H4' U 1 -1.526 17.268 0.838 287 H3' U 1 H3' U 1 -2.096 16.479 -1.675 288 H2' U 1 H2' U 1 -2.950 18.578 -2.417 289 HO2' U 1 HO2' U 1 -4.526 17.126 -2.981 290 H1' U 1 H1' U 1 -4.691 18.807 0.035 291 H3 U 1 H3 U 1 -3.703 23.553 0.160 292 H5 U 1 H5 U 1 -4.418 22.244 -3.770 293 H6 U 1 H6 U 1 -4.286 19.976 -2.987 294 H5' G 2 H5' G 2 -1.730 12.778 -1.716 295 H5'' G 2 H5'' G 2 -1.894 14.439 -2.327 296 H4' G 2 H4' G 2 -2.458 12.450 -3.918 297 H3' G 2 H3' G 2 -4.067 14.961 -3.502 298 H2' G 2 H2' G 2 -5.724 14.172 -5.054 299 HO2' G 2 HO2' G 2 -4.106 13.222 -6.516 300 H1' G 2 H1' G 2 -5.900 11.662 -4.080 301 H8 G 2 H8 G 2 -5.174 14.834 -1.885 302 H1 G 2 H1 G 2 -11.197 12.646 -1.830 303 H21 G 2 H21 G 2 -11.445 11.097 -3.396 304 H22 G 2 H22 G 2 -10.110 10.543 -4.377 305 H5' G 3 H5' G 3 -4.154 14.005 -7.726 306 H5'' G 3 H5'' G 3 -2.796 15.009 -8.279 307 H4' G 3 H4' G 3 -4.619 14.652 -9.986 308 H3' G 3 H3' G 3 -3.107 16.950 -9.417 309 H2' G 3 H2' G 3 -4.846 18.164 -8.439 310 HO2' G 3 HO2' G 3 -4.369 19.180 -10.536 311 H1' G 3 H1' G 3 -6.841 16.879 -10.317 312 H8 G 3 H8 G 3 -6.292 19.262 -7.547 313 H1 G 3 H1 G 3 -12.099 16.562 -7.243 314 H21 G 3 H21 G 3 -12.180 14.803 -8.574 315 H22 G 3 H22 G 3 -10.800 14.275 -9.519 316 H5' U 4 H5' U 4 -4.791 16.262 -13.987 317 H5'' U 4 H5'' U 4 -3.919 17.389 -15.040 318 H4' U 4 H4' U 4 -6.107 17.396 -15.919 319 H3' U 4 H3' U 4 -5.946 19.697 -13.933 320 H2' U 4 H2' U 4 -8.182 20.184 -14.445 321 HO2' U 4 HO2' U 4 -7.814 20.122 -16.758 322 H1' U 4 H1' U 4 -8.923 17.501 -15.036 323 H3 U 4 H3 U 4 -11.895 17.857 -11.706 324 H5 U 4 H5 U 4 -8.491 19.712 -10.088 325 H6 U 4 H6 U 4 -7.302 19.196 -12.133 326 H5' G 5 H5' G 5 -5.970 22.147 -14.320 327 H5'' G 5 H5'' G 5 -4.749 23.180 -15.085 328 H4' G 5 H4' G 5 -3.493 23.210 -12.882 329 H3' G 5 H3' G 5 -5.577 21.288 -12.206 330 H2' G 5 H2' G 5 -6.857 22.471 -10.660 331 HO2' G 5 HO2' G 5 -4.961 22.937 -9.348 332 H1' G 5 H1' G 5 -6.624 25.030 -11.501 333 H8 G 5 H8 G 5 -8.062 21.740 -12.112 334 H1 G 5 H1 G 5 -9.766 25.791 -16.781 335 H21 G 5 H21 G 5 -8.503 27.608 -16.714 336 H22 G 5 H22 G 5 -7.239 27.816 -15.519 Start of MODEL 9 1 H1 GLY 414 H1 NGL 414 0.825 13.358 -4.819 2 H2 GLY 414 H2 NGL 414 -0.585 13.981 -5.394 3 H3 GLY 414 H3 NGL 414 0.854 14.565 -5.940 4 HA2 GLY 414 HA2 NGL 414 1.386 12.461 -6.964 5 HA3 GLY 414 HA3 NGL 414 -0.170 11.842 -6.378 6 HA PRO 415 HA PRO 415 -0.542 15.080 -10.094 7 HB2 PRO 415 HB2 PRO 415 1.244 13.418 -11.825 8 HB3 PRO 415 HB3 PRO 415 1.061 15.198 -11.774 9 HG2 PRO 415 HG2 PRO 415 3.234 13.951 -10.673 10 HG3 PRO 415 HG3 PRO 415 2.481 15.386 -9.899 11 HD2 PRO 415 HD2 PRO 415 2.189 12.474 -9.171 12 HD3 PRO 415 HD3 PRO 415 2.315 13.908 -8.106 13 H LEU 416 H LEU 416 -2.004 14.715 -11.816 14 HA LEU 416 HA LEU 416 -3.774 13.683 -12.774 15 HB2 LEU 416 HB2 LEU 416 -1.942 11.268 -12.964 16 HB3 LEU 416 HB3 LEU 416 -3.354 11.619 -13.973 17 HG LEU 416 HG LEU 416 -0.827 13.335 -13.837 18 HD11 LEU 416 HD11 LEU 416 -0.455 11.141 -14.911 19 HD12 LEU 416 HD12 LEU 416 -1.853 11.426 -15.977 20 HD13 LEU 416 HD13 LEU 416 -0.408 12.463 -16.102 21 HD21 LEU 416 HD21 LEU 416 -1.805 14.441 -15.830 22 HD22 LEU 416 HD22 LEU 416 -3.284 13.461 -15.636 23 HD23 LEU 416 HD23 LEU 416 -2.829 14.653 -14.395 24 H GLY 417 H GLY 417 -3.203 13.267 -9.753 25 HA2 GLY 417 HA2 GLY 417 -4.517 10.769 -9.105 26 HA3 GLY 417 HA3 GLY 417 -4.084 12.078 -7.990 27 H SER 418 H SER 418 -5.794 13.417 -10.584 28 HA SER 418 HA SER 418 -8.021 14.113 -8.945 29 HB2 SER 418 HB2 SER 418 -8.869 15.154 -11.014 30 HB3 SER 418 HB3 SER 418 -7.143 15.509 -10.782 31 HG SER 418 HG SER 418 -7.576 14.854 -12.912 32 H GLY 419 H GLY 419 -7.350 11.254 -10.764 33 HA2 GLY 419 HA2 GLY 419 -10.163 10.587 -11.280 34 HA3 GLY 419 HA3 GLY 419 -8.739 9.607 -11.649 35 H GLN 420 H GLN 420 -8.076 10.439 -8.569 36 HA GLN 420 HA GLN 420 -8.908 7.866 -7.533 37 HB2 GLN 420 HB2 GLN 420 -6.736 8.921 -6.988 38 HB3 GLN 420 HB3 GLN 420 -7.586 10.267 -6.212 39 HG2 GLN 420 HG2 GLN 420 -6.765 8.639 -4.538 40 HG3 GLN 420 HG3 GLN 420 -8.526 8.740 -4.525 41 HE21 GLN 420 HE21 GLN 420 -8.479 5.193 -4.569 42 HE22 GLN 420 HE22 GLN 420 -8.893 6.650 -3.693 43 H GLN 421 H GLN 421 -10.200 7.541 -5.593 44 HA GLN 421 HA GLN 421 -12.056 9.773 -4.925 45 HB2 GLN 421 HB2 GLN 421 -13.914 8.191 -4.825 46 HB3 GLN 421 HB3 GLN 421 -13.221 8.257 -6.457 47 HG2 GLN 421 HG2 GLN 421 -11.935 6.181 -5.992 48 HG3 GLN 421 HG3 GLN 421 -12.632 6.115 -4.363 49 HE21 GLN 421 HE21 GLN 421 -14.684 3.782 -6.310 50 HE22 GLN 421 HE22 GLN 421 -13.070 3.888 -5.637 51 H ARG 422 H ARG 422 -12.734 9.834 -2.762 52 HA ARG 422 HA ARG 422 -11.665 7.803 -0.900 53 HB2 ARG 422 HB2 ARG 422 -11.029 10.780 -0.729 54 HB3 ARG 422 HB3 ARG 422 -10.715 9.604 0.551 55 HG2 ARG 422 HG2 ARG 422 -9.212 8.338 -0.977 56 HG3 ARG 422 HG3 ARG 422 -9.487 9.569 -2.234 57 HD2 ARG 422 HD2 ARG 422 -8.644 11.312 -0.621 58 HD3 ARG 422 HD3 ARG 422 -8.246 10.003 0.501 59 HE ARG 422 HE ARG 422 -7.093 10.034 -2.254 60 HH11 ARG 422 HH11 ARG 422 -6.631 10.295 1.237 61 HH12 ARG 422 HH12 ARG 422 -4.902 10.027 1.151 62 HH21 ARG 422 HH21 ARG 422 -4.839 9.678 -2.340 63 HH22 ARG 422 HH22 ARG 422 -3.891 9.698 -0.871 64 H ALA 423 H ALA 423 -12.677 7.862 1.185 65 HA ALA 423 HA ALA 423 -15.442 8.524 1.114 66 HB1 ALA 423 HB1 ALA 423 -13.609 7.980 3.485 67 HB2 ALA 423 HB2 ALA 423 -15.390 7.957 3.515 68 HB3 ALA 423 HB3 ALA 423 -14.503 6.759 2.549 69 H GLY 424 H GLY 424 -16.484 10.396 1.461 70 HA2 GLY 424 HA2 GLY 424 -16.865 12.360 2.801 71 HA3 GLY 424 HA3 GLY 424 -15.110 12.562 2.986 72 H ASP 425 H ASP 425 -15.158 11.665 -0.114 73 HA ASP 425 HA ASP 425 -14.966 14.270 -1.219 74 HB2 ASP 425 HB2 ASP 425 -15.393 11.554 -2.473 75 HB3 ASP 425 HB3 ASP 425 -15.146 13.031 -3.410 76 H TRP 426 H TRP 426 -16.339 15.195 -2.976 77 HA TRP 426 HA TRP 426 -19.163 14.395 -2.874 78 HB2 TRP 426 HB2 TRP 426 -19.934 16.556 -2.071 79 HB3 TRP 426 HB3 TRP 426 -18.895 15.770 -0.880 80 HD1 TRP 426 HD1 TRP 426 -16.531 16.872 -0.392 81 HE1 TRP 426 HE1 TRP 426 -15.583 19.216 -0.738 82 HE3 TRP 426 HE3 TRP 426 -20.016 18.670 -3.671 83 HZ2 TRP 426 HZ2 TRP 426 -16.245 21.580 -2.253 84 HZ3 TRP 426 HZ3 TRP 426 -19.823 20.978 -4.552 85 HH2 TRP 426 HH2 TRP 426 -17.965 22.443 -3.838 86 H LYS 427 H LYS 427 -20.298 15.004 -4.676 87 HA LYS 427 HA LYS 427 -18.679 16.139 -6.857 88 HB2 LYS 427 HB2 LYS 427 -20.027 14.041 -7.108 89 HB3 LYS 427 HB3 LYS 427 -21.500 15.004 -6.867 90 HG2 LYS 427 HG2 LYS 427 -20.631 16.458 -8.854 91 HG3 LYS 427 HG3 LYS 427 -19.493 15.123 -9.143 92 HD2 LYS 427 HD2 LYS 427 -21.404 14.733 -10.539 93 HD3 LYS 427 HD3 LYS 427 -21.541 13.583 -9.190 94 HE2 LYS 427 HE2 LYS 427 -23.082 15.161 -8.030 95 HE3 LYS 427 HE3 LYS 427 -22.924 16.303 -9.372 96 HZ1 LYS 427 HZ1 LYS 427 -23.887 14.637 -10.814 97 HZ2 LYS 427 HZ2 LYS 427 -24.051 13.590 -9.555 98 HZ3 LYS 427 HZ3 LYS 427 -24.907 14.992 -9.573 99 H CYS 428 H CYS 428 -19.225 17.987 -8.024 100 HA CYS 428 HA CYS 428 -20.319 20.135 -6.582 101 HB2 CYS 428 HB2 CYS 428 -18.698 20.258 -8.484 102 HB3 CYS 428 HB3 CYS 428 -20.013 19.825 -9.597 103 HA PRO 429 HA PRO 429 -24.651 19.289 -7.169 104 HB2 PRO 429 HB2 PRO 429 -25.686 21.623 -6.173 105 HB3 PRO 429 HB3 PRO 429 -24.944 20.360 -5.134 106 HG2 PRO 429 HG2 PRO 429 -23.682 22.909 -6.187 107 HG3 PRO 429 HG3 PRO 429 -23.608 22.228 -4.528 108 HD2 PRO 429 HD2 PRO 429 -21.610 21.882 -6.369 109 HD3 PRO 429 HD3 PRO 429 -22.013 20.632 -5.153 110 H ASN 430 H ASN 430 -22.852 21.792 -8.755 111 HA ASN 430 HA ASN 430 -25.013 22.978 -10.249 112 HB2 ASN 430 HB2 ASN 430 -22.380 23.585 -9.791 113 HB3 ASN 430 HB3 ASN 430 -22.250 22.864 -11.392 114 HD21 ASN 430 HD21 ASN 430 -22.691 26.493 -11.883 115 HD22 ASN 430 HD22 ASN 430 -21.508 25.427 -11.155 116 HA PRO 431 HA PRO 431 -25.457 19.384 -12.926 117 HB2 PRO 431 HB2 PRO 431 -27.216 20.484 -14.754 118 HB3 PRO 431 HB3 PRO 431 -27.693 19.892 -13.131 119 HG2 PRO 431 HG2 PRO 431 -27.114 22.733 -14.013 120 HG3 PRO 431 HG3 PRO 431 -28.453 22.132 -12.980 121 HD2 PRO 431 HD2 PRO 431 -26.194 23.270 -11.945 122 HD3 PRO 431 HD3 PRO 431 -27.051 21.942 -11.107 123 H THR 432 H THR 432 -24.337 22.578 -13.777 124 HA THR 432 HA THR 432 -23.327 21.689 -16.383 125 HB THR 432 HB THR 432 -22.888 23.901 -16.891 126 HG1 THR 432 HG1 THR 432 -22.646 25.490 -15.305 127 HG21 THR 432 HG21 THR 432 -25.177 24.131 -14.883 128 HG22 THR 432 HG22 THR 432 -24.885 25.160 -16.303 129 HG23 THR 432 HG23 THR 432 -25.342 23.454 -16.520 130 H CYS 433 H CYS 433 -22.307 21.158 -13.344 131 HA CYS 433 HA CYS 433 -19.417 21.468 -14.030 132 HB2 CYS 433 HB2 CYS 433 -20.224 22.931 -12.195 133 HB3 CYS 433 HB3 CYS 433 -20.767 21.486 -11.310 134 H GLU 434 H GLU 434 -21.397 19.645 -11.650 135 HA GLU 434 HA GLU 434 -21.267 17.527 -10.883 136 HB2 GLU 434 HB2 GLU 434 -20.954 16.983 -13.853 137 HB3 GLU 434 HB3 GLU 434 -21.325 15.749 -12.631 138 HG2 GLU 434 HG2 GLU 434 -23.329 17.070 -11.942 139 HG3 GLU 434 HG3 GLU 434 -23.003 18.211 -13.258 140 H ASN 435 H ASN 435 -18.605 19.040 -11.203 141 HA ASN 435 HA ASN 435 -16.621 17.016 -11.698 142 HB2 ASN 435 HB2 ASN 435 -16.219 19.472 -11.891 143 HB3 ASN 435 HB3 ASN 435 -16.437 19.628 -10.144 144 HD21 ASN 435 HD21 ASN 435 -13.037 19.022 -9.551 145 HD22 ASN 435 HD22 ASN 435 -14.526 19.818 -9.095 146 H MET 436 H MET 436 -15.541 15.660 -10.264 147 HA MET 436 HA MET 436 -16.802 15.239 -7.660 148 HB2 MET 436 HB2 MET 436 -16.122 13.326 -9.074 149 HB3 MET 436 HB3 MET 436 -14.450 13.910 -9.052 150 HG2 MET 436 HG2 MET 436 -14.190 12.521 -7.310 151 HG3 MET 436 HG3 MET 436 -14.968 13.797 -6.366 152 HE1 MET 436 HE1 MET 436 -17.093 13.619 -5.164 153 HE2 MET 436 HE2 MET 436 -17.914 13.799 -6.732 154 HE3 MET 436 HE3 MET 436 -18.447 12.536 -5.595 155 H ASN 437 H ASN 437 -16.318 16.871 -6.226 156 HA ASN 437 HA ASN 437 -13.611 17.985 -6.136 157 HB2 ASN 437 HB2 ASN 437 -16.084 18.553 -4.465 158 HB3 ASN 437 HB3 ASN 437 -14.600 19.499 -4.442 159 HD21 ASN 437 HD21 ASN 437 -17.417 20.571 -7.003 160 HD22 ASN 437 HD22 ASN 437 -17.629 19.705 -5.495 161 H PHE 438 H PHE 438 -12.209 17.895 -4.356 162 HA PHE 438 HA PHE 438 -12.222 15.394 -2.960 163 HB2 PHE 438 HB2 PHE 438 -10.445 17.828 -2.803 164 HB3 PHE 438 HB3 PHE 438 -10.210 16.410 -1.795 165 HD1 PHE 438 HD1 PHE 438 -8.131 17.481 -3.629 166 HD2 PHE 438 HD2 PHE 438 -11.227 14.574 -4.368 167 HE1 PHE 438 HE1 PHE 438 -6.721 16.408 -5.347 168 HE2 PHE 438 HE2 PHE 438 -9.819 13.527 -6.095 169 HZ PHE 438 HZ PHE 438 -7.554 14.422 -6.581 170 H SER 439 H SER 439 -12.001 15.051 -0.659 171 HA SER 439 HA SER 439 -14.399 15.873 0.582 172 HB2 SER 439 HB2 SER 439 -13.516 14.661 2.529 173 HB3 SER 439 HB3 SER 439 -13.207 13.743 1.031 174 HG SER 439 HG SER 439 -11.101 14.428 1.074 175 H TRP 440 H TRP 440 -11.177 17.321 0.670 176 HA TRP 440 HA TRP 440 -11.796 18.763 3.143 177 HB2 TRP 440 HB2 TRP 440 -9.502 19.723 2.771 178 HB3 TRP 440 HB3 TRP 440 -9.610 17.973 2.993 179 HD1 TRP 440 HD1 TRP 440 -8.802 16.437 1.058 180 HE1 TRP 440 HE1 TRP 440 -7.571 16.802 -1.129 181 HE3 TRP 440 HE3 TRP 440 -9.354 21.504 0.687 182 HZ2 TRP 440 HZ2 TRP 440 -6.816 19.052 -2.813 183 HZ3 TRP 440 HZ3 TRP 440 -8.382 22.727 -1.226 184 HH2 TRP 440 HH2 TRP 440 -7.090 21.516 -2.971 185 H ARG 441 H ARG 441 -12.442 19.289 -0.170 186 HA ARG 441 HA ARG 441 -12.236 22.201 -0.056 187 HB2 ARG 441 HB2 ARG 441 -13.502 20.281 -2.041 188 HB3 ARG 441 HB3 ARG 441 -13.520 22.050 -2.215 189 HG2 ARG 441 HG2 ARG 441 -11.024 22.057 -2.095 190 HG3 ARG 441 HG3 ARG 441 -11.046 20.277 -2.087 191 HD2 ARG 441 HD2 ARG 441 -12.253 20.284 -4.255 192 HD3 ARG 441 HD3 ARG 441 -12.239 22.050 -4.269 193 HE ARG 441 HE ARG 441 -10.057 20.246 -4.942 194 HH11 ARG 441 HH11 ARG 441 -10.844 23.499 -3.811 195 HH12 ARG 441 HH12 ARG 441 -9.324 24.181 -4.344 196 HH21 ARG 441 HH21 ARG 441 -8.104 21.149 -5.639 197 HH22 ARG 441 HH22 ARG 441 -7.779 22.854 -5.398 198 H ASN 442 H ASN 442 -13.918 23.679 0.153 199 HA ASN 442 HA ASN 442 -16.533 22.562 1.060 200 HB2 ASN 442 HB2 ASN 442 -15.167 25.194 1.726 201 HB3 ASN 442 HB3 ASN 442 -16.820 24.769 2.200 202 HD21 ASN 442 HD21 ASN 442 -14.226 23.938 4.899 203 HD22 ASN 442 HD22 ASN 442 -14.454 25.351 3.892 204 H GLU 443 H GLU 443 -14.969 23.958 -1.538 205 HA GLU 443 HA GLU 443 -17.552 24.790 -2.721 206 HB2 GLU 443 HB2 GLU 443 -14.986 26.423 -2.863 207 HB3 GLU 443 HB3 GLU 443 -16.485 26.765 -3.740 208 HG2 GLU 443 HG2 GLU 443 -17.681 26.991 -1.558 209 HG3 GLU 443 HG3 GLU 443 -16.132 26.758 -0.716 210 H CYS 444 H CYS 444 -17.470 24.830 -5.080 211 HA CYS 444 HA CYS 444 -16.271 22.443 -6.061 212 HB2 CYS 444 HB2 CYS 444 -18.399 23.383 -6.884 213 HB3 CYS 444 HB3 CYS 444 -17.522 24.771 -7.567 214 H ASN 445 H ASN 445 -14.689 22.121 -7.662 215 HA ASN 445 HA ASN 445 -12.481 24.051 -7.419 216 HB2 ASN 445 HB2 ASN 445 -12.437 21.457 -7.028 217 HB3 ASN 445 HB3 ASN 445 -12.404 21.349 -8.794 218 HD21 ASN 445 HD21 ASN 445 -8.883 21.281 -8.049 219 HD22 ASN 445 HD22 ASN 445 -10.300 20.279 -8.307 220 H GLN 446 H GLN 446 -15.071 23.978 -9.356 221 HA GLN 446 HA GLN 446 -13.538 24.701 -11.810 222 HB2 GLN 446 HB2 GLN 446 -15.973 22.883 -11.663 223 HB3 GLN 446 HB3 GLN 446 -15.166 23.411 -13.148 224 HG2 GLN 446 HG2 GLN 446 -13.804 21.788 -10.949 225 HG3 GLN 446 HG3 GLN 446 -14.567 21.073 -12.357 226 HE21 GLN 446 HE21 GLN 446 -10.979 21.324 -13.194 227 HE22 GLN 446 HE22 GLN 446 -11.998 20.443 -12.071 228 H CYS 447 H CYS 447 -16.529 24.892 -9.887 229 HA CYS 447 HA CYS 447 -17.193 27.404 -11.340 230 HB2 CYS 447 HB2 CYS 447 -19.593 26.766 -11.185 231 HB3 CYS 447 HB3 CYS 447 -18.641 25.653 -12.199 232 H LYS 448 H LYS 448 -16.213 26.192 -8.470 233 HA LYS 448 HA LYS 448 -16.194 26.953 -6.354 234 HB2 LYS 448 HB2 LYS 448 -17.059 29.555 -7.657 235 HB3 LYS 448 HB3 LYS 448 -16.403 29.392 -6.017 236 HG2 LYS 448 HG2 LYS 448 -14.325 28.411 -6.944 237 HG3 LYS 448 HG3 LYS 448 -14.964 28.624 -8.590 238 HD2 LYS 448 HD2 LYS 448 -15.168 31.065 -8.192 239 HD3 LYS 448 HD3 LYS 448 -14.477 30.855 -6.572 240 HE2 LYS 448 HE2 LYS 448 -13.099 30.137 -9.198 241 HE3 LYS 448 HE3 LYS 448 -12.788 31.599 -8.241 242 HZ1 LYS 448 HZ1 LYS 448 -12.060 30.193 -6.448 243 HZ2 LYS 448 HZ2 LYS 448 -12.362 28.832 -7.323 244 HZ3 LYS 448 HZ3 LYS 448 -11.184 29.872 -7.801 245 H ALA 449 H ALA 449 -18.925 25.981 -7.558 246 HA ALA 449 HA ALA 449 -20.931 27.227 -5.951 247 HB1 ALA 449 HB1 ALA 449 -20.766 24.391 -7.052 248 HB2 ALA 449 HB2 ALA 449 -22.234 25.190 -6.446 249 HB3 ALA 449 HB3 ALA 449 -21.425 25.806 -7.906 250 HA PRO 450 HA PRO 450 -19.716 25.723 -2.003 251 HB2 PRO 450 HB2 PRO 450 -22.082 25.867 -0.611 252 HB3 PRO 450 HB3 PRO 450 -21.131 27.309 -1.098 253 HG2 PRO 450 HG2 PRO 450 -23.554 26.108 -2.456 254 HG3 PRO 450 HG3 PRO 450 -23.194 27.837 -2.140 255 HD2 PRO 450 HD2 PRO 450 -22.744 26.642 -4.568 256 HD3 PRO 450 HD3 PRO 450 -21.701 27.953 -3.945 257 H LYS 451 H LYS 451 -19.646 23.826 -0.780 258 HA LYS 451 HA LYS 451 -20.769 21.440 -1.905 259 HB2 LYS 451 HB2 LYS 451 -18.665 21.369 -0.723 260 HB3 LYS 451 HB3 LYS 451 -19.386 22.021 0.739 261 HG2 LYS 451 HG2 LYS 451 -20.971 19.829 0.461 262 HG3 LYS 451 HG3 LYS 451 -19.528 19.254 -0.386 263 HD2 LYS 451 HD2 LYS 451 -19.713 20.289 2.473 264 HD3 LYS 451 HD3 LYS 451 -19.332 18.635 1.950 265 HE2 LYS 451 HE2 LYS 451 -17.271 19.487 0.848 266 HE3 LYS 451 HE3 LYS 451 -17.656 21.124 1.416 267 HZ1 LYS 451 HZ1 LYS 451 -17.116 18.795 3.132 268 HZ2 LYS 451 HZ2 LYS 451 -16.097 20.061 2.863 269 HZ3 LYS 451 HZ3 LYS 451 -17.504 20.299 3.676 270 HA PRO 452 HA PRO 452 -23.979 21.628 1.684 271 HB2 PRO 452 HB2 PRO 452 -24.189 23.952 3.145 272 HB3 PRO 452 HB3 PRO 452 -23.145 22.573 3.617 273 HG2 PRO 452 HG2 PRO 452 -22.362 25.114 2.160 274 HG3 PRO 452 HG3 PRO 452 -21.524 24.311 3.533 275 HD2 PRO 452 HD2 PRO 452 -20.711 23.965 0.962 276 HD3 PRO 452 HD3 PRO 452 -20.651 22.634 2.154 277 H ASP 453 H ASP 453 -26.126 22.727 1.760 278 HA ASP 453 HA ASP 453 -26.690 23.970 -0.798 279 HB2 ASP 453 HB2 ASP 453 -28.420 23.222 1.569 280 HB3 ASP 453 HB3 ASP 453 -29.051 23.942 0.077 281 H GLY 454 H GLY 454 -25.544 25.295 2.045 282 HA2 GLY 454 HA2 GLY 454 -27.188 27.676 2.196 283 HA3 GLY 454 HA3 GLY 454 -25.640 27.394 3.015 284 H5' U 1 H5' U 1 -0.301 17.225 -1.410 285 H5'' U 1 H5'' U 1 -1.086 18.806 -1.607 286 H4' U 1 H4' U 1 -1.373 17.066 0.891 287 H3' U 1 H3' U 1 -2.396 16.251 -1.460 288 H2' U 1 H2' U 1 -3.252 18.325 -2.181 289 HO2' U 1 HO2' U 1 -5.344 17.145 -0.654 290 H1' U 1 H1' U 1 -4.489 18.975 0.471 291 H3 U 1 H3 U 1 -2.636 23.473 -0.092 292 H5 U 1 H5 U 1 -4.446 22.026 -3.600 293 H6 U 1 H6 U 1 -4.528 19.846 -2.598 294 H5' G 2 H5' G 2 -2.044 12.363 -1.146 295 H5'' G 2 H5'' G 2 -1.687 14.029 -1.656 296 H4' G 2 H4' G 2 -2.317 12.448 -3.529 297 H3' G 2 H3' G 2 -3.679 15.064 -2.977 298 H2' G 2 H2' G 2 -5.259 14.701 -4.704 299 HO2' G 2 HO2' G 2 -3.627 13.917 -6.227 300 H1' G 2 H1' G 2 -5.722 12.061 -4.293 301 H8 G 2 H8 G 2 -5.167 14.942 -1.698 302 H1 G 2 H1 G 2 -11.134 12.626 -2.127 303 H21 G 2 H21 G 2 -11.270 11.251 -3.830 304 H22 G 2 H22 G 2 -9.876 10.797 -4.792 305 H5' G 3 H5' G 3 -4.410 17.310 -6.614 306 H5'' G 3 H5'' G 3 -4.879 15.624 -6.302 307 H4' G 3 H4' G 3 -4.139 15.099 -8.696 308 H3' G 3 H3' G 3 -2.952 17.485 -8.838 309 H2' G 3 H2' G 3 -4.811 18.740 -8.011 310 HO2' G 3 HO2' G 3 -4.120 19.524 -10.169 311 H1' G 3 H1' G 3 -6.721 17.414 -9.927 312 H8 G 3 H8 G 3 -6.272 19.646 -7.018 313 H1 G 3 H1 G 3 -12.015 16.791 -7.020 314 H21 G 3 H21 G 3 -12.027 15.108 -8.450 315 H22 G 3 H22 G 3 -10.618 14.664 -9.390 316 H5' U 4 H5' U 4 -4.318 19.418 -13.415 317 H5'' U 4 H5'' U 4 -5.354 18.666 -12.179 318 H4' U 4 H4' U 4 -5.329 17.681 -15.051 319 H3' U 4 H3' U 4 -6.739 20.019 -13.778 320 H2' U 4 H2' U 4 -8.793 19.447 -14.779 321 HO2' U 4 HO2' U 4 -7.953 19.030 -16.884 322 H1' U 4 H1' U 4 -8.585 16.711 -14.525 323 H3 U 4 H3 U 4 -11.685 17.226 -11.318 324 H5 U 4 H5 U 4 -8.752 20.028 -10.218 325 H6 U 4 H6 U 4 -7.453 19.340 -12.134 326 H5' G 5 H5' G 5 -7.922 21.583 -13.720 327 H5'' G 5 H5'' G 5 -8.565 22.884 -14.741 328 H4' G 5 H4' G 5 -6.390 23.313 -12.640 329 H3' G 5 H3' G 5 -8.881 22.604 -11.880 330 H2' G 5 H2' G 5 -10.191 23.983 -13.228 331 HO2' G 5 HO2' G 5 -10.658 24.760 -11.134 332 H1' G 5 H1' G 5 -8.546 26.426 -13.200 333 H8 G 5 H8 G 5 -11.351 25.435 -14.535 334 H1 G 5 H1 G 5 -7.421 25.633 -19.599 335 H21 G 5 H21 G 5 -5.307 25.651 -18.927 336 H22 G 5 H22 G 5 -4.874 25.602 -17.233 Start of MODEL 10 1 H1 GLY 414 H1 NGL 414 -21.308 12.736 -16.037 2 H2 GLY 414 H2 NGL 414 -21.860 13.977 -15.103 3 H3 GLY 414 H3 NGL 414 -22.741 12.594 -15.232 4 HA2 GLY 414 HA2 NGL 414 -21.635 12.687 -13.115 5 HA3 GLY 414 HA3 NGL 414 -21.066 11.329 -14.107 6 HA PRO 415 HA PRO 415 -17.539 14.267 -12.811 7 HB2 PRO 415 HB2 PRO 415 -16.412 12.746 -10.816 8 HB3 PRO 415 HB3 PRO 415 -17.688 13.967 -10.519 9 HG2 PRO 415 HG2 PRO 415 -17.982 10.972 -10.798 10 HG3 PRO 415 HG3 PRO 415 -18.748 12.069 -9.604 11 HD2 PRO 415 HD2 PRO 415 -20.039 11.191 -11.857 12 HD3 PRO 415 HD3 PRO 415 -20.335 12.815 -11.153 13 H LEU 416 H LEU 416 -15.249 13.807 -13.182 14 HA LEU 416 HA LEU 416 -14.841 11.729 -15.149 15 HB2 LEU 416 HB2 LEU 416 -12.823 13.512 -13.729 16 HB3 LEU 416 HB3 LEU 416 -12.539 12.576 -15.205 17 HG LEU 416 HG LEU 416 -14.567 14.842 -14.922 18 HD11 LEU 416 HD11 LEU 416 -11.856 14.715 -16.308 19 HD12 LEU 416 HD12 LEU 416 -12.986 16.090 -16.353 20 HD13 LEU 416 HD13 LEU 416 -12.225 15.616 -14.820 21 HD21 LEU 416 HD21 LEU 416 -15.249 13.183 -16.618 22 HD22 LEU 416 HD22 LEU 416 -14.673 14.662 -17.405 23 HD23 LEU 416 HD23 LEU 416 -13.620 13.227 -17.332 24 H GLY 417 H GLY 417 -13.441 9.928 -15.022 25 HA2 GLY 417 HA2 GLY 417 -13.326 8.671 -12.378 26 HA3 GLY 417 HA3 GLY 417 -12.857 7.953 -13.934 27 H SER 418 H SER 418 -11.352 10.817 -14.113 28 HA SER 418 HA SER 418 -8.759 9.715 -13.440 29 HB2 SER 418 HB2 SER 418 -9.638 12.488 -14.326 30 HB3 SER 418 HB3 SER 418 -7.950 11.943 -14.202 31 HG SER 418 HG SER 418 -8.816 11.704 -16.317 32 H GLY 419 H GLY 419 -7.173 10.915 -12.072 33 HA2 GLY 419 HA2 GLY 419 -6.514 11.997 -10.142 34 HA3 GLY 419 HA3 GLY 419 -8.142 12.679 -9.984 35 H GLN 420 H GLN 420 -7.100 12.018 -7.671 36 HA GLN 420 HA GLN 420 -7.523 9.246 -6.917 37 HB2 GLN 420 HB2 GLN 420 -7.132 11.787 -5.279 38 HB3 GLN 420 HB3 GLN 420 -7.116 10.146 -4.612 39 HG2 GLN 420 HG2 GLN 420 -5.198 11.195 -6.737 40 HG3 GLN 420 HG3 GLN 420 -4.828 11.030 -5.018 41 HE21 GLN 420 HE21 GLN 420 -3.497 8.035 -6.822 42 HE22 GLN 420 HE22 GLN 420 -3.271 9.769 -6.960 43 H GLN 421 H GLN 421 -9.012 8.696 -5.055 44 HA GLN 421 HA GLN 421 -11.449 10.343 -4.893 45 HB2 GLN 421 HB2 GLN 421 -11.893 8.893 -6.796 46 HB3 GLN 421 HB3 GLN 421 -11.449 7.458 -5.845 47 HG2 GLN 421 HG2 GLN 421 -13.317 7.821 -4.317 48 HG3 GLN 421 HG3 GLN 421 -13.711 9.362 -5.097 49 HE21 GLN 421 HE21 GLN 421 -16.180 7.114 -6.540 50 HE22 GLN 421 HE22 GLN 421 -15.860 8.021 -5.077 51 H ARG 422 H ARG 422 -12.475 10.165 -2.929 52 HA ARG 422 HA ARG 422 -11.707 7.992 -1.079 53 HB2 ARG 422 HB2 ARG 422 -11.414 10.966 -0.475 54 HB3 ARG 422 HB3 ARG 422 -11.321 9.685 0.741 55 HG2 ARG 422 HG2 ARG 422 -9.378 8.691 -0.463 56 HG3 ARG 422 HG3 ARG 422 -9.461 10.011 -1.653 57 HD2 ARG 422 HD2 ARG 422 -9.234 11.630 0.301 58 HD3 ARG 422 HD3 ARG 422 -8.873 10.223 1.321 59 HE ARG 422 HE ARG 422 -7.225 10.494 -1.104 60 HH11 ARG 422 HH11 ARG 422 -7.548 11.255 2.339 61 HH12 ARG 422 HH12 ARG 422 -5.825 11.449 2.566 62 HH21 ARG 422 HH21 ARG 422 -4.988 10.715 -0.759 63 HH22 ARG 422 HH22 ARG 422 -4.385 11.135 0.825 64 H ALA 423 H ALA 423 -13.172 7.848 0.786 65 HA ALA 423 HA ALA 423 -15.877 8.107 -0.129 66 HB1 ALA 423 HB1 ALA 423 -14.734 7.316 2.581 67 HB2 ALA 423 HB2 ALA 423 -16.414 7.055 2.051 68 HB3 ALA 423 HB3 ALA 423 -15.070 6.215 1.230 69 H GLY 424 H GLY 424 -13.894 10.467 1.164 70 HA2 GLY 424 HA2 GLY 424 -16.068 11.804 2.694 71 HA3 GLY 424 HA3 GLY 424 -14.349 12.240 2.684 72 H ASP 425 H ASP 425 -14.809 11.624 -0.454 73 HA ASP 425 HA ASP 425 -14.807 14.359 -1.251 74 HB2 ASP 425 HB2 ASP 425 -15.254 11.805 -2.823 75 HB3 ASP 425 HB3 ASP 425 -14.961 13.398 -3.542 76 H TRP 426 H TRP 426 -16.292 15.262 -2.952 77 HA TRP 426 HA TRP 426 -19.086 14.362 -2.733 78 HB2 TRP 426 HB2 TRP 426 -19.875 16.537 -1.952 79 HB3 TRP 426 HB3 TRP 426 -18.812 15.752 -0.783 80 HD1 TRP 426 HD1 TRP 426 -16.478 16.881 -0.275 81 HE1 TRP 426 HE1 TRP 426 -15.536 19.225 -0.642 82 HE3 TRP 426 HE3 TRP 426 -19.930 18.618 -3.607 83 HZ2 TRP 426 HZ2 TRP 426 -16.179 21.564 -2.219 84 HZ3 TRP 426 HZ3 TRP 426 -19.737 20.905 -4.528 85 HH2 TRP 426 HH2 TRP 426 -17.886 22.386 -3.839 86 H LYS 427 H LYS 427 -20.357 14.966 -4.460 87 HA LYS 427 HA LYS 427 -18.859 15.984 -6.774 88 HB2 LYS 427 HB2 LYS 427 -20.425 13.968 -6.817 89 HB3 LYS 427 HB3 LYS 427 -21.765 15.122 -6.655 90 HG2 LYS 427 HG2 LYS 427 -20.748 16.331 -8.708 91 HG3 LYS 427 HG3 LYS 427 -19.715 14.906 -8.898 92 HD2 LYS 427 HD2 LYS 427 -21.609 14.606 -10.331 93 HD3 LYS 427 HD3 LYS 427 -21.854 13.515 -8.948 94 HE2 LYS 427 HE2 LYS 427 -23.302 15.255 -7.880 95 HE3 LYS 427 HE3 LYS 427 -23.076 16.292 -9.295 96 HZ1 LYS 427 HZ1 LYS 427 -24.326 13.627 -9.317 97 HZ2 LYS 427 HZ2 LYS 427 -25.119 15.062 -9.427 98 HZ3 LYS 427 HZ3 LYS 427 -24.104 14.584 -10.633 99 H CYS 428 H CYS 428 -19.337 17.849 -7.925 100 HA CYS 428 HA CYS 428 -20.331 20.085 -6.513 101 HB2 CYS 428 HB2 CYS 428 -18.704 20.122 -8.396 102 HB3 CYS 428 HB3 CYS 428 -20.014 19.655 -9.510 103 HA PRO 429 HA PRO 429 -24.682 19.319 -7.064 104 HB2 PRO 429 HB2 PRO 429 -25.656 21.691 -6.113 105 HB3 PRO 429 HB3 PRO 429 -24.942 20.434 -5.050 106 HG2 PRO 429 HG2 PRO 429 -23.630 22.937 -6.151 107 HG3 PRO 429 HG3 PRO 429 -23.563 22.283 -4.482 108 HD2 PRO 429 HD2 PRO 429 -21.574 21.859 -6.327 109 HD3 PRO 429 HD3 PRO 429 -21.995 20.645 -5.083 110 H ASN 430 H ASN 430 -22.836 21.746 -8.720 111 HA ASN 430 HA ASN 430 -24.993 22.979 -10.177 112 HB2 ASN 430 HB2 ASN 430 -22.334 23.517 -9.769 113 HB3 ASN 430 HB3 ASN 430 -22.264 22.805 -11.383 114 HD21 ASN 430 HD21 ASN 430 -22.620 26.452 -11.807 115 HD22 ASN 430 HD22 ASN 430 -21.459 25.350 -11.091 116 HA PRO 431 HA PRO 431 -25.561 19.405 -12.863 117 HB2 PRO 431 HB2 PRO 431 -27.330 20.555 -14.655 118 HB3 PRO 431 HB3 PRO 431 -27.792 19.948 -13.028 119 HG2 PRO 431 HG2 PRO 431 -27.189 22.784 -13.888 120 HG3 PRO 431 HG3 PRO 431 -28.516 22.190 -12.835 121 HD2 PRO 431 HD2 PRO 431 -26.213 23.291 -11.848 122 HD3 PRO 431 HD3 PRO 431 -27.078 21.980 -10.990 123 H THR 432 H THR 432 -24.361 22.575 -13.691 124 HA THR 432 HA THR 432 -23.431 21.691 -16.327 125 HB THR 432 HB THR 432 -22.939 23.899 -16.820 126 HG1 THR 432 HG1 THR 432 -22.699 25.464 -15.216 127 HG21 THR 432 HG21 THR 432 -24.904 25.189 -16.234 128 HG22 THR 432 HG22 THR 432 -25.397 23.499 -16.468 129 HG23 THR 432 HG23 THR 432 -25.231 24.162 -14.820 130 H CYS 433 H CYS 433 -22.369 21.113 -13.298 131 HA CYS 433 HA CYS 433 -19.492 21.354 -14.056 132 HB2 CYS 433 HB2 CYS 433 -20.218 22.872 -12.216 133 HB3 CYS 433 HB3 CYS 433 -20.768 21.450 -11.301 134 H GLU 434 H GLU 434 -21.472 19.625 -11.619 135 HA GLU 434 HA GLU 434 -21.399 17.521 -10.809 136 HB2 GLU 434 HB2 GLU 434 -21.075 16.895 -13.764 137 HB3 GLU 434 HB3 GLU 434 -21.459 15.698 -12.505 138 HG2 GLU 434 HG2 GLU 434 -23.455 17.055 -11.868 139 HG3 GLU 434 HG3 GLU 434 -23.120 18.143 -13.231 140 H ASN 435 H ASN 435 -18.655 18.971 -11.342 141 HA ASN 435 HA ASN 435 -16.752 16.821 -11.616 142 HB2 ASN 435 HB2 ASN 435 -16.203 19.188 -12.081 143 HB3 ASN 435 HB3 ASN 435 -16.519 19.595 -10.388 144 HD21 ASN 435 HD21 ASN 435 -13.164 19.052 -9.560 145 HD22 ASN 435 HD22 ASN 435 -14.618 20.021 -9.412 146 H MET 436 H MET 436 -15.721 15.580 -10.037 147 HA MET 436 HA MET 436 -16.907 15.625 -7.354 148 HB2 MET 436 HB2 MET 436 -16.503 13.479 -8.322 149 HB3 MET 436 HB3 MET 436 -14.798 13.864 -8.646 150 HG2 MET 436 HG2 MET 436 -14.173 13.624 -6.449 151 HG3 MET 436 HG3 MET 436 -15.722 14.197 -5.827 152 HE1 MET 436 HE1 MET 436 -17.670 12.911 -5.203 153 HE2 MET 436 HE2 MET 436 -17.956 12.558 -6.914 154 HE3 MET 436 HE3 MET 436 -18.041 11.241 -5.715 155 H ASN 437 H ASN 437 -15.964 16.333 -5.513 156 HA ASN 437 HA ASN 437 -13.436 17.878 -5.845 157 HB2 ASN 437 HB2 ASN 437 -15.891 18.505 -4.167 158 HB3 ASN 437 HB3 ASN 437 -14.434 19.499 -4.258 159 HD21 ASN 437 HD21 ASN 437 -17.340 19.856 -7.067 160 HD22 ASN 437 HD22 ASN 437 -17.498 18.853 -5.638 161 H PHE 438 H PHE 438 -11.956 17.859 -4.105 162 HA PHE 438 HA PHE 438 -11.925 15.489 -2.534 163 HB2 PHE 438 HB2 PHE 438 -10.287 18.033 -2.351 164 HB3 PHE 438 HB3 PHE 438 -10.025 16.625 -1.333 165 HD1 PHE 438 HD1 PHE 438 -7.940 17.838 -3.070 166 HD2 PHE 438 HD2 PHE 438 -10.790 14.723 -3.915 167 HE1 PHE 438 HE1 PHE 438 -6.385 16.857 -4.730 168 HE2 PHE 438 HE2 PHE 438 -9.233 13.757 -5.576 169 HZ PHE 438 HZ PHE 438 -7.023 14.808 -5.972 170 H SER 439 H SER 439 -11.859 15.242 -0.226 171 HA SER 439 HA SER 439 -14.377 16.017 0.802 172 HB2 SER 439 HB2 SER 439 -13.670 14.842 2.809 173 HB3 SER 439 HB3 SER 439 -13.117 13.939 1.376 174 HG SER 439 HG SER 439 -11.068 14.781 1.694 175 H TRP 440 H TRP 440 -11.211 17.560 1.076 176 HA TRP 440 HA TRP 440 -12.058 19.100 3.431 177 HB2 TRP 440 HB2 TRP 440 -9.758 20.074 3.219 178 HB3 TRP 440 HB3 TRP 440 -9.840 18.326 3.467 179 HD1 TRP 440 HD1 TRP 440 -8.802 16.783 1.680 180 HE1 TRP 440 HE1 TRP 440 -7.409 17.130 -0.414 181 HE3 TRP 440 HE3 TRP 440 -9.551 21.804 1.057 182 HZ2 TRP 440 HZ2 TRP 440 -6.639 19.341 -2.136 183 HZ3 TRP 440 HZ3 TRP 440 -8.483 22.994 -0.815 184 HH2 TRP 440 HH2 TRP 440 -7.027 21.784 -2.421 185 H ARG 441 H ARG 441 -12.412 19.444 0.046 186 HA ARG 441 HA ARG 441 -12.252 22.349 0.000 187 HB2 ARG 441 HB2 ARG 441 -13.481 20.314 -1.894 188 HB3 ARG 441 HB3 ARG 441 -13.458 22.062 -2.193 189 HG2 ARG 441 HG2 ARG 441 -10.968 22.029 -1.981 190 HG3 ARG 441 HG3 ARG 441 -11.029 20.251 -1.861 191 HD2 ARG 441 HD2 ARG 441 -12.216 20.172 -4.057 192 HD3 ARG 441 HD3 ARG 441 -12.060 21.929 -4.195 193 HE ARG 441 HE ARG 441 -10.038 19.914 -4.713 194 HH11 ARG 441 HH11 ARG 441 -10.504 23.268 -3.689 195 HH12 ARG 441 HH12 ARG 441 -8.918 23.773 -4.223 196 HH21 ARG 441 HH21 ARG 441 -7.990 20.589 -5.385 197 HH22 ARG 441 HH22 ARG 441 -7.485 22.253 -5.177 198 H ASN 442 H ASN 442 -13.897 23.842 0.158 199 HA ASN 442 HA ASN 442 -16.537 22.803 1.088 200 HB2 ASN 442 HB2 ASN 442 -15.157 25.475 1.542 201 HB3 ASN 442 HB3 ASN 442 -16.811 25.096 2.049 202 HD21 ASN 442 HD21 ASN 442 -14.251 24.485 4.827 203 HD22 ASN 442 HD22 ASN 442 -14.485 25.822 3.717 204 H GLU 443 H GLU 443 -14.954 24.023 -1.618 205 HA GLU 443 HA GLU 443 -17.544 24.743 -2.839 206 HB2 GLU 443 HB2 GLU 443 -15.029 26.451 -3.053 207 HB3 GLU 443 HB3 GLU 443 -16.535 26.688 -3.959 208 HG2 GLU 443 HG2 GLU 443 -17.758 26.993 -1.811 209 HG3 GLU 443 HG3 GLU 443 -16.226 26.838 -0.928 210 H CYS 444 H CYS 444 -17.464 24.710 -5.194 211 HA CYS 444 HA CYS 444 -16.219 22.332 -6.121 212 HB2 CYS 444 HB2 CYS 444 -18.354 23.188 -6.978 213 HB3 CYS 444 HB3 CYS 444 -17.531 24.622 -7.634 214 H ASN 445 H ASN 445 -14.562 21.982 -7.577 215 HA ASN 445 HA ASN 445 -12.376 23.879 -7.357 216 HB2 ASN 445 HB2 ASN 445 -12.525 21.185 -7.372 217 HB3 ASN 445 HB3 ASN 445 -12.267 21.429 -9.102 218 HD21 ASN 445 HD21 ASN 445 -8.895 21.005 -7.823 219 HD22 ASN 445 HD22 ASN 445 -10.296 20.114 -8.369 220 H GLN 446 H GLN 446 -15.011 23.847 -9.413 221 HA GLN 446 HA GLN 446 -13.379 24.883 -11.688 222 HB2 GLN 446 HB2 GLN 446 -15.774 23.020 -11.944 223 HB3 GLN 446 HB3 GLN 446 -14.751 23.658 -13.248 224 HG2 GLN 446 HG2 GLN 446 -12.800 22.521 -11.919 225 HG3 GLN 446 HG3 GLN 446 -14.074 21.626 -11.089 226 HE21 GLN 446 HE21 GLN 446 -13.051 19.441 -13.863 227 HE22 GLN 446 HE22 GLN 446 -12.430 20.016 -12.328 228 H CYS 447 H CYS 447 -16.603 24.685 -10.131 229 HA CYS 447 HA CYS 447 -17.282 27.261 -11.478 230 HB2 CYS 447 HB2 CYS 447 -19.639 26.572 -11.260 231 HB3 CYS 447 HB3 CYS 447 -18.685 25.423 -12.232 232 H LYS 448 H LYS 448 -16.252 26.059 -8.578 233 HA LYS 448 HA LYS 448 -16.187 26.857 -6.470 234 HB2 LYS 448 HB2 LYS 448 -17.046 29.449 -7.799 235 HB3 LYS 448 HB3 LYS 448 -16.355 29.296 -6.170 236 HG2 LYS 448 HG2 LYS 448 -14.316 28.249 -7.149 237 HG3 LYS 448 HG3 LYS 448 -14.977 28.505 -8.773 238 HD2 LYS 448 HD2 LYS 448 -14.387 30.686 -6.717 239 HD3 LYS 448 HD3 LYS 448 -13.384 30.302 -8.128 240 HE2 LYS 448 HE2 LYS 448 -16.276 31.270 -8.200 241 HE3 LYS 448 HE3 LYS 448 -14.850 32.264 -8.525 242 HZ1 LYS 448 HZ1 LYS 448 -15.839 31.485 -10.546 243 HZ2 LYS 448 HZ2 LYS 448 -14.338 30.832 -10.376 244 HZ3 LYS 448 HZ3 LYS 448 -15.674 29.912 -10.094 245 H ALA 449 H ALA 449 -18.911 25.879 -7.634 246 HA ALA 449 HA ALA 449 -20.905 27.181 -6.031 247 HB1 ALA 449 HB1 ALA 449 -22.229 25.137 -6.497 248 HB2 ALA 449 HB2 ALA 449 -21.446 25.754 -7.971 249 HB3 ALA 449 HB3 ALA 449 -20.765 24.345 -7.128 250 HA PRO 450 HA PRO 450 -19.693 25.726 -2.083 251 HB2 PRO 450 HB2 PRO 450 -22.064 25.864 -0.689 252 HB3 PRO 450 HB3 PRO 450 -21.128 27.306 -1.192 253 HG2 PRO 450 HG2 PRO 450 -23.534 26.058 -2.539 254 HG3 PRO 450 HG3 PRO 450 -23.190 27.801 -2.237 255 HD2 PRO 450 HD2 PRO 450 -22.721 26.599 -4.661 256 HD3 PRO 450 HD3 PRO 450 -21.695 27.923 -4.029 257 H LYS 451 H LYS 451 -19.611 23.843 -0.826 258 HA LYS 451 HA LYS 451 -20.713 21.428 -1.911 259 HB2 LYS 451 HB2 LYS 451 -18.614 21.403 -0.711 260 HB3 LYS 451 HB3 LYS 451 -19.357 22.084 0.726 261 HG2 LYS 451 HG2 LYS 451 -20.920 19.871 0.481 262 HG3 LYS 451 HG3 LYS 451 -19.469 19.294 -0.346 263 HD2 LYS 451 HD2 LYS 451 -19.678 20.381 2.488 264 HD3 LYS 451 HD3 LYS 451 -19.271 18.721 1.999 265 HE2 LYS 451 HE2 LYS 451 -17.211 19.590 0.886 266 HE3 LYS 451 HE3 LYS 451 -17.637 21.226 1.420 267 HZ1 LYS 451 HZ1 LYS 451 -16.056 20.191 2.882 268 HZ2 LYS 451 HZ2 LYS 451 -17.461 20.465 3.685 269 HZ3 LYS 451 HZ3 LYS 451 -17.079 18.940 3.193 270 HA PRO 452 HA PRO 452 -23.975 21.727 1.619 271 HB2 PRO 452 HB2 PRO 452 -24.221 24.108 2.978 272 HB3 PRO 452 HB3 PRO 452 -23.180 22.757 3.537 273 HG2 PRO 452 HG2 PRO 452 -22.366 25.230 1.985 274 HG3 PRO 452 HG3 PRO 452 -21.567 24.497 3.412 275 HD2 PRO 452 HD2 PRO 452 -20.692 24.042 0.883 276 HD3 PRO 452 HD3 PRO 452 -20.664 22.751 2.125 277 H ASP 453 H ASP 453 -26.117 22.923 1.683 278 HA ASP 453 HA ASP 453 -26.731 23.846 -0.967 279 HB2 ASP 453 HB2 ASP 453 -28.375 23.661 1.573 280 HB3 ASP 453 HB3 ASP 453 -29.031 24.164 0.007 281 H GLY 454 H GLY 454 -25.331 25.534 1.551 282 HA2 GLY 454 HA2 GLY 454 -25.547 28.053 0.274 283 HA3 GLY 454 HA3 GLY 454 -26.721 28.001 1.606 284 H5' U 1 H5' U 1 0.026 19.641 1.191 285 H5'' U 1 H5'' U 1 0.126 18.029 0.461 286 H4' U 1 H4' U 1 -1.523 17.981 2.242 287 H3' U 1 H3' U 1 -2.066 17.007 -0.261 288 H2' U 1 H2' U 1 -3.099 18.877 -1.178 289 HO2' U 1 HO2' U 1 -5.166 17.587 0.298 290 H1' U 1 H1' U 1 -4.595 19.601 1.314 291 H3 U 1 H3 U 1 -3.097 24.200 0.534 292 H5 U 1 H5 U 1 -4.416 22.332 -2.986 293 H6 U 1 H6 U 1 -4.405 20.228 -1.819 294 H5' G 2 H5' G 2 -1.502 13.344 -0.205 295 H5'' G 2 H5'' G 2 -1.529 15.053 -0.693 296 H4' G 2 H4' G 2 -2.019 13.307 -2.518 297 H3' G 2 H3' G 2 -3.796 15.672 -1.936 298 H2' G 2 H2' G 2 -5.207 15.003 -3.768 299 HO2' G 2 HO2' G 2 -3.518 14.341 -5.206 300 H1' G 2 H1' G 2 -5.339 12.400 -3.078 301 H8 G 2 H8 G 2 -5.024 15.302 -0.461 302 H1 G 2 H1 G 2 -10.930 13.061 -1.498 303 H21 G 2 H21 G 2 -10.931 11.783 -3.300 304 H22 G 2 H22 G 2 -9.448 11.311 -4.105 305 H5' G 3 H5' G 3 -2.958 17.628 -7.022 306 H5'' G 3 H5'' G 3 -4.644 17.636 -6.480 307 H4' G 3 H4' G 3 -3.548 15.190 -7.903 308 H3' G 3 H3' G 3 -3.135 17.496 -9.200 309 H2' G 3 H2' G 3 -5.213 18.503 -8.704 310 HO2' G 3 HO2' G 3 -4.970 18.370 -11.054 311 H1' G 3 H1' G 3 -6.805 16.060 -9.409 312 H8 G 3 H8 G 3 -6.205 19.063 -7.033 313 H1 G 3 H1 G 3 -12.126 16.614 -6.922 314 H21 G 3 H21 G 3 -12.215 14.771 -8.140 315 H22 G 3 H22 G 3 -10.806 14.126 -8.955 316 H5' U 4 H5' U 4 -5.229 14.020 -12.015 317 H5'' U 4 H5'' U 4 -4.605 14.318 -13.651 318 H4' U 4 H4' U 4 -6.857 13.722 -14.007 319 H3' U 4 H3' U 4 -6.683 16.749 -13.885 320 H2' U 4 H2' U 4 -8.974 16.786 -14.450 321 HO2' U 4 HO2' U 4 -8.814 15.275 -16.188 322 H1' U 4 H1' U 4 -9.603 14.377 -13.097 323 H3 U 4 H3 U 4 -12.286 16.950 -10.583 324 H5 U 4 H5 U 4 -8.667 19.089 -10.556 325 H6 U 4 H6 U 4 -7.714 17.389 -11.990 326 H5' G 5 H5' G 5 -7.976 14.529 -17.811 327 H5'' G 5 H5'' G 5 -7.535 15.596 -19.164 328 H4' G 5 H4' G 5 -10.350 15.509 -17.981 329 H3' G 5 H3' G 5 -9.363 13.296 -19.150 330 H2' G 5 H2' G 5 -8.334 14.230 -21.030 331 HO2' G 5 HO2' G 5 -9.929 12.861 -21.911 332 H1' G 5 H1' G 5 -10.433 16.214 -21.698 333 H8 G 5 H8 G 5 -7.808 15.310 -23.220 334 H1 G 5 H1 G 5 -5.752 20.735 -20.491 335 H21 G 5 H21 G 5 -7.122 21.328 -18.841 336 H22 G 5 H22 G 5 -8.527 20.375 -18.425 Start of MODEL 11 1 H1 GLY 414 H1 NGL 414 -16.338 20.297 -14.878 2 H2 GLY 414 H2 NGL 414 -17.984 20.239 -14.773 3 H3 GLY 414 H3 NGL 414 -17.235 21.603 -15.314 4 HA2 GLY 414 HA2 NGL 414 -18.186 20.448 -17.155 5 HA3 GLY 414 HA3 NGL 414 -16.413 20.443 -17.252 6 HA PRO 415 HA PRO 415 -16.641 16.018 -17.493 7 HB2 PRO 415 HB2 PRO 415 -14.105 15.351 -16.667 8 HB3 PRO 415 HB3 PRO 415 -14.455 16.085 -18.264 9 HG2 PRO 415 HG2 PRO 415 -13.477 17.438 -15.739 10 HG3 PRO 415 HG3 PRO 415 -12.914 17.674 -17.426 11 HD2 PRO 415 HD2 PRO 415 -14.702 19.364 -16.197 12 HD3 PRO 415 HD3 PRO 415 -14.757 19.029 -17.954 13 H LEU 416 H LEU 416 -16.471 14.066 -16.111 14 HA LEU 416 HA LEU 416 -17.463 14.594 -13.441 15 HB2 LEU 416 HB2 LEU 416 -16.620 11.993 -14.788 16 HB3 LEU 416 HB3 LEU 416 -17.559 12.124 -13.292 17 HG LEU 416 HG LEU 416 -18.448 13.180 -16.015 18 HD11 LEU 416 HD11 LEU 416 -18.378 10.712 -15.908 19 HD12 LEU 416 HD12 LEU 416 -19.333 10.746 -14.408 20 HD13 LEU 416 HD13 LEU 416 -20.055 11.300 -15.933 21 HD21 LEU 416 HD21 LEU 416 -19.426 14.475 -14.162 22 HD22 LEU 416 HD22 LEU 416 -20.654 13.416 -14.873 23 HD23 LEU 416 HD23 LEU 416 -19.887 12.969 -13.330 24 H GLY 417 H GLY 417 -14.339 14.558 -14.707 25 HA2 GLY 417 HA2 GLY 417 -12.359 14.887 -13.535 26 HA3 GLY 417 HA3 GLY 417 -13.176 14.464 -12.024 27 H SER 418 H SER 418 -10.882 13.403 -11.980 28 HA SER 418 HA SER 418 -10.441 10.979 -13.451 29 HB2 SER 418 HB2 SER 418 -8.604 12.243 -12.498 30 HB3 SER 418 HB3 SER 418 -9.273 12.051 -10.861 31 HG SER 418 HG SER 418 -7.589 10.540 -11.411 32 H GLY 419 H GLY 419 -10.257 8.805 -12.481 33 HA2 GLY 419 HA2 GLY 419 -12.697 8.047 -11.128 34 HA3 GLY 419 HA3 GLY 419 -11.343 6.988 -11.580 35 H GLN 420 H GLN 420 -9.763 9.317 -9.951 36 HA GLN 420 HA GLN 420 -9.385 7.817 -7.567 37 HB2 GLN 420 HB2 GLN 420 -7.702 9.365 -8.406 38 HB3 GLN 420 HB3 GLN 420 -8.829 10.723 -8.288 39 HG2 GLN 420 HG2 GLN 420 -7.245 10.774 -6.446 40 HG3 GLN 420 HG3 GLN 420 -8.888 10.503 -5.840 41 HE21 GLN 420 HE21 GLN 420 -6.655 7.019 -5.977 42 HE22 GLN 420 HE22 GLN 420 -6.869 8.001 -7.412 43 H GLN 421 H GLN 421 -10.522 7.714 -5.692 44 HA GLN 421 HA GLN 421 -12.373 9.873 -4.958 45 HB2 GLN 421 HB2 GLN 421 -13.718 8.563 -6.502 46 HB3 GLN 421 HB3 GLN 421 -13.329 7.070 -5.632 47 HG2 GLN 421 HG2 GLN 421 -14.517 7.802 -3.669 48 HG3 GLN 421 HG3 GLN 421 -14.688 9.449 -4.312 49 HE21 GLN 421 HE21 GLN 421 -16.844 6.826 -6.629 50 HE22 GLN 421 HE22 GLN 421 -15.101 6.712 -6.500 51 H ARG 422 H ARG 422 -12.875 9.877 -2.773 52 HA ARG 422 HA ARG 422 -11.935 7.651 -1.065 53 HB2 ARG 422 HB2 ARG 422 -11.043 10.554 -0.798 54 HB3 ARG 422 HB3 ARG 422 -10.775 9.293 0.420 55 HG2 ARG 422 HG2 ARG 422 -9.434 7.993 -1.205 56 HG3 ARG 422 HG3 ARG 422 -9.721 9.241 -2.439 57 HD2 ARG 422 HD2 ARG 422 -8.691 10.918 -0.824 58 HD3 ARG 422 HD3 ARG 422 -8.189 9.541 0.166 59 HE ARG 422 HE ARG 422 -7.406 9.681 -2.712 60 HH11 ARG 422 HH11 ARG 422 -6.478 9.757 0.702 61 HH12 ARG 422 HH12 ARG 422 -4.786 9.486 0.368 62 HH21 ARG 422 HH21 ARG 422 -5.202 9.280 -3.114 63 HH22 ARG 422 HH22 ARG 422 -4.061 9.236 -1.788 64 H ALA 423 H ALA 423 -12.794 7.794 1.123 65 HA ALA 423 HA ALA 423 -15.539 8.520 1.131 66 HB1 ALA 423 HB1 ALA 423 -15.428 7.965 3.538 67 HB2 ALA 423 HB2 ALA 423 -14.598 6.743 2.542 68 HB3 ALA 423 HB3 ALA 423 -13.654 7.946 3.453 69 H GLY 424 H GLY 424 -16.553 10.403 1.529 70 HA2 GLY 424 HA2 GLY 424 -16.864 12.364 2.887 71 HA3 GLY 424 HA3 GLY 424 -15.105 12.539 3.011 72 H ASP 425 H ASP 425 -15.195 11.677 -0.070 73 HA ASP 425 HA ASP 425 -15.023 14.276 -1.179 74 HB2 ASP 425 HB2 ASP 425 -15.502 11.564 -2.437 75 HB3 ASP 425 HB3 ASP 425 -15.246 13.040 -3.369 76 H TRP 426 H TRP 426 -16.376 15.174 -2.966 77 HA TRP 426 HA TRP 426 -19.206 14.416 -2.878 78 HB2 TRP 426 HB2 TRP 426 -19.966 16.604 -2.128 79 HB3 TRP 426 HB3 TRP 426 -18.962 15.822 -0.904 80 HD1 TRP 426 HD1 TRP 426 -16.541 16.872 -0.452 81 HE1 TRP 426 HE1 TRP 426 -15.584 19.210 -0.784 82 HE3 TRP 426 HE3 TRP 426 -20.041 18.714 -3.687 83 HZ2 TRP 426 HZ2 TRP 426 -16.249 21.598 -2.279 84 HZ3 TRP 426 HZ3 TRP 426 -19.847 21.023 -4.550 85 HH2 TRP 426 HH2 TRP 426 -17.978 22.475 -3.842 86 H LYS 427 H LYS 427 -20.265 14.937 -4.726 87 HA LYS 427 HA LYS 427 -18.635 16.090 -6.880 88 HB2 LYS 427 HB2 LYS 427 -19.972 13.985 -7.152 89 HB3 LYS 427 HB3 LYS 427 -21.451 14.946 -6.935 90 HG2 LYS 427 HG2 LYS 427 -20.527 16.397 -8.908 91 HG3 LYS 427 HG3 LYS 427 -19.402 15.051 -9.172 92 HD2 LYS 427 HD2 LYS 427 -21.292 14.654 -10.605 93 HD3 LYS 427 HD3 LYS 427 -21.450 13.519 -9.251 94 HE2 LYS 427 HE2 LYS 427 -23.007 15.096 -8.125 95 HE3 LYS 427 HE3 LYS 427 -22.835 16.230 -9.475 96 HZ1 LYS 427 HZ1 LYS 427 -23.943 13.503 -9.637 97 HZ2 LYS 427 HZ2 LYS 427 -24.811 14.900 -9.681 98 HZ3 LYS 427 HZ3 LYS 427 -23.778 14.534 -10.910 99 H CYS 428 H CYS 428 -19.186 17.956 -8.046 100 HA CYS 428 HA CYS 428 -20.294 20.085 -6.597 101 HB2 CYS 428 HB2 CYS 428 -18.686 20.215 -8.508 102 HB3 CYS 428 HB3 CYS 428 -20.010 19.782 -9.613 103 HA PRO 429 HA PRO 429 -24.624 19.217 -7.161 104 HB2 PRO 429 HB2 PRO 429 -25.661 21.562 -6.188 105 HB3 PRO 429 HB3 PRO 429 -24.944 20.300 -5.140 106 HG2 PRO 429 HG2 PRO 429 -23.663 22.847 -6.178 107 HG3 PRO 429 HG3 PRO 429 -23.595 22.147 -4.521 108 HD2 PRO 429 HD2 PRO 429 -21.592 21.823 -6.377 109 HD3 PRO 429 HD3 PRO 429 -21.987 20.575 -5.151 110 H ASN 430 H ASN 430 -22.834 21.749 -8.746 111 HA ASN 430 HA ASN 430 -25.004 22.925 -10.220 112 HB2 ASN 430 HB2 ASN 430 -22.382 23.541 -9.748 113 HB3 ASN 430 HB3 ASN 430 -22.237 22.839 -11.363 114 HD21 ASN 430 HD21 ASN 430 -22.708 26.482 -11.785 115 HD22 ASN 430 HD22 ASN 430 -21.526 25.414 -11.053 116 HA PRO 431 HA PRO 431 -25.452 19.355 -12.935 117 HB2 PRO 431 HB2 PRO 431 -27.205 20.470 -14.749 118 HB3 PRO 431 HB3 PRO 431 -27.691 19.863 -13.134 119 HG2 PRO 431 HG2 PRO 431 -27.104 22.709 -13.979 120 HG3 PRO 431 HG3 PRO 431 -28.452 22.097 -12.956 121 HD2 PRO 431 HD2 PRO 431 -26.193 23.228 -11.910 122 HD3 PRO 431 HD3 PRO 431 -27.046 21.887 -11.082 123 H THR 432 H THR 432 -24.309 22.546 -13.742 124 HA THR 432 HA THR 432 -23.315 21.681 -16.364 125 HB THR 432 HB THR 432 -22.857 23.900 -16.848 126 HG1 THR 432 HG1 THR 432 -22.622 25.463 -15.236 127 HG21 THR 432 HG21 THR 432 -24.829 25.176 -16.242 128 HG22 THR 432 HG22 THR 432 -25.304 23.490 -16.517 129 HG23 THR 432 HG23 THR 432 -25.152 24.113 -14.853 130 H CYS 433 H CYS 433 -22.273 21.184 -13.285 131 HA CYS 433 HA CYS 433 -19.398 21.507 -14.015 132 HB2 CYS 433 HB2 CYS 433 -20.198 22.950 -12.167 133 HB3 CYS 433 HB3 CYS 433 -20.707 21.492 -11.279 134 H GLU 434 H GLU 434 -21.343 19.622 -11.660 135 HA GLU 434 HA GLU 434 -21.200 17.491 -10.936 136 HB2 GLU 434 HB2 GLU 434 -20.864 17.017 -13.919 137 HB3 GLU 434 HB3 GLU 434 -21.238 15.754 -12.721 138 HG2 GLU 434 HG2 GLU 434 -23.255 17.047 -12.028 139 HG3 GLU 434 HG3 GLU 434 -22.917 18.226 -13.309 140 H ASN 435 H ASN 435 -18.522 19.015 -11.223 141 HA ASN 435 HA ASN 435 -16.553 16.964 -11.705 142 HB2 ASN 435 HB2 ASN 435 -16.077 19.390 -11.912 143 HB3 ASN 435 HB3 ASN 435 -16.394 19.593 -10.180 144 HD21 ASN 435 HD21 ASN 435 -13.032 19.020 -9.420 145 HD22 ASN 435 HD22 ASN 435 -14.528 19.871 -9.093 146 H MET 436 H MET 436 -15.453 15.650 -10.252 147 HA MET 436 HA MET 436 -16.722 15.225 -7.642 148 HB2 MET 436 HB2 MET 436 -15.997 13.300 -9.028 149 HB3 MET 436 HB3 MET 436 -14.339 13.918 -9.008 150 HG2 MET 436 HG2 MET 436 -14.042 12.590 -7.230 151 HG3 MET 436 HG3 MET 436 -14.886 13.840 -6.320 152 HE1 MET 436 HE1 MET 436 -17.098 13.658 -5.252 153 HE2 MET 436 HE2 MET 436 -17.852 13.677 -6.864 154 HE3 MET 436 HE3 MET 436 -18.360 12.470 -5.658 155 H ASN 437 H ASN 437 -16.286 16.884 -6.232 156 HA ASN 437 HA ASN 437 -13.588 18.017 -6.085 157 HB2 ASN 437 HB2 ASN 437 -16.091 18.575 -4.465 158 HB3 ASN 437 HB3 ASN 437 -14.602 19.519 -4.405 159 HD21 ASN 437 HD21 ASN 437 -17.352 20.585 -7.048 160 HD22 ASN 437 HD22 ASN 437 -17.627 19.667 -5.576 161 H PHE 438 H PHE 438 -12.219 17.913 -4.283 162 HA PHE 438 HA PHE 438 -12.285 15.385 -2.929 163 HB2 PHE 438 HB2 PHE 438 -10.437 17.764 -2.743 164 HB3 PHE 438 HB3 PHE 438 -10.222 16.308 -1.779 165 HD1 PHE 438 HD1 PHE 438 -11.199 14.377 -4.131 166 HD2 PHE 438 HD2 PHE 438 -8.309 17.569 -3.877 167 HE1 PHE 438 HE1 PHE 438 -9.871 13.333 -5.930 168 HE2 PHE 438 HE2 PHE 438 -6.958 16.474 -5.624 169 HZ PHE 438 HZ PHE 438 -7.743 14.363 -6.673 170 H SER 439 H SER 439 -11.985 15.046 -0.603 171 HA SER 439 HA SER 439 -14.354 15.892 0.677 172 HB2 SER 439 HB2 SER 439 -13.264 13.762 1.127 173 HB3 SER 439 HB3 SER 439 -11.823 14.583 1.754 174 HG SER 439 HG SER 439 -13.043 15.362 3.453 175 H TRP 440 H TRP 440 -11.098 17.293 0.711 176 HA TRP 440 HA TRP 440 -11.673 18.809 3.151 177 HB2 TRP 440 HB2 TRP 440 -9.383 19.772 2.678 178 HB3 TRP 440 HB3 TRP 440 -9.474 18.043 3.016 179 HD1 TRP 440 HD1 TRP 440 -8.720 16.388 1.131 180 HE1 TRP 440 HE1 TRP 440 -7.507 16.642 -1.078 181 HE3 TRP 440 HE3 TRP 440 -9.253 21.436 0.526 182 HZ2 TRP 440 HZ2 TRP 440 -6.799 18.796 -2.900 183 HZ3 TRP 440 HZ3 TRP 440 -8.322 22.555 -1.457 184 HH2 TRP 440 HH2 TRP 440 -7.057 21.250 -3.170 185 H ARG 441 H ARG 441 -12.393 19.264 -0.155 186 HA ARG 441 HA ARG 441 -12.201 22.181 -0.080 187 HB2 ARG 441 HB2 ARG 441 -13.475 20.233 -2.035 188 HB3 ARG 441 HB3 ARG 441 -13.552 21.996 -2.204 189 HG2 ARG 441 HG2 ARG 441 -11.034 22.063 -2.078 190 HG3 ARG 441 HG3 ARG 441 -11.038 20.287 -2.168 191 HD2 ARG 441 HD2 ARG 441 -12.257 20.409 -4.332 192 HD3 ARG 441 HD3 ARG 441 -12.303 22.168 -4.220 193 HE ARG 441 HE ARG 441 -10.056 20.487 -5.017 194 HH11 ARG 441 HH11 ARG 441 -10.989 23.648 -3.737 195 HH12 ARG 441 HH12 ARG 441 -9.500 24.422 -4.240 196 HH21 ARG 441 HH21 ARG 441 -8.136 21.504 -5.642 197 HH22 ARG 441 HH22 ARG 441 -7.886 23.211 -5.326 198 H ASN 442 H ASN 442 -13.925 23.644 0.035 199 HA ASN 442 HA ASN 442 -16.526 22.520 0.999 200 HB2 ASN 442 HB2 ASN 442 -15.169 25.155 1.685 201 HB3 ASN 442 HB3 ASN 442 -16.806 24.702 2.179 202 HD21 ASN 442 HD21 ASN 442 -14.068 23.846 4.775 203 HD22 ASN 442 HD22 ASN 442 -14.274 25.257 3.757 204 H GLU 443 H GLU 443 -14.922 24.055 -1.541 205 HA GLU 443 HA GLU 443 -17.522 24.856 -2.723 206 HB2 GLU 443 HB2 GLU 443 -14.950 26.441 -3.088 207 HB3 GLU 443 HB3 GLU 443 -16.569 26.839 -3.667 208 HG2 GLU 443 HG2 GLU 443 -16.471 28.198 -1.813 209 HG3 GLU 443 HG3 GLU 443 -17.201 26.752 -1.097 210 H CYS 444 H CYS 444 -17.480 24.851 -5.079 211 HA CYS 444 HA CYS 444 -16.263 22.479 -6.068 212 HB2 CYS 444 HB2 CYS 444 -18.412 23.388 -6.879 213 HB3 CYS 444 HB3 CYS 444 -17.562 24.796 -7.555 214 H ASN 445 H ASN 445 -14.660 22.171 -7.607 215 HA ASN 445 HA ASN 445 -12.468 24.092 -7.406 216 HB2 ASN 445 HB2 ASN 445 -12.519 21.428 -7.315 217 HB3 ASN 445 HB3 ASN 445 -12.433 21.567 -9.072 218 HD21 ASN 445 HD21 ASN 445 -8.940 21.319 -8.252 219 HD22 ASN 445 HD22 ASN 445 -10.358 20.414 -8.737 220 H GLN 446 H GLN 446 -15.140 23.943 -9.425 221 HA GLN 446 HA GLN 446 -13.569 24.906 -11.773 222 HB2 GLN 446 HB2 GLN 446 -15.907 22.958 -11.872 223 HB3 GLN 446 HB3 GLN 446 -14.945 23.563 -13.235 224 HG2 GLN 446 HG2 GLN 446 -12.915 22.586 -11.880 225 HG3 GLN 446 HG3 GLN 446 -14.135 21.668 -11.000 226 HE21 GLN 446 HE21 GLN 446 -12.971 19.472 -13.741 227 HE22 GLN 446 HE22 GLN 446 -12.340 20.171 -12.265 228 H CYS 447 H CYS 447 -16.596 24.915 -9.939 229 HA CYS 447 HA CYS 447 -17.352 27.406 -11.395 230 HB2 CYS 447 HB2 CYS 447 -19.719 26.706 -11.237 231 HB3 CYS 447 HB3 CYS 447 -18.745 25.590 -12.208 232 H LYS 448 H LYS 448 -16.316 26.224 -8.524 233 HA LYS 448 HA LYS 448 -16.255 27.020 -6.417 234 HB2 LYS 448 HB2 LYS 448 -17.209 29.596 -7.711 235 HB3 LYS 448 HB3 LYS 448 -16.481 29.438 -6.101 236 HG2 LYS 448 HG2 LYS 448 -14.428 28.483 -7.121 237 HG3 LYS 448 HG3 LYS 448 -15.142 28.701 -8.741 238 HD2 LYS 448 HD2 LYS 448 -15.311 31.132 -8.353 239 HD3 LYS 448 HD3 LYS 448 -14.637 30.926 -6.722 240 HE2 LYS 448 HE2 LYS 448 -12.885 31.661 -8.263 241 HE3 LYS 448 HE3 LYS 448 -12.549 30.016 -7.695 242 HZ1 LYS 448 HZ1 LYS 448 -12.211 30.212 -10.045 243 HZ2 LYS 448 HZ2 LYS 448 -13.464 29.191 -9.755 244 HZ3 LYS 448 HZ3 LYS 448 -13.755 30.725 -10.286 245 H ALA 449 H ALA 449 -18.973 25.984 -7.563 246 HA ALA 449 HA ALA 449 -20.977 27.221 -5.936 247 HB1 ALA 449 HB1 ALA 449 -20.798 24.383 -7.036 248 HB2 ALA 449 HB2 ALA 449 -22.266 25.173 -6.412 249 HB3 ALA 449 HB3 ALA 449 -21.482 25.790 -7.886 250 HA PRO 450 HA PRO 450 -19.690 25.706 -2.009 251 HB2 PRO 450 HB2 PRO 450 -22.024 25.848 -0.577 252 HB3 PRO 450 HB3 PRO 450 -21.090 27.294 -1.078 253 HG2 PRO 450 HG2 PRO 450 -23.536 26.090 -2.397 254 HG3 PRO 450 HG3 PRO 450 -23.172 27.815 -2.076 255 HD2 PRO 450 HD2 PRO 450 -22.752 26.638 -4.527 256 HD3 PRO 450 HD3 PRO 450 -21.713 27.950 -3.903 257 H LYS 451 H LYS 451 -19.643 23.830 -0.767 258 HA LYS 451 HA LYS 451 -20.754 21.432 -1.896 259 HB2 LYS 451 HB2 LYS 451 -18.645 21.373 -0.725 260 HB3 LYS 451 HB3 LYS 451 -19.362 22.023 0.737 261 HG2 LYS 451 HG2 LYS 451 -20.953 19.831 0.448 262 HG3 LYS 451 HG3 LYS 451 -19.512 19.258 -0.399 263 HD2 LYS 451 HD2 LYS 451 -19.700 20.251 2.473 264 HD3 LYS 451 HD3 LYS 451 -19.303 18.610 1.917 265 HE2 LYS 451 HE2 LYS 451 -17.246 19.514 0.829 266 HE3 LYS 451 HE3 LYS 451 -17.650 21.128 1.452 267 HZ1 LYS 451 HZ1 LYS 451 -16.075 20.016 2.848 268 HZ2 LYS 451 HZ2 LYS 451 -17.485 20.250 3.666 269 HZ3 LYS 451 HZ3 LYS 451 -17.100 18.753 3.093 270 HA PRO 452 HA PRO 452 -23.956 21.642 1.693 271 HB2 PRO 452 HB2 PRO 452 -24.153 23.953 3.167 272 HB3 PRO 452 HB3 PRO 452 -23.107 22.574 3.633 273 HG2 PRO 452 HG2 PRO 452 -22.336 25.118 2.180 274 HG3 PRO 452 HG3 PRO 452 -21.487 24.312 3.544 275 HD2 PRO 452 HD2 PRO 452 -20.692 23.982 0.965 276 HD3 PRO 452 HD3 PRO 452 -20.618 22.643 2.152 277 H ASP 453 H ASP 453 -26.097 22.743 1.783 278 HA ASP 453 HA ASP 453 -26.705 23.992 -0.771 279 HB2 ASP 453 HB2 ASP 453 -28.153 22.326 0.444 280 HB3 ASP 453 HB3 ASP 453 -28.447 23.549 1.691 281 H GLY 454 H GLY 454 -25.642 25.136 2.290 282 HA2 GLY 454 HA2 GLY 454 -27.060 27.662 2.343 283 HA3 GLY 454 HA3 GLY 454 -25.652 27.207 3.324 284 H5' U 1 H5' U 1 0.191 18.467 0.227 285 H5'' U 1 H5'' U 1 0.122 16.897 -0.593 286 H4' U 1 H4' U 1 -1.657 17.006 1.054 287 H3' U 1 H3' U 1 -2.118 16.289 -1.574 288 H2' U 1 H2' U 1 -2.886 18.428 -2.277 289 HO2' U 1 HO2' U 1 -4.601 17.163 -2.813 290 H1' U 1 H1' U 1 -4.443 18.688 0.301 291 H3 U 1 H3 U 1 -3.535 23.445 0.314 292 H5 U 1 H5 U 1 -4.519 22.117 -3.547 293 H6 U 1 H6 U 1 -4.288 19.851 -2.778 294 H5' G 2 H5' G 2 -1.954 12.429 -1.584 295 H5'' G 2 H5'' G 2 -1.816 14.138 -2.038 296 H4' G 2 H4' G 2 -2.477 12.537 -3.921 297 H3' G 2 H3' G 2 -4.009 15.007 -3.157 298 H2' G 2 H2' G 2 -5.602 14.579 -4.890 299 HO2' G 2 HO2' G 2 -3.958 13.860 -6.439 300 H1' G 2 H1' G 2 -5.914 11.940 -4.394 301 H8 G 2 H8 G 2 -5.262 14.781 -1.755 302 H1 G 2 H1 G 2 -11.244 12.494 -2.051 303 H21 G 2 H21 G 2 -11.429 11.121 -3.752 304 H22 G 2 H22 G 2 -10.053 10.625 -4.715 305 H5' G 3 H5' G 3 -5.131 17.134 -6.687 306 H5'' G 3 H5'' G 3 -5.177 15.365 -6.889 307 H4' G 3 H4' G 3 -4.392 15.578 -9.211 308 H3' G 3 H3' G 3 -3.096 17.845 -8.490 309 H2' G 3 H2' G 3 -4.922 19.120 -7.796 310 HO2' G 3 HO2' G 3 -3.979 20.293 -9.552 311 H1' G 3 H1' G 3 -6.731 18.371 -10.044 312 H8 G 3 H8 G 3 -6.429 20.191 -7.046 313 H1 G 3 H1 G 3 -11.888 16.835 -6.835 314 H21 G 3 H21 G 3 -11.816 15.163 -8.276 315 H22 G 3 H22 G 3 -10.450 14.908 -9.340 316 H5' U 4 H5' U 4 -4.079 16.114 -13.753 317 H5'' U 4 H5'' U 4 -4.997 17.133 -12.622 318 H4' U 4 H4' U 4 -5.657 14.219 -13.241 319 H3' U 4 H3' U 4 -6.620 16.870 -14.329 320 H2' U 4 H2' U 4 -8.827 16.101 -14.375 321 HO2' U 4 HO2' U 4 -8.313 14.087 -15.431 322 H1' U 4 H1' U 4 -8.651 14.424 -12.126 323 H3 U 4 H3 U 4 -11.874 17.301 -10.841 324 H5 U 4 H5 U 4 -8.582 19.820 -11.545 325 H6 U 4 H6 U 4 -7.332 17.875 -12.293 326 H5' G 5 H5' G 5 -6.143 13.327 -18.376 327 H5'' G 5 H5'' G 5 -4.776 13.592 -17.267 328 H4' G 5 H4' G 5 -4.784 14.345 -20.230 329 H3' G 5 H3' G 5 -4.121 11.819 -18.780 330 H2' G 5 H2' G 5 -1.969 11.573 -19.742 331 HO2' G 5 HO2' G 5 -1.321 12.899 -21.499 332 H1' G 5 H1' G 5 -1.145 14.131 -19.504 333 H8 G 5 H8 G 5 -1.406 11.076 -17.906 334 H1 G 5 H1 G 5 -1.552 15.544 -13.307 335 H21 G 5 H21 G 5 -1.971 17.520 -14.180 336 H22 G 5 H22 G 5 -2.204 17.753 -15.902 Start of MODEL 12 1 H1 GLY 414 H1 NGL 414 -11.490 5.046 -16.320 2 H2 GLY 414 H2 NGL 414 -10.374 3.832 -16.353 3 H3 GLY 414 H3 NGL 414 -11.463 3.990 -17.579 4 HA2 GLY 414 HA2 NGL 414 -9.323 4.763 -18.285 5 HA3 GLY 414 HA3 NGL 414 -10.520 6.068 -18.254 6 HA PRO 415 HA PRO 415 -6.768 6.906 -15.419 7 HB2 PRO 415 HB2 PRO 415 -5.195 8.457 -17.043 8 HB3 PRO 415 HB3 PRO 415 -5.083 6.666 -16.994 9 HG2 PRO 415 HG2 PRO 415 -6.552 8.402 -18.991 10 HG3 PRO 415 HG3 PRO 415 -5.504 6.981 -19.308 11 HD2 PRO 415 HD2 PRO 415 -8.248 6.827 -19.218 12 HD3 PRO 415 HD3 PRO 415 -7.194 5.476 -18.694 13 H LEU 416 H LEU 416 -9.009 8.634 -17.412 14 HA LEU 416 HA LEU 416 -8.421 11.313 -16.624 15 HB2 LEU 416 HB2 LEU 416 -9.756 10.738 -18.601 16 HB3 LEU 416 HB3 LEU 416 -10.989 9.992 -17.570 17 HG LEU 416 HG LEU 416 -11.434 12.208 -16.510 18 HD11 LEU 416 HD11 LEU 416 -10.511 14.238 -17.589 19 HD12 LEU 416 HD12 LEU 416 -9.206 13.249 -16.905 20 HD13 LEU 416 HD13 LEU 416 -9.518 13.228 -18.657 21 HD21 LEU 416 HD21 LEU 416 -12.767 11.427 -18.432 22 HD22 LEU 416 HD22 LEU 416 -12.562 13.193 -18.466 23 HD23 LEU 416 HD23 LEU 416 -11.595 12.171 -19.547 24 H GLY 417 H GLY 417 -9.494 12.672 -15.093 25 HA2 GLY 417 HA2 GLY 417 -10.734 13.153 -13.179 26 HA3 GLY 417 HA3 GLY 417 -11.262 11.469 -13.086 27 H SER 418 H SER 418 -10.738 12.126 -10.702 28 HA SER 418 HA SER 418 -7.986 12.267 -9.916 29 HB2 SER 418 HB2 SER 418 -8.897 11.878 -7.645 30 HB3 SER 418 HB3 SER 418 -9.782 13.147 -8.522 31 HG SER 418 HG SER 418 -10.558 10.452 -8.110 32 H GLY 419 H GLY 419 -6.659 10.687 -8.963 33 HA2 GLY 419 HA2 GLY 419 -7.122 7.989 -10.032 34 HA3 GLY 419 HA3 GLY 419 -5.621 8.624 -9.338 35 H GLN 420 H GLN 420 -8.159 9.456 -7.257 36 HA GLN 420 HA GLN 420 -7.997 6.937 -5.706 37 HB2 GLN 420 HB2 GLN 420 -7.223 9.678 -4.637 38 HB3 GLN 420 HB3 GLN 420 -7.395 8.201 -3.674 39 HG2 GLN 420 HG2 GLN 420 -5.596 7.136 -5.077 40 HG3 GLN 420 HG3 GLN 420 -5.364 8.693 -5.888 41 HE21 GLN 420 HE21 GLN 420 -2.777 8.733 -3.326 42 HE22 GLN 420 HE22 GLN 420 -3.116 8.022 -4.893 43 H GLN 421 H GLN 421 -9.461 7.016 -3.792 44 HA GLN 421 HA GLN 421 -11.658 8.991 -3.971 45 HB2 GLN 421 HB2 GLN 421 -12.373 7.039 -5.275 46 HB3 GLN 421 HB3 GLN 421 -12.018 5.964 -3.913 47 HG2 GLN 421 HG2 GLN 421 -13.913 8.319 -3.594 48 HG3 GLN 421 HG3 GLN 421 -14.483 6.820 -4.325 49 HE21 GLN 421 HE21 GLN 421 -15.186 6.754 -0.630 50 HE22 GLN 421 HE22 GLN 421 -15.554 7.873 -1.923 51 H ARG 422 H ARG 422 -12.503 9.529 -1.940 52 HA ARG 422 HA ARG 422 -11.466 8.044 0.405 53 HB2 ARG 422 HB2 ARG 422 -11.070 11.038 0.002 54 HB3 ARG 422 HB3 ARG 422 -10.642 10.107 1.447 55 HG2 ARG 422 HG2 ARG 422 -9.055 8.752 0.052 56 HG3 ARG 422 HG3 ARG 422 -9.427 9.810 -1.334 57 HD2 ARG 422 HD2 ARG 422 -8.752 11.779 0.106 58 HD3 ARG 422 HD3 ARG 422 -8.187 10.619 1.319 59 HE ARG 422 HE ARG 422 -7.038 10.127 -1.309 60 HH11 ARG 422 HH11 ARG 422 -6.807 12.191 1.554 61 HH12 ARG 422 HH12 ARG 422 -5.100 12.497 1.329 62 HH21 ARG 422 HH21 ARG 422 -4.797 10.428 -1.483 63 HH22 ARG 422 HH22 ARG 422 -3.961 11.492 -0.367 64 H ALA 423 H ALA 423 -12.624 8.420 2.350 65 HA ALA 423 HA ALA 423 -15.407 8.876 1.997 66 HB1 ALA 423 HB1 ALA 423 -13.706 8.937 4.522 67 HB2 ALA 423 HB2 ALA 423 -15.479 8.787 4.466 68 HB3 ALA 423 HB3 ALA 423 -14.461 7.492 3.804 69 H GLY 424 H GLY 424 -16.586 10.704 1.953 70 HA2 GLY 424 HA2 GLY 424 -17.155 12.860 2.829 71 HA3 GLY 424 HA3 GLY 424 -15.435 13.198 3.098 72 H ASP 425 H ASP 425 -15.234 11.718 0.210 73 HA ASP 425 HA ASP 425 -14.997 14.008 -1.410 74 HB2 ASP 425 HB2 ASP 425 -15.592 11.115 -2.067 75 HB3 ASP 425 HB3 ASP 425 -15.327 12.338 -3.312 76 H TRP 426 H TRP 426 -16.342 14.933 -3.065 77 HA TRP 426 HA TRP 426 -19.182 14.193 -3.017 78 HB2 TRP 426 HB2 TRP 426 -19.932 16.371 -2.264 79 HB3 TRP 426 HB3 TRP 426 -18.944 15.579 -1.035 80 HD1 TRP 426 HD1 TRP 426 -16.493 16.604 -0.595 81 HE1 TRP 426 HE1 TRP 426 -15.530 18.947 -0.906 82 HE3 TRP 426 HE3 TRP 426 -20.033 18.519 -3.740 83 HZ2 TRP 426 HZ2 TRP 426 -16.197 21.358 -2.362 84 HZ3 TRP 426 HZ3 TRP 426 -19.839 20.838 -4.574 85 HH2 TRP 426 HH2 TRP 426 -17.947 22.267 -3.886 86 H LYS 427 H LYS 427 -20.341 14.954 -4.785 87 HA LYS 427 HA LYS 427 -18.652 15.988 -6.984 88 HB2 LYS 427 HB2 LYS 427 -20.200 13.916 -7.115 89 HB3 LYS 427 HB3 LYS 427 -21.535 15.086 -7.150 90 HG2 LYS 427 HG2 LYS 427 -20.246 16.223 -9.092 91 HG3 LYS 427 HG3 LYS 427 -19.245 14.755 -9.120 92 HD2 LYS 427 HD2 LYS 427 -20.996 14.470 -10.759 93 HD3 LYS 427 HD3 LYS 427 -21.392 13.418 -9.381 94 HE2 LYS 427 HE2 LYS 427 -22.922 15.186 -8.502 95 HE3 LYS 427 HE3 LYS 427 -22.524 16.208 -9.886 96 HZ1 LYS 427 HZ1 LYS 427 -23.444 14.513 -11.323 97 HZ2 LYS 427 HZ2 LYS 427 -23.804 13.557 -10.034 98 HZ3 LYS 427 HZ3 LYS 427 -24.569 14.999 -10.224 99 H CYS 428 H CYS 428 -19.233 17.833 -8.210 100 HA CYS 428 HA CYS 428 -20.260 20.016 -6.736 101 HB2 CYS 428 HB2 CYS 428 -18.669 20.130 -8.656 102 HB3 CYS 428 HB3 CYS 428 -20.003 19.685 -9.748 103 HA PRO 429 HA PRO 429 -24.597 19.168 -7.279 104 HB2 PRO 429 HB2 PRO 429 -25.617 21.454 -6.165 105 HB3 PRO 429 HB3 PRO 429 -24.841 20.166 -5.189 106 HG2 PRO 429 HG2 PRO 429 -23.627 22.757 -6.185 107 HG3 PRO 429 HG3 PRO 429 -23.509 22.013 -4.551 108 HD2 PRO 429 HD2 PRO 429 -21.551 21.752 -6.465 109 HD3 PRO 429 HD3 PRO 429 -21.910 20.469 -5.264 110 H ASN 430 H ASN 430 -22.827 21.736 -8.790 111 HA ASN 430 HA ASN 430 -25.016 23.037 -10.134 112 HB2 ASN 430 HB2 ASN 430 -22.386 23.599 -9.726 113 HB3 ASN 430 HB3 ASN 430 -22.291 22.938 -11.365 114 HD21 ASN 430 HD21 ASN 430 -22.725 26.580 -11.711 115 HD22 ASN 430 HD22 ASN 430 -21.531 25.495 -11.015 116 HA PRO 431 HA PRO 431 -25.563 19.636 -13.074 117 HB2 PRO 431 HB2 PRO 431 -27.410 20.876 -14.721 118 HB3 PRO 431 HB3 PRO 431 -27.824 20.143 -13.140 119 HG2 PRO 431 HG2 PRO 431 -27.275 23.047 -13.791 120 HG3 PRO 431 HG3 PRO 431 -28.585 22.358 -12.771 121 HD2 PRO 431 HD2 PRO 431 -26.295 23.410 -11.715 122 HD3 PRO 431 HD3 PRO 431 -27.119 22.011 -10.967 123 H THR 432 H THR 432 -24.488 22.901 -13.646 124 HA THR 432 HA THR 432 -23.551 22.250 -16.354 125 HB THR 432 HB THR 432 -23.220 24.496 -16.737 126 HG1 THR 432 HG1 THR 432 -21.913 24.998 -15.031 127 HG21 THR 432 HG21 THR 432 -25.391 24.547 -14.599 128 HG22 THR 432 HG22 THR 432 -25.197 25.670 -15.965 129 HG23 THR 432 HG23 THR 432 -25.634 23.970 -16.263 130 H CYS 433 H CYS 433 -22.436 21.344 -13.503 131 HA CYS 433 HA CYS 433 -19.578 21.801 -14.236 132 HB2 CYS 433 HB2 CYS 433 -20.318 23.165 -12.280 133 HB3 CYS 433 HB3 CYS 433 -20.793 21.668 -11.450 134 H GLU 434 H GLU 434 -21.452 19.859 -11.876 135 HA GLU 434 HA GLU 434 -21.308 17.702 -11.224 136 HB2 GLU 434 HB2 GLU 434 -20.997 17.278 -14.214 137 HB3 GLU 434 HB3 GLU 434 -21.348 15.995 -13.039 138 HG2 GLU 434 HG2 GLU 434 -23.376 17.253 -12.308 139 HG3 GLU 434 HG3 GLU 434 -23.051 18.470 -13.552 140 H ASN 435 H ASN 435 -18.631 19.291 -11.686 141 HA ASN 435 HA ASN 435 -16.638 17.277 -12.151 142 HB2 ASN 435 HB2 ASN 435 -16.228 19.719 -12.332 143 HB3 ASN 435 HB3 ASN 435 -16.500 19.885 -10.588 144 HD21 ASN 435 HD21 ASN 435 -13.124 19.322 -9.884 145 HD22 ASN 435 HD22 ASN 435 -14.633 20.122 -9.500 146 H MET 436 H MET 436 -15.435 16.019 -10.666 147 HA MET 436 HA MET 436 -16.787 15.545 -8.107 148 HB2 MET 436 HB2 MET 436 -15.819 13.749 -9.708 149 HB3 MET 436 HB3 MET 436 -14.225 14.242 -9.084 150 HG2 MET 436 HG2 MET 436 -14.994 12.407 -7.711 151 HG3 MET 436 HG3 MET 436 -15.138 13.879 -6.747 152 HE1 MET 436 HE1 MET 436 -18.243 12.470 -5.207 153 HE2 MET 436 HE2 MET 436 -16.600 11.793 -5.374 154 HE3 MET 436 HE3 MET 436 -16.824 13.532 -5.057 155 H ASN 437 H ASN 437 -16.065 16.251 -6.127 156 HA ASN 437 HA ASN 437 -13.543 17.842 -6.144 157 HB2 ASN 437 HB2 ASN 437 -16.103 18.366 -4.596 158 HB3 ASN 437 HB3 ASN 437 -14.631 19.336 -4.513 159 HD21 ASN 437 HD21 ASN 437 -17.372 20.170 -7.307 160 HD22 ASN 437 HD22 ASN 437 -17.648 19.173 -5.887 161 H PHE 438 H PHE 438 -12.201 17.753 -4.361 162 HA PHE 438 HA PHE 438 -12.254 15.239 -2.973 163 HB2 PHE 438 HB2 PHE 438 -10.406 17.628 -2.820 164 HB3 PHE 438 HB3 PHE 438 -10.187 16.170 -1.856 165 HD1 PHE 438 HD1 PHE 438 -11.115 14.173 -4.095 166 HD2 PHE 438 HD2 PHE 438 -8.353 17.481 -4.055 167 HE1 PHE 438 HE1 PHE 438 -9.832 13.131 -5.923 168 HE2 PHE 438 HE2 PHE 438 -7.047 16.399 -5.857 169 HZ PHE 438 HZ PHE 438 -7.798 14.237 -6.810 170 H SER 439 H SER 439 -11.928 14.948 -0.646 171 HA SER 439 HA SER 439 -14.305 15.789 0.635 172 HB2 SER 439 HB2 SER 439 -13.202 13.668 1.118 173 HB3 SER 439 HB3 SER 439 -11.758 14.513 1.710 174 HG SER 439 HG SER 439 -13.171 13.849 3.396 175 H TRP 440 H TRP 440 -11.018 17.148 0.712 176 HA TRP 440 HA TRP 440 -11.600 18.710 3.102 177 HB2 TRP 440 HB2 TRP 440 -9.330 19.690 2.608 178 HB3 TRP 440 HB3 TRP 440 -9.397 17.958 2.945 179 HD1 TRP 440 HD1 TRP 440 -8.632 16.312 1.065 180 HE1 TRP 440 HE1 TRP 440 -7.433 16.583 -1.160 181 HE3 TRP 440 HE3 TRP 440 -9.229 21.353 0.450 182 HZ2 TRP 440 HZ2 TRP 440 -6.780 18.733 -2.995 183 HZ3 TRP 440 HZ3 TRP 440 -8.336 22.473 -1.551 184 HH2 TRP 440 HH2 TRP 440 -7.086 21.180 -3.273 185 H ARG 441 H ARG 441 -12.332 19.126 -0.213 186 HA ARG 441 HA ARG 441 -12.166 22.046 -0.165 187 HB2 ARG 441 HB2 ARG 441 -13.450 20.079 -2.096 188 HB3 ARG 441 HB3 ARG 441 -13.505 21.844 -2.289 189 HG2 ARG 441 HG2 ARG 441 -10.999 21.884 -2.196 190 HG3 ARG 441 HG3 ARG 441 -11.010 20.103 -2.231 191 HD2 ARG 441 HD2 ARG 441 -12.247 20.163 -4.383 192 HD3 ARG 441 HD3 ARG 441 -12.278 21.924 -4.332 193 HE ARG 441 HE ARG 441 -10.061 20.199 -5.103 194 HH11 ARG 441 HH11 ARG 441 -10.941 23.402 -3.900 195 HH12 ARG 441 HH12 ARG 441 -9.457 24.146 -4.449 196 HH21 ARG 441 HH21 ARG 441 -8.130 21.170 -5.768 197 HH22 ARG 441 HH22 ARG 441 -7.855 22.880 -5.512 198 H ASN 442 H ASN 442 -13.860 23.506 -0.002 199 HA ASN 442 HA ASN 442 -16.448 22.408 1.009 200 HB2 ASN 442 HB2 ASN 442 -15.046 25.048 1.581 201 HB3 ASN 442 HB3 ASN 442 -16.697 24.656 2.095 202 HD21 ASN 442 HD21 ASN 442 -14.066 23.879 4.768 203 HD22 ASN 442 HD22 ASN 442 -14.317 25.272 3.732 204 H GLU 443 H GLU 443 -14.930 23.755 -1.654 205 HA GLU 443 HA GLU 443 -17.540 24.565 -2.789 206 HB2 GLU 443 HB2 GLU 443 -14.976 26.193 -3.008 207 HB3 GLU 443 HB3 GLU 443 -16.487 26.522 -3.875 208 HG2 GLU 443 HG2 GLU 443 -17.651 26.804 -1.683 209 HG3 GLU 443 HG3 GLU 443 -16.096 26.587 -0.855 210 H CYS 444 H CYS 444 -17.508 24.604 -5.147 211 HA CYS 444 HA CYS 444 -16.261 22.278 -6.210 212 HB2 CYS 444 HB2 CYS 444 -18.403 23.210 -7.009 213 HB3 CYS 444 HB3 CYS 444 -17.547 24.640 -7.628 214 H ASN 445 H ASN 445 -14.635 22.053 -7.780 215 HA ASN 445 HA ASN 445 -12.466 23.994 -7.424 216 HB2 ASN 445 HB2 ASN 445 -12.428 21.355 -7.315 217 HB3 ASN 445 HB3 ASN 445 -12.349 21.461 -9.079 218 HD21 ASN 445 HD21 ASN 445 -8.855 21.281 -8.186 219 HD22 ASN 445 HD22 ASN 445 -10.260 20.315 -8.588 220 H GLN 446 H GLN 446 -15.072 23.997 -9.392 221 HA GLN 446 HA GLN 446 -13.541 24.947 -11.773 222 HB2 GLN 446 HB2 GLN 446 -15.909 23.038 -11.775 223 HB3 GLN 446 HB3 GLN 446 -15.106 23.688 -13.210 224 HG2 GLN 446 HG2 GLN 446 -13.718 21.985 -11.086 225 HG3 GLN 446 HG3 GLN 446 -14.407 21.342 -12.573 226 HE21 GLN 446 HE21 GLN 446 -10.738 21.961 -13.077 227 HE22 GLN 446 HE22 GLN 446 -11.684 21.031 -11.933 228 H CYS 447 H CYS 447 -16.543 24.951 -9.870 229 HA CYS 447 HA CYS 447 -17.286 27.502 -11.218 230 HB2 CYS 447 HB2 CYS 447 -19.652 26.808 -11.093 231 HB3 CYS 447 HB3 CYS 447 -18.686 25.723 -12.118 232 H LYS 448 H LYS 448 -16.268 26.168 -8.387 233 HA LYS 448 HA LYS 448 -16.287 26.815 -6.228 234 HB2 LYS 448 HB2 LYS 448 -17.053 29.451 -7.511 235 HB3 LYS 448 HB3 LYS 448 -16.644 29.263 -5.793 236 HG2 LYS 448 HG2 LYS 448 -14.436 28.358 -6.376 237 HG3 LYS 448 HG3 LYS 448 -14.831 28.446 -8.103 238 HD2 LYS 448 HD2 LYS 448 -13.424 30.353 -7.371 239 HD3 LYS 448 HD3 LYS 448 -14.999 30.888 -7.983 240 HE2 LYS 448 HE2 LYS 448 -14.362 32.105 -5.934 241 HE3 LYS 448 HE3 LYS 448 -15.838 31.154 -5.684 242 HZ1 LYS 448 HZ1 LYS 448 -14.562 29.510 -4.562 243 HZ2 LYS 448 HZ2 LYS 448 -13.144 30.292 -4.881 244 HZ3 LYS 448 HZ3 LYS 448 -14.258 30.961 -3.872 245 H ALA 449 H ALA 449 -18.965 25.867 -7.510 246 HA ALA 449 HA ALA 449 -21.022 27.006 -5.884 247 HB1 ALA 449 HB1 ALA 449 -21.469 25.626 -7.874 248 HB2 ALA 449 HB2 ALA 449 -20.754 24.210 -7.063 249 HB3 ALA 449 HB3 ALA 449 -22.256 24.935 -6.436 250 HA PRO 450 HA PRO 450 -19.702 25.470 -1.986 251 HB2 PRO 450 HB2 PRO 450 -22.036 25.577 -0.540 252 HB3 PRO 450 HB3 PRO 450 -21.103 27.028 -1.027 253 HG2 PRO 450 HG2 PRO 450 -23.549 25.833 -2.353 254 HG3 PRO 450 HG3 PRO 450 -23.196 27.557 -2.003 255 HD2 PRO 450 HD2 PRO 450 -22.785 26.423 -4.471 256 HD3 PRO 450 HD3 PRO 450 -21.728 27.720 -3.834 257 H LYS 451 H LYS 451 -19.589 23.573 -0.798 258 HA LYS 451 HA LYS 451 -20.714 21.180 -1.912 259 HB2 LYS 451 HB2 LYS 451 -18.587 21.121 -0.768 260 HB3 LYS 451 HB3 LYS 451 -19.287 21.762 0.710 261 HG2 LYS 451 HG2 LYS 451 -20.862 19.564 0.450 262 HG3 LYS 451 HG3 LYS 451 -19.443 18.998 -0.443 263 HD2 LYS 451 HD2 LYS 451 -19.546 20.002 2.430 264 HD3 LYS 451 HD3 LYS 451 -19.182 18.352 1.873 265 HE2 LYS 451 HE2 LYS 451 -17.150 19.206 0.724 266 HE3 LYS 451 HE3 LYS 451 -17.513 20.837 1.310 267 HZ1 LYS 451 HZ1 LYS 451 -16.948 18.499 3.002 268 HZ2 LYS 451 HZ2 LYS 451 -15.913 19.732 2.686 269 HZ3 LYS 451 HZ3 LYS 451 -17.284 20.024 3.544 270 HA PRO 452 HA PRO 452 -23.894 21.400 1.722 271 HB2 PRO 452 HB2 PRO 452 -24.074 23.752 3.137 272 HB3 PRO 452 HB3 PRO 452 -23.042 22.367 3.639 273 HG2 PRO 452 HG2 PRO 452 -22.232 24.874 2.140 274 HG3 PRO 452 HG3 PRO 452 -21.404 24.085 3.518 275 HD2 PRO 452 HD2 PRO 452 -20.601 23.693 0.956 276 HD3 PRO 452 HD3 PRO 452 -20.556 22.370 2.161 277 H ASP 453 H ASP 453 -25.999 22.655 1.908 278 HA ASP 453 HA ASP 453 -26.710 23.663 -0.694 279 HB2 ASP 453 HB2 ASP 453 -28.250 23.415 1.906 280 HB3 ASP 453 HB3 ASP 453 -28.971 23.967 0.386 281 H GLY 454 H GLY 454 -25.157 25.236 1.806 282 HA2 GLY 454 HA2 GLY 454 -25.411 27.803 0.627 283 HA3 GLY 454 HA3 GLY 454 -26.508 27.709 2.024 284 H5' U 1 H5' U 1 -0.053 17.344 -1.306 285 H5'' U 1 H5'' U 1 -0.910 18.898 -1.430 286 H4' U 1 H4' U 1 -1.394 16.880 0.811 287 H3' U 1 H3' U 1 -2.059 16.269 -1.739 288 H2' U 1 H2' U 1 -2.944 18.402 -2.300 289 HO2' U 1 HO2' U 1 -4.552 16.960 -2.861 290 H1' U 1 H1' U 1 -4.570 18.477 0.237 291 H3 U 1 H3 U 1 -3.502 23.213 0.594 292 H5 U 1 H5 U 1 -4.492 22.151 -3.346 293 H6 U 1 H6 U 1 -4.330 19.832 -2.713 294 H5' G 2 H5' G 2 -1.697 12.609 -2.071 295 H5'' G 2 H5'' G 2 -1.904 14.313 -2.536 296 H4' G 2 H4' G 2 -2.535 12.435 -4.253 297 H3' G 2 H3' G 2 -4.092 14.913 -3.587 298 H2' G 2 H2' G 2 -5.845 14.266 -5.077 299 HO2' G 2 HO2' G 2 -5.563 12.444 -6.467 300 H1' G 2 H1' G 2 -5.990 11.678 -4.302 301 H8 G 2 H8 G 2 -5.147 14.687 -1.929 302 H1 G 2 H1 G 2 -11.178 12.521 -1.768 303 H21 G 2 H21 G 2 -11.478 11.049 -3.402 304 H22 G 2 H22 G 2 -10.173 10.540 -4.449 305 H5' G 3 H5' G 3 -4.639 14.277 -8.016 306 H5'' G 3 H5'' G 3 -3.100 15.103 -8.322 307 H4' G 3 H4' G 3 -4.719 15.343 -10.201 308 H3' G 3 H3' G 3 -3.058 17.304 -9.154 309 H2' G 3 H2' G 3 -4.745 18.278 -7.773 310 HO2' G 3 HO2' G 3 -4.880 19.552 -10.319 311 H1' G 3 H1' G 3 -6.662 17.955 -10.102 312 H8 G 3 H8 G 3 -6.324 19.671 -6.998 313 H1 G 3 H1 G 3 -12.087 16.877 -7.289 314 H21 G 3 H21 G 3 -12.104 15.329 -8.864 315 H22 G 3 H22 G 3 -10.692 14.971 -9.838 316 H5' U 4 H5' U 4 -4.778 14.299 -11.776 317 H5'' U 4 H5'' U 4 -4.198 14.182 -13.449 318 H4' U 4 H4' U 4 -6.538 13.402 -13.274 319 H3' U 4 H3' U 4 -5.787 15.720 -14.935 320 H2' U 4 H2' U 4 -7.617 16.967 -14.417 321 HO2' U 4 HO2' U 4 -8.476 15.873 -16.271 322 H1' U 4 H1' U 4 -9.048 14.631 -13.156 323 H3 U 4 H3 U 4 -12.075 17.486 -11.435 324 H5 U 4 H5 U 4 -8.478 19.636 -11.097 325 H6 U 4 H6 U 4 -7.334 17.782 -12.150 326 H5' G 5 H5' G 5 -5.913 15.535 -17.819 327 H5'' G 5 H5'' G 5 -5.191 14.242 -18.796 328 H4' G 5 H4' G 5 -3.574 16.534 -17.584 329 H3' G 5 H3' G 5 -5.384 17.039 -19.510 330 H2' G 5 H2' G 5 -4.969 15.265 -20.985 331 HO2' G 5 HO2' G 5 -4.448 17.109 -22.229 332 H1' G 5 H1' G 5 -2.017 15.217 -20.802 333 H8 G 5 H8 G 5 -4.236 13.621 -22.514 334 H1 G 5 H1 G 5 -2.506 9.211 -18.189 335 H21 G 5 H21 G 5 -1.460 10.185 -16.488 336 H22 G 5 H22 G 5 -1.224 11.918 -16.414 Start of MODEL 13 1 H1 GLY 414 H1 NGL 414 -13.989 -5.905 -5.743 2 H2 GLY 414 H2 NGL 414 -13.701 -4.376 -5.209 3 H3 GLY 414 H3 NGL 414 -12.630 -5.584 -4.866 4 HA2 GLY 414 HA2 NGL 414 -12.074 -5.832 -7.170 5 HA3 GLY 414 HA3 NGL 414 -13.238 -4.550 -7.550 6 HA PRO 415 HA PRO 415 -8.919 -2.837 -6.625 7 HB2 PRO 415 HB2 PRO 415 -8.264 -1.991 -9.170 8 HB3 PRO 415 HB3 PRO 415 -7.893 -3.629 -8.547 9 HG2 PRO 415 HG2 PRO 415 -10.200 -2.754 -10.289 10 HG3 PRO 415 HG3 PRO 415 -9.167 -4.209 -10.458 11 HD2 PRO 415 HD2 PRO 415 -11.647 -4.284 -9.284 12 HD3 PRO 415 HD3 PRO 415 -10.307 -5.338 -8.743 13 H LEU 416 H LEU 416 -8.286 -0.533 -6.826 14 HA LEU 416 HA LEU 416 -10.552 1.198 -6.478 15 HB2 LEU 416 HB2 LEU 416 -8.467 1.485 -5.237 16 HB3 LEU 416 HB3 LEU 416 -7.562 1.710 -6.740 17 HG LEU 416 HG LEU 416 -8.848 3.795 -7.202 18 HD11 LEU 416 HD11 LEU 416 -10.927 3.250 -5.983 19 HD12 LEU 416 HD12 LEU 416 -10.034 3.258 -4.444 20 HD13 LEU 416 HD13 LEU 416 -10.225 4.762 -5.379 21 HD21 LEU 416 HD21 LEU 416 -6.691 3.868 -5.981 22 HD22 LEU 416 HD22 LEU 416 -7.800 5.140 -5.420 23 HD23 LEU 416 HD23 LEU 416 -7.559 3.673 -4.441 24 H GLY 417 H GLY 417 -8.598 0.276 -9.241 25 HA2 GLY 417 HA2 GLY 417 -8.812 0.816 -11.474 26 HA3 GLY 417 HA3 GLY 417 -10.306 1.682 -11.077 27 H SER 418 H SER 418 -9.432 3.188 -12.774 28 HA SER 418 HA SER 418 -7.109 4.791 -12.229 29 HB2 SER 418 HB2 SER 418 -8.021 4.511 -14.485 30 HB3 SER 418 HB3 SER 418 -9.536 5.296 -13.989 31 HG SER 418 HG SER 418 -8.072 6.735 -15.021 32 H GLY 419 H GLY 419 -7.085 7.087 -11.672 33 HA2 GLY 419 HA2 GLY 419 -7.728 8.941 -10.449 34 HA3 GLY 419 HA3 GLY 419 -9.398 8.351 -10.504 35 H GLN 420 H GLN 420 -9.580 9.047 -8.257 36 HA GLN 420 HA GLN 420 -8.840 6.903 -6.404 37 HB2 GLN 420 HB2 GLN 420 -7.782 8.399 -4.793 38 HB3 GLN 420 HB3 GLN 420 -6.869 8.387 -6.307 39 HG2 GLN 420 HG2 GLN 420 -8.931 10.530 -5.603 40 HG3 GLN 420 HG3 GLN 420 -7.206 10.666 -5.225 41 HE21 GLN 420 HE21 GLN 420 -6.252 10.793 -8.787 42 HE22 GLN 420 HE22 GLN 420 -5.809 9.896 -7.351 43 H GLN 421 H GLN 421 -9.934 7.156 -4.292 44 HA GLN 421 HA GLN 421 -12.087 9.135 -4.124 45 HB2 GLN 421 HB2 GLN 421 -13.112 7.423 -5.551 46 HB3 GLN 421 HB3 GLN 421 -12.659 6.157 -4.389 47 HG2 GLN 421 HG2 GLN 421 -14.113 7.131 -2.685 48 HG3 GLN 421 HG3 GLN 421 -14.448 8.526 -3.725 49 HE21 GLN 421 HE21 GLN 421 -17.425 6.446 -4.131 50 HE22 GLN 421 HE22 GLN 421 -16.693 7.525 -2.963 51 H ARG 422 H ARG 422 -12.766 9.460 -2.029 52 HA ARG 422 HA ARG 422 -11.873 7.602 0.087 53 HB2 ARG 422 HB2 ARG 422 -11.160 10.565 0.003 54 HB3 ARG 422 HB3 ARG 422 -10.929 9.501 1.400 55 HG2 ARG 422 HG2 ARG 422 -9.380 8.090 0.074 56 HG3 ARG 422 HG3 ARG 422 -9.604 9.166 -1.324 57 HD2 ARG 422 HD2 ARG 422 -8.824 11.084 0.159 58 HD3 ARG 422 HD3 ARG 422 -8.392 9.866 1.374 59 HE ARG 422 HE ARG 422 -7.264 9.551 -1.350 60 HH11 ARG 422 HH11 ARG 422 -6.788 10.645 1.976 61 HH12 ARG 422 HH12 ARG 422 -5.042 10.606 1.864 62 HH21 ARG 422 HH21 ARG 422 -4.983 9.443 -1.449 63 HH22 ARG 422 HH22 ARG 422 -4.026 9.920 -0.066 64 H ALA 423 H ALA 423 -12.977 7.940 2.115 65 HA ALA 423 HA ALA 423 -15.723 8.633 1.780 66 HB1 ALA 423 HB1 ALA 423 -14.055 8.306 4.305 67 HB2 ALA 423 HB2 ALA 423 -15.837 8.331 4.235 68 HB3 ALA 423 HB3 ALA 423 -14.933 7.015 3.450 69 H GLY 424 H GLY 424 -16.712 10.560 1.817 70 HA2 GLY 424 HA2 GLY 424 -17.108 12.680 2.927 71 HA3 GLY 424 HA3 GLY 424 -15.358 12.847 3.175 72 H ASP 425 H ASP 425 -15.299 11.601 0.183 73 HA ASP 425 HA ASP 425 -14.968 14.035 -1.226 74 HB2 ASP 425 HB2 ASP 425 -15.570 11.223 -2.165 75 HB3 ASP 425 HB3 ASP 425 -15.210 12.561 -3.260 76 H TRP 426 H TRP 426 -16.270 14.957 -2.984 77 HA TRP 426 HA TRP 426 -19.119 14.241 -2.967 78 HB2 TRP 426 HB2 TRP 426 -19.865 16.432 -2.253 79 HB3 TRP 426 HB3 TRP 426 -18.890 15.662 -0.997 80 HD1 TRP 426 HD1 TRP 426 -16.423 16.678 -0.572 81 HE1 TRP 426 HE1 TRP 426 -15.457 19.018 -0.909 82 HE3 TRP 426 HE3 TRP 426 -19.957 18.557 -3.742 83 HZ2 TRP 426 HZ2 TRP 426 -16.136 21.423 -2.372 84 HZ3 TRP 426 HZ3 TRP 426 -19.761 20.876 -4.601 85 HH2 TRP 426 HH2 TRP 426 -17.877 22.310 -3.913 86 H LYS 427 H LYS 427 -20.232 14.945 -4.773 87 HA LYS 427 HA LYS 427 -18.524 16.011 -6.943 88 HB2 LYS 427 HB2 LYS 427 -20.025 13.914 -7.114 89 HB3 LYS 427 HB3 LYS 427 -21.393 15.045 -7.150 90 HG2 LYS 427 HG2 LYS 427 -20.117 16.243 -9.070 91 HG3 LYS 427 HG3 LYS 427 -19.066 14.817 -9.096 92 HD2 LYS 427 HD2 LYS 427 -20.797 14.504 -10.758 93 HD3 LYS 427 HD3 LYS 427 -21.162 13.408 -9.403 94 HE2 LYS 427 HE2 LYS 427 -22.772 15.068 -8.508 95 HE3 LYS 427 HE3 LYS 427 -22.383 16.168 -9.845 96 HZ1 LYS 427 HZ1 LYS 427 -24.378 14.917 -10.274 97 HZ2 LYS 427 HZ2 LYS 427 -23.216 14.500 -11.359 98 HZ3 LYS 427 HZ3 LYS 427 -23.582 13.490 -10.110 99 H CYS 428 H CYS 428 -19.138 17.849 -8.182 100 HA CYS 428 HA CYS 428 -20.193 20.011 -6.704 101 HB2 CYS 428 HB2 CYS 428 -18.617 20.166 -8.627 102 HB3 CYS 428 HB3 CYS 428 -19.947 19.706 -9.721 103 HA PRO 429 HA PRO 429 -24.524 19.101 -7.219 104 HB2 PRO 429 HB2 PRO 429 -25.569 21.375 -6.108 105 HB3 PRO 429 HB3 PRO 429 -24.765 20.101 -5.131 106 HG2 PRO 429 HG2 PRO 429 -23.601 22.706 -6.141 107 HG3 PRO 429 HG3 PRO 429 -23.458 21.976 -4.507 108 HD2 PRO 429 HD2 PRO 429 -21.505 21.731 -6.418 109 HD3 PRO 429 HD3 PRO 429 -21.845 20.441 -5.221 110 H ASN 430 H ASN 430 -22.795 21.694 -8.763 111 HA ASN 430 HA ASN 430 -25.035 22.935 -10.083 112 HB2 ASN 430 HB2 ASN 430 -22.371 23.525 -9.696 113 HB3 ASN 430 HB3 ASN 430 -22.350 22.973 -11.373 114 HD21 ASN 430 HD21 ASN 430 -22.837 26.613 -11.488 115 HD22 ASN 430 HD22 ASN 430 -21.597 25.485 -10.963 116 HA PRO 431 HA PRO 431 -25.529 19.532 -12.992 117 HB2 PRO 431 HB2 PRO 431 -27.394 20.717 -14.646 118 HB3 PRO 431 HB3 PRO 431 -27.793 20.016 -13.042 119 HG2 PRO 431 HG2 PRO 431 -27.310 22.908 -13.769 120 HG3 PRO 431 HG3 PRO 431 -28.573 22.215 -12.700 121 HD2 PRO 431 HD2 PRO 431 -26.272 23.340 -11.740 122 HD3 PRO 431 HD3 PRO 431 -27.076 21.967 -10.920 123 H THR 432 H THR 432 -24.514 22.804 -13.658 124 HA THR 432 HA THR 432 -23.600 22.116 -16.354 125 HB THR 432 HB THR 432 -23.213 24.362 -16.725 126 HG1 THR 432 HG1 THR 432 -22.920 25.836 -15.053 127 HG21 THR 432 HG21 THR 432 -25.412 24.425 -14.608 128 HG22 THR 432 HG22 THR 432 -25.191 25.555 -15.958 129 HG23 THR 432 HG23 THR 432 -25.645 23.874 -16.286 130 H CYS 433 H CYS 433 -22.446 21.384 -13.402 131 HA CYS 433 HA CYS 433 -19.602 21.772 -14.201 132 HB2 CYS 433 HB2 CYS 433 -20.318 23.149 -12.265 133 HB3 CYS 433 HB3 CYS 433 -20.825 21.671 -11.421 134 H GLU 434 H GLU 434 -21.391 19.822 -11.774 135 HA GLU 434 HA GLU 434 -21.188 17.679 -11.116 136 HB2 GLU 434 HB2 GLU 434 -20.948 17.199 -14.107 137 HB3 GLU 434 HB3 GLU 434 -21.294 15.959 -12.882 138 HG2 GLU 434 HG2 GLU 434 -23.299 17.270 -12.168 139 HG3 GLU 434 HG3 GLU 434 -22.994 18.412 -13.487 140 H ASN 435 H ASN 435 -18.555 19.299 -11.607 141 HA ASN 435 HA ASN 435 -16.547 17.312 -12.131 142 HB2 ASN 435 HB2 ASN 435 -16.226 19.807 -12.271 143 HB3 ASN 435 HB3 ASN 435 -16.363 19.879 -10.509 144 HD21 ASN 435 HD21 ASN 435 -12.892 19.495 -10.232 145 HD22 ASN 435 HD22 ASN 435 -14.345 20.362 -9.792 146 H MET 436 H MET 436 -15.202 16.174 -10.612 147 HA MET 436 HA MET 436 -16.604 15.589 -8.086 148 HB2 MET 436 HB2 MET 436 -15.679 13.818 -9.711 149 HB3 MET 436 HB3 MET 436 -14.066 14.283 -9.112 150 HG2 MET 436 HG2 MET 436 -14.832 12.441 -7.750 151 HG3 MET 436 HG3 MET 436 -14.940 13.902 -6.764 152 HE1 MET 436 HE1 MET 436 -16.408 11.893 -5.336 153 HE2 MET 436 HE2 MET 436 -16.617 13.640 -5.053 154 HE3 MET 436 HE3 MET 436 -18.040 12.579 -5.164 155 H ASN 437 H ASN 437 -15.964 16.360 -6.126 156 HA ASN 437 HA ASN 437 -13.402 17.883 -6.056 157 HB2 ASN 437 HB2 ASN 437 -15.997 18.370 -4.557 158 HB3 ASN 437 HB3 ASN 437 -14.533 19.347 -4.424 159 HD21 ASN 437 HD21 ASN 437 -17.222 20.273 -7.212 160 HD22 ASN 437 HD22 ASN 437 -17.518 19.304 -5.782 161 H PHE 438 H PHE 438 -12.086 17.722 -4.265 162 HA PHE 438 HA PHE 438 -12.251 15.246 -2.821 163 HB2 PHE 438 HB2 PHE 438 -10.356 17.591 -2.678 164 HB3 PHE 438 HB3 PHE 438 -10.222 16.199 -1.617 165 HD1 PHE 438 HD1 PHE 438 -10.986 14.011 -3.641 166 HD2 PHE 438 HD2 PHE 438 -8.346 17.399 -3.908 167 HE1 PHE 438 HE1 PHE 438 -9.628 12.824 -5.327 168 HE2 PHE 438 HE2 PHE 438 -6.947 16.174 -5.537 169 HZ PHE 438 HZ PHE 438 -7.591 13.892 -6.264 170 H SER 439 H SER 439 -12.032 15.006 -0.468 171 HA SER 439 HA SER 439 -14.418 15.999 0.697 172 HB2 SER 439 HB2 SER 439 -13.442 13.849 1.291 173 HB3 SER 439 HB3 SER 439 -11.987 14.644 1.926 174 HG SER 439 HG SER 439 -14.632 14.978 2.907 175 H TRP 440 H TRP 440 -11.070 17.212 0.834 176 HA TRP 440 HA TRP 440 -11.631 18.872 3.158 177 HB2 TRP 440 HB2 TRP 440 -9.344 19.796 2.659 178 HB3 TRP 440 HB3 TRP 440 -9.428 18.066 2.989 179 HD1 TRP 440 HD1 TRP 440 -8.692 16.417 1.126 180 HE1 TRP 440 HE1 TRP 440 -7.514 16.649 -1.109 181 HE3 TRP 440 HE3 TRP 440 -9.223 21.466 0.486 182 HZ2 TRP 440 HZ2 TRP 440 -6.855 18.792 -2.971 183 HZ3 TRP 440 HZ3 TRP 440 -8.318 22.564 -1.522 184 HH2 TRP 440 HH2 TRP 440 -7.117 21.249 -3.250 185 H ARG 441 H ARG 441 -12.286 19.218 -0.200 186 HA ARG 441 HA ARG 441 -12.148 22.137 -0.196 187 HB2 ARG 441 HB2 ARG 441 -13.405 20.121 -2.096 188 HB3 ARG 441 HB3 ARG 441 -13.479 21.878 -2.326 189 HG2 ARG 441 HG2 ARG 441 -10.973 21.955 -2.231 190 HG3 ARG 441 HG3 ARG 441 -10.968 20.174 -2.212 191 HD2 ARG 441 HD2 ARG 441 -12.227 20.163 -4.356 192 HD3 ARG 441 HD3 ARG 441 -12.230 21.927 -4.373 193 HE ARG 441 HE ARG 441 -10.045 20.139 -5.076 194 HH11 ARG 441 HH11 ARG 441 -10.863 23.397 -3.981 195 HH12 ARG 441 HH12 ARG 441 -9.370 24.100 -4.560 196 HH21 ARG 441 HH21 ARG 441 -8.107 21.062 -5.792 197 HH22 ARG 441 HH22 ARG 441 -7.804 22.778 -5.597 198 H ASN 442 H ASN 442 -13.834 23.590 -0.019 199 HA ASN 442 HA ASN 442 -16.418 22.478 0.981 200 HB2 ASN 442 HB2 ASN 442 -15.044 25.133 1.533 201 HB3 ASN 442 HB3 ASN 442 -16.688 24.730 2.049 202 HD21 ASN 442 HD21 ASN 442 -14.072 24.003 4.745 203 HD22 ASN 442 HD22 ASN 442 -14.335 25.387 3.706 204 H GLU 443 H GLU 443 -14.917 23.850 -1.688 205 HA GLU 443 HA GLU 443 -17.539 24.616 -2.823 206 HB2 GLU 443 HB2 GLU 443 -15.030 26.331 -3.004 207 HB3 GLU 443 HB3 GLU 443 -16.557 26.624 -3.853 208 HG2 GLU 443 HG2 GLU 443 -17.722 26.814 -1.653 209 HG3 GLU 443 HG3 GLU 443 -16.162 26.622 -0.830 210 H CYS 444 H CYS 444 -17.492 24.685 -5.185 211 HA CYS 444 HA CYS 444 -16.231 22.382 -6.259 212 HB2 CYS 444 HB2 CYS 444 -18.390 23.300 -7.029 213 HB3 CYS 444 HB3 CYS 444 -17.553 24.733 -7.659 214 H ASN 445 H ASN 445 -14.691 22.216 -7.971 215 HA ASN 445 HA ASN 445 -12.506 24.158 -7.629 216 HB2 ASN 445 HB2 ASN 445 -12.512 21.477 -7.550 217 HB3 ASN 445 HB3 ASN 445 -12.326 21.652 -9.301 218 HD21 ASN 445 HD21 ASN 445 -8.904 21.421 -8.072 219 HD22 ASN 445 HD22 ASN 445 -10.292 20.429 -8.472 220 H GLN 446 H GLN 446 -15.162 24.090 -9.541 221 HA GLN 446 HA GLN 446 -13.715 25.066 -11.962 222 HB2 GLN 446 HB2 GLN 446 -16.034 23.101 -11.832 223 HB3 GLN 446 HB3 GLN 446 -15.397 23.813 -13.320 224 HG2 GLN 446 HG2 GLN 446 -13.695 22.182 -11.383 225 HG3 GLN 446 HG3 GLN 446 -14.566 21.468 -12.734 226 HE21 GLN 446 HE21 GLN 446 -11.173 22.029 -14.032 227 HE22 GLN 446 HE22 GLN 446 -12.005 20.975 -12.909 228 H CYS 447 H CYS 447 -16.646 25.047 -9.949 229 HA CYS 447 HA CYS 447 -17.476 27.571 -11.294 230 HB2 CYS 447 HB2 CYS 447 -19.831 26.813 -11.088 231 HB3 CYS 447 HB3 CYS 447 -18.867 25.764 -12.146 232 H LYS 448 H LYS 448 -16.341 26.287 -8.507 233 HA LYS 448 HA LYS 448 -16.295 26.934 -6.347 234 HB2 LYS 448 HB2 LYS 448 -17.259 29.566 -7.512 235 HB3 LYS 448 HB3 LYS 448 -16.566 29.345 -5.894 236 HG2 LYS 448 HG2 LYS 448 -14.472 28.485 -6.895 237 HG3 LYS 448 HG3 LYS 448 -15.146 28.732 -8.527 238 HD2 LYS 448 HD2 LYS 448 -15.387 31.146 -8.063 239 HD3 LYS 448 HD3 LYS 448 -14.723 30.911 -6.432 240 HE2 LYS 448 HE2 LYS 448 -12.622 30.042 -7.410 241 HE3 LYS 448 HE3 LYS 448 -13.283 30.290 -9.037 242 HZ1 LYS 448 HZ1 LYS 448 -11.878 32.107 -8.363 243 HZ2 LYS 448 HZ2 LYS 448 -13.426 32.634 -8.549 244 HZ3 LYS 448 HZ3 LYS 448 -12.817 32.402 -7.040 245 H ALA 449 H ALA 449 -19.002 25.928 -7.533 246 HA ALA 449 HA ALA 449 -21.032 27.055 -5.872 247 HB1 ALA 449 HB1 ALA 449 -21.509 25.667 -7.857 248 HB2 ALA 449 HB2 ALA 449 -20.775 24.259 -7.056 249 HB3 ALA 449 HB3 ALA 449 -22.265 24.980 -6.402 250 HA PRO 450 HA PRO 450 -19.669 25.527 -1.990 251 HB2 PRO 450 HB2 PRO 450 -22.001 25.642 -0.524 252 HB3 PRO 450 HB3 PRO 450 -21.063 27.089 -1.021 253 HG2 PRO 450 HG2 PRO 450 -23.528 25.906 -2.320 254 HG3 PRO 450 HG3 PRO 450 -23.150 27.626 -1.988 255 HD2 PRO 450 HD2 PRO 450 -22.778 26.453 -4.448 256 HD3 PRO 450 HD3 PRO 450 -21.719 27.764 -3.843 257 H LYS 451 H LYS 451 -19.539 23.618 -0.814 258 HA LYS 451 HA LYS 451 -20.668 21.231 -1.928 259 HB2 LYS 451 HB2 LYS 451 -18.534 21.177 -0.785 260 HB3 LYS 451 HB3 LYS 451 -19.235 21.814 0.694 261 HG2 LYS 451 HG2 LYS 451 -20.807 19.613 0.424 262 HG3 LYS 451 HG3 LYS 451 -19.386 19.052 -0.461 263 HD2 LYS 451 HD2 LYS 451 -19.495 20.061 2.412 264 HD3 LYS 451 HD3 LYS 451 -19.131 18.412 1.867 265 HE2 LYS 451 HE2 LYS 451 -17.099 19.277 0.706 266 HE3 LYS 451 HE3 LYS 451 -17.470 20.902 1.313 267 HZ1 LYS 451 HZ1 LYS 451 -17.224 20.056 3.543 268 HZ2 LYS 451 HZ2 LYS 451 -16.899 18.542 2.981 269 HZ3 LYS 451 HZ3 LYS 451 -15.856 19.776 2.672 270 HA PRO 452 HA PRO 452 -23.829 21.385 1.691 271 HB2 PRO 452 HB2 PRO 452 -24.026 23.692 3.179 272 HB3 PRO 452 HB3 PRO 452 -22.982 22.307 3.635 273 HG2 PRO 452 HG2 PRO 452 -22.214 24.866 2.198 274 HG3 PRO 452 HG3 PRO 452 -21.365 24.050 3.550 275 HD2 PRO 452 HD2 PRO 452 -20.579 23.738 0.957 276 HD3 PRO 452 HD3 PRO 452 -20.489 22.400 2.138 277 H ASP 453 H ASP 453 -25.966 22.554 1.852 278 HA ASP 453 HA ASP 453 -26.628 23.703 -0.709 279 HB2 ASP 453 HB2 ASP 453 -28.241 23.266 1.824 280 HB3 ASP 453 HB3 ASP 453 -28.924 23.895 0.323 281 H GLY 454 H GLY 454 -25.209 25.144 1.948 282 HA2 GLY 454 HA2 GLY 454 -25.461 27.780 0.941 283 HA3 GLY 454 HA3 GLY 454 -26.622 27.574 2.270 284 H5' U 1 H5' U 1 0.008 17.758 -1.304 285 H5'' U 1 H5'' U 1 -0.866 19.255 -1.698 286 H4' U 1 H4' U 1 -1.327 17.632 0.850 287 H3' U 1 H3' U 1 -1.991 16.615 -1.565 288 H2' U 1 H2' U 1 -2.899 18.635 -2.444 289 HO2' U 1 HO2' U 1 -4.486 17.156 -2.829 290 H1' U 1 H1' U 1 -4.525 19.046 0.064 291 H3 U 1 H3 U 1 -3.655 23.810 -0.296 292 H5 U 1 H5 U 1 -4.595 22.135 -4.034 293 H6 U 1 H6 U 1 -4.346 19.951 -3.059 294 H5' G 2 H5' G 2 -1.618 12.870 -1.210 295 H5'' G 2 H5'' G 2 -1.771 14.468 -1.971 296 H4' G 2 H4' G 2 -2.411 12.404 -3.398 297 H3' G 2 H3' G 2 -4.118 14.863 -3.039 298 H2' G 2 H2' G 2 -5.750 13.913 -4.517 299 HO2' G 2 HO2' G 2 -4.109 12.989 -5.970 300 H1' G 2 H1' G 2 -5.742 11.439 -3.413 301 H8 G 2 H8 G 2 -5.188 14.703 -1.314 302 H1 G 2 H1 G 2 -11.167 12.393 -1.423 303 H21 G 2 H21 G 2 -11.316 10.806 -2.949 304 H22 G 2 H22 G 2 -9.908 10.197 -3.803 305 H5' G 3 H5' G 3 -4.945 13.742 -7.450 306 H5'' G 3 H5'' G 3 -3.282 14.328 -7.645 307 H4' G 3 H4' G 3 -4.642 14.687 -9.678 308 H3' G 3 H3' G 3 -2.954 16.563 -8.496 309 H2' G 3 H2' G 3 -4.680 17.788 -7.423 310 HO2' G 3 HO2' G 3 -3.623 19.218 -8.932 311 H1' G 3 H1' G 3 -6.389 17.433 -9.891 312 H8 G 3 H8 G 3 -6.299 19.587 -7.254 313 H1 G 3 H1 G 3 -11.879 16.458 -6.841 314 H21 G 3 H21 G 3 -11.741 14.506 -7.892 315 H22 G 3 H22 G 3 -10.301 14.017 -8.756 316 H5' U 4 H5' U 4 -4.570 15.946 -13.836 317 H5'' U 4 H5'' U 4 -5.343 16.745 -12.448 318 H4' U 4 H4' U 4 -6.178 14.039 -13.579 319 H3' U 4 H3' U 4 -7.188 16.863 -13.964 320 H2' U 4 H2' U 4 -9.380 16.075 -14.022 321 HO2' U 4 HO2' U 4 -8.896 14.273 -15.464 322 H1' U 4 H1' U 4 -9.069 14.075 -12.103 323 H3 U 4 H3 U 4 -12.013 16.902 -10.152 324 H5 U 4 H5 U 4 -8.590 19.286 -10.657 325 H6 U 4 H6 U 4 -7.541 17.425 -11.814 326 H5' G 5 H5' G 5 -9.274 16.741 -16.251 327 H5'' G 5 H5'' G 5 -8.904 17.572 -17.776 328 H4' G 5 H4' G 5 -9.351 19.753 -16.723 329 H3' G 5 H3' G 5 -8.811 18.471 -14.297 330 H2' G 5 H2' G 5 -10.896 17.344 -14.142 331 HO2' G 5 HO2' G 5 -12.269 18.598 -12.808 332 H1' G 5 H1' G 5 -12.246 19.775 -15.330 333 H8 G 5 H8 G 5 -12.118 15.878 -15.765 334 H1 G 5 H1 G 5 -17.949 18.415 -14.936 335 H21 G 5 H21 G 5 -17.796 20.603 -14.688 336 H22 G 5 H22 G 5 -16.271 21.455 -14.792 Start of MODEL 14 1 H1 GLY 414 H1 NGL 414 1.421 3.899 -11.516 2 H2 GLY 414 H2 NGL 414 1.901 3.809 -13.089 3 H3 GLY 414 H3 NGL 414 0.401 3.288 -12.657 4 HA2 GLY 414 HA2 NGL 414 1.361 6.063 -12.520 5 HA3 GLY 414 HA3 NGL 414 0.266 5.411 -13.754 6 HA PRO 415 HA PRO 415 -2.201 7.362 -10.298 7 HB2 PRO 415 HB2 PRO 415 -3.791 8.177 -12.700 8 HB3 PRO 415 HB3 PRO 415 -3.331 9.143 -11.264 9 HG2 PRO 415 HG2 PRO 415 -2.082 9.474 -13.671 10 HG3 PRO 415 HG3 PRO 415 -1.169 9.562 -12.129 11 HD2 PRO 415 HD2 PRO 415 -1.353 7.274 -14.085 12 HD3 PRO 415 HD3 PRO 415 0.060 7.876 -13.164 13 H LEU 416 H LEU 416 -4.428 6.888 -9.668 14 HA LEU 416 HA LEU 416 -5.230 4.197 -10.345 15 HB2 LEU 416 HB2 LEU 416 -6.679 6.369 -8.779 16 HB3 LEU 416 HB3 LEU 416 -7.088 4.647 -8.779 17 HG LEU 416 HG LEU 416 -4.427 5.818 -7.824 18 HD11 LEU 416 HD11 LEU 416 -5.249 5.249 -5.577 19 HD12 LEU 416 HD12 LEU 416 -6.331 6.421 -6.358 20 HD13 LEU 416 HD13 LEU 416 -6.793 4.702 -6.266 21 HD21 LEU 416 HD21 LEU 416 -4.189 3.521 -8.653 22 HD22 LEU 416 HD22 LEU 416 -4.091 3.545 -6.881 23 HD23 LEU 416 HD23 LEU 416 -5.582 2.998 -7.681 24 H GLY 417 H GLY 417 -7.239 3.524 -11.288 25 HA2 GLY 417 HA2 GLY 417 -8.013 5.029 -13.611 26 HA3 GLY 417 HA3 GLY 417 -8.793 3.557 -12.998 27 H SER 418 H SER 418 -9.990 6.089 -14.045 28 HA SER 418 HA SER 418 -11.627 7.583 -13.594 29 HB2 SER 418 HB2 SER 418 -12.777 5.461 -13.007 30 HB3 SER 418 HB3 SER 418 -12.320 5.705 -11.308 31 HG SER 418 HG SER 418 -13.934 7.403 -12.918 32 H GLY 419 H GLY 419 -8.928 7.684 -12.018 33 HA2 GLY 419 HA2 GLY 419 -7.979 9.365 -10.768 34 HA3 GLY 419 HA3 GLY 419 -9.573 10.119 -10.580 35 H GLN 420 H GLN 420 -8.129 10.287 -8.407 36 HA GLN 420 HA GLN 420 -8.250 8.020 -6.636 37 HB2 GLN 420 HB2 GLN 420 -7.980 10.987 -5.980 38 HB3 GLN 420 HB3 GLN 420 -7.623 9.628 -4.909 39 HG2 GLN 420 HG2 GLN 420 -5.507 10.202 -5.710 40 HG3 GLN 420 HG3 GLN 420 -5.957 8.844 -6.747 41 HE21 GLN 420 HE21 GLN 420 -4.635 11.158 -9.197 42 HE22 GLN 420 HE22 GLN 420 -4.155 9.918 -8.056 43 H GLN 421 H GLN 421 -9.546 7.891 -4.655 44 HA GLN 421 HA GLN 421 -12.001 9.493 -4.576 45 HB2 GLN 421 HB2 GLN 421 -12.612 7.736 -6.142 46 HB3 GLN 421 HB3 GLN 421 -12.058 6.486 -5.012 47 HG2 GLN 421 HG2 GLN 421 -13.788 7.088 -3.401 48 HG3 GLN 421 HG3 GLN 421 -14.256 8.494 -4.373 49 HE21 GLN 421 HE21 GLN 421 -16.829 6.061 -5.224 50 HE22 GLN 421 HE22 GLN 421 -16.383 7.178 -3.949 51 H ARG 422 H ARG 422 -12.825 9.678 -2.536 52 HA ARG 422 HA ARG 422 -11.950 7.810 -0.416 53 HB2 ARG 422 HB2 ARG 422 -11.610 10.833 -0.275 54 HB3 ARG 422 HB3 ARG 422 -11.412 9.722 1.087 55 HG2 ARG 422 HG2 ARG 422 -9.576 8.562 -0.122 56 HG3 ARG 422 HG3 ARG 422 -9.750 9.707 -1.470 57 HD2 ARG 422 HD2 ARG 422 -9.388 11.579 0.249 58 HD3 ARG 422 HD3 ARG 422 -8.918 10.307 1.386 59 HE ARG 422 HE ARG 422 -7.487 10.253 -1.169 60 HH11 ARG 422 HH11 ARG 422 -7.564 11.561 2.115 61 HH12 ARG 422 HH12 ARG 422 -5.842 11.862 2.163 62 HH21 ARG 422 HH21 ARG 422 -5.232 10.599 -1.054 63 HH22 ARG 422 HH22 ARG 422 -4.524 11.313 0.377 64 H ALA 423 H ALA 423 -13.309 7.979 1.518 65 HA ALA 423 HA ALA 423 -16.049 8.076 0.714 66 HB1 ALA 423 HB1 ALA 423 -15.150 6.454 2.330 67 HB2 ALA 423 HB2 ALA 423 -14.785 7.774 3.465 68 HB3 ALA 423 HB3 ALA 423 -16.472 7.399 3.048 69 H GLY 424 H GLY 424 -14.077 10.668 1.434 70 HA2 GLY 424 HA2 GLY 424 -16.238 12.187 2.815 71 HA3 GLY 424 HA3 GLY 424 -14.516 12.621 2.777 72 H ASP 425 H ASP 425 -15.011 11.585 -0.285 73 HA ASP 425 HA ASP 425 -14.851 14.162 -1.439 74 HB2 ASP 425 HB2 ASP 425 -15.621 11.493 -2.651 75 HB3 ASP 425 HB3 ASP 425 -15.222 12.942 -3.580 76 H TRP 426 H TRP 426 -16.313 15.151 -3.030 77 HA TRP 426 HA TRP 426 -19.140 14.398 -2.836 78 HB2 TRP 426 HB2 TRP 426 -19.866 16.567 -2.035 79 HB3 TRP 426 HB3 TRP 426 -18.819 15.782 -0.855 80 HD1 TRP 426 HD1 TRP 426 -16.405 16.858 -0.458 81 HE1 TRP 426 HE1 TRP 426 -15.477 19.206 -0.809 82 HE3 TRP 426 HE3 TRP 426 -19.986 18.659 -3.620 83 HZ2 TRP 426 HZ2 TRP 426 -16.193 21.587 -2.296 84 HZ3 TRP 426 HZ3 TRP 426 -19.837 20.968 -4.491 85 HH2 TRP 426 HH2 TRP 426 -17.959 22.437 -3.840 86 H LYS 427 H LYS 427 -20.280 15.002 -4.639 87 HA LYS 427 HA LYS 427 -18.662 16.107 -6.833 88 HB2 LYS 427 HB2 LYS 427 -20.046 14.014 -7.058 89 HB3 LYS 427 HB3 LYS 427 -21.500 15.017 -6.850 90 HG2 LYS 427 HG2 LYS 427 -20.591 16.415 -8.847 91 HG3 LYS 427 HG3 LYS 427 -19.456 15.073 -9.097 92 HD2 LYS 427 HD2 LYS 427 -21.347 14.675 -10.518 93 HD3 LYS 427 HD3 LYS 427 -21.507 13.537 -9.157 94 HE2 LYS 427 HE2 LYS 427 -23.053 15.120 -8.033 95 HE3 LYS 427 HE3 LYS 427 -22.890 16.247 -9.386 96 HZ1 LYS 427 HZ1 LYS 427 -23.982 13.519 -9.538 97 HZ2 LYS 427 HZ2 LYS 427 -24.863 14.908 -9.587 98 HZ3 LYS 427 HZ3 LYS 427 -23.819 14.546 -10.814 99 H CYS 428 H CYS 428 -19.204 17.944 -8.022 100 HA CYS 428 HA CYS 428 -20.292 20.122 -6.602 101 HB2 CYS 428 HB2 CYS 428 -18.655 20.227 -8.481 102 HB3 CYS 428 HB3 CYS 428 -19.942 19.752 -9.609 103 HA PRO 429 HA PRO 429 -24.613 19.248 -7.198 104 HB2 PRO 429 HB2 PRO 429 -25.656 21.583 -6.206 105 HB3 PRO 429 HB3 PRO 429 -24.910 20.325 -5.163 106 HG2 PRO 429 HG2 PRO 429 -23.675 22.881 -6.222 107 HG3 PRO 429 HG3 PRO 429 -23.584 22.204 -4.562 108 HD2 PRO 429 HD2 PRO 429 -21.589 21.869 -6.422 109 HD3 PRO 429 HD3 PRO 429 -21.965 20.628 -5.184 110 H ASN 430 H ASN 430 -22.815 21.764 -8.786 111 HA ASN 430 HA ASN 430 -24.978 22.941 -10.277 112 HB2 ASN 430 HB2 ASN 430 -22.357 23.562 -9.822 113 HB3 ASN 430 HB3 ASN 430 -22.212 22.811 -11.417 114 HD21 ASN 430 HD21 ASN 430 -22.660 26.442 -11.941 115 HD22 ASN 430 HD22 ASN 430 -21.482 25.387 -11.187 116 HA PRO 431 HA PRO 431 -25.422 19.340 -12.946 117 HB2 PRO 431 HB2 PRO 431 -27.212 20.415 -14.745 118 HB3 PRO 431 HB3 PRO 431 -27.680 19.838 -13.121 119 HG2 PRO 431 HG2 PRO 431 -27.099 22.672 -14.006 120 HG3 PRO 431 HG3 PRO 431 -28.442 22.075 -12.975 121 HD2 PRO 431 HD2 PRO 431 -26.192 23.213 -11.940 122 HD3 PRO 431 HD3 PRO 431 -27.034 21.874 -11.102 123 H THR 432 H THR 432 -24.332 22.545 -13.784 124 HA THR 432 HA THR 432 -23.340 21.682 -16.404 125 HB THR 432 HB THR 432 -22.884 23.900 -16.884 126 HG1 THR 432 HG1 THR 432 -22.672 25.464 -15.273 127 HG21 THR 432 HG21 THR 432 -25.344 23.467 -16.540 128 HG22 THR 432 HG22 THR 432 -25.185 24.104 -14.883 129 HG23 THR 432 HG23 THR 432 -24.876 25.158 -16.283 130 H CYS 433 H CYS 433 -22.288 21.093 -13.376 131 HA CYS 433 HA CYS 433 -19.408 21.416 -14.095 132 HB2 CYS 433 HB2 CYS 433 -20.208 22.911 -12.261 133 HB3 CYS 433 HB3 CYS 433 -20.713 21.470 -11.352 134 H GLU 434 H GLU 434 -21.352 19.632 -11.669 135 HA GLU 434 HA GLU 434 -21.239 17.506 -10.892 136 HB2 GLU 434 HB2 GLU 434 -20.930 16.956 -13.857 137 HB3 GLU 434 HB3 GLU 434 -21.288 15.719 -12.631 138 HG2 GLU 434 HG2 GLU 434 -23.301 17.026 -11.941 139 HG3 GLU 434 HG3 GLU 434 -22.975 18.184 -13.237 140 H ASN 435 H ASN 435 -18.578 19.015 -11.217 141 HA ASN 435 HA ASN 435 -16.583 16.989 -11.689 142 HB2 ASN 435 HB2 ASN 435 -16.163 19.426 -11.906 143 HB3 ASN 435 HB3 ASN 435 -16.443 19.625 -10.174 144 HD21 ASN 435 HD21 ASN 435 -13.050 19.110 -9.498 145 HD22 ASN 435 HD22 ASN 435 -14.548 19.942 -9.139 146 H MET 436 H MET 436 -15.478 15.670 -10.247 147 HA MET 436 HA MET 436 -16.727 15.243 -7.629 148 HB2 MET 436 HB2 MET 436 -16.028 13.333 -9.042 149 HB3 MET 436 HB3 MET 436 -14.353 13.924 -8.999 150 HG2 MET 436 HG2 MET 436 -14.094 12.594 -7.217 151 HG3 MET 436 HG3 MET 436 -14.979 13.826 -6.316 152 HE1 MET 436 HE1 MET 436 -17.255 13.632 -5.378 153 HE2 MET 436 HE2 MET 436 -17.909 13.651 -7.037 154 HE3 MET 436 HE3 MET 436 -18.493 12.446 -5.865 155 H ASN 437 H ASN 437 -16.252 16.896 -6.222 156 HA ASN 437 HA ASN 437 -13.547 18.025 -6.116 157 HB2 ASN 437 HB2 ASN 437 -16.047 18.555 -4.480 158 HB3 ASN 437 HB3 ASN 437 -14.564 19.514 -4.414 159 HD21 ASN 437 HD21 ASN 437 -17.344 20.583 -7.018 160 HD22 ASN 437 HD22 ASN 437 -17.594 19.653 -5.554 161 H PHE 438 H PHE 438 -12.140 17.915 -4.335 162 HA PHE 438 HA PHE 438 -12.221 15.433 -2.898 163 HB2 PHE 438 HB2 PHE 438 -10.351 17.802 -2.789 164 HB3 PHE 438 HB3 PHE 438 -10.178 16.401 -1.742 165 HD1 PHE 438 HD1 PHE 438 -8.221 17.533 -3.862 166 HD2 PHE 438 HD2 PHE 438 -11.095 14.323 -3.971 167 HE1 PHE 438 HE1 PHE 438 -6.850 16.348 -5.545 168 HE2 PHE 438 HE2 PHE 438 -9.733 13.171 -5.678 169 HZ PHE 438 HZ PHE 438 -7.606 14.170 -6.466 170 H SER 439 H SER 439 -11.902 15.191 -0.562 171 HA SER 439 HA SER 439 -14.303 16.020 0.678 172 HB2 SER 439 HB2 SER 439 -13.131 13.927 1.190 173 HB3 SER 439 HB3 SER 439 -11.752 14.832 1.838 174 HG SER 439 HG SER 439 -13.059 15.611 3.476 175 H TRP 440 H TRP 440 -11.032 17.423 0.776 176 HA TRP 440 HA TRP 440 -11.654 19.011 3.145 177 HB2 TRP 440 HB2 TRP 440 -9.394 20.017 2.643 178 HB3 TRP 440 HB3 TRP 440 -9.438 18.288 3.005 179 HD1 TRP 440 HD1 TRP 440 -8.677 16.623 1.156 180 HE1 TRP 440 HE1 TRP 440 -7.488 16.857 -1.079 181 HE3 TRP 440 HE3 TRP 440 -9.285 21.648 0.470 182 HZ2 TRP 440 HZ2 TRP 440 -6.826 18.989 -2.934 183 HZ3 TRP 440 HZ3 TRP 440 -8.379 22.749 -1.543 184 HH2 TRP 440 HH2 TRP 440 -7.129 21.440 -3.243 185 H ARG 441 H ARG 441 -12.327 19.396 -0.206 186 HA ARG 441 HA ARG 441 -12.192 22.310 -0.194 187 HB2 ARG 441 HB2 ARG 441 -13.459 20.296 -2.083 188 HB3 ARG 441 HB3 ARG 441 -13.519 22.057 -2.317 189 HG2 ARG 441 HG2 ARG 441 -11.010 22.101 -2.211 190 HG3 ARG 441 HG3 ARG 441 -11.027 20.321 -2.208 191 HD2 ARG 441 HD2 ARG 441 -12.247 20.335 -4.362 192 HD3 ARG 441 HD3 ARG 441 -12.275 22.099 -4.356 193 HE ARG 441 HE ARG 441 -10.055 20.359 -5.075 194 HH11 ARG 441 HH11 ARG 441 -10.929 23.578 -3.897 195 HH12 ARG 441 HH12 ARG 441 -9.450 24.318 -4.471 196 HH21 ARG 441 HH21 ARG 441 -8.137 21.327 -5.778 197 HH22 ARG 441 HH22 ARG 441 -7.851 23.034 -5.530 198 H ASN 442 H ASN 442 -13.862 23.772 0.014 199 HA ASN 442 HA ASN 442 -16.458 22.677 1.010 200 HB2 ASN 442 HB2 ASN 442 -15.081 25.333 1.552 201 HB3 ASN 442 HB3 ASN 442 -16.711 24.912 2.100 202 HD21 ASN 442 HD21 ASN 442 -14.007 24.180 4.727 203 HD22 ASN 442 HD22 ASN 442 -14.252 25.559 3.676 204 H GLU 443 H GLU 443 -14.941 24.039 -1.654 205 HA GLU 443 HA GLU 443 -17.565 24.782 -2.799 206 HB2 GLU 443 HB2 GLU 443 -15.041 26.466 -3.039 207 HB3 GLU 443 HB3 GLU 443 -16.570 26.749 -3.895 208 HG2 GLU 443 HG2 GLU 443 -17.726 27.026 -1.708 209 HG3 GLU 443 HG3 GLU 443 -16.169 26.835 -0.876 210 H CYS 444 H CYS 444 -17.534 24.790 -5.164 211 HA CYS 444 HA CYS 444 -16.265 22.444 -6.151 212 HB2 CYS 444 HB2 CYS 444 -18.416 23.301 -6.974 213 HB3 CYS 444 HB3 CYS 444 -17.599 24.729 -7.655 214 H ASN 445 H ASN 445 -14.616 22.143 -7.618 215 HA ASN 445 HA ASN 445 -12.449 24.074 -7.389 216 HB2 ASN 445 HB2 ASN 445 -12.484 21.420 -7.363 217 HB3 ASN 445 HB3 ASN 445 -12.403 21.596 -9.119 218 HD21 ASN 445 HD21 ASN 445 -8.911 21.307 -8.189 219 HD22 ASN 445 HD22 ASN 445 -10.339 20.367 -8.583 220 H GLN 446 H GLN 446 -15.106 23.989 -9.419 221 HA GLN 446 HA GLN 446 -13.540 25.045 -11.735 222 HB2 GLN 446 HB2 GLN 446 -15.893 23.125 -11.899 223 HB3 GLN 446 HB3 GLN 446 -14.921 23.766 -13.238 224 HG2 GLN 446 HG2 GLN 446 -12.909 22.706 -11.914 225 HG3 GLN 446 HG3 GLN 446 -14.161 21.761 -11.094 226 HE21 GLN 446 HE21 GLN 446 -13.081 19.614 -13.866 227 HE22 GLN 446 HE22 GLN 446 -12.509 20.167 -12.308 228 H CYS 447 H CYS 447 -16.564 24.977 -9.896 229 HA CYS 447 HA CYS 447 -17.333 27.518 -11.256 230 HB2 CYS 447 HB2 CYS 447 -19.700 26.779 -11.118 231 HB3 CYS 447 HB3 CYS 447 -18.711 25.756 -12.181 232 H LYS 448 H LYS 448 -16.307 26.261 -8.418 233 HA LYS 448 HA LYS 448 -16.346 26.956 -6.267 234 HB2 LYS 448 HB2 LYS 448 -17.159 29.536 -7.627 235 HB3 LYS 448 HB3 LYS 448 -16.762 29.414 -5.899 236 HG2 LYS 448 HG2 LYS 448 -14.531 28.524 -6.443 237 HG3 LYS 448 HG3 LYS 448 -14.922 28.561 -8.170 238 HD2 LYS 448 HD2 LYS 448 -13.558 30.521 -7.485 239 HD3 LYS 448 HD3 LYS 448 -15.139 30.987 -8.131 240 HE2 LYS 448 HE2 LYS 448 -14.576 32.293 -6.117 241 HE3 LYS 448 HE3 LYS 448 -16.019 31.301 -5.856 242 HZ1 LYS 448 HZ1 LYS 448 -13.303 30.557 -4.991 243 HZ2 LYS 448 HZ2 LYS 448 -14.446 31.224 -4.018 244 HZ3 LYS 448 HZ3 LYS 448 -14.695 29.739 -4.660 245 H ALA 449 H ALA 449 -19.007 25.922 -7.533 246 HA ALA 449 HA ALA 449 -21.086 27.058 -5.936 247 HB1 ALA 449 HB1 ALA 449 -21.493 25.613 -7.896 248 HB2 ALA 449 HB2 ALA 449 -20.788 24.227 -7.025 249 HB3 ALA 449 HB3 ALA 449 -22.295 24.969 -6.445 250 HA PRO 450 HA PRO 450 -19.773 25.662 -1.992 251 HB2 PRO 450 HB2 PRO 450 -22.133 25.760 -0.579 252 HB3 PRO 450 HB3 PRO 450 -21.220 27.218 -1.088 253 HG2 PRO 450 HG2 PRO 450 -23.621 25.931 -2.416 254 HG3 PRO 450 HG3 PRO 450 -23.308 27.674 -2.112 255 HD2 PRO 450 HD2 PRO 450 -22.850 26.478 -4.534 256 HD3 PRO 450 HD3 PRO 450 -21.820 27.813 -3.923 257 H LYS 451 H LYS 451 -19.600 23.771 -0.784 258 HA LYS 451 HA LYS 451 -20.709 21.339 -1.827 259 HB2 LYS 451 HB2 LYS 451 -18.566 21.343 -0.710 260 HB3 LYS 451 HB3 LYS 451 -19.252 22.002 0.762 261 HG2 LYS 451 HG2 LYS 451 -20.811 19.774 0.546 262 HG3 LYS 451 HG3 LYS 451 -19.378 19.212 -0.321 263 HD2 LYS 451 HD2 LYS 451 -19.508 20.293 2.524 264 HD3 LYS 451 HD3 LYS 451 -19.127 18.633 2.020 265 HE2 LYS 451 HE2 LYS 451 -17.098 19.488 0.851 266 HE3 LYS 451 HE3 LYS 451 -17.495 21.131 1.392 267 HZ1 LYS 451 HZ1 LYS 451 -17.276 20.358 3.658 268 HZ2 LYS 451 HZ2 LYS 451 -16.874 18.846 3.140 269 HZ3 LYS 451 HZ3 LYS 451 -15.884 20.118 2.817 270 HA PRO 452 HA PRO 452 -23.835 21.607 1.842 271 HB2 PRO 452 HB2 PRO 452 -24.044 24.004 3.177 272 HB3 PRO 452 HB3 PRO 452 -22.996 22.656 3.719 273 HG2 PRO 452 HG2 PRO 452 -22.227 25.127 2.129 274 HG3 PRO 452 HG3 PRO 452 -21.384 24.382 3.528 275 HD2 PRO 452 HD2 PRO 452 -20.594 23.925 0.964 276 HD3 PRO 452 HD3 PRO 452 -20.523 22.647 2.215 277 H ASP 453 H ASP 453 -25.978 22.835 2.004 278 HA ASP 453 HA ASP 453 -26.723 23.706 -0.630 279 HB2 ASP 453 HB2 ASP 453 -28.231 23.601 1.997 280 HB3 ASP 453 HB3 ASP 453 -28.958 24.077 0.456 281 H GLY 454 H GLY 454 -25.149 25.436 1.750 282 HA2 GLY 454 HA2 GLY 454 -25.434 27.928 0.401 283 HA3 GLY 454 HA3 GLY 454 -26.480 27.920 1.834 284 H5' U 1 H5' U 1 -0.171 17.567 -1.511 285 H5'' U 1 H5'' U 1 -1.058 19.086 -1.746 286 H4' U 1 H4' U 1 -1.216 17.402 0.802 287 H3' U 1 H3' U 1 -2.223 16.465 -1.518 288 H2' U 1 H2' U 1 -3.213 18.448 -2.302 289 HO2' U 1 HO2' U 1 -5.188 17.235 -0.651 290 H1' U 1 H1' U 1 -4.437 19.203 0.313 291 H3 U 1 H3 U 1 -2.451 23.647 -0.600 292 H5 U 1 H5 U 1 -4.504 22.026 -3.886 293 H6 U 1 H6 U 1 -4.588 19.915 -2.735 294 H5' G 2 H5' G 2 -1.642 12.815 -1.281 295 H5'' G 2 H5'' G 2 -1.735 14.462 -1.938 296 H4' G 2 H4' G 2 -2.365 12.472 -3.500 297 H3' G 2 H3' G 2 -3.931 15.014 -3.111 298 H2' G 2 H2' G 2 -5.586 14.228 -4.673 299 HO2' G 2 HO2' G 2 -3.981 13.268 -6.129 300 H1' G 2 H1' G 2 -5.784 11.714 -3.676 301 H8 G 2 H8 G 2 -5.102 14.890 -1.481 302 H1 G 2 H1 G 2 -11.136 12.749 -1.625 303 H21 G 2 H21 G 2 -11.345 11.225 -3.222 304 H22 G 2 H22 G 2 -9.962 10.626 -4.116 305 H5' G 3 H5' G 3 -4.724 14.140 -7.483 306 H5'' G 3 H5'' G 3 -3.069 14.711 -7.770 307 H4' G 3 H4' G 3 -4.480 15.205 -9.704 308 H3' G 3 H3' G 3 -2.872 17.103 -8.379 309 H2' G 3 H2' G 3 -4.653 18.251 -7.362 310 HO2' G 3 HO2' G 3 -4.482 19.299 -10.007 311 H1' G 3 H1' G 3 -6.341 17.786 -9.830 312 H8 G 3 H8 G 3 -6.271 19.851 -7.024 313 H1 G 3 H1 G 3 -11.862 16.714 -6.920 314 H21 G 3 H21 G 3 -11.761 14.944 -8.228 315 H22 G 3 H22 G 3 -10.321 14.525 -9.137 316 H5' U 4 H5' U 4 -3.904 15.768 -13.905 317 H5'' U 4 H5'' U 4 -4.661 16.996 -12.864 318 H4' U 4 H4' U 4 -5.644 14.120 -12.992 319 H3' U 4 H3' U 4 -6.093 16.431 -14.806 320 H2' U 4 H2' U 4 -8.267 16.748 -14.230 321 HO2' U 4 HO2' U 4 -8.697 14.856 -15.560 322 H1' U 4 H1' U 4 -8.379 14.529 -12.250 323 H3 U 4 H3 U 4 -11.872 17.010 -10.723 324 H5 U 4 H5 U 4 -8.660 19.718 -10.740 325 H6 U 4 H6 U 4 -7.303 18.021 -11.797 326 H5' G 5 H5' G 5 -8.124 12.302 -17.650 327 H5'' G 5 H5'' G 5 -7.348 11.999 -16.077 328 H4' G 5 H4' G 5 -6.277 10.904 -18.721 329 H3' G 5 H3' G 5 -8.667 10.070 -17.798 330 H2' G 5 H2' G 5 -8.107 9.843 -15.525 331 HO2' G 5 HO2' G 5 -8.829 7.771 -16.201 332 H1' G 5 H1' G 5 -5.503 8.475 -16.041 333 H8 G 5 H8 G 5 -7.265 8.762 -13.387 334 H1 G 5 H1 G 5 -2.804 13.254 -12.379 335 H21 G 5 H21 G 5 -1.809 13.790 -14.289 336 H22 G 5 H22 G 5 -2.267 13.057 -15.809 Start of MODEL 15 1 H1 GLY 414 H1 NGL 414 -7.107 19.311 -20.642 2 H2 GLY 414 H2 NGL 414 -5.524 19.491 -20.216 3 H3 GLY 414 H3 NGL 414 -6.675 19.378 -19.052 4 HA2 GLY 414 HA2 NGL 414 -5.930 17.253 -20.941 5 HA3 GLY 414 HA3 NGL 414 -5.475 17.321 -19.221 6 HA PRO 415 HA PRO 415 -9.530 15.014 -19.710 7 HB2 PRO 415 HB2 PRO 415 -8.691 12.632 -18.636 8 HB3 PRO 415 HB3 PRO 415 -8.550 13.028 -20.380 9 HG2 PRO 415 HG2 PRO 415 -6.436 13.213 -18.217 10 HG3 PRO 415 HG3 PRO 415 -6.272 12.574 -19.889 11 HD2 PRO 415 HD2 PRO 415 -5.490 15.107 -19.178 12 HD3 PRO 415 HD3 PRO 415 -6.145 14.728 -20.804 13 H LEU 416 H LEU 416 -10.860 14.186 -17.895 14 HA LEU 416 HA LEU 416 -10.518 15.785 -15.549 15 HB2 LEU 416 HB2 LEU 416 -12.316 13.370 -16.019 16 HB3 LEU 416 HB3 LEU 416 -12.482 14.548 -14.708 17 HG LEU 416 HG LEU 416 -12.672 15.190 -17.688 18 HD11 LEU 416 HD11 LEU 416 -14.819 14.983 -15.534 19 HD12 LEU 416 HD12 LEU 416 -15.077 15.496 -17.220 20 HD13 LEU 416 HD13 LEU 416 -14.568 13.831 -16.864 21 HD21 LEU 416 HD21 LEU 416 -13.554 17.374 -16.863 22 HD22 LEU 416 HD22 LEU 416 -13.180 16.875 -15.198 23 HD23 LEU 416 HD23 LEU 416 -11.868 17.121 -16.379 24 H GLY 417 H GLY 417 -10.186 15.113 -13.356 25 HA2 GLY 417 HA2 GLY 417 -8.029 13.203 -13.090 26 HA3 GLY 417 HA3 GLY 417 -8.795 14.132 -11.786 27 H SER 418 H SER 418 -8.034 11.170 -12.162 28 HA SER 418 HA SER 418 -10.374 10.073 -10.850 29 HB2 SER 418 HB2 SER 418 -11.080 9.951 -13.236 30 HB3 SER 418 HB3 SER 418 -9.604 9.034 -13.611 31 HG SER 418 HG SER 418 -11.759 8.296 -11.933 32 H GLY 419 H GLY 419 -9.975 7.765 -10.220 33 HA2 GLY 419 HA2 GLY 419 -8.477 5.909 -10.010 34 HA3 GLY 419 HA3 GLY 419 -7.100 6.984 -10.310 35 H GLN 420 H GLN 420 -9.295 8.548 -8.234 36 HA GLN 420 HA GLN 420 -8.053 7.398 -5.789 37 HB2 GLN 420 HB2 GLN 420 -8.319 10.387 -6.326 38 HB3 GLN 420 HB3 GLN 420 -7.626 9.609 -4.903 39 HG2 GLN 420 HG2 GLN 420 -5.733 10.224 -6.139 40 HG3 GLN 420 HG3 GLN 420 -5.928 8.511 -6.530 41 HE21 GLN 420 HE21 GLN 420 -5.444 9.653 -9.876 42 HE22 GLN 420 HE22 GLN 420 -4.692 8.889 -8.492 43 H GLN 421 H GLN 421 -9.307 7.598 -3.897 44 HA GLN 421 HA GLN 421 -11.865 8.998 -3.957 45 HB2 GLN 421 HB2 GLN 421 -12.470 6.926 -5.119 46 HB3 GLN 421 HB3 GLN 421 -11.752 5.962 -3.811 47 HG2 GLN 421 HG2 GLN 421 -13.405 6.821 -2.220 48 HG3 GLN 421 HG3 GLN 421 -14.037 7.942 -3.432 49 HE21 GLN 421 HE21 GLN 421 -16.479 5.249 -3.517 50 HE22 GLN 421 HE22 GLN 421 -16.035 6.650 -2.566 51 H ARG 422 H ARG 422 -12.460 9.582 -1.893 52 HA ARG 422 HA ARG 422 -11.335 8.095 0.403 53 HB2 ARG 422 HB2 ARG 422 -11.010 11.096 0.017 54 HB3 ARG 422 HB3 ARG 422 -10.622 10.202 1.492 55 HG2 ARG 422 HG2 ARG 422 -8.942 8.854 0.179 56 HG3 ARG 422 HG3 ARG 422 -9.280 9.894 -1.226 57 HD2 ARG 422 HD2 ARG 422 -8.705 11.884 0.235 58 HD3 ARG 422 HD3 ARG 422 -8.196 10.745 1.492 59 HE ARG 422 HE ARG 422 -6.883 10.223 -1.040 60 HH11 ARG 422 HH11 ARG 422 -6.863 12.362 1.778 61 HH12 ARG 422 HH12 ARG 422 -5.156 12.711 1.639 62 HH21 ARG 422 HH21 ARG 422 -4.623 10.591 -1.096 63 HH22 ARG 422 HH22 ARG 422 -3.894 11.695 0.050 64 H ALA 423 H ALA 423 -12.497 8.424 2.364 65 HA ALA 423 HA ALA 423 -15.291 8.821 2.036 66 HB1 ALA 423 HB1 ALA 423 -14.330 7.444 3.822 67 HB2 ALA 423 HB2 ALA 423 -13.573 8.881 4.551 68 HB3 ALA 423 HB3 ALA 423 -15.347 8.729 4.507 69 H GLY 424 H GLY 424 -16.492 10.641 1.982 70 HA2 GLY 424 HA2 GLY 424 -17.075 12.790 2.884 71 HA3 GLY 424 HA3 GLY 424 -15.354 13.137 3.131 72 H ASP 425 H ASP 425 -15.197 11.680 0.220 73 HA ASP 425 HA ASP 425 -14.982 13.983 -1.373 74 HB2 ASP 425 HB2 ASP 425 -15.533 11.090 -2.052 75 HB3 ASP 425 HB3 ASP 425 -15.312 12.328 -3.290 76 H TRP 426 H TRP 426 -16.327 14.896 -3.039 77 HA TRP 426 HA TRP 426 -19.168 14.153 -2.988 78 HB2 TRP 426 HB2 TRP 426 -19.926 16.326 -2.214 79 HB3 TRP 426 HB3 TRP 426 -18.919 15.532 -1.000 80 HD1 TRP 426 HD1 TRP 426 -16.495 16.591 -0.533 81 HE1 TRP 426 HE1 TRP 426 -15.538 18.928 -0.864 82 HE3 TRP 426 HE3 TRP 426 -20.013 18.457 -3.731 83 HZ2 TRP 426 HZ2 TRP 426 -16.203 21.325 -2.348 84 HZ3 TRP 426 HZ3 TRP 426 -19.815 20.766 -4.597 85 HH2 TRP 426 HH2 TRP 426 -17.931 22.204 -3.910 86 H LYS 427 H LYS 427 -20.357 14.977 -4.723 87 HA LYS 427 HA LYS 427 -18.667 15.983 -6.933 88 HB2 LYS 427 HB2 LYS 427 -20.235 13.917 -7.055 89 HB3 LYS 427 HB3 LYS 427 -21.554 15.106 -7.119 90 HG2 LYS 427 HG2 LYS 427 -20.208 16.214 -9.049 91 HG3 LYS 427 HG3 LYS 427 -19.233 14.728 -9.043 92 HD2 LYS 427 HD2 LYS 427 -20.953 14.469 -10.713 93 HD3 LYS 427 HD3 LYS 427 -21.391 13.427 -9.341 94 HE2 LYS 427 HE2 LYS 427 -22.913 15.211 -8.495 95 HE3 LYS 427 HE3 LYS 427 -22.478 16.229 -9.874 96 HZ1 LYS 427 HZ1 LYS 427 -24.532 15.051 -10.251 97 HZ2 LYS 427 HZ2 LYS 427 -23.388 14.538 -11.320 98 HZ3 LYS 427 HZ3 LYS 427 -23.799 13.598 -10.034 99 H CYS 428 H CYS 428 -19.230 17.841 -8.147 100 HA CYS 428 HA CYS 428 -20.272 20.026 -6.690 101 HB2 CYS 428 HB2 CYS 428 -18.665 20.134 -8.596 102 HB3 CYS 428 HB3 CYS 428 -19.979 19.684 -9.705 103 HA PRO 429 HA PRO 429 -24.599 19.153 -7.255 104 HB2 PRO 429 HB2 PRO 429 -25.644 21.425 -6.145 105 HB3 PRO 429 HB3 PRO 429 -24.869 20.142 -5.162 106 HG2 PRO 429 HG2 PRO 429 -23.659 22.741 -6.151 107 HG3 PRO 429 HG3 PRO 429 -23.549 22.011 -4.516 108 HD2 PRO 429 HD2 PRO 429 -21.578 21.756 -6.420 109 HD3 PRO 429 HD3 PRO 429 -21.924 20.469 -5.226 110 H ASN 430 H ASN 430 -22.825 21.725 -8.751 111 HA ASN 430 HA ASN 430 -25.016 23.024 -10.097 112 HB2 ASN 430 HB2 ASN 430 -22.346 23.556 -9.670 113 HB3 ASN 430 HB3 ASN 430 -22.316 23.027 -11.354 114 HD21 ASN 430 HD21 ASN 430 -22.734 26.683 -11.410 115 HD22 ASN 430 HD22 ASN 430 -21.522 25.528 -10.896 116 HA PRO 431 HA PRO 431 -25.546 19.642 -13.024 117 HB2 PRO 431 HB2 PRO 431 -27.383 20.851 -14.690 118 HB3 PRO 431 HB3 PRO 431 -27.800 20.171 -13.086 119 HG2 PRO 431 HG2 PRO 431 -27.235 23.050 -13.821 120 HG3 PRO 431 HG3 PRO 431 -28.536 22.393 -12.771 121 HD2 PRO 431 HD2 PRO 431 -26.225 23.460 -11.770 122 HD3 PRO 431 HD3 PRO 431 -27.066 22.102 -10.970 123 H THR 432 H THR 432 -24.497 22.918 -13.707 124 HA THR 432 HA THR 432 -23.566 22.204 -16.393 125 HB THR 432 HB THR 432 -23.142 24.450 -16.759 126 HG1 THR 432 HG1 THR 432 -22.885 25.916 -15.055 127 HG21 THR 432 HG21 THR 432 -25.580 23.981 -16.377 128 HG22 THR 432 HG22 THR 432 -25.378 24.507 -14.683 129 HG23 THR 432 HG23 THR 432 -25.129 25.657 -16.012 130 H CYS 433 H CYS 433 -22.438 21.489 -13.421 131 HA CYS 433 HA CYS 433 -19.578 21.849 -14.208 132 HB2 CYS 433 HB2 CYS 433 -20.301 23.187 -12.252 133 HB3 CYS 433 HB3 CYS 433 -20.810 21.686 -11.437 134 H GLU 434 H GLU 434 -21.469 19.873 -11.892 135 HA GLU 434 HA GLU 434 -21.304 17.714 -11.240 136 HB2 GLU 434 HB2 GLU 434 -20.988 17.314 -14.234 137 HB3 GLU 434 HB3 GLU 434 -21.330 16.023 -13.071 138 HG2 GLU 434 HG2 GLU 434 -23.361 17.234 -12.315 139 HG3 GLU 434 HG3 GLU 434 -23.059 18.489 -13.524 140 H ASN 435 H ASN 435 -18.647 19.318 -11.649 141 HA ASN 435 HA ASN 435 -16.641 17.314 -12.127 142 HB2 ASN 435 HB2 ASN 435 -16.198 19.739 -12.285 143 HB3 ASN 435 HB3 ASN 435 -16.532 19.916 -10.551 144 HD21 ASN 435 HD21 ASN 435 -13.179 19.360 -9.736 145 HD22 ASN 435 HD22 ASN 435 -14.671 20.228 -9.457 146 H MET 436 H MET 436 -15.495 16.001 -10.665 147 HA MET 436 HA MET 436 -16.823 15.539 -8.087 148 HB2 MET 436 HB2 MET 436 -15.876 13.740 -9.691 149 HB3 MET 436 HB3 MET 436 -14.277 14.218 -9.080 150 HG2 MET 436 HG2 MET 436 -15.057 12.386 -7.712 151 HG3 MET 436 HG3 MET 436 -15.161 13.855 -6.738 152 HE1 MET 436 HE1 MET 436 -16.640 11.700 -5.409 153 HE2 MET 436 HE2 MET 436 -16.811 13.429 -5.005 154 HE3 MET 436 HE3 MET 436 -18.261 12.405 -5.179 155 H ASN 437 H ASN 437 -16.028 16.168 -6.085 156 HA ASN 437 HA ASN 437 -13.521 17.783 -6.148 157 HB2 ASN 437 HB2 ASN 437 -16.057 18.282 -4.554 158 HB3 ASN 437 HB3 ASN 437 -14.581 19.245 -4.461 159 HD21 ASN 437 HD21 ASN 437 -17.330 20.116 -7.246 160 HD22 ASN 437 HD22 ASN 437 -17.602 19.084 -5.850 161 H PHE 438 H PHE 438 -12.127 17.640 -4.429 162 HA PHE 438 HA PHE 438 -12.151 15.167 -2.990 163 HB2 PHE 438 HB2 PHE 438 -10.385 17.619 -2.837 164 HB3 PHE 438 HB3 PHE 438 -10.136 16.198 -1.834 165 HD1 PHE 438 HD1 PHE 438 -11.008 14.200 -4.193 166 HD2 PHE 438 HD2 PHE 438 -8.195 17.451 -3.873 167 HE1 PHE 438 HE1 PHE 438 -9.618 13.176 -5.949 168 HE2 PHE 438 HE2 PHE 438 -6.780 16.382 -5.598 169 HZ PHE 438 HZ PHE 438 -7.492 14.253 -6.647 170 H SER 439 H SER 439 -11.957 14.849 -0.680 171 HA SER 439 HA SER 439 -14.374 15.700 0.509 172 HB2 SER 439 HB2 SER 439 -13.580 14.477 2.466 173 HB3 SER 439 HB3 SER 439 -13.178 13.562 0.994 174 HG SER 439 HG SER 439 -11.070 14.316 1.154 175 H TRP 440 H TRP 440 -11.136 17.113 0.664 176 HA TRP 440 HA TRP 440 -11.789 18.596 3.103 177 HB2 TRP 440 HB2 TRP 440 -9.493 19.527 2.769 178 HB3 TRP 440 HB3 TRP 440 -9.599 17.776 2.978 179 HD1 TRP 440 HD1 TRP 440 -8.759 16.250 1.045 180 HE1 TRP 440 HE1 TRP 440 -7.468 16.643 -1.105 181 HE3 TRP 440 HE3 TRP 440 -9.329 21.319 0.699 182 HZ2 TRP 440 HZ2 TRP 440 -6.746 18.892 -2.791 183 HZ3 TRP 440 HZ3 TRP 440 -8.326 22.561 -1.180 184 HH2 TRP 440 HH2 TRP 440 -7.008 21.366 -2.924 185 H ARG 441 H ARG 441 -12.374 19.083 -0.225 186 HA ARG 441 HA ARG 441 -12.193 21.991 -0.140 187 HB2 ARG 441 HB2 ARG 441 -13.484 20.053 -2.095 188 HB3 ARG 441 HB3 ARG 441 -13.480 21.813 -2.301 189 HG2 ARG 441 HG2 ARG 441 -10.995 21.801 -2.197 190 HG3 ARG 441 HG3 ARG 441 -11.017 20.022 -2.106 191 HD2 ARG 441 HD2 ARG 441 -12.241 19.953 -4.277 192 HD3 ARG 441 HD3 ARG 441 -12.172 21.716 -4.370 193 HE ARG 441 HE ARG 441 -10.065 19.830 -5.002 194 HH11 ARG 441 HH11 ARG 441 -10.683 23.115 -3.857 195 HH12 ARG 441 HH12 ARG 441 -9.122 23.714 -4.369 196 HH21 ARG 441 HH21 ARG 441 -8.051 20.618 -5.647 197 HH22 ARG 441 HH22 ARG 441 -7.625 22.300 -5.392 198 H ASN 442 H ASN 442 -13.876 23.462 0.054 199 HA ASN 442 HA ASN 442 -16.479 22.350 1.010 200 HB2 ASN 442 HB2 ASN 442 -15.097 24.985 1.618 201 HB3 ASN 442 HB3 ASN 442 -16.745 24.580 2.123 202 HD21 ASN 442 HD21 ASN 442 -14.121 23.772 4.798 203 HD22 ASN 442 HD22 ASN 442 -14.355 25.180 3.782 204 H GLU 443 H GLU 443 -14.956 23.725 -1.635 205 HA GLU 443 HA GLU 443 -17.564 24.525 -2.774 206 HB2 GLU 443 HB2 GLU 443 -15.046 26.231 -2.921 207 HB3 GLU 443 HB3 GLU 443 -16.565 26.541 -3.775 208 HG2 GLU 443 HG2 GLU 443 -17.738 26.726 -1.583 209 HG3 GLU 443 HG3 GLU 443 -16.188 26.511 -0.746 210 H CYS 444 H CYS 444 -17.509 24.631 -5.126 211 HA CYS 444 HA CYS 444 -16.253 22.323 -6.212 212 HB2 CYS 444 HB2 CYS 444 -18.407 23.271 -6.997 213 HB3 CYS 444 HB3 CYS 444 -17.542 24.692 -7.628 214 H ASN 445 H ASN 445 -14.639 22.113 -7.792 215 HA ASN 445 HA ASN 445 -12.489 24.091 -7.442 216 HB2 ASN 445 HB2 ASN 445 -12.453 21.420 -7.338 217 HB3 ASN 445 HB3 ASN 445 -12.266 21.569 -9.091 218 HD21 ASN 445 HD21 ASN 445 -8.851 21.396 -7.810 219 HD22 ASN 445 HD22 ASN 445 -10.231 20.376 -8.167 220 H GLN 446 H GLN 446 -15.087 24.047 -9.399 221 HA GLN 446 HA GLN 446 -13.580 24.986 -11.799 222 HB2 GLN 446 HB2 GLN 446 -15.951 23.076 -11.771 223 HB3 GLN 446 HB3 GLN 446 -15.139 23.703 -13.214 224 HG2 GLN 446 HG2 GLN 446 -13.775 22.007 -11.074 225 HG3 GLN 446 HG3 GLN 446 -14.469 21.361 -12.559 226 HE21 GLN 446 HE21 GLN 446 -10.842 21.820 -13.179 227 HE22 GLN 446 HE22 GLN 446 -11.859 20.845 -12.133 228 H CYS 447 H CYS 447 -16.582 24.974 -9.879 229 HA CYS 447 HA CYS 447 -17.355 27.494 -11.270 230 HB2 CYS 447 HB2 CYS 447 -19.711 26.770 -11.142 231 HB3 CYS 447 HB3 CYS 447 -18.733 25.660 -12.128 232 H LYS 448 H LYS 448 -16.301 26.258 -8.424 233 HA LYS 448 HA LYS 448 -16.270 26.997 -6.296 234 HB2 LYS 448 HB2 LYS 448 -17.380 29.566 -7.481 235 HB3 LYS 448 HB3 LYS 448 -16.587 29.401 -5.912 236 HG2 LYS 448 HG2 LYS 448 -15.269 28.804 -8.602 237 HG3 LYS 448 HG3 LYS 448 -15.085 30.303 -7.676 238 HD2 LYS 448 HD2 LYS 448 -14.130 29.015 -5.778 239 HD3 LYS 448 HD3 LYS 448 -14.287 27.517 -6.717 240 HE2 LYS 448 HE2 LYS 448 -12.004 28.342 -6.869 241 HE3 LYS 448 HE3 LYS 448 -12.789 28.444 -8.452 242 HZ1 LYS 448 HZ1 LYS 448 -12.468 30.675 -6.561 243 HZ2 LYS 448 HZ2 LYS 448 -11.568 30.437 -7.921 244 HZ3 LYS 448 HZ3 LYS 448 -13.173 30.769 -8.048 245 H ALA 449 H ALA 449 -18.976 25.938 -7.532 246 HA ALA 449 HA ALA 449 -21.026 27.052 -5.878 247 HB1 ALA 449 HB1 ALA 449 -22.251 24.977 -6.430 248 HB2 ALA 449 HB2 ALA 449 -21.496 25.683 -7.871 249 HB3 ALA 449 HB3 ALA 449 -20.756 24.268 -7.083 250 HA PRO 450 HA PRO 450 -19.723 25.489 -1.985 251 HB2 PRO 450 HB2 PRO 450 -22.072 25.545 -0.566 252 HB3 PRO 450 HB3 PRO 450 -21.164 27.021 -1.035 253 HG2 PRO 450 HG2 PRO 450 -23.563 25.774 -2.387 254 HG3 PRO 450 HG3 PRO 450 -23.256 27.508 -2.028 255 HD2 PRO 450 HD2 PRO 450 -22.794 26.405 -4.501 256 HD3 PRO 450 HD3 PRO 450 -21.776 27.720 -3.839 257 H LYS 451 H LYS 451 -19.612 23.566 -0.803 258 HA LYS 451 HA LYS 451 -20.720 21.175 -1.944 259 HB2 LYS 451 HB2 LYS 451 -18.599 21.116 -0.769 260 HB3 LYS 451 HB3 LYS 451 -19.320 21.753 0.697 261 HG2 LYS 451 HG2 LYS 451 -20.896 19.563 0.420 262 HG3 LYS 451 HG3 LYS 451 -19.475 18.998 -0.463 263 HD2 LYS 451 HD2 LYS 451 -19.604 19.982 2.423 264 HD3 LYS 451 HD3 LYS 451 -19.220 18.344 1.854 265 HE2 LYS 451 HE2 LYS 451 -17.186 19.239 0.728 266 HE3 LYS 451 HE3 LYS 451 -17.572 20.853 1.339 267 HZ1 LYS 451 HZ1 LYS 451 -16.990 18.494 2.998 268 HZ2 LYS 451 HZ2 LYS 451 -15.972 19.748 2.714 269 HZ3 LYS 451 HZ3 LYS 451 -17.361 19.997 3.565 270 HA PRO 452 HA PRO 452 -23.950 21.399 1.625 271 HB2 PRO 452 HB2 PRO 452 -24.148 23.729 3.054 272 HB3 PRO 452 HB3 PRO 452 -23.123 22.348 3.570 273 HG2 PRO 452 HG2 PRO 452 -22.287 24.860 2.089 274 HG3 PRO 452 HG3 PRO 452 -21.484 24.063 3.488 275 HD2 PRO 452 HD2 PRO 452 -20.621 23.676 0.936 276 HD3 PRO 452 HD3 PRO 452 -20.615 22.356 2.142 277 H ASP 453 H ASP 453 -25.993 22.902 1.923 278 HA ASP 453 HA ASP 453 -26.731 23.790 -0.712 279 HB2 ASP 453 HB2 ASP 453 -28.887 24.415 0.448 280 HB3 ASP 453 HB3 ASP 453 -28.406 22.711 0.528 281 H GLY 454 H GLY 454 -24.985 25.397 1.666 282 HA2 GLY 454 HA2 GLY 454 -25.024 27.879 0.284 283 HA3 GLY 454 HA3 GLY 454 -26.128 27.978 1.676 284 H5' U 1 H5' U 1 -0.037 17.453 -1.090 285 H5'' U 1 H5'' U 1 -0.857 19.023 -1.223 286 H4' U 1 H4' U 1 -1.376 17.037 1.039 287 H3' U 1 H3' U 1 -2.063 16.399 -1.493 288 H2' U 1 H2' U 1 -2.902 18.544 -2.084 289 HO2' U 1 HO2' U 1 -4.528 17.111 -2.628 290 H1' U 1 H1' U 1 -4.535 18.676 0.445 291 H3 U 1 H3 U 1 -3.416 23.399 0.736 292 H5 U 1 H5 U 1 -4.447 22.285 -3.182 293 H6 U 1 H6 U 1 -4.303 19.983 -2.516 294 H5' G 2 H5' G 2 -1.683 12.708 -1.650 295 H5'' G 2 H5'' G 2 -1.836 14.395 -2.195 296 H4' G 2 H4' G 2 -2.426 12.497 -3.886 297 H3' G 2 H3' G 2 -4.043 14.961 -3.310 298 H2' G 2 H2' G 2 -5.704 14.240 -4.898 299 HO2' G 2 HO2' G 2 -3.814 12.198 -5.567 300 H1' G 2 H1' G 2 -5.840 11.677 -4.052 301 H8 G 2 H8 G 2 -5.160 14.751 -1.702 302 H1 G 2 H1 G 2 -11.165 12.524 -1.799 303 H21 G 2 H21 G 2 -11.376 11.004 -3.399 304 H22 G 2 H22 G 2 -10.012 10.470 -4.362 305 H5' G 3 H5' G 3 -3.971 14.109 -7.550 306 H5'' G 3 H5'' G 3 -2.704 15.213 -8.109 307 H4' G 3 H4' G 3 -4.522 14.663 -9.792 308 H3' G 3 H3' G 3 -3.100 17.030 -9.376 309 H2' G 3 H2' G 3 -4.856 18.193 -8.335 310 HO2' G 3 HO2' G 3 -4.454 19.134 -10.536 311 H1' G 3 H1' G 3 -6.842 16.824 -10.160 312 H8 G 3 H8 G 3 -6.289 19.153 -7.294 313 H1 G 3 H1 G 3 -12.166 16.609 -7.317 314 H21 G 3 H21 G 3 -12.267 14.930 -8.765 315 H22 G 3 H22 G 3 -10.873 14.430 -9.703 316 H5' U 4 H5' U 4 -4.915 16.058 -13.852 317 H5'' U 4 H5'' U 4 -4.236 17.226 -15.004 318 H4' U 4 H4' U 4 -6.515 16.895 -15.638 319 H3' U 4 H3' U 4 -6.211 19.461 -14.054 320 H2' U 4 H2' U 4 -8.513 19.829 -14.373 321 HO2' U 4 HO2' U 4 -8.486 19.568 -16.648 322 H1' U 4 H1' U 4 -9.191 17.051 -14.616 323 H3 U 4 H3 U 4 -12.056 17.730 -11.239 324 H5 U 4 H5 U 4 -8.666 19.903 -10.018 325 H6 U 4 H6 U 4 -7.537 19.163 -12.019 326 H5' G 5 H5' G 5 -3.495 21.497 -16.805 327 H5'' G 5 H5'' G 5 -3.426 20.493 -15.343 328 H4' G 5 H4' G 5 -3.456 23.540 -15.276 329 H3' G 5 H3' G 5 -1.107 21.636 -15.468 330 H2' G 5 H2' G 5 0.125 23.216 -14.144 331 HO2' G 5 HO2' G 5 -0.696 25.112 -15.226 332 H1' G 5 H1' G 5 -1.965 23.746 -12.411 333 H8 G 5 H8 G 5 0.531 21.235 -13.698 334 H1 G 5 H1 G 5 -1.711 19.793 -7.864 335 H21 G 5 H21 G 5 -3.465 21.081 -7.379 336 H22 G 5 H22 G 5 -4.073 22.274 -8.504 Start of MODEL 16 1 H1 GLY 414 H1 NGL 414 -19.021 19.605 -16.255 2 H2 GLY 414 H2 NGL 414 -18.350 20.234 -17.624 3 H3 GLY 414 H3 NGL 414 -18.815 21.233 -16.396 4 HA2 GLY 414 HA2 NGL 414 -16.439 20.993 -16.403 5 HA3 GLY 414 HA3 NGL 414 -17.166 20.317 -14.934 6 HA PRO 415 HA PRO 415 -14.510 17.135 -17.208 7 HB2 PRO 415 HB2 PRO 415 -12.516 16.881 -15.323 8 HB3 PRO 415 HB3 PRO 415 -12.470 18.068 -16.661 9 HG2 PRO 415 HG2 PRO 415 -13.292 18.502 -13.783 10 HG3 PRO 415 HG3 PRO 415 -12.258 19.542 -14.822 11 HD2 PRO 415 HD2 PRO 415 -14.922 20.044 -14.386 12 HD3 PRO 415 HD3 PRO 415 -14.112 20.437 -15.934 13 H LEU 416 H LEU 416 -14.049 14.910 -16.417 14 HA LEU 416 HA LEU 416 -16.228 14.003 -14.758 15 HB2 LEU 416 HB2 LEU 416 -15.662 11.857 -15.471 16 HB3 LEU 416 HB3 LEU 416 -15.213 12.880 -16.842 17 HG LEU 416 HG LEU 416 -13.301 11.790 -14.719 18 HD11 LEU 416 HD11 LEU 416 -13.751 10.999 -17.623 19 HD12 LEU 416 HD12 LEU 416 -12.506 10.335 -16.538 20 HD13 LEU 416 HD13 LEU 416 -14.231 10.055 -16.197 21 HD21 LEU 416 HD21 LEU 416 -12.454 13.909 -15.678 22 HD22 LEU 416 HD22 LEU 416 -11.535 12.541 -16.321 23 HD23 LEU 416 HD23 LEU 416 -12.787 13.313 -17.323 24 H GLY 417 H GLY 417 -13.298 15.322 -13.864 25 HA2 GLY 417 HA2 GLY 417 -12.367 15.497 -11.762 26 HA3 GLY 417 HA3 GLY 417 -13.556 14.339 -11.147 27 H SER 418 H SER 418 -11.474 13.730 -9.939 28 HA SER 418 HA SER 418 -9.447 12.270 -11.426 29 HB2 SER 418 HB2 SER 418 -8.892 13.511 -9.375 30 HB3 SER 418 HB3 SER 418 -10.035 12.504 -8.456 31 HG SER 418 HG SER 418 -7.644 11.710 -9.745 32 H GLY 419 H GLY 419 -8.954 10.010 -11.128 33 HA2 GLY 419 HA2 GLY 419 -11.326 8.311 -11.128 34 HA3 GLY 419 HA3 GLY 419 -9.640 7.809 -11.372 35 H GLN 420 H GLN 420 -9.178 9.517 -8.703 36 HA GLN 420 HA GLN 420 -9.308 7.205 -6.944 37 HB2 GLN 420 HB2 GLN 420 -8.571 10.105 -6.390 38 HB3 GLN 420 HB3 GLN 420 -8.330 8.734 -5.290 39 HG2 GLN 420 HG2 GLN 420 -6.932 7.652 -7.147 40 HG3 GLN 420 HG3 GLN 420 -6.998 9.208 -7.986 41 HE21 GLN 420 HE21 GLN 420 -3.888 9.713 -6.287 42 HE22 GLN 420 HE22 GLN 420 -4.623 9.175 -7.781 43 H GLN 421 H GLN 421 -10.422 7.129 -4.911 44 HA GLN 421 HA GLN 421 -12.601 9.083 -4.481 45 HB2 GLN 421 HB2 GLN 421 -12.954 6.060 -4.568 46 HB3 GLN 421 HB3 GLN 421 -14.160 7.200 -3.956 47 HG2 GLN 421 HG2 GLN 421 -13.048 7.202 -6.797 48 HG3 GLN 421 HG3 GLN 421 -14.570 6.453 -6.316 49 HE21 GLN 421 HE21 GLN 421 -15.302 9.858 -7.692 50 HE22 GLN 421 HE22 GLN 421 -14.513 8.415 -8.291 51 H ARG 422 H ARG 422 -12.913 9.554 -2.349 52 HA ARG 422 HA ARG 422 -11.705 7.811 -0.284 53 HB2 ARG 422 HB2 ARG 422 -11.071 10.775 -0.589 54 HB3 ARG 422 HB3 ARG 422 -10.574 9.746 0.765 55 HG2 ARG 422 HG2 ARG 422 -9.311 8.295 -0.849 56 HG3 ARG 422 HG3 ARG 422 -9.750 9.420 -2.153 57 HD2 ARG 422 HD2 ARG 422 -8.674 11.268 -0.790 58 HD3 ARG 422 HD3 ARG 422 -8.045 10.008 0.287 59 HE ARG 422 HE ARG 422 -7.458 10.055 -2.651 60 HH11 ARG 422 HH11 ARG 422 -6.338 9.894 0.703 61 HH12 ARG 422 HH12 ARG 422 -4.696 9.499 0.248 62 HH21 ARG 422 HH21 ARG 422 -5.338 9.513 -3.202 63 HH22 ARG 422 HH22 ARG 422 -4.129 9.281 -1.958 64 H ALA 423 H ALA 423 -12.518 8.267 1.862 65 HA ALA 423 HA ALA 423 -15.311 8.770 1.854 66 HB1 ALA 423 HB1 ALA 423 -13.334 8.768 4.170 67 HB2 ALA 423 HB2 ALA 423 -15.103 8.642 4.307 68 HB3 ALA 423 HB3 ALA 423 -14.180 7.341 3.520 69 H GLY 424 H GLY 424 -16.445 10.621 1.890 70 HA2 GLY 424 HA2 GLY 424 -16.954 12.731 2.889 71 HA3 GLY 424 HA3 GLY 424 -15.222 13.046 3.093 72 H ASP 425 H ASP 425 -15.171 11.735 0.115 73 HA ASP 425 HA ASP 425 -15.009 14.137 -1.346 74 HB2 ASP 425 HB2 ASP 425 -15.558 11.291 -2.197 75 HB3 ASP 425 HB3 ASP 425 -15.368 12.611 -3.349 76 H TRP 426 H TRP 426 -16.387 15.043 -3.019 77 HA TRP 426 HA TRP 426 -19.217 14.283 -2.914 78 HB2 TRP 426 HB2 TRP 426 -19.976 16.468 -2.143 79 HB3 TRP 426 HB3 TRP 426 -18.968 15.665 -0.932 80 HD1 TRP 426 HD1 TRP 426 -16.551 16.700 -0.463 81 HE1 TRP 426 HE1 TRP 426 -15.576 19.029 -0.781 82 HE3 TRP 426 HE3 TRP 426 -20.043 18.590 -3.680 83 HZ2 TRP 426 HZ2 TRP 426 -16.217 21.436 -2.269 84 HZ3 TRP 426 HZ3 TRP 426 -19.827 20.904 -4.534 85 HH2 TRP 426 HH2 TRP 426 -17.943 22.337 -3.820 86 H LYS 427 H LYS 427 -20.345 14.898 -4.726 87 HA LYS 427 HA LYS 427 -18.711 15.994 -6.916 88 HB2 LYS 427 HB2 LYS 427 -20.271 13.929 -7.042 89 HB3 LYS 427 HB3 LYS 427 -21.604 15.099 -7.043 90 HG2 LYS 427 HG2 LYS 427 -20.350 16.255 -9.002 91 HG3 LYS 427 HG3 LYS 427 -19.333 14.801 -9.045 92 HD2 LYS 427 HD2 LYS 427 -21.103 14.533 -10.672 93 HD3 LYS 427 HD3 LYS 427 -21.446 13.432 -9.321 94 HE2 LYS 427 HE2 LYS 427 -22.997 15.136 -8.361 95 HE3 LYS 427 HE3 LYS 427 -22.650 16.209 -9.724 96 HZ1 LYS 427 HZ1 LYS 427 -23.894 13.540 -9.907 97 HZ2 LYS 427 HZ2 LYS 427 -24.677 14.975 -10.065 98 HZ3 LYS 427 HZ3 LYS 427 -23.563 14.521 -11.186 99 H CYS 428 H CYS 428 -19.282 17.835 -8.139 100 HA CYS 428 HA CYS 428 -20.305 20.029 -6.666 101 HB2 CYS 428 HB2 CYS 428 -18.682 20.112 -8.579 102 HB3 CYS 428 HB3 CYS 428 -20.025 19.725 -9.677 103 HA PRO 429 HA PRO 429 -24.652 19.228 -7.296 104 HB2 PRO 429 HB2 PRO 429 -25.656 21.548 -6.236 105 HB3 PRO 429 HB3 PRO 429 -24.954 20.244 -5.228 106 HG2 PRO 429 HG2 PRO 429 -23.650 22.809 -6.180 107 HG3 PRO 429 HG3 PRO 429 -23.587 22.064 -4.548 108 HD2 PRO 429 HD2 PRO 429 -21.586 21.768 -6.412 109 HD3 PRO 429 HD3 PRO 429 -21.987 20.492 -5.223 110 H ASN 430 H ASN 430 -22.800 21.758 -8.791 111 HA ASN 430 HA ASN 430 -24.944 23.044 -10.217 112 HB2 ASN 430 HB2 ASN 430 -22.245 23.510 -9.751 113 HB3 ASN 430 HB3 ASN 430 -22.234 23.001 -11.440 114 HD21 ASN 430 HD21 ASN 430 -22.545 26.667 -11.440 115 HD22 ASN 430 HD22 ASN 430 -21.366 25.463 -10.951 116 HA PRO 431 HA PRO 431 -25.508 19.577 -12.979 117 HB2 PRO 431 HB2 PRO 431 -27.254 20.746 -14.770 118 HB3 PRO 431 HB3 PRO 431 -27.734 20.165 -13.142 119 HG2 PRO 431 HG2 PRO 431 -27.081 22.979 -14.037 120 HG3 PRO 431 HG3 PRO 431 -28.401 22.430 -12.956 121 HD2 PRO 431 HD2 PRO 431 -26.053 23.498 -12.026 122 HD3 PRO 431 HD3 PRO 431 -26.954 22.239 -11.125 123 H THR 432 H THR 432 -24.299 22.738 -13.886 124 HA THR 432 HA THR 432 -23.379 21.770 -16.502 125 HB THR 432 HB THR 432 -22.837 23.951 -17.047 126 HG1 THR 432 HG1 THR 432 -22.533 25.547 -15.480 127 HG21 THR 432 HG21 THR 432 -24.772 25.304 -16.458 128 HG22 THR 432 HG22 THR 432 -25.305 23.617 -16.667 129 HG23 THR 432 HG23 THR 432 -25.103 24.298 -15.034 130 H CYS 433 H CYS 433 -22.292 21.491 -13.365 131 HA CYS 433 HA CYS 433 -19.420 21.662 -14.126 132 HB2 CYS 433 HB2 CYS 433 -20.194 23.063 -12.241 133 HB3 CYS 433 HB3 CYS 433 -20.753 21.598 -11.398 134 H GLU 434 H GLU 434 -21.375 19.762 -11.791 135 HA GLU 434 HA GLU 434 -21.237 17.616 -11.096 136 HB2 GLU 434 HB2 GLU 434 -20.905 17.150 -14.075 137 HB3 GLU 434 HB3 GLU 434 -21.267 15.890 -12.876 138 HG2 GLU 434 HG2 GLU 434 -23.290 17.180 -12.181 139 HG3 GLU 434 HG3 GLU 434 -22.965 18.345 -13.476 140 H ASN 435 H ASN 435 -18.563 19.185 -11.497 141 HA ASN 435 HA ASN 435 -16.566 17.177 -11.943 142 HB2 ASN 435 HB2 ASN 435 -16.143 19.624 -12.071 143 HB3 ASN 435 HB3 ASN 435 -16.455 19.757 -10.332 144 HD21 ASN 435 HD21 ASN 435 -13.047 19.293 -9.663 145 HD22 ASN 435 HD22 ASN 435 -14.536 20.167 -9.357 146 H MET 436 H MET 436 -15.413 15.880 -10.478 147 HA MET 436 HA MET 436 -16.823 15.362 -7.949 148 HB2 MET 436 HB2 MET 436 -15.952 13.574 -9.587 149 HB3 MET 436 HB3 MET 436 -14.328 13.987 -8.994 150 HG2 MET 436 HG2 MET 436 -15.109 12.168 -7.638 151 HG3 MET 436 HG3 MET 436 -15.231 13.627 -6.639 152 HE1 MET 436 HE1 MET 436 -16.985 13.677 -5.053 153 HE2 MET 436 HE2 MET 436 -18.403 12.600 -5.061 154 HE3 MET 436 HE3 MET 436 -16.758 11.912 -5.077 155 H ASN 437 H ASN 437 -16.334 16.724 -6.283 156 HA ASN 437 HA ASN 437 -13.646 17.941 -6.189 157 HB2 ASN 437 HB2 ASN 437 -16.134 18.461 -4.535 158 HB3 ASN 437 HB3 ASN 437 -14.643 19.406 -4.485 159 HD21 ASN 437 HD21 ASN 437 -17.467 20.371 -7.132 160 HD22 ASN 437 HD22 ASN 437 -17.704 19.381 -5.701 161 H PHE 438 H PHE 438 -12.262 17.809 -4.441 162 HA PHE 438 HA PHE 438 -12.263 15.274 -3.092 163 HB2 PHE 438 HB2 PHE 438 -10.465 17.696 -2.934 164 HB3 PHE 438 HB3 PHE 438 -10.197 16.242 -1.980 165 HD1 PHE 438 HD1 PHE 438 -8.252 17.454 -3.972 166 HD2 PHE 438 HD2 PHE 438 -11.248 14.387 -4.447 167 HE1 PHE 438 HE1 PHE 438 -6.912 16.408 -5.764 168 HE2 PHE 438 HE2 PHE 438 -9.926 13.389 -6.264 169 HZ PHE 438 HZ PHE 438 -7.757 14.380 -6.927 170 H SER 439 H SER 439 -11.910 14.939 -0.774 171 HA SER 439 HA SER 439 -14.276 15.718 0.546 172 HB2 SER 439 HB2 SER 439 -13.170 13.613 1.015 173 HB3 SER 439 HB3 SER 439 -11.690 14.455 1.530 174 HG SER 439 HG SER 439 -12.986 13.806 3.301 175 H TRP 440 H TRP 440 -11.008 17.120 0.642 176 HA TRP 440 HA TRP 440 -11.595 18.594 3.087 177 HB2 TRP 440 HB2 TRP 440 -9.326 19.597 2.621 178 HB3 TRP 440 HB3 TRP 440 -9.390 17.858 2.902 179 HD1 TRP 440 HD1 TRP 440 -8.681 16.263 0.965 180 HE1 TRP 440 HE1 TRP 440 -7.503 16.587 -1.267 181 HE3 TRP 440 HE3 TRP 440 -9.208 21.322 0.529 182 HZ2 TRP 440 HZ2 TRP 440 -6.765 18.801 -2.988 183 HZ3 TRP 440 HZ3 TRP 440 -8.287 22.508 -1.431 184 HH2 TRP 440 HH2 TRP 440 -7.022 21.264 -3.179 185 H ARG 441 H ARG 441 -12.364 19.137 -0.195 186 HA ARG 441 HA ARG 441 -12.166 22.048 -0.054 187 HB2 ARG 441 HB2 ARG 441 -13.458 20.139 -2.038 188 HB3 ARG 441 HB3 ARG 441 -13.522 21.911 -2.183 189 HG2 ARG 441 HG2 ARG 441 -11.026 21.973 -2.094 190 HG3 ARG 441 HG3 ARG 441 -11.003 20.196 -2.136 191 HD2 ARG 441 HD2 ARG 441 -12.234 20.226 -4.280 192 HD3 ARG 441 HD3 ARG 441 -12.283 21.990 -4.252 193 HE ARG 441 HE ARG 441 -10.049 20.269 -4.985 194 HH11 ARG 441 HH11 ARG 441 -10.935 23.479 -3.788 195 HH12 ARG 441 HH12 ARG 441 -9.445 24.220 -4.325 196 HH21 ARG 441 HH21 ARG 441 -8.117 21.247 -5.653 197 HH22 ARG 441 HH22 ARG 441 -7.847 22.958 -5.385 198 H ASN 442 H ASN 442 -13.899 23.522 0.056 199 HA ASN 442 HA ASN 442 -16.469 22.397 1.081 200 HB2 ASN 442 HB2 ASN 442 -15.091 25.038 1.689 201 HB3 ASN 442 HB3 ASN 442 -16.730 24.623 2.204 202 HD21 ASN 442 HD21 ASN 442 -14.061 23.801 4.844 203 HD22 ASN 442 HD22 ASN 442 -14.268 25.200 3.814 204 H GLU 443 H GLU 443 -14.961 23.850 -1.555 205 HA GLU 443 HA GLU 443 -17.591 24.590 -2.688 206 HB2 GLU 443 HB2 GLU 443 -15.109 26.345 -2.840 207 HB3 GLU 443 HB3 GLU 443 -16.644 26.626 -3.682 208 HG2 GLU 443 HG2 GLU 443 -17.797 26.772 -1.471 209 HG3 GLU 443 HG3 GLU 443 -16.224 26.590 -0.666 210 H CYS 444 H CYS 444 -17.515 24.719 -5.051 211 HA CYS 444 HA CYS 444 -16.244 22.409 -6.121 212 HB2 CYS 444 HB2 CYS 444 -18.396 23.329 -6.913 213 HB3 CYS 444 HB3 CYS 444 -17.550 24.756 -7.549 214 H ASN 445 H ASN 445 -14.658 22.208 -7.744 215 HA ASN 445 HA ASN 445 -12.511 24.191 -7.433 216 HB2 ASN 445 HB2 ASN 445 -12.439 21.552 -7.210 217 HB3 ASN 445 HB3 ASN 445 -12.322 21.592 -8.975 218 HD21 ASN 445 HD21 ASN 445 -8.848 21.517 -7.967 219 HD22 ASN 445 HD22 ASN 445 -10.230 20.497 -8.305 220 H GLN 446 H GLN 446 -15.116 24.039 -9.395 221 HA GLN 446 HA GLN 446 -13.629 24.907 -11.833 222 HB2 GLN 446 HB2 GLN 446 -15.984 22.991 -11.682 223 HB3 GLN 446 HB3 GLN 446 -15.234 23.586 -13.173 224 HG2 GLN 446 HG2 GLN 446 -13.757 21.990 -11.026 225 HG3 GLN 446 HG3 GLN 446 -14.495 21.264 -12.442 226 HE21 GLN 446 HE21 GLN 446 -10.852 21.888 -13.120 227 HE22 GLN 446 HE22 GLN 446 -11.754 21.016 -11.895 228 H CYS 447 H CYS 447 -16.601 24.976 -9.876 229 HA CYS 447 HA CYS 447 -17.358 27.478 -11.294 230 HB2 CYS 447 HB2 CYS 447 -19.732 26.766 -11.143 231 HB3 CYS 447 HB3 CYS 447 -18.758 25.687 -12.163 232 H LYS 448 H LYS 448 -16.325 26.233 -8.458 233 HA LYS 448 HA LYS 448 -16.282 26.963 -6.323 234 HB2 LYS 448 HB2 LYS 448 -17.263 29.559 -7.543 235 HB3 LYS 448 HB3 LYS 448 -16.541 29.364 -5.933 236 HG2 LYS 448 HG2 LYS 448 -14.479 28.427 -6.997 237 HG3 LYS 448 HG3 LYS 448 -15.175 28.764 -8.590 238 HD2 LYS 448 HD2 LYS 448 -14.610 30.823 -6.414 239 HD3 LYS 448 HD3 LYS 448 -13.643 30.575 -7.879 240 HE2 LYS 448 HE2 LYS 448 -16.567 31.438 -7.809 241 HE3 LYS 448 HE3 LYS 448 -15.186 32.506 -8.095 242 HZ1 LYS 448 HZ1 LYS 448 -16.204 31.824 -10.145 243 HZ2 LYS 448 HZ2 LYS 448 -14.677 31.223 -10.059 244 HZ3 LYS 448 HZ3 LYS 448 -15.970 30.235 -9.798 245 H ALA 449 H ALA 449 -18.985 25.929 -7.518 246 HA ALA 449 HA ALA 449 -21.016 27.105 -5.889 247 HB1 ALA 449 HB1 ALA 449 -20.785 24.286 -7.032 248 HB2 ALA 449 HB2 ALA 449 -22.267 25.021 -6.390 249 HB3 ALA 449 HB3 ALA 449 -21.508 25.696 -7.851 250 HA PRO 450 HA PRO 450 -19.717 25.583 -1.968 251 HB2 PRO 450 HB2 PRO 450 -22.056 25.720 -0.536 252 HB3 PRO 450 HB3 PRO 450 -21.120 27.167 -1.036 253 HG2 PRO 450 HG2 PRO 450 -23.559 25.964 -2.357 254 HG3 PRO 450 HG3 PRO 450 -23.196 27.692 -2.029 255 HD2 PRO 450 HD2 PRO 450 -22.787 26.518 -4.479 256 HD3 PRO 450 HD3 PRO 450 -21.737 27.826 -3.863 257 H LYS 451 H LYS 451 -19.661 23.693 -0.731 258 HA LYS 451 HA LYS 451 -20.800 21.303 -1.858 259 HB2 LYS 451 HB2 LYS 451 -18.663 21.242 -0.723 260 HB3 LYS 451 HB3 LYS 451 -19.356 21.876 0.755 261 HG2 LYS 451 HG2 LYS 451 -20.945 19.683 0.473 262 HG3 LYS 451 HG3 LYS 451 -19.520 19.124 -0.407 263 HD2 LYS 451 HD2 LYS 451 -19.653 20.116 2.466 264 HD3 LYS 451 HD3 LYS 451 -19.289 18.469 1.915 265 HE2 LYS 451 HE2 LYS 451 -17.236 19.333 0.792 266 HE3 LYS 451 HE3 LYS 451 -17.617 20.961 1.387 267 HZ1 LYS 451 HZ1 LYS 451 -16.026 19.856 2.782 268 HZ2 LYS 451 HZ2 LYS 451 -17.416 20.122 3.624 269 HZ3 LYS 451 HZ3 LYS 451 -17.056 18.612 3.071 270 HA PRO 452 HA PRO 452 -23.948 21.541 1.790 271 HB2 PRO 452 HB2 PRO 452 -24.106 23.886 3.223 272 HB3 PRO 452 HB3 PRO 452 -23.078 22.498 3.705 273 HG2 PRO 452 HG2 PRO 452 -22.271 25.008 2.203 274 HG3 PRO 452 HG3 PRO 452 -21.436 24.212 3.579 275 HD2 PRO 452 HD2 PRO 452 -20.656 23.826 1.002 276 HD3 PRO 452 HD3 PRO 452 -20.605 22.502 2.210 277 H ASP 453 H ASP 453 -26.064 22.770 1.946 278 HA ASP 453 HA ASP 453 -26.759 23.806 -0.647 279 HB2 ASP 453 HB2 ASP 453 -28.293 23.622 1.962 280 HB3 ASP 453 HB3 ASP 453 -29.001 24.146 0.432 281 H GLY 454 H GLY 454 -25.406 25.335 2.085 282 HA2 GLY 454 HA2 GLY 454 -24.900 27.565 2.442 283 HA3 GLY 454 HA3 GLY 454 -25.669 27.955 0.886 284 H5' U 1 H5' U 1 0.245 18.008 -0.394 285 H5'' U 1 H5'' U 1 0.017 16.499 -1.299 286 H4' U 1 H4' U 1 -1.466 16.510 0.637 287 H3' U 1 H3' U 1 -2.352 15.908 -1.882 288 H2' U 1 H2' U 1 -3.141 18.038 -2.483 289 HO2' U 1 HO2' U 1 -5.280 16.876 -0.996 290 H1' U 1 H1' U 1 -4.316 18.578 0.227 291 H3 U 1 H3 U 1 -2.397 23.064 -0.179 292 H5 U 1 H5 U 1 -4.317 21.817 -3.700 293 H6 U 1 H6 U 1 -4.414 19.586 -2.800 294 H5' G 2 H5' G 2 -2.172 12.050 -1.920 295 H5'' G 2 H5'' G 2 -1.850 13.742 -2.339 296 H4' G 2 H4' G 2 -2.555 12.255 -4.282 297 H3' G 2 H3' G 2 -3.850 14.848 -3.539 298 H2' G 2 H2' G 2 -5.512 14.600 -5.223 299 HO2' G 2 HO2' G 2 -3.955 13.814 -6.835 300 H1' G 2 H1' G 2 -6.037 11.962 -4.870 301 H8 G 2 H8 G 2 -5.239 14.769 -2.246 302 H1 G 2 H1 G 2 -11.215 12.459 -2.167 303 H21 G 2 H21 G 2 -11.482 10.997 -3.802 304 H22 G 2 H22 G 2 -10.166 10.524 -4.858 305 H5' G 3 H5' G 3 -4.706 17.250 -6.961 306 H5'' G 3 H5'' G 3 -5.075 15.518 -6.902 307 H4' G 3 H4' G 3 -4.400 15.334 -9.323 308 H3' G 3 H3' G 3 -3.079 17.654 -9.170 309 H2' G 3 H2' G 3 -4.857 18.926 -8.208 310 HO2' G 3 HO2' G 3 -4.127 19.876 -10.297 311 H1' G 3 H1' G 3 -6.859 17.965 -10.226 312 H8 G 3 H8 G 3 -6.256 19.765 -7.068 313 H1 G 3 H1 G 3 -12.046 17.004 -7.202 314 H21 G 3 H21 G 3 -12.172 15.598 -8.893 315 H22 G 3 H22 G 3 -10.808 15.301 -9.961 316 H5' U 4 H5' U 4 -4.356 20.097 -13.585 317 H5'' U 4 H5'' U 4 -5.387 19.260 -12.408 318 H4' U 4 H4' U 4 -5.382 18.474 -15.341 319 H3' U 4 H3' U 4 -6.758 20.748 -13.936 320 H2' U 4 H2' U 4 -8.837 20.245 -14.910 321 HO2' U 4 HO2' U 4 -7.983 19.957 -17.064 322 H1' U 4 H1' U 4 -8.646 17.494 -14.859 323 H3 U 4 H3 U 4 -11.671 17.720 -11.546 324 H5 U 4 H5 U 4 -8.805 20.553 -10.362 325 H6 U 4 H6 U 4 -7.524 20.011 -12.333 326 H5' G 5 H5' G 5 -5.630 22.337 -13.475 327 H5'' G 5 H5'' G 5 -6.891 23.561 -13.741 328 H4' G 5 H4' G 5 -3.898 24.201 -13.643 329 H3' G 5 H3' G 5 -5.143 23.305 -11.434 330 H2' G 5 H2' G 5 -7.130 24.528 -11.503 331 HO2' G 5 HO2' G 5 -6.928 26.425 -10.215 332 H1' G 5 H1' G 5 -6.076 27.112 -12.455 333 H8 G 5 H8 G 5 -8.983 25.985 -11.618 334 H1 G 5 H1 G 5 -9.474 26.180 -18.013 335 H21 G 5 H21 G 5 -7.444 26.341 -18.930 336 H22 G 5 H22 G 5 -5.993 26.373 -17.948 Start of MODEL 17 1 H1 GLY 414 H1 NGL 414 -13.577 1.956 -13.890 2 H2 GLY 414 H2 NGL 414 -12.079 2.617 -13.764 3 H3 GLY 414 H3 NGL 414 -12.284 1.192 -14.570 4 HA2 GLY 414 HA2 NGL 414 -13.601 2.271 -16.254 5 HA3 GLY 414 HA3 NGL 414 -13.345 3.808 -15.393 6 HA PRO 415 HA PRO 415 -9.829 2.727 -18.416 7 HB2 PRO 415 HB2 PRO 415 -10.532 4.216 -20.609 8 HB3 PRO 415 HB3 PRO 415 -11.102 2.536 -20.347 9 HG2 PRO 415 HG2 PRO 415 -12.557 5.129 -19.758 10 HG3 PRO 415 HG3 PRO 415 -13.186 3.653 -20.564 11 HD2 PRO 415 HD2 PRO 415 -13.595 4.197 -17.897 12 HD3 PRO 415 HD3 PRO 415 -13.412 2.526 -18.512 13 H LEU 416 H LEU 416 -11.389 5.519 -17.090 14 HA LEU 416 HA LEU 416 -9.524 7.518 -18.000 15 HB2 LEU 416 HB2 LEU 416 -11.366 7.490 -15.579 16 HB3 LEU 416 HB3 LEU 416 -10.586 8.919 -16.283 17 HG LEU 416 HG LEU 416 -12.613 7.129 -17.708 18 HD11 LEU 416 HD11 LEU 416 -12.867 9.928 -16.529 19 HD12 LEU 416 HD12 LEU 416 -14.119 9.076 -17.455 20 HD13 LEU 416 HD13 LEU 416 -13.605 8.443 -15.874 21 HD21 LEU 416 HD21 LEU 416 -11.052 8.192 -19.296 22 HD22 LEU 416 HD22 LEU 416 -12.636 8.976 -19.381 23 HD23 LEU 416 HD23 LEU 416 -11.303 9.767 -18.500 24 H GLY 417 H GLY 417 -7.997 8.683 -16.670 25 HA2 GLY 417 HA2 GLY 417 -6.301 6.905 -15.104 26 HA3 GLY 417 HA3 GLY 417 -5.999 8.607 -15.509 27 H SER 418 H SER 418 -9.077 8.644 -14.332 28 HA SER 418 HA SER 418 -8.354 9.893 -11.869 29 HB2 SER 418 HB2 SER 418 -10.401 10.439 -13.106 30 HB3 SER 418 HB3 SER 418 -11.007 8.789 -12.859 31 HG SER 418 HG SER 418 -10.486 10.759 -10.883 32 H GLY 419 H GLY 419 -8.785 9.208 -9.697 33 HA2 GLY 419 HA2 GLY 419 -9.661 6.658 -8.893 34 HA3 GLY 419 HA3 GLY 419 -7.908 6.555 -9.128 35 H GLN 420 H GLN 420 -7.783 6.151 -6.818 36 HA GLN 420 HA GLN 420 -7.424 6.725 -4.659 37 HB2 GLN 420 HB2 GLN 420 -6.728 9.425 -5.882 38 HB3 GLN 420 HB3 GLN 420 -6.253 8.863 -4.266 39 HG2 GLN 420 HG2 GLN 420 -5.467 7.534 -6.890 40 HG3 GLN 420 HG3 GLN 420 -4.438 8.611 -5.939 41 HE21 GLN 420 HE21 GLN 420 -3.586 5.033 -5.136 42 HE22 GLN 420 HE22 GLN 420 -3.634 5.998 -6.597 43 H GLN 421 H GLN 421 -10.181 7.062 -5.665 44 HA GLN 421 HA GLN 421 -11.407 9.385 -4.621 45 HB2 GLN 421 HB2 GLN 421 -12.496 7.860 -6.180 46 HB3 GLN 421 HB3 GLN 421 -12.466 6.556 -4.979 47 HG2 GLN 421 HG2 GLN 421 -13.981 7.794 -3.523 48 HG3 GLN 421 HG3 GLN 421 -13.888 9.220 -4.579 49 HE21 GLN 421 HE21 GLN 421 -17.076 7.744 -5.533 50 HE22 GLN 421 HE22 GLN 421 -16.363 8.713 -4.259 51 H ARG 422 H ARG 422 -12.547 9.756 -2.631 52 HA ARG 422 HA ARG 422 -11.840 7.911 -0.402 53 HB2 ARG 422 HB2 ARG 422 -11.610 10.946 -0.364 54 HB3 ARG 422 HB3 ARG 422 -11.354 9.876 1.021 55 HG2 ARG 422 HG2 ARG 422 -9.478 8.763 -0.207 56 HG3 ARG 422 HG3 ARG 422 -9.724 9.891 -1.560 57 HD2 ARG 422 HD2 ARG 422 -9.413 11.773 0.159 58 HD3 ARG 422 HD3 ARG 422 -8.815 10.524 1.265 59 HE ARG 422 HE ARG 422 -7.517 10.581 -1.369 60 HH11 ARG 422 HH11 ARG 422 -7.477 11.801 1.952 61 HH12 ARG 422 HH12 ARG 422 -5.760 12.125 1.934 62 HH21 ARG 422 HH21 ARG 422 -5.261 10.976 -1.340 63 HH22 ARG 422 HH22 ARG 422 -4.519 11.668 0.084 64 H ALA 423 H ALA 423 -13.291 7.987 1.409 65 HA ALA 423 HA ALA 423 -16.007 8.128 0.498 66 HB1 ALA 423 HB1 ALA 423 -14.853 7.691 3.280 67 HB2 ALA 423 HB2 ALA 423 -16.525 7.349 2.785 68 HB3 ALA 423 HB3 ALA 423 -15.180 6.422 2.077 69 H GLY 424 H GLY 424 -14.026 10.641 1.434 70 HA2 GLY 424 HA2 GLY 424 -16.201 12.142 2.801 71 HA3 GLY 424 HA3 GLY 424 -14.479 12.576 2.774 72 H ASP 425 H ASP 425 -14.984 11.587 -0.298 73 HA ASP 425 HA ASP 425 -14.847 14.181 -1.424 74 HB2 ASP 425 HB2 ASP 425 -15.577 11.506 -2.654 75 HB3 ASP 425 HB3 ASP 425 -15.197 12.965 -3.575 76 H TRP 426 H TRP 426 -16.324 15.171 -3.006 77 HA TRP 426 HA TRP 426 -19.144 14.381 -2.820 78 HB2 TRP 426 HB2 TRP 426 -19.887 16.548 -1.996 79 HB3 TRP 426 HB3 TRP 426 -18.829 15.764 -0.826 80 HD1 TRP 426 HD1 TRP 426 -16.445 16.859 -0.394 81 HE1 TRP 426 HE1 TRP 426 -15.517 19.208 -0.757 82 HE3 TRP 426 HE3 TRP 426 -20.003 18.644 -3.597 83 HZ2 TRP 426 HZ2 TRP 426 -16.207 21.568 -2.275 84 HZ3 TRP 426 HZ3 TRP 426 -19.835 20.946 -4.491 85 HH2 TRP 426 HH2 TRP 426 -17.958 22.416 -3.835 86 H LYS 427 H LYS 427 -20.300 14.957 -4.611 87 HA LYS 427 HA LYS 427 -18.704 16.067 -6.821 88 HB2 LYS 427 HB2 LYS 427 -20.105 13.989 -7.026 89 HB3 LYS 427 HB3 LYS 427 -21.551 14.999 -6.806 90 HG2 LYS 427 HG2 LYS 427 -20.641 16.394 -8.809 91 HG3 LYS 427 HG3 LYS 427 -19.516 15.044 -9.071 92 HD2 LYS 427 HD2 LYS 427 -21.413 14.667 -10.484 93 HD3 LYS 427 HD3 LYS 427 -21.578 13.527 -9.126 94 HE2 LYS 427 HE2 LYS 427 -23.109 15.141 -7.997 95 HE3 LYS 427 HE3 LYS 427 -22.937 16.248 -9.368 96 HZ1 LYS 427 HZ1 LYS 427 -23.901 14.548 -10.768 97 HZ2 LYS 427 HZ2 LYS 427 -24.065 13.532 -9.485 98 HZ3 LYS 427 HZ3 LYS 427 -24.924 14.933 -9.540 99 H CYS 428 H CYS 428 -19.208 17.924 -7.972 100 HA CYS 428 HA CYS 428 -20.294 20.098 -6.548 101 HB2 CYS 428 HB2 CYS 428 -18.672 20.188 -8.448 102 HB3 CYS 428 HB3 CYS 428 -19.982 19.736 -9.563 103 HA PRO 429 HA PRO 429 -24.620 19.240 -7.144 104 HB2 PRO 429 HB2 PRO 429 -25.664 21.579 -6.175 105 HB3 PRO 429 HB3 PRO 429 -24.919 20.335 -5.117 106 HG2 PRO 429 HG2 PRO 429 -23.680 22.882 -6.179 107 HG3 PRO 429 HG3 PRO 429 -23.597 22.207 -4.522 108 HD2 PRO 429 HD2 PRO 429 -21.596 21.869 -6.375 109 HD3 PRO 429 HD3 PRO 429 -21.975 20.635 -5.136 110 H ASN 430 H ASN 430 -22.833 21.760 -8.747 111 HA ASN 430 HA ASN 430 -24.995 22.932 -10.224 112 HB2 ASN 430 HB2 ASN 430 -22.397 23.574 -9.781 113 HB3 ASN 430 HB3 ASN 430 -22.221 22.768 -11.345 114 HD21 ASN 430 HD21 ASN 430 -22.673 26.355 -12.059 115 HD22 ASN 430 HD22 ASN 430 -21.496 25.342 -11.245 116 HA PRO 431 HA PRO 431 -25.446 19.343 -12.964 117 HB2 PRO 431 HB2 PRO 431 -27.213 20.473 -14.754 118 HB3 PRO 431 HB3 PRO 431 -27.695 19.840 -13.152 119 HG2 PRO 431 HG2 PRO 431 -27.116 22.710 -13.939 120 HG3 PRO 431 HG3 PRO 431 -28.467 22.070 -12.942 121 HD2 PRO 431 HD2 PRO 431 -26.243 23.193 -11.849 122 HD3 PRO 431 HD3 PRO 431 -27.076 21.814 -11.065 123 H THR 432 H THR 432 -24.321 22.558 -13.676 124 HA THR 432 HA THR 432 -23.290 21.748 -16.301 125 HB THR 432 HB THR 432 -22.946 23.961 -16.821 126 HG1 THR 432 HG1 THR 432 -21.732 24.587 -15.067 127 HG21 THR 432 HG21 THR 432 -25.376 23.442 -16.441 128 HG22 THR 432 HG22 THR 432 -25.231 24.119 -14.801 129 HG23 THR 432 HG23 THR 432 -24.971 25.158 -16.220 130 H CYS 433 H CYS 433 -22.281 20.980 -13.393 131 HA CYS 433 HA CYS 433 -19.403 21.421 -14.031 132 HB2 CYS 433 HB2 CYS 433 -20.205 22.901 -12.199 133 HB3 CYS 433 HB3 CYS 433 -20.717 21.451 -11.297 134 H GLU 434 H GLU 434 -21.361 19.623 -11.628 135 HA GLU 434 HA GLU 434 -21.246 17.513 -10.847 136 HB2 GLU 434 HB2 GLU 434 -20.915 16.935 -13.808 137 HB3 GLU 434 HB3 GLU 434 -21.301 15.714 -12.571 138 HG2 GLU 434 HG2 GLU 434 -23.314 17.052 -11.929 139 HG3 GLU 434 HG3 GLU 434 -22.958 18.180 -13.246 140 H ASN 435 H ASN 435 -18.560 19.011 -11.200 141 HA ASN 435 HA ASN 435 -16.583 16.969 -11.643 142 HB2 ASN 435 HB2 ASN 435 -16.169 19.410 -11.864 143 HB3 ASN 435 HB3 ASN 435 -16.410 19.591 -10.114 144 HD21 ASN 435 HD21 ASN 435 -13.006 19.045 -9.511 145 HD22 ASN 435 HD22 ASN 435 -14.490 19.879 -9.119 146 H MET 436 H MET 436 -15.583 15.583 -10.209 147 HA MET 436 HA MET 436 -16.816 15.214 -7.581 148 HB2 MET 436 HB2 MET 436 -16.137 13.284 -8.965 149 HB3 MET 436 HB3 MET 436 -14.462 13.864 -8.961 150 HG2 MET 436 HG2 MET 436 -14.167 12.563 -7.163 151 HG3 MET 436 HG3 MET 436 -15.046 13.800 -6.261 152 HE1 MET 436 HE1 MET 436 -17.315 13.628 -5.319 153 HE2 MET 436 HE2 MET 436 -17.989 13.596 -6.968 154 HE3 MET 436 HE3 MET 436 -18.547 12.416 -5.759 155 H ASN 437 H ASN 437 -16.327 16.886 -6.189 156 HA ASN 437 HA ASN 437 -13.628 18.004 -6.126 157 HB2 ASN 437 HB2 ASN 437 -16.090 18.552 -4.440 158 HB3 ASN 437 HB3 ASN 437 -14.600 19.505 -4.410 159 HD21 ASN 437 HD21 ASN 437 -17.420 20.534 -6.996 160 HD22 ASN 437 HD22 ASN 437 -17.648 19.630 -5.510 161 H PHE 438 H PHE 438 -12.201 17.937 -4.373 162 HA PHE 438 HA PHE 438 -12.168 15.468 -2.913 163 HB2 PHE 438 HB2 PHE 438 -10.415 17.930 -2.828 164 HB3 PHE 438 HB3 PHE 438 -10.161 16.534 -1.793 165 HD1 PHE 438 HD1 PHE 438 -11.124 14.568 -4.229 166 HD2 PHE 438 HD2 PHE 438 -8.155 17.647 -3.729 167 HE1 PHE 438 HE1 PHE 438 -9.711 13.500 -5.954 168 HE2 PHE 438 HE2 PHE 438 -6.739 16.555 -5.437 169 HZ PHE 438 HZ PHE 438 -7.515 14.484 -6.555 170 H SER 439 H SER 439 -11.887 15.208 -0.591 171 HA SER 439 HA SER 439 -14.287 16.032 0.647 172 HB2 SER 439 HB2 SER 439 -13.134 13.930 1.158 173 HB3 SER 439 HB3 SER 439 -11.740 14.824 1.796 174 HG SER 439 HG SER 439 -14.386 14.897 2.822 175 H TRP 440 H TRP 440 -11.003 17.416 0.787 176 HA TRP 440 HA TRP 440 -11.623 18.964 3.177 177 HB2 TRP 440 HB2 TRP 440 -9.383 19.995 2.698 178 HB3 TRP 440 HB3 TRP 440 -9.396 18.253 2.978 179 HD1 TRP 440 HD1 TRP 440 -8.656 16.681 1.028 180 HE1 TRP 440 HE1 TRP 440 -7.502 17.040 -1.205 181 HE3 TRP 440 HE3 TRP 440 -9.301 21.730 0.616 182 HZ2 TRP 440 HZ2 TRP 440 -6.845 19.272 -2.940 183 HZ3 TRP 440 HZ3 TRP 440 -8.399 22.947 -1.334 184 HH2 TRP 440 HH2 TRP 440 -7.152 21.732 -3.113 185 H ARG 441 H ARG 441 -12.339 19.399 -0.151 186 HA ARG 441 HA ARG 441 -12.202 22.314 -0.101 187 HB2 ARG 441 HB2 ARG 441 -13.472 20.328 -2.017 188 HB3 ARG 441 HB3 ARG 441 -13.520 22.093 -2.231 189 HG2 ARG 441 HG2 ARG 441 -11.026 22.143 -2.169 190 HG3 ARG 441 HG3 ARG 441 -11.011 20.366 -2.090 191 HD2 ARG 441 HD2 ARG 441 -12.249 20.277 -4.243 192 HD3 ARG 441 HD3 ARG 441 -12.271 22.041 -4.322 193 HE ARG 441 HE ARG 441 -10.071 20.260 -4.975 194 HH11 ARG 441 HH11 ARG 441 -10.896 23.528 -3.923 195 HH12 ARG 441 HH12 ARG 441 -9.398 24.222 -4.507 196 HH21 ARG 441 HH21 ARG 441 -8.135 21.172 -5.708 197 HH22 ARG 441 HH22 ARG 441 -7.829 22.885 -5.521 198 H ASN 442 H ASN 442 -13.895 23.774 0.101 199 HA ASN 442 HA ASN 442 -16.476 22.644 1.079 200 HB2 ASN 442 HB2 ASN 442 -15.126 25.308 1.650 201 HB3 ASN 442 HB3 ASN 442 -16.766 24.876 2.171 202 HD21 ASN 442 HD21 ASN 442 -14.084 24.138 4.826 203 HD22 ASN 442 HD22 ASN 442 -14.316 25.516 3.771 204 H GLU 443 H GLU 443 -14.969 24.007 -1.579 205 HA GLU 443 HA GLU 443 -17.587 24.731 -2.749 206 HB2 GLU 443 HB2 GLU 443 -15.099 26.480 -2.914 207 HB3 GLU 443 HB3 GLU 443 -16.618 26.737 -3.792 208 HG2 GLU 443 HG2 GLU 443 -17.810 26.918 -1.595 209 HG3 GLU 443 HG3 GLU 443 -16.244 26.788 -0.771 210 H CYS 444 H CYS 444 -17.494 24.807 -5.113 211 HA CYS 444 HA CYS 444 -16.246 22.445 -6.098 212 HB2 CYS 444 HB2 CYS 444 -18.392 23.323 -6.914 213 HB3 CYS 444 HB3 CYS 444 -17.559 24.749 -7.580 214 H ASN 445 H ASN 445 -14.620 22.149 -7.627 215 HA ASN 445 HA ASN 445 -12.443 24.070 -7.380 216 HB2 ASN 445 HB2 ASN 445 -12.503 21.397 -7.361 217 HB3 ASN 445 HB3 ASN 445 -12.364 21.595 -9.112 218 HD21 ASN 445 HD21 ASN 445 -8.908 21.279 -8.017 219 HD22 ASN 445 HD22 ASN 445 -10.322 20.338 -8.452 220 H GLN 446 H GLN 446 -15.098 23.989 -9.411 221 HA GLN 446 HA GLN 446 -13.514 25.006 -11.727 222 HB2 GLN 446 HB2 GLN 446 -15.863 23.079 -11.899 223 HB3 GLN 446 HB3 GLN 446 -14.894 23.725 -13.238 224 HG2 GLN 446 HG2 GLN 446 -12.874 22.677 -11.918 225 HG3 GLN 446 HG3 GLN 446 -14.114 21.727 -11.087 226 HE21 GLN 446 HE21 GLN 446 -12.975 19.634 -13.904 227 HE22 GLN 446 HE22 GLN 446 -12.360 20.232 -12.373 228 H CYS 447 H CYS 447 -16.636 24.869 -10.011 229 HA CYS 447 HA CYS 447 -17.387 27.411 -11.392 230 HB2 CYS 447 HB2 CYS 447 -19.738 26.684 -11.198 231 HB3 CYS 447 HB3 CYS 447 -18.769 25.592 -12.208 232 H LYS 448 H LYS 448 -16.325 26.218 -8.524 233 HA LYS 448 HA LYS 448 -16.284 26.987 -6.406 234 HB2 LYS 448 HB2 LYS 448 -17.247 29.578 -7.658 235 HB3 LYS 448 HB3 LYS 448 -16.497 29.400 -6.060 236 HG2 LYS 448 HG2 LYS 448 -14.470 28.420 -7.144 237 HG3 LYS 448 HG3 LYS 448 -15.190 28.735 -8.733 238 HD2 LYS 448 HD2 LYS 448 -14.550 30.815 -6.599 239 HD3 LYS 448 HD3 LYS 448 -13.618 30.531 -8.082 240 HE2 LYS 448 HE2 LYS 448 -16.524 31.452 -7.965 241 HE3 LYS 448 HE3 LYS 448 -15.129 32.485 -8.299 242 HZ1 LYS 448 HZ1 LYS 448 -16.216 31.788 -10.310 243 HZ2 LYS 448 HZ2 LYS 448 -14.692 31.170 -10.250 244 HZ3 LYS 448 HZ3 LYS 448 -15.990 30.204 -9.946 245 H ALA 449 H ALA 449 -19.002 25.963 -7.574 246 HA ALA 449 HA ALA 449 -21.005 27.168 -5.925 247 HB1 ALA 449 HB1 ALA 449 -20.811 24.348 -7.075 248 HB2 ALA 449 HB2 ALA 449 -22.280 25.099 -6.420 249 HB3 ALA 449 HB3 ALA 449 -21.523 25.763 -7.888 250 HA PRO 450 HA PRO 450 -19.696 25.666 -2.026 251 HB2 PRO 450 HB2 PRO 450 -22.040 25.756 -0.591 252 HB3 PRO 450 HB3 PRO 450 -21.126 27.217 -1.090 253 HG2 PRO 450 HG2 PRO 450 -23.551 25.968 -2.406 254 HG3 PRO 450 HG3 PRO 450 -23.218 27.705 -2.091 255 HD2 PRO 450 HD2 PRO 450 -22.786 26.528 -4.532 256 HD3 PRO 450 HD3 PRO 450 -21.754 27.857 -3.918 257 H LYS 451 H LYS 451 -19.609 23.788 -0.756 258 HA LYS 451 HA LYS 451 -20.678 21.360 -1.861 259 HB2 LYS 451 HB2 LYS 451 -18.573 21.349 -0.670 260 HB3 LYS 451 HB3 LYS 451 -19.311 22.020 0.774 261 HG2 LYS 451 HG2 LYS 451 -20.859 19.801 0.545 262 HG3 LYS 451 HG3 LYS 451 -19.429 19.227 -0.320 263 HD2 LYS 451 HD2 LYS 451 -19.560 20.290 2.534 264 HD3 LYS 451 HD3 LYS 451 -19.188 18.636 2.020 265 HE2 LYS 451 HE2 LYS 451 -17.151 19.483 0.856 266 HE3 LYS 451 HE3 LYS 451 -17.522 21.124 1.420 267 HZ1 LYS 451 HZ1 LYS 451 -17.303 20.335 3.666 268 HZ2 LYS 451 HZ2 LYS 451 -16.958 18.811 3.142 269 HZ3 LYS 451 HZ3 LYS 451 -15.922 20.051 2.826 270 HA PRO 452 HA PRO 452 -23.941 21.607 1.686 271 HB2 PRO 452 HB2 PRO 452 -24.179 23.980 3.066 272 HB3 PRO 452 HB3 PRO 452 -23.158 22.611 3.616 273 HG2 PRO 452 HG2 PRO 452 -22.321 25.099 2.100 274 HG3 PRO 452 HG3 PRO 452 -21.529 24.327 3.519 275 HD2 PRO 452 HD2 PRO 452 -20.645 23.916 0.980 276 HD3 PRO 452 HD3 PRO 452 -20.630 22.615 2.209 277 H ASP 453 H ASP 453 -26.079 22.805 1.767 278 HA ASP 453 HA ASP 453 -26.685 23.793 -0.872 279 HB2 ASP 453 HB2 ASP 453 -28.351 23.533 1.653 280 HB3 ASP 453 HB3 ASP 453 -28.991 24.060 0.094 281 H GLY 454 H GLY 454 -25.281 25.389 1.697 282 HA2 GLY 454 HA2 GLY 454 -25.533 27.971 0.526 283 HA3 GLY 454 HA3 GLY 454 -26.672 27.837 1.878 284 H5' U 1 H5' U 1 -0.227 17.683 -1.834 285 H5'' U 1 H5'' U 1 -1.074 19.244 -1.961 286 H4' U 1 H4' U 1 -1.160 17.484 0.533 287 H3' U 1 H3' U 1 -2.269 16.604 -1.778 288 H2' U 1 H2' U 1 -3.235 18.634 -2.456 289 HO2' U 1 HO2' U 1 -5.207 17.349 -0.848 290 H1' U 1 H1' U 1 -4.387 19.228 0.252 291 H3 U 1 H3 U 1 -2.829 23.820 -0.381 292 H5 U 1 H5 U 1 -4.634 22.268 -3.841 293 H6 U 1 H6 U 1 -4.579 20.081 -2.831 294 H5' G 2 H5' G 2 -1.681 12.913 -1.568 295 H5'' G 2 H5'' G 2 -1.721 14.567 -2.203 296 H4' G 2 H4' G 2 -2.393 12.622 -3.797 297 H3' G 2 H3' G 2 -3.866 15.207 -3.391 298 H2' G 2 H2' G 2 -5.582 14.508 -4.910 299 HO2' G 2 HO2' G 2 -3.992 13.505 -6.381 300 H1' G 2 H1' G 2 -5.853 11.971 -3.972 301 H8 G 2 H8 G 2 -5.059 15.119 -1.771 302 H1 G 2 H1 G 2 -11.091 12.948 -1.640 303 H21 G 2 H21 G 2 -11.365 11.434 -3.245 304 H22 G 2 H22 G 2 -10.008 10.835 -4.181 305 H5' G 3 H5' G 3 -4.222 14.321 -7.726 306 H5'' G 3 H5'' G 3 -2.785 15.231 -8.235 307 H4' G 3 H4' G 3 -4.589 15.262 -9.941 308 H3' G 3 H3' G 3 -3.012 17.412 -9.145 309 H2' G 3 H2' G 3 -4.701 18.353 -7.724 310 HO2' G 3 HO2' G 3 -4.147 19.928 -9.334 311 H1' G 3 H1' G 3 -6.667 17.627 -9.926 312 H8 G 3 H8 G 3 -6.268 19.569 -6.860 313 H1 G 3 H1 G 3 -12.088 16.903 -7.144 314 H21 G 3 H21 G 3 -12.122 15.303 -8.661 315 H22 G 3 H22 G 3 -10.723 14.900 -9.631 316 H5' U 4 H5' U 4 -4.755 14.998 -12.788 317 H5'' U 4 H5'' U 4 -3.960 15.107 -14.371 318 H4' U 4 H4' U 4 -6.245 15.122 -14.920 319 H3' U 4 H3' U 4 -5.015 17.819 -14.974 320 H2' U 4 H2' U 4 -6.813 18.856 -14.043 321 HO2' U 4 HO2' U 4 -7.392 19.090 -16.280 322 H1' U 4 H1' U 4 -8.544 16.423 -14.510 323 H3 U 4 H3 U 4 -11.788 17.620 -11.646 324 H5 U 4 H5 U 4 -8.474 19.778 -10.223 325 H6 U 4 H6 U 4 -7.136 18.768 -11.967 326 H5' G 5 H5' G 5 -5.797 13.971 -18.662 327 H5'' G 5 H5'' G 5 -6.875 14.220 -17.272 328 H4' G 5 H4' G 5 -4.604 12.186 -17.257 329 H3' G 5 H3' G 5 -6.624 11.930 -19.043 330 H2' G 5 H2' G 5 -8.389 12.406 -17.522 331 HO2' G 5 HO2' G 5 -8.848 10.374 -18.479 332 H1' G 5 H1' G 5 -7.176 10.542 -15.482 333 H8 G 5 H8 G 5 -10.168 12.147 -16.110 334 H1 G 5 H1 G 5 -8.129 14.179 -10.376 335 H21 G 5 H21 G 5 -5.979 13.711 -10.124 336 H22 G 5 H22 G 5 -5.046 12.930 -11.383 Start of MODEL 18 1 H1 GLY 414 H1 NGL 414 -6.161 -6.760 -0.250 2 H2 GLY 414 H2 NGL 414 -7.112 -5.781 -1.171 3 H3 GLY 414 H3 NGL 414 -6.687 -7.278 -1.721 4 HA2 GLY 414 HA2 NGL 414 -7.921 -8.335 0.034 5 HA3 GLY 414 HA3 NGL 414 -8.391 -6.724 0.611 6 HA PRO 415 HA PRO 415 -11.227 -8.487 -2.801 7 HB2 PRO 415 HB2 PRO 415 -13.366 -9.310 -1.276 8 HB3 PRO 415 HB3 PRO 415 -11.973 -10.364 -1.682 9 HG2 PRO 415 HG2 PRO 415 -12.477 -8.811 0.870 10 HG3 PRO 415 HG3 PRO 415 -11.889 -10.492 0.684 11 HD2 PRO 415 HD2 PRO 415 -10.210 -8.377 1.144 12 HD3 PRO 415 HD3 PRO 415 -9.725 -9.786 0.145 13 H LEU 416 H LEU 416 -11.348 -6.241 -0.173 14 HA LEU 416 HA LEU 416 -13.881 -5.009 -0.864 15 HB2 LEU 416 HB2 LEU 416 -11.540 -3.955 0.776 16 HB3 LEU 416 HB3 LEU 416 -13.183 -3.294 0.754 17 HG LEU 416 HG LEU 416 -12.410 -6.095 1.695 18 HD11 LEU 416 HD11 LEU 416 -13.292 -3.613 3.226 19 HD12 LEU 416 HD12 LEU 416 -12.968 -5.217 3.929 20 HD13 LEU 416 HD13 LEU 416 -11.646 -4.285 3.197 21 HD21 LEU 416 HD21 LEU 416 -14.691 -6.051 0.783 22 HD22 LEU 416 HD22 LEU 416 -14.755 -6.147 2.551 23 HD23 LEU 416 HD23 LEU 416 -15.068 -4.594 1.735 24 H GLY 417 H GLY 417 -10.897 -5.097 -2.435 25 HA2 GLY 417 HA2 GLY 417 -10.158 -3.948 -4.289 26 HA3 GLY 417 HA3 GLY 417 -11.624 -2.958 -4.241 27 H SER 418 H SER 418 -9.767 -1.396 -4.927 28 HA SER 418 HA SER 418 -9.181 0.264 -2.601 29 HB2 SER 418 HB2 SER 418 -7.253 -1.289 -2.615 30 HB3 SER 418 HB3 SER 418 -6.930 -0.869 -4.313 31 HG SER 418 HG SER 418 -6.797 0.821 -2.040 32 H GLY 419 H GLY 419 -8.370 2.423 -3.277 33 HA2 GLY 419 HA2 GLY 419 -8.113 3.214 -5.992 34 HA3 GLY 419 HA3 GLY 419 -9.791 3.466 -5.482 35 H GLN 420 H GLN 420 -8.500 5.692 -6.186 36 HA GLN 420 HA GLN 420 -7.043 6.922 -3.991 37 HB2 GLN 420 HB2 GLN 420 -8.155 7.940 -6.624 38 HB3 GLN 420 HB3 GLN 420 -7.270 8.971 -5.480 39 HG2 GLN 420 HG2 GLN 420 -5.294 7.591 -5.633 40 HG3 GLN 420 HG3 GLN 420 -6.144 6.370 -6.595 41 HE21 GLN 420 HE21 GLN 420 -4.158 8.309 -9.025 42 HE22 GLN 420 HE22 GLN 420 -3.886 7.172 -7.723 43 H GLN 421 H GLN 421 -10.359 6.337 -4.511 44 HA GLN 421 HA GLN 421 -11.536 8.794 -3.743 45 HB2 GLN 421 HB2 GLN 421 -12.488 5.921 -3.411 46 HB3 GLN 421 HB3 GLN 421 -13.473 7.348 -3.057 47 HG2 GLN 421 HG2 GLN 421 -14.076 6.778 -5.258 48 HG3 GLN 421 HG3 GLN 421 -12.978 8.144 -5.439 49 HE21 GLN 421 HE21 GLN 421 -11.632 6.036 -8.013 50 HE22 GLN 421 HE22 GLN 421 -12.767 7.326 -7.691 51 H ARG 422 H ARG 422 -12.420 9.515 -1.736 52 HA ARG 422 HA ARG 422 -11.367 8.180 0.697 53 HB2 ARG 422 HB2 ARG 422 -11.063 11.149 0.094 54 HB3 ARG 422 HB3 ARG 422 -10.654 10.348 1.612 55 HG2 ARG 422 HG2 ARG 422 -9.024 8.889 0.286 56 HG3 ARG 422 HG3 ARG 422 -9.329 9.971 -1.099 57 HD2 ARG 422 HD2 ARG 422 -8.694 11.910 0.420 58 HD3 ARG 422 HD3 ARG 422 -8.184 10.713 1.620 59 HE ARG 422 HE ARG 422 -6.941 10.255 -0.959 60 HH11 ARG 422 HH11 ARG 422 -6.809 12.220 1.972 61 HH12 ARG 422 HH12 ARG 422 -5.093 12.541 1.828 62 HH21 ARG 422 HH21 ARG 422 -4.672 10.671 -1.102 63 HH22 ARG 422 HH22 ARG 422 -3.908 11.696 0.092 64 H ALA 423 H ALA 423 -12.531 8.631 2.613 65 HA ALA 423 HA ALA 423 -15.337 8.937 2.235 66 HB1 ALA 423 HB1 ALA 423 -13.648 9.190 4.763 67 HB2 ALA 423 HB2 ALA 423 -15.412 8.974 4.707 68 HB3 ALA 423 HB3 ALA 423 -14.347 7.687 4.107 69 H GLY 424 H GLY 424 -16.559 10.722 2.024 70 HA2 GLY 424 HA2 GLY 424 -17.220 12.897 2.813 71 HA3 GLY 424 HA3 GLY 424 -15.511 13.304 3.079 72 H ASP 425 H ASP 425 -15.296 11.693 0.241 73 HA ASP 425 HA ASP 425 -15.041 13.925 -1.446 74 HB2 ASP 425 HB2 ASP 425 -15.659 11.025 -2.032 75 HB3 ASP 425 HB3 ASP 425 -15.346 12.215 -3.299 76 H TRP 426 H TRP 426 -16.360 14.864 -3.086 77 HA TRP 426 HA TRP 426 -19.213 14.157 -3.055 78 HB2 TRP 426 HB2 TRP 426 -19.937 16.348 -2.294 79 HB3 TRP 426 HB3 TRP 426 -18.945 15.546 -1.070 80 HD1 TRP 426 HD1 TRP 426 -16.478 16.546 -0.653 81 HE1 TRP 426 HE1 TRP 426 -15.504 18.881 -0.955 82 HE3 TRP 426 HE3 TRP 426 -20.029 18.491 -3.763 83 HZ2 TRP 426 HZ2 TRP 426 -16.163 21.302 -2.406 84 HZ3 TRP 426 HZ3 TRP 426 -19.824 20.807 -4.600 85 HH2 TRP 426 HH2 TRP 426 -17.912 22.224 -3.923 86 H LYS 427 H LYS 427 -20.354 14.903 -4.834 87 HA LYS 427 HA LYS 427 -18.658 15.949 -7.017 88 HB2 LYS 427 HB2 LYS 427 -20.232 13.890 -7.163 89 HB3 LYS 427 HB3 LYS 427 -21.552 15.071 -7.194 90 HG2 LYS 427 HG2 LYS 427 -20.246 16.208 -9.132 91 HG3 LYS 427 HG3 LYS 427 -19.252 14.734 -9.154 92 HD2 LYS 427 HD2 LYS 427 -21.007 14.479 -10.808 93 HD3 LYS 427 HD3 LYS 427 -21.410 13.413 -9.446 94 HE2 LYS 427 HE2 LYS 427 -22.932 15.183 -8.552 95 HE3 LYS 427 HE3 LYS 427 -22.518 16.216 -9.926 96 HZ1 LYS 427 HZ1 LYS 427 -23.839 13.590 -10.079 97 HZ2 LYS 427 HZ2 LYS 427 -24.560 15.051 -10.298 98 HZ3 LYS 427 HZ3 LYS 427 -23.435 14.515 -11.375 99 H CYS 428 H CYS 428 -19.237 17.806 -8.245 100 HA CYS 428 HA CYS 428 -20.243 19.987 -6.750 101 HB2 CYS 428 HB2 CYS 428 -18.646 20.111 -8.667 102 HB3 CYS 428 HB3 CYS 428 -19.980 19.695 -9.768 103 HA PRO 429 HA PRO 429 -24.577 19.145 -7.302 104 HB2 PRO 429 HB2 PRO 429 -25.602 21.407 -6.149 105 HB3 PRO 429 HB3 PRO 429 -24.819 20.098 -5.196 106 HG2 PRO 429 HG2 PRO 429 -23.623 22.716 -6.137 107 HG3 PRO 429 HG3 PRO 429 -23.498 21.938 -4.521 108 HD2 PRO 429 HD2 PRO 429 -21.536 21.718 -6.440 109 HD3 PRO 429 HD3 PRO 429 -21.886 20.413 -5.270 110 H ASN 430 H ASN 430 -22.807 21.727 -8.793 111 HA ASN 430 HA ASN 430 -25.009 23.028 -10.125 112 HB2 ASN 430 HB2 ASN 430 -22.350 23.565 -9.704 113 HB3 ASN 430 HB3 ASN 430 -22.303 23.003 -11.378 114 HD21 ASN 430 HD21 ASN 430 -22.731 26.671 -11.468 115 HD22 ASN 430 HD22 ASN 430 -21.530 25.537 -10.888 116 HA PRO 431 HA PRO 431 -25.534 19.653 -13.074 117 HB2 PRO 431 HB2 PRO 431 -27.357 20.887 -14.734 118 HB3 PRO 431 HB3 PRO 431 -27.788 20.157 -13.155 119 HG2 PRO 431 HG2 PRO 431 -27.245 23.064 -13.808 120 HG3 PRO 431 HG3 PRO 431 -28.547 22.370 -12.785 121 HD2 PRO 431 HD2 PRO 431 -26.249 23.436 -11.744 122 HD3 PRO 431 HD3 PRO 431 -27.074 22.045 -10.976 123 H THR 432 H THR 432 -24.458 22.919 -13.679 124 HA THR 432 HA THR 432 -23.546 22.268 -16.390 125 HB THR 432 HB THR 432 -23.125 24.521 -16.713 126 HG1 THR 432 HG1 THR 432 -22.859 25.958 -14.994 127 HG21 THR 432 HG21 THR 432 -25.363 24.541 -14.640 128 HG22 THR 432 HG22 THR 432 -25.098 25.715 -15.950 129 HG23 THR 432 HG23 THR 432 -25.559 24.045 -16.338 130 H CYS 433 H CYS 433 -22.408 21.492 -13.427 131 HA CYS 433 HA CYS 433 -19.552 21.845 -14.221 132 HB2 CYS 433 HB2 CYS 433 -20.281 23.206 -12.274 133 HB3 CYS 433 HB3 CYS 433 -20.771 21.707 -11.441 134 H GLU 434 H GLU 434 -21.455 19.899 -11.884 135 HA GLU 434 HA GLU 434 -21.322 17.739 -11.238 136 HB2 GLU 434 HB2 GLU 434 -21.022 17.328 -14.233 137 HB3 GLU 434 HB3 GLU 434 -21.385 16.046 -13.056 138 HG2 GLU 434 HG2 GLU 434 -23.391 17.319 -12.311 139 HG3 GLU 434 HG3 GLU 434 -23.062 18.534 -13.559 140 H ASN 435 H ASN 435 -18.644 19.306 -11.679 141 HA ASN 435 HA ASN 435 -16.662 17.287 -12.175 142 HB2 ASN 435 HB2 ASN 435 -16.195 19.696 -12.372 143 HB3 ASN 435 HB3 ASN 435 -16.567 19.917 -10.654 144 HD21 ASN 435 HD21 ASN 435 -13.223 19.428 -9.770 145 HD22 ASN 435 HD22 ASN 435 -14.738 20.274 -9.536 146 H MET 436 H MET 436 -15.461 16.003 -10.703 147 HA MET 436 HA MET 436 -16.802 15.529 -8.135 148 HB2 MET 436 HB2 MET 436 -15.842 13.730 -9.728 149 HB3 MET 436 HB3 MET 436 -14.250 14.210 -9.109 150 HG2 MET 436 HG2 MET 436 -15.018 12.391 -7.731 151 HG3 MET 436 HG3 MET 436 -15.173 13.866 -6.771 152 HE1 MET 436 HE1 MET 436 -16.861 13.433 -5.075 153 HE2 MET 436 HE2 MET 436 -18.282 12.375 -5.274 154 HE3 MET 436 HE3 MET 436 -16.640 11.708 -5.448 155 H ASN 437 H ASN 437 -16.042 16.196 -6.146 156 HA ASN 437 HA ASN 437 -13.513 17.774 -6.161 157 HB2 ASN 437 HB2 ASN 437 -16.064 18.298 -4.602 158 HB3 ASN 437 HB3 ASN 437 -14.583 19.247 -4.490 159 HD21 ASN 437 HD21 ASN 437 -17.298 20.141 -7.307 160 HD22 ASN 437 HD22 ASN 437 -17.593 19.086 -5.934 161 H PHE 438 H PHE 438 -12.161 17.610 -4.376 162 HA PHE 438 HA PHE 438 -12.300 15.089 -2.996 163 HB2 PHE 438 HB2 PHE 438 -10.391 17.430 -2.776 164 HB3 PHE 438 HB3 PHE 438 -10.203 15.918 -1.900 165 HD1 PHE 438 HD1 PHE 438 -8.384 17.330 -4.101 166 HD2 PHE 438 HD2 PHE 438 -11.167 14.038 -4.196 167 HE1 PHE 438 HE1 PHE 438 -7.121 16.302 -5.953 168 HE2 PHE 438 HE2 PHE 438 -9.926 13.052 -6.083 169 HZ PHE 438 HZ PHE 438 -7.893 14.172 -6.963 170 H SER 439 H SER 439 -12.035 14.797 -0.654 171 HA SER 439 HA SER 439 -14.423 15.695 0.544 172 HB2 SER 439 HB2 SER 439 -13.585 14.517 2.533 173 HB3 SER 439 HB3 SER 439 -13.259 13.558 1.068 174 HG SER 439 HG SER 439 -11.146 14.222 1.128 175 H TRP 440 H TRP 440 -11.171 17.071 0.648 176 HA TRP 440 HA TRP 440 -11.791 18.628 3.051 177 HB2 TRP 440 HB2 TRP 440 -9.453 19.521 2.620 178 HB3 TRP 440 HB3 TRP 440 -9.629 17.805 3.012 179 HD1 TRP 440 HD1 TRP 440 -8.902 16.050 1.233 180 HE1 TRP 440 HE1 TRP 440 -7.634 16.158 -0.967 181 HE3 TRP 440 HE3 TRP 440 -9.195 21.085 0.388 182 HZ2 TRP 440 HZ2 TRP 440 -6.803 18.179 -2.860 183 HZ3 TRP 440 HZ3 TRP 440 -8.174 22.070 -1.622 184 HH2 TRP 440 HH2 TRP 440 -6.918 20.637 -3.235 185 H ARG 441 H ARG 441 -12.362 19.063 -0.288 186 HA ARG 441 HA ARG 441 -12.136 21.967 -0.241 187 HB2 ARG 441 HB2 ARG 441 -13.455 20.019 -2.166 188 HB3 ARG 441 HB3 ARG 441 -13.481 21.782 -2.375 189 HG2 ARG 441 HG2 ARG 441 -10.981 21.788 -2.254 190 HG3 ARG 441 HG3 ARG 441 -11.015 20.007 -2.276 191 HD2 ARG 441 HD2 ARG 441 -12.225 20.055 -4.430 192 HD3 ARG 441 HD3 ARG 441 -12.240 21.818 -4.413 193 HE ARG 441 HE ARG 441 -10.046 20.070 -5.161 194 HH11 ARG 441 HH11 ARG 441 -10.861 23.284 -3.933 195 HH12 ARG 441 HH12 ARG 441 -9.330 23.985 -4.415 196 HH21 ARG 441 HH21 ARG 441 -8.055 20.996 -5.749 197 HH22 ARG 441 HH22 ARG 441 -7.749 22.696 -5.466 198 H ASN 442 H ASN 442 -13.793 23.469 0.020 199 HA ASN 442 HA ASN 442 -16.387 22.390 1.024 200 HB2 ASN 442 HB2 ASN 442 -14.975 25.027 1.555 201 HB3 ASN 442 HB3 ASN 442 -16.614 24.638 2.107 202 HD21 ASN 442 HD21 ASN 442 -14.001 23.877 4.773 203 HD22 ASN 442 HD22 ASN 442 -14.281 25.282 3.761 204 H GLU 443 H GLU 443 -14.900 23.752 -1.665 205 HA GLU 443 HA GLU 443 -17.528 24.519 -2.785 206 HB2 GLU 443 HB2 GLU 443 -15.029 26.251 -2.950 207 HB3 GLU 443 HB3 GLU 443 -16.554 26.536 -3.814 208 HG2 GLU 443 HG2 GLU 443 -17.731 26.731 -1.628 209 HG3 GLU 443 HG3 GLU 443 -16.182 26.519 -0.789 210 H CYS 444 H CYS 444 -17.486 24.626 -5.141 211 HA CYS 444 HA CYS 444 -16.231 22.324 -6.243 212 HB2 CYS 444 HB2 CYS 444 -18.380 23.270 -7.017 213 HB3 CYS 444 HB3 CYS 444 -17.528 24.703 -7.625 214 H ASN 445 H ASN 445 -14.598 22.128 -7.815 215 HA ASN 445 HA ASN 445 -12.437 24.053 -7.447 216 HB2 ASN 445 HB2 ASN 445 -12.502 21.375 -7.610 217 HB3 ASN 445 HB3 ASN 445 -12.286 21.714 -9.330 218 HD21 ASN 445 HD21 ASN 445 -8.882 21.334 -8.088 219 HD22 ASN 445 HD22 ASN 445 -10.277 20.397 -8.601 220 H GLN 446 H GLN 446 -15.093 24.082 -9.471 221 HA GLN 446 HA GLN 446 -13.527 25.253 -11.730 222 HB2 GLN 446 HB2 GLN 446 -15.812 23.262 -11.999 223 HB3 GLN 446 HB3 GLN 446 -14.894 24.029 -13.312 224 HG2 GLN 446 HG2 GLN 446 -12.808 22.991 -12.088 225 HG3 GLN 446 HG3 GLN 446 -13.992 21.952 -11.293 226 HE21 GLN 446 HE21 GLN 446 -12.880 20.015 -14.219 227 HE22 GLN 446 HE22 GLN 446 -12.273 20.534 -12.660 228 H CYS 447 H CYS 447 -16.626 24.984 -10.008 229 HA CYS 447 HA CYS 447 -17.453 27.549 -11.296 230 HB2 CYS 447 HB2 CYS 447 -19.781 26.762 -11.168 231 HB3 CYS 447 HB3 CYS 447 -18.782 25.668 -12.148 232 H LYS 448 H LYS 448 -16.345 26.277 -8.486 233 HA LYS 448 HA LYS 448 -16.282 26.995 -6.350 234 HB2 LYS 448 HB2 LYS 448 -17.468 29.563 -7.462 235 HB3 LYS 448 HB3 LYS 448 -16.603 29.380 -5.931 236 HG2 LYS 448 HG2 LYS 448 -15.455 28.985 -8.731 237 HG3 LYS 448 HG3 LYS 448 -15.124 30.332 -7.629 238 HD2 LYS 448 HD2 LYS 448 -14.330 27.418 -7.273 239 HD3 LYS 448 HD3 LYS 448 -13.255 28.795 -7.546 240 HE2 LYS 448 HE2 LYS 448 -15.006 28.365 -5.089 241 HE3 LYS 448 HE3 LYS 448 -13.260 28.093 -5.173 242 HZ1 LYS 448 HZ1 LYS 448 -14.591 30.687 -5.578 243 HZ2 LYS 448 HZ2 LYS 448 -13.780 30.226 -4.231 244 HZ3 LYS 448 HZ3 LYS 448 -12.970 30.417 -5.653 245 H ALA 449 H ALA 449 -18.990 25.895 -7.532 246 HA ALA 449 HA ALA 449 -21.033 26.992 -5.852 247 HB1 ALA 449 HB1 ALA 449 -20.753 24.206 -7.044 248 HB2 ALA 449 HB2 ALA 449 -22.252 24.912 -6.390 249 HB3 ALA 449 HB3 ALA 449 -21.500 25.612 -7.840 250 HA PRO 450 HA PRO 450 -19.632 25.426 -1.991 251 HB2 PRO 450 HB2 PRO 450 -21.938 25.550 -0.505 252 HB3 PRO 450 HB3 PRO 450 -21.002 26.996 -1.001 253 HG2 PRO 450 HG2 PRO 450 -23.480 25.818 -2.282 254 HG3 PRO 450 HG3 PRO 450 -23.111 27.539 -1.942 255 HD2 PRO 450 HD2 PRO 450 -22.757 26.384 -4.417 256 HD3 PRO 450 HD3 PRO 450 -21.695 27.695 -3.809 257 H LYS 451 H LYS 451 -19.543 23.525 -0.782 258 HA LYS 451 HA LYS 451 -20.690 21.151 -1.914 259 HB2 LYS 451 HB2 LYS 451 -18.547 21.070 -0.805 260 HB3 LYS 451 HB3 LYS 451 -19.217 21.704 0.686 261 HG2 LYS 451 HG2 LYS 451 -20.817 19.521 0.426 262 HG3 LYS 451 HG3 LYS 451 -19.409 18.953 -0.478 263 HD2 LYS 451 HD2 LYS 451 -19.483 19.937 2.398 264 HD3 LYS 451 HD3 LYS 451 -19.115 18.292 1.830 265 HE2 LYS 451 HE2 LYS 451 -17.103 19.169 0.663 266 HE3 LYS 451 HE3 LYS 451 -17.464 20.793 1.291 267 HZ1 LYS 451 HZ1 LYS 451 -15.843 19.660 2.625 268 HZ2 LYS 451 HZ2 LYS 451 -17.207 19.926 3.507 269 HZ3 LYS 451 HZ3 LYS 451 -16.873 18.419 2.930 270 HA PRO 452 HA PRO 452 -23.814 21.343 1.760 271 HB2 PRO 452 HB2 PRO 452 -23.964 23.668 3.225 272 HB3 PRO 452 HB3 PRO 452 -22.931 22.272 3.677 273 HG2 PRO 452 HG2 PRO 452 -22.139 24.810 2.220 274 HG3 PRO 452 HG3 PRO 452 -21.285 23.984 3.565 275 HD2 PRO 452 HD2 PRO 452 -20.536 23.654 0.962 276 HD3 PRO 452 HD3 PRO 452 -20.454 22.316 2.146 277 H ASP 453 H ASP 453 -25.935 22.533 1.944 278 HA ASP 453 HA ASP 453 -26.629 23.635 -0.621 279 HB2 ASP 453 HB2 ASP 453 -28.187 23.289 1.959 280 HB3 ASP 453 HB3 ASP 453 -28.892 23.904 0.459 281 H GLY 454 H GLY 454 -25.159 25.128 1.998 282 HA2 GLY 454 HA2 GLY 454 -25.347 27.735 0.912 283 HA3 GLY 454 HA3 GLY 454 -26.532 27.598 2.223 284 H5' U 1 H5' U 1 -3.349 16.407 3.332 285 H5'' U 1 H5'' U 1 -2.737 18.053 3.045 286 H4' U 1 H4' U 1 -5.279 16.926 1.783 287 H3' U 1 H3' U 1 -2.409 17.017 0.837 288 H2' U 1 H2' U 1 -3.177 17.476 -1.353 289 HO2' U 1 HO2' U 1 -5.287 16.981 -1.993 290 H1' U 1 H1' U 1 -5.480 18.899 -0.548 291 H3 U 1 H3 U 1 -0.957 21.605 -0.014 292 H5 U 1 H5 U 1 -3.422 21.775 -3.415 293 H6 U 1 H6 U 1 -4.725 19.959 -2.486 294 H5' G 2 H5' G 2 -2.068 12.419 -1.826 295 H5'' G 2 H5'' G 2 -1.543 13.843 -2.748 296 H4' G 2 H4' G 2 -2.720 12.347 -4.229 297 H3' G 2 H3' G 2 -4.304 14.804 -3.455 298 H2' G 2 H2' G 2 -6.037 14.066 -4.945 299 HO2' G 2 HO2' G 2 -4.529 13.313 -6.604 300 H1' G 2 H1' G 2 -5.997 11.451 -4.142 301 H8 G 2 H8 G 2 -5.294 14.298 -1.598 302 H1 G 2 H1 G 2 -11.375 12.313 -1.944 303 H21 G 2 H21 G 2 -11.630 10.980 -3.698 304 H22 G 2 H22 G 2 -10.279 10.518 -4.718 305 H5' G 3 H5' G 3 -5.027 14.054 -8.088 306 H5'' G 3 H5'' G 3 -3.385 14.723 -8.137 307 H4' G 3 H4' G 3 -4.670 15.178 -10.209 308 H3' G 3 H3' G 3 -3.026 16.931 -8.846 309 H2' G 3 H2' G 3 -4.749 18.064 -7.675 310 HO2' G 3 HO2' G 3 -3.693 19.641 -9.001 311 H1' G 3 H1' G 3 -6.497 18.015 -10.136 312 H8 G 3 H8 G 3 -6.259 19.544 -6.994 313 H1 G 3 H1 G 3 -12.051 16.829 -7.469 314 H21 G 3 H21 G 3 -12.055 15.320 -9.089 315 H22 G 3 H22 G 3 -10.633 14.983 -10.051 316 H5' U 4 H5' U 4 -4.057 16.465 -14.507 317 H5'' U 4 H5'' U 4 -4.809 17.560 -13.327 318 H4' U 4 H4' U 4 -6.014 14.899 -14.175 319 H3' U 4 H3' U 4 -6.037 17.552 -15.463 320 H2' U 4 H2' U 4 -8.059 18.201 -14.672 321 HO2' U 4 HO2' U 4 -8.815 17.137 -16.597 322 H1' U 4 H1' U 4 -8.771 15.469 -13.642 323 H3 U 4 H3 U 4 -12.131 17.649 -11.509 324 H5 U 4 H5 U 4 -8.716 19.885 -10.504 325 H6 U 4 H6 U 4 -7.432 18.489 -12.010 326 H5' G 5 H5' G 5 -2.964 14.388 -15.534 327 H5'' G 5 H5'' G 5 -3.191 13.447 -17.022 328 H4' G 5 H4' G 5 -2.437 11.967 -15.241 329 H3' G 5 H3' G 5 -5.251 11.679 -16.259 330 H2' G 5 H2' G 5 -5.741 9.976 -14.688 331 HO2' G 5 HO2' G 5 -3.736 8.834 -15.015 332 H1' G 5 H1' G 5 -4.416 11.031 -12.541 333 H8 G 5 H8 G 5 -6.858 12.353 -15.282 334 H1 G 5 H1 G 5 -8.773 13.169 -9.217 335 H21 G 5 H21 G 5 -7.226 12.413 -7.824 336 H22 G 5 H22 G 5 -5.704 11.763 -8.393 Start of MODEL 19 1 H1 GLY 414 H1 NGL 414 -5.920 0.593 -22.665 2 H2 GLY 414 H2 NGL 414 -7.505 0.316 -22.317 3 H3 GLY 414 H3 NGL 414 -6.327 -0.291 -21.338 4 HA2 GLY 414 HA2 NGL 414 -6.953 2.552 -21.740 5 HA3 GLY 414 HA3 NGL 414 -7.353 1.593 -20.298 6 HA PRO 415 HA PRO 415 -3.061 3.579 -19.963 7 HB2 PRO 415 HB2 PRO 415 -3.624 5.386 -17.963 8 HB3 PRO 415 HB3 PRO 415 -3.768 5.756 -19.711 9 HG2 PRO 415 HG2 PRO 415 -5.944 4.953 -17.760 10 HG3 PRO 415 HG3 PRO 415 -5.989 6.236 -19.015 11 HD2 PRO 415 HD2 PRO 415 -7.090 3.750 -19.382 12 HD3 PRO 415 HD3 PRO 415 -6.357 4.678 -20.723 13 H LEU 416 H LEU 416 -1.651 3.447 -18.029 14 HA LEU 416 HA LEU 416 -2.293 1.129 -16.422 15 HB2 LEU 416 HB2 LEU 416 -0.025 1.567 -17.236 16 HB3 LEU 416 HB3 LEU 416 0.008 3.117 -16.377 17 HG LEU 416 HG LEU 416 -0.141 1.927 -14.204 18 HD11 LEU 416 HD11 LEU 416 0.007 -0.575 -15.955 19 HD12 LEU 416 HD12 LEU 416 0.170 -0.547 -14.184 20 HD13 LEU 416 HD13 LEU 416 -1.371 -0.090 -14.940 21 HD21 LEU 416 HD21 LEU 416 2.049 2.460 -15.192 22 HD22 LEU 416 HD22 LEU 416 2.112 0.942 -14.267 23 HD23 LEU 416 HD23 LEU 416 2.048 0.898 -16.047 24 H GLY 417 H GLY 417 -2.707 4.579 -16.066 25 HA2 GLY 417 HA2 GLY 417 -2.737 4.654 -13.175 26 HA3 GLY 417 HA3 GLY 417 -3.319 5.910 -14.275 27 H SER 418 H SER 418 -4.792 5.544 -12.049 28 HA SER 418 HA SER 418 -7.334 4.556 -13.100 29 HB2 SER 418 HB2 SER 418 -6.356 2.487 -12.201 30 HB3 SER 418 HB3 SER 418 -6.034 3.288 -10.650 31 HG SER 418 HG SER 418 -8.201 3.450 -10.293 32 H GLY 419 H GLY 419 -9.148 5.213 -11.765 33 HA2 GLY 419 HA2 GLY 419 -8.763 7.799 -10.549 34 HA3 GLY 419 HA3 GLY 419 -10.267 6.872 -10.624 35 H GLN 420 H GLN 420 -9.824 8.258 -8.349 36 HA GLN 420 HA GLN 420 -9.279 6.141 -6.345 37 HB2 GLN 420 HB2 GLN 420 -8.093 8.947 -6.313 38 HB3 GLN 420 HB3 GLN 420 -8.020 7.793 -4.969 39 HG2 GLN 420 HG2 GLN 420 -6.831 7.340 -7.733 40 HG3 GLN 420 HG3 GLN 420 -5.926 7.844 -6.301 41 HE21 GLN 420 HE21 GLN 420 -5.560 4.134 -6.693 42 HE22 GLN 420 HE22 GLN 420 -5.224 5.526 -7.704 43 H GLN 421 H GLN 421 -10.140 6.756 -4.178 44 HA GLN 421 HA GLN 421 -12.137 8.909 -4.141 45 HB2 GLN 421 HB2 GLN 421 -13.373 7.061 -5.147 46 HB3 GLN 421 HB3 GLN 421 -12.883 5.973 -3.836 47 HG2 GLN 421 HG2 GLN 421 -14.119 7.289 -2.196 48 HG3 GLN 421 HG3 GLN 421 -14.462 8.542 -3.394 49 HE21 GLN 421 HE21 GLN 421 -17.585 6.647 -3.232 50 HE22 GLN 421 HE22 GLN 421 -16.673 7.805 -2.288 51 H ARG 422 H ARG 422 -12.629 9.581 -2.041 52 HA ARG 422 HA ARG 422 -11.499 8.027 0.215 53 HB2 ARG 422 HB2 ARG 422 -11.086 11.007 -0.242 54 HB3 ARG 422 HB3 ARG 422 -10.632 10.112 1.209 55 HG2 ARG 422 HG2 ARG 422 -9.103 8.681 -0.193 56 HG3 ARG 422 HG3 ARG 422 -9.495 9.709 -1.590 57 HD2 ARG 422 HD2 ARG 422 -8.738 11.703 -0.194 58 HD3 ARG 422 HD3 ARG 422 -8.185 10.549 1.029 59 HE ARG 422 HE ARG 422 -7.084 9.990 -1.603 60 HH11 ARG 422 HH11 ARG 422 -6.769 12.071 1.242 61 HH12 ARG 422 HH12 ARG 422 -5.060 12.344 1.002 62 HH21 ARG 422 HH21 ARG 422 -4.813 10.251 -1.804 63 HH22 ARG 422 HH22 ARG 422 -3.955 11.295 -0.694 64 H ALA 423 H ALA 423 -12.520 8.474 2.251 65 HA ALA 423 HA ALA 423 -15.326 8.874 2.022 66 HB1 ALA 423 HB1 ALA 423 -13.514 8.978 4.469 67 HB2 ALA 423 HB2 ALA 423 -15.284 8.801 4.493 68 HB3 ALA 423 HB3 ALA 423 -14.274 7.517 3.798 69 H GLY 424 H GLY 424 -16.476 10.692 1.878 70 HA2 GLY 424 HA2 GLY 424 -17.093 12.832 2.801 71 HA3 GLY 424 HA3 GLY 424 -15.376 13.205 3.045 72 H ASP 425 H ASP 425 -15.220 11.740 0.127 73 HA ASP 425 HA ASP 425 -15.005 14.081 -1.430 74 HB2 ASP 425 HB2 ASP 425 -15.535 11.207 -2.188 75 HB3 ASP 425 HB3 ASP 425 -15.261 12.482 -3.377 76 H TRP 426 H TRP 426 -16.336 14.996 -3.099 77 HA TRP 426 HA TRP 426 -19.169 14.240 -3.086 78 HB2 TRP 426 HB2 TRP 426 -19.947 16.391 -2.265 79 HB3 TRP 426 HB3 TRP 426 -18.941 15.589 -1.056 80 HD1 TRP 426 HD1 TRP 426 -16.523 16.645 -0.576 81 HE1 TRP 426 HE1 TRP 426 -15.573 18.995 -0.870 82 HE3 TRP 426 HE3 TRP 426 -20.051 18.544 -3.743 83 HZ2 TRP 426 HZ2 TRP 426 -16.252 21.408 -2.323 84 HZ3 TRP 426 HZ3 TRP 426 -19.870 20.868 -4.568 85 HH2 TRP 426 HH2 TRP 426 -17.988 22.307 -3.861 86 H LYS 427 H LYS 427 -20.272 14.955 -4.876 87 HA LYS 427 HA LYS 427 -18.570 16.138 -6.984 88 HB2 LYS 427 HB2 LYS 427 -19.823 14.012 -7.367 89 HB3 LYS 427 HB3 LYS 427 -21.342 14.908 -7.134 90 HG2 LYS 427 HG2 LYS 427 -20.459 16.463 -9.050 91 HG3 LYS 427 HG3 LYS 427 -19.278 15.171 -9.345 92 HD2 LYS 427 HD2 LYS 427 -21.139 14.759 -10.808 93 HD3 LYS 427 HD3 LYS 427 -21.279 13.572 -9.496 94 HE2 LYS 427 HE2 LYS 427 -22.881 15.090 -8.328 95 HE3 LYS 427 HE3 LYS 427 -22.741 16.249 -9.654 96 HZ1 LYS 427 HZ1 LYS 427 -24.676 14.858 -9.891 97 HZ2 LYS 427 HZ2 LYS 427 -23.627 14.561 -11.124 98 HZ3 LYS 427 HZ3 LYS 427 -23.757 13.493 -9.879 99 H CYS 428 H CYS 428 -19.162 17.984 -8.160 100 HA CYS 428 HA CYS 428 -20.295 20.089 -6.678 101 HB2 CYS 428 HB2 CYS 428 -18.676 20.271 -8.560 102 HB3 CYS 428 HB3 CYS 428 -19.971 19.833 -9.697 103 HA PRO 429 HA PRO 429 -24.610 19.175 -7.299 104 HB2 PRO 429 HB2 PRO 429 -25.680 21.456 -6.220 105 HB3 PRO 429 HB3 PRO 429 -24.922 20.175 -5.222 106 HG2 PRO 429 HG2 PRO 429 -23.708 22.785 -6.180 107 HG3 PRO 429 HG3 PRO 429 -23.611 22.033 -4.553 108 HD2 PRO 429 HD2 PRO 429 -21.616 21.801 -6.426 109 HD3 PRO 429 HD3 PRO 429 -21.983 20.509 -5.239 110 H ASN 430 H ASN 430 -22.851 21.769 -8.788 111 HA ASN 430 HA ASN 430 -25.033 23.009 -10.195 112 HB2 ASN 430 HB2 ASN 430 -22.404 23.606 -9.742 113 HB3 ASN 430 HB3 ASN 430 -22.287 22.964 -11.384 114 HD21 ASN 430 HD21 ASN 430 -22.742 26.607 -11.695 115 HD22 ASN 430 HD22 ASN 430 -21.543 25.502 -11.052 116 HA PRO 431 HA PRO 431 -25.508 19.551 -13.047 117 HB2 PRO 431 HB2 PRO 431 -27.299 20.741 -14.792 118 HB3 PRO 431 HB3 PRO 431 -27.761 20.055 -13.204 119 HG2 PRO 431 HG2 PRO 431 -27.192 22.942 -13.923 120 HG3 PRO 431 HG3 PRO 431 -28.524 22.282 -12.922 121 HD2 PRO 431 HD2 PRO 431 -26.266 23.366 -11.828 122 HD3 PRO 431 HD3 PRO 431 -27.101 21.979 -11.067 123 H THR 432 H THR 432 -24.383 22.785 -13.731 124 HA THR 432 HA THR 432 -23.415 22.025 -16.394 125 HB THR 432 HB THR 432 -22.979 24.264 -16.801 126 HG1 THR 432 HG1 THR 432 -22.751 25.768 -15.143 127 HG21 THR 432 HG21 THR 432 -24.961 25.491 -16.141 128 HG22 THR 432 HG22 THR 432 -25.430 23.808 -16.455 129 HG23 THR 432 HG23 THR 432 -25.259 24.390 -14.781 130 H CYS 433 H CYS 433 -22.356 21.328 -13.400 131 HA CYS 433 HA CYS 433 -19.482 21.696 -14.117 132 HB2 CYS 433 HB2 CYS 433 -20.264 23.104 -12.224 133 HB3 CYS 433 HB3 CYS 433 -20.768 21.628 -11.368 134 H GLU 434 H GLU 434 -21.417 19.786 -11.777 135 HA GLU 434 HA GLU 434 -21.246 17.647 -11.062 136 HB2 GLU 434 HB2 GLU 434 -20.932 17.178 -14.045 137 HB3 GLU 434 HB3 GLU 434 -21.287 15.914 -12.851 138 HG2 GLU 434 HG2 GLU 434 -23.319 17.180 -12.141 139 HG3 GLU 434 HG3 GLU 434 -22.996 18.379 -13.399 140 H ASN 435 H ASN 435 -18.612 19.208 -11.345 141 HA ASN 435 HA ASN 435 -16.589 17.248 -11.925 142 HB2 ASN 435 HB2 ASN 435 -16.220 19.705 -12.000 143 HB3 ASN 435 HB3 ASN 435 -16.467 19.788 -10.249 144 HD21 ASN 435 HD21 ASN 435 -13.078 19.197 -9.615 145 HD22 ASN 435 HD22 ASN 435 -14.600 19.901 -9.122 146 H MET 436 H MET 436 -15.468 15.856 -10.567 147 HA MET 436 HA MET 436 -16.725 15.228 -7.999 148 HB2 MET 436 HB2 MET 436 -15.942 13.462 -9.578 149 HB3 MET 436 HB3 MET 436 -14.294 14.082 -9.427 150 HG2 MET 436 HG2 MET 436 -14.206 12.389 -7.895 151 HG3 MET 436 HG3 MET 436 -14.712 13.704 -6.832 152 HE1 MET 436 HE1 MET 436 -18.058 12.755 -5.518 153 HE2 MET 436 HE2 MET 436 -16.453 13.443 -5.190 154 HE3 MET 436 HE3 MET 436 -17.475 14.139 -6.475 155 H ASN 437 H ASN 437 -16.281 16.704 -6.405 156 HA ASN 437 HA ASN 437 -13.595 17.910 -6.254 157 HB2 ASN 437 HB2 ASN 437 -16.105 18.398 -4.613 158 HB3 ASN 437 HB3 ASN 437 -14.618 19.335 -4.513 159 HD21 ASN 437 HD21 ASN 437 -17.366 20.571 -7.058 160 HD22 ASN 437 HD22 ASN 437 -17.620 19.649 -5.589 161 H PHE 438 H PHE 438 -12.222 17.754 -4.470 162 HA PHE 438 HA PHE 438 -12.301 15.206 -3.146 163 HB2 PHE 438 HB2 PHE 438 -10.424 17.569 -2.970 164 HB3 PHE 438 HB3 PHE 438 -10.215 16.114 -2.011 165 HD1 PHE 438 HD1 PHE 438 -8.400 17.433 -4.230 166 HD2 PHE 438 HD2 PHE 438 -11.155 14.119 -4.247 167 HE1 PHE 438 HE1 PHE 438 -7.114 16.360 -6.052 168 HE2 PHE 438 HE2 PHE 438 -9.887 13.082 -6.094 169 HZ PHE 438 HZ PHE 438 -7.855 14.196 -6.991 170 H SER 439 H SER 439 -12.029 14.825 -0.839 171 HA SER 439 HA SER 439 -14.357 15.687 0.479 172 HB2 SER 439 HB2 SER 439 -13.419 14.474 2.405 173 HB3 SER 439 HB3 SER 439 -13.191 13.549 0.902 174 HG SER 439 HG SER 439 -11.059 14.216 0.864 175 H TRP 440 H TRP 440 -11.117 17.104 0.464 176 HA TRP 440 HA TRP 440 -11.636 18.567 2.947 177 HB2 TRP 440 HB2 TRP 440 -9.334 19.489 2.485 178 HB3 TRP 440 HB3 TRP 440 -9.476 17.749 2.765 179 HD1 TRP 440 HD1 TRP 440 -8.721 16.142 0.870 180 HE1 TRP 440 HE1 TRP 440 -7.534 16.428 -1.364 181 HE3 TRP 440 HE3 TRP 440 -9.234 21.195 0.354 182 HZ2 TRP 440 HZ2 TRP 440 -6.856 18.610 -3.161 183 HZ3 TRP 440 HZ3 TRP 440 -8.351 22.343 -1.638 184 HH2 TRP 440 HH2 TRP 440 -7.126 21.073 -3.387 185 H ARG 441 H ARG 441 -12.435 19.083 -0.303 186 HA ARG 441 HA ARG 441 -12.199 21.998 -0.191 187 HB2 ARG 441 HB2 ARG 441 -13.505 20.089 -2.170 188 HB3 ARG 441 HB3 ARG 441 -13.554 21.858 -2.322 189 HG2 ARG 441 HG2 ARG 441 -11.041 21.877 -2.218 190 HG3 ARG 441 HG3 ARG 441 -11.067 20.100 -2.301 191 HD2 ARG 441 HD2 ARG 441 -12.278 20.219 -4.456 192 HD3 ARG 441 HD3 ARG 441 -12.338 21.976 -4.351 193 HE ARG 441 HE ARG 441 -10.092 20.304 -5.157 194 HH11 ARG 441 HH11 ARG 441 -11.010 23.452 -3.832 195 HH12 ARG 441 HH12 ARG 441 -9.528 24.233 -4.339 196 HH21 ARG 441 HH21 ARG 441 -8.157 21.329 -5.764 197 HH22 ARG 441 HH22 ARG 441 -7.906 23.029 -5.428 198 H ASN 442 H ASN 442 -13.885 23.474 0.032 199 HA ASN 442 HA ASN 442 -16.472 22.350 1.019 200 HB2 ASN 442 HB2 ASN 442 -15.071 24.963 1.675 201 HB3 ASN 442 HB3 ASN 442 -16.715 24.551 2.191 202 HD21 ASN 442 HD21 ASN 442 -14.102 23.680 4.837 203 HD22 ASN 442 HD22 ASN 442 -14.358 25.111 3.867 204 H GLU 443 H GLU 443 -14.963 23.808 -1.592 205 HA GLU 443 HA GLU 443 -17.580 24.628 -2.707 206 HB2 GLU 443 HB2 GLU 443 -15.016 26.262 -2.910 207 HB3 GLU 443 HB3 GLU 443 -16.541 26.603 -3.747 208 HG2 GLU 443 HG2 GLU 443 -17.666 26.839 -1.528 209 HG3 GLU 443 HG3 GLU 443 -16.097 26.603 -0.735 210 H CYS 444 H CYS 444 -17.538 24.716 -5.073 211 HA CYS 444 HA CYS 444 -16.293 22.384 -6.136 212 HB2 CYS 444 HB2 CYS 444 -18.446 23.310 -6.935 213 HB3 CYS 444 HB3 CYS 444 -17.598 24.739 -7.558 214 H ASN 445 H ASN 445 -14.660 22.155 -7.692 215 HA ASN 445 HA ASN 445 -12.515 24.122 -7.348 216 HB2 ASN 445 HB2 ASN 445 -12.430 21.503 -7.182 217 HB3 ASN 445 HB3 ASN 445 -12.399 21.552 -8.949 218 HD21 ASN 445 HD21 ASN 445 -8.876 21.452 -8.199 219 HD22 ASN 445 HD22 ASN 445 -10.288 20.473 -8.559 220 H GLN 446 H GLN 446 -15.114 24.036 -9.350 221 HA GLN 446 HA GLN 446 -13.569 24.946 -11.735 222 HB2 GLN 446 HB2 GLN 446 -15.951 23.059 -11.720 223 HB3 GLN 446 HB3 GLN 446 -15.079 23.638 -13.148 224 HG2 GLN 446 HG2 GLN 446 -13.839 21.970 -10.908 225 HG3 GLN 446 HG3 GLN 446 -14.443 21.314 -12.427 226 HE21 GLN 446 HE21 GLN 446 -10.718 21.906 -12.647 227 HE22 GLN 446 HE22 GLN 446 -11.757 21.019 -11.545 228 H CYS 447 H CYS 447 -16.560 25.001 -9.822 229 HA CYS 447 HA CYS 447 -17.289 27.541 -11.201 230 HB2 CYS 447 HB2 CYS 447 -19.657 26.857 -11.112 231 HB3 CYS 447 HB3 CYS 447 -18.683 25.767 -12.123 232 H LYS 448 H LYS 448 -16.299 26.237 -8.371 233 HA LYS 448 HA LYS 448 -16.335 26.889 -6.211 234 HB2 LYS 448 HB2 LYS 448 -17.116 29.517 -7.504 235 HB3 LYS 448 HB3 LYS 448 -16.699 29.335 -5.792 236 HG2 LYS 448 HG2 LYS 448 -14.495 28.410 -6.397 237 HG3 LYS 448 HG3 LYS 448 -14.898 28.540 -8.116 238 HD2 LYS 448 HD2 LYS 448 -13.482 30.431 -7.349 239 HD3 LYS 448 HD3 LYS 448 -15.060 30.974 -7.948 240 HE2 LYS 448 HE2 LYS 448 -14.427 32.157 -5.886 241 HE3 LYS 448 HE3 LYS 448 -15.890 31.186 -5.646 242 HZ1 LYS 448 HZ1 LYS 448 -14.560 29.515 -4.578 243 HZ2 LYS 448 HZ2 LYS 448 -13.175 30.361 -4.855 244 HZ3 LYS 448 HZ3 LYS 448 -14.318 30.960 -3.835 245 H ALA 449 H ALA 449 -19.030 25.950 -7.506 246 HA ALA 449 HA ALA 449 -21.069 27.070 -5.845 247 HB1 ALA 449 HB1 ALA 449 -20.822 24.281 -7.037 248 HB2 ALA 449 HB2 ALA 449 -22.313 25.009 -6.401 249 HB3 ALA 449 HB3 ALA 449 -21.544 25.697 -7.843 250 HA PRO 450 HA PRO 450 -19.741 25.523 -1.957 251 HB2 PRO 450 HB2 PRO 450 -22.086 25.587 -0.522 252 HB3 PRO 450 HB3 PRO 450 -21.166 27.057 -0.993 253 HG2 PRO 450 HG2 PRO 450 -23.595 25.843 -2.325 254 HG3 PRO 450 HG3 PRO 450 -23.255 27.570 -1.980 255 HD2 PRO 450 HD2 PRO 450 -22.836 26.431 -4.443 256 HD3 PRO 450 HD3 PRO 450 -21.801 27.750 -3.814 257 H LYS 451 H LYS 451 -19.641 23.607 -0.742 258 HA LYS 451 HA LYS 451 -20.741 21.217 -1.896 259 HB2 LYS 451 HB2 LYS 451 -18.621 21.169 -0.741 260 HB3 LYS 451 HB3 LYS 451 -19.334 21.789 0.739 261 HG2 LYS 451 HG2 LYS 451 -20.903 19.591 0.449 262 HG3 LYS 451 HG3 LYS 451 -19.477 19.041 -0.442 263 HD2 LYS 451 HD2 LYS 451 -19.600 20.002 2.446 264 HD3 LYS 451 HD3 LYS 451 -19.216 18.364 1.866 265 HE2 LYS 451 HE2 LYS 451 -17.179 19.244 0.756 266 HE3 LYS 451 HE3 LYS 451 -17.570 20.872 1.344 267 HZ1 LYS 451 HZ1 LYS 451 -17.370 20.022 3.590 268 HZ2 LYS 451 HZ2 LYS 451 -16.993 18.524 3.027 269 HZ3 LYS 451 HZ3 LYS 451 -15.975 19.787 2.755 270 HA PRO 452 HA PRO 452 -23.957 21.438 1.696 271 HB2 PRO 452 HB2 PRO 452 -24.146 23.777 3.121 272 HB3 PRO 452 HB3 PRO 452 -23.130 22.389 3.630 273 HG2 PRO 452 HG2 PRO 452 -22.278 24.901 2.154 274 HG3 PRO 452 HG3 PRO 452 -21.474 24.094 3.540 275 HD2 PRO 452 HD2 PRO 452 -20.638 23.708 0.985 276 HD3 PRO 452 HD3 PRO 452 -20.623 22.389 2.188 277 H ASP 453 H ASP 453 -26.011 22.940 2.006 278 HA ASP 453 HA ASP 453 -26.775 23.834 -0.612 279 HB2 ASP 453 HB2 ASP 453 -28.908 24.476 0.584 280 HB3 ASP 453 HB3 ASP 453 -28.431 22.768 0.673 281 H GLY 454 H GLY 454 -24.965 25.440 1.717 282 HA2 GLY 454 HA2 GLY 454 -24.988 27.920 0.372 283 HA3 GLY 454 HA3 GLY 454 -26.137 28.024 1.723 284 H5' U 1 H5' U 1 -0.088 17.160 -1.654 285 H5'' U 1 H5'' U 1 -0.932 18.723 -1.748 286 H4' U 1 H4' U 1 -1.354 16.699 0.498 287 H3' U 1 H3' U 1 -2.132 16.126 -2.028 288 H2' U 1 H2' U 1 -3.006 18.269 -2.534 289 HO2' U 1 HO2' U 1 -4.665 16.893 -3.052 290 H1' U 1 H1' U 1 -4.527 18.362 0.063 291 H3 U 1 H3 U 1 -3.332 23.078 0.377 292 H5 U 1 H5 U 1 -4.587 22.030 -3.495 293 H6 U 1 H6 U 1 -4.428 19.709 -2.864 294 H5' G 2 H5' G 2 -1.795 12.441 -2.359 295 H5'' G 2 H5'' G 2 -1.945 14.153 -2.818 296 H4' G 2 H4' G 2 -2.626 12.354 -4.568 297 H3' G 2 H3' G 2 -4.201 14.799 -3.797 298 H2' G 2 H2' G 2 -5.929 14.188 -5.332 299 HO2' G 2 HO2' G 2 -4.419 13.450 -6.996 300 H1' G 2 H1' G 2 -6.056 11.572 -4.644 301 H8 G 2 H8 G 2 -5.285 14.521 -2.184 302 H1 G 2 H1 G 2 -11.282 12.237 -2.183 303 H21 G 2 H21 G 2 -11.504 10.735 -3.781 304 H22 G 2 H22 G 2 -10.158 10.213 -4.769 305 H5' G 3 H5' G 3 -5.008 14.413 -8.422 306 H5'' G 3 H5'' G 3 -3.341 15.015 -8.498 307 H4' G 3 H4' G 3 -4.655 15.758 -10.446 308 H3' G 3 H3' G 3 -3.049 17.404 -8.864 309 H2' G 3 H2' G 3 -4.814 18.383 -7.646 310 HO2' G 3 HO2' G 3 -3.789 20.096 -8.845 311 H1' G 3 H1' G 3 -6.520 18.457 -10.141 312 H8 G 3 H8 G 3 -6.396 20.007 -7.098 313 H1 G 3 H1 G 3 -11.926 16.766 -7.219 314 H21 G 3 H21 G 3 -11.845 15.174 -8.744 315 H22 G 3 H22 G 3 -10.436 14.910 -9.748 316 H5' U 4 H5' U 4 -4.305 17.826 -14.265 317 H5'' U 4 H5'' U 4 -5.232 18.232 -12.810 318 H4' U 4 H4' U 4 -5.762 15.819 -14.613 319 H3' U 4 H3' U 4 -7.010 18.564 -14.341 320 H2' U 4 H2' U 4 -9.120 17.631 -14.784 321 HO2' U 4 HO2' U 4 -8.477 16.317 -16.569 322 H1' U 4 H1' U 4 -8.724 15.273 -13.375 323 H3 U 4 H3 U 4 -11.978 17.375 -11.039 324 H5 U 4 H5 U 4 -8.735 20.037 -10.778 325 H6 U 4 H6 U 4 -7.473 18.549 -12.217 326 H5' G 5 H5' G 5 -5.770 21.228 -17.375 327 H5'' G 5 H5'' G 5 -5.214 20.262 -15.993 328 H4' G 5 H4' G 5 -5.252 22.654 -15.420 329 H3' G 5 H3' G 5 -6.162 20.676 -13.802 330 H2' G 5 H2' G 5 -8.428 20.687 -14.424 331 HO2' G 5 HO2' G 5 -8.285 22.798 -12.518 332 H1' G 5 H1' G 5 -8.609 23.674 -14.604 333 H8 G 5 H8 G 5 -9.809 20.250 -15.671 334 H1 G 5 H1 G 5 -12.516 25.044 -18.955 335 H21 G 5 H21 G 5 -11.425 26.939 -18.577 336 H22 G 5 H22 G 5 -10.029 27.007 -17.519 Start of MODEL 20 1 H1 GLY 414 H1 NGL 414 -4.343 9.997 -23.057 2 H2 GLY 414 H2 NGL 414 -5.327 10.467 -24.296 3 H3 GLY 414 H3 NGL 414 -4.115 9.383 -24.564 4 HA2 GLY 414 HA2 NGL 414 -6.231 8.272 -24.500 5 HA3 GLY 414 HA3 NGL 414 -5.163 7.753 -23.182 6 HA PRO 415 HA PRO 415 -9.298 9.239 -21.507 7 HB2 PRO 415 HB2 PRO 415 -10.062 6.864 -20.327 8 HB3 PRO 415 HB3 PRO 415 -10.447 7.298 -22.022 9 HG2 PRO 415 HG2 PRO 415 -8.210 5.547 -20.990 10 HG3 PRO 415 HG3 PRO 415 -9.294 5.264 -22.393 11 HD2 PRO 415 HD2 PRO 415 -6.755 6.267 -22.652 12 HD3 PRO 415 HD3 PRO 415 -8.084 6.761 -23.744 13 H LEU 416 H LEU 416 -9.944 9.200 -19.141 14 HA LEU 416 HA LEU 416 -7.690 9.790 -17.489 15 HB2 LEU 416 HB2 LEU 416 -9.895 10.843 -17.251 16 HB3 LEU 416 HB3 LEU 416 -10.608 9.283 -16.803 17 HG LEU 416 HG LEU 416 -9.159 9.218 -14.768 18 HD11 LEU 416 HD11 LEU 416 -8.343 12.009 -15.696 19 HD12 LEU 416 HD12 LEU 416 -7.969 11.305 -14.111 20 HD13 LEU 416 HD13 LEU 416 -7.264 10.599 -15.580 21 HD21 LEU 416 HD21 LEU 416 -11.432 10.176 -14.677 22 HD22 LEU 416 HD22 LEU 416 -10.331 11.017 -13.562 23 HD23 LEU 416 HD23 LEU 416 -10.774 11.774 -15.112 24 H GLY 417 H GLY 417 -6.958 8.701 -15.570 25 HA2 GLY 417 HA2 GLY 417 -6.711 5.843 -15.876 26 HA3 GLY 417 HA3 GLY 417 -6.085 6.835 -14.551 27 H SER 418 H SER 418 -6.801 4.809 -13.338 28 HA SER 418 HA SER 418 -9.585 4.224 -13.035 29 HB2 SER 418 HB2 SER 418 -8.822 2.835 -11.154 30 HB3 SER 418 HB3 SER 418 -7.758 2.615 -12.563 31 HG SER 418 HG SER 418 -7.273 4.233 -10.280 32 H GLY 419 H GLY 419 -7.685 6.833 -11.876 33 HA2 GLY 419 HA2 GLY 419 -8.293 8.646 -10.573 34 HA3 GLY 419 HA3 GLY 419 -9.928 7.970 -10.485 35 H GLN 420 H GLN 420 -9.852 8.797 -8.252 36 HA GLN 420 HA GLN 420 -9.004 6.697 -6.398 37 HB2 GLN 420 HB2 GLN 420 -6.988 8.067 -6.571 38 HB3 GLN 420 HB3 GLN 420 -7.917 9.544 -6.231 39 HG2 GLN 420 HG2 GLN 420 -8.471 8.730 -3.987 40 HG3 GLN 420 HG3 GLN 420 -7.663 7.184 -4.328 41 HE21 GLN 420 HE21 GLN 420 -4.476 9.418 -4.613 42 HE22 GLN 420 HE22 GLN 420 -5.506 8.798 -5.885 43 H GLN 421 H GLN 421 -10.058 6.918 -4.309 44 HA GLN 421 HA GLN 421 -12.105 9.044 -4.113 45 HB2 GLN 421 HB2 GLN 421 -13.878 7.421 -3.664 46 HB3 GLN 421 HB3 GLN 421 -13.205 7.192 -5.285 47 HG2 GLN 421 HG2 GLN 421 -11.810 5.316 -4.438 48 HG3 GLN 421 HG3 GLN 421 -12.492 5.538 -2.820 49 HE21 GLN 421 HE21 GLN 421 -14.423 2.778 -4.269 50 HE22 GLN 421 HE22 GLN 421 -12.804 3.085 -3.671 51 H ARG 422 H ARG 422 -12.732 9.509 -1.997 52 HA ARG 422 HA ARG 422 -11.625 7.879 0.205 53 HB2 ARG 422 HB2 ARG 422 -11.183 10.881 -0.085 54 HB3 ARG 422 HB3 ARG 422 -10.772 9.910 1.335 55 HG2 ARG 422 HG2 ARG 422 -9.198 8.563 -0.096 56 HG3 ARG 422 HG3 ARG 422 -9.553 9.658 -1.451 57 HD2 ARG 422 HD2 ARG 422 -8.870 11.585 0.067 58 HD3 ARG 422 HD3 ARG 422 -8.306 10.375 1.231 59 HE ARG 422 HE ARG 422 -7.167 9.966 -1.409 60 HH11 ARG 422 HH11 ARG 422 -6.916 11.956 1.511 61 HH12 ARG 422 HH12 ARG 422 -5.209 12.264 1.283 62 HH21 ARG 422 HH21 ARG 422 -4.938 10.271 -1.598 63 HH22 ARG 422 HH22 ARG 422 -4.089 11.311 -0.474 64 H ALA 423 H ALA 423 -12.722 8.190 2.215 65 HA ALA 423 HA ALA 423 -15.508 8.697 1.950 66 HB1 ALA 423 HB1 ALA 423 -13.750 8.616 4.436 67 HB2 ALA 423 HB2 ALA 423 -15.524 8.493 4.410 68 HB3 ALA 423 HB3 ALA 423 -14.536 7.216 3.671 69 H GLY 424 H GLY 424 -16.610 10.561 1.912 70 HA2 GLY 424 HA2 GLY 424 -17.163 12.672 2.924 71 HA3 GLY 424 HA3 GLY 424 -15.444 12.960 3.230 72 H ASP 425 H ASP 425 -15.301 11.657 0.223 73 HA ASP 425 HA ASP 425 -15.020 14.098 -1.186 74 HB2 ASP 425 HB2 ASP 425 -15.511 11.251 -2.101 75 HB3 ASP 425 HB3 ASP 425 -15.212 12.586 -3.218 76 H TRP 426 H TRP 426 -16.307 14.960 -2.978 77 HA TRP 426 HA TRP 426 -19.160 14.244 -2.955 78 HB2 TRP 426 HB2 TRP 426 -19.910 16.427 -2.229 79 HB3 TRP 426 HB3 TRP 426 -18.923 15.651 -0.986 80 HD1 TRP 426 HD1 TRP 426 -16.480 16.679 -0.546 81 HE1 TRP 426 HE1 TRP 426 -15.513 19.016 -0.877 82 HE3 TRP 426 HE3 TRP 426 -19.999 18.555 -3.732 83 HZ2 TRP 426 HZ2 TRP 426 -16.186 21.424 -2.347 84 HZ3 TRP 426 HZ3 TRP 426 -19.799 20.869 -4.597 85 HH2 TRP 426 HH2 TRP 426 -17.923 22.311 -3.890 86 H LYS 427 H LYS 427 -20.275 14.929 -4.746 87 HA LYS 427 HA LYS 427 -18.590 15.984 -6.932 88 HB2 LYS 427 HB2 LYS 427 -20.114 13.892 -7.077 89 HB3 LYS 427 HB3 LYS 427 -21.463 15.041 -7.109 90 HG2 LYS 427 HG2 LYS 427 -20.182 16.200 -9.051 91 HG3 LYS 427 HG3 LYS 427 -19.155 14.753 -9.074 92 HD2 LYS 427 HD2 LYS 427 -20.885 14.437 -10.725 93 HD3 LYS 427 HD3 LYS 427 -21.284 13.384 -9.351 94 HE2 LYS 427 HE2 LYS 427 -22.837 15.137 -8.488 95 HE3 LYS 427 HE3 LYS 427 -22.444 16.158 -9.878 96 HZ1 LYS 427 HZ1 LYS 427 -24.467 14.929 -10.228 97 HZ2 LYS 427 HZ2 LYS 427 -23.331 14.448 -11.314 98 HZ3 LYS 427 HZ3 LYS 427 -23.690 13.492 -10.024 99 H CYS 428 H CYS 428 -19.175 17.827 -8.169 100 HA CYS 428 HA CYS 428 -20.223 19.999 -6.704 101 HB2 CYS 428 HB2 CYS 428 -18.636 20.117 -8.625 102 HB3 CYS 428 HB3 CYS 428 -19.958 19.656 -9.717 103 HA PRO 429 HA PRO 429 -24.560 19.117 -7.230 104 HB2 PRO 429 HB2 PRO 429 -25.583 21.402 -6.116 105 HB3 PRO 429 HB3 PRO 429 -24.816 20.106 -5.142 106 HG2 PRO 429 HG2 PRO 429 -23.601 22.705 -6.121 107 HG3 PRO 429 HG3 PRO 429 -23.482 21.950 -4.492 108 HD2 PRO 429 HD2 PRO 429 -21.528 21.716 -6.412 109 HD3 PRO 429 HD3 PRO 429 -21.864 20.419 -5.222 110 H ASN 430 H ASN 430 -22.798 21.690 -8.764 111 HA ASN 430 HA ASN 430 -25.012 22.960 -10.094 112 HB2 ASN 430 HB2 ASN 430 -22.367 23.536 -9.684 113 HB3 ASN 430 HB3 ASN 430 -22.300 22.945 -11.346 114 HD21 ASN 430 HD21 ASN 430 -22.780 26.608 -11.497 115 HD22 ASN 430 HD22 ASN 430 -21.564 25.508 -10.876 116 HA PRO 431 HA PRO 431 -25.500 19.555 -13.024 117 HB2 PRO 431 HB2 PRO 431 -27.347 20.763 -14.679 118 HB3 PRO 431 HB3 PRO 431 -27.764 20.022 -13.099 119 HG2 PRO 431 HG2 PRO 431 -27.280 22.935 -13.750 120 HG3 PRO 431 HG3 PRO 431 -28.562 22.216 -12.719 121 HD2 PRO 431 HD2 PRO 431 -26.289 23.325 -11.682 122 HD3 PRO 431 HD3 PRO 431 -27.088 21.914 -10.923 123 H THR 432 H THR 432 -24.490 22.844 -13.638 124 HA THR 432 HA THR 432 -23.572 22.197 -16.337 125 HB THR 432 HB THR 432 -23.170 24.466 -16.658 126 HG1 THR 432 HG1 THR 432 -22.946 25.902 -14.917 127 HG21 THR 432 HG21 THR 432 -25.402 24.457 -14.578 128 HG22 THR 432 HG22 THR 432 -25.143 25.648 -15.872 129 HG23 THR 432 HG23 THR 432 -25.602 23.978 -16.280 130 H CYS 433 H CYS 433 -22.416 21.391 -13.402 131 HA CYS 433 HA CYS 433 -19.567 21.783 -14.203 132 HB2 CYS 433 HB2 CYS 433 -20.300 23.164 -12.264 133 HB3 CYS 433 HB3 CYS 433 -20.765 21.668 -11.417 134 H GLU 434 H GLU 434 -21.424 19.858 -11.819 135 HA GLU 434 HA GLU 434 -21.259 17.708 -11.138 136 HB2 GLU 434 HB2 GLU 434 -20.998 17.251 -14.127 137 HB3 GLU 434 HB3 GLU 434 -21.365 15.996 -12.922 138 HG2 GLU 434 HG2 GLU 434 -23.359 17.307 -12.199 139 HG3 GLU 434 HG3 GLU 434 -23.032 18.481 -13.487 140 H ASN 435 H ASN 435 -18.593 19.282 -11.626 141 HA ASN 435 HA ASN 435 -16.611 17.259 -12.122 142 HB2 ASN 435 HB2 ASN 435 -16.170 19.692 -12.315 143 HB3 ASN 435 HB3 ASN 435 -16.453 19.879 -10.575 144 HD21 ASN 435 HD21 ASN 435 -13.055 19.358 -9.911 145 HD22 ASN 435 HD22 ASN 435 -14.544 20.218 -9.567 146 H MET 436 H MET 436 -15.385 16.011 -10.654 147 HA MET 436 HA MET 436 -16.720 15.509 -8.090 148 HB2 MET 436 HB2 MET 436 -15.780 13.716 -9.692 149 HB3 MET 436 HB3 MET 436 -14.176 14.216 -9.111 150 HG2 MET 436 HG2 MET 436 -14.907 12.382 -7.724 151 HG3 MET 436 HG3 MET 436 -15.021 13.854 -6.753 152 HE1 MET 436 HE1 MET 436 -16.708 13.632 -5.039 153 HE2 MET 436 HE2 MET 436 -18.109 12.537 -5.116 154 HE3 MET 436 HE3 MET 436 -16.459 11.880 -5.267 155 H ASN 437 H ASN 437 -16.046 16.301 -6.144 156 HA ASN 437 HA ASN 437 -13.483 17.837 -6.136 157 HB2 ASN 437 HB2 ASN 437 -16.046 18.361 -4.597 158 HB3 ASN 437 HB3 ASN 437 -14.565 19.311 -4.480 159 HD21 ASN 437 HD21 ASN 437 -17.260 20.255 -7.273 160 HD22 ASN 437 HD22 ASN 437 -17.562 19.259 -5.859 161 H PHE 438 H PHE 438 -12.135 17.684 -4.376 162 HA PHE 438 HA PHE 438 -12.253 15.185 -2.968 163 HB2 PHE 438 HB2 PHE 438 -10.367 17.548 -2.815 164 HB3 PHE 438 HB3 PHE 438 -10.155 16.082 -1.862 165 HD1 PHE 438 HD1 PHE 438 -11.091 14.088 -4.074 166 HD2 PHE 438 HD2 PHE 438 -8.362 17.420 -4.103 167 HE1 PHE 438 HE1 PHE 438 -9.834 13.053 -5.931 168 HE2 PHE 438 HE2 PHE 438 -7.079 16.343 -5.920 169 HZ PHE 438 HZ PHE 438 -7.822 14.170 -6.852 170 H SER 439 H SER 439 -11.998 14.904 -0.632 171 HA SER 439 HA SER 439 -14.356 15.864 0.600 172 HB2 SER 439 HB2 SER 439 -13.370 13.719 1.163 173 HB3 SER 439 HB3 SER 439 -11.877 14.499 1.714 174 HG SER 439 HG SER 439 -14.457 14.845 2.859 175 H TRP 440 H TRP 440 -11.016 17.113 0.721 176 HA TRP 440 HA TRP 440 -11.584 18.710 3.082 177 HB2 TRP 440 HB2 TRP 440 -9.301 19.658 2.574 178 HB3 TRP 440 HB3 TRP 440 -9.390 17.938 2.948 179 HD1 TRP 440 HD1 TRP 440 -8.641 16.243 1.124 180 HE1 TRP 440 HE1 TRP 440 -7.457 16.429 -1.117 181 HE3 TRP 440 HE3 TRP 440 -9.203 21.261 0.366 182 HZ2 TRP 440 HZ2 TRP 440 -6.793 18.534 -3.020 183 HZ3 TRP 440 HZ3 TRP 440 -8.327 22.319 -1.671 184 HH2 TRP 440 HH2 TRP 440 -7.093 20.973 -3.372 185 H ARG 441 H ARG 441 -12.347 19.118 -0.222 186 HA ARG 441 HA ARG 441 -12.161 22.033 -0.177 187 HB2 ARG 441 HB2 ARG 441 -13.442 20.063 -2.103 188 HB3 ARG 441 HB3 ARG 441 -13.534 21.827 -2.293 189 HG2 ARG 441 HG2 ARG 441 -11.024 21.906 -2.203 190 HG3 ARG 441 HG3 ARG 441 -11.012 20.126 -2.255 191 HD2 ARG 441 HD2 ARG 441 -12.247 20.177 -4.401 192 HD3 ARG 441 HD3 ARG 441 -12.324 21.937 -4.331 193 HE ARG 441 HE ARG 441 -10.066 20.279 -5.125 194 HH11 ARG 441 HH11 ARG 441 -11.024 23.456 -3.887 195 HH12 ARG 441 HH12 ARG 441 -9.549 24.234 -4.416 196 HH21 ARG 441 HH21 ARG 441 -8.152 21.310 -5.771 197 HH22 ARG 441 HH22 ARG 441 -7.929 23.025 -5.495 198 H ASN 442 H ASN 442 -13.904 23.490 -0.098 199 HA ASN 442 HA ASN 442 -16.473 22.359 0.927 200 HB2 ASN 442 HB2 ASN 442 -15.117 25.001 1.571 201 HB3 ASN 442 HB3 ASN 442 -16.752 24.557 2.087 202 HD21 ASN 442 HD21 ASN 442 -14.010 23.736 4.680 203 HD22 ASN 442 HD22 ASN 442 -14.231 25.135 3.655 204 H GLU 443 H GLU 443 -14.912 23.878 -1.650 205 HA GLU 443 HA GLU 443 -17.519 24.668 -2.803 206 HB2 GLU 443 HB2 GLU 443 -14.967 26.284 -3.184 207 HB3 GLU 443 HB3 GLU 443 -16.590 26.666 -3.753 208 HG2 GLU 443 HG2 GLU 443 -16.508 28.022 -1.893 209 HG3 GLU 443 HG3 GLU 443 -17.217 26.568 -1.181 210 H CYS 444 H CYS 444 -17.500 24.664 -5.157 211 HA CYS 444 HA CYS 444 -16.233 22.352 -6.208 212 HB2 CYS 444 HB2 CYS 444 -18.392 23.270 -7.001 213 HB3 CYS 444 HB3 CYS 444 -17.543 24.686 -7.650 214 H ASN 445 H ASN 445 -14.595 22.123 -7.769 215 HA ASN 445 HA ASN 445 -12.432 24.036 -7.444 216 HB2 ASN 445 HB2 ASN 445 -12.512 21.356 -7.629 217 HB3 ASN 445 HB3 ASN 445 -12.333 21.704 -9.351 218 HD21 ASN 445 HD21 ASN 445 -8.906 21.277 -8.176 219 HD22 ASN 445 HD22 ASN 445 -10.317 20.369 -8.684 220 H GLN 446 H GLN 446 -15.106 24.058 -9.483 221 HA GLN 446 HA GLN 446 -13.523 25.287 -11.695 222 HB2 GLN 446 HB2 GLN 446 -15.848 23.344 -12.046 223 HB3 GLN 446 HB3 GLN 446 -14.864 24.097 -13.318 224 HG2 GLN 446 HG2 GLN 446 -12.852 22.970 -12.079 225 HG3 GLN 446 HG3 GLN 446 -14.083 21.975 -11.293 226 HE21 GLN 446 HE21 GLN 446 -12.983 20.026 -14.227 227 HE22 GLN 446 HE22 GLN 446 -12.358 20.534 -12.670 228 H CYS 447 H CYS 447 -16.718 24.908 -10.121 229 HA CYS 447 HA CYS 447 -17.511 27.510 -11.352 230 HB2 CYS 447 HB2 CYS 447 -19.836 26.732 -11.091 231 HB3 CYS 447 HB3 CYS 447 -18.887 25.642 -12.128 232 H LYS 448 H LYS 448 -16.370 26.237 -8.531 233 HA LYS 448 HA LYS 448 -16.301 26.916 -6.385 234 HB2 LYS 448 HB2 LYS 448 -17.270 29.549 -7.550 235 HB3 LYS 448 HB3 LYS 448 -16.545 29.328 -5.943 236 HG2 LYS 448 HG2 LYS 448 -14.473 28.460 -6.993 237 HG3 LYS 448 HG3 LYS 448 -15.187 28.713 -8.607 238 HD2 LYS 448 HD2 LYS 448 -15.426 31.133 -8.114 239 HD3 LYS 448 HD3 LYS 448 -14.687 30.873 -6.517 240 HE2 LYS 448 HE2 LYS 448 -12.640 29.995 -7.619 241 HE3 LYS 448 HE3 LYS 448 -13.375 30.288 -9.207 242 HZ1 LYS 448 HZ1 LYS 448 -11.933 32.078 -8.572 243 HZ2 LYS 448 HZ2 LYS 448 -13.485 32.617 -8.658 244 HZ3 LYS 448 HZ3 LYS 448 -12.783 32.347 -7.190 245 H ALA 449 H ALA 449 -18.999 25.901 -7.563 246 HA ALA 449 HA ALA 449 -21.033 27.038 -5.910 247 HB1 ALA 449 HB1 ALA 449 -22.269 24.953 -6.447 248 HB2 ALA 449 HB2 ALA 449 -21.502 25.641 -7.895 249 HB3 ALA 449 HB3 ALA 449 -20.773 24.236 -7.087 250 HA PRO 450 HA PRO 450 -19.691 25.520 -2.021 251 HB2 PRO 450 HB2 PRO 450 -22.028 25.631 -0.571 252 HB3 PRO 450 HB3 PRO 450 -21.108 27.083 -1.070 253 HG2 PRO 450 HG2 PRO 450 -23.545 25.859 -2.384 254 HG3 PRO 450 HG3 PRO 450 -23.192 27.590 -2.059 255 HD2 PRO 450 HD2 PRO 450 -22.788 26.406 -4.511 256 HD3 PRO 450 HD3 PRO 450 -21.760 27.741 -3.898 257 H LYS 451 H LYS 451 -19.597 23.625 -0.805 258 HA LYS 451 HA LYS 451 -20.703 21.221 -1.918 259 HB2 LYS 451 HB2 LYS 451 -18.582 21.179 -0.766 260 HB3 LYS 451 HB3 LYS 451 -19.282 21.821 0.706 261 HG2 LYS 451 HG2 LYS 451 -20.858 19.613 0.430 262 HG3 LYS 451 HG3 LYS 451 -19.426 19.061 -0.444 263 HD2 LYS 451 HD2 LYS 451 -19.565 20.054 2.436 264 HD3 LYS 451 HD3 LYS 451 -19.191 18.412 1.875 265 HE2 LYS 451 HE2 LYS 451 -17.151 19.298 0.737 266 HE3 LYS 451 HE3 LYS 451 -17.533 20.913 1.358 267 HZ1 LYS 451 HZ1 LYS 451 -17.315 20.050 3.581 268 HZ2 LYS 451 HZ2 LYS 451 -16.965 18.545 3.012 269 HZ3 LYS 451 HZ3 LYS 451 -15.933 19.795 2.730 270 HA PRO 452 HA PRO 452 -23.890 21.409 1.690 271 HB2 PRO 452 HB2 PRO 452 -24.092 23.740 3.146 272 HB3 PRO 452 HB3 PRO 452 -23.034 22.370 3.625 273 HG2 PRO 452 HG2 PRO 452 -22.282 24.899 2.135 274 HG3 PRO 452 HG3 PRO 452 -21.438 24.117 3.516 275 HD2 PRO 452 HD2 PRO 452 -20.622 23.750 0.949 276 HD3 PRO 452 HD3 PRO 452 -20.561 22.427 2.151 277 H ASP 453 H ASP 453 -26.009 22.682 1.889 278 HA ASP 453 HA ASP 453 -26.708 23.674 -0.722 279 HB2 ASP 453 HB2 ASP 453 -28.247 23.484 1.886 280 HB3 ASP 453 HB3 ASP 453 -28.952 24.024 0.352 281 H GLY 454 H GLY 454 -25.171 25.258 1.806 282 HA2 GLY 454 HA2 GLY 454 -25.361 27.806 0.574 283 HA3 GLY 454 HA3 GLY 454 -26.484 27.757 1.945 284 H5' U 1 H5' U 1 0.042 18.341 0.428 285 H5'' U 1 H5'' U 1 0.092 16.846 -0.529 286 H4' U 1 H4' U 1 -1.712 16.681 1.091 287 H3' U 1 H3' U 1 -2.070 16.154 -1.592 288 H2' U 1 H2' U 1 -2.937 18.284 -2.159 289 HO2' U 1 HO2' U 1 -4.555 16.916 -2.817 290 H1' U 1 H1' U 1 -4.601 18.279 0.362 291 H3 U 1 H3 U 1 -3.987 23.044 0.805 292 H5 U 1 H5 U 1 -4.648 22.000 -3.209 293 H6 U 1 H6 U 1 -4.326 19.690 -2.612 294 H5' G 2 H5' G 2 -1.729 12.542 -2.067 295 H5'' G 2 H5'' G 2 -1.989 14.255 -2.470 296 H4' G 2 H4' G 2 -2.561 12.416 -4.259 297 H3' G 2 H3' G 2 -4.197 14.827 -3.505 298 H2' G 2 H2' G 2 -5.898 14.178 -5.059 299 HO2' G 2 HO2' G 2 -4.347 13.451 -6.702 300 H1' G 2 H1' G 2 -5.989 11.571 -4.360 301 H8 G 2 H8 G 2 -5.239 14.511 -1.881 302 H1 G 2 H1 G 2 -11.252 12.289 -1.943 303 H21 G 2 H21 G 2 -11.486 10.847 -3.595 304 H22 G 2 H22 G 2 -10.138 10.335 -4.594 305 H5' G 3 H5' G 3 -4.930 14.363 -8.137 306 H5'' G 3 H5'' G 3 -3.262 14.973 -8.175 307 H4' G 3 H4' G 3 -4.498 15.660 -10.184 308 H3' G 3 H3' G 3 -2.960 17.343 -8.582 309 H2' G 3 H2' G 3 -4.762 18.381 -7.474 310 HO2' G 3 HO2' G 3 -4.481 19.789 -9.934 311 H1' G 3 H1' G 3 -6.410 18.375 -9.999 312 H8 G 3 H8 G 3 -6.325 19.917 -6.932 313 H1 G 3 H1 G 3 -11.913 16.790 -7.259 314 H21 G 3 H21 G 3 -11.803 15.174 -8.771 315 H22 G 3 H22 G 3 -10.358 14.899 -9.724 316 H5' U 4 H5' U 4 -3.968 17.415 -14.052 317 H5'' U 4 H5'' U 4 -4.937 17.938 -12.661 318 H4' U 4 H4' U 4 -5.389 15.341 -14.196 319 H3' U 4 H3' U 4 -6.583 18.109 -14.358 320 H2' U 4 H2' U 4 -8.702 17.195 -14.750 321 HO2' U 4 HO2' U 4 -7.990 15.619 -16.343 322 H1' U 4 H1' U 4 -8.405 14.965 -13.098 323 H3 U 4 H3 U 4 -11.812 17.208 -11.151 324 H5 U 4 H5 U 4 -8.601 19.904 -10.866 325 H6 U 4 H6 U 4 -7.252 18.334 -12.141 326 H5' G 5 H5' G 5 -6.590 16.538 -19.697 327 H5'' G 5 H5'' G 5 -7.969 15.446 -19.491 328 H4' G 5 H4' G 5 -5.584 15.283 -17.612 329 H3' G 5 H3' G 5 -5.060 15.025 -20.238 330 H2' G 5 H2' G 5 -6.846 13.653 -20.884 331 HO2' G 5 HO2' G 5 -6.093 11.499 -21.015 332 H1' G 5 H1' G 5 -6.799 11.847 -18.526 333 H8 G 5 H8 G 5 -8.383 11.688 -21.263 334 H1 G 5 H1 G 5 -12.940 14.077 -17.441 335 H21 G 5 H21 G 5 -12.021 14.944 -15.605 336 H22 G 5 H22 G 5 -10.289 14.937 -15.352
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