NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
16770 | 2aqf | 6781 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name 1 1H GLY 1 HT1 GLY 1 29.219 -13.731 -2.890 2 2H GLY 1 HT2 GLY 1 28.504 -15.005 -2.024 3 3H GLY 1 HT3 GLY 1 29.878 -14.224 -1.404 4 1HA GLY 1 HA1 GLY 1 28.263 -13.219 -0.164 5 2HA GLY 1 HA2 GLY 1 28.380 -12.115 -1.534 6 H SER 2 HN SER 2 26.025 -11.872 -0.478 7 HA SER 2 HA SER 2 24.203 -13.322 -2.324 8 1HB SER 2 HB2 SER 2 23.565 -13.128 0.619 9 2HB SER 2 HB1 SER 2 22.925 -14.258 -0.573 10 HG SER 2 HG SER 2 24.401 -15.387 0.585 11 H ASN 3 HN ASN 3 21.803 -12.407 -1.525 12 HA ASN 3 HA ASN 3 21.811 -9.623 -2.244 13 1HB ASN 3 HB2 ASN 3 19.892 -11.732 -1.367 14 2HB ASN 3 HB1 ASN 3 19.350 -10.062 -1.198 15 1HD2 ASN 3 HD22 ASN 3 21.335 -11.743 -3.709 16 2HD2 ASN 3 HD21 ASN 3 20.381 -11.228 -5.015 17 H SER 4 HN SER 4 21.327 -7.793 -0.912 18 HA SER 4 HA SER 4 21.824 -8.230 2.014 19 1HB SER 4 HB1 SER 4 22.379 -5.799 0.275 20 2HB SER 4 HB2 SER 4 22.916 -6.044 1.937 21 HG SER 4 HG SER 4 23.782 -7.280 -0.426 22 H GLY 5 HN GLY 5 19.585 -7.047 -0.332 23 1HA GLY 5 HA1 GLY 5 17.418 -6.183 -0.009 24 2HA GLY 5 HA2 GLY 5 17.657 -6.369 1.728 25 H ARG 6 HN ARG 6 19.999 -4.605 -0.154 26 HA ARG 6 HA ARG 6 19.049 -2.076 1.149 27 1HB ARG 6 HB1 ARG 6 21.565 -3.482 0.974 28 2HB ARG 6 HB2 ARG 6 21.738 -1.896 0.222 29 1HG ARG 6 HG1 ARG 6 22.233 -1.703 2.601 30 2HG ARG 6 HG2 ARG 6 20.715 -0.871 2.264 31 1HD ARG 6 HD2 ARG 6 19.446 -2.457 3.386 32 2HD ARG 6 HD1 ARG 6 20.586 -3.769 3.029 33 HE ARG 6 HE ARG 6 22.035 -1.989 4.612 34 1HH1 ARG 6 HH11 ARG 6 19.045 -3.744 4.924 35 2HH1 ARG 6 HH12 ARG 6 19.169 -3.867 6.644 36 1HH2 ARG 6 HH22 ARG 6 22.175 -2.162 6.846 37 2HH2 ARG 6 HH21 ARG 6 20.927 -2.979 7.727 38 H ARG 7 HN ARG 7 20.560 -3.372 -1.826 39 HA ARG 7 HA ARG 7 20.555 -2.525 -4.031 40 1HB ARG 7 HB1 ARG 7 18.021 -2.735 -3.059 41 2HB ARG 7 HB2 ARG 7 18.056 -1.016 -3.448 42 1HG ARG 7 HG1 ARG 7 19.279 -2.273 -5.637 43 2HG ARG 7 HG2 ARG 7 17.900 -3.298 -5.239 44 1HD ARG 7 HD1 ARG 7 16.391 -1.712 -5.900 45 2HD ARG 7 HD2 ARG 7 17.332 -0.391 -5.181 46 HE ARG 7 HE ARG 7 18.466 -0.153 -7.249 47 1HH1 ARG 7 HH11 ARG 7 16.815 -3.213 -7.078 48 2HH1 ARG 7 HH12 ARG 7 17.161 -3.616 -8.724 49 1HH2 ARG 7 HH22 ARG 7 18.902 -0.700 -9.383 50 2HH2 ARG 7 HH21 ARG 7 18.334 -2.206 -10.020 51 H SER 8 HN SER 8 19.388 -0.017 -4.901 52 HA SER 8 HA SER 8 21.517 1.807 -3.974 53 1HB SER 8 HB1 SER 8 20.923 1.430 -6.374 54 2HB SER 8 HB2 SER 8 19.323 2.101 -6.059 55 HG SER 8 HG SER 8 21.772 3.358 -6.290 56 H ALA 9 HN ALA 9 18.736 1.061 -2.553 57 HA ALA 9 HA ALA 9 17.276 2.174 -1.097 58 1HB ALA 9 HB1 ALA 9 19.716 3.870 -1.335 59 2HB ALA 9 HB2 ALA 9 19.022 3.090 0.084 60 3HB ALA 9 HB3 ALA 9 18.313 4.579 -0.537 61 HA PRO 10 HA PRO 10 14.940 4.449 -4.192 62 1HB PRO 10 HB2 PRO 10 12.728 4.374 -2.270 63 2HB PRO 10 HB1 PRO 10 12.845 3.593 -3.854 64 1HG PRO 10 HG2 PRO 10 12.885 2.249 -1.486 65 2HG PRO 10 HG1 PRO 10 13.628 1.654 -2.976 66 1HD PRO 10 HD2 PRO 10 14.905 2.869 -0.579 67 2HD PRO 10 HD1 PRO 10 15.512 1.610 -1.675 68 HA PRO 11 HA PRO 11 15.025 8.562 -2.709 69 1HB PRO 11 HB2 PRO 11 12.289 9.123 -3.686 70 2HB PRO 11 HB1 PRO 11 13.831 9.814 -4.218 71 1HG PRO 11 HG1 PRO 11 12.406 8.063 -5.699 72 2HG PRO 11 HG2 PRO 11 14.169 8.184 -5.771 73 1HD PRO 11 HD1 PRO 11 12.465 6.125 -4.471 74 2HD PRO 11 HD2 PRO 11 14.063 5.974 -5.221 75 H LEU 12 HN LEU 12 13.589 10.238 -1.504 76 HA LEU 12 HA LEU 12 12.530 10.773 0.534 77 1HB LEU 12 HB2 LEU 12 10.862 9.193 -1.172 78 2HB LEU 12 HB1 LEU 12 10.532 8.712 0.494 79 HG LEU 12 HG LEU 12 10.792 11.576 0.375 80 1HD1 LEU 12 HD21 LEU 12 10.143 11.141 -2.037 81 2HD1 LEU 12 HD22 LEU 12 9.019 12.158 -1.136 82 3HD1 LEU 12 HD23 LEU 12 8.633 10.463 -1.430 83 1HD2 LEU 12 HD11 LEU 12 8.701 9.545 1.098 84 2HD2 LEU 12 HD12 LEU 12 8.275 11.255 1.049 85 3HD2 LEU 12 HD13 LEU 12 9.542 10.693 2.139 86 H ASN 13 HN ASN 13 11.304 9.284 2.479 87 HA ASN 13 HA ASN 13 13.588 7.832 3.641 88 1HB ASN 13 HB1 ASN 13 11.163 9.245 4.468 89 2HB ASN 13 HB2 ASN 13 11.383 7.744 5.366 90 1HD2 ASN 13 HD22 ASN 13 11.792 9.420 7.199 91 2HD2 ASN 13 HD21 ASN 13 13.383 9.981 7.385 92 H LEU 14 HN LEU 14 13.695 5.800 2.607 93 HA LEU 14 HA LEU 14 11.971 3.723 3.581 94 1HB LEU 14 HB2 LEU 14 10.868 5.245 1.526 95 2HB LEU 14 HB1 LEU 14 11.518 3.839 0.681 96 HG LEU 14 HG LEU 14 10.358 2.641 2.845 97 1HD1 LEU 14 HD11 LEU 14 9.089 4.218 3.880 98 2HD1 LEU 14 HD12 LEU 14 7.981 3.965 2.531 99 3HD1 LEU 14 HD13 LEU 14 9.131 5.301 2.488 100 1HD2 LEU 14 HD21 LEU 14 8.292 2.559 1.124 101 2HD2 LEU 14 HD22 LEU 14 9.792 1.676 0.834 102 3HD2 LEU 14 HD23 LEU 14 9.517 3.230 0.046 103 H THR 15 HN THR 15 14.778 4.132 3.323 104 HA THR 15 HA THR 15 15.604 2.278 1.134 105 HB THR 15 HB THR 15 17.837 3.211 1.621 106 HG1 THR 15 HG1 THR 15 18.072 3.756 3.631 107 1HG2 THR 15 HG21 THR 15 17.411 5.498 0.961 108 2HG2 THR 15 HG22 THR 15 15.778 5.436 1.627 109 3HG2 THR 15 HG23 THR 15 16.184 4.486 0.198 110 H GLY 16 HN GLY 16 15.683 2.703 4.654 111 1HA GLY 16 HA2 GLY 16 16.343 -0.194 4.895 112 2HA GLY 16 HA1 GLY 16 17.236 0.984 5.857 113 H LEU 17 HN LEU 17 13.881 1.607 5.192 114 HA LEU 17 HA LEU 17 13.222 1.720 7.999 115 1HB LEU 17 HB2 LEU 17 11.713 1.821 5.376 116 2HB LEU 17 HB1 LEU 17 10.858 1.903 6.912 117 HG LEU 17 HG LEU 17 13.008 3.809 5.956 118 1HD1 LEU 17 HD21 LEU 17 11.224 5.435 5.889 119 2HD1 LEU 17 HD22 LEU 17 10.095 4.307 6.641 120 3HD1 LEU 17 HD23 LEU 17 10.670 4.017 4.999 121 1HD2 LEU 17 HD11 LEU 17 11.838 4.900 8.206 122 2HD2 LEU 17 HD12 LEU 17 13.401 4.083 8.178 123 3HD2 LEU 17 HD13 LEU 17 11.948 3.192 8.632 124 HA PRO 18 HA PRO 18 11.920 -2.392 8.813 125 1HB PRO 18 HB2 PRO 18 9.659 -2.045 10.315 126 2HB PRO 18 HB1 PRO 18 11.270 -1.612 10.924 127 1HG PRO 18 HG2 PRO 18 9.174 0.141 9.685 128 2HG PRO 18 HG1 PRO 18 10.135 0.413 11.153 129 1HD PRO 18 HD2 PRO 18 10.748 1.550 8.792 130 2HD PRO 18 HD1 PRO 18 12.004 1.050 9.946 131 H GLY 19 HN GLY 19 11.272 -3.240 6.768 132 1HA GLY 19 HA1 GLY 19 9.101 -4.512 6.156 133 2HA GLY 19 HA2 GLY 19 8.387 -2.904 6.069 134 H THR 20 HN THR 20 10.738 -1.627 4.906 135 HA THR 20 HA THR 20 10.268 -1.906 2.140 136 HB THR 20 HB THR 20 12.966 -1.283 3.367 137 HG1 THR 20 HG1 THR 20 12.103 0.802 3.760 138 1HG2 THR 20 HG21 THR 20 13.095 0.329 1.557 139 2HG2 THR 20 HG22 THR 20 11.415 0.026 1.114 140 3HG2 THR 20 HG23 THR 20 12.630 -1.229 0.875 141 H GLU 21 HN GLU 21 12.298 -3.778 4.302 142 HA GLU 21 HA GLU 21 13.893 -5.207 2.434 143 1HB GLU 21 HB1 GLU 21 14.317 -5.306 4.795 144 2HB GLU 21 HB2 GLU 21 12.669 -5.817 5.144 145 1HG GLU 21 HG2 GLU 21 13.068 -8.008 4.459 146 2HG GLU 21 HG1 GLU 21 14.370 -7.538 3.366 147 H LYS 22 HN LYS 22 10.481 -5.333 3.105 148 HA LYS 22 HA LYS 22 10.224 -7.866 1.527 149 1HB LYS 22 HB2 LYS 22 8.601 -6.479 3.669 150 2HB LYS 22 HB1 LYS 22 7.869 -7.716 2.646 151 1HG LYS 22 HG2 LYS 22 10.146 -8.997 3.341 152 2HG LYS 22 HG1 LYS 22 9.930 -7.988 4.771 153 1HD LYS 22 HD2 LYS 22 7.554 -8.817 4.904 154 2HD LYS 22 HD1 LYS 22 7.932 -9.946 3.602 155 1HE LYS 22 HE1 LYS 22 9.194 -11.296 4.974 156 2HE LYS 22 HE2 LYS 22 9.814 -9.925 5.914 157 1HZ LYS 22 HZ1 LYS 22 7.751 -9.704 7.028 158 2HZ LYS 22 HZ2 LYS 22 8.127 -11.359 7.087 159 3HZ LYS 22 HZ3 LYS 22 6.973 -10.789 5.979 160 H LEU 23 HN LEU 23 9.450 -4.460 1.630 161 HA LEU 23 HA LEU 23 7.210 -4.258 -0.053 162 1HB LEU 23 HB2 LEU 23 9.725 -2.606 0.313 163 2HB LEU 23 HB1 LEU 23 8.411 -2.061 -0.728 164 HG LEU 23 HG LEU 23 8.198 -2.715 2.228 165 1HD1 LEU 23 HD21 LEU 23 7.581 -0.063 0.959 166 2HD1 LEU 23 HD22 LEU 23 9.259 -0.482 1.302 167 3HD1 LEU 23 HD23 LEU 23 8.081 -0.415 2.613 168 1HD2 LEU 23 HD11 LEU 23 6.034 -3.149 1.698 169 2HD2 LEU 23 HD12 LEU 23 6.202 -2.459 0.084 170 3HD2 LEU 23 HD13 LEU 23 5.891 -1.407 1.464 171 H ASN 24 HN ASN 24 6.889 -4.961 -2.120 172 HA ASN 24 HA ASN 24 9.009 -6.095 -3.725 173 1HB ASN 24 HB2 ASN 24 6.164 -5.236 -4.376 174 2HB ASN 24 HB1 ASN 24 7.149 -6.313 -5.366 175 1HD2 ASN 24 HD22 ASN 24 6.453 -8.429 -5.032 176 2HD2 ASN 24 HD21 ASN 24 6.038 -9.094 -3.526 177 H GLU 25 HN GLU 25 9.364 -5.307 -6.049 178 HA GLU 25 HA GLU 25 10.411 -2.653 -6.077 179 1HB GLU 25 HB2 GLU 25 10.593 -3.139 -8.542 180 2HB GLU 25 HB1 GLU 25 11.192 -4.455 -7.533 181 1HG GLU 25 HG1 GLU 25 9.396 -5.835 -8.029 182 2HG GLU 25 HG2 GLU 25 8.307 -4.483 -8.336 183 H LYS 26 HN LYS 26 7.205 -3.870 -6.716 184 HA LYS 26 HA LYS 26 6.342 -1.468 -8.186 185 1HB LYS 26 HB1 LYS 26 5.192 -4.078 -7.241 186 2HB LYS 26 HB2 LYS 26 4.079 -2.783 -7.681 187 1HG LYS 26 HG2 LYS 26 6.053 -2.851 -9.707 188 2HG LYS 26 HG1 LYS 26 5.593 -4.528 -9.411 189 1HD LYS 26 HD2 LYS 26 3.144 -3.542 -9.440 190 2HD LYS 26 HD1 LYS 26 3.900 -2.233 -10.349 191 1HE LYS 26 HE2 LYS 26 4.400 -5.111 -11.121 192 2HE LYS 26 HE1 LYS 26 2.962 -4.251 -11.702 193 1HZ LYS 26 HZ1 LYS 26 4.468 -2.423 -12.392 194 2HZ LYS 26 HZ2 LYS 26 4.748 -3.867 -13.240 195 3HZ LYS 26 HZ3 LYS 26 5.798 -3.398 -11.990 196 H GLU 27 HN GLU 27 5.337 -3.015 -5.105 197 HA GLU 27 HA GLU 27 3.789 -0.872 -4.101 198 1HB GLU 27 HB2 GLU 27 5.562 -2.869 -2.641 199 2HB GLU 27 HB1 GLU 27 4.207 -1.993 -1.927 200 1HG GLU 27 HG2 GLU 27 2.878 -3.043 -3.965 201 2HG GLU 27 HG1 GLU 27 4.180 -4.231 -3.921 202 H LYS 28 HN LYS 28 7.289 -1.411 -4.013 203 HA LYS 28 HA LYS 28 8.080 0.523 -2.119 204 1HB LYS 28 HB2 LYS 28 9.205 -0.699 -4.620 205 2HB LYS 28 HB1 LYS 28 10.082 0.640 -3.881 206 1HG LYS 28 HG2 LYS 28 10.124 -0.576 -1.731 207 2HG LYS 28 HG1 LYS 28 9.250 -1.916 -2.474 208 1HD LYS 28 HD2 LYS 28 11.567 -2.523 -2.528 209 2HD LYS 28 HD1 LYS 28 11.148 -2.041 -4.173 210 1HE LYS 28 HE1 LYS 28 11.957 0.297 -2.692 211 2HE LYS 28 HE2 LYS 28 13.205 -0.955 -2.547 212 1HZ LYS 28 HZ1 LYS 28 13.630 0.122 -4.586 213 2HZ LYS 28 HZ2 LYS 28 11.987 0.146 -5.019 214 3HZ LYS 28 HZ3 LYS 28 12.842 -1.321 -5.011 215 H GLU 29 HN GLU 29 7.891 1.005 -5.676 216 HA GLU 29 HA GLU 29 8.288 3.817 -5.650 217 1HB GLU 29 HB1 GLU 29 8.387 2.310 -7.624 218 2HB GLU 29 HB2 GLU 29 6.643 2.065 -7.516 219 1HG GLU 29 HG2 GLU 29 7.357 4.898 -7.522 220 2HG GLU 29 HG1 GLU 29 7.927 4.067 -8.969 221 H LEU 30 HN LEU 30 5.321 1.888 -5.311 222 HA LEU 30 HA LEU 30 3.416 3.997 -5.487 223 1HB LEU 30 HB2 LEU 30 2.924 1.570 -5.517 224 2HB LEU 30 HB1 LEU 30 3.443 1.440 -3.837 225 HG LEU 30 HG LEU 30 1.632 3.423 -3.579 226 1HD1 LEU 30 HD11 LEU 30 1.109 2.121 -6.170 227 2HD1 LEU 30 HD12 LEU 30 0.541 3.674 -5.557 228 3HD1 LEU 30 HD13 LEU 30 -0.294 2.188 -5.104 229 1HD2 LEU 30 HD21 LEU 30 1.797 1.108 -2.473 230 2HD2 LEU 30 HD22 LEU 30 0.733 0.543 -3.761 231 3HD2 LEU 30 HD23 LEU 30 0.179 1.788 -2.642 232 H CYS 31 HN CYS 31 5.100 2.637 -2.633 233 HA CYS 31 HA CYS 31 3.893 4.504 -0.765 234 1HB CYS 31 HB1 CYS 31 6.043 2.423 -0.828 235 2HB CYS 31 HB2 CYS 31 6.088 3.582 0.500 236 HG CYS 31 HG CYS 31 4.530 1.502 1.116 237 H GLN 32 HN GLN 32 7.047 4.335 -2.440 238 HA GLN 32 HA GLN 32 8.285 6.592 -1.246 239 1HB GLN 32 HB1 GLN 32 8.407 5.260 -3.963 240 2HB GLN 32 HB2 GLN 32 9.458 6.618 -3.562 241 1HG GLN 32 HG1 GLN 32 10.609 5.416 -1.929 242 2HG GLN 32 HG2 GLN 32 9.273 4.294 -1.670 243 1HE2 GLN 32 HE21 GLN 32 10.635 5.216 -4.850 244 2HE2 GLN 32 HE22 GLN 32 11.196 3.662 -5.240 245 H VAL 33 HN VAL 33 6.478 6.462 -4.347 246 HA VAL 33 HA VAL 33 6.428 9.229 -4.907 247 HB VAL 33 HB VAL 33 4.324 7.078 -5.363 248 1HG1 VAL 33 HG11 VAL 33 3.243 9.065 -5.955 249 2HG1 VAL 33 HG12 VAL 33 4.002 8.601 -7.478 250 3HG1 VAL 33 HG13 VAL 33 4.741 9.843 -6.467 251 1HG2 VAL 33 HG21 VAL 33 6.947 7.088 -6.198 252 2HG2 VAL 33 HG22 VAL 33 6.126 7.861 -7.554 253 3HG2 VAL 33 HG23 VAL 33 5.632 6.253 -7.025 254 H VAL 34 HN VAL 34 4.239 7.276 -2.882 255 HA VAL 34 HA VAL 34 2.623 9.623 -2.167 256 HB VAL 34 HB VAL 34 2.675 6.661 -1.523 257 1HG1 VAL 34 HG11 VAL 34 0.850 8.828 -0.489 258 2HG1 VAL 34 HG12 VAL 34 1.773 7.649 0.438 259 3HG1 VAL 34 HG13 VAL 34 0.384 7.127 -0.512 260 1HG2 VAL 34 HG21 VAL 34 0.282 7.177 -2.680 261 2HG2 VAL 34 HG22 VAL 34 1.724 6.750 -3.601 262 3HG2 VAL 34 HG23 VAL 34 1.258 8.441 -3.427 263 H ARG 35 HN ARG 35 5.625 8.606 -1.198 264 HA ARG 35 HA ARG 35 6.898 8.910 0.766 265 1HB ARG 35 HB2 ARG 35 4.627 10.853 1.344 266 2HB ARG 35 HB1 ARG 35 6.268 10.941 1.981 267 1HG ARG 35 HG2 ARG 35 7.054 11.075 -0.451 268 2HG ARG 35 HG1 ARG 35 5.364 11.336 -0.879 269 1HD ARG 35 HD1 ARG 35 5.496 13.195 1.008 270 2HD ARG 35 HD2 ARG 35 7.230 13.130 0.640 271 HE ARG 35 HE ARG 35 5.839 13.161 -1.832 272 1HH1 ARG 35 HH12 ARG 35 6.357 15.216 0.930 273 2HH1 ARG 35 HH11 ARG 35 6.181 16.674 0.016 274 1HH2 ARG 35 HH22 ARG 35 5.615 15.068 -2.996 275 2HH2 ARG 35 HH21 ARG 35 5.764 16.593 -2.189 276 H LEU 36 HN LEU 36 5.303 6.659 0.940 277 HA LEU 36 HA LEU 36 3.829 6.808 3.524 278 1HB LEU 36 HB1 LEU 36 3.886 5.144 1.070 279 2HB LEU 36 HB2 LEU 36 3.604 4.245 2.560 280 HG LEU 36 HG LEU 36 2.071 6.778 2.139 281 1HD1 LEU 36 HD21 LEU 36 0.391 5.636 0.799 282 2HD1 LEU 36 HD22 LEU 36 1.307 4.131 0.870 283 3HD1 LEU 36 HD23 LEU 36 1.944 5.510 -0.026 284 1HD2 LEU 36 HD11 LEU 36 1.767 4.157 3.564 285 2HD2 LEU 36 HD12 LEU 36 0.319 5.071 3.140 286 3HD2 LEU 36 HD13 LEU 36 1.546 5.794 4.181 287 H VAL 37 HN VAL 37 4.136 4.628 4.817 288 HA VAL 37 HA VAL 37 7.075 4.175 5.182 289 HB VAL 37 HB VAL 37 4.640 4.283 6.971 290 1HG1 VAL 37 HG11 VAL 37 6.139 2.194 7.439 291 2HG1 VAL 37 HG12 VAL 37 5.711 3.247 8.780 292 3HG1 VAL 37 HG13 VAL 37 7.304 3.374 8.034 293 1HG2 VAL 37 HG21 VAL 37 5.596 6.371 6.980 294 2HG2 VAL 37 HG22 VAL 37 7.210 5.748 6.637 295 3HG2 VAL 37 HG23 VAL 37 6.547 5.629 8.267 296 HA PRO 38 HA PRO 38 6.471 0.000 3.948 297 1HB PRO 38 HB2 PRO 38 8.128 -1.018 6.131 298 2HB PRO 38 HB1 PRO 38 8.476 -0.997 4.402 299 1HG PRO 38 HG2 PRO 38 9.707 0.555 6.287 300 2HG PRO 38 HG1 PRO 38 9.641 0.927 4.559 301 1HD PRO 38 HD2 PRO 38 8.196 2.162 6.806 302 2HD PRO 38 HD1 PRO 38 8.580 2.825 5.210 303 H GLY 39 HN GLY 39 6.936 -0.304 7.484 304 1HA GLY 39 HA1 GLY 39 5.031 -2.318 7.908 305 2HA GLY 39 HA2 GLY 39 5.504 -1.152 9.143 306 H ALA 40 HN ALA 40 4.553 1.212 7.934 307 HA ALA 40 HA ALA 40 1.853 1.309 8.734 308 1HB ALA 40 HB1 ALA 40 3.484 3.197 8.302 309 2HB ALA 40 HB2 ALA 40 1.879 3.471 7.626 310 3HB ALA 40 HB3 ALA 40 3.202 2.964 6.577 311 H TYR 41 HN TYR 41 2.988 1.443 5.335 312 HA TYR 41 HA TYR 41 0.479 0.940 4.116 313 1HB TYR 41 HB2 TYR 41 2.512 1.784 2.994 314 2HB TYR 41 HB1 TYR 41 3.310 0.234 3.253 315 HD1 TYR 41 HD1 TYR 41 0.666 2.003 1.383 316 HD2 TYR 41 HD2 TYR 41 2.706 -1.733 1.956 317 HE1 TYR 41 HE1 TYR 41 -0.333 1.136 -0.715 318 HE2 TYR 41 HE2 TYR 41 1.707 -2.600 -0.142 319 HH TYR 41 HH TYR 41 0.781 -1.489 -2.332 320 H LEU 42 HN LEU 42 3.099 -1.368 4.939 321 HA LEU 42 HA LEU 42 1.946 -3.753 4.003 322 1HB LEU 42 HB1 LEU 42 3.750 -2.944 6.269 323 2HB LEU 42 HB2 LEU 42 3.214 -4.622 6.177 324 HG LEU 42 HG LEU 42 4.064 -3.637 3.574 325 1HD1 LEU 42 HD21 LEU 42 6.571 -3.918 4.681 326 2HD1 LEU 42 HD22 LEU 42 5.722 -2.992 5.918 327 3HD1 LEU 42 HD23 LEU 42 5.821 -2.376 4.269 328 1HD2 LEU 42 HD11 LEU 42 4.829 -5.897 5.434 329 2HD2 LEU 42 HD12 LEU 42 5.590 -5.674 3.859 330 3HD2 LEU 42 HD13 LEU 42 3.857 -5.984 3.965 331 H GLU 43 HN GLU 43 1.185 -1.885 6.901 332 HA GLU 43 HA GLU 43 -0.477 -3.913 8.149 333 1HB GLU 43 HB1 GLU 43 0.717 -1.592 8.907 334 2HB GLU 43 HB2 GLU 43 -0.925 -1.008 8.641 335 1HG GLU 43 HG2 GLU 43 -1.674 -3.034 10.057 336 2HG GLU 43 HG1 GLU 43 0.015 -3.150 10.550 337 H TYR 44 HN TYR 44 -1.378 -0.779 6.644 338 HA TYR 44 HA TYR 44 -4.153 -1.204 6.487 339 1HB TYR 44 HB2 TYR 44 -2.291 0.197 4.531 340 2HB TYR 44 HB1 TYR 44 -4.021 0.499 4.687 341 HD1 TYR 44 HD1 TYR 44 -1.238 2.162 5.288 342 HD2 TYR 44 HD2 TYR 44 -4.416 0.432 7.604 343 HE1 TYR 44 HE1 TYR 44 -0.793 3.784 7.111 344 HE2 TYR 44 HE2 TYR 44 -3.971 2.055 9.426 345 HH TYR 44 HH TYR 44 -2.836 4.550 9.427 346 H LYS 45 HN LYS 45 -1.620 -2.150 4.152 347 HA LYS 45 HA LYS 45 -3.299 -3.181 2.106 348 1HB LYS 45 HB2 LYS 45 -0.606 -2.906 2.627 349 2HB LYS 45 HB1 LYS 45 -0.804 -4.657 2.696 350 1HG LYS 45 HG1 LYS 45 -2.308 -3.787 0.467 351 2HG LYS 45 HG2 LYS 45 -0.771 -2.928 0.381 352 1HD LYS 45 HD1 LYS 45 -0.366 -4.972 -0.753 353 2HD LYS 45 HD2 LYS 45 0.325 -5.216 0.851 354 1HE LYS 45 HE1 LYS 45 -2.056 -6.156 1.449 355 2HE LYS 45 HE2 LYS 45 -2.211 -6.357 -0.307 356 1HZ LYS 45 HZ1 LYS 45 0.010 -7.364 1.401 357 2HZ LYS 45 HZ2 LYS 45 -0.037 -7.478 -0.293 358 3HZ LYS 45 HZ3 LYS 45 -1.180 -8.312 0.647 359 H SER 46 HN SER 46 -1.971 -4.761 5.022 360 HA SER 46 HA SER 46 -3.075 -7.369 4.448 361 1HB SER 46 HB2 SER 46 -1.410 -6.076 6.343 362 2HB SER 46 HB1 SER 46 -2.727 -6.802 7.263 363 HG SER 46 HG SER 46 -1.384 -8.456 7.051 364 H ALA 47 HN ALA 47 -4.098 -4.780 6.707 365 HA ALA 47 HA ALA 47 -6.463 -6.009 7.664 366 1HB ALA 47 HB1 ALA 47 -6.621 -3.993 8.731 367 2HB ALA 47 HB2 ALA 47 -6.567 -3.093 7.214 368 3HB ALA 47 HB3 ALA 47 -5.070 -3.640 7.969 369 H LEU 48 HN LEU 48 -6.083 -3.727 4.922 370 HA LEU 48 HA LEU 48 -8.780 -3.625 4.090 371 1HB LEU 48 HB2 LEU 48 -6.067 -3.232 2.928 372 2HB LEU 48 HB1 LEU 48 -7.376 -3.435 1.764 373 HG LEU 48 HG LEU 48 -8.633 -1.614 2.833 374 1HD1 LEU 48 HD11 LEU 48 -7.766 -0.375 4.695 375 2HD1 LEU 48 HD12 LEU 48 -6.209 -1.197 4.598 376 3HD1 LEU 48 HD13 LEU 48 -7.640 -2.079 5.132 377 1HD2 LEU 48 HD21 LEU 48 -6.821 -1.188 1.076 378 2HD2 LEU 48 HD22 LEU 48 -5.788 -0.678 2.411 379 3HD2 LEU 48 HD23 LEU 48 -7.280 0.197 2.066 380 H LEU 49 HN LEU 49 -6.235 -5.982 3.257 381 HA LEU 49 HA LEU 49 -7.725 -7.462 1.317 382 1HB LEU 49 HB1 LEU 49 -5.191 -7.432 2.305 383 2HB LEU 49 HB2 LEU 49 -5.815 -8.866 3.121 384 HG LEU 49 HG LEU 49 -6.763 -9.245 0.581 385 1HD1 LEU 49 HD11 LEU 49 -5.686 -7.595 -0.630 386 2HD1 LEU 49 HD12 LEU 49 -4.451 -8.852 -0.695 387 3HD1 LEU 49 HD13 LEU 49 -4.310 -7.538 0.473 388 1HD2 LEU 49 HD21 LEU 49 -4.137 -10.091 1.832 389 2HD2 LEU 49 HD22 LEU 49 -4.771 -10.795 0.345 390 3HD2 LEU 49 HD23 LEU 49 -5.666 -10.970 1.854 391 H ASN 50 HN ASN 50 -7.356 -7.920 4.847 392 HA ASN 50 HA ASN 50 -8.997 -10.283 4.995 393 1HB ASN 50 HB2 ASN 50 -7.285 -8.967 6.626 394 2HB ASN 50 HB1 ASN 50 -8.812 -8.375 7.283 395 1HD2 ASN 50 HD22 ASN 50 -7.605 -11.568 6.071 396 2HD2 ASN 50 HD21 ASN 50 -8.200 -12.452 7.392 397 H GLU 51 HN GLU 51 -9.712 -6.857 5.800 398 HA GLU 51 HA GLU 51 -12.464 -7.221 6.428 399 1HB GLU 51 HB2 GLU 51 -10.698 -5.208 6.557 400 2HB GLU 51 HB1 GLU 51 -11.489 -4.745 5.050 401 1HG GLU 51 HG2 GLU 51 -13.238 -3.927 6.205 402 2HG GLU 51 HG1 GLU 51 -13.510 -5.512 6.931 403 H CYS 52 HN CYS 52 -10.972 -6.169 3.337 404 HA CYS 52 HA CYS 52 -13.291 -5.928 1.773 405 1HB CYS 52 HB1 CYS 52 -10.894 -5.393 1.184 406 2HB CYS 52 HB2 CYS 52 -10.617 -7.119 0.951 407 HG CYS 52 HG CYS 52 -12.657 -6.914 -0.889 408 H HIS 53 HN HIS 53 -11.379 -8.872 2.448 409 HA HIS 53 HA HIS 53 -12.991 -10.631 0.825 410 1HB HIS 53 HB1 HIS 53 -10.598 -10.858 1.834 411 2HB HIS 53 HB2 HIS 53 -11.426 -11.400 3.292 412 HD1 HIS 53 HD1 HIS 53 -10.777 -12.375 -0.283 413 HD2 HIS 53 HD2 HIS 53 -12.639 -13.961 3.093 414 HE1 HIS 53 HE1 HIS 53 -11.276 -14.801 -0.813 415 H LYS 54 HN LYS 54 -13.161 -9.550 4.191 416 HA LYS 54 HA LYS 54 -15.143 -11.470 5.054 417 1HB LYS 54 HB2 LYS 54 -13.516 -9.470 6.134 418 2HB LYS 54 HB1 LYS 54 -15.151 -8.851 6.372 419 1HG LYS 54 HG1 LYS 54 -15.784 -10.666 7.705 420 2HG LYS 54 HG2 LYS 54 -14.530 -11.715 7.044 421 1HD LYS 54 HD2 LYS 54 -13.921 -9.267 8.720 422 2HD LYS 54 HD1 LYS 54 -14.097 -10.883 9.405 423 1HE LYS 54 HE1 LYS 54 -12.029 -11.507 8.683 424 2HE LYS 54 HE2 LYS 54 -12.304 -10.815 7.073 425 1HZ LYS 54 HZ1 LYS 54 -11.809 -8.663 7.856 426 2HZ LYS 54 HZ2 LYS 54 -10.590 -9.650 8.507 427 3HZ LYS 54 HZ3 LYS 54 -11.882 -9.139 9.484 428 H GLN 55 HN GLN 55 -15.438 -7.982 4.245 429 HA GLN 55 HA GLN 55 -18.351 -8.107 4.174 430 1HB GLN 55 HB1 GLN 55 -16.311 -6.056 3.232 431 2HB GLN 55 HB2 GLN 55 -18.040 -5.752 3.388 432 1HG GLN 55 HG1 GLN 55 -17.860 -6.383 5.818 433 2HG GLN 55 HG2 GLN 55 -16.111 -6.474 5.612 434 1HE2 GLN 55 HE22 GLN 55 -16.276 -4.627 7.324 435 2HE2 GLN 55 HE21 GLN 55 -16.442 -3.047 6.728 436 H GLY 56 HN GLY 56 -15.732 -8.251 1.801 437 1HA GLY 56 HA1 GLY 56 -15.764 -8.732 -0.494 438 2HA GLY 56 HA2 GLY 56 -17.270 -9.590 -0.170 439 H GLY 57 HN GLY 57 -15.886 -6.788 -1.579 440 1HA GLY 57 HA2 GLY 57 -17.309 -5.629 -3.261 441 2HA GLY 57 HA1 GLY 57 -18.639 -5.746 -2.110 442 H LEU 58 HN LEU 58 -15.308 -4.844 -1.297 443 HA LEU 58 HA LEU 58 -16.315 -2.347 -0.079 444 1HB LEU 58 HB1 LEU 58 -14.432 -4.190 0.601 445 2HB LEU 58 HB2 LEU 58 -13.412 -3.002 -0.211 446 HG LEU 58 HG LEU 58 -14.889 -1.328 1.289 447 1HD1 LEU 58 HD11 LEU 58 -16.149 -3.289 2.253 448 2HD1 LEU 58 HD12 LEU 58 -15.362 -2.275 3.462 449 3HD1 LEU 58 HD13 LEU 58 -14.641 -3.817 3.000 450 1HD2 LEU 58 HD21 LEU 58 -12.665 -1.013 1.680 451 2HD2 LEU 58 HD22 LEU 58 -12.317 -2.742 1.659 452 3HD2 LEU 58 HD23 LEU 58 -12.971 -1.991 3.115 453 H ARG 59 HN ARG 59 -15.984 -0.312 -0.959 454 HA ARG 59 HA ARG 59 -14.607 -0.198 -3.612 455 1HB ARG 59 HB2 ARG 59 -17.067 0.789 -2.471 456 2HB ARG 59 HB1 ARG 59 -16.098 2.156 -3.021 457 1HG ARG 59 HG2 ARG 59 -16.117 -0.106 -4.900 458 2HG ARG 59 HG1 ARG 59 -17.708 0.611 -4.641 459 1HD ARG 59 HD1 ARG 59 -16.702 2.872 -5.101 460 2HD ARG 59 HD2 ARG 59 -15.183 2.057 -5.520 461 HE ARG 59 HE ARG 59 -17.088 0.696 -7.002 462 1HH1 ARG 59 HH21 ARG 59 -16.200 4.043 -6.637 463 2HH1 ARG 59 HH22 ARG 59 -16.678 4.459 -8.245 464 1HH2 ARG 59 HH11 ARG 59 -17.701 1.261 -9.085 465 2HH2 ARG 59 HH12 ARG 59 -17.522 2.897 -9.624 466 H LEU 60 HN LEU 60 -14.054 2.447 -3.845 467 HA LEU 60 HA LEU 60 -11.656 2.812 -2.325 468 1HB LEU 60 HB1 LEU 60 -13.178 4.078 -4.434 469 2HB LEU 60 HB2 LEU 60 -12.631 5.309 -3.299 470 HG LEU 60 HG LEU 60 -10.914 5.057 -4.969 471 1HD1 LEU 60 HD11 LEU 60 -9.048 4.682 -3.602 472 2HD1 LEU 60 HD12 LEU 60 -9.844 3.396 -2.697 473 3HD1 LEU 60 HD13 LEU 60 -10.306 5.077 -2.432 474 1HD2 LEU 60 HD21 LEU 60 -10.987 3.072 -6.077 475 2HD2 LEU 60 HD22 LEU 60 -11.597 2.203 -4.668 476 3HD2 LEU 60 HD23 LEU 60 -9.870 2.524 -4.827 477 H ALA 61 HN ALA 61 -14.890 4.310 -2.024 478 HA ALA 61 HA ALA 61 -14.464 6.188 -0.017 479 1HB ALA 61 HB1 ALA 61 -16.844 4.523 0.419 480 2HB ALA 61 HB2 ALA 61 -16.595 4.915 -1.283 481 3HB ALA 61 HB3 ALA 61 -16.741 6.208 -0.092 482 H GLN 62 HN GLN 62 -15.183 2.710 0.512 483 HA GLN 62 HA GLN 62 -15.026 2.744 3.353 484 1HB GLN 62 HB1 GLN 62 -14.228 0.562 1.388 485 2HB GLN 62 HB2 GLN 62 -14.723 0.320 3.063 486 1HG GLN 62 HG2 GLN 62 -16.789 1.841 1.981 487 2HG GLN 62 HG1 GLN 62 -16.371 0.723 0.683 488 1HE2 GLN 62 HE21 GLN 62 -17.301 0.830 4.144 489 2HE2 GLN 62 HE22 GLN 62 -17.920 -0.750 4.189 490 H ALA 63 HN ALA 63 -12.512 2.470 0.869 491 HA ALA 63 HA ALA 63 -10.327 1.786 2.599 492 1HB ALA 63 HB1 ALA 63 -10.341 3.414 0.031 493 2HB ALA 63 HB2 ALA 63 -10.469 1.656 0.077 494 3HB ALA 63 HB3 ALA 63 -9.005 2.451 0.657 495 H ARG 64 HN ARG 64 -11.194 4.961 1.169 496 HA ARG 64 HA ARG 64 -9.355 6.541 2.629 497 1HB ARG 64 HB1 ARG 64 -12.161 7.154 1.628 498 2HB ARG 64 HB2 ARG 64 -10.948 8.367 2.035 499 1HG ARG 64 HG2 ARG 64 -9.422 7.219 0.340 500 2HG ARG 64 HG1 ARG 64 -10.836 6.309 -0.182 501 1HD ARG 64 HD1 ARG 64 -10.524 9.331 -0.224 502 2HD ARG 64 HD2 ARG 64 -10.628 8.251 -1.628 503 HE ARG 64 HE ARG 64 -12.904 7.635 -0.191 504 1HH1 ARG 64 HH21 ARG 64 -11.506 10.599 -1.368 505 2HH1 ARG 64 HH22 ARG 64 -13.039 11.378 -1.551 506 1HH2 ARG 64 HH11 ARG 64 -14.883 8.669 -0.438 507 2HH2 ARG 64 HH12 ARG 64 -14.937 10.296 -1.030 508 H ALA 65 HN ALA 65 -12.265 4.961 3.694 509 HA ALA 65 HA ALA 65 -12.509 6.658 6.111 510 1HB ALA 65 HB1 ALA 65 -14.501 5.231 6.476 511 2HB ALA 65 HB2 ALA 65 -14.000 4.189 5.144 512 3HB ALA 65 HB3 ALA 65 -14.483 5.855 4.826 513 H LEU 66 HN LEU 66 -12.111 3.149 5.426 514 HA LEU 66 HA LEU 66 -11.521 2.280 8.042 515 1HB LEU 66 HB2 LEU 66 -11.634 1.241 5.479 516 2HB LEU 66 HB1 LEU 66 -9.927 1.059 5.879 517 HG LEU 66 HG LEU 66 -10.884 0.142 8.167 518 1HD1 LEU 66 HD11 LEU 66 -13.206 0.138 6.290 519 2HD1 LEU 66 HD12 LEU 66 -13.181 0.337 8.042 520 3HD1 LEU 66 HD13 LEU 66 -12.999 -1.268 7.334 521 1HD2 LEU 66 HD21 LEU 66 -9.730 -1.002 6.011 522 2HD2 LEU 66 HD22 LEU 66 -11.304 -1.796 5.949 523 3HD2 LEU 66 HD23 LEU 66 -10.300 -1.939 7.392 524 H ILE 67 HN ILE 67 -9.068 2.889 5.510 525 HA ILE 67 HA ILE 67 -7.100 3.519 7.668 526 HB ILE 67 HB ILE 67 -5.430 3.067 5.886 527 1HG1 ILE 67 HG11 ILE 67 -7.849 2.518 4.138 528 2HG1 ILE 67 HG12 ILE 67 -6.740 3.867 3.945 529 1HG2 ILE 67 HG21 ILE 67 -6.176 1.180 7.208 530 2HG2 ILE 67 HG22 ILE 67 -6.016 0.650 5.534 531 3HG2 ILE 67 HG23 ILE 67 -7.612 0.990 6.203 532 1HD1 ILE 67 HD11 ILE 67 -4.928 2.423 3.380 533 2HD1 ILE 67 HD12 ILE 67 -6.308 1.837 2.453 534 3HD1 ILE 67 HD13 ILE 67 -5.807 0.992 3.917 535 H LYS 68 HN LYS 68 -8.732 5.565 7.501 536 HA LYS 68 HA LYS 68 -8.353 7.455 5.387 537 1HB LYS 68 HB1 LYS 68 -9.384 8.990 7.088 538 2HB LYS 68 HB2 LYS 68 -10.243 7.457 6.948 539 1HG LYS 68 HG1 LYS 68 -9.680 6.808 9.052 540 2HG LYS 68 HG2 LYS 68 -8.042 7.446 8.912 541 1HD LYS 68 HD1 LYS 68 -8.635 9.284 10.067 542 2HD LYS 68 HD2 LYS 68 -9.900 9.638 8.890 543 1HE LYS 68 HE1 LYS 68 -11.552 8.649 10.174 544 2HE LYS 68 HE2 LYS 68 -10.437 7.458 10.870 545 1HZ LYS 68 HZ1 LYS 68 -11.109 9.289 12.422 546 2HZ LYS 68 HZ2 LYS 68 -10.281 10.376 11.413 547 3HZ LYS 68 HZ3 LYS 68 -9.431 9.135 12.203 548 H ILE 69 HN ILE 69 -5.761 6.867 5.663 549 HA ILE 69 HA ILE 69 -4.328 8.419 7.648 550 HB ILE 69 HB ILE 69 -2.400 7.878 6.204 551 1HG1 ILE 69 HG11 ILE 69 -4.482 6.915 4.217 552 2HG1 ILE 69 HG12 ILE 69 -3.502 8.370 4.037 553 1HG2 ILE 69 HG21 ILE 69 -3.243 5.317 5.796 554 2HG2 ILE 69 HG22 ILE 69 -4.441 5.879 6.962 555 3HG2 ILE 69 HG23 ILE 69 -2.725 5.945 7.360 556 1HD1 ILE 69 HD11 ILE 69 -1.569 7.179 3.609 557 2HD1 ILE 69 HD12 ILE 69 -2.751 6.040 2.964 558 3HD1 ILE 69 HD13 ILE 69 -2.080 5.796 4.576 559 H ASP 70 HN ASP 70 -5.758 9.102 4.535 560 HA ASP 70 HA ASP 70 -5.600 11.949 4.893 561 1HB ASP 70 HB1 ASP 70 -3.274 10.615 3.908 562 2HB ASP 70 HB2 ASP 70 -3.957 11.539 2.573 563 H VAL 71 HN VAL 71 -5.469 12.562 2.016 564 HA VAL 71 HA VAL 71 -8.147 11.488 1.283 565 HB VAL 71 HB VAL 71 -6.646 13.670 -0.169 566 1HG1 VAL 71 HG11 VAL 71 -9.451 12.769 0.204 567 2HG1 VAL 71 HG12 VAL 71 -8.668 13.458 -1.218 568 3HG1 VAL 71 HG13 VAL 71 -9.197 14.510 0.095 569 1HG2 VAL 71 HG21 VAL 71 -8.056 13.960 2.501 570 2HG2 VAL 71 HG22 VAL 71 -7.612 15.315 1.462 571 3HG2 VAL 71 HG23 VAL 71 -6.355 14.291 2.161 572 H ASN 72 HN ASN 72 -5.221 12.395 -0.584 573 HA ASN 72 HA ASN 72 -5.927 10.470 -2.697 574 1HB ASN 72 HB2 ASN 72 -3.887 12.603 -2.157 575 2HB ASN 72 HB1 ASN 72 -3.506 11.395 -3.384 576 1HD2 ASN 72 HD22 ASN 72 -3.752 12.927 -5.159 577 2HD2 ASN 72 HD21 ASN 72 -5.274 13.529 -5.610 578 H LYS 73 HN LYS 73 -3.979 10.566 0.162 579 HA LYS 73 HA LYS 73 -1.961 8.663 -0.422 580 1HB LYS 73 HB2 LYS 73 -3.394 9.806 1.925 581 2HB LYS 73 HB1 LYS 73 -2.497 8.323 2.220 582 1HG LYS 73 HG2 LYS 73 -1.149 10.395 2.617 583 2HG LYS 73 HG1 LYS 73 -0.446 9.331 1.401 584 1HD LYS 73 HD2 LYS 73 -0.295 11.488 0.438 585 2HD LYS 73 HD1 LYS 73 -1.719 10.791 -0.325 586 1HE LYS 73 HE2 LYS 73 -3.171 12.214 0.792 587 2HE LYS 73 HE1 LYS 73 -2.133 12.299 2.226 588 1HZ LYS 73 HZ1 LYS 73 -1.768 13.643 -0.389 589 2HZ LYS 73 HZ2 LYS 73 -0.476 13.441 0.695 590 3HZ LYS 73 HZ3 LYS 73 -1.835 14.350 1.153 591 H THR 74 HN THR 74 -5.205 8.161 1.042 592 HA THR 74 HA THR 74 -4.937 5.268 1.108 593 HB THR 74 HB THR 74 -7.295 7.183 1.269 594 HG1 THR 74 HG1 THR 74 -5.857 5.769 3.262 595 1HG2 THR 74 HG21 THR 74 -8.427 5.214 0.861 596 2HG2 THR 74 HG22 THR 74 -8.151 5.010 2.592 597 3HG2 THR 74 HG23 THR 74 -7.094 4.208 1.430 598 H ARG 75 HN ARG 75 -6.172 7.613 -1.215 599 HA ARG 75 HA ARG 75 -7.646 5.780 -2.862 600 1HB ARG 75 HB1 ARG 75 -6.745 8.549 -2.823 601 2HB ARG 75 HB2 ARG 75 -6.623 7.876 -4.448 602 1HG ARG 75 HG2 ARG 75 -9.109 7.172 -3.023 603 2HG ARG 75 HG1 ARG 75 -8.928 8.893 -3.366 604 1HD ARG 75 HD2 ARG 75 -8.234 7.045 -5.596 605 2HD ARG 75 HD1 ARG 75 -9.954 7.163 -5.175 606 HE ARG 75 HE ARG 75 -8.844 9.793 -5.190 607 1HH1 ARG 75 HH12 ARG 75 -9.623 7.193 -7.370 608 2HH1 ARG 75 HH11 ARG 75 -9.896 8.251 -8.710 609 1HH2 ARG 75 HH22 ARG 75 -9.203 11.147 -6.946 610 2HH2 ARG 75 HH21 ARG 75 -9.660 10.474 -8.475 611 H LYS 76 HN LYS 76 -4.233 6.718 -2.752 612 HA LYS 76 HA LYS 76 -3.537 5.397 -5.256 613 1HB LYS 76 HB2 LYS 76 -2.031 6.494 -2.868 614 2HB LYS 76 HB1 LYS 76 -1.205 5.780 -4.252 615 1HG LYS 76 HG2 LYS 76 -2.455 7.403 -5.727 616 2HG LYS 76 HG1 LYS 76 -3.050 8.186 -4.264 617 1HD LYS 76 HD1 LYS 76 -0.779 8.705 -3.561 618 2HD LYS 76 HD2 LYS 76 -0.114 7.795 -4.917 619 1HE LYS 76 HE2 LYS 76 -1.203 9.373 -6.499 620 2HE LYS 76 HE1 LYS 76 -1.828 10.301 -5.123 621 1HZ LYS 76 HZ1 LYS 76 0.468 10.519 -4.319 622 2HZ LYS 76 HZ2 LYS 76 0.276 11.225 -5.852 623 3HZ LYS 76 HZ3 LYS 76 1.032 9.712 -5.703 624 H ILE 77 HN ILE 77 -3.191 4.608 -1.784 625 HA ILE 77 HA ILE 77 -1.961 2.048 -2.132 626 HB ILE 77 HB ILE 77 -3.833 3.125 0.013 627 1HG1 ILE 77 HG12 ILE 77 -0.810 3.173 -0.235 628 2HG1 ILE 77 HG11 ILE 77 -1.877 4.566 -0.369 629 1HG2 ILE 77 HG21 ILE 77 -3.498 1.206 1.153 630 2HG2 ILE 77 HG22 ILE 77 -1.758 1.283 0.877 631 3HG2 ILE 77 HG23 ILE 77 -2.809 0.533 -0.325 632 1HD1 ILE 77 HD11 ILE 77 -1.319 2.880 2.076 633 2HD1 ILE 77 HD12 ILE 77 -2.712 3.957 1.980 634 3HD1 ILE 77 HD13 ILE 77 -1.080 4.615 1.871 635 H TYR 78 HN TYR 78 -5.400 2.987 -1.778 636 HA TYR 78 HA TYR 78 -6.424 0.300 -2.030 637 1HB TYR 78 HB2 TYR 78 -7.396 2.735 -1.284 638 2HB TYR 78 HB1 TYR 78 -8.065 2.615 -2.912 639 HD1 TYR 78 HD1 TYR 78 -7.548 0.429 0.098 640 HD2 TYR 78 HD2 TYR 78 -10.112 1.532 -3.163 641 HE1 TYR 78 HE1 TYR 78 -9.264 -1.171 0.906 642 HE2 TYR 78 HE2 TYR 78 -11.828 -0.064 -2.357 643 HH TYR 78 HH TYR 78 -11.179 -2.452 -0.063 644 H ASP 79 HN ASP 79 -6.256 3.023 -4.368 645 HA ASP 79 HA ASP 79 -7.339 1.740 -6.621 646 1HB ASP 79 HB1 ASP 79 -6.685 4.123 -6.457 647 2HB ASP 79 HB2 ASP 79 -4.984 3.658 -6.419 648 H PHE 80 HN PHE 80 -4.257 1.231 -5.050 649 HA PHE 80 HA PHE 80 -2.988 -0.180 -7.260 650 1HB PHE 80 HB1 PHE 80 -1.923 1.010 -5.249 651 2HB PHE 80 HB2 PHE 80 -2.424 -0.379 -4.283 652 HD1 PHE 80 HD1 PHE 80 -0.418 0.626 -7.262 653 HD2 PHE 80 HD2 PHE 80 -1.195 -2.411 -4.325 654 HE1 PHE 80 HE1 PHE 80 1.575 -0.630 -8.034 655 HE2 PHE 80 HE2 PHE 80 0.799 -3.668 -5.098 656 HZ PHE 80 HZ PHE 80 2.184 -2.777 -6.952 657 H LEU 81 HN LEU 81 -4.314 -1.304 -4.110 658 HA LEU 81 HA LEU 81 -4.222 -4.088 -4.727 659 1HB LEU 81 HB2 LEU 81 -6.164 -2.564 -2.947 660 2HB LEU 81 HB1 LEU 81 -5.730 -4.264 -2.797 661 HG LEU 81 HG LEU 81 -3.412 -2.445 -2.816 662 1HD1 LEU 81 HD21 LEU 81 -5.065 -2.472 -0.301 663 2HD1 LEU 81 HD22 LEU 81 -5.359 -1.246 -1.534 664 3HD1 LEU 81 HD23 LEU 81 -3.776 -1.363 -0.768 665 1HD2 LEU 81 HD11 LEU 81 -3.935 -5.037 -2.101 666 2HD2 LEU 81 HD12 LEU 81 -3.961 -4.231 -0.533 667 3HD2 LEU 81 HD13 LEU 81 -2.530 -4.121 -1.557 668 H ILE 82 HN ILE 82 -6.664 -1.611 -5.388 669 HA ILE 82 HA ILE 82 -8.786 -3.366 -6.194 670 HB ILE 82 HB ILE 82 -8.052 -0.506 -6.824 671 1HG1 ILE 82 HG11 ILE 82 -8.510 -1.206 -4.439 672 2HG1 ILE 82 HG12 ILE 82 -9.584 0.026 -5.069 673 1HG2 ILE 82 HG21 ILE 82 -10.742 -1.846 -7.243 674 2HG2 ILE 82 HG22 ILE 82 -9.595 -1.531 -8.542 675 3HG2 ILE 82 HG23 ILE 82 -10.304 -0.187 -7.648 676 1HD1 ILE 82 HD11 ILE 82 -11.393 -1.458 -5.286 677 2HD1 ILE 82 HD12 ILE 82 -10.647 -1.937 -3.763 678 3HD1 ILE 82 HD13 ILE 82 -10.351 -2.877 -5.224 679 H ARG 83 HN ARG 83 -6.716 -1.301 -8.254 680 HA ARG 83 HA ARG 83 -7.442 -2.533 -10.721 681 1HB ARG 83 HB1 ARG 83 -5.293 -0.748 -9.654 682 2HB ARG 83 HB2 ARG 83 -5.059 -1.425 -11.258 683 1HG ARG 83 HG2 ARG 83 -6.196 0.785 -11.312 684 2HG ARG 83 HG1 ARG 83 -7.193 -0.502 -11.969 685 1HD ARG 83 HD1 ARG 83 -8.375 -0.690 -9.784 686 2HD ARG 83 HD2 ARG 83 -7.413 0.670 -9.173 687 HE ARG 83 HE ARG 83 -8.708 2.117 -10.533 688 1HH1 ARG 83 HH11 ARG 83 -9.091 -1.198 -11.526 689 2HH1 ARG 83 HH12 ARG 83 -10.340 -0.828 -12.663 690 1HH2 ARG 83 HH21 ARG 83 -10.331 2.572 -12.015 691 2HH2 ARG 83 HH22 ARG 83 -11.038 1.289 -12.940 692 H GLU 84 HN GLU 84 -4.816 -3.246 -8.429 693 HA GLU 84 HA GLU 84 -3.349 -5.049 -10.111 694 1HB GLU 84 HB1 GLU 84 -3.681 -4.660 -7.124 695 2HB GLU 84 HB2 GLU 84 -2.565 -5.854 -7.786 696 1HG GLU 84 HG1 GLU 84 -2.514 -2.953 -8.638 697 2HG GLU 84 HG2 GLU 84 -1.574 -3.549 -7.270 698 H GLY 85 HN GLY 85 -5.722 -5.749 -7.503 699 1HA GLY 85 HA1 GLY 85 -7.450 -7.502 -8.369 700 2HA GLY 85 HA2 GLY 85 -6.016 -8.484 -8.653 701 H TYR 86 HN TYR 86 -5.147 -6.825 -5.986 702 HA TYR 86 HA TYR 86 -5.400 -9.028 -4.194 703 1HB TYR 86 HB2 TYR 86 -4.903 -6.054 -3.917 704 2HB TYR 86 HB1 TYR 86 -4.896 -7.117 -2.510 705 HD1 TYR 86 HD1 TYR 86 -3.135 -6.136 -5.569 706 HD2 TYR 86 HD2 TYR 86 -3.221 -8.930 -2.307 707 HE1 TYR 86 HE1 TYR 86 -0.814 -6.829 -6.102 708 HE2 TYR 86 HE2 TYR 86 -0.900 -9.624 -2.841 709 HH TYR 86 HH TYR 86 0.646 -8.781 -5.753 710 H ILE 87 HN ILE 87 -7.397 -6.120 -4.652 711 HA ILE 87 HA ILE 87 -9.536 -7.442 -3.020 712 HB ILE 87 HB ILE 87 -10.035 -5.170 -2.135 713 1HG1 ILE 87 HG11 ILE 87 -7.516 -4.321 -3.585 714 2HG1 ILE 87 HG12 ILE 87 -9.142 -3.979 -4.174 715 1HG2 ILE 87 HG21 ILE 87 -8.578 -5.624 -0.479 716 2HG2 ILE 87 HG22 ILE 87 -7.223 -5.110 -1.487 717 3HG2 ILE 87 HG23 ILE 87 -7.784 -6.782 -1.546 718 1HD1 ILE 87 HD11 ILE 87 -8.051 -2.126 -2.791 719 2HD1 ILE 87 HD12 ILE 87 -8.212 -3.199 -1.401 720 3HD1 ILE 87 HD13 ILE 87 -9.650 -2.640 -2.253 721 H THR 88 HN THR 88 -11.703 -6.085 -3.508 722 HA THR 88 HA THR 88 -11.792 -5.664 -6.478 723 HB THR 88 HB THR 88 -14.267 -6.455 -5.979 724 HG1 THR 88 HG1 THR 88 -14.308 -7.854 -4.192 725 1HG2 THR 88 HG21 THR 88 -12.170 -8.588 -5.664 726 2HG2 THR 88 HG22 THR 88 -12.255 -7.652 -7.157 727 3HG2 THR 88 HG23 THR 88 -13.641 -8.612 -6.638 728 H LYS 89 HN LYS 89 -13.666 -4.253 -7.152 729 HA LYS 89 HA LYS 89 -14.068 -2.038 -5.170 730 1HB LYS 89 HB2 LYS 89 -12.792 -1.964 -7.539 731 2HB LYS 89 HB1 LYS 89 -14.434 -1.697 -8.120 732 1HG LYS 89 HG2 LYS 89 -14.599 0.103 -6.285 733 2HG LYS 89 HG1 LYS 89 -12.844 -0.027 -6.168 734 1HD LYS 89 HD2 LYS 89 -12.622 0.516 -8.549 735 2HD LYS 89 HD1 LYS 89 -14.377 0.576 -8.717 736 1HE LYS 89 HE2 LYS 89 -14.490 2.675 -7.826 737 2HE LYS 89 HE1 LYS 89 -13.325 2.283 -6.547 738 1HZ LYS 89 HZ1 LYS 89 -12.652 2.724 -9.413 739 2HZ LYS 89 HZ2 LYS 89 -11.545 2.390 -8.169 740 3HZ LYS 89 HZ3 LYS 89 -12.402 3.856 -8.173 741 H ALA 90 HN ALA 90 -15.907 -3.844 -4.680 742 HA ALA 90 HA ALA 90 -18.220 -4.326 -4.708 743 1HB ALA 90 HB1 ALA 90 -19.142 -1.953 -6.012 744 2HB ALA 90 HB2 ALA 90 -17.724 -1.515 -5.061 745 3HB ALA 90 HB3 ALA 90 -19.106 -2.285 -4.281
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