NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
5215 | 1go1 | 5485 | cing | 1-original | 5 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name 1 H1 GLY -2 3H GLY -2 8.980 6.318 -13.985 2 H2 GLY -2 2H GLY -2 9.133 7.623 -12.917 3 H3 GLY -2 1H GLY -2 8.639 7.890 -14.511 4 1HA GLY -2 1HA GLY -2 10.976 8.518 -14.125 5 2HA GLY -2 2HA GLY -2 10.759 7.311 -15.382 6 H SER -1 H SER -1 10.955 4.969 -14.638 7 HA SER -1 HA SER -1 12.064 3.246 -13.683 8 HG SER -1 HG SER -1 15.609 3.395 -13.567 9 H VAL 1 H VAL 1 10.345 4.453 -11.874 10 HA VAL 1 HA VAL 1 11.453 5.146 -9.380 11 HB VAL 1 HB VAL 1 9.217 4.584 -8.393 12 1HG1 VAL 1 1HG1 VAL 1 9.689 6.803 -9.302 13 2HG1 VAL 1 2HG1 VAL 1 9.085 6.290 -10.879 14 3HG1 VAL 1 3HG1 VAL 1 7.992 6.368 -9.495 15 1HG2 VAL 1 3HG2 VAL 1 8.602 3.583 -11.181 16 2HG2 VAL 1 1HG2 VAL 1 8.366 2.762 -9.642 17 3HG2 VAL 1 2HG2 VAL 1 7.335 4.118 -10.080 18 H ASP 2 H ASP 2 12.677 3.945 -8.036 19 HA ASP 2 HA ASP 2 13.118 1.185 -8.354 20 H PHE 3 H PHE 3 11.179 2.886 -5.828 21 HA PHE 3 HA PHE 3 9.396 2.276 -4.594 22 HD1 PHE 3 1HD PHE 3 8.449 -1.781 -4.680 23 HD2 PHE 3 2HD PHE 3 6.493 1.949 -5.310 24 HE1 PHE 3 1HE PHE 3 6.510 -2.589 -3.438 25 HE2 PHE 3 2HE PHE 3 4.543 1.136 -4.059 26 HZ PHE 3 HZ PHE 3 4.551 -1.140 -3.119 27 H ALA 4 H ALA 4 11.654 -0.523 -4.973 28 HA ALA 4 HA ALA 4 11.127 -1.879 -2.602 29 1HB ALA 4 1HB ALA 4 13.710 -1.635 -4.162 30 2HB ALA 4 2HB ALA 4 13.438 -2.812 -2.878 31 3HB ALA 4 3HB ALA 4 12.462 -2.868 -4.347 32 H PHE 5 H PHE 5 13.646 0.638 -3.167 33 HA PHE 5 HA PHE 5 14.673 0.735 -0.530 34 HD1 PHE 5 1HD PHE 5 17.200 1.284 -0.378 35 HD2 PHE 5 2HD PHE 5 15.301 4.966 -1.423 36 HE1 PHE 5 1HE PHE 5 18.722 2.501 1.117 37 HE2 PHE 5 2HE PHE 5 16.829 6.172 0.073 38 HZ PHE 5 HZ PHE 5 18.540 4.943 1.344 39 H GLU 6 H GLU 6 12.000 2.509 -2.090 40 HA GLU 6 HA GLU 6 11.460 4.340 0.017 41 H LEU 7 H LEU 7 10.202 1.021 -0.647 42 HA LEU 7 HA LEU 7 8.254 1.052 1.450 43 HG LEU 7 HG LEU 7 7.385 -0.239 -1.156 44 1HD1 LEU 7 1HD1 LEU 7 7.037 -2.956 0.119 45 2HD1 LEU 7 2HD1 LEU 7 6.028 -2.323 -1.179 46 3HD1 LEU 7 3HD1 LEU 7 7.746 -2.600 -1.453 47 1HD2 LEU 7 2HD2 LEU 7 6.162 -0.827 1.556 48 2HD2 LEU 7 3HD2 LEU 7 6.288 0.739 0.752 49 3HD2 LEU 7 1HD2 LEU 7 5.220 -0.498 0.100 50 H ARG 8 H ARG 8 11.611 -0.311 1.327 51 HA ARG 8 HA ARG 8 11.549 -1.246 4.027 52 HE ARG 8 HE ARG 8 15.284 -2.443 -0.024 53 1HH1 ARG 8 2HH1 ARG 8 15.496 -3.219 3.452 54 2HH1 ARG 8 1HH1 ARG 8 15.269 -4.909 3.186 55 1HH2 ARG 8 2HH2 ARG 8 14.986 -4.683 -0.301 56 2HH2 ARG 8 1HH2 ARG 8 14.978 -5.738 1.073 57 H LYS 9 H LYS 9 12.515 1.893 2.644 58 HA LYS 9 HA LYS 9 13.568 2.998 5.085 59 1HZ LYS 9 3HZ LYS 9 16.304 7.053 5.563 60 2HZ LYS 9 2HZ LYS 9 16.967 5.935 6.643 61 3HZ LYS 9 1HZ LYS 9 17.700 6.190 5.142 62 H ALA 10 H ALA 10 10.316 2.952 3.568 63 HA ALA 10 HA ALA 10 9.063 4.765 5.400 64 1HB ALA 10 2HB ALA 10 6.972 4.102 4.426 65 2HB ALA 10 1HB ALA 10 7.690 2.642 3.742 66 3HB ALA 10 3HB ALA 10 8.162 4.224 3.135 67 H GLN 11 H GLN 11 9.465 1.207 5.387 68 HA GLN 11 HA GLN 11 7.740 0.752 7.661 69 1HE2 GLN 11 1HE2 GLN 11 6.317 -3.161 6.272 70 2HE2 GLN 11 2HE2 GLN 11 7.111 -4.670 5.998 71 H ASP 12 H ASP 12 11.231 1.292 7.251 72 HA ASP 12 HA ASP 12 11.909 0.539 9.963 73 H THR 13 H THR 13 11.686 3.687 8.198 74 HA THR 13 HA THR 13 12.176 5.215 10.629 75 HB THR 13 HB THR 13 11.326 6.414 7.973 76 HG1 THR 13 1HG THR 13 13.066 5.357 7.265 77 1HG2 THR 13 2HG2 THR 13 13.082 7.433 10.222 78 2HG2 THR 13 1HG2 THR 13 12.781 8.280 8.706 79 3HG2 THR 13 3HG2 THR 13 11.454 7.989 9.831 80 H GLY 14 H GLY 14 9.416 4.996 8.288 81 1HA GLY 14 2HA GLY 14 7.287 5.930 8.517 82 2HA GLY 14 1HA GLY 14 7.642 6.363 10.177 83 H LYS 15 H LYS 15 5.433 4.725 8.629 84 HA LYS 15 HA LYS 15 5.521 2.197 10.126 85 1HZ LYS 15 3HZ LYS 15 2.962 2.181 15.130 86 2HZ LYS 15 2HZ LYS 15 4.340 2.868 14.425 87 3HZ LYS 15 1HZ LYS 15 3.467 3.730 15.587 88 H ILE 16 H ILE 16 4.555 0.498 9.073 89 HA ILE 16 HA ILE 16 2.841 1.043 6.714 90 HB ILE 16 HB ILE 16 5.002 -1.101 6.816 91 1HG2 ILE 16 2HG2 ILE 16 3.089 -0.353 4.599 92 2HG2 ILE 16 3HG2 ILE 16 4.509 -1.375 4.368 93 3HG2 ILE 16 1HG2 ILE 16 3.217 -1.895 5.444 94 1HD1 ILE 16 2HD1 ILE 16 3.904 1.851 4.909 95 2HD1 ILE 16 3HD1 ILE 16 5.366 2.776 5.244 96 3HD1 ILE 16 1HD1 ILE 16 5.311 1.689 3.859 97 H VAL 17 H VAL 17 0.929 -0.030 6.788 98 HA VAL 17 HA VAL 17 0.605 -2.265 8.713 99 HB VAL 17 HB VAL 17 -1.602 -0.533 7.513 100 1HG1 VAL 17 2HG1 VAL 17 -1.676 -2.527 9.795 101 2HG1 VAL 17 3HG1 VAL 17 -3.013 -1.478 9.316 102 3HG1 VAL 17 1HG1 VAL 17 -2.426 -2.717 8.210 103 1HG2 VAL 17 2HG2 VAL 17 -0.309 -0.309 10.245 104 2HG2 VAL 17 3HG2 VAL 17 -0.193 0.863 8.931 105 3HG2 VAL 17 1HG2 VAL 17 -1.740 0.574 9.716 106 H MET 18 H MET 18 1.218 -4.028 7.467 107 HA MET 18 HA MET 18 0.223 -4.370 4.756 108 1HE MET 18 3HE MET 18 4.148 -4.691 7.901 109 2HE MET 18 1HE MET 18 3.984 -6.030 9.037 110 3HE MET 18 2HE MET 18 5.531 -5.730 8.248 111 H GLY 19 H GLY 19 -1.474 -5.564 4.084 112 1HA GLY 19 2HA GLY 19 -3.189 -6.846 6.100 113 2HA GLY 19 1HA GLY 19 -2.603 -7.851 4.783 114 H ALA 20 H ALA 20 -4.609 -8.240 3.803 115 HA ALA 20 HA ALA 20 -5.624 -6.200 2.045 116 1HB ALA 20 1HB ALA 20 -6.454 -9.040 2.596 117 2HB ALA 20 2HB ALA 20 -7.376 -7.999 1.513 118 3HB ALA 20 3HB ALA 20 -5.693 -8.365 1.159 119 H ARG 21 H ARG 21 -6.994 -7.863 4.916 120 HA ARG 21 HA ARG 21 -9.462 -6.405 4.909 121 HE ARG 21 HE ARG 21 -10.132 -9.856 9.077 122 1HH1 ARG 21 2HH1 ARG 21 -10.000 -10.747 5.621 123 2HH1 ARG 21 1HH1 ARG 21 -8.879 -12.029 5.897 124 1HH2 ARG 21 2HH2 ARG 21 -8.647 -11.552 9.364 125 2HH2 ARG 21 1HH2 ARG 21 -8.109 -12.482 8.005 126 H LYS 22 H LYS 22 -6.344 -5.932 6.605 127 HA LYS 22 HA LYS 22 -7.261 -3.890 8.389 128 1HZ LYS 22 3HZ LYS 22 -2.099 -5.331 12.192 129 2HZ LYS 22 2HZ LYS 22 -2.642 -6.708 13.009 130 3HZ LYS 22 1HZ LYS 22 -1.924 -6.862 11.486 131 H SER 23 H SER 23 -6.047 -3.792 5.043 132 HA SER 23 HA SER 23 -5.553 -0.987 4.889 133 HG SER 23 HG SER 23 -3.786 -1.507 2.999 134 H ILE 24 H ILE 24 -8.533 -2.900 4.564 135 HA ILE 24 HA ILE 24 -10.145 -0.794 3.429 136 HB ILE 24 HB ILE 24 -11.115 -3.296 4.880 137 1HG2 ILE 24 2HG2 ILE 24 -12.570 -1.385 3.033 138 2HG2 ILE 24 3HG2 ILE 24 -13.207 -2.956 3.526 139 3HG2 ILE 24 1HG2 ILE 24 -12.913 -1.708 4.732 140 1HD1 ILE 24 1HD1 ILE 24 -11.089 -5.428 3.646 141 2HD1 ILE 24 2HD1 ILE 24 -12.352 -4.836 2.566 142 3HD1 ILE 24 3HD1 ILE 24 -10.845 -5.464 1.900 143 H GLN 25 H GLN 25 -9.597 -2.059 6.751 144 HA GLN 25 HA GLN 25 -11.505 -0.482 8.117 145 1HE2 GLN 25 1HE2 GLN 25 -8.325 -1.376 11.862 146 2HE2 GLN 25 2HE2 GLN 25 -8.710 -2.694 12.909 147 H TYR 26 H TYR 26 -8.077 0.208 7.308 148 HA TYR 26 HA TYR 26 -7.969 2.721 8.701 149 HD1 TYR 26 1HD TYR 26 -6.330 -0.106 9.088 150 HD2 TYR 26 2HD TYR 26 -4.466 3.713 8.699 151 HE1 TYR 26 1HE TYR 26 -5.047 -0.525 11.135 152 HE2 TYR 26 2HE TYR 26 -3.184 3.292 10.748 153 HH TYR 26 HH TYR 26 -2.487 0.697 12.004 154 H ALA 27 H ALA 27 -8.927 1.763 5.415 155 HA ALA 27 HA ALA 27 -9.034 4.432 4.333 156 1HB ALA 27 3HB ALA 27 -10.329 1.891 3.324 157 2HB ALA 27 2HB ALA 27 -8.744 2.507 2.857 158 3HB ALA 27 1HB ALA 27 -10.197 3.407 2.430 159 H LYS 28 H LYS 28 -11.320 2.335 6.076 160 HA LYS 28 HA LYS 28 -13.748 3.684 5.491 161 1HZ LYS 28 3HZ LYS 28 -15.029 -2.647 7.620 162 2HZ LYS 28 2HZ LYS 28 -16.533 -1.964 7.993 163 3HZ LYS 28 1HZ LYS 28 -16.365 -2.941 6.623 164 H MET 29 H MET 29 -11.611 4.000 8.384 165 HA MET 29 HA MET 29 -13.099 6.265 9.397 166 1HE MET 29 2HE MET 29 -10.040 2.076 11.431 167 2HE MET 29 3HE MET 29 -10.031 2.198 13.190 168 3HE MET 29 1HE MET 29 -11.398 2.827 12.270 169 H GLY 30 H GLY 30 -9.972 5.880 7.701 170 1HA GLY 30 2HA GLY 30 -9.961 8.779 7.176 171 2HA GLY 30 1HA GLY 30 -9.082 7.552 6.289 172 H GLY 31 H GLY 31 -7.511 6.253 7.990 173 1HA GLY 31 2HA GLY 31 -6.117 6.781 10.018 174 2HA GLY 31 1HA GLY 31 -5.873 8.366 9.303 175 H ALA 32 H ALA 32 -5.471 7.572 6.584 176 HA ALA 32 HA ALA 32 -2.771 6.411 6.780 177 1HB ALA 32 2HB ALA 32 -3.221 5.065 4.707 178 2HB ALA 32 1HB ALA 32 -4.933 5.449 4.901 179 3HB ALA 32 3HB ALA 32 -4.091 4.521 6.142 180 H LYS 33 H LYS 33 -1.272 7.225 5.300 181 HA LYS 33 HA LYS 33 -2.000 9.705 3.945 182 1HZ LYS 33 1HZ LYS 33 -1.606 13.489 5.564 183 2HZ LYS 33 3HZ LYS 33 -0.599 12.736 6.699 184 3HZ LYS 33 2HZ LYS 33 -0.394 14.375 6.341 185 H LEU 34 H LEU 34 -0.513 6.557 2.978 186 HA LEU 34 HA LEU 34 -1.704 6.859 0.288 187 HG LEU 34 HG LEU 34 0.044 5.206 -1.407 188 1HD1 LEU 34 3HD1 LEU 34 -1.201 7.243 -1.950 189 2HD1 LEU 34 1HD1 LEU 34 0.316 8.107 -2.201 190 3HD1 LEU 34 2HD1 LEU 34 -0.123 6.765 -3.259 191 1HD2 LEU 34 2HD2 LEU 34 2.543 6.893 -1.615 192 2HD2 LEU 34 3HD2 LEU 34 2.457 5.207 -1.099 193 3HD2 LEU 34 1HD2 LEU 34 2.046 5.642 -2.757 194 H ILE 35 H ILE 35 -2.631 4.951 -0.445 195 HA ILE 35 HA ILE 35 -1.931 2.461 1.034 196 HB ILE 35 HB ILE 35 -4.595 3.082 -0.304 197 1HG2 ILE 35 2HG2 ILE 35 -3.597 0.650 1.190 198 2HG2 ILE 35 3HG2 ILE 35 -5.318 0.997 1.028 199 3HG2 ILE 35 1HG2 ILE 35 -4.336 0.736 -0.408 200 1HD1 ILE 35 3HD1 ILE 35 -6.451 3.883 1.222 201 2HD1 ILE 35 1HD1 ILE 35 -6.341 2.445 2.242 202 3HD1 ILE 35 2HD1 ILE 35 -6.158 4.047 2.954 203 H ILE 36 H ILE 36 -0.741 1.062 -0.134 204 HA ILE 36 HA ILE 36 -0.840 1.165 -3.081 205 HB ILE 36 HB ILE 36 1.197 -0.242 -1.310 206 1HG2 ILE 36 2HG2 ILE 36 1.180 0.216 -4.302 207 2HG2 ILE 36 3HG2 ILE 36 2.571 -0.365 -3.394 208 3HG2 ILE 36 1HG2 ILE 36 1.104 -1.331 -3.463 209 1HD1 ILE 36 3HD1 ILE 36 3.485 0.656 -1.560 210 2HD1 ILE 36 1HD1 ILE 36 3.745 2.271 -2.216 211 3HD1 ILE 36 2HD1 ILE 36 3.249 2.074 -0.537 212 H VAL 37 H VAL 37 -1.811 -0.425 -4.251 213 HA VAL 37 HA VAL 37 -2.549 -2.963 -2.888 214 HB VAL 37 HB VAL 37 -4.545 -3.090 -4.384 215 1HG1 VAL 37 2HG1 VAL 37 -4.754 -2.285 -2.083 216 2HG1 VAL 37 3HG1 VAL 37 -4.507 -0.628 -2.635 217 3HG1 VAL 37 1HG1 VAL 37 -5.935 -1.529 -3.149 218 1HG2 VAL 37 2HG2 VAL 37 -3.828 -0.248 -5.167 219 2HG2 VAL 37 3HG2 VAL 37 -3.907 -1.652 -6.230 220 3HG2 VAL 37 1HG2 VAL 37 -5.378 -1.020 -5.498 221 H ALA 38 H ALA 38 -2.075 -4.892 -3.899 222 HA ALA 38 HA ALA 38 -0.280 -4.840 -6.169 223 1HB ALA 38 3HB ALA 38 -0.053 -7.233 -5.844 224 2HB ALA 38 2HB ALA 38 -1.418 -7.239 -4.725 225 3HB ALA 38 1HB ALA 38 0.074 -6.403 -4.294 226 H ARG 39 H ARG 39 -0.748 -5.190 -8.307 227 HA ARG 39 HA ARG 39 -3.422 -5.177 -9.226 228 HE ARG 39 HE ARG 39 0.201 -3.606 -11.914 229 1HH1 ARG 39 2HH1 ARG 39 0.134 -5.360 -15.013 230 2HH1 ARG 39 1HH1 ARG 39 0.305 -3.916 -15.947 231 1HH2 ARG 39 2HH2 ARG 39 0.429 -1.739 -13.200 232 2HH2 ARG 39 1HH2 ARG 39 0.479 -1.873 -14.926 233 H ASN 40 H ASN 40 -1.275 -7.903 -8.563 234 HA ASN 40 HA ASN 40 -2.941 -9.836 -9.954 235 1HD2 ASN 40 1HD2 ASN 40 -1.963 -12.813 -8.483 236 2HD2 ASN 40 2HD2 ASN 40 -1.693 -13.611 -9.991 237 H ALA 41 H ALA 41 -3.425 -8.250 -7.029 238 HA ALA 41 HA ALA 41 -4.289 -10.415 -5.347 239 1HB ALA 41 1HB ALA 41 -3.524 -8.306 -4.381 240 2HB ALA 41 3HB ALA 41 -5.184 -8.637 -3.894 241 3HB ALA 41 2HB ALA 41 -4.855 -7.445 -5.152 242 H ARG 42 H ARG 42 -6.701 -10.226 -4.408 243 HA ARG 42 HA ARG 42 -8.459 -11.031 -6.467 244 HE ARG 42 HE ARG 42 -7.508 -14.944 -4.927 245 1HH1 ARG 42 2HH1 ARG 42 -9.210 -14.028 -1.937 246 2HH1 ARG 42 1HH1 ARG 42 -9.586 -15.665 -1.530 247 1HH2 ARG 42 2HH2 ARG 42 -8.039 -17.080 -4.343 248 2HH2 ARG 42 1HH2 ARG 42 -8.926 -17.391 -2.889 249 HA PRO 43 HA PRO 43 -10.198 -7.169 -7.999 250 H ASP 44 H ASP 44 -12.310 -9.008 -5.724 251 HA ASP 44 HA ASP 44 -13.917 -6.771 -4.975 252 H ILE 45 H ILE 45 -10.803 -7.958 -3.753 253 HA ILE 45 HA ILE 45 -10.784 -6.368 -1.346 254 HB ILE 45 HB ILE 45 -8.453 -7.654 -2.825 255 1HG2 ILE 45 1HG2 ILE 45 -8.504 -6.474 -0.043 256 2HG2 ILE 45 2HG2 ILE 45 -7.205 -7.484 -0.678 257 3HG2 ILE 45 3HG2 ILE 45 -7.552 -5.928 -1.423 258 1HD1 ILE 45 3HD1 ILE 45 -9.610 -8.374 0.752 259 2HD1 ILE 45 1HD1 ILE 45 -11.124 -8.248 -0.144 260 3HD1 ILE 45 2HD1 ILE 45 -10.476 -9.832 0.273 261 H LYS 46 H LYS 46 -9.321 -5.996 -4.618 262 HA LYS 46 HA LYS 46 -8.042 -3.498 -4.134 263 1HZ LYS 46 2HZ LYS 46 -7.957 -5.182 -9.634 264 2HZ LYS 46 1HZ LYS 46 -7.802 -3.701 -8.831 265 3HZ LYS 46 3HZ LYS 46 -6.928 -3.991 -10.248 266 H GLU 47 H GLU 47 -11.251 -4.285 -5.555 267 HA GLU 47 HA GLU 47 -11.940 -1.588 -6.189 268 H ASP 48 H ASP 48 -12.509 -3.566 -3.257 269 HA ASP 48 HA ASP 48 -14.333 -1.729 -2.021 270 H ILE 49 H ILE 49 -10.778 -2.242 -1.679 271 HA ILE 49 HA ILE 49 -10.369 -0.198 0.273 272 HB ILE 49 HB ILE 49 -8.350 -1.407 -1.664 273 1HG2 ILE 49 2HG2 ILE 49 -7.901 0.375 0.743 274 2HG2 ILE 49 3HG2 ILE 49 -6.630 -0.616 0.024 275 3HG2 ILE 49 1HG2 ILE 49 -7.396 0.654 -0.923 276 1HD1 ILE 49 1HD1 ILE 49 -7.436 -3.640 -0.986 277 2HD1 ILE 49 2HD1 ILE 49 -6.543 -2.802 0.284 278 3HD1 ILE 49 3HD1 ILE 49 -7.574 -4.174 0.689 279 H GLU 50 H GLU 50 -10.181 -0.169 -3.324 280 HA GLU 50 HA GLU 50 -9.259 2.518 -3.557 281 H TYR 51 H TYR 51 -12.575 1.129 -3.662 282 HA TYR 51 HA TYR 51 -13.928 3.572 -4.226 283 HD1 TYR 51 1HD TYR 51 -16.886 1.519 -1.611 284 HD2 TYR 51 2HD TYR 51 -16.361 3.546 -5.332 285 HE1 TYR 51 1HE TYR 51 -19.111 2.526 -1.377 286 HE2 TYR 51 2HE TYR 51 -18.588 4.552 -5.095 287 HH TYR 51 HH TYR 51 -20.164 5.000 -2.621 288 H TYR 52 H TYR 52 -13.234 1.907 -1.117 289 HA TYR 52 HA TYR 52 -14.550 3.858 0.525 290 HD1 TYR 52 1HD TYR 52 -14.777 2.170 3.798 291 HD2 TYR 52 2HD TYR 52 -15.009 0.694 -0.193 292 HE1 TYR 52 1HE TYR 52 -16.853 0.984 4.353 293 HE2 TYR 52 2HE TYR 52 -17.078 -0.492 0.360 294 HH TYR 52 HH TYR 52 -18.049 -1.365 3.051 295 H ALA 53 H ALA 53 -11.188 3.533 -0.639 296 HA ALA 53 HA ALA 53 -10.121 5.622 1.047 297 1HB ALA 53 3HB ALA 53 -8.682 3.830 0.199 298 2HB ALA 53 1HB ALA 53 -8.932 4.400 -1.451 299 3HB ALA 53 2HB ALA 53 -8.086 5.417 -0.283 300 H ARG 54 H ARG 54 -11.566 5.521 -2.210 301 HA ARG 54 HA ARG 54 -10.682 8.034 -3.168 302 HE ARG 54 HE ARG 54 -8.962 8.292 -5.552 303 1HH1 ARG 54 2HH1 ARG 54 -11.420 9.055 -8.011 304 2HH1 ARG 54 1HH1 ARG 54 -10.582 10.464 -8.557 305 1HH2 ARG 54 2HH2 ARG 54 -7.904 10.161 -6.312 306 2HH2 ARG 54 1HH2 ARG 54 -8.594 11.089 -7.601 307 H LEU 55 H LEU 55 -13.792 7.193 -1.540 308 HA LEU 55 HA LEU 55 -14.765 9.882 -1.501 309 HG LEU 55 HG LEU 55 -14.882 6.582 0.182 310 1HD1 LEU 55 3HD1 LEU 55 -15.437 7.888 2.164 311 2HD1 LEU 55 1HD1 LEU 55 -17.157 7.638 1.865 312 3HD1 LEU 55 2HD1 LEU 55 -16.121 6.266 2.263 313 1HD2 LEU 55 3HD2 LEU 55 -16.624 5.819 -1.390 314 2HD2 LEU 55 1HD2 LEU 55 -16.755 5.032 0.180 315 3HD2 LEU 55 2HD2 LEU 55 -17.868 6.332 -0.248 316 H SER 56 H SER 56 -12.903 8.013 0.902 317 HA SER 56 HA SER 56 -13.294 9.880 3.055 318 HG SER 56 HG SER 56 -10.703 6.738 3.051 319 H GLY 57 H GLY 57 -10.778 9.529 0.535 320 1HA GLY 57 2HA GLY 57 -9.676 12.170 1.325 321 2HA GLY 57 1HA GLY 57 -9.713 11.534 -0.307 322 H ILE 58 H ILE 58 -8.674 8.923 0.131 323 HA ILE 58 HA ILE 58 -5.886 9.536 0.922 324 HB ILE 58 HB ILE 58 -7.214 6.822 1.279 325 1HG2 ILE 58 3HG2 ILE 58 -4.464 7.837 2.046 326 2HG2 ILE 58 1HG2 ILE 58 -5.145 6.322 2.638 327 3HG2 ILE 58 2HG2 ILE 58 -4.860 6.542 0.916 328 1HD1 ILE 58 2HD1 ILE 58 -6.944 6.073 3.782 329 2HD1 ILE 58 3HD1 ILE 58 -7.379 7.266 5.003 330 3HD1 ILE 58 1HD1 ILE 58 -8.585 6.713 3.844 331 HA PRO 59 HA PRO 59 -5.413 8.394 -3.491 332 H VAL 60 H VAL 60 -5.028 6.498 -4.584 333 HA VAL 60 HA VAL 60 -3.746 4.284 -3.100 334 HB VAL 60 HB VAL 60 -5.688 3.833 -5.382 335 1HG1 VAL 60 1HG1 VAL 60 -4.283 1.928 -4.671 336 2HG1 VAL 60 2HG1 VAL 60 -4.932 2.067 -3.037 337 3HG1 VAL 60 3HG1 VAL 60 -5.993 1.633 -4.377 338 1HG2 VAL 60 1HG2 VAL 60 -6.437 4.100 -2.470 339 2HG2 VAL 60 2HG2 VAL 60 -6.933 5.160 -3.790 340 3HG2 VAL 60 3HG2 VAL 60 -7.484 3.491 -3.748 341 H TYR 61 H TYR 61 -2.124 3.092 -4.084 342 HA TYR 61 HA TYR 61 -1.345 3.895 -6.827 343 HD1 TYR 61 1HD TYR 61 0.781 4.744 -7.921 344 HD2 TYR 61 2HD TYR 61 2.362 1.942 -5.116 345 HE1 TYR 61 1HE TYR 61 2.588 4.192 -9.486 346 HE2 TYR 61 2HE TYR 61 4.169 1.395 -6.683 347 HH TYR 61 HH TYR 61 4.243 1.698 -9.598 348 H GLU 62 H GLU 62 -1.661 2.303 -8.242 349 HA GLU 62 HA GLU 62 -1.970 -0.463 -7.458 350 H PHE 63 H PHE 63 -0.245 -1.681 -6.926 351 HA PHE 63 HA PHE 63 2.461 -1.091 -7.607 352 HD1 PHE 63 1HD PHE 63 4.495 -1.767 -6.649 353 HD2 PHE 63 2HD PHE 63 2.467 -5.480 -6.066 354 HE1 PHE 63 1HE PHE 63 6.647 -2.936 -6.539 355 HE2 PHE 63 2HE PHE 63 4.629 -6.633 -5.955 356 HZ PHE 63 HZ PHE 63 6.703 -5.356 -6.183 357 H GLU 64 H GLU 64 3.732 -1.731 -9.288 358 HA GLU 64 HA GLU 64 2.530 -3.274 -11.463 359 H GLY 65 H GLY 65 2.463 -5.271 -10.152 360 1HA GLY 65 2HA GLY 65 4.776 -6.616 -9.228 361 2HA GLY 65 1HA GLY 65 4.451 -7.118 -10.880 362 H THR 66 H THR 66 4.219 -8.401 -8.035 363 HA THR 66 HA THR 66 1.411 -9.308 -8.143 364 HB THR 66 HB THR 66 2.088 -11.678 -7.896 365 HG1 THR 66 1HG THR 66 4.165 -12.276 -7.814 366 1HG2 THR 66 3HG2 THR 66 1.637 -10.766 -10.176 367 2HG2 THR 66 2HG2 THR 66 3.370 -10.496 -10.369 368 3HG2 THR 66 1HG2 THR 66 2.750 -12.134 -10.168 369 H SER 67 H SER 67 0.813 -10.662 -6.182 370 HA SER 67 HA SER 67 1.468 -9.290 -3.779 371 HG SER 67 HG SER 67 0.355 -12.888 -4.011 372 H VAL 68 H VAL 68 2.840 -12.197 -5.261 373 HA VAL 68 HA VAL 68 4.224 -13.207 -2.963 374 HB VAL 68 HB VAL 68 4.992 -13.647 -5.885 375 1HG1 VAL 68 2HG1 VAL 68 5.619 -15.284 -3.414 376 2HG1 VAL 68 3HG1 VAL 68 5.974 -15.778 -5.071 377 3HG1 VAL 68 1HG1 VAL 68 6.763 -14.360 -4.388 378 1HG2 VAL 68 1HG2 VAL 68 3.067 -15.260 -4.193 379 2HG2 VAL 68 2HG2 VAL 68 2.665 -14.300 -5.615 380 3HG2 VAL 68 3HG2 VAL 68 3.668 -15.738 -5.780 381 H GLU 69 H GLU 69 5.222 -11.097 -5.715 382 HA GLU 69 HA GLU 69 7.898 -10.655 -4.813 383 H LEU 70 H LEU 70 4.824 -8.896 -4.249 384 HA LEU 70 HA LEU 70 5.953 -6.631 -2.945 385 HG LEU 70 HG LEU 70 3.574 -5.930 -0.970 386 1HD1 LEU 70 1HD1 LEU 70 4.259 -4.302 -3.415 387 2HD1 LEU 70 2HD1 LEU 70 3.951 -3.637 -1.811 388 3HD1 LEU 70 3HD1 LEU 70 5.326 -4.705 -2.069 389 1HD2 LEU 70 2HD2 LEU 70 1.745 -5.219 -3.268 390 2HD2 LEU 70 3HD2 LEU 70 1.339 -6.217 -1.871 391 3HD2 LEU 70 1HD2 LEU 70 1.681 -4.503 -1.658 392 H GLY 71 H GLY 71 4.713 -9.763 -1.671 393 1HA GLY 71 2HA GLY 71 4.947 -10.795 0.371 394 2HA GLY 71 1HA GLY 71 5.091 -9.201 1.094 395 H THR 72 H THR 72 7.166 -10.943 -1.278 396 HA THR 72 HA THR 72 9.306 -11.557 0.487 397 HB THR 72 HB THR 72 9.452 -11.129 -2.525 398 HG1 THR 72 1HG THR 72 8.912 -13.515 -1.037 399 1HG2 THR 72 3HG2 THR 72 11.310 -12.616 -0.648 400 2HG2 THR 72 2HG2 THR 72 11.340 -12.786 -2.402 401 3HG2 THR 72 1HG2 THR 72 11.699 -11.225 -1.667 402 H LEU 73 H LEU 73 8.602 -8.668 -1.479 403 HA LEU 73 HA LEU 73 11.113 -7.369 -1.116 404 HG LEU 73 HG LEU 73 9.970 -4.374 -1.332 405 1HD1 LEU 73 2HD1 LEU 73 12.001 -5.934 -2.297 406 2HD1 LEU 73 3HD1 LEU 73 11.740 -4.828 -3.642 407 3HD1 LEU 73 1HD1 LEU 73 12.087 -4.205 -2.031 408 1HD2 LEU 73 1HD2 LEU 73 8.249 -4.136 -3.079 409 2HD2 LEU 73 2HD2 LEU 73 9.671 -3.155 -3.410 410 3HD2 LEU 73 3HD2 LEU 73 9.419 -4.660 -4.292 411 H LEU 74 H LEU 74 7.982 -7.112 0.630 412 HA LEU 74 HA LEU 74 8.774 -4.993 2.388 413 HG LEU 74 HG LEU 74 6.446 -4.955 0.963 414 1HD1 LEU 74 3HD1 LEU 74 4.632 -6.581 1.402 415 2HD1 LEU 74 1HD1 LEU 74 4.135 -5.613 2.791 416 3HD1 LEU 74 2HD1 LEU 74 4.056 -4.935 1.165 417 1HD2 LEU 74 1HD2 LEU 74 7.072 -3.309 2.679 418 2HD2 LEU 74 2HD2 LEU 74 5.467 -2.991 2.030 419 3HD2 LEU 74 3HD2 LEU 74 5.642 -3.741 3.618 420 H GLY 75 H GLY 75 9.263 -8.496 2.521 421 1HA GLY 75 2HA GLY 75 10.618 -8.227 5.151 422 2HA GLY 75 1HA GLY 75 11.132 -9.308 3.869 423 H ARG 76 H ARG 76 7.761 -9.414 3.935 424 HA ARG 76 HA ARG 76 7.524 -11.422 6.046 425 HE ARG 76 HE ARG 76 4.753 -12.007 9.250 426 1HH1 ARG 76 2HH1 ARG 76 2.960 -9.413 7.605 427 2HH1 ARG 76 1HH1 ARG 76 1.587 -9.561 8.640 428 1HH2 ARG 76 2HH2 ARG 76 2.907 -12.165 10.583 429 2HH2 ARG 76 1HH2 ARG 76 1.554 -11.115 10.325 430 HA PRO 77 HA PRO 77 7.820 -14.685 2.897 431 H HIS 78 H HIS 78 4.854 -13.641 4.282 432 HA HIS 78 HA HIS 78 3.135 -15.521 2.843 433 HD1 HIS 78 1HD HIS 78 0.700 -16.127 5.561 434 HD2 HIS 78 2HD HIS 78 4.422 -14.466 6.417 435 HE1 HIS 78 1HE HIS 78 1.471 -17.247 7.672 436 HE2 HIS 78 2HE HIS 78 3.751 -16.281 8.129 437 H THR 79 H THR 79 1.412 -14.687 1.388 438 HA THR 79 HA THR 79 2.462 -12.738 -0.494 439 HB THR 79 HB THR 79 0.400 -13.250 -1.834 440 HG1 THR 79 1HG THR 79 -1.174 -13.930 -0.519 441 1HG2 THR 79 2HG2 THR 79 2.454 -14.575 -2.153 442 2HG2 THR 79 1HG2 THR 79 1.906 -15.709 -0.918 443 3HG2 THR 79 3HG2 THR 79 1.003 -15.538 -2.423 444 H VAL 80 H VAL 80 2.199 -10.580 -0.176 445 HA VAL 80 HA VAL 80 -0.024 -9.559 1.440 446 HB VAL 80 HB VAL 80 2.295 -8.012 0.204 447 1HG1 VAL 80 3HG1 VAL 80 0.234 -7.157 2.251 448 2HG1 VAL 80 1HG1 VAL 80 1.700 -6.247 1.880 449 3HG1 VAL 80 2HG1 VAL 80 0.478 -6.489 0.636 450 1HG2 VAL 80 3HG2 VAL 80 3.071 -9.657 1.858 451 2HG2 VAL 80 1HG2 VAL 80 3.312 -8.004 2.411 452 3HG2 VAL 80 2HG2 VAL 80 1.980 -8.963 3.056 453 H SER 81 H SER 81 -1.894 -8.937 0.520 454 HA SER 81 HA SER 81 -2.100 -8.531 -2.367 455 HG SER 81 HG SER 81 -4.765 -10.553 -1.406 456 H ALA 82 H ALA 82 -2.502 -6.610 0.635 457 HA ALA 82 HA ALA 82 -2.120 -4.132 -0.865 458 1HB ALA 82 3HB ALA 82 -4.620 -4.611 0.771 459 2HB ALA 82 2HB ALA 82 -4.534 -4.442 -0.983 460 3HB ALA 82 1HB ALA 82 -4.141 -3.069 0.053 461 H LEU 83 H LEU 83 -1.413 -2.360 0.422 462 HA LEU 83 HA LEU 83 -1.032 -2.796 3.311 463 HG LEU 83 HG LEU 83 0.861 -1.545 0.362 464 1HD1 LEU 83 1HD1 LEU 83 1.439 0.211 1.992 465 2HD1 LEU 83 2HD1 LEU 83 2.972 -0.598 2.309 466 3HD1 LEU 83 3HD1 LEU 83 2.638 0.071 0.712 467 1HD2 LEU 83 3HD2 LEU 83 2.232 -3.620 0.259 468 2HD2 LEU 83 1HD2 LEU 83 3.047 -2.196 -0.385 469 3HD2 LEU 83 2HD2 LEU 83 3.468 -2.804 1.215 470 H ALA 84 H ALA 84 -1.236 -0.954 4.566 471 HA ALA 84 HA ALA 84 -1.866 1.565 3.141 472 1HB ALA 84 3HB ALA 84 -2.739 0.659 5.891 473 2HB ALA 84 2HB ALA 84 -3.726 0.660 4.428 474 3HB ALA 84 1HB ALA 84 -3.174 2.185 5.117 475 H VAL 85 H VAL 85 -0.262 3.031 3.161 476 HA VAL 85 HA VAL 85 1.816 3.026 5.218 477 HB VAL 85 HB VAL 85 1.572 4.955 2.868 478 1HG1 VAL 85 3HG1 VAL 85 3.788 4.340 4.805 479 2HG1 VAL 85 1HG1 VAL 85 4.138 5.007 3.213 480 3HG1 VAL 85 2HG1 VAL 85 3.115 5.898 4.334 481 1HG2 VAL 85 3HG2 VAL 85 3.036 2.305 2.940 482 2HG2 VAL 85 1HG2 VAL 85 1.650 2.718 1.935 483 3HG2 VAL 85 2HG2 VAL 85 3.196 3.516 1.668 484 H VAL 86 H VAL 86 1.243 3.963 7.117 485 HA VAL 86 HA VAL 86 -0.696 6.115 7.287 486 HB VAL 86 HB VAL 86 0.966 4.919 9.545 487 1HG1 VAL 86 2HG1 VAL 86 -1.546 6.610 9.612 488 2HG1 VAL 86 3HG1 VAL 86 -0.898 5.746 11.008 489 3HG1 VAL 86 1HG1 VAL 86 0.043 7.028 10.250 490 1HG2 VAL 86 3HG2 VAL 86 -1.792 4.118 8.582 491 2HG2 VAL 86 1HG2 VAL 86 -0.324 3.143 8.507 492 3HG2 VAL 86 2HG2 VAL 86 -1.033 3.545 10.068 493 H ASP 87 H ASP 87 2.807 5.782 8.079 494 HA ASP 87 HA ASP 87 3.075 8.722 7.867 495 HA PRO 88 HA PRO 88 5.908 7.266 4.534 496 H GLY 89 H GLY 89 6.782 10.147 6.541 497 1HA GLY 89 2HA GLY 89 9.167 8.942 7.549 498 2HA GLY 89 1HA GLY 89 8.641 10.595 7.802 499 H GLU 90 H GLU 90 11.073 8.750 6.521 500 HA GLU 90 HA GLU 90 12.255 11.014 5.120 501 H SER 91 H SER 91 10.923 7.832 4.262 502 HA SER 91 HA SER 91 11.979 7.600 1.651 503 HG SER 91 HG SER 91 8.406 6.395 2.187 504 H ARG 92 H ARG 92 11.102 7.979 -0.418 505 HA ARG 92 HA ARG 92 9.106 10.149 -0.586 506 HE ARG 92 HE ARG 92 11.108 13.130 -3.271 507 1HH1 ARG 92 2HH1 ARG 92 13.321 12.760 -0.507 508 2HH1 ARG 92 1HH1 ARG 92 12.932 14.313 0.142 509 1HH2 ARG 92 2HH2 ARG 92 10.629 15.167 -2.361 510 2HH2 ARG 92 1HH2 ARG 92 11.411 15.673 -0.900 511 H ILE 93 H ILE 93 7.763 7.996 0.112 512 HA ILE 93 HA ILE 93 6.999 6.266 -2.037 513 HB ILE 93 HB ILE 93 6.975 5.691 0.452 514 1HG2 ILE 93 1HG2 ILE 93 5.593 7.758 1.058 515 2HG2 ILE 93 2HG2 ILE 93 4.192 6.814 0.556 516 3HG2 ILE 93 3HG2 ILE 93 5.220 6.241 1.868 517 1HD1 ILE 93 1HD1 ILE 93 6.985 3.335 -0.279 518 2HD1 ILE 93 2HD1 ILE 93 5.749 2.752 -1.391 519 3HD1 ILE 93 3HD1 ILE 93 6.899 3.978 -1.918 520 H LEU 94 H LEU 94 5.716 9.315 -0.778 521 HA LEU 94 HA LEU 94 3.135 9.227 -1.969 522 HG LEU 94 HG LEU 94 4.012 10.034 0.733 523 1HD1 LEU 94 3HD1 LEU 94 3.222 12.950 0.736 524 2HD1 LEU 94 1HD1 LEU 94 3.309 11.932 2.174 525 3HD1 LEU 94 2HD1 LEU 94 4.766 12.256 1.236 526 1HD2 LEU 94 1HD2 LEU 94 1.781 9.550 -0.190 527 2HD2 LEU 94 2HD2 LEU 94 1.681 10.239 1.427 528 3HD2 LEU 94 3HD2 LEU 94 1.327 11.241 0.018 529 H ALA 95 H ALA 95 6.272 9.926 -3.410 530 HA ALA 95 HA ALA 95 5.307 11.460 -5.640 531 1HB ALA 95 2HB ALA 95 7.629 11.620 -4.876 532 2HB ALA 95 3HB ALA 95 7.913 9.952 -5.373 533 3HB ALA 95 1HB ALA 95 7.535 11.184 -6.580 534 H LEU 96 H LEU 96 5.414 8.000 -5.002 535 HA LEU 96 HA LEU 96 5.431 7.067 -7.715 536 HG LEU 96 HG LEU 96 7.194 6.058 -6.217 537 1HD1 LEU 96 2HD1 LEU 96 6.227 3.874 -4.372 538 2HD1 LEU 96 3HD1 LEU 96 7.915 4.320 -4.632 539 3HD1 LEU 96 1HD1 LEU 96 6.800 5.473 -3.913 540 1HD2 LEU 96 2HD2 LEU 96 6.112 3.350 -7.012 541 2HD2 LEU 96 3HD2 LEU 96 6.721 4.615 -8.073 542 3HD2 LEU 96 1HD2 LEU 96 7.822 3.777 -6.983 543 H GLY 97 H GLY 97 2.793 7.958 -5.472 544 1HA GLY 97 2HA GLY 97 0.619 6.776 -6.773 545 2HA GLY 97 1HA GLY 97 0.917 8.299 -7.591 546 H GLY 98 H GLY 98 1.693 9.876 -5.336 547 1HA GLY 98 2HA GLY 98 0.846 10.659 -3.245 548 2HA GLY 98 1HA GLY 98 -0.677 9.844 -3.566 549 H LYS 99 H LYS 99 -1.566 10.651 -5.912 550 HA LYS 99 HA LYS 99 -2.682 12.265 -7.006 551 1HZ LYS 99 3HZ LYS 99 -3.688 16.295 -8.075 552 2HZ LYS 99 2HZ LYS 99 -4.536 17.616 -7.444 553 3HZ LYS 99 1HZ LYS 99 -2.923 17.795 -7.918 554 H GLU 100 H GLU 100 -2.366 14.006 -8.494 555 HA GLU 100 HA GLU 100 0.298 15.245 -8.601 No H/Q in entry = 555
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