NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | cing | stage | position | program | type |
9569 | 1oa6 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 ARG 1 1H ARG 1 29.124 15.004 -11.856 2 H2 ARG 1 3H ARG 1 27.607 14.236 -11.897 3 H3 ARG 1 2H ARG 1 28.079 15.095 -10.504 4 HA ARG 1 HA ARG 1 28.887 13.226 -9.662 5 1HB ARG 1 2HB ARG 1 28.841 11.125 -11.029 6 2HB ARG 1 1HB ARG 1 27.306 11.997 -11.043 7 1HG ARG 1 2HG ARG 1 27.843 12.989 -13.215 8 2HG ARG 1 1HG ARG 1 29.439 12.251 -13.192 9 1HD ARG 1 2HD ARG 1 28.637 10.336 -14.040 10 2HD ARG 1 1HD ARG 1 27.400 10.231 -12.790 11 HE ARG 1 HE ARG 1 26.957 10.999 -15.506 12 1HH1 ARG 1 1HH1 ARG 1 25.384 12.457 -16.173 13 2HH1 ARG 1 2HH1 ARG 1 24.471 13.357 -14.987 14 1HH2 ARG 1 1HH2 ARG 1 26.053 11.898 -12.317 15 2HH2 ARG 1 2HH2 ARG 1 24.830 13.034 -12.840 16 HA PRO 2 HA PRO 2 32.973 14.221 -11.951 17 1HB PRO 2 2HB PRO 2 33.681 15.341 -9.289 18 2HB PRO 2 1HB PRO 2 33.969 16.010 -10.908 19 1HG PRO 2 2HG PRO 2 32.113 17.047 -9.314 20 2HG PRO 2 1HG PRO 2 31.850 16.907 -11.063 21 1HD PRO 2 1HD PRO 2 30.760 15.175 -8.855 22 2HD PRO 2 2HD PRO 2 29.952 15.769 -10.320 23 H ASP 3 H ASP 3 35.198 14.008 -9.997 24 HA ASP 3 HA ASP 3 35.493 11.163 -9.986 25 1HB ASP 3 2HB ASP 3 37.403 11.590 -8.344 26 2HB ASP 3 1HB ASP 3 37.523 12.434 -9.910 27 H PHE 4 H PHE 4 34.983 13.344 -7.221 28 HA PHE 4 HA PHE 4 34.669 11.281 -5.301 29 1HB PHE 4 2HB PHE 4 33.617 13.150 -3.931 30 2HB PHE 4 1HB PHE 4 35.229 13.508 -4.582 31 HD1 PHE 4 HD1 PHE 4 31.610 14.231 -4.803 32 HD2 PHE 4 HD2 PHE 4 35.491 15.123 -6.406 33 HE1 PHE 4 HE1 PHE 4 30.681 16.218 -5.940 34 HE2 PHE 4 HE2 PHE 4 34.560 17.113 -7.559 35 HZ PHE 4 HZ PHE 4 32.146 17.666 -7.321 36 H CYS 5 H CYS 5 33.247 10.390 -7.386 37 HA CYS 5 HA CYS 5 30.474 10.193 -6.330 38 1HB CYS 5 2HB CYS 5 31.181 10.936 -9.185 39 2HB CYS 5 1HB CYS 5 29.564 10.542 -8.618 40 H LEU 6 H LEU 6 33.211 8.688 -7.254 41 HA LEU 6 HA LEU 6 31.851 6.456 -8.667 42 1HB LEU 6 2HB LEU 6 34.734 7.304 -8.433 43 2HB LEU 6 1HB LEU 6 34.277 5.725 -9.076 44 HG LEU 6 HG LEU 6 32.610 7.717 -10.292 45 1HD1 LEU 6 1HD1 LEU 6 35.466 8.462 -9.953 46 2HD1 LEU 6 3HD1 LEU 6 34.796 8.644 -11.574 47 3HD1 LEU 6 2HD1 LEU 6 34.054 9.486 -10.213 48 1HD2 LEU 6 2HD2 LEU 6 34.865 6.001 -11.371 49 2HD2 LEU 6 1HD2 LEU 6 33.171 5.524 -11.244 50 3HD2 LEU 6 3HD2 LEU 6 33.644 6.814 -12.351 51 H GLU 7 H GLU 7 34.308 6.815 -6.045 52 HA GLU 7 HA GLU 7 34.213 4.126 -5.186 53 1HB GLU 7 2HB GLU 7 34.633 5.299 -2.805 54 2HB GLU 7 1HB GLU 7 35.887 5.209 -4.036 55 1HG GLU 7 2HG GLU 7 35.912 7.460 -4.314 56 2HG GLU 7 1HG GLU 7 34.151 7.549 -4.382 57 HA PRO 8 HA PRO 8 29.950 3.906 -3.916 58 1HB PRO 8 2HB PRO 8 29.971 1.367 -2.922 59 2HB PRO 8 1HB PRO 8 30.089 1.724 -4.657 60 1HG PRO 8 2HG PRO 8 32.254 1.040 -2.718 61 2HG PRO 8 1HG PRO 8 31.992 0.434 -4.368 62 1HD PRO 8 1HD PRO 8 33.792 2.428 -3.783 63 2HD PRO 8 2HD PRO 8 32.948 2.324 -5.345 64 HA PRO 9 HA PRO 9 29.242 4.909 0.364 65 1HB PRO 9 2HB PRO 9 27.714 2.476 0.968 66 2HB PRO 9 1HB PRO 9 27.167 4.156 0.859 67 1HG PRO 9 2HG PRO 9 26.820 2.061 -1.036 68 2HG PRO 9 1HG PRO 9 26.277 3.736 -1.142 69 1HD PRO 9 1HD PRO 9 28.278 2.524 -2.711 70 2HD PRO 9 2HD PRO 9 27.921 4.259 -2.620 71 H TYR 10 H TYR 10 30.628 4.538 2.156 72 HA TYR 10 HA TYR 10 31.631 1.799 2.780 73 1HB TYR 10 2HB TYR 10 33.194 3.228 1.387 74 2HB TYR 10 1HB TYR 10 33.273 4.389 2.702 75 HD1 TYR 10 HD1 TYR 10 34.562 1.326 1.331 76 HD2 TYR 10 HD2 TYR 10 34.164 3.555 4.979 77 HE1 TYR 10 HE1 TYR 10 36.465 0.071 2.306 78 HE2 TYR 10 HE2 TYR 10 36.060 2.288 5.957 79 HH TYR 10 HH TYR 10 37.602 -0.366 4.189 80 H THR 11 H THR 11 30.660 1.508 4.725 81 HA THR 11 HA THR 11 30.035 3.616 6.617 82 HB THR 11 HB THR 11 29.739 0.589 6.722 83 HG1 THR 11 HG1 THR 11 27.690 2.534 6.607 84 1HG2 THR 11 1HG2 THR 11 29.976 1.658 8.975 85 2HG2 THR 11 3HG2 THR 11 28.594 2.676 8.578 86 3HG2 THR 11 2HG2 THR 11 28.395 0.929 8.701 87 H GLY 12 H GLY 12 32.454 1.096 6.214 88 1HA GLY 12 1HA GLY 12 34.162 2.333 8.247 89 2HA GLY 12 2HA GLY 12 34.582 0.942 7.255 90 HA PRO 13 HA PRO 13 34.101 -1.703 10.729 91 1HB PRO 13 2HB PRO 13 35.854 -0.734 12.659 92 2HB PRO 13 1HB PRO 13 36.306 -1.757 11.284 93 1HG PRO 13 2HG PRO 13 36.627 1.155 11.661 94 2HG PRO 13 1HG PRO 13 37.621 0.014 10.743 95 1HD PRO 13 1HD PRO 13 35.853 1.787 9.584 96 2HD PRO 13 2HD PRO 13 36.363 0.273 8.827 97 H CYS 14 H CYS 14 34.206 1.645 11.995 98 HA CYS 14 HA CYS 14 32.794 1.076 14.419 99 1HB CYS 14 2HB CYS 14 32.760 3.671 12.852 100 2HB CYS 14 1HB CYS 14 32.409 3.477 14.569 101 H LYS 15 H LYS 15 30.532 1.747 14.934 102 HA LYS 15 HA LYS 15 28.732 1.668 12.590 103 1HB LYS 15 2HB LYS 15 28.447 -0.080 15.049 104 2HB LYS 15 1HB LYS 15 27.267 0.030 13.742 105 1HG LYS 15 2HG LYS 15 30.153 -0.783 13.296 106 2HG LYS 15 1HG LYS 15 28.860 -1.945 13.590 107 1HD LYS 15 2HD LYS 15 27.766 -1.441 11.574 108 2HD LYS 15 1HD LYS 15 28.557 0.126 11.422 109 1HE LYS 15 2HE LYS 15 29.926 -2.569 11.149 110 2HE LYS 15 1HE LYS 15 29.501 -1.490 9.816 111 1HZ LYS 15 3HZ LYS 15 30.843 0.192 11.383 112 2HZ LYS 15 2HZ LYS 15 31.650 -1.260 11.792 113 3HZ LYS 15 1HZ LYS 15 31.603 -0.721 10.160 114 H ALA 16 H ALA 16 29.544 3.862 14.234 115 HA ALA 16 HA ALA 16 27.642 4.408 16.281 116 1HB ALA 16 1HB ALA 16 29.661 5.778 16.124 117 2HB ALA 16 2HB ALA 16 28.254 6.818 15.899 118 3HB ALA 16 3HB ALA 16 29.200 6.301 14.500 119 H ARG 17 H ARG 17 25.591 4.797 16.130 120 HA ARG 17 HA ARG 17 24.083 4.627 13.777 121 1HB ARG 17 2HB ARG 17 23.575 5.396 16.569 122 2HB ARG 17 1HB ARG 17 22.451 6.118 15.420 123 1HG ARG 17 2HG ARG 17 21.348 4.150 15.575 124 2HG ARG 17 1HG ARG 17 22.597 3.541 14.491 125 1HD ARG 17 2HD ARG 17 23.982 3.067 16.594 126 2HD ARG 17 1HD ARG 17 22.505 3.342 17.516 127 HE ARG 17 HE ARG 17 23.195 0.943 16.119 128 1HH1 ARG 17 1HH1 ARG 17 21.695 -0.504 15.372 129 2HH1 ARG 17 2HH1 ARG 17 20.030 -0.053 15.309 130 1HH2 ARG 17 1HH2 ARG 17 20.581 3.090 16.568 131 2HH2 ARG 17 2HH2 ARG 17 19.398 1.980 15.980 132 H ILE 18 H ILE 18 26.033 6.422 12.989 133 HA ILE 18 HA ILE 18 24.744 9.090 12.949 134 HB ILE 18 HB ILE 18 27.385 8.287 11.661 135 1HG1 ILE 18 2HG1 ILE 18 26.860 9.492 14.407 136 2HG1 ILE 18 1HG1 ILE 18 27.567 7.921 14.069 137 1HG2 ILE 18 3HG2 ILE 18 26.319 10.341 10.793 138 2HG2 ILE 18 2HG2 ILE 18 26.197 10.976 12.435 139 3HG2 ILE 18 1HG2 ILE 18 27.780 10.723 11.702 140 1HD1 ILE 18 1HD1 ILE 18 28.806 10.467 13.046 141 2HD1 ILE 18 3HD1 ILE 18 29.238 9.753 14.601 142 3HD1 ILE 18 2HD1 ILE 18 29.520 8.855 13.109 143 H ILE 19 H ILE 19 22.996 8.798 11.613 144 HA ILE 19 HA ILE 19 23.186 7.506 9.025 145 HB ILE 19 HB ILE 19 21.061 9.552 9.327 146 1HG1 ILE 19 2HG1 ILE 19 21.264 8.835 11.688 147 2HG1 ILE 19 1HG1 ILE 19 19.786 8.202 10.972 148 1HG2 ILE 19 1HG2 ILE 19 21.439 6.771 8.332 149 2HG2 ILE 19 3HG2 ILE 19 19.823 7.196 8.902 150 3HG2 ILE 19 2HG2 ILE 19 20.575 8.124 7.605 151 1HD1 ILE 19 1HD1 ILE 19 22.343 6.597 11.054 152 2HD1 ILE 19 3HD1 ILE 19 21.151 6.546 12.353 153 3HD1 ILE 19 2HD1 ILE 19 20.710 6.021 10.729 154 H ARG 20 H ARG 20 23.537 8.411 7.039 155 HA ARG 20 HA ARG 20 23.963 11.346 6.831 156 1HB ARG 20 2HB ARG 20 26.074 9.304 6.044 157 2HB ARG 20 1HB ARG 20 26.170 11.033 5.740 158 1HG ARG 20 2HG ARG 20 25.789 10.066 8.556 159 2HG ARG 20 1HG ARG 20 27.386 9.975 7.834 160 1HD ARG 20 2HD ARG 20 25.696 12.478 8.067 161 2HD ARG 20 1HD ARG 20 27.109 12.088 9.044 162 HE ARG 20 HE ARG 20 27.948 11.904 6.360 163 1HH1 ARG 20 1HH1 ARG 20 28.932 13.563 5.309 164 2HH1 ARG 20 2HH1 ARG 20 28.674 15.195 5.834 165 1HH2 ARG 20 1HH2 ARG 20 26.554 14.287 8.406 166 2HH2 ARG 20 2HH2 ARG 20 27.352 15.601 7.620 167 H TYR 21 H TYR 21 24.661 11.767 4.396 168 HA TYR 21 HA TYR 21 22.841 10.127 2.640 169 1HB TYR 21 2HB TYR 21 23.698 13.034 2.470 170 2HB TYR 21 1HB TYR 21 22.772 12.205 1.220 171 HD1 TYR 21 HD1 TYR 21 22.744 12.910 4.882 172 HD2 TYR 21 HD2 TYR 21 20.447 12.129 1.363 173 HE1 TYR 21 HE1 TYR 21 20.665 13.338 6.142 174 HE2 TYR 21 HE2 TYR 21 18.370 12.575 2.623 175 HH TYR 21 HH TYR 21 17.898 12.419 5.502 176 H PHE 22 H PHE 22 23.660 9.772 0.386 177 HA PHE 22 HA PHE 22 26.538 10.391 -0.088 178 1HB PHE 22 2HB PHE 22 27.268 8.186 -0.345 179 2HB PHE 22 1HB PHE 22 26.218 8.075 1.059 180 HD1 PHE 22 HD1 PHE 22 26.885 6.758 -2.183 181 HD2 PHE 22 HD2 PHE 22 23.700 7.555 0.589 182 HE1 PHE 22 HE1 PHE 22 25.437 5.131 -3.389 183 HE2 PHE 22 HE2 PHE 22 22.255 5.934 -0.598 184 HZ PHE 22 HZ PHE 22 23.113 4.728 -2.596 185 H TYR 23 H TYR 23 27.165 9.447 -2.390 186 HA TYR 23 HA TYR 23 24.933 10.241 -4.267 187 1HB TYR 23 2HB TYR 23 27.017 11.450 -4.596 188 2HB TYR 23 1HB TYR 23 27.930 9.945 -4.616 189 HD1 TYR 23 HD1 TYR 23 28.540 9.114 -6.699 190 HD2 TYR 23 HD2 TYR 23 24.927 11.417 -6.358 191 HE1 TYR 23 HE1 TYR 23 28.188 8.928 -9.147 192 HE2 TYR 23 HE2 TYR 23 24.579 11.223 -8.810 193 HH TYR 23 HH TYR 23 26.086 9.066 -10.739 194 H ASN 24 H ASN 24 23.785 8.459 -5.086 195 HA ASN 24 HA ASN 24 25.040 5.800 -5.078 196 1HB ASN 24 2HB ASN 24 22.620 6.148 -4.472 197 2HB ASN 24 1HB ASN 24 22.297 6.524 -6.162 198 1HD2 ASN 24 1HD2 ASN 24 21.220 4.209 -4.707 199 2HD2 ASN 24 2HD2 ASN 24 21.828 2.824 -5.489 200 H ALA 25 H ALA 25 26.661 5.837 -6.602 201 HA ALA 25 HA ALA 25 26.318 6.899 -9.257 202 1HB ALA 25 2HB ALA 25 28.495 6.277 -7.874 203 2HB ALA 25 3HB ALA 25 28.508 6.194 -9.626 204 3HB ALA 25 1HB ALA 25 28.315 4.727 -8.676 205 H LYS 26 H LYS 26 25.091 4.031 -7.818 206 HA LYS 26 HA LYS 26 25.292 2.238 -10.085 207 1HB LYS 26 2HB LYS 26 24.475 2.003 -7.443 208 2HB LYS 26 1HB LYS 26 22.968 1.821 -8.338 209 1HG LYS 26 2HG LYS 26 25.393 0.342 -9.302 210 2HG LYS 26 1HG LYS 26 24.518 -0.278 -7.898 211 1HD LYS 26 2HD LYS 26 22.423 -0.298 -9.168 212 2HD LYS 26 1HD LYS 26 23.246 0.392 -10.570 213 1HE LYS 26 2HE LYS 26 24.770 -1.602 -10.582 214 2HE LYS 26 1HE LYS 26 23.771 -2.310 -9.304 215 1HZ LYS 26 2HZ LYS 26 21.851 -1.748 -10.935 216 2HZ LYS 26 1HZ LYS 26 23.079 -1.751 -12.110 217 3HZ LYS 26 3HZ LYS 26 22.784 -3.148 -11.189 218 H ALA 27 H ALA 27 23.062 4.825 -9.227 219 HA ALA 27 HA ALA 27 21.536 4.245 -11.761 220 1HB ALA 27 2HB ALA 27 20.118 3.664 -9.827 221 2HB ALA 27 3HB ALA 27 19.490 5.072 -10.675 222 3HB ALA 27 1HB ALA 27 20.362 5.276 -9.157 223 H GLY 28 H GLY 28 23.271 6.565 -9.858 224 1HA GLY 28 1HA GLY 28 22.835 8.564 -12.030 225 2HA GLY 28 2HA GLY 28 24.055 8.634 -10.764 226 H LEU 29 H LEU 29 22.426 8.271 -8.513 227 HA LEU 29 HA LEU 29 21.266 10.975 -8.315 228 1HB LEU 29 2HB LEU 29 19.530 8.891 -8.937 229 2HB LEU 29 1HB LEU 29 19.403 9.006 -7.189 230 HG LEU 29 HG LEU 29 19.193 11.573 -7.619 231 1HD1 LEU 29 2HD1 LEU 29 18.930 10.354 -10.334 232 2HD1 LEU 29 1HD1 LEU 29 17.825 11.666 -9.918 233 3HD1 LEU 29 3HD1 LEU 29 19.568 11.932 -9.868 234 1HD2 LEU 29 3HD2 LEU 29 17.105 9.467 -8.186 235 2HD2 LEU 29 2HD2 LEU 29 17.329 10.419 -6.718 236 3HD2 LEU 29 1HD2 LEU 29 16.703 11.185 -8.177 237 H CYS 30 H CYS 30 21.128 11.626 -6.102 238 HA CYS 30 HA CYS 30 22.973 10.235 -4.343 239 1HB CYS 30 2HB CYS 30 21.179 12.631 -3.827 240 2HB CYS 30 1HB CYS 30 22.403 12.040 -2.702 241 H GLN 31 H GLN 31 22.404 9.460 -2.158 242 HA GLN 31 HA GLN 31 19.552 8.908 -1.628 243 1HB GLN 31 2HB GLN 31 21.427 6.863 -2.670 244 2HB GLN 31 1HB GLN 31 20.494 6.370 -1.257 245 1HG GLN 31 2HG GLN 31 18.531 6.326 -2.408 246 2HG GLN 31 1HG GLN 31 18.917 7.791 -3.309 247 1HE2 GLN 31 1HE2 GLN 31 19.261 7.423 -5.497 248 2HE2 GLN 31 2HE2 GLN 31 19.818 5.966 -6.166 249 H THR 32 H THR 32 19.598 7.343 0.425 250 HA THR 32 HA THR 32 21.224 8.742 2.482 251 HB THR 32 HB THR 32 19.563 7.753 4.045 252 HG1 THR 32 HG1 THR 32 17.779 6.696 3.087 253 1HG2 THR 32 2HG2 THR 32 19.234 9.962 2.736 254 2HG2 THR 32 1HG2 THR 32 18.085 9.050 1.757 255 3HG2 THR 32 3HG2 THR 32 17.809 9.246 3.489 256 H PHE 33 H PHE 33 22.092 7.462 4.314 257 HA PHE 33 HA PHE 33 22.328 4.601 4.111 258 1HB PHE 33 2HB PHE 33 24.456 4.285 3.333 259 2HB PHE 33 1HB PHE 33 23.870 5.590 2.311 260 HD1 PHE 33 HD1 PHE 33 26.410 4.548 4.573 261 HD2 PHE 33 HD2 PHE 33 24.369 8.010 3.082 262 HE1 PHE 33 HE1 PHE 33 28.375 5.948 5.144 263 HE2 PHE 33 HE2 PHE 33 26.318 9.417 3.682 264 HZ PHE 33 HZ PHE 33 28.329 8.386 4.687 265 H VAL 34 H VAL 34 24.490 3.999 5.554 266 HA VAL 34 HA VAL 34 24.237 5.686 8.058 267 HB VAL 34 HB VAL 34 24.503 2.678 7.782 268 1HG1 VAL 34 3HG1 VAL 34 24.576 4.461 10.238 269 2HG1 VAL 34 2HG1 VAL 34 24.442 2.704 10.280 270 3HG1 VAL 34 1HG1 VAL 34 25.898 3.460 9.634 271 1HG2 VAL 34 1HG2 VAL 34 22.215 3.749 7.515 272 2HG2 VAL 34 3HG2 VAL 34 22.340 2.618 8.864 273 3HG2 VAL 34 2HG2 VAL 34 22.383 4.357 9.163 274 H TYR 35 H TYR 35 26.160 6.508 8.814 275 HA TYR 35 HA TYR 35 28.705 5.432 7.673 276 1HB TYR 35 2HB TYR 35 28.447 7.850 7.519 277 2HB TYR 35 1HB TYR 35 28.074 7.961 9.236 278 HD1 TYR 35 HD1 TYR 35 30.765 5.797 7.777 279 HD2 TYR 35 HD2 TYR 35 29.870 9.429 9.886 280 HE1 TYR 35 HE1 TYR 35 33.160 6.089 8.262 281 HE2 TYR 35 HE2 TYR 35 32.289 9.725 10.365 282 HH TYR 35 HH TYR 35 34.313 8.514 10.461 283 H GLY 36 H GLY 36 30.174 4.366 8.994 284 1HA GLY 36 1HA GLY 36 30.912 3.165 10.851 285 2HA GLY 36 2HA GLY 36 29.323 3.405 11.574 286 H GLY 37 H GLY 37 31.588 5.942 10.513 287 1HA GLY 37 1HA GLY 37 31.969 6.745 13.414 288 2HA GLY 37 2HA GLY 37 31.622 7.939 12.167 289 H CYS 38 H CYS 38 33.647 5.173 11.465 290 HA CYS 38 HA CYS 38 36.043 7.032 11.417 291 1HB CYS 38 2HB CYS 38 37.416 5.060 12.108 292 2HB CYS 38 1HB CYS 38 36.244 5.549 13.333 293 H ARG 39 H ARG 39 37.592 6.649 9.804 294 HA ARG 39 HA ARG 39 38.345 6.072 7.740 295 1HB ARG 39 2HB ARG 39 37.136 3.498 8.663 296 2HB ARG 39 1HB ARG 39 37.876 3.614 7.066 297 1HG ARG 39 2HG ARG 39 39.804 4.804 8.540 298 2HG ARG 39 1HG ARG 39 39.147 3.701 9.750 299 1HD ARG 39 2HD ARG 39 39.430 1.817 8.175 300 2HD ARG 39 1HD ARG 39 40.120 2.927 6.982 301 HE ARG 39 HE ARG 39 41.639 3.321 9.300 302 1HH1 ARG 39 1HH1 ARG 39 43.509 2.186 9.730 303 2HH1 ARG 39 2HH1 ARG 39 43.772 0.658 8.969 304 1HH2 ARG 39 1HH2 ARG 39 40.801 0.716 7.237 305 2HH2 ARG 39 2HH2 ARG 39 42.246 -0.171 7.565 306 H ALA 40 H ALA 40 36.211 7.643 7.472 307 HA ALA 40 HA ALA 40 34.105 6.428 5.840 308 1HB ALA 40 2HB ALA 40 34.155 8.654 7.324 309 2HB ALA 40 1HB ALA 40 34.645 9.381 5.793 310 3HB ALA 40 3HB ALA 40 33.108 8.521 5.915 311 H LYS 41 H LYS 41 33.796 7.891 3.628 312 HA LYS 41 HA LYS 41 36.412 7.952 2.173 313 1HB LYS 41 2HB LYS 41 33.848 6.720 1.116 314 2HB LYS 41 1HB LYS 41 35.384 6.814 0.254 315 1HG LYS 41 2HG LYS 41 34.979 5.378 2.900 316 2HG LYS 41 1HG LYS 41 35.008 4.581 1.326 317 1HD LYS 41 2HD LYS 41 37.292 5.051 0.990 318 2HD LYS 41 1HD LYS 41 37.307 6.334 2.196 319 1HE LYS 41 2HE LYS 41 36.639 3.544 3.068 320 2HE LYS 41 1HE LYS 41 38.324 3.956 2.759 321 1HZ LYS 41 1HZ LYS 41 37.213 6.049 4.261 322 2HZ LYS 41 3HZ LYS 41 36.745 4.592 5.034 323 3HZ LYS 41 2HZ LYS 41 38.398 4.918 4.742 324 H ARG 42 H ARG 42 35.675 8.823 -0.313 325 HA ARG 42 HA ARG 42 35.037 11.605 0.193 326 1HB ARG 42 2HB ARG 42 35.451 9.986 -2.325 327 2HB ARG 42 1HB ARG 42 34.789 11.610 -2.423 328 1HG ARG 42 2HG ARG 42 36.799 12.257 -0.869 329 2HG ARG 42 1HG ARG 42 37.500 10.744 -1.443 330 1HD ARG 42 2HD ARG 42 37.327 11.486 -3.758 331 2HD ARG 42 1HD ARG 42 36.489 12.963 -3.268 332 HE ARG 42 HE ARG 42 38.891 12.978 -1.826 333 1HH1 ARG 42 1HH1 ARG 42 40.758 13.938 -2.587 334 2HH1 ARG 42 2HH1 ARG 42 40.952 14.192 -4.286 335 1HH2 ARG 42 1HH2 ARG 42 37.919 12.836 -5.124 336 2HH2 ARG 42 2HH2 ARG 42 39.361 13.576 -5.708 337 H ASN 43 H ASN 43 33.239 8.912 -1.264 338 HA ASN 43 HA ASN 43 30.872 10.401 -1.956 339 1HB ASN 43 2HB ASN 43 31.675 7.840 -2.346 340 2HB ASN 43 1HB ASN 43 30.629 7.585 -0.954 341 1HD2 ASN 43 1HD2 ASN 43 30.347 6.953 -3.954 342 2HD2 ASN 43 2HD2 ASN 43 28.802 7.572 -4.348 343 H ASN 44 H ASN 44 30.622 11.821 -0.037 344 HA ASN 44 HA ASN 44 29.039 10.552 2.108 345 1HB ASN 44 2HB ASN 44 31.521 10.286 2.738 346 2HB ASN 44 1HB ASN 44 31.572 12.041 2.892 347 1HD2 ASN 44 1HD2 ASN 44 31.186 9.321 4.759 348 2HD2 ASN 44 2HD2 ASN 44 30.217 9.974 5.992 349 H PHE 45 H PHE 45 27.464 11.994 2.656 350 HA PHE 45 HA PHE 45 28.025 14.895 2.572 351 1HB PHE 45 2HB PHE 45 25.810 13.523 1.056 352 2HB PHE 45 1HB PHE 45 25.874 15.263 1.340 353 HD1 PHE 45 HD1 PHE 45 27.164 12.511 -0.638 354 HD2 PHE 45 HD2 PHE 45 27.859 16.577 0.539 355 HE1 PHE 45 HE1 PHE 45 28.772 12.793 -2.528 356 HE2 PHE 45 HE2 PHE 45 29.451 16.854 -1.327 357 HZ PHE 45 HZ PHE 45 29.907 14.965 -2.859 358 H LYS 46 H LYS 46 26.019 16.135 3.518 359 HA LYS 46 HA LYS 46 25.066 14.484 5.821 360 1HB LYS 46 2HB LYS 46 24.965 16.504 7.109 361 2HB LYS 46 1HB LYS 46 26.487 16.575 6.216 362 1HG LYS 46 2HG LYS 46 25.376 17.944 4.466 363 2HG LYS 46 1HG LYS 46 23.888 17.913 5.407 364 1HD LYS 46 2HD LYS 46 24.618 19.751 6.472 365 2HD LYS 46 1HD LYS 46 25.856 18.748 7.234 366 1HE LYS 46 2HE LYS 46 26.355 19.705 4.446 367 2HE LYS 46 1HE LYS 46 26.486 20.884 5.751 368 1HZ LYS 46 2HZ LYS 46 27.891 18.269 5.689 369 2HZ LYS 46 1HZ LYS 46 28.591 19.753 5.260 370 3HZ LYS 46 3HZ LYS 46 28.083 19.489 6.858 371 H SER 47 H SER 47 24.005 16.388 3.112 372 HA SER 47 HA SER 47 21.178 15.634 3.740 373 1HB SER 47 2HB SER 47 20.344 17.788 3.391 374 2HB SER 47 1HB SER 47 21.875 18.179 4.170 375 HG SER 47 HG SER 47 22.359 19.207 2.389 376 H ALA 48 H ALA 48 19.865 15.448 1.812 377 HA ALA 48 HA ALA 48 21.271 14.352 -0.458 378 1HB ALA 48 3HB ALA 48 18.922 13.736 0.234 379 2HB ALA 48 2HB ALA 48 18.392 15.312 -0.351 380 3HB ALA 48 1HB ALA 48 19.073 14.136 -1.477 381 H GLU 49 H GLU 49 19.776 17.468 0.261 382 HA GLU 49 HA GLU 49 20.019 18.718 -2.259 383 1HB GLU 49 2HB GLU 49 20.551 19.958 0.444 384 2HB GLU 49 1HB GLU 49 20.141 20.837 -1.021 385 1HG GLU 49 2HG GLU 49 18.275 20.428 0.681 386 2HG GLU 49 1HG GLU 49 17.904 20.064 -0.954 387 H ASP 50 H ASP 50 22.318 18.504 0.416 388 HA ASP 50 HA ASP 50 24.506 19.835 -0.738 389 1HB ASP 50 2HB ASP 50 24.195 17.693 1.319 390 2HB ASP 50 1HB ASP 50 25.815 18.055 0.741 391 H CYS 51 H CYS 51 23.965 16.298 -0.745 392 HA CYS 51 HA CYS 51 26.173 15.650 -2.418 393 1HB CYS 51 2HB CYS 51 25.074 13.920 -1.181 394 2HB CYS 51 1HB CYS 51 23.528 14.252 -1.959 395 H MET 52 H MET 52 22.816 16.464 -3.303 396 HA MET 52 HA MET 52 23.080 15.827 -6.100 397 1HB MET 52 2HB MET 52 21.205 17.661 -4.584 398 2HB MET 52 1HB MET 52 21.050 17.336 -6.313 399 1HG MET 52 2HG MET 52 21.013 15.252 -4.107 400 2HG MET 52 1HG MET 52 19.613 15.802 -5.027 401 1HE MET 52 1HE MET 52 19.296 15.837 -7.158 402 2HE MET 52 3HE MET 52 20.151 15.041 -8.487 403 3HE MET 52 2HE MET 52 18.979 14.142 -7.525 404 H ARG 53 H ARG 53 23.340 18.917 -4.341 405 HA ARG 53 HA ARG 53 24.021 20.481 -6.677 406 1HB ARG 53 2HB ARG 53 23.232 21.910 -5.082 407 2HB ARG 53 1HB ARG 53 23.751 20.873 -3.758 408 1HG ARG 53 2HG ARG 53 25.814 22.385 -5.354 409 2HG ARG 53 1HG ARG 53 24.899 23.211 -4.097 410 1HD ARG 53 2HD ARG 53 26.124 20.562 -3.442 411 2HD ARG 53 1HD ARG 53 27.176 21.975 -3.505 412 HE ARG 53 HE ARG 53 25.023 22.769 -1.929 413 1HH1 ARG 53 1HH1 ARG 53 24.963 22.523 0.299 414 2HH1 ARG 53 2HH1 ARG 53 25.940 21.298 1.056 415 1HH2 ARG 53 1HH2 ARG 53 27.340 20.182 -1.901 416 2HH2 ARG 53 2HH2 ARG 53 27.253 20.014 -0.167 417 H THR 54 H THR 54 25.911 18.472 -4.522 418 HA THR 54 HA THR 54 28.399 19.765 -5.457 419 HB THR 54 HB THR 54 28.383 17.483 -3.500 420 HG1 THR 54 HG1 THR 54 26.789 18.800 -2.676 421 1HG2 THR 54 3HG2 THR 54 29.992 20.039 -3.820 422 2HG2 THR 54 2HG2 THR 54 30.241 18.843 -2.548 423 3HG2 THR 54 1HG2 THR 54 30.528 18.408 -4.234 424 H CYS 55 H CYS 55 27.381 16.335 -5.054 425 HA CYS 55 HA CYS 55 29.345 15.559 -7.148 426 1HB CYS 55 2HB CYS 55 29.360 14.087 -5.284 427 2HB CYS 55 1HB CYS 55 27.600 14.031 -5.202 428 H GLY 56 H GLY 56 25.867 15.318 -6.443 429 1HA GLY 56 1HA GLY 56 24.044 15.137 -7.958 430 2HA GLY 56 2HA GLY 56 25.100 14.012 -8.839 431 H GLY 57 H GLY 57 24.376 17.508 -8.406 432 1HA GLY 57 1HA GLY 57 25.984 18.426 -10.625 433 2HA GLY 57 2HA GLY 57 24.601 19.294 -9.941 434 H ALA 58 H ALA 58 24.848 16.119 -11.585 435 HA ALA 58 HA ALA 58 22.395 16.419 -13.036 436 1HB ALA 58 1HB ALA 58 24.931 17.339 -14.379 437 2HB ALA 58 3HB ALA 58 23.619 16.654 -15.342 438 3HB ALA 58 2HB ALA 58 23.347 18.108 -14.382 No H/Q in entry = 438 Start of MODEL 2 1 H1 ARG 1 1H ARG 1 29.209 15.182 -11.777 2 H2 ARG 1 3H ARG 1 27.684 14.434 -11.876 3 H3 ARG 1 2H ARG 1 28.137 15.241 -10.446 4 HA ARG 1 HA ARG 1 28.906 13.336 -9.648 5 1HB ARG 1 2HB ARG 1 28.888 11.285 -11.113 6 2HB ARG 1 1HB ARG 1 27.350 12.149 -11.071 7 1HG ARG 1 2HG ARG 1 27.841 13.232 -13.199 8 2HG ARG 1 1HG ARG 1 29.462 12.550 -13.217 9 1HD ARG 1 2HD ARG 1 28.728 10.631 -14.125 10 2HD ARG 1 1HD ARG 1 27.460 10.460 -12.912 11 HE ARG 1 HE ARG 1 27.073 11.324 -15.609 12 1HH1 ARG 1 1HH1 ARG 1 25.503 12.799 -16.257 13 2HH1 ARG 1 2HH1 ARG 1 24.553 13.639 -15.057 14 1HH2 ARG 1 1HH2 ARG 1 26.075 12.070 -12.413 15 2HH2 ARG 1 2HH2 ARG 1 24.859 13.222 -12.913 16 HA PRO 2 HA PRO 2 33.057 14.326 -11.791 17 1HB PRO 2 2HB PRO 2 33.777 15.396 -9.125 18 2HB PRO 2 1HB PRO 2 34.007 16.119 -10.728 19 1HG PRO 2 2HG PRO 2 32.181 17.051 -9.011 20 2HG PRO 2 1HG PRO 2 31.911 17.049 -10.763 21 1HD PRO 2 1HD PRO 2 30.807 15.179 -8.684 22 2HD PRO 2 2HD PRO 2 30.014 15.861 -10.121 23 H ASP 3 H ASP 3 35.258 14.031 -9.843 24 HA ASP 3 HA ASP 3 35.473 11.190 -9.834 25 1HB ASP 3 2HB ASP 3 37.330 11.584 -8.101 26 2HB ASP 3 1HB ASP 3 37.532 12.365 -9.687 27 H PHE 4 H PHE 4 35.001 13.313 -6.995 28 HA PHE 4 HA PHE 4 34.537 11.239 -5.139 29 1HB PHE 4 2HB PHE 4 33.242 13.107 -3.850 30 2HB PHE 4 1HB PHE 4 34.966 13.341 -4.134 31 HD1 PHE 4 HD1 PHE 4 31.577 14.490 -4.879 32 HD2 PHE 4 HD2 PHE 4 35.712 14.905 -5.967 33 HE1 PHE 4 HE1 PHE 4 31.052 16.616 -6.055 34 HE2 PHE 4 HE2 PHE 4 35.191 17.020 -7.156 35 HZ PHE 4 HZ PHE 4 32.862 17.880 -7.196 36 H CYS 5 H CYS 5 33.127 10.447 -7.347 37 HA CYS 5 HA CYS 5 30.342 10.275 -6.293 38 1HB CYS 5 2HB CYS 5 31.113 11.072 -9.118 39 2HB CYS 5 1HB CYS 5 29.478 10.675 -8.606 40 H LEU 6 H LEU 6 33.047 8.723 -7.191 41 HA LEU 6 HA LEU 6 31.640 6.515 -8.609 42 1HB LEU 6 2HB LEU 6 34.521 7.393 -8.522 43 2HB LEU 6 1HB LEU 6 34.057 5.803 -9.129 44 HG LEU 6 HG LEU 6 32.314 7.758 -10.297 45 1HD1 LEU 6 1HD1 LEU 6 35.220 8.494 -10.196 46 2HD1 LEU 6 3HD1 LEU 6 34.315 8.799 -11.678 47 3HD1 LEU 6 2HD1 LEU 6 33.797 9.537 -10.162 48 1HD2 LEU 6 1HD2 LEU 6 32.902 5.552 -11.237 49 2HD2 LEU 6 3HD2 LEU 6 33.254 6.844 -12.384 50 3HD2 LEU 6 2HD2 LEU 6 34.564 6.095 -11.471 51 H GLU 7 H GLU 7 34.143 6.964 -6.037 52 HA GLU 7 HA GLU 7 34.219 4.260 -5.238 53 1HB GLU 7 2HB GLU 7 34.603 5.401 -2.836 54 2HB GLU 7 1HB GLU 7 35.848 5.397 -4.079 55 1HG GLU 7 2HG GLU 7 35.751 7.652 -4.329 56 2HG GLU 7 1HG GLU 7 33.986 7.656 -4.338 57 HA PRO 8 HA PRO 8 30.004 3.726 -4.036 58 1HB PRO 8 2HB PRO 8 30.256 1.212 -2.936 59 2HB PRO 8 1HB PRO 8 30.233 1.536 -4.675 60 1HG PRO 8 2HG PRO 8 32.544 1.005 -2.883 61 2HG PRO 8 1HG PRO 8 32.251 0.452 -4.539 62 1HD PRO 8 1HD PRO 8 33.929 2.536 -3.927 63 2HD PRO 8 2HD PRO 8 33.056 2.413 -5.471 64 HA PRO 9 HA PRO 9 29.315 4.920 0.171 65 1HB PRO 9 2HB PRO 9 27.555 2.837 1.008 66 2HB PRO 9 1HB PRO 9 27.112 4.418 0.339 67 1HG PRO 9 2HG PRO 9 27.203 1.780 -0.960 68 2HG PRO 9 1HG PRO 9 26.247 3.213 -1.365 69 1HD PRO 9 1HD PRO 9 28.389 2.365 -2.838 70 2HD PRO 9 2HD PRO 9 27.893 4.069 -2.757 71 H TYR 10 H TYR 10 30.811 4.577 1.807 72 HA TYR 10 HA TYR 10 31.683 1.826 2.587 73 1HB TYR 10 2HB TYR 10 33.257 3.367 1.292 74 2HB TYR 10 1HB TYR 10 33.306 4.435 2.693 75 HD1 TYR 10 HD1 TYR 10 34.541 1.358 1.196 76 HD2 TYR 10 HD2 TYR 10 34.229 3.548 4.877 77 HE1 TYR 10 HE1 TYR 10 36.434 0.059 2.128 78 HE2 TYR 10 HE2 TYR 10 36.112 2.233 5.814 79 HH TYR 10 HH TYR 10 37.588 -0.422 3.992 80 H THR 11 H THR 11 30.655 1.484 4.483 81 HA THR 11 HA THR 11 29.876 3.549 6.366 82 HB THR 11 HB THR 11 29.605 0.521 6.343 83 HG1 THR 11 HG1 THR 11 27.603 2.529 6.358 84 1HG2 THR 11 3HG2 THR 11 28.660 2.531 8.394 85 2HG2 THR 11 2HG2 THR 11 28.177 0.837 8.344 86 3HG2 THR 11 1HG2 THR 11 29.858 1.265 8.657 87 H GLY 12 H GLY 12 32.374 1.133 5.969 88 1HA GLY 12 1HA GLY 12 33.957 2.300 8.140 89 2HA GLY 12 2HA GLY 12 34.451 0.965 7.105 90 HA PRO 13 HA PRO 13 33.815 -1.889 10.385 91 1HB PRO 13 2HB PRO 13 35.629 -1.152 12.344 92 2HB PRO 13 1HB PRO 13 36.032 -2.064 10.877 93 1HG PRO 13 2HG PRO 13 36.423 0.806 11.489 94 2HG PRO 13 1HG PRO 13 37.409 -0.288 10.506 95 1HD PRO 13 1HD PRO 13 35.707 1.594 9.440 96 2HD PRO 13 2HD PRO 13 36.165 0.104 8.599 97 H CYS 14 H CYS 14 34.089 1.348 11.884 98 HA CYS 14 HA CYS 14 32.673 0.696 14.272 99 1HB CYS 14 2HB CYS 14 32.698 3.371 12.853 100 2HB CYS 14 1HB CYS 14 32.398 3.093 14.568 101 H LYS 15 H LYS 15 30.431 1.441 14.850 102 HA LYS 15 HA LYS 15 28.631 1.503 12.505 103 1HB LYS 15 2HB LYS 15 28.275 -0.278 14.926 104 2HB LYS 15 1HB LYS 15 27.089 -0.083 13.634 105 1HG LYS 15 2HG LYS 15 29.933 -1.019 13.146 106 2HG LYS 15 1HG LYS 15 28.583 -2.123 13.403 107 1HD LYS 15 2HD LYS 15 27.515 -1.495 11.406 108 2HD LYS 15 1HD LYS 15 28.387 0.032 11.304 109 1HE LYS 15 2HE LYS 15 29.657 -2.704 10.982 110 2HE LYS 15 1HE LYS 15 29.215 -1.633 9.650 111 1HZ LYS 15 3HZ LYS 15 30.631 0.035 11.188 112 2HZ LYS 15 2HZ LYS 15 31.427 -1.435 11.547 113 3HZ LYS 15 1HZ LYS 15 31.327 -0.877 9.926 114 H ALA 16 H ALA 16 29.502 3.664 14.162 115 HA ALA 16 HA ALA 16 27.671 4.268 16.249 116 1HB ALA 16 1HB ALA 16 29.671 5.649 15.944 117 2HB ALA 16 2HB ALA 16 28.245 6.672 15.764 118 3HB ALA 16 3HB ALA 16 29.121 6.122 14.332 119 H ARG 17 H ARG 17 25.592 4.706 16.158 120 HA ARG 17 HA ARG 17 24.000 4.429 13.872 121 1HB ARG 17 2HB ARG 17 23.565 5.424 16.632 122 2HB ARG 17 1HB ARG 17 22.369 5.926 15.439 123 1HG ARG 17 2HG ARG 17 21.401 3.916 15.805 124 2HG ARG 17 1HG ARG 17 22.706 3.258 14.823 125 1HD ARG 17 2HD ARG 17 24.069 3.107 16.973 126 2HD ARG 17 1HD ARG 17 22.576 3.440 17.847 127 HE ARG 17 HE ARG 17 23.374 0.904 16.763 128 1HH1 ARG 17 1HH1 ARG 17 21.949 -0.720 16.217 129 2HH1 ARG 17 2HH1 ARG 17 20.260 -0.376 16.112 130 1HH2 ARG 17 1HH2 ARG 17 20.624 2.942 16.935 131 2HH2 ARG 17 2HH2 ARG 17 19.512 1.691 16.510 132 H ILE 18 H ILE 18 25.935 6.155 12.951 133 HA ILE 18 HA ILE 18 24.680 8.821 12.874 134 HB ILE 18 HB ILE 18 27.328 7.850 11.727 135 1HG1 ILE 18 2HG1 ILE 18 26.755 9.684 14.084 136 2HG1 ILE 18 1HG1 ILE 18 27.201 7.984 14.228 137 1HG2 ILE 18 2HG2 ILE 18 26.127 10.640 11.896 138 2HG2 ILE 18 1HG2 ILE 18 27.765 10.267 11.364 139 3HG2 ILE 18 3HG2 ILE 18 26.386 9.715 10.416 140 1HD1 ILE 18 3HD1 ILE 18 28.883 10.100 12.854 141 2HD1 ILE 18 2HD1 ILE 18 29.167 9.489 14.483 142 3HD1 ILE 18 1HD1 ILE 18 29.329 8.411 13.095 143 H ILE 19 H ILE 19 23.028 8.877 11.558 144 HA ILE 19 HA ILE 19 23.063 7.452 8.985 145 HB ILE 19 HB ILE 19 20.948 9.503 9.422 146 1HG1 ILE 19 2HG1 ILE 19 21.285 8.658 11.748 147 2HG1 ILE 19 1HG1 ILE 19 19.745 8.125 11.083 148 1HG2 ILE 19 2HG2 ILE 19 21.349 6.908 8.129 149 2HG2 ILE 19 1HG2 ILE 19 19.822 6.996 9.007 150 3HG2 ILE 19 3HG2 ILE 19 20.193 8.187 7.760 151 1HD1 ILE 19 1HD1 ILE 19 22.275 6.453 11.063 152 2HD1 ILE 19 3HD1 ILE 19 20.986 6.301 12.261 153 3HD1 ILE 19 2HD1 ILE 19 20.662 5.936 10.568 154 H ARG 20 H ARG 20 23.476 8.379 7.025 155 HA ARG 20 HA ARG 20 23.779 11.327 6.825 156 1HB ARG 20 2HB ARG 20 25.991 9.408 6.009 157 2HB ARG 20 1HB ARG 20 25.997 11.145 5.745 158 1HG ARG 20 2HG ARG 20 25.667 10.161 8.548 159 2HG ARG 20 1HG ARG 20 27.258 10.039 7.820 160 1HD ARG 20 2HD ARG 20 25.620 12.577 8.036 161 2HD ARG 20 1HD ARG 20 26.993 12.152 9.051 162 HE ARG 20 HE ARG 20 27.879 11.955 6.371 163 1HH1 ARG 20 1HH1 ARG 20 28.944 13.596 5.360 164 2HH1 ARG 20 2HH1 ARG 20 28.751 15.227 5.917 165 1HH2 ARG 20 1HH2 ARG 20 26.585 14.350 8.465 166 2HH2 ARG 20 2HH2 ARG 20 27.438 15.646 7.710 167 H TYR 21 H TYR 21 24.583 11.676 4.346 168 HA TYR 21 HA TYR 21 22.769 10.007 2.601 169 1HB TYR 21 2HB TYR 21 23.632 12.909 2.353 170 2HB TYR 21 1HB TYR 21 22.688 12.042 1.144 171 HD1 TYR 21 HD1 TYR 21 22.702 12.982 4.754 172 HD2 TYR 21 HD2 TYR 21 20.364 11.911 1.328 173 HE1 TYR 21 HE1 TYR 21 20.629 13.462 6.009 174 HE2 TYR 21 HE2 TYR 21 18.297 12.416 2.586 175 HH TYR 21 HH TYR 21 17.856 12.423 5.434 176 H PHE 22 H PHE 22 23.621 9.616 0.368 177 HA PHE 22 HA PHE 22 26.523 10.264 -0.104 178 1HB PHE 22 2HB PHE 22 27.239 8.065 -0.335 179 2HB PHE 22 1HB PHE 22 26.122 7.917 1.010 180 HD1 PHE 22 HD1 PHE 22 26.961 6.681 -2.211 181 HD2 PHE 22 HD2 PHE 22 23.624 7.412 0.387 182 HE1 PHE 22 HE1 PHE 22 25.600 5.061 -3.520 183 HE2 PHE 22 HE2 PHE 22 22.257 5.805 -0.909 184 HZ PHE 22 HZ PHE 22 23.237 4.631 -2.870 185 H TYR 23 H TYR 23 27.161 9.387 -2.428 186 HA TYR 23 HA TYR 23 24.918 10.168 -4.279 187 1HB TYR 23 2HB TYR 23 26.970 11.422 -4.600 188 2HB TYR 23 1HB TYR 23 27.919 9.941 -4.662 189 HD1 TYR 23 HD1 TYR 23 28.468 9.074 -6.750 190 HD2 TYR 23 HD2 TYR 23 24.944 11.502 -6.371 191 HE1 TYR 23 HE1 TYR 23 28.137 8.975 -9.208 192 HE2 TYR 23 HE2 TYR 23 24.615 11.401 -8.833 193 HH TYR 23 HH TYR 23 26.112 9.231 -10.811 194 H ASN 24 H ASN 24 23.807 8.456 -5.189 195 HA ASN 24 HA ASN 24 25.043 5.779 -5.260 196 1HB ASN 24 2HB ASN 24 22.623 6.110 -4.635 197 2HB ASN 24 1HB ASN 24 22.295 6.585 -6.298 198 1HD2 ASN 24 1HD2 ASN 24 21.207 4.202 -4.954 199 2HD2 ASN 24 2HD2 ASN 24 21.789 2.857 -5.819 200 H ALA 25 H ALA 25 26.676 5.906 -6.822 201 HA ALA 25 HA ALA 25 26.247 7.121 -9.409 202 1HB ALA 25 2HB ALA 25 28.496 6.552 -8.156 203 2HB ALA 25 3HB ALA 25 28.436 6.481 -9.918 204 3HB ALA 25 1HB ALA 25 28.342 4.995 -8.968 205 H LYS 26 H LYS 26 25.039 4.198 -8.135 206 HA LYS 26 HA LYS 26 25.273 2.514 -10.497 207 1HB LYS 26 2HB LYS 26 24.395 2.202 -7.843 208 2HB LYS 26 1HB LYS 26 22.967 1.896 -8.832 209 1HG LYS 26 2HG LYS 26 25.651 0.649 -9.464 210 2HG LYS 26 1HG LYS 26 24.495 -0.122 -8.374 211 1HD LYS 26 2HD LYS 26 22.763 0.016 -10.202 212 2HD LYS 26 1HD LYS 26 24.016 0.631 -11.282 213 1HE LYS 26 2HE LYS 26 25.290 -1.421 -11.091 214 2HE LYS 26 1HE LYS 26 24.220 -2.024 -9.820 215 1HZ LYS 26 3HZ LYS 26 23.190 -1.308 -12.507 216 2HZ LYS 26 2HZ LYS 26 23.819 -2.853 -12.177 217 3HZ LYS 26 1HZ LYS 26 22.462 -2.287 -11.325 218 H ALA 27 H ALA 27 23.050 5.037 -9.512 219 HA ALA 27 HA ALA 27 21.432 4.533 -12.009 220 1HB ALA 27 3HB ALA 27 19.895 3.953 -10.318 221 2HB ALA 27 1HB ALA 27 19.532 5.653 -10.614 222 3HB ALA 27 2HB ALA 27 20.494 5.188 -9.210 223 H GLY 28 H GLY 28 23.218 6.749 -10.041 224 1HA GLY 28 1HA GLY 28 22.837 8.855 -12.119 225 2HA GLY 28 2HA GLY 28 24.057 8.838 -10.842 226 H LEU 29 H LEU 29 22.413 8.363 -8.626 227 HA LEU 29 HA LEU 29 21.248 11.052 -8.290 228 1HB LEU 29 2HB LEU 29 19.540 8.912 -8.933 229 2HB LEU 29 1HB LEU 29 19.408 9.075 -7.187 230 HG LEU 29 HG LEU 29 19.178 11.629 -7.690 231 1HD1 LEU 29 1HD1 LEU 29 18.806 10.339 -10.380 232 2HD1 LEU 29 3HD1 LEU 29 17.850 11.762 -9.960 233 3HD1 LEU 29 2HD1 LEU 29 19.610 11.854 -9.965 234 1HD2 LEU 29 1HD2 LEU 29 17.270 9.407 -7.687 235 2HD2 LEU 29 3HD2 LEU 29 17.184 10.962 -6.860 236 3HD2 LEU 29 2HD2 LEU 29 16.651 10.824 -8.535 237 H CYS 30 H CYS 30 21.071 11.565 -6.032 238 HA CYS 30 HA CYS 30 22.935 10.052 -4.369 239 1HB CYS 30 2HB CYS 30 21.307 12.531 -3.664 240 2HB CYS 30 1HB CYS 30 22.557 11.801 -2.658 241 H GLN 31 H GLN 31 22.354 9.313 -2.186 242 HA GLN 31 HA GLN 31 19.483 8.852 -1.671 243 1HB GLN 31 2HB GLN 31 21.330 6.755 -2.671 244 2HB GLN 31 1HB GLN 31 20.361 6.298 -1.270 245 1HG GLN 31 2HG GLN 31 18.446 6.220 -2.479 246 2HG GLN 31 1HG GLN 31 18.809 7.731 -3.312 247 1HE2 GLN 31 1HE2 GLN 31 19.199 7.466 -5.519 248 2HE2 GLN 31 2HE2 GLN 31 19.778 6.043 -6.241 249 H THR 32 H THR 32 19.491 7.337 0.393 250 HA THR 32 HA THR 32 21.125 8.708 2.446 251 HB THR 32 HB THR 32 19.469 7.698 4.022 252 HG1 THR 32 HG1 THR 32 17.677 6.665 3.076 253 1HG2 THR 32 1HG2 THR 32 19.170 9.913 2.629 254 2HG2 THR 32 3HG2 THR 32 17.901 8.998 1.818 255 3HG2 THR 32 2HG2 THR 32 17.813 9.276 3.558 256 H PHE 33 H PHE 33 21.960 7.382 4.294 257 HA PHE 33 HA PHE 33 22.218 4.526 4.021 258 1HB PHE 33 2HB PHE 33 24.376 4.244 3.271 259 2HB PHE 33 1HB PHE 33 23.783 5.547 2.250 260 HD1 PHE 33 HD1 PHE 33 26.356 4.532 4.475 261 HD2 PHE 33 HD2 PHE 33 24.191 7.976 3.115 262 HE1 PHE 33 HE1 PHE 33 28.288 5.977 5.074 263 HE2 PHE 33 HE2 PHE 33 26.103 9.423 3.741 264 HZ PHE 33 HZ PHE 33 28.158 8.425 4.691 265 H VAL 34 H VAL 34 24.363 3.907 5.433 266 HA VAL 34 HA VAL 34 24.108 5.507 7.994 267 HB VAL 34 HB VAL 34 24.403 2.517 7.599 268 1HG1 VAL 34 3HG1 VAL 34 24.476 4.197 10.127 269 2HG1 VAL 34 2HG1 VAL 34 24.365 2.438 10.096 270 3HG1 VAL 34 1HG1 VAL 34 25.803 3.240 9.467 271 1HG2 VAL 34 3HG2 VAL 34 22.198 4.377 8.409 272 2HG2 VAL 34 2HG2 VAL 34 22.117 2.892 7.461 273 3HG2 VAL 34 1HG2 VAL 34 22.282 2.810 9.215 274 H TYR 35 H TYR 35 26.025 6.214 8.894 275 HA TYR 35 HA TYR 35 28.577 5.240 7.647 276 1HB TYR 35 2HB TYR 35 28.306 7.655 7.554 277 2HB TYR 35 1HB TYR 35 27.939 7.725 9.273 278 HD1 TYR 35 HD1 TYR 35 30.643 5.636 7.714 279 HD2 TYR 35 HD2 TYR 35 29.718 9.158 9.994 280 HE1 TYR 35 HE1 TYR 35 33.038 5.933 8.206 281 HE2 TYR 35 HE2 TYR 35 32.137 9.459 10.476 282 HH TYR 35 HH TYR 35 34.175 8.333 10.474 283 H GLY 36 H GLY 36 30.100 4.194 8.918 284 1HA GLY 36 1HA GLY 36 30.869 2.950 10.732 285 2HA GLY 36 2HA GLY 36 29.283 3.138 11.477 286 H GLY 37 H GLY 37 31.456 5.758 10.450 287 1HA GLY 37 1HA GLY 37 31.802 6.551 13.363 288 2HA GLY 37 2HA GLY 37 31.530 7.733 12.093 289 H CYS 38 H CYS 38 33.536 4.977 11.348 290 HA CYS 38 HA CYS 38 35.961 6.797 11.454 291 1HB CYS 38 2HB CYS 38 37.288 4.826 12.189 292 2HB CYS 38 1HB CYS 38 36.027 5.241 13.352 293 H ARG 39 H ARG 39 37.480 6.497 9.803 294 HA ARG 39 HA ARG 39 38.259 5.942 7.740 295 1HB ARG 39 2HB ARG 39 37.081 3.334 8.619 296 2HB ARG 39 1HB ARG 39 37.838 3.486 7.033 297 1HG ARG 39 2HG ARG 39 39.703 4.701 8.632 298 2HG ARG 39 1HG ARG 39 39.079 3.456 9.714 299 1HD ARG 39 2HD ARG 39 39.508 1.735 8.012 300 2HD ARG 39 1HD ARG 39 40.096 2.973 6.893 301 HE ARG 39 HE ARG 39 41.647 3.302 9.200 302 1HH1 ARG 39 1HH1 ARG 39 43.592 2.265 9.528 303 2HH1 ARG 39 2HH1 ARG 39 43.943 0.810 8.664 304 1HH2 ARG 39 1HH2 ARG 39 40.934 0.785 6.977 305 2HH2 ARG 39 2HH2 ARG 39 42.439 -0.028 7.222 306 H ALA 40 H ALA 40 36.083 7.480 7.498 307 HA ALA 40 HA ALA 40 34.017 6.253 5.821 308 1HB ALA 40 2HB ALA 40 33.973 8.418 7.366 309 2HB ALA 40 1HB ALA 40 34.503 9.220 5.889 310 3HB ALA 40 3HB ALA 40 32.978 8.333 5.916 311 H LYS 41 H LYS 41 33.685 7.798 3.644 312 HA LYS 41 HA LYS 41 36.312 7.957 2.225 313 1HB LYS 41 2HB LYS 41 33.803 6.659 1.118 314 2HB LYS 41 1HB LYS 41 35.326 6.859 0.249 315 1HG LYS 41 2HG LYS 41 35.010 5.310 2.844 316 2HG LYS 41 1HG LYS 41 35.075 4.574 1.241 317 1HD LYS 41 2HD LYS 41 37.334 5.182 0.922 318 2HD LYS 41 1HD LYS 41 37.286 6.401 2.192 319 1HE LYS 41 2HE LYS 41 36.778 3.521 2.890 320 2HE LYS 41 1HE LYS 41 38.434 4.080 2.662 321 1HZ LYS 41 1HZ LYS 41 37.157 5.993 4.249 322 2HZ LYS 41 3HZ LYS 41 36.724 4.472 4.907 323 3HZ LYS 41 2HZ LYS 41 38.369 4.884 4.716 324 H ARG 42 H ARG 42 35.621 8.897 -0.237 325 HA ARG 42 HA ARG 42 34.907 11.640 0.328 326 1HB ARG 42 2HB ARG 42 35.343 10.105 -2.242 327 2HB ARG 42 1HB ARG 42 34.691 11.733 -2.277 328 1HG ARG 42 2HG ARG 42 36.682 12.378 -0.754 329 2HG ARG 42 1HG ARG 42 37.380 10.832 -1.231 330 1HD ARG 42 2HD ARG 42 37.276 11.486 -3.598 331 2HD ARG 42 1HD ARG 42 36.506 13.016 -3.174 332 HE ARG 42 HE ARG 42 38.895 12.932 -1.682 333 1HH1 ARG 42 1HH1 ARG 42 40.840 13.759 -2.442 334 2HH1 ARG 42 2HH1 ARG 42 41.053 13.997 -4.142 335 1HH2 ARG 42 1HH2 ARG 42 37.922 12.855 -4.978 336 2HH2 ARG 42 2HH2 ARG 42 39.411 13.490 -5.568 337 H ASN 43 H ASN 43 33.165 8.974 -1.234 338 HA ASN 43 HA ASN 43 30.790 10.455 -1.909 339 1HB ASN 43 2HB ASN 43 31.611 7.973 -2.466 340 2HB ASN 43 1HB ASN 43 30.675 7.575 -1.030 341 1HD2 ASN 43 1HD2 ASN 43 30.124 6.819 -3.825 342 2HD2 ASN 43 2HD2 ASN 43 28.575 7.444 -4.191 343 H ASN 44 H ASN 44 30.645 11.784 0.075 344 HA ASN 44 HA ASN 44 28.974 10.514 2.159 345 1HB ASN 44 2HB ASN 44 31.446 10.212 2.809 346 2HB ASN 44 1HB ASN 44 31.515 11.965 2.971 347 1HD2 ASN 44 1HD2 ASN 44 30.974 9.178 4.773 348 2HD2 ASN 44 2HD2 ASN 44 30.058 9.863 6.030 349 H PHE 45 H PHE 45 27.425 11.961 2.721 350 HA PHE 45 HA PHE 45 28.006 14.882 2.600 351 1HB PHE 45 2HB PHE 45 25.637 13.535 1.242 352 2HB PHE 45 1HB PHE 45 25.928 15.274 1.304 353 HD1 PHE 45 HD1 PHE 45 26.847 12.123 -0.281 354 HD2 PHE 45 HD2 PHE 45 27.939 16.247 0.199 355 HE1 PHE 45 HE1 PHE 45 28.414 11.923 -2.186 356 HE2 PHE 45 HE2 PHE 45 29.494 16.051 -1.717 357 HZ PHE 45 HZ PHE 45 29.732 13.892 -2.903 358 H LYS 46 H LYS 46 26.056 16.112 3.616 359 HA LYS 46 HA LYS 46 25.122 14.487 5.942 360 1HB LYS 46 2HB LYS 46 24.935 16.554 7.171 361 2HB LYS 46 1HB LYS 46 26.499 16.573 6.359 362 1HG LYS 46 2HG LYS 46 25.556 17.953 4.542 363 2HG LYS 46 1HG LYS 46 23.980 17.920 5.330 364 1HD LYS 46 2HD LYS 46 24.571 19.709 6.553 365 2HD LYS 46 1HD LYS 46 25.841 18.749 7.312 366 1HE LYS 46 2HE LYS 46 26.365 19.864 4.582 367 2HE LYS 46 1HE LYS 46 26.410 20.970 5.958 368 1HZ LYS 46 2HZ LYS 46 27.865 18.391 5.938 369 2HZ LYS 46 1HZ LYS 46 28.561 19.837 5.381 370 3HZ LYS 46 3HZ LYS 46 28.074 19.705 7.002 371 H SER 47 H SER 47 24.046 16.365 3.238 372 HA SER 47 HA SER 47 21.223 15.573 3.863 373 1HB SER 47 2HB SER 47 20.380 17.727 3.546 374 2HB SER 47 1HB SER 47 21.935 18.150 4.255 375 HG SER 47 HG SER 47 22.345 19.144 2.438 376 H ALA 48 H ALA 48 19.917 15.425 1.920 377 HA ALA 48 HA ALA 48 21.353 14.278 -0.318 378 1HB ALA 48 3HB ALA 48 19.072 13.553 0.256 379 2HB ALA 48 2HB ALA 48 18.458 15.174 -0.064 380 3HB ALA 48 1HB ALA 48 19.101 14.197 -1.385 381 H GLU 49 H GLU 49 19.877 17.385 0.404 382 HA GLU 49 HA GLU 49 20.088 18.641 -2.113 383 1HB GLU 49 2HB GLU 49 20.600 19.864 0.600 384 2HB GLU 49 1HB GLU 49 20.173 20.748 -0.856 385 1HG GLU 49 2HG GLU 49 18.342 20.247 0.906 386 2HG GLU 49 1HG GLU 49 17.945 20.035 -0.754 387 H ASP 50 H ASP 50 22.396 18.390 0.558 388 HA ASP 50 HA ASP 50 24.577 19.743 -0.609 389 1HB ASP 50 2HB ASP 50 24.313 17.573 1.439 390 2HB ASP 50 1HB ASP 50 25.916 18.019 0.874 391 H CYS 51 H CYS 51 23.998 16.209 -0.626 392 HA CYS 51 HA CYS 51 26.214 15.521 -2.278 393 1HB CYS 51 2HB CYS 51 24.981 13.822 -1.069 394 2HB CYS 51 1HB CYS 51 23.507 14.187 -1.962 395 H MET 52 H MET 52 22.858 16.342 -3.180 396 HA MET 52 HA MET 52 23.148 15.798 -5.989 397 1HB MET 52 2HB MET 52 21.241 17.634 -4.507 398 2HB MET 52 1HB MET 52 21.068 17.153 -6.197 399 1HG MET 52 2HG MET 52 21.332 15.116 -3.978 400 2HG MET 52 1HG MET 52 19.764 15.756 -4.466 401 1HE MET 52 3HE MET 52 18.414 14.967 -5.956 402 2HE MET 52 2HE MET 52 19.132 15.721 -7.377 403 3HE MET 52 1HE MET 52 18.714 14.011 -7.413 404 H ARG 53 H ARG 53 23.340 18.858 -4.156 405 HA ARG 53 HA ARG 53 23.954 20.496 -6.459 406 1HB ARG 53 2HB ARG 53 23.146 21.856 -4.814 407 2HB ARG 53 1HB ARG 53 23.731 20.811 -3.524 408 1HG ARG 53 2HG ARG 53 25.709 22.415 -5.135 409 2HG ARG 53 1HG ARG 53 24.792 23.194 -3.848 410 1HD ARG 53 2HD ARG 53 26.095 20.573 -3.249 411 2HD ARG 53 1HD ARG 53 27.117 22.008 -3.323 412 HE ARG 53 HE ARG 53 24.995 22.756 -1.694 413 1HH1 ARG 53 1HH1 ARG 53 24.980 22.484 0.533 414 2HH1 ARG 53 2HH1 ARG 53 25.974 21.252 1.255 415 1HH2 ARG 53 1HH2 ARG 53 27.323 20.189 -1.744 416 2HH2 ARG 53 2HH2 ARG 53 27.273 19.996 -0.011 417 H THR 54 H THR 54 25.931 18.486 -4.374 418 HA THR 54 HA THR 54 28.386 19.854 -5.362 419 HB THR 54 HB THR 54 28.547 17.614 -3.388 420 HG1 THR 54 HG1 THR 54 26.824 18.773 -2.551 421 1HG2 THR 54 1HG2 THR 54 30.546 18.829 -4.210 422 2HG2 THR 54 3HG2 THR 54 29.861 20.339 -3.605 423 3HG2 THR 54 2HG2 THR 54 30.302 19.056 -2.478 424 H CYS 55 H CYS 55 27.320 16.427 -4.943 425 HA CYS 55 HA CYS 55 29.344 15.631 -6.962 426 1HB CYS 55 2HB CYS 55 29.305 14.150 -5.111 427 2HB CYS 55 1HB CYS 55 27.545 14.121 -5.054 428 H GLY 56 H GLY 56 25.855 15.422 -6.352 429 1HA GLY 56 1HA GLY 56 24.060 15.237 -7.899 430 2HA GLY 56 2HA GLY 56 25.131 14.138 -8.783 431 H GLY 57 H GLY 57 24.367 17.602 -8.312 432 1HA GLY 57 1HA GLY 57 25.996 18.571 -10.491 433 2HA GLY 57 2HA GLY 57 24.607 19.419 -9.805 434 H ALA 58 H ALA 58 24.900 16.292 -11.530 435 HA ALA 58 HA ALA 58 22.451 16.610 -12.985 436 1HB ALA 58 1HB ALA 58 24.976 17.330 -14.506 437 2HB ALA 58 3HB ALA 58 23.398 17.064 -15.248 438 3HB ALA 58 2HB ALA 58 23.638 18.417 -14.143 No H/Q in entry = 438 Start of MODEL 3 1 H1 ARG 1 1H ARG 1 29.159 15.381 -11.721 2 H2 ARG 1 3H ARG 1 27.660 14.597 -11.890 3 H3 ARG 1 2H ARG 1 28.033 15.399 -10.435 4 HA ARG 1 HA ARG 1 28.865 13.534 -9.615 5 1HB ARG 1 2HB ARG 1 28.835 11.461 -11.042 6 2HB ARG 1 1HB ARG 1 27.299 12.329 -11.019 7 1HG ARG 1 2HG ARG 1 27.835 13.397 -13.163 8 2HG ARG 1 1HG ARG 1 29.418 12.631 -13.175 9 1HD ARG 1 2HD ARG 1 28.573 10.753 -14.069 10 2HD ARG 1 1HD ARG 1 27.338 10.640 -12.816 11 HE ARG 1 HE ARG 1 26.918 11.510 -15.515 12 1HH1 ARG 1 1HH1 ARG 1 25.351 13.006 -16.126 13 2HH1 ARG 1 2HH1 ARG 1 24.439 13.857 -14.904 14 1HH2 ARG 1 1HH2 ARG 1 26.020 12.289 -12.294 15 2HH2 ARG 1 2HH2 ARG 1 24.797 13.447 -12.771 16 HA PRO 2 HA PRO 2 33.001 14.514 -11.799 17 1HB PRO 2 2HB PRO 2 33.707 15.643 -9.148 18 2HB PRO 2 1HB PRO 2 33.944 16.332 -10.766 19 1HG PRO 2 2HG PRO 2 32.104 17.304 -9.098 20 2HG PRO 2 1HG PRO 2 31.824 17.222 -10.847 21 1HD PRO 2 1HD PRO 2 30.776 15.405 -8.688 22 2HD PRO 2 2HD PRO 2 29.944 16.042 -10.123 23 H ASP 3 H ASP 3 35.193 14.314 -9.792 24 HA ASP 3 HA ASP 3 35.519 11.484 -9.763 25 1HB ASP 3 2HB ASP 3 37.336 11.933 -8.017 26 2HB ASP 3 1HB ASP 3 37.527 12.753 -9.585 27 H PHE 4 H PHE 4 34.901 13.589 -6.944 28 HA PHE 4 HA PHE 4 34.478 11.465 -5.126 29 1HB PHE 4 2HB PHE 4 33.234 13.293 -3.782 30 2HB PHE 4 1HB PHE 4 34.937 13.602 -4.168 31 HD1 PHE 4 HD1 PHE 4 31.443 14.577 -4.762 32 HD2 PHE 4 HD2 PHE 4 35.506 15.208 -5.996 33 HE1 PHE 4 HE1 PHE 4 30.764 16.649 -5.943 34 HE2 PHE 4 HE2 PHE 4 34.832 17.276 -7.186 35 HZ PHE 4 HZ PHE 4 32.455 18.004 -7.157 36 H CYS 5 H CYS 5 33.141 10.640 -7.299 37 HA CYS 5 HA CYS 5 30.328 10.415 -6.355 38 1HB CYS 5 2HB CYS 5 31.155 11.239 -9.159 39 2HB CYS 5 1HB CYS 5 29.514 10.822 -8.678 40 H LEU 6 H LEU 6 33.111 8.944 -7.233 41 HA LEU 6 HA LEU 6 31.777 6.729 -8.707 42 1HB LEU 6 2HB LEU 6 34.655 7.617 -8.522 43 2HB LEU 6 1HB LEU 6 34.193 6.061 -9.215 44 HG LEU 6 HG LEU 6 32.493 8.132 -10.287 45 1HD1 LEU 6 2HD1 LEU 6 34.428 9.609 -9.761 46 2HD1 LEU 6 1HD1 LEU 6 35.459 8.559 -10.738 47 3HD1 LEU 6 3HD1 LEU 6 34.141 9.456 -11.493 48 1HD2 LEU 6 1HD2 LEU 6 32.962 5.922 -11.303 49 2HD2 LEU 6 3HD2 LEU 6 33.331 7.241 -12.414 50 3HD2 LEU 6 2HD2 LEU 6 34.638 6.410 -11.568 51 H GLU 7 H GLU 7 34.276 7.084 -6.102 52 HA GLU 7 HA GLU 7 34.281 4.364 -5.348 53 1HB GLU 7 2HB GLU 7 34.684 5.437 -2.925 54 2HB GLU 7 1HB GLU 7 35.924 5.476 -4.173 55 1HG GLU 7 2HG GLU 7 35.839 7.735 -4.320 56 2HG GLU 7 1HG GLU 7 34.075 7.741 -4.379 57 HA PRO 8 HA PRO 8 30.020 3.952 -4.123 58 1HB PRO 8 2HB PRO 8 30.163 1.391 -3.147 59 2HB PRO 8 1HB PRO 8 30.192 1.777 -4.879 60 1HG PRO 8 2HG PRO 8 32.460 1.151 -3.039 61 2HG PRO 8 1HG PRO 8 32.159 0.568 -4.691 62 1HD PRO 8 1HD PRO 8 33.907 2.599 -4.159 63 2HD PRO 8 2HD PRO 8 32.965 2.534 -5.667 64 HA PRO 9 HA PRO 9 29.360 4.864 0.182 65 1HB PRO 9 2HB PRO 9 27.829 2.472 0.824 66 2HB PRO 9 1HB PRO 9 27.262 4.134 0.602 67 1HG PRO 9 2HG PRO 9 27.078 1.897 -1.202 68 2HG PRO 9 1HG PRO 9 26.352 3.502 -1.340 69 1HD PRO 9 1HD PRO 9 28.417 2.503 -2.934 70 2HD PRO 9 2HD PRO 9 27.976 4.213 -2.790 71 H TYR 10 H TYR 10 30.561 4.404 2.096 72 HA TYR 10 HA TYR 10 31.701 1.696 2.563 73 1HB TYR 10 2HB TYR 10 33.242 3.291 1.296 74 2HB TYR 10 1HB TYR 10 33.258 4.326 2.713 75 HD1 TYR 10 HD1 TYR 10 34.661 1.420 1.111 76 HD2 TYR 10 HD2 TYR 10 34.142 3.333 4.920 77 HE1 TYR 10 HE1 TYR 10 36.583 0.144 2.013 78 HE2 TYR 10 HE2 TYR 10 36.058 2.042 5.824 79 HH TYR 10 HH TYR 10 37.656 -0.456 3.913 80 H THR 11 H THR 11 30.765 1.249 4.500 81 HA THR 11 HA THR 11 29.996 3.299 6.431 82 HB THR 11 HB THR 11 29.700 0.281 6.343 83 HG1 THR 11 HG1 THR 11 27.722 2.314 6.342 84 1HG2 THR 11 1HG2 THR 11 29.954 1.194 8.685 85 2HG2 THR 11 3HG2 THR 11 28.524 2.175 8.378 86 3HG2 THR 11 2HG2 THR 11 28.406 0.418 8.360 87 H GLY 12 H GLY 12 32.440 0.801 6.038 88 1HA GLY 12 1HA GLY 12 34.071 1.994 8.164 89 2HA GLY 12 2HA GLY 12 34.543 0.650 7.129 90 HA PRO 13 HA PRO 13 33.963 -2.139 10.476 91 1HB PRO 13 2HB PRO 13 35.667 -1.264 12.487 92 2HB PRO 13 1HB PRO 13 36.159 -2.219 11.079 93 1HG PRO 13 2HG PRO 13 36.445 0.680 11.592 94 2HG PRO 13 1HG PRO 13 37.487 -0.417 10.673 95 1HD PRO 13 1HD PRO 13 35.765 1.379 9.498 96 2HD PRO 13 2HD PRO 13 36.290 -0.121 8.721 97 H CYS 14 H CYS 14 34.027 1.160 11.850 98 HA CYS 14 HA CYS 14 32.541 0.538 14.210 99 1HB CYS 14 2HB CYS 14 32.531 3.171 12.706 100 2HB CYS 14 1HB CYS 14 32.180 2.928 14.417 101 H LYS 15 H LYS 15 30.282 1.130 14.676 102 HA LYS 15 HA LYS 15 28.545 1.146 12.301 103 1HB LYS 15 2HB LYS 15 28.163 -0.640 14.716 104 2HB LYS 15 1HB LYS 15 27.032 -0.502 13.368 105 1HG LYS 15 2HG LYS 15 29.929 -1.320 13.012 106 2HG LYS 15 1HG LYS 15 28.623 -2.482 13.243 107 1HD LYS 15 2HD LYS 15 27.610 -1.957 11.195 108 2HD LYS 15 1HD LYS 15 28.383 -0.376 11.104 109 1HE LYS 15 2HE LYS 15 29.822 -3.035 10.847 110 2HE LYS 15 1HE LYS 15 29.393 -1.975 9.501 111 1HZ LYS 15 3HZ LYS 15 30.649 -0.243 11.086 112 2HZ LYS 15 2HZ LYS 15 31.484 -1.671 11.529 113 3HZ LYS 15 1HZ LYS 15 31.466 -1.146 9.892 114 H ALA 16 H ALA 16 29.353 3.282 13.997 115 HA ALA 16 HA ALA 16 27.450 3.862 16.012 116 1HB ALA 16 1HB ALA 16 29.519 5.207 15.748 117 2HB ALA 16 2HB ALA 16 28.086 6.236 15.707 118 3HB ALA 16 3HB ALA 16 28.905 5.803 14.202 119 H ARG 17 H ARG 17 25.421 4.119 15.877 120 HA ARG 17 HA ARG 17 23.889 3.947 13.558 121 1HB ARG 17 2HB ARG 17 23.372 4.737 16.360 122 2HB ARG 17 1HB ARG 17 22.162 5.256 15.187 123 1HG ARG 17 2HG ARG 17 21.298 3.185 15.287 124 2HG ARG 17 1HG ARG 17 22.751 2.610 14.476 125 1HD ARG 17 2HD ARG 17 23.854 2.450 16.732 126 2HD ARG 17 1HD ARG 17 22.297 2.816 17.471 127 HE ARG 17 HE ARG 17 23.172 0.255 16.482 128 1HH1 ARG 17 1HH1 ARG 17 21.755 -1.381 15.928 129 2HH1 ARG 17 2HH1 ARG 17 20.076 -1.023 15.727 130 1HH2 ARG 17 1HH2 ARG 17 20.438 2.329 16.459 131 2HH2 ARG 17 2HH2 ARG 17 19.330 1.078 16.022 132 H ILE 18 H ILE 18 25.762 5.841 12.806 133 HA ILE 18 HA ILE 18 24.356 8.449 12.815 134 HB ILE 18 HB ILE 18 27.082 7.755 11.650 135 1HG1 ILE 18 2HG1 ILE 18 26.358 9.087 14.289 136 2HG1 ILE 18 1HG1 ILE 18 26.995 7.452 14.115 137 1HG2 ILE 18 3HG2 ILE 18 25.945 9.754 10.682 138 2HG2 ILE 18 2HG2 ILE 18 25.766 10.418 12.307 139 3HG2 ILE 18 1HG2 ILE 18 27.374 10.195 11.616 140 1HD1 ILE 18 2HD1 ILE 18 29.007 8.400 12.978 141 2HD1 ILE 18 1HD1 ILE 18 28.391 10.022 13.302 142 3HD1 ILE 18 3HD1 ILE 18 28.838 8.963 14.641 143 H ILE 19 H ILE 19 22.721 8.320 11.396 144 HA ILE 19 HA ILE 19 22.935 7.032 8.794 145 HB ILE 19 HB ILE 19 20.841 9.123 9.184 146 1HG1 ILE 19 2HG1 ILE 19 21.006 8.111 11.462 147 2HG1 ILE 19 1HG1 ILE 19 19.494 7.694 10.661 148 1HG2 ILE 19 2HG2 ILE 19 21.201 6.470 7.887 149 2HG2 ILE 19 1HG2 ILE 19 19.579 6.837 8.479 150 3HG2 ILE 19 3HG2 ILE 19 20.354 7.906 7.310 151 1HD1 ILE 19 1HD1 ILE 19 20.665 5.552 9.878 152 2HD1 ILE 19 3HD1 ILE 19 21.929 5.944 11.042 153 3HD1 ILE 19 2HD1 ILE 19 20.283 5.653 11.598 154 H ARG 20 H ARG 20 23.389 7.983 6.835 155 HA ARG 20 HA ARG 20 23.839 10.916 6.722 156 1HB ARG 20 2HB ARG 20 25.940 8.879 5.909 157 2HB ARG 20 1HB ARG 20 26.067 10.620 5.693 158 1HG ARG 20 2HG ARG 20 25.606 9.497 8.446 159 2HG ARG 20 1HG ARG 20 27.222 9.475 7.760 160 1HD ARG 20 2HD ARG 20 25.483 11.932 8.097 161 2HD ARG 20 1HD ARG 20 26.880 11.509 9.086 162 HE ARG 20 HE ARG 20 27.834 11.510 6.454 163 1HH1 ARG 20 1HH1 ARG 20 28.776 13.260 5.510 164 2HH1 ARG 20 2HH1 ARG 20 28.401 14.856 6.077 165 1HH2 ARG 20 1HH2 ARG 20 26.207 13.738 8.505 166 2HH2 ARG 20 2HH2 ARG 20 26.973 15.121 7.811 167 H TYR 21 H TYR 21 24.520 11.459 4.344 168 HA TYR 21 HA TYR 21 22.782 9.856 2.485 169 1HB TYR 21 2HB TYR 21 23.585 12.779 2.439 170 2HB TYR 21 1HB TYR 21 22.686 11.982 1.149 171 HD1 TYR 21 HD1 TYR 21 22.614 12.624 4.816 172 HD2 TYR 21 HD2 TYR 21 20.347 11.808 1.284 173 HE1 TYR 21 HE1 TYR 21 20.524 12.982 6.075 174 HE2 TYR 21 HE2 TYR 21 18.250 12.192 2.542 175 HH TYR 21 HH TYR 21 17.735 11.981 5.349 176 H PHE 22 H PHE 22 23.628 9.604 0.251 177 HA PHE 22 HA PHE 22 26.505 10.283 -0.175 178 1HB PHE 22 2HB PHE 22 27.266 8.084 -0.483 179 2HB PHE 22 1HB PHE 22 26.210 7.929 0.916 180 HD1 PHE 22 HD1 PHE 22 26.906 6.684 -2.340 181 HD2 PHE 22 HD2 PHE 22 23.690 7.428 0.404 182 HE1 PHE 22 HE1 PHE 22 25.475 5.083 -3.597 183 HE2 PHE 22 HE2 PHE 22 22.257 5.836 -0.834 184 HZ PHE 22 HZ PHE 22 23.140 4.667 -2.846 185 H TYR 23 H TYR 23 27.167 9.476 -2.502 186 HA TYR 23 HA TYR 23 24.910 10.234 -4.356 187 1HB TYR 23 2HB TYR 23 26.963 11.514 -4.634 188 2HB TYR 23 1HB TYR 23 27.914 10.037 -4.731 189 HD1 TYR 23 HD1 TYR 23 28.489 9.262 -6.844 190 HD2 TYR 23 HD2 TYR 23 24.893 11.567 -6.389 191 HE1 TYR 23 HE1 TYR 23 28.141 9.207 -9.302 192 HE2 TYR 23 HE2 TYR 23 24.547 11.503 -8.849 193 HH TYR 23 HH TYR 23 25.936 9.439 -10.860 194 H ASN 24 H ASN 24 23.850 8.485 -5.326 195 HA ASN 24 HA ASN 24 25.179 5.851 -5.355 196 1HB ASN 24 2HB ASN 24 22.756 6.086 -4.729 197 2HB ASN 24 1HB ASN 24 22.408 6.559 -6.391 198 1HD2 ASN 24 1HD2 ASN 24 21.372 4.142 -5.099 199 2HD2 ASN 24 2HD2 ASN 24 22.008 2.817 -5.960 200 H ALA 25 H ALA 25 26.803 6.016 -6.893 201 HA ALA 25 HA ALA 25 26.372 7.200 -9.491 202 1HB ALA 25 2HB ALA 25 28.623 6.928 -8.403 203 2HB ALA 25 3HB ALA 25 28.571 6.319 -10.054 204 3HB ALA 25 1HB ALA 25 28.520 5.192 -8.701 205 H LYS 26 H LYS 26 25.271 4.235 -8.197 206 HA LYS 26 HA LYS 26 25.579 2.542 -10.534 207 1HB LYS 26 2HB LYS 26 24.698 2.210 -7.891 208 2HB LYS 26 1HB LYS 26 23.275 1.876 -8.878 209 1HG LYS 26 2HG LYS 26 25.979 0.682 -9.516 210 2HG LYS 26 1HG LYS 26 24.845 -0.107 -8.416 211 1HD LYS 26 2HD LYS 26 23.131 -0.139 -10.170 212 2HD LYS 26 1HD LYS 26 24.218 0.706 -11.270 213 1HE LYS 26 2HE LYS 26 25.790 -1.175 -11.191 214 2HE LYS 26 1HE LYS 26 24.732 -2.024 -10.059 215 1HZ LYS 26 3HZ LYS 26 22.968 -1.921 -11.754 216 2HZ LYS 26 2HZ LYS 26 24.068 -1.221 -12.845 217 3HZ LYS 26 1HZ LYS 26 24.315 -2.810 -12.283 218 H ALA 27 H ALA 27 23.244 4.982 -9.572 219 HA ALA 27 HA ALA 27 21.689 4.429 -12.097 220 1HB ALA 27 1HB ALA 27 20.276 3.778 -10.230 221 2HB ALA 27 2HB ALA 27 19.673 5.299 -10.885 222 3HB ALA 27 3HB ALA 27 20.612 5.293 -9.390 223 H GLY 28 H GLY 28 23.396 6.734 -10.141 224 1HA GLY 28 1HA GLY 28 22.939 8.788 -12.264 225 2HA GLY 28 2HA GLY 28 24.150 8.833 -10.986 226 H LEU 29 H LEU 29 22.595 8.401 -8.741 227 HA LEU 29 HA LEU 29 21.369 11.054 -8.437 228 1HB LEU 29 2HB LEU 29 19.665 8.970 -9.163 229 2HB LEU 29 1HB LEU 29 19.515 9.028 -7.414 230 HG LEU 29 HG LEU 29 19.265 11.595 -7.742 231 1HD1 LEU 29 1HD1 LEU 29 19.035 10.508 -10.530 232 2HD1 LEU 29 3HD1 LEU 29 18.006 11.860 -10.059 233 3HD1 LEU 29 2HD1 LEU 29 19.760 12.018 -9.976 234 1HD2 LEU 29 3HD2 LEU 29 17.466 9.979 -7.057 235 2HD2 LEU 29 2HD2 LEU 29 16.861 11.340 -8.005 236 3HD2 LEU 29 1HD2 LEU 29 17.075 9.762 -8.764 237 H CYS 30 H CYS 30 21.165 11.581 -6.185 238 HA CYS 30 HA CYS 30 23.007 10.117 -4.474 239 1HB CYS 30 2HB CYS 30 21.213 12.484 -3.855 240 2HB CYS 30 1HB CYS 30 22.440 11.839 -2.763 241 H GLN 31 H GLN 31 22.400 9.294 -2.314 242 HA GLN 31 HA GLN 31 19.547 8.704 -1.868 243 1HB GLN 31 2HB GLN 31 21.463 6.700 -2.916 244 2HB GLN 31 1HB GLN 31 20.489 6.165 -1.546 245 1HG GLN 31 2HG GLN 31 18.570 6.127 -2.767 246 2HG GLN 31 1HG GLN 31 18.956 7.636 -3.592 247 1HE2 GLN 31 1HE2 GLN 31 19.376 7.370 -5.785 248 2HE2 GLN 31 2HE2 GLN 31 19.974 5.952 -6.499 249 H THR 32 H THR 32 19.584 7.058 0.131 250 HA THR 32 HA THR 32 21.148 8.413 2.266 251 HB THR 32 HB THR 32 19.430 7.333 3.751 252 HG1 THR 32 HG1 THR 32 17.701 6.335 2.746 253 1HG2 THR 32 3HG2 THR 32 19.228 9.595 2.214 254 2HG2 THR 32 2HG2 THR 32 17.764 8.723 1.753 255 3HG2 THR 32 1HG2 THR 32 18.057 9.125 3.447 256 H PHE 33 H PHE 33 22.067 7.130 4.022 257 HA PHE 33 HA PHE 33 22.228 4.248 3.793 258 1HB PHE 33 2HB PHE 33 24.400 3.926 3.084 259 2HB PHE 33 1HB PHE 33 23.819 5.208 2.030 260 HD1 PHE 33 HD1 PHE 33 26.346 4.234 4.345 261 HD2 PHE 33 HD2 PHE 33 24.268 7.650 2.788 262 HE1 PHE 33 HE1 PHE 33 28.285 5.666 4.921 263 HE2 PHE 33 HE2 PHE 33 26.194 9.089 3.399 264 HZ PHE 33 HZ PHE 33 28.209 8.099 4.439 265 H VAL 34 H VAL 34 24.441 3.656 5.239 266 HA VAL 34 HA VAL 34 24.100 5.275 7.785 267 HB VAL 34 HB VAL 34 24.419 2.282 7.432 268 1HG1 VAL 34 3HG1 VAL 34 24.428 3.994 9.940 269 2HG1 VAL 34 2HG1 VAL 34 24.347 2.233 9.928 270 3HG1 VAL 34 1HG1 VAL 34 25.784 3.053 9.318 271 1HG2 VAL 34 2HG2 VAL 34 22.125 3.716 7.327 272 2HG2 VAL 34 1HG2 VAL 34 22.201 2.111 8.061 273 3HG2 VAL 34 3HG2 VAL 34 22.272 3.551 9.080 274 H TYR 35 H TYR 35 25.998 6.089 8.614 275 HA TYR 35 HA TYR 35 28.576 5.106 7.469 276 1HB TYR 35 2HB TYR 35 28.289 7.519 7.440 277 2HB TYR 35 1HB TYR 35 27.876 7.533 9.152 278 HD1 TYR 35 HD1 TYR 35 30.628 5.535 7.565 279 HD2 TYR 35 HD2 TYR 35 29.624 8.931 9.994 280 HE1 TYR 35 HE1 TYR 35 33.015 5.835 8.115 281 HE2 TYR 35 HE2 TYR 35 32.030 9.238 10.530 282 HH TYR 35 HH TYR 35 34.084 8.110 10.524 283 H GLY 36 H GLY 36 30.124 4.108 8.797 284 1HA GLY 36 1HA GLY 36 30.786 2.758 10.600 285 2HA GLY 36 2HA GLY 36 29.182 2.967 11.302 286 H GLY 37 H GLY 37 31.444 5.555 10.384 287 1HA GLY 37 1HA GLY 37 31.773 6.247 13.326 288 2HA GLY 37 2HA GLY 37 31.471 7.488 12.114 289 H CYS 38 H CYS 38 33.486 4.736 11.325 290 HA CYS 38 HA CYS 38 35.900 6.562 11.422 291 1HB CYS 38 2HB CYS 38 37.229 4.523 12.034 292 2HB CYS 38 1HB CYS 38 36.059 4.994 13.267 293 H ARG 39 H ARG 39 37.424 6.280 9.788 294 HA ARG 39 HA ARG 39 38.198 5.793 7.722 295 1HB ARG 39 2HB ARG 39 36.957 3.167 8.448 296 2HB ARG 39 1HB ARG 39 37.807 3.388 6.920 297 1HG ARG 39 2HG ARG 39 39.544 4.509 8.770 298 2HG ARG 39 1HG ARG 39 38.895 3.111 9.627 299 1HD ARG 39 2HD ARG 39 39.598 1.611 7.914 300 2HD ARG 39 1HD ARG 39 39.934 2.934 6.793 301 HE ARG 39 HE ARG 39 41.590 3.425 8.987 302 1HH1 ARG 39 1HH1 ARG 39 43.677 2.641 9.143 303 2HH1 ARG 39 2HH1 ARG 39 44.141 1.254 8.221 304 1HH2 ARG 39 1HH2 ARG 39 41.031 0.875 6.766 305 2HH2 ARG 39 2HH2 ARG 39 42.640 0.252 6.874 306 H ALA 40 H ALA 40 36.056 7.371 7.525 307 HA ALA 40 HA ALA 40 33.977 6.237 5.801 308 1HB ALA 40 2HB ALA 40 33.951 8.360 7.394 309 2HB ALA 40 1HB ALA 40 34.537 9.191 5.953 310 3HB ALA 40 3HB ALA 40 32.989 8.343 5.918 311 H LYS 41 H LYS 41 33.687 7.775 3.646 312 HA LYS 41 HA LYS 41 36.332 7.950 2.249 313 1HB LYS 41 2HB LYS 41 33.829 6.663 1.109 314 2HB LYS 41 1HB LYS 41 35.368 6.850 0.267 315 1HG LYS 41 2HG LYS 41 34.997 5.305 2.856 316 2HG LYS 41 1HG LYS 41 35.070 4.566 1.256 317 1HD LYS 41 2HD LYS 41 37.338 5.146 0.956 318 2HD LYS 41 1HD LYS 41 37.293 6.370 2.221 319 1HE LYS 41 2HE LYS 41 36.751 3.496 2.922 320 2HE LYS 41 1HE LYS 41 38.413 4.043 2.713 321 1HZ LYS 41 1HZ LYS 41 37.132 5.971 4.275 322 2HZ LYS 41 3HZ LYS 41 36.672 4.456 4.936 323 3HZ LYS 41 2HZ LYS 41 38.326 4.853 4.764 324 H ARG 42 H ARG 42 35.631 8.875 -0.221 325 HA ARG 42 HA ARG 42 34.909 11.614 0.351 326 1HB ARG 42 2HB ARG 42 35.454 10.091 -2.191 327 2HB ARG 42 1HB ARG 42 34.683 11.666 -2.283 328 1HG ARG 42 2HG ARG 42 36.591 12.435 -0.670 329 2HG ARG 42 1HG ARG 42 37.414 10.976 -1.215 330 1HD ARG 42 2HD ARG 42 37.237 11.725 -3.549 331 2HD ARG 42 1HD ARG 42 36.363 13.175 -3.045 332 HE ARG 42 HE ARG 42 38.750 13.178 -1.557 333 1HH1 ARG 42 1HH1 ARG 42 40.629 14.180 -2.257 334 2HH1 ARG 42 2HH1 ARG 42 40.834 14.519 -3.941 335 1HH2 ARG 42 1HH2 ARG 42 37.798 13.188 -4.856 336 2HH2 ARG 42 2HH2 ARG 42 39.236 13.961 -5.408 337 H ASN 43 H ASN 43 33.175 8.973 -1.290 338 HA ASN 43 HA ASN 43 30.802 10.470 -1.933 339 1HB ASN 43 2HB ASN 43 31.622 7.926 -2.415 340 2HB ASN 43 1HB ASN 43 30.548 7.614 -1.057 341 1HD2 ASN 43 1HD2 ASN 43 30.292 7.010 -4.019 342 2HD2 ASN 43 2HD2 ASN 43 28.773 7.665 -4.453 343 H ASN 44 H ASN 44 30.469 11.799 0.028 344 HA ASN 44 HA ASN 44 28.895 10.424 2.104 345 1HB ASN 44 2HB ASN 44 31.372 10.172 2.760 346 2HB ASN 44 1HB ASN 44 31.389 11.919 2.988 347 1HD2 ASN 44 1HD2 ASN 44 30.963 9.076 4.697 348 2HD2 ASN 44 2HD2 ASN 44 29.996 9.674 5.959 349 H PHE 45 H PHE 45 27.296 11.813 2.706 350 HA PHE 45 HA PHE 45 27.803 14.737 2.736 351 1HB PHE 45 2HB PHE 45 25.579 13.391 1.181 352 2HB PHE 45 1HB PHE 45 25.668 15.126 1.483 353 HD1 PHE 45 HD1 PHE 45 26.842 12.408 -0.568 354 HD2 PHE 45 HD2 PHE 45 27.738 16.387 0.750 355 HE1 PHE 45 HE1 PHE 45 28.465 12.672 -2.445 356 HE2 PHE 45 HE2 PHE 45 29.343 16.650 -1.107 357 HZ PHE 45 HZ PHE 45 29.708 14.795 -2.702 358 H LYS 46 H LYS 46 25.829 15.896 3.761 359 HA LYS 46 HA LYS 46 24.850 14.137 5.961 360 1HB LYS 46 2HB LYS 46 24.635 16.118 7.308 361 2HB LYS 46 1HB LYS 46 26.207 16.207 6.516 362 1HG LYS 46 2HG LYS 46 25.277 17.689 4.788 363 2HG LYS 46 1HG LYS 46 23.684 17.578 5.533 364 1HD LYS 46 2HD LYS 46 24.219 19.310 6.865 365 2HD LYS 46 1HD LYS 46 25.475 18.317 7.604 366 1HE LYS 46 2HE LYS 46 26.014 19.659 4.966 367 2HE LYS 46 1HE LYS 46 26.127 20.596 6.458 368 1HZ LYS 46 2HZ LYS 46 27.476 17.981 6.181 369 2HZ LYS 46 1HZ LYS 46 28.216 19.411 5.636 370 3HZ LYS 46 3HZ LYS 46 27.815 19.237 7.278 371 H SER 47 H SER 47 23.811 16.077 3.286 372 HA SER 47 HA SER 47 20.988 15.271 3.855 373 1HB SER 47 2HB SER 47 20.121 17.424 3.592 374 2HB SER 47 1HB SER 47 21.642 17.819 4.384 375 HG SER 47 HG SER 47 22.166 18.879 2.631 376 H ALA 48 H ALA 48 19.697 15.158 1.909 377 HA ALA 48 HA ALA 48 21.128 14.143 -0.385 378 1HB ALA 48 3HB ALA 48 18.779 13.494 0.236 379 2HB ALA 48 2HB ALA 48 18.248 15.106 -0.246 380 3HB ALA 48 1HB ALA 48 18.931 14.005 -1.445 381 H GLU 49 H GLU 49 19.631 17.224 0.443 382 HA GLU 49 HA GLU 49 19.884 18.577 -2.026 383 1HB GLU 49 2HB GLU 49 20.372 19.710 0.735 384 2HB GLU 49 1HB GLU 49 19.965 20.643 -0.697 385 1HG GLU 49 2HG GLU 49 18.096 20.132 0.989 386 2HG GLU 49 1HG GLU 49 17.734 19.878 -0.672 387 H ASP 50 H ASP 50 22.142 18.267 0.675 388 HA ASP 50 HA ASP 50 24.350 19.647 -0.370 389 1HB ASP 50 2HB ASP 50 24.017 17.378 1.549 390 2HB ASP 50 1HB ASP 50 25.642 17.807 1.035 391 H CYS 51 H CYS 51 23.810 16.115 -0.575 392 HA CYS 51 HA CYS 51 26.049 15.565 -2.246 393 1HB CYS 51 2HB CYS 51 24.904 13.788 -1.096 394 2HB CYS 51 1HB CYS 51 23.402 14.123 -1.955 395 H MET 52 H MET 52 22.693 16.393 -3.142 396 HA MET 52 HA MET 52 23.008 15.918 -5.964 397 1HB MET 52 2HB MET 52 21.095 17.627 -4.356 398 2HB MET 52 1HB MET 52 20.986 17.476 -6.111 399 1HG MET 52 2HG MET 52 20.907 15.169 -4.139 400 2HG MET 52 1HG MET 52 19.513 15.835 -4.992 401 1HE MET 52 2HE MET 52 19.373 16.000 -7.606 402 2HE MET 52 1HE MET 52 19.449 14.392 -8.327 403 3HE MET 52 3HE MET 52 18.575 14.644 -6.809 404 H ARG 53 H ARG 53 23.225 18.905 -4.030 405 HA ARG 53 HA ARG 53 23.925 20.603 -6.260 406 1HB ARG 53 2HB ARG 53 23.109 21.932 -4.597 407 2HB ARG 53 1HB ARG 53 23.624 20.827 -3.328 408 1HG ARG 53 2HG ARG 53 25.695 22.432 -4.815 409 2HG ARG 53 1HG ARG 53 24.756 23.193 -3.534 410 1HD ARG 53 2HD ARG 53 25.993 20.521 -2.995 411 2HD ARG 53 1HD ARG 53 27.029 21.947 -2.960 412 HE ARG 53 HE ARG 53 24.843 22.633 -1.386 413 1HH1 ARG 53 1HH1 ARG 53 24.734 22.263 0.822 414 2HH1 ARG 53 2HH1 ARG 53 25.700 21.000 1.533 415 1HH2 ARG 53 1HH2 ARG 53 27.173 20.059 -1.451 416 2HH2 ARG 53 2HH2 ARG 53 27.045 19.791 0.268 417 H THR 54 H THR 54 25.816 18.506 -4.183 418 HA THR 54 HA THR 54 28.294 19.872 -5.044 419 HB THR 54 HB THR 54 28.327 17.507 -3.198 420 HG1 THR 54 HG1 THR 54 26.665 18.725 -2.335 421 1HG2 THR 54 1HG2 THR 54 30.414 18.676 -3.952 422 2HG2 THR 54 3HG2 THR 54 29.812 20.156 -3.200 423 3HG2 THR 54 2HG2 THR 54 30.174 18.745 -2.206 424 H CYS 55 H CYS 55 27.282 16.426 -4.823 425 HA CYS 55 HA CYS 55 29.287 15.761 -6.927 426 1HB CYS 55 2HB CYS 55 29.332 14.210 -5.141 427 2HB CYS 55 1HB CYS 55 27.574 14.145 -5.026 428 H GLY 56 H GLY 56 25.805 15.481 -6.245 429 1HA GLY 56 1HA GLY 56 23.993 15.314 -7.777 430 2HA GLY 56 2HA GLY 56 25.063 14.224 -8.682 431 H GLY 57 H GLY 57 24.321 17.699 -8.150 432 1HA GLY 57 1HA GLY 57 25.912 18.688 -10.352 433 2HA GLY 57 2HA GLY 57 24.541 19.538 -9.621 434 H ALA 58 H ALA 58 24.763 16.422 -11.369 435 HA ALA 58 HA ALA 58 22.289 16.735 -12.760 436 1HB ALA 58 1HB ALA 58 24.759 17.539 -14.326 437 2HB ALA 58 3HB ALA 58 23.178 17.232 -15.045 438 3HB ALA 58 2HB ALA 58 23.394 18.580 -13.928 No H/Q in entry = 438
Contact the webmaster for help, if required. Friday, July 5, 2024 2:37:57 AM GMT (wattos1)