NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
3666 | 1e0m | 4713 | cing | 1-original | 1 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name 1 H1 SER 1 H1 SER 1 9.196 10.617 -5.313 2 H2 SER 1 H2 SER 1 9.330 11.544 -6.722 3 H3 SER 1 H3 SER 1 8.663 9.991 -6.791 4 HA SER 1 HA SER 1 10.753 9.574 -7.567 5 1HB SER 1 1HB SER 1 11.417 11.974 -7.116 6 2HB SER 1 2HB SER 1 11.876 11.467 -5.491 7 HG SER 1 HG SER 1 13.129 9.782 -6.849 8 H MET 2 H MET 2 10.629 7.499 -6.870 9 HA MET 2 HA MET 2 10.923 5.644 -5.587 10 1HB MET 2 1HB MET 2 13.055 7.439 -4.424 11 2HB MET 2 2HB MET 2 12.887 5.741 -3.999 12 1HG MET 2 1HG MET 2 13.324 5.074 -6.263 13 2HG MET 2 2HG MET 2 13.329 6.755 -6.795 14 1HE MET 2 1HE MET 2 15.456 4.040 -6.664 15 2HE MET 2 2HE MET 2 16.876 4.375 -5.675 16 3HE MET 2 3HE MET 2 15.353 3.927 -4.908 17 H GLY 3 H GLY 3 8.704 6.519 -4.772 18 1HA GLY 3 1HA GLY 3 8.647 7.492 -2.066 19 2HA GLY 3 2HA GLY 3 7.259 6.986 -3.026 20 H LEU 4 H LEU 4 6.466 4.932 -2.816 21 HA LEU 4 HA LEU 4 7.115 3.531 -0.417 22 1HB LEU 4 1HB LEU 4 5.514 2.231 -2.551 23 2HB LEU 4 2HB LEU 4 5.229 2.288 -0.823 24 HG LEU 4 HG LEU 4 4.941 4.848 -2.289 25 1HD1 LEU 4 1HD1 LEU 4 3.849 2.707 -3.522 26 2HD1 LEU 4 2HD1 LEU 4 2.555 3.131 -2.399 27 3HD1 LEU 4 3HD1 LEU 4 3.150 4.327 -3.551 28 1HD2 LEU 4 1HD2 LEU 4 4.508 4.248 0.217 29 2HD2 LEU 4 2HD2 LEU 4 3.416 5.335 -0.640 30 3HD2 LEU 4 3HD2 LEU 4 2.971 3.645 -0.402 31 HA PRO 5 HA PRO 5 10.215 0.593 -1.548 32 1HB PRO 5 1HB PRO 5 9.927 -1.321 -0.285 33 2HB PRO 5 2HB PRO 5 8.231 -1.500 -0.752 34 1HG PRO 5 1HG PRO 5 7.996 -0.629 1.398 35 2HG PRO 5 2HG PRO 5 9.463 0.357 1.252 36 1HD PRO 5 1HD PRO 5 7.941 2.019 0.806 37 2HD PRO 5 2HD PRO 5 6.717 0.876 0.220 38 HA PRO 6 HA PRO 6 9.443 -0.932 -5.608 39 1HB PRO 6 1HB PRO 6 10.779 -3.338 -5.620 40 2HB PRO 6 2HB PRO 6 11.553 -1.761 -5.799 41 1HG PRO 6 1HG PRO 6 11.285 -3.477 -3.365 42 2HG PRO 6 2HG PRO 6 12.680 -2.536 -3.925 43 1HD PRO 6 1HD PRO 6 11.096 -1.656 -1.946 44 2HD PRO 6 2HD PRO 6 11.812 -0.539 -3.127 45 H GLY 7 H GLY 7 8.019 -2.373 -2.987 46 1HA GLY 7 1HA GLY 7 6.480 -4.177 -4.746 47 2HA GLY 7 2HA GLY 7 6.972 -4.673 -3.135 48 H TRP 8 H TRP 8 6.378 -1.557 -2.661 49 HA TRP 8 HA TRP 8 3.621 -2.081 -1.825 50 1HB TRP 8 1HB TRP 8 5.763 -0.181 -0.928 51 2HB TRP 8 2HB TRP 8 4.077 0.178 -0.567 52 HD1 TRP 8 HD1 TRP 8 6.966 -1.891 0.605 53 HE1 TRP 8 HE1 TRP 8 6.258 -3.299 2.626 54 HE3 TRP 8 HE3 TRP 8 1.917 -1.138 0.383 55 HZ2 TRP 8 HZ2 TRP 8 3.869 -4.006 3.963 56 HZ3 TRP 8 HZ3 TRP 8 0.489 -2.219 2.076 57 HH2 TRP 8 HH2 TRP 8 1.452 -3.615 3.826 58 H ASP 9 H ASP 9 2.020 -1.348 -3.048 59 HA ASP 9 HA ASP 9 2.439 1.143 -4.574 60 1HB ASP 9 1HB ASP 9 1.324 -1.486 -5.434 61 2HB ASP 9 2HB ASP 9 0.597 -0.029 -6.104 62 H GLU 10 H GLU 10 0.594 2.487 -4.869 63 HA GLU 10 HA GLU 10 -1.400 2.134 -2.745 64 1HB GLU 10 1HB GLU 10 -1.810 4.669 -3.606 65 2HB GLU 10 2HB GLU 10 -0.693 4.239 -2.322 66 1HG GLU 10 1HG GLU 10 1.123 4.738 -3.549 67 2HG GLU 10 2HG GLU 10 0.412 4.129 -5.045 68 H TYR 11 H TYR 11 -3.530 1.983 -3.135 69 HA TYR 11 HA TYR 11 -4.668 2.752 -5.663 70 1HB TYR 11 1HB TYR 11 -4.232 -0.106 -4.925 71 2HB TYR 11 2HB TYR 11 -5.739 0.318 -5.732 72 HD1 TYR 11 HD1 TYR 11 -5.440 1.804 -7.902 73 HD2 TYR 11 HD2 TYR 11 -2.409 -0.668 -6.229 74 HE1 TYR 11 HE1 TYR 11 -4.297 1.744 -10.078 75 HE2 TYR 11 HE2 TYR 11 -1.256 -0.734 -8.401 76 HH TYR 11 HH TYR 11 -2.600 0.915 -11.246 77 H LYS 12 H LYS 12 -6.878 3.088 -5.554 78 HA LYS 12 HA LYS 12 -7.969 3.083 -2.850 79 1HB LYS 12 1HB LYS 12 -8.612 4.520 -5.381 80 2HB LYS 12 2HB LYS 12 -9.892 4.305 -4.198 81 1HG LYS 12 1HG LYS 12 -8.442 5.372 -2.498 82 2HG LYS 12 2HG LYS 12 -7.262 5.695 -3.769 83 1HD LYS 12 1HD LYS 12 -10.066 6.571 -4.213 84 2HD LYS 12 2HD LYS 12 -9.082 7.485 -3.068 85 1HE LYS 12 1HE LYS 12 -7.338 7.285 -5.094 86 2HE LYS 12 2HE LYS 12 -8.480 8.618 -4.926 87 1HZ LYS 12 1HZ LYS 12 -9.654 6.402 -6.274 88 2HZ LYS 12 2HZ LYS 12 -9.512 8.010 -6.778 89 3HZ LYS 12 3HZ LYS 12 -8.252 6.919 -7.066 90 H THR 13 H THR 13 -9.369 1.622 -2.158 91 HA THR 13 HA THR 13 -10.290 -0.464 -3.882 92 HB THR 13 HB THR 13 -11.550 -0.218 -1.226 93 HG1 THR 13 HG1 THR 13 -9.376 0.645 -0.937 94 1HG2 THR 13 1HG2 THR 13 -11.201 -2.217 -3.028 95 2HG2 THR 13 2HG2 THR 13 -9.862 -2.521 -1.922 96 3HG2 THR 13 3HG2 THR 13 -11.515 -2.471 -1.311 97 H HIS 14 H HIS 14 -12.861 -0.918 -2.672 98 HA HIS 14 HA HIS 14 -14.532 0.303 -4.515 99 1HB HIS 14 1HB HIS 14 -16.368 -0.628 -3.286 100 2HB HIS 14 2HB HIS 14 -15.418 -0.699 -1.805 101 HD1 HIS 14 HD1 HIS 14 -14.205 -1.933 -5.157 102 HD2 HIS 14 HD2 HIS 14 -15.462 -3.432 -1.491 103 HE1 HIS 14 HE1 HIS 14 -13.706 -4.397 -5.231 104 HE2 HIS 14 HE2 HIS 14 -14.475 -5.285 -3.001 105 H ASN 15 H ASN 15 -14.631 0.963 -1.002 106 HA ASN 15 HA ASN 15 -16.204 3.252 -1.182 107 1HB ASN 15 1HB ASN 15 -15.213 3.818 1.087 108 2HB ASN 15 2HB ASN 15 -15.969 2.234 0.951 109 2HD2 ASN 15 2HD2 ASN 15 -14.819 0.484 1.441 110 1HD2 ASN 15 1HD2 ASN 15 -13.128 0.475 1.794 111 H GLY 16 H GLY 16 -12.764 2.829 -1.602 112 1HA GLY 16 1HA GLY 16 -11.696 4.465 -3.087 113 2HA GLY 16 2HA GLY 16 -12.563 5.715 -2.210 114 H LYS 17 H LYS 17 -11.203 3.110 -0.373 115 HA LYS 17 HA LYS 17 -9.440 4.958 0.962 116 1HB LYS 17 1HB LYS 17 -10.676 3.061 2.116 117 2HB LYS 17 2HB LYS 17 -8.977 3.233 2.519 118 1HG LYS 17 1HG LYS 17 -9.224 1.435 0.320 119 2HG LYS 17 2HG LYS 17 -8.600 1.145 1.943 120 1HD LYS 17 1HD LYS 17 -11.118 1.056 2.598 121 2HD LYS 17 2HD LYS 17 -11.363 0.743 0.878 122 1HE LYS 17 1HE LYS 17 -9.308 -0.961 1.524 123 2HE LYS 17 2HE LYS 17 -10.317 -1.000 2.970 124 1HZ LYS 17 1HZ LYS 17 -11.827 -1.172 0.534 125 2HZ LYS 17 2HZ LYS 17 -10.734 -2.449 0.716 126 3HZ LYS 17 3HZ LYS 17 -11.889 -2.148 1.915 127 H THR 18 H THR 18 -7.447 5.427 0.348 128 HA THR 18 HA THR 18 -6.238 4.104 -1.889 129 HB THR 18 HB THR 18 -4.696 5.946 -0.098 130 HG1 THR 18 HG1 THR 18 -5.762 7.589 -1.659 131 1HG2 THR 18 1HG2 THR 18 -4.755 5.252 -3.013 132 2HG2 THR 18 2HG2 THR 18 -4.047 6.774 -2.470 133 3HG2 THR 18 3HG2 THR 18 -3.393 5.241 -1.891 134 H TYR 19 H TYR 19 -6.290 1.958 -0.885 135 HA TYR 19 HA TYR 19 -4.557 1.467 1.348 136 1HB TYR 19 1HB TYR 19 -5.466 -0.644 1.433 137 2HB TYR 19 2HB TYR 19 -6.770 0.235 0.640 138 HD1 TYR 19 HD1 TYR 19 -7.152 -0.053 -1.790 139 HD2 TYR 19 HD2 TYR 19 -4.290 -2.394 0.316 140 HE1 TYR 19 HE1 TYR 19 -7.115 -1.668 -3.644 141 HE2 TYR 19 HE2 TYR 19 -4.245 -4.014 -1.532 142 HH TYR 19 HH TYR 19 -4.770 -4.204 -3.826 143 H TYR 20 H TYR 20 -2.585 0.635 1.381 144 HA TYR 20 HA TYR 20 -1.161 0.412 -1.164 145 1HB TYR 20 1HB TYR 20 -0.018 0.500 1.637 146 2HB TYR 20 2HB TYR 20 0.865 0.701 0.127 147 HD1 TYR 20 HD1 TYR 20 -1.603 2.280 2.381 148 HD2 TYR 20 HD2 TYR 20 0.991 2.817 -0.948 149 HE1 TYR 20 HE1 TYR 20 -1.938 4.712 2.521 150 HE2 TYR 20 HE2 TYR 20 0.662 5.252 -0.818 151 HH TYR 20 HH TYR 20 -1.395 6.781 0.204 152 H TYR 21 H TYR 21 -0.213 -1.475 -1.822 153 HA TYR 21 HA TYR 21 -0.541 -3.809 -0.058 154 1HB TYR 21 1HB TYR 21 -2.265 -3.825 -1.796 155 2HB TYR 21 2HB TYR 21 -1.030 -3.685 -3.044 156 HD1 TYR 21 HD1 TYR 21 -0.453 -5.618 -4.152 157 HD2 TYR 21 HD2 TYR 21 -1.841 -5.904 -0.141 158 HE1 TYR 21 HE1 TYR 21 -0.304 -8.069 -4.280 159 HE2 TYR 21 HE2 TYR 21 -1.695 -8.355 -0.259 160 HH TYR 21 HH TYR 21 -1.718 -10.119 -2.007 161 H ASN 22 H ASN 22 1.040 -5.333 -0.061 162 HA ASN 22 HA ASN 22 3.504 -4.658 -1.524 163 1HB ASN 22 1HB ASN 22 3.604 -4.664 0.988 164 2HB ASN 22 2HB ASN 22 3.244 -6.388 0.944 165 2HD2 ASN 22 2HD2 ASN 22 5.382 -4.264 -0.933 166 1HD2 ASN 22 1HD2 ASN 22 6.812 -5.199 -0.680 167 H HIS 23 H HIS 23 3.887 -5.906 -3.229 168 HA HIS 23 HA HIS 23 2.621 -8.504 -3.454 169 1HB HIS 23 1HB HIS 23 2.636 -8.098 -5.650 170 2HB HIS 23 2HB HIS 23 4.373 -7.828 -5.657 171 HD1 HIS 23 HD1 HIS 23 1.422 -5.782 -4.372 172 HD2 HIS 23 HD2 HIS 23 4.835 -5.391 -6.708 173 HE1 HIS 23 HE1 HIS 23 1.474 -3.372 -5.087 174 HE2 HIS 23 HE2 HIS 23 3.548 -3.156 -6.500 175 H ASN 24 H ASN 24 5.167 -7.695 -1.803 176 HA ASN 24 HA ASN 24 6.969 -9.763 -2.853 177 1HB ASN 24 1HB ASN 24 8.653 -8.799 -1.327 178 2HB ASN 24 2HB ASN 24 7.457 -7.644 -0.745 179 2HD2 ASN 24 2HD2 ASN 24 8.666 -5.885 -1.389 180 1HD2 ASN 24 1HD2 ASN 24 8.853 -5.445 -3.048 181 H THR 25 H THR 25 4.926 -8.911 -0.180 182 HA THR 25 HA THR 25 5.383 -11.566 0.985 183 HB THR 25 HB THR 25 5.522 -10.764 3.207 184 HG1 THR 25 HG1 THR 25 5.200 -8.077 2.395 185 1HG2 THR 25 1HG2 THR 25 7.184 -9.086 1.340 186 2HG2 THR 25 2HG2 THR 25 7.395 -9.046 3.091 187 3HG2 THR 25 3HG2 THR 25 7.654 -10.549 2.207 188 H LYS 26 H LYS 26 3.272 -9.803 -0.547 189 HA LYS 26 HA LYS 26 1.014 -9.615 -0.670 190 1HB LYS 26 1HB LYS 26 -0.224 -11.541 -0.243 191 2HB LYS 26 2HB LYS 26 0.727 -11.963 1.174 192 1HG LYS 26 1HG LYS 26 2.635 -12.205 -0.653 193 2HG LYS 26 2HG LYS 26 1.524 -13.520 -0.268 194 1HD LYS 26 1HD LYS 26 0.058 -12.687 -2.133 195 2HD LYS 26 2HD LYS 26 1.378 -11.607 -2.581 196 1HE LYS 26 1HE LYS 26 2.369 -14.260 -2.210 197 2HE LYS 26 2HE LYS 26 1.015 -14.285 -3.337 198 1HZ LYS 26 1HZ LYS 26 3.147 -12.283 -3.661 199 2HZ LYS 26 2HZ LYS 26 3.398 -13.864 -4.208 200 3HZ LYS 26 3HZ LYS 26 2.118 -12.948 -4.827 201 H THR 27 H THR 27 1.432 -7.660 0.705 202 HA THR 27 HA THR 27 0.023 -7.928 3.289 203 HB THR 27 HB THR 27 2.047 -5.781 2.697 204 HG1 THR 27 HG1 THR 27 2.905 -7.690 4.418 205 1HG2 THR 27 1HG2 THR 27 0.194 -5.905 4.655 206 2HG2 THR 27 2HG2 THR 27 1.529 -6.764 5.427 207 3HG2 THR 27 3HG2 THR 27 1.763 -5.117 4.838 208 H SER 28 H SER 28 -1.992 -7.201 2.971 209 HA SER 28 HA SER 28 -2.378 -4.788 1.344 210 1HB SER 28 1HB SER 28 -4.877 -5.559 1.642 211 2HB SER 28 2HB SER 28 -3.830 -6.369 0.475 212 HG SER 28 HG SER 28 -4.316 -8.106 1.540 213 H THR 29 H THR 29 -2.648 -2.927 2.344 214 HA THR 29 HA THR 29 -4.295 -2.733 4.724 215 HB THR 29 HB THR 29 -1.936 -3.218 5.532 216 HG1 THR 29 HG1 THR 29 -2.877 -2.253 7.168 217 1HG2 THR 29 1HG2 THR 29 -1.479 -0.559 4.214 218 2HG2 THR 29 2HG2 THR 29 -0.482 -1.111 5.560 219 3HG2 THR 29 3HG2 THR 29 -0.539 -2.044 4.065 220 H TRP 30 H TRP 30 -4.646 -0.395 5.331 221 HA TRP 30 HA TRP 30 -4.656 1.218 2.883 222 1HB TRP 30 1HB TRP 30 -6.042 2.570 4.963 223 2HB TRP 30 2HB TRP 30 -6.705 1.848 3.502 224 HD1 TRP 30 HD1 TRP 30 -6.990 1.646 7.131 225 HE1 TRP 30 HE1 TRP 30 -8.229 -0.496 7.845 226 HE3 TRP 30 HE3 TRP 30 -6.812 -0.890 2.711 227 HZ2 TRP 30 HZ2 TRP 30 -9.027 -2.943 6.677 228 HZ3 TRP 30 HZ3 TRP 30 -7.831 -3.128 2.585 229 HH2 TRP 30 HH2 TRP 30 -8.918 -4.130 4.529 230 H THR 31 H THR 31 -2.954 0.860 5.753 231 HA THR 31 HA THR 31 -2.254 3.620 6.167 232 HB THR 31 HB THR 31 -0.644 1.325 7.232 233 HG1 THR 31 HG1 THR 31 -2.766 0.747 7.706 234 1HG2 THR 31 1HG2 THR 31 -0.486 4.046 7.561 235 2HG2 THR 31 2HG2 THR 31 -1.391 3.534 8.986 236 3HG2 THR 31 3HG2 THR 31 0.196 2.840 8.652 237 H ASP 32 H ASP 32 -0.299 4.611 5.740 238 HA ASP 32 HA ASP 32 0.937 3.946 3.293 239 1HB ASP 32 1HB ASP 32 0.747 6.244 4.442 240 2HB ASP 32 2HB ASP 32 2.167 5.757 5.363 241 HA PRO 33 HA PRO 33 3.830 0.908 4.810 242 1HB PRO 33 1HB PRO 33 5.311 0.670 2.544 243 2HB PRO 33 2HB PRO 33 3.714 -0.056 2.732 244 1HG PRO 33 1HG PRO 33 4.496 2.485 1.362 245 2HG PRO 33 2HG PRO 33 3.365 1.229 0.830 246 1HD PRO 33 1HD PRO 33 2.543 3.548 1.957 247 2HD PRO 33 2HD PRO 33 1.662 2.018 2.156 248 H ARG 34 H ARG 34 4.718 3.948 3.383 249 HA ARG 34 HA ARG 34 7.476 3.930 3.935 250 1HB ARG 34 1HB ARG 34 5.686 6.362 3.915 251 2HB ARG 34 2HB ARG 34 7.410 6.308 3.582 252 1HG ARG 34 1HG ARG 34 6.170 4.547 1.772 253 2HG ARG 34 2HG ARG 34 5.216 6.030 1.787 254 1HD ARG 34 1HD ARG 34 8.207 6.083 1.559 255 2HD ARG 34 2HD ARG 34 7.178 5.879 0.142 256 HE ARG 34 HE ARG 34 6.240 8.058 0.605 257 1HH1 ARG 34 1HH1 ARG 34 6.799 10.228 1.033 258 2HH1 ARG 34 2HH1 ARG 34 8.239 10.576 1.930 259 1HH2 ARG 34 1HH2 ARG 34 9.139 7.224 2.350 260 2HH2 ARG 34 2HH2 ARG 34 9.569 8.868 2.678 261 H MET 35 H MET 35 4.684 4.614 5.913 262 HA MET 35 HA MET 35 6.295 5.675 8.084 263 1HB MET 35 1HB MET 35 3.325 5.173 7.843 264 2HB MET 35 2HB MET 35 4.103 5.880 9.253 265 1HG MET 35 1HG MET 35 4.613 7.832 8.177 266 2HG MET 35 2HG MET 35 4.499 7.110 6.572 267 1HE MET 35 1HE MET 35 2.917 8.075 9.708 268 2HE MET 35 2HE MET 35 1.663 9.189 9.160 269 3HE MET 35 3HE MET 35 1.257 7.510 9.520 270 H SER 36 H SER 36 3.593 3.466 8.544 271 HA SER 36 HA SER 36 5.174 1.207 9.254 272 1HB SER 36 1HB SER 36 5.284 3.031 11.214 273 2HB SER 36 2HB SER 36 3.761 2.260 11.655 274 HG SER 36 HG SER 36 5.510 1.223 12.659 275 H SER 37 H SER 37 3.938 -0.452 8.718 276 HA SER 37 HA SER 37 1.142 -0.512 9.532 277 1HB SER 37 1HB SER 37 1.464 0.449 7.117 278 2HB SER 37 2HB SER 37 0.219 -0.767 7.407 279 HG SER 37 HG SER 37 2.782 -1.631 6.702 280 H1 SER 1 H1 SER 1 12.644 8.253 -6.879 281 H2 SER 1 H2 SER 1 11.720 9.655 -6.684 282 H3 SER 1 H3 SER 1 13.008 9.637 -7.780 283 HA SER 1 HA SER 1 14.598 9.416 -6.021 284 1HB SER 1 1HB SER 1 12.632 11.606 -5.320 285 2HB SER 1 2HB SER 1 14.383 11.629 -5.113 286 HG SER 1 HG SER 1 13.433 11.193 -7.687 287 H MET 2 H MET 2 11.305 9.770 -4.708 288 HA MET 2 HA MET 2 12.008 7.971 -2.528 289 1HB MET 2 1HB MET 2 11.683 10.850 -2.222 290 2HB MET 2 2HB MET 2 10.565 9.947 -1.210 291 1HG MET 2 1HG MET 2 12.269 8.931 -0.012 292 2HG MET 2 2HG MET 2 13.472 9.254 -1.259 293 1HE MET 2 1HE MET 2 15.232 10.113 -0.153 294 2HE MET 2 2HE MET 2 15.097 11.592 -1.102 295 3HE MET 2 3HE MET 2 15.373 11.683 0.637 296 H GLY 3 H GLY 3 10.372 6.645 -2.015 297 1HA GLY 3 1HA GLY 3 7.637 7.341 -2.069 298 2HA GLY 3 2HA GLY 3 8.050 6.512 -3.567 299 H LEU 4 H LEU 4 6.449 4.953 -2.765 300 HA LEU 4 HA LEU 4 6.836 3.401 -0.449 301 1HB LEU 4 1HB LEU 4 5.611 2.216 -2.890 302 2HB LEU 4 2HB LEU 4 5.097 2.093 -1.220 303 HG LEU 4 HG LEU 4 4.898 4.784 -2.414 304 1HD1 LEU 4 1HD1 LEU 4 4.123 2.761 -4.055 305 2HD1 LEU 4 2HD1 LEU 4 2.640 3.069 -3.152 306 3HD1 LEU 4 3HD1 LEU 4 3.414 4.377 -4.046 307 1HD2 LEU 4 1HD2 LEU 4 4.122 4.036 -0.123 308 2HD2 LEU 4 2HD2 LEU 4 2.947 4.915 -1.102 309 3HD2 LEU 4 3HD2 LEU 4 2.835 3.161 -0.954 310 HA PRO 5 HA PRO 5 10.209 0.655 -1.272 311 1HB PRO 5 1HB PRO 5 8.292 -1.535 -0.606 312 2HB PRO 5 2HB PRO 5 9.914 -1.228 0.023 313 1HG PRO 5 1HG PRO 5 7.764 -0.651 1.478 314 2HG PRO 5 2HG PRO 5 9.181 0.411 1.484 315 1HD PRO 5 1HD PRO 5 7.635 1.988 0.856 316 2HD PRO 5 2HD PRO 5 6.539 0.779 0.159 317 HA PRO 6 HA PRO 6 9.789 -1.024 -5.334 318 1HB PRO 6 1HB PRO 6 11.185 -3.378 -5.212 319 2HB PRO 6 2HB PRO 6 11.940 -1.784 -5.317 320 1HG PRO 6 1HG PRO 6 12.903 -2.561 -3.347 321 2HG PRO 6 2HG PRO 6 11.465 -3.505 -2.912 322 1HD PRO 6 1HD PRO 6 11.137 -1.676 -1.530 323 2HD PRO 6 2HD PRO 6 11.958 -0.564 -2.645 324 H GLY 7 H GLY 7 8.093 -2.303 -2.865 325 1HA GLY 7 1HA GLY 7 6.772 -4.233 -4.656 326 2HA GLY 7 2HA GLY 7 7.154 -4.682 -3.003 327 H TRP 8 H TRP 8 6.488 -1.664 -2.431 328 HA TRP 8 HA TRP 8 3.684 -2.218 -1.859 329 1HB TRP 8 1HB TRP 8 5.684 -0.211 -0.854 330 2HB TRP 8 2HB TRP 8 3.962 0.040 -0.586 331 HD1 TRP 8 HD1 TRP 8 6.899 -2.024 0.613 332 HE1 TRP 8 HE1 TRP 8 6.185 -3.397 2.656 333 HE3 TRP 8 HE3 TRP 8 1.869 -1.137 0.469 334 HZ2 TRP 8 HZ2 TRP 8 3.801 -4.029 4.040 335 HZ3 TRP 8 HZ3 TRP 8 0.439 -2.169 2.190 336 HH2 TRP 8 HH2 TRP 8 1.390 -3.577 3.939 337 H ASP 9 H ASP 9 2.008 -1.228 -2.813 338 HA ASP 9 HA ASP 9 2.525 1.143 -4.471 339 1HB ASP 9 1HB ASP 9 2.367 -1.052 -5.806 340 2HB ASP 9 2HB ASP 9 1.363 0.297 -6.329 341 H GLU 10 H GLU 10 0.543 2.379 -4.971 342 HA GLU 10 HA GLU 10 -1.440 2.086 -2.809 343 1HB GLU 10 1HB GLU 10 -1.710 4.681 -3.574 344 2HB GLU 10 2HB GLU 10 -0.696 4.141 -2.245 345 1HG GLU 10 1HG GLU 10 1.210 4.624 -3.329 346 2HG GLU 10 2HG GLU 10 0.582 4.094 -4.888 347 H TYR 11 H TYR 11 -3.561 2.082 -3.278 348 HA TYR 11 HA TYR 11 -4.596 3.039 -5.775 349 1HB TYR 11 1HB TYR 11 -4.061 0.172 -5.372 350 2HB TYR 11 2HB TYR 11 -5.700 0.535 -5.900 351 HD1 TYR 11 HD1 TYR 11 -5.877 2.171 -7.950 352 HD2 TYR 11 HD2 TYR 11 -2.403 -0.080 -6.969 353 HE1 TYR 11 HE1 TYR 11 -5.089 2.387 -10.270 354 HE2 TYR 11 HE2 TYR 11 -1.606 0.128 -9.286 355 HH TYR 11 HH TYR 11 -1.960 1.730 -11.218 356 H LYS 12 H LYS 12 -6.881 3.231 -5.758 357 HA LYS 12 HA LYS 12 -7.976 3.135 -3.051 358 1HB LYS 12 1HB LYS 12 -8.596 4.691 -5.511 359 2HB LYS 12 2HB LYS 12 -9.904 4.389 -4.379 360 1HG LYS 12 1HG LYS 12 -8.566 5.403 -2.587 361 2HG LYS 12 2HG LYS 12 -7.302 5.765 -3.763 362 1HD LYS 12 1HD LYS 12 -10.120 6.708 -4.170 363 2HD LYS 12 2HD LYS 12 -8.985 7.620 -3.173 364 1HE LYS 12 1HE LYS 12 -7.423 7.346 -5.264 365 2HE LYS 12 2HE LYS 12 -8.952 7.109 -6.109 366 1HZ LYS 12 1HZ LYS 12 -9.561 9.273 -4.758 367 2HZ LYS 12 2HZ LYS 12 -7.888 9.511 -4.833 368 3HZ LYS 12 3HZ LYS 12 -8.784 9.350 -6.258 369 H THR 13 H THR 13 -9.456 1.720 -2.421 370 HA THR 13 HA THR 13 -10.283 -0.396 -4.151 371 HB THR 13 HB THR 13 -11.632 -1.165 -2.209 372 HG1 THR 13 HG1 THR 13 -12.110 0.240 -0.710 373 1HG2 THR 13 1HG2 THR 13 -9.103 -1.551 -2.517 374 2HG2 THR 13 2HG2 THR 13 -8.914 -0.377 -1.214 375 3HG2 THR 13 3HG2 THR 13 -9.809 -1.871 -0.933 376 H HIS 14 H HIS 14 -12.915 -0.857 -3.257 377 HA HIS 14 HA HIS 14 -14.418 0.510 -5.182 378 1HB HIS 14 1HB HIS 14 -14.862 -1.540 -3.225 379 2HB HIS 14 2HB HIS 14 -16.186 -0.384 -3.153 380 HD1 HIS 14 HD1 HIS 14 -16.562 0.290 -6.089 381 HD2 HIS 14 HD2 HIS 14 -15.907 -3.570 -4.693 382 HE1 HIS 14 HE1 HIS 14 -17.493 -1.233 -7.861 383 HE2 HIS 14 HE2 HIS 14 -17.085 -3.564 -6.996 384 H ASN 15 H ASN 15 -14.479 0.874 -1.633 385 HA ASN 15 HA ASN 15 -16.222 3.077 -1.600 386 1HB ASN 15 1HB ASN 15 -14.829 1.517 0.304 387 2HB ASN 15 2HB ASN 15 -16.111 2.685 0.596 388 2HD2 ASN 15 2HD2 ASN 15 -12.684 2.136 0.572 389 1HD2 ASN 15 1HD2 ASN 15 -12.247 3.554 1.457 390 H GLY 16 H GLY 16 -12.715 2.841 -1.828 391 1HA GLY 16 1HA GLY 16 -11.712 4.612 -3.253 392 2HA GLY 16 2HA GLY 16 -12.636 5.758 -2.297 393 H LYS 17 H LYS 17 -11.213 3.082 -0.616 394 HA LYS 17 HA LYS 17 -9.491 4.901 0.820 395 1HB LYS 17 1HB LYS 17 -10.783 2.864 1.792 396 2HB LYS 17 2HB LYS 17 -9.165 3.211 2.381 397 1HG LYS 17 1HG LYS 17 -9.617 1.238 0.168 398 2HG LYS 17 2HG LYS 17 -8.241 1.406 1.250 399 1HD LYS 17 1HD LYS 17 -9.742 0.781 3.142 400 2HD LYS 17 2HD LYS 17 -9.480 -0.504 1.963 401 1HE LYS 17 1HE LYS 17 -11.928 1.089 2.535 402 2HE LYS 17 2HE LYS 17 -11.664 0.516 0.889 403 1HZ LYS 17 1HZ LYS 17 -11.149 -1.639 2.532 404 2HZ LYS 17 2HZ LYS 17 -12.552 -0.930 3.157 405 3HZ LYS 17 3HZ LYS 17 -12.500 -1.414 1.538 406 H THR 18 H THR 18 -7.450 5.341 0.285 407 HA THR 18 HA THR 18 -6.263 4.123 -2.021 408 HB THR 18 HB THR 18 -4.645 5.770 -0.119 409 HG1 THR 18 HG1 THR 18 -5.619 7.629 -1.317 410 1HG2 THR 18 1HG2 THR 18 -4.789 5.315 -3.075 411 2HG2 THR 18 2HG2 THR 18 -4.018 6.767 -2.435 412 3HG2 THR 18 3HG2 THR 18 -3.404 5.174 -1.991 413 H TYR 19 H TYR 19 -6.452 1.933 -1.106 414 HA TYR 19 HA TYR 19 -4.909 1.154 1.131 415 1HB TYR 19 1HB TYR 19 -5.803 -0.933 0.825 416 2HB TYR 19 2HB TYR 19 -6.976 0.017 -0.084 417 HD1 TYR 19 HD1 TYR 19 -6.907 -0.007 -2.569 418 HD2 TYR 19 HD2 TYR 19 -4.416 -2.547 -0.237 419 HE1 TYR 19 HE1 TYR 19 -6.505 -1.415 -4.543 420 HE2 TYR 19 HE2 TYR 19 -4.006 -3.962 -2.205 421 HH TYR 19 HH TYR 19 -5.669 -4.257 -4.638 422 H TYR 20 H TYR 20 -2.916 0.421 1.312 423 HA TYR 20 HA TYR 20 -1.214 0.430 -1.079 424 1HB TYR 20 1HB TYR 20 -0.310 0.490 1.804 425 2HB TYR 20 2HB TYR 20 0.654 0.842 0.375 426 HD1 TYR 20 HD1 TYR 20 -1.900 2.133 2.669 427 HD2 TYR 20 HD2 TYR 20 0.504 2.983 -0.736 428 HE1 TYR 20 HE1 TYR 20 -2.436 4.522 2.894 429 HE2 TYR 20 HE2 TYR 20 -0.025 5.375 -0.520 430 HH TYR 20 HH TYR 20 -1.202 6.910 0.572 431 H TYR 21 H TYR 21 -0.287 -1.431 -1.752 432 HA TYR 21 HA TYR 21 -0.447 -3.760 0.038 433 1HB TYR 21 1HB TYR 21 -2.322 -3.899 -1.488 434 2HB TYR 21 2HB TYR 21 -1.265 -3.633 -2.870 435 HD1 TYR 21 HD1 TYR 21 -0.670 -5.483 -4.109 436 HD2 TYR 21 HD2 TYR 21 -1.579 -5.993 0.014 437 HE1 TYR 21 HE1 TYR 21 -0.363 -7.911 -4.348 438 HE2 TYR 21 HE2 TYR 21 -1.274 -8.423 -0.213 439 HH TYR 21 HH TYR 21 -1.206 -10.130 -1.810 440 H ASN 22 H ASN 22 1.170 -5.206 -0.036 441 HA ASN 22 HA ASN 22 3.436 -4.610 -1.820 442 1HB ASN 22 1HB ASN 22 3.760 -4.459 0.713 443 2HB ASN 22 2HB ASN 22 3.575 -6.209 0.737 444 2HD2 ASN 22 2HD2 ASN 22 5.836 -5.418 1.717 445 1HD2 ASN 22 1HD2 ASN 22 7.153 -5.623 0.617 446 H HIS 23 H HIS 23 3.728 -6.018 -3.416 447 HA HIS 23 HA HIS 23 2.374 -8.574 -3.357 448 1HB HIS 23 1HB HIS 23 2.304 -8.358 -5.580 449 2HB HIS 23 2HB HIS 23 4.047 -8.161 -5.685 450 HD1 HIS 23 HD1 HIS 23 1.351 -5.840 -4.321 451 HD2 HIS 23 HD2 HIS 23 4.435 -5.897 -7.105 452 HE1 HIS 23 HE1 HIS 23 1.429 -3.519 -5.283 453 HE2 HIS 23 HE2 HIS 23 3.303 -3.575 -6.968 454 H ASN 24 H ASN 24 5.249 -7.554 -2.191 455 HA ASN 24 HA ASN 24 6.804 -9.875 -3.033 456 1HB ASN 24 1HB ASN 24 7.542 -7.562 -1.226 457 2HB ASN 24 2HB ASN 24 8.641 -8.834 -1.748 458 2HD2 ASN 24 2HD2 ASN 24 8.967 -6.052 -2.160 459 1HD2 ASN 24 1HD2 ASN 24 8.977 -5.776 -3.865 460 H THR 25 H THR 25 4.978 -8.690 -0.345 461 HA THR 25 HA THR 25 5.571 -11.170 1.121 462 HB THR 25 HB THR 25 5.717 -10.078 3.203 463 HG1 THR 25 HG1 THR 25 5.358 -7.689 3.230 464 1HG2 THR 25 1HG2 THR 25 7.263 -8.830 1.004 465 2HG2 THR 25 2HG2 THR 25 7.311 -8.023 2.572 466 3HG2 THR 25 3HG2 THR 25 7.824 -9.705 2.429 467 H LYS 26 H LYS 26 3.339 -9.698 -0.572 468 HA LYS 26 HA LYS 26 1.069 -9.568 -0.628 469 1HB LYS 26 1HB LYS 26 0.008 -11.586 -0.270 470 2HB LYS 26 2HB LYS 26 0.879 -11.902 1.224 471 1HG LYS 26 1HG LYS 26 2.902 -12.403 -0.073 472 2HG LYS 26 2HG LYS 26 1.554 -13.466 -0.486 473 1HD LYS 26 1HD LYS 26 1.172 -11.522 -2.300 474 2HD LYS 26 2HD LYS 26 2.923 -11.412 -2.110 475 1HE LYS 26 1HE LYS 26 3.290 -13.400 -3.102 476 2HE LYS 26 2HE LYS 26 1.863 -14.139 -2.376 477 1HZ LYS 26 1HZ LYS 26 0.673 -12.513 -4.055 478 2HZ LYS 26 2HZ LYS 26 2.126 -12.695 -4.901 479 3HZ LYS 26 3HZ LYS 26 1.191 -14.054 -4.524 480 H THR 27 H THR 27 1.452 -7.596 0.785 481 HA THR 27 HA THR 27 -0.057 -7.934 3.300 482 HB THR 27 HB THR 27 2.211 -5.983 2.893 483 HG1 THR 27 HG1 THR 27 2.151 -8.337 4.498 484 1HG2 THR 27 1HG2 THR 27 0.281 -5.446 4.505 485 2HG2 THR 27 2HG2 THR 27 0.927 -6.757 5.494 486 3HG2 THR 27 3HG2 THR 27 1.929 -5.352 5.128 487 H SER 28 H SER 28 -1.985 -7.035 3.004 488 HA SER 28 HA SER 28 -2.161 -4.524 1.481 489 1HB SER 28 1HB SER 28 -4.482 -5.043 1.075 490 2HB SER 28 2HB SER 28 -3.528 -6.473 0.681 491 HG SER 28 HG SER 28 -4.961 -6.018 3.089 492 H THR 29 H THR 29 -2.695 -2.691 2.488 493 HA THR 29 HA THR 29 -4.319 -2.626 4.853 494 HB THR 29 HB THR 29 -1.949 -3.263 5.643 495 HG1 THR 29 HG1 THR 29 -2.322 -1.184 7.196 496 1HG2 THR 29 1HG2 THR 29 -1.513 -0.345 5.015 497 2HG2 THR 29 2HG2 THR 29 -0.438 -1.345 5.993 498 3HG2 THR 29 3HG2 THR 29 -0.674 -1.714 4.283 499 H TRP 30 H TRP 30 -4.987 -0.497 5.405 500 HA TRP 30 HA TRP 30 -4.801 1.360 3.208 501 1HB TRP 30 1HB TRP 30 -6.027 2.359 5.689 502 2HB TRP 30 2HB TRP 30 -6.650 2.358 4.045 503 HD1 TRP 30 HD1 TRP 30 -7.833 1.274 7.106 504 HE1 TRP 30 HE1 TRP 30 -9.231 -0.884 6.994 505 HE3 TRP 30 HE3 TRP 30 -6.346 -0.415 2.525 506 HZ2 TRP 30 HZ2 TRP 30 -9.651 -3.019 5.195 507 HZ3 TRP 30 HZ3 TRP 30 -7.289 -2.526 1.678 508 HH2 TRP 30 HH2 TRP 30 -8.910 -3.799 2.987 509 H THR 31 H THR 31 -2.874 0.687 5.813 510 HA THR 31 HA THR 31 -2.062 3.398 6.426 511 HB THR 31 HB THR 31 -0.465 0.991 7.205 512 HG1 THR 31 HG1 THR 31 -2.617 0.465 7.746 513 1HG2 THR 31 1HG2 THR 31 0.257 3.357 7.692 514 2HG2 THR 31 2HG2 THR 31 -1.136 3.474 8.768 515 3HG2 THR 31 3HG2 THR 31 0.134 2.296 9.095 516 H ASP 32 H ASP 32 -0.225 4.387 5.849 517 HA ASP 32 HA ASP 32 0.839 3.841 3.317 518 1HB ASP 32 1HB ASP 32 2.622 5.555 4.197 519 2HB ASP 32 2HB ASP 32 0.970 6.074 3.896 520 HA PRO 33 HA PRO 33 3.873 0.703 4.216 521 1HB PRO 33 1HB PRO 33 5.288 1.859 1.903 522 2HB PRO 33 2HB PRO 33 4.738 0.224 2.143 523 1HG PRO 33 1HG PRO 33 3.579 1.848 0.449 524 2HG PRO 33 2HG PRO 33 2.649 0.687 1.390 525 1HD PRO 33 1HD PRO 33 1.509 2.590 2.009 526 2HD PRO 33 2HD PRO 33 2.923 3.632 1.759 527 H ARG 34 H ARG 34 5.248 3.617 2.858 528 HA ARG 34 HA ARG 34 7.753 3.639 3.743 529 1HB ARG 34 1HB ARG 34 5.870 5.997 3.737 530 2HB ARG 34 2HB ARG 34 7.616 6.138 3.872 531 1HG ARG 34 1HG ARG 34 7.098 4.520 1.631 532 2HG ARG 34 2HG ARG 34 5.999 5.896 1.537 533 1HD ARG 34 1HD ARG 34 7.997 6.516 0.409 534 2HD ARG 34 2HD ARG 34 9.002 5.937 1.738 535 HE ARG 34 HE ARG 34 7.149 8.107 2.322 536 1HH1 ARG 34 1HH1 ARG 34 10.411 7.098 1.621 537 2HH1 ARG 34 2HH1 ARG 34 11.128 8.552 2.232 538 1HH2 ARG 34 1HH2 ARG 34 8.086 10.025 3.126 539 2HH2 ARG 34 2HH2 ARG 34 9.807 10.215 3.086 540 H MET 35 H MET 35 4.959 4.263 5.782 541 HA MET 35 HA MET 35 6.755 4.536 8.098 542 1HB MET 35 1HB MET 35 5.686 6.514 8.256 543 2HB MET 35 2HB MET 35 4.311 5.977 7.299 544 1HG MET 35 1HG MET 35 3.526 4.715 9.237 545 2HG MET 35 2HG MET 35 4.887 5.355 10.155 546 1HE MET 35 1HE MET 35 5.320 8.137 9.877 547 2HE MET 35 2HE MET 35 4.066 9.027 10.737 548 3HE MET 35 3HE MET 35 4.793 7.600 11.471 549 H SER 36 H SER 36 6.705 2.931 9.517 550 HA SER 36 HA SER 36 4.456 1.041 9.407 551 1HB SER 36 1HB SER 36 6.422 -0.135 10.968 552 2HB SER 36 2HB SER 36 6.132 -0.455 9.257 553 HG SER 36 HG SER 36 8.325 0.404 10.209 554 H SER 37 H SER 37 4.940 3.686 10.976 555 HA SER 37 HA SER 37 4.694 2.756 13.716 556 1HB SER 37 1HB SER 37 4.691 5.536 12.514 557 2HB SER 37 2HB SER 37 4.564 5.204 14.242 558 HG SER 37 HG SER 37 6.626 3.839 13.452 559 H1 SER 1 H1 SER 1 9.460 12.277 -3.646 560 H2 SER 1 H2 SER 1 9.316 13.942 -3.912 561 H3 SER 1 H3 SER 1 10.837 13.258 -3.629 562 HA SER 1 HA SER 1 10.594 13.771 -1.508 563 1HB SER 1 1HB SER 1 8.088 14.342 -0.771 564 2HB SER 1 2HB SER 1 9.064 15.481 -1.698 565 HG SER 1 HG SER 1 6.754 14.628 -2.384 566 H MET 2 H MET 2 7.757 11.866 -2.523 567 HA MET 2 HA MET 2 8.341 10.004 -0.315 568 1HB MET 2 1HB MET 2 5.796 9.450 -0.641 569 2HB MET 2 2HB MET 2 6.285 10.835 0.325 570 1HG MET 2 1HG MET 2 5.895 11.392 -2.529 571 2HG MET 2 2HG MET 2 4.444 10.907 -1.653 572 1HE MET 2 1HE MET 2 3.698 12.996 -2.661 573 2HE MET 2 2HE MET 2 2.968 13.498 -1.136 574 3HE MET 2 3HE MET 2 3.981 14.622 -2.040 575 H GLY 3 H GLY 3 8.410 7.843 -0.759 576 1HA GLY 3 1HA GLY 3 7.518 6.846 -3.339 577 2HA GLY 3 2HA GLY 3 9.259 6.818 -3.083 578 H LEU 4 H LEU 4 6.434 5.081 -2.777 579 HA LEU 4 HA LEU 4 6.870 3.588 -0.425 580 1HB LEU 4 1HB LEU 4 5.573 2.389 -2.833 581 2HB LEU 4 2HB LEU 4 5.141 2.216 -1.144 582 HG LEU 4 HG LEU 4 4.841 4.933 -2.265 583 1HD1 LEU 4 1HD1 LEU 4 3.800 2.696 -3.685 584 2HD1 LEU 4 2HD1 LEU 4 2.460 3.559 -2.927 585 3HD1 LEU 4 3HD1 LEU 4 3.566 4.416 -4.003 586 1HD2 LEU 4 1HD2 LEU 4 4.199 4.058 0.057 587 2HD2 LEU 4 2HD2 LEU 4 3.022 5.045 -0.811 588 3HD2 LEU 4 3HD2 LEU 4 2.835 3.292 -0.761 589 HA PRO 5 HA PRO 5 10.224 0.844 -1.224 590 1HB PRO 5 1HB PRO 5 9.976 -0.979 0.156 591 2HB PRO 5 2HB PRO 5 8.367 -1.363 -0.465 592 1HG PRO 5 1HG PRO 5 7.791 -0.421 1.573 593 2HG PRO 5 2HG PRO 5 9.182 0.673 1.566 594 1HD PRO 5 1HD PRO 5 7.604 2.194 0.879 595 2HD PRO 5 2HD PRO 5 6.552 0.938 0.196 596 HA PRO 6 HA PRO 6 9.897 -0.987 -5.231 597 1HB PRO 6 1HB PRO 6 11.129 -3.442 -4.841 598 2HB PRO 6 2HB PRO 6 11.966 -1.925 -5.182 599 1HG PRO 6 1HG PRO 6 12.938 -2.432 -3.143 600 2HG PRO 6 2HG PRO 6 11.496 -3.287 -2.564 601 1HD PRO 6 1HD PRO 6 11.254 -1.287 -1.410 602 2HD PRO 6 2HD PRO 6 12.026 -0.339 -2.700 603 H GLY 7 H GLY 7 8.592 -2.564 -2.469 604 1HA GLY 7 1HA GLY 7 6.776 -4.089 -4.228 605 2HA GLY 7 2HA GLY 7 7.429 -4.790 -2.754 606 H TRP 8 H TRP 8 5.937 -1.661 -3.588 607 HA TRP 8 HA TRP 8 3.689 -2.187 -1.857 608 1HB TRP 8 1HB TRP 8 5.916 -0.372 -1.059 609 2HB TRP 8 2HB TRP 8 4.274 0.158 -0.708 610 HD1 TRP 8 HD1 TRP 8 6.993 -1.858 0.720 611 HE1 TRP 8 HE1 TRP 8 6.153 -3.218 2.727 612 HE3 TRP 8 HE3 TRP 8 1.964 -1.262 0.047 613 HZ2 TRP 8 HZ2 TRP 8 3.673 -3.945 3.887 614 HZ3 TRP 8 HZ3 TRP 8 0.424 -2.321 1.654 615 HH2 TRP 8 HH2 TRP 8 1.265 -3.631 3.532 616 H ASP 9 H ASP 9 2.210 -1.724 -3.391 617 HA ASP 9 HA ASP 9 2.475 0.783 -4.895 618 1HB ASP 9 1HB ASP 9 0.908 -0.106 -6.464 619 2HB ASP 9 2HB ASP 9 2.058 -1.394 -6.116 620 H GLU 10 H GLU 10 0.427 2.029 -5.244 621 HA GLU 10 HA GLU 10 -1.340 1.877 -2.900 622 1HB GLU 10 1HB GLU 10 -1.246 4.244 -2.586 623 2HB GLU 10 2HB GLU 10 0.405 3.649 -2.648 624 1HG GLU 10 1HG GLU 10 0.737 4.501 -4.823 625 2HG GLU 10 2HG GLU 10 -0.984 4.819 -5.039 626 H TYR 11 H TYR 11 -3.459 2.280 -3.217 627 HA TYR 11 HA TYR 11 -4.546 3.665 -5.434 628 1HB TYR 11 1HB TYR 11 -4.109 0.777 -5.735 629 2HB TYR 11 2HB TYR 11 -5.774 1.270 -6.023 630 HD1 TYR 11 HD1 TYR 11 -5.769 3.663 -7.445 631 HD2 TYR 11 HD2 TYR 11 -2.892 0.537 -7.677 632 HE1 TYR 11 HE1 TYR 11 -5.172 4.390 -9.715 633 HE2 TYR 11 HE2 TYR 11 -2.286 1.257 -9.948 634 HH TYR 11 HH TYR 11 -2.985 2.532 -11.725 635 H LYS 12 H LYS 12 -6.913 3.673 -5.391 636 HA LYS 12 HA LYS 12 -7.869 3.306 -2.660 637 1HB LYS 12 1HB LYS 12 -8.673 4.958 -4.985 638 2HB LYS 12 2HB LYS 12 -9.964 4.430 -3.918 639 1HG LYS 12 1HG LYS 12 -8.816 5.440 -2.017 640 2HG LYS 12 2HG LYS 12 -7.525 5.979 -3.088 641 1HD LYS 12 1HD LYS 12 -10.395 6.743 -3.540 642 2HD LYS 12 2HD LYS 12 -9.328 7.681 -2.494 643 1HE LYS 12 1HE LYS 12 -8.451 8.706 -4.255 644 2HE LYS 12 2HE LYS 12 -7.987 7.158 -4.956 645 1HZ LYS 12 1HZ LYS 12 -10.780 7.685 -5.251 646 2HZ LYS 12 2HZ LYS 12 -9.833 8.890 -5.966 647 3HZ LYS 12 3HZ LYS 12 -9.632 7.274 -6.424 648 H THR 13 H THR 13 -9.222 1.741 -2.052 649 HA THR 13 HA THR 13 -9.987 -0.286 -3.949 650 HB THR 13 HB THR 13 -11.246 -0.532 -1.340 651 HG1 THR 13 HG1 THR 13 -9.033 -0.895 -0.373 652 1HG2 THR 13 1HG2 THR 13 -10.351 -2.207 -3.286 653 2HG2 THR 13 2HG2 THR 13 -9.054 -2.334 -2.097 654 3HG2 THR 13 3HG2 THR 13 -10.714 -2.701 -1.632 655 H HIS 14 H HIS 14 -12.449 -1.115 -2.857 656 HA HIS 14 HA HIS 14 -14.255 0.397 -4.396 657 1HB HIS 14 1HB HIS 14 -14.308 -2.079 -3.227 658 2HB HIS 14 2HB HIS 14 -15.449 -1.187 -2.225 659 HD1 HIS 14 HD1 HIS 14 -17.051 0.428 -4.078 660 HD2 HIS 14 HD2 HIS 14 -15.728 -3.372 -5.117 661 HE1 HIS 14 HE1 HIS 14 -18.600 -0.347 -5.902 662 HE2 HIS 14 HE2 HIS 14 -17.781 -2.650 -6.517 663 H ASN 15 H ASN 15 -13.486 0.413 -0.960 664 HA ASN 15 HA ASN 15 -15.577 2.269 -0.292 665 1HB ASN 15 1HB ASN 15 -13.764 0.598 1.129 666 2HB ASN 15 2HB ASN 15 -13.561 2.247 1.710 667 2HD2 ASN 15 2HD2 ASN 15 -14.626 0.017 3.149 668 1HD2 ASN 15 1HD2 ASN 15 -16.251 0.421 3.579 669 H GLY 16 H GLY 16 -12.900 2.672 -2.055 670 1HA GLY 16 1HA GLY 16 -11.825 4.568 -2.796 671 2HA GLY 16 2HA GLY 16 -12.896 5.511 -1.771 672 H LYS 17 H LYS 17 -11.114 2.997 -0.234 673 HA LYS 17 HA LYS 17 -9.564 4.993 1.200 674 1HB LYS 17 1HB LYS 17 -10.730 3.005 2.318 675 2HB LYS 17 2HB LYS 17 -9.065 3.319 2.787 676 1HG LYS 17 1HG LYS 17 -9.496 1.398 0.575 677 2HG LYS 17 2HG LYS 17 -8.298 1.403 1.866 678 1HD LYS 17 1HD LYS 17 -9.519 -0.141 2.902 679 2HD LYS 17 2HD LYS 17 -10.748 1.100 3.162 680 1HE LYS 17 1HE LYS 17 -11.947 0.463 1.239 681 2HE LYS 17 2HE LYS 17 -10.603 -0.499 0.624 682 1HZ LYS 17 1HZ LYS 17 -10.919 -2.013 2.517 683 2HZ LYS 17 2HZ LYS 17 -12.275 -1.122 2.996 684 3HZ LYS 17 3HZ LYS 17 -12.280 -1.938 1.515 685 H THR 18 H THR 18 -7.536 5.504 0.682 686 HA THR 18 HA THR 18 -6.280 4.371 -1.607 687 HB THR 18 HB THR 18 -4.637 5.894 0.356 688 HG1 THR 18 HG1 THR 18 -6.901 6.807 0.182 689 1HG2 THR 18 1HG2 THR 18 -5.041 6.060 -2.632 690 2HG2 THR 18 2HG2 THR 18 -3.888 7.019 -1.705 691 3HG2 THR 18 3HG2 THR 18 -3.703 5.268 -1.800 692 H TYR 19 H TYR 19 -6.313 2.127 -0.974 693 HA TYR 19 HA TYR 19 -4.713 1.307 1.270 694 1HB TYR 19 1HB TYR 19 -5.658 -0.772 1.028 695 2HB TYR 19 2HB TYR 19 -6.903 0.224 0.280 696 HD1 TYR 19 HD1 TYR 19 -7.066 0.301 -2.217 697 HD2 TYR 19 HD2 TYR 19 -4.502 -2.429 -0.201 698 HE1 TYR 19 HE1 TYR 19 -6.927 -1.067 -4.257 699 HE2 TYR 19 HE2 TYR 19 -4.355 -3.803 -2.234 700 HH TYR 19 HH TYR 19 -6.323 -3.853 -4.567 701 H TYR 20 H TYR 20 -2.794 0.306 1.274 702 HA TYR 20 HA TYR 20 -1.260 0.335 -1.237 703 1HB TYR 20 1HB TYR 20 0.718 0.658 0.078 704 2HB TYR 20 2HB TYR 20 -0.138 0.287 1.571 705 HD1 TYR 20 HD1 TYR 20 -1.810 1.923 2.463 706 HD2 TYR 20 HD2 TYR 20 0.763 2.861 -0.792 707 HE1 TYR 20 HE1 TYR 20 -2.245 4.316 2.816 708 HE2 TYR 20 HE2 TYR 20 0.334 5.257 -0.446 709 HH TYR 20 HH TYR 20 -1.335 6.706 0.553 710 H TYR 21 H TYR 21 -0.152 -1.530 -1.865 711 HA TYR 21 HA TYR 21 -0.583 -3.897 -0.169 712 1HB TYR 21 1HB TYR 21 -2.214 -3.878 -2.003 713 2HB TYR 21 2HB TYR 21 -0.905 -3.771 -3.173 714 HD1 TYR 21 HD1 TYR 21 -0.174 -5.724 -4.167 715 HD2 TYR 21 HD2 TYR 21 -2.024 -5.938 -0.341 716 HE1 TYR 21 HE1 TYR 21 -0.040 -8.179 -4.246 717 HE2 TYR 21 HE2 TYR 21 -1.895 -8.393 -0.410 718 HH TYR 21 HH TYR 21 -0.655 -10.142 -1.505 719 H ASN 22 H ASN 22 0.970 -5.421 -0.106 720 HA ASN 22 HA ASN 22 3.533 -4.772 -1.402 721 1HB ASN 22 1HB ASN 22 3.387 -4.857 1.140 722 2HB ASN 22 2HB ASN 22 3.101 -6.585 0.980 723 2HD2 ASN 22 2HD2 ASN 22 5.267 -5.301 2.329 724 1HD2 ASN 22 1HD2 ASN 22 6.723 -5.804 1.548 725 H HIS 23 H HIS 23 4.000 -6.017 -3.107 726 HA HIS 23 HA HIS 23 2.594 -8.521 -3.487 727 1HB HIS 23 1HB HIS 23 2.726 -8.015 -5.653 728 2HB HIS 23 2HB HIS 23 4.481 -7.940 -5.585 729 HD1 HIS 23 HD1 HIS 23 1.706 -5.626 -4.369 730 HD2 HIS 23 HD2 HIS 23 5.273 -5.531 -6.496 731 HE1 HIS 23 HE1 HIS 23 2.058 -3.215 -4.982 732 HE2 HIS 23 HE2 HIS 23 4.223 -3.178 -6.269 733 H ASN 24 H ASN 24 5.412 -7.699 -1.991 734 HA ASN 24 HA ASN 24 6.896 -10.050 -2.907 735 1HB ASN 24 1HB ASN 24 8.790 -9.134 -1.679 736 2HB ASN 24 2HB ASN 24 7.765 -7.882 -0.981 737 2HD2 ASN 24 2HD2 ASN 24 9.129 -6.291 -1.823 738 1HD2 ASN 24 1HD2 ASN 24 9.099 -5.866 -3.497 739 H THR 25 H THR 25 5.013 -8.886 -0.274 740 HA THR 25 HA THR 25 5.500 -11.402 1.165 741 HB THR 25 HB THR 25 5.651 -10.362 3.274 742 HG1 THR 25 HG1 THR 25 5.076 -7.839 2.094 743 1HG2 THR 25 1HG2 THR 25 7.382 -9.459 1.158 744 2HG2 THR 25 2HG2 THR 25 7.239 -8.221 2.405 745 3HG2 THR 25 3HG2 THR 25 7.775 -9.845 2.834 746 H LYS 26 H LYS 26 3.358 -9.874 -0.558 747 HA LYS 26 HA LYS 26 1.097 -9.643 -0.649 748 1HB LYS 26 1HB LYS 26 -0.083 -11.615 -0.221 749 2HB LYS 26 2HB LYS 26 0.909 -12.019 1.174 750 1HG LYS 26 1HG LYS 26 1.336 -13.494 -0.736 751 2HG LYS 26 2HG LYS 26 2.771 -12.579 -0.266 752 1HD LYS 26 1HD LYS 26 1.377 -11.034 -2.182 753 2HD LYS 26 2HD LYS 26 2.950 -11.819 -2.345 754 1HE LYS 26 1HE LYS 26 0.670 -13.628 -2.611 755 2HE LYS 26 2HE LYS 26 0.746 -12.381 -3.854 756 1HZ LYS 26 1HZ LYS 26 3.260 -13.164 -3.870 757 2HZ LYS 26 2HZ LYS 26 2.557 -14.610 -3.344 758 3HZ LYS 26 3HZ LYS 26 2.077 -13.921 -4.812 759 H THR 27 H THR 27 1.394 -7.676 0.709 760 HA THR 27 HA THR 27 -0.047 -7.987 3.269 761 HB THR 27 HB THR 27 2.069 -5.901 2.739 762 HG1 THR 27 HG1 THR 27 2.771 -7.665 4.622 763 1HG2 THR 27 1HG2 THR 27 0.472 -6.705 5.159 764 2HG2 THR 27 2HG2 THR 27 1.974 -5.789 5.281 765 3HG2 THR 27 3HG2 THR 27 0.597 -5.115 4.409 766 H SER 28 H SER 28 -2.041 -7.235 2.918 767 HA SER 28 HA SER 28 -2.384 -4.812 1.294 768 1HB SER 28 1HB SER 28 -4.872 -5.497 1.491 769 2HB SER 28 2HB SER 28 -3.824 -6.477 0.467 770 HG SER 28 HG SER 28 -4.020 -8.104 1.802 771 H THR 29 H THR 29 -2.795 -2.932 2.239 772 HA THR 29 HA THR 29 -4.279 -2.783 4.727 773 HB THR 29 HB THR 29 -1.791 -3.094 5.295 774 HG1 THR 29 HG1 THR 29 -2.096 -1.822 7.065 775 1HG2 THR 29 1HG2 THR 29 -1.747 -0.354 4.072 776 2HG2 THR 29 2HG2 THR 29 -0.588 -0.831 5.313 777 3HG2 THR 29 3HG2 THR 29 -0.657 -1.711 3.786 778 H TRP 30 H TRP 30 -4.269 -0.284 5.417 779 HA TRP 30 HA TRP 30 -4.665 1.254 2.934 780 1HB TRP 30 1HB TRP 30 -6.063 2.445 5.144 781 2HB TRP 30 2HB TRP 30 -6.703 1.872 3.610 782 HD1 TRP 30 HD1 TRP 30 -7.013 1.285 7.189 783 HE1 TRP 30 HE1 TRP 30 -8.215 -0.942 7.668 784 HE3 TRP 30 HE3 TRP 30 -6.740 -0.794 2.536 785 HZ2 TRP 30 HZ2 TRP 30 -8.951 -3.272 6.250 786 HZ3 TRP 30 HZ3 TRP 30 -7.715 -3.023 2.174 787 HH2 TRP 30 HH2 TRP 30 -8.800 -4.236 3.996 788 H THR 31 H THR 31 -2.822 0.944 5.697 789 HA THR 31 HA THR 31 -2.236 3.770 6.031 790 HB THR 31 HB THR 31 -0.562 1.654 7.301 791 HG1 THR 31 HG1 THR 31 -2.325 1.740 9.006 792 1HG2 THR 31 1HG2 THR 31 -1.382 4.447 7.824 793 2HG2 THR 31 2HG2 THR 31 -1.167 3.408 9.234 794 3HG2 THR 31 3HG2 THR 31 0.166 3.647 8.104 795 H ASP 32 H ASP 32 -0.344 4.777 5.464 796 HA ASP 32 HA ASP 32 0.935 3.951 3.125 797 1HB ASP 32 1HB ASP 32 0.786 6.298 4.334 798 2HB ASP 32 2HB ASP 32 2.342 5.808 4.997 799 HA PRO 33 HA PRO 33 3.764 0.906 4.757 800 1HB PRO 33 1HB PRO 33 5.287 0.673 2.485 801 2HB PRO 33 2HB PRO 33 3.754 -0.159 2.743 802 1HG PRO 33 1HG PRO 33 4.338 2.314 1.187 803 2HG PRO 33 2HG PRO 33 3.218 0.992 0.819 804 1HD PRO 33 1HD PRO 33 2.400 3.377 1.806 805 2HD PRO 33 2HD PRO 33 1.563 1.851 2.154 806 H ARG 34 H ARG 34 4.657 3.935 3.329 807 HA ARG 34 HA ARG 34 7.423 3.904 3.866 808 1HB ARG 34 1HB ARG 34 5.445 6.162 3.573 809 2HB ARG 34 2HB ARG 34 7.163 6.437 3.819 810 1HG ARG 34 1HG ARG 34 6.926 4.594 1.710 811 2HG ARG 34 2HG ARG 34 5.751 5.874 1.410 812 1HD ARG 34 1HD ARG 34 8.696 6.239 1.943 813 2HD ARG 34 2HD ARG 34 7.888 6.418 0.387 814 HE ARG 34 HE ARG 34 6.797 8.377 1.245 815 1HH1 ARG 34 1HH1 ARG 34 9.354 7.101 3.241 816 2HH1 ARG 34 2HH1 ARG 34 9.603 8.587 4.095 817 1HH2 ARG 34 1HH2 ARG 34 7.119 10.336 2.363 818 2HH2 ARG 34 2HH2 ARG 34 8.334 10.425 3.595 819 H MET 35 H MET 35 4.628 4.655 5.821 820 HA MET 35 HA MET 35 6.403 5.197 8.110 821 1HB MET 35 1HB MET 35 4.551 6.461 9.093 822 2HB MET 35 2HB MET 35 3.546 6.098 7.696 823 1HG MET 35 1HG MET 35 5.902 7.899 7.928 824 2HG MET 35 2HG MET 35 5.441 7.241 6.360 825 1HE MET 35 1HE MET 35 5.055 9.080 5.146 826 2HE MET 35 2HE MET 35 3.381 8.615 4.840 827 3HE MET 35 3HE MET 35 3.765 10.273 5.302 828 H SER 36 H SER 36 4.708 4.874 10.193 829 HA SER 36 HA SER 36 3.319 2.341 9.963 830 1HB SER 36 1HB SER 36 6.001 2.260 10.632 831 2HB SER 36 2HB SER 36 5.200 2.231 12.203 832 HG SER 36 HG SER 36 4.913 0.428 10.047 833 H SER 37 H SER 37 2.398 4.921 10.539 834 HA SER 37 HA SER 37 1.710 4.703 13.397 835 1HB SER 37 1HB SER 37 2.993 6.765 12.728 836 2HB SER 37 2HB SER 37 1.623 7.217 11.713 837 HG SER 37 HG SER 37 0.920 6.571 14.281 838 H1 SER 1 H1 SER 1 3.033 5.476 -7.237 839 H2 SER 1 H2 SER 1 2.950 5.018 -8.863 840 H3 SER 1 H3 SER 1 3.918 4.144 -7.787 841 HA SER 1 HA SER 1 5.639 5.419 -8.232 842 1HB SER 1 1HB SER 1 5.259 7.293 -9.961 843 2HB SER 1 2HB SER 1 4.875 5.646 -10.461 844 HG SER 1 HG SER 1 3.046 7.622 -9.565 845 H MET 2 H MET 2 5.780 6.128 -6.049 846 HA MET 2 HA MET 2 5.499 9.010 -5.787 847 1HB MET 2 1HB MET 2 3.404 7.760 -4.880 848 2HB MET 2 2HB MET 2 4.456 7.301 -3.548 849 1HG MET 2 1HG MET 2 4.741 9.526 -2.863 850 2HG MET 2 2HG MET 2 4.094 10.161 -4.375 851 1HE MET 2 1HE MET 2 3.092 11.444 -1.818 852 2HE MET 2 2HE MET 2 2.327 11.788 -3.370 853 3HE MET 2 3HE MET 2 1.336 11.387 -1.967 854 H GLY 3 H GLY 3 6.174 6.187 -3.701 855 1HA GLY 3 1HA GLY 3 8.948 6.610 -3.551 856 2HA GLY 3 2HA GLY 3 8.188 7.447 -2.202 857 H LEU 4 H LEU 4 6.158 4.987 -2.744 858 HA LEU 4 HA LEU 4 6.797 3.552 -0.437 859 1HB LEU 4 1HB LEU 4 5.404 2.221 -2.715 860 2HB LEU 4 2HB LEU 4 5.057 2.125 -1.000 861 HG LEU 4 HG LEU 4 4.636 4.758 -2.303 862 1HD1 LEU 4 1HD1 LEU 4 3.512 2.361 -3.379 863 2HD1 LEU 4 2HD1 LEU 4 2.235 3.322 -2.631 864 3HD1 LEU 4 3HD1 LEU 4 3.257 4.033 -3.882 865 1HD2 LEU 4 1HD2 LEU 4 4.218 4.272 0.111 866 2HD2 LEU 4 2HD2 LEU 4 2.815 4.888 -0.764 867 3HD2 LEU 4 3HD2 LEU 4 2.937 3.169 -0.392 868 HA PRO 5 HA PRO 5 10.101 0.741 -1.281 869 1HB PRO 5 1HB PRO 5 9.808 -1.153 0.011 870 2HB PRO 5 2HB PRO 5 8.163 -1.425 -0.573 871 1HG PRO 5 1HG PRO 5 7.721 -0.523 1.528 872 2HG PRO 5 2HG PRO 5 9.152 0.521 1.477 873 1HD PRO 5 1HD PRO 5 7.608 2.112 0.880 874 2HD PRO 5 2HD PRO 5 6.474 0.911 0.234 875 HA PRO 6 HA PRO 6 9.647 -0.895 -5.348 876 1HB PRO 6 1HB PRO 6 11.089 -3.233 -5.235 877 2HB PRO 6 2HB PRO 6 11.804 -1.626 -5.390 878 1HG PRO 6 1HG PRO 6 12.840 -2.327 -3.436 879 2HG PRO 6 2HG PRO 6 11.451 -3.317 -2.948 880 1HD PRO 6 1HD PRO 6 11.098 -1.485 -1.577 881 2HD PRO 6 2HD PRO 6 11.844 -0.358 -2.729 882 H GLY 7 H GLY 7 8.121 -2.320 -2.791 883 1HA GLY 7 1HA GLY 7 6.770 -4.239 -4.581 884 2HA GLY 7 2HA GLY 7 7.179 -4.667 -2.927 885 H TRP 8 H TRP 8 6.440 -1.577 -2.553 886 HA TRP 8 HA TRP 8 3.657 -2.191 -1.898 887 1HB TRP 8 1HB TRP 8 5.651 -0.185 -0.895 888 2HB TRP 8 2HB TRP 8 3.931 0.106 -0.658 889 HD1 TRP 8 HD1 TRP 8 6.813 -1.859 0.716 890 HE1 TRP 8 HE1 TRP 8 6.032 -3.251 2.719 891 HE3 TRP 8 HE3 TRP 8 1.765 -1.227 0.213 892 HZ2 TRP 8 HZ2 TRP 8 3.589 -3.990 3.941 893 HZ3 TRP 8 HZ3 TRP 8 0.275 -2.309 1.846 894 HH2 TRP 8 HH2 TRP 8 1.171 -3.662 3.669 895 H ASP 9 H ASP 9 2.092 -1.509 -3.171 896 HA ASP 9 HA ASP 9 2.530 0.918 -4.787 897 1HB ASP 9 1HB ASP 9 1.284 0.000 -6.573 898 2HB ASP 9 2HB ASP 9 2.339 -1.309 -6.048 899 H GLU 10 H GLU 10 0.642 2.261 -5.134 900 HA GLU 10 HA GLU 10 -1.273 1.981 -2.920 901 1HB GLU 10 1HB GLU 10 0.361 4.013 -3.178 902 2HB GLU 10 2HB GLU 10 -1.293 4.258 -2.639 903 1HG GLU 10 1HG GLU 10 -0.516 4.512 -5.524 904 2HG GLU 10 2HG GLU 10 -1.957 5.124 -4.714 905 H TYR 11 H TYR 11 -3.443 2.282 -3.219 906 HA TYR 11 HA TYR 11 -4.623 3.116 -5.657 907 1HB TYR 11 1HB TYR 11 -3.978 0.290 -5.387 908 2HB TYR 11 2HB TYR 11 -5.707 0.549 -5.599 909 HD1 TYR 11 HD1 TYR 11 -6.284 2.311 -7.531 910 HD2 TYR 11 HD2 TYR 11 -2.716 0.004 -7.294 911 HE1 TYR 11 HE1 TYR 11 -5.958 2.575 -9.954 912 HE2 TYR 11 HE2 TYR 11 -2.381 0.263 -9.717 913 HH TYR 11 HH TYR 11 -4.261 0.787 -11.789 914 H LYS 12 H LYS 12 -6.885 3.333 -5.482 915 HA LYS 12 HA LYS 12 -7.840 3.205 -2.725 916 1HB LYS 12 1HB LYS 12 -8.564 4.789 -5.128 917 2HB LYS 12 2HB LYS 12 -9.857 4.421 -3.998 918 1HG LYS 12 1HG LYS 12 -8.566 5.433 -2.187 919 2HG LYS 12 2HG LYS 12 -7.286 5.828 -3.333 920 1HD LYS 12 1HD LYS 12 -10.099 6.747 -3.801 921 2HD LYS 12 2HD LYS 12 -9.024 7.643 -2.726 922 1HE LYS 12 1HE LYS 12 -7.358 7.553 -4.700 923 2HE LYS 12 2HE LYS 12 -8.778 7.167 -5.672 924 1HZ LYS 12 1HZ LYS 12 -9.778 9.239 -4.586 925 2HZ LYS 12 2HZ LYS 12 -8.186 9.640 -4.176 926 3HZ LYS 12 3HZ LYS 12 -8.621 9.462 -5.800 927 H THR 13 H THR 13 -9.225 1.722 -2.035 928 HA THR 13 HA THR 13 -10.149 -0.322 -3.823 929 HB THR 13 HB THR 13 -11.344 -0.284 -1.141 930 HG1 THR 13 HG1 THR 13 -9.274 0.721 -0.759 931 1HG2 THR 13 1HG2 THR 13 -10.589 -2.149 -3.105 932 2HG2 THR 13 2HG2 THR 13 -9.569 -2.467 -1.702 933 3HG2 THR 13 3HG2 THR 13 -11.325 -2.475 -1.536 934 H HIS 14 H HIS 14 -12.634 -0.991 -2.754 935 HA HIS 14 HA HIS 14 -14.387 0.384 -4.391 936 1HB HIS 14 1HB HIS 14 -14.991 -1.165 -1.863 937 2HB HIS 14 2HB HIS 14 -16.197 -0.673 -3.048 938 HD1 HIS 14 HD1 HIS 14 -16.317 -1.999 -5.241 939 HD2 HIS 14 HD2 HIS 14 -13.321 -3.289 -2.666 940 HE1 HIS 14 HE1 HIS 14 -15.529 -4.196 -6.176 941 HE2 HIS 14 HE2 HIS 14 -13.716 -4.961 -4.602 942 H ASN 15 H ASN 15 -14.187 0.679 -0.835 943 HA ASN 15 HA ASN 15 -15.950 2.852 -0.629 944 1HB ASN 15 1HB ASN 15 -14.623 3.251 1.576 945 2HB ASN 15 2HB ASN 15 -15.549 1.766 1.392 946 2HD2 ASN 15 2HD2 ASN 15 -14.348 0.547 2.771 947 1HD2 ASN 15 1HD2 ASN 15 -12.716 0.081 2.455 948 H GLY 16 H GLY 16 -12.739 2.673 -1.752 949 1HA GLY 16 1HA GLY 16 -11.691 4.418 -2.944 950 2HA GLY 16 2HA GLY 16 -12.687 5.579 -2.083 951 H LYS 17 H LYS 17 -11.107 3.096 -0.252 952 HA LYS 17 HA LYS 17 -9.522 5.106 1.095 953 1HB LYS 17 1HB LYS 17 -10.685 3.121 2.241 954 2HB LYS 17 2HB LYS 17 -9.036 3.483 2.729 955 1HG LYS 17 1HG LYS 17 -9.516 1.446 0.600 956 2HG LYS 17 2HG LYS 17 -8.186 1.593 1.747 957 1HD LYS 17 1HD LYS 17 -9.274 0.459 3.362 958 2HD LYS 17 2HD LYS 17 -10.830 1.189 2.963 959 1HE LYS 17 1HE LYS 17 -11.019 -0.304 1.025 960 2HE LYS 17 2HE LYS 17 -9.480 -1.047 1.456 961 1HZ LYS 17 1HZ LYS 17 -11.059 -1.138 3.726 962 2HZ LYS 17 2HZ LYS 17 -12.062 -1.616 2.450 963 3HZ LYS 17 3HZ LYS 17 -10.609 -2.434 2.736 964 H THR 18 H THR 18 -7.482 5.598 0.613 965 HA THR 18 HA THR 18 -6.211 4.439 -1.658 966 HB THR 18 HB THR 18 -4.605 6.019 0.292 967 HG1 THR 18 HG1 THR 18 -6.917 6.934 -1.047 968 1HG2 THR 18 1HG2 THR 18 -4.818 5.659 -2.655 969 2HG2 THR 18 2HG2 THR 18 -4.193 7.190 -2.042 970 3HG2 THR 18 3HG2 THR 18 -3.390 5.677 -1.620 971 H TYR 19 H TYR 19 -6.269 2.210 -0.940 972 HA TYR 19 HA TYR 19 -4.588 1.469 1.284 973 1HB TYR 19 1HB TYR 19 -5.743 -0.466 1.309 974 2HB TYR 19 2HB TYR 19 -6.867 0.387 0.257 975 HD1 TYR 19 HD1 TYR 19 -6.773 -0.005 -2.203 976 HD2 TYR 19 HD2 TYR 19 -4.471 -2.321 0.524 977 HE1 TYR 19 HE1 TYR 19 -6.444 -1.711 -3.942 978 HE2 TYR 19 HE2 TYR 19 -4.135 -4.035 -1.208 979 HH TYR 19 HH TYR 19 -5.752 -4.616 -3.561 980 H TYR 20 H TYR 20 -2.692 0.410 1.217 981 HA TYR 20 HA TYR 20 -1.332 0.301 -1.385 982 1HB TYR 20 1HB TYR 20 0.727 0.623 -0.238 983 2HB TYR 20 2HB TYR 20 0.001 0.282 1.325 984 HD1 TYR 20 HD1 TYR 20 -1.593 1.946 2.326 985 HD2 TYR 20 HD2 TYR 20 0.751 2.826 -1.113 986 HE1 TYR 20 HE1 TYR 20 -1.970 4.347 2.693 987 HE2 TYR 20 HE2 TYR 20 0.381 5.231 -0.754 988 HH TYR 20 HH TYR 20 -0.336 6.782 0.755 989 H TYR 21 H TYR 21 -0.027 -1.556 -1.865 990 HA TYR 21 HA TYR 21 -0.488 -3.893 -0.156 991 1HB TYR 21 1HB TYR 21 -2.210 -3.947 -1.885 992 2HB TYR 21 2HB TYR 21 -0.983 -3.799 -3.138 993 HD1 TYR 21 HD1 TYR 21 -0.203 -5.722 -4.164 994 HD2 TYR 21 HD2 TYR 21 -1.922 -6.016 -0.283 995 HE1 TYR 21 HE1 TYR 21 -0.010 -8.171 -4.270 996 HE2 TYR 21 HE2 TYR 21 -1.733 -8.466 -0.379 997 HH TYR 21 HH TYR 21 -0.174 -10.084 -3.113 998 H ASN 22 H ASN 22 1.101 -5.398 -0.118 999 HA ASN 22 HA ASN 22 3.562 -4.755 -1.601 1000 1HB ASN 22 1HB ASN 22 3.620 -4.707 0.935 1001 2HB ASN 22 2HB ASN 22 3.347 -6.445 0.896 1002 2HD2 ASN 22 2HD2 ASN 22 5.404 -4.169 -0.894 1003 1HD2 ASN 22 1HD2 ASN 22 6.871 -5.053 -0.662 1004 H HIS 23 H HIS 23 3.926 -6.054 -3.275 1005 HA HIS 23 HA HIS 23 2.628 -8.638 -3.426 1006 1HB HIS 23 1HB HIS 23 2.645 -8.285 -5.628 1007 2HB HIS 23 2HB HIS 23 4.392 -8.096 -5.645 1008 HD1 HIS 23 HD1 HIS 23 1.630 -5.830 -4.316 1009 HD2 HIS 23 HD2 HIS 23 4.871 -5.764 -6.914 1010 HE1 HIS 23 HE1 HIS 23 1.766 -3.467 -5.160 1011 HE2 HIS 23 HE2 HIS 23 3.736 -3.448 -6.732 1012 H ASN 24 H ASN 24 5.348 -7.683 -1.968 1013 HA ASN 24 HA ASN 24 7.023 -9.900 -2.887 1014 1HB ASN 24 1HB ASN 24 7.616 -7.662 -0.938 1015 2HB ASN 24 2HB ASN 24 8.769 -8.887 -1.457 1016 2HD2 ASN 24 2HD2 ASN 24 8.859 -5.991 -1.727 1017 1HD2 ASN 24 1HD2 ASN 24 9.026 -5.674 -3.417 1018 H THR 25 H THR 25 5.051 -8.884 -0.229 1019 HA THR 25 HA THR 25 5.594 -11.439 1.117 1020 HB THR 25 HB THR 25 5.686 -10.458 3.270 1021 HG1 THR 25 HG1 THR 25 5.547 -7.877 2.987 1022 1HG2 THR 25 1HG2 THR 25 7.309 -8.955 1.240 1023 2HG2 THR 25 2HG2 THR 25 7.470 -8.624 2.965 1024 3HG2 THR 25 3HG2 THR 25 7.821 -10.235 2.341 1025 H LYS 26 H LYS 26 3.413 -9.841 -0.524 1026 HA LYS 26 HA LYS 26 1.147 -9.727 -0.640 1027 1HB LYS 26 1HB LYS 26 0.002 -11.705 -0.192 1028 2HB LYS 26 2HB LYS 26 0.967 -12.062 1.234 1029 1HG LYS 26 1HG LYS 26 2.892 -12.232 -0.582 1030 2HG LYS 26 2HG LYS 26 1.842 -13.597 -0.191 1031 1HD LYS 26 1HD LYS 26 0.346 -12.844 -2.069 1032 2HD LYS 26 2HD LYS 26 1.619 -11.711 -2.521 1033 1HE LYS 26 1HE LYS 26 2.757 -13.304 -3.561 1034 2HE LYS 26 2HE LYS 26 2.721 -14.319 -2.121 1035 1HZ LYS 26 1HZ LYS 26 0.341 -14.142 -3.840 1036 2HZ LYS 26 2HZ LYS 26 1.623 -15.149 -4.288 1037 3HZ LYS 26 3HZ LYS 26 0.829 -15.397 -2.816 1038 H THR 27 H THR 27 1.356 -7.729 0.653 1039 HA THR 27 HA THR 27 -0.096 -8.020 3.206 1040 HB THR 27 HB THR 27 2.053 -5.952 2.759 1041 HG1 THR 27 HG1 THR 27 2.753 -8.270 2.834 1042 1HG2 THR 27 1HG2 THR 27 0.480 -6.872 5.155 1043 2HG2 THR 27 2HG2 THR 27 1.951 -5.908 5.284 1044 3HG2 THR 27 3HG2 THR 27 0.542 -5.258 4.446 1045 H SER 28 H SER 28 -2.043 -7.141 2.926 1046 HA SER 28 HA SER 28 -2.267 -4.698 1.300 1047 1HB SER 28 1HB SER 28 -4.767 -5.325 1.332 1048 2HB SER 28 2HB SER 28 -3.690 -6.325 0.358 1049 HG SER 28 HG SER 28 -4.562 -6.919 2.995 1050 H THR 29 H THR 29 -2.815 -2.833 2.230 1051 HA THR 29 HA THR 29 -4.423 -2.719 4.620 1052 HB THR 29 HB THR 29 -2.032 -3.163 5.414 1053 HG1 THR 29 HG1 THR 29 -3.251 -2.381 7.009 1054 1HG2 THR 29 1HG2 THR 29 -1.240 -1.325 3.667 1055 2HG2 THR 29 2HG2 THR 29 -1.499 -0.266 5.053 1056 3HG2 THR 29 3HG2 THR 29 -0.373 -1.619 5.175 1057 H TRP 30 H TRP 30 -4.472 -0.283 5.397 1058 HA TRP 30 HA TRP 30 -4.632 1.350 2.954 1059 1HB TRP 30 1HB TRP 30 -6.009 2.658 5.055 1060 2HB TRP 30 2HB TRP 30 -6.684 1.940 3.598 1061 HD1 TRP 30 HD1 TRP 30 -6.931 1.722 7.229 1062 HE1 TRP 30 HE1 TRP 30 -8.171 -0.419 7.945 1063 HE3 TRP 30 HE3 TRP 30 -6.801 -0.793 2.797 1064 HZ2 TRP 30 HZ2 TRP 30 -8.990 -2.856 6.773 1065 HZ3 TRP 30 HZ3 TRP 30 -7.834 -3.028 2.669 1066 HH2 TRP 30 HH2 TRP 30 -8.906 -4.035 4.619 1067 H THR 31 H THR 31 -2.937 0.917 5.824 1068 HA THR 31 HA THR 31 -2.232 3.657 6.330 1069 HB THR 31 HB THR 31 -0.678 1.273 7.302 1070 HG1 THR 31 HG1 THR 31 -2.864 0.884 7.799 1071 1HG2 THR 31 1HG2 THR 31 0.099 3.676 7.649 1072 2HG2 THR 31 2HG2 THR 31 -1.285 3.849 8.730 1073 3HG2 THR 31 3HG2 THR 31 -0.029 2.663 9.088 1074 H ASP 32 H ASP 32 -0.282 4.647 6.026 1075 HA ASP 32 HA ASP 32 0.961 4.213 3.550 1076 1HB ASP 32 1HB ASP 32 2.667 5.881 4.657 1077 2HB ASP 32 2HB ASP 32 1.050 6.415 4.226 1078 HA PRO 33 HA PRO 33 3.680 0.893 4.935 1079 1HB PRO 33 1HB PRO 33 4.976 0.696 2.492 1080 2HB PRO 33 2HB PRO 33 3.501 -0.166 2.933 1081 1HG PRO 33 1HG PRO 33 3.842 2.308 1.315 1082 2HG PRO 33 2HG PRO 33 2.687 0.981 1.115 1083 1HD PRO 33 1HD PRO 33 1.991 3.365 2.177 1084 2HD PRO 33 2HD PRO 33 1.237 1.840 2.682 1085 H ARG 34 H ARG 34 4.585 3.888 3.423 1086 HA ARG 34 HA ARG 34 7.376 3.737 3.746 1087 1HB ARG 34 1HB ARG 34 5.541 6.137 3.713 1088 2HB ARG 34 2HB ARG 34 7.295 6.219 3.606 1089 1HG ARG 34 1HG ARG 34 5.968 4.459 1.655 1090 2HG ARG 34 2HG ARG 34 5.671 6.189 1.479 1091 1HD ARG 34 1HD ARG 34 8.285 6.309 1.816 1092 2HD ARG 34 2HD ARG 34 7.576 6.001 0.232 1093 HE ARG 34 HE ARG 34 8.265 3.771 0.380 1094 1HH1 ARG 34 1HH1 ARG 34 9.096 5.578 3.241 1095 2HH1 ARG 34 2HH1 ARG 34 10.220 4.394 3.818 1096 1HH2 ARG 34 1HH2 ARG 34 9.745 2.207 1.133 1097 2HH2 ARG 34 2HH2 ARG 34 10.589 2.479 2.621 1098 H MET 35 H MET 35 4.782 4.656 5.904 1099 HA MET 35 HA MET 35 6.756 4.919 8.076 1100 1HB MET 35 1HB MET 35 5.380 6.637 9.100 1101 2HB MET 35 2HB MET 35 4.191 6.494 7.812 1102 1HG MET 35 1HG MET 35 6.939 7.640 7.739 1103 2HG MET 35 2HG MET 35 6.149 7.106 6.257 1104 1HE MET 35 1HE MET 35 6.314 8.955 5.121 1105 2HE MET 35 2HE MET 35 4.632 9.419 4.866 1106 3HE MET 35 3HE MET 35 5.784 10.594 5.499 1107 H SER 36 H SER 36 6.557 3.145 9.274 1108 HA SER 36 HA SER 36 3.895 2.014 9.739 1109 1HB SER 36 1HB SER 36 5.513 0.209 10.891 1110 2HB SER 36 2HB SER 36 5.176 0.205 9.159 1111 HG SER 36 HG SER 36 7.516 0.567 10.417 1112 H SER 37 H SER 37 4.686 4.456 11.049 1113 HA SER 37 HA SER 37 5.339 3.768 13.779 1114 1HB SER 37 1HB SER 37 6.219 5.850 12.997 1115 2HB SER 37 2HB SER 37 4.636 6.376 12.423 1116 HG SER 37 HG SER 37 5.009 7.370 14.374 1117 H1 SER 1 H1 SER 1 13.713 5.265 -7.492 1118 H2 SER 1 H2 SER 1 14.703 4.635 -6.274 1119 H3 SER 1 H3 SER 1 13.775 3.596 -7.234 1120 HA SER 1 HA SER 1 11.798 4.170 -6.232 1121 1HB SER 1 1HB SER 1 14.103 4.062 -4.306 1122 2HB SER 1 2HB SER 1 12.456 4.245 -3.700 1123 HG SER 1 HG SER 1 13.402 2.155 -5.371 1124 H MET 2 H MET 2 10.436 5.816 -5.963 1125 HA MET 2 HA MET 2 11.445 8.321 -4.810 1126 1HB MET 2 1HB MET 2 9.753 9.408 -6.510 1127 2HB MET 2 2HB MET 2 11.396 9.023 -7.001 1128 1HG MET 2 1HG MET 2 10.476 6.825 -7.856 1129 2HG MET 2 2HG MET 2 8.874 7.523 -7.623 1130 1HE MET 2 1HE MET 2 9.157 6.538 -10.327 1131 2HE MET 2 2HE MET 2 7.882 7.710 -9.992 1132 3HE MET 2 3HE MET 2 8.905 7.902 -11.416 1133 H GLY 3 H GLY 3 10.073 6.368 -3.396 1134 1HA GLY 3 1HA GLY 3 8.177 7.717 -1.995 1135 2HA GLY 3 2HA GLY 3 7.261 7.002 -3.318 1136 H LEU 4 H LEU 4 6.297 5.178 -2.792 1137 HA LEU 4 HA LEU 4 6.752 3.746 -0.424 1138 1HB LEU 4 1HB LEU 4 5.101 2.277 -1.158 1139 2HB LEU 4 2HB LEU 4 5.554 2.453 -2.841 1140 HG LEU 4 HG LEU 4 4.711 4.957 -2.374 1141 1HD1 LEU 4 1HD1 LEU 4 3.627 2.554 -3.548 1142 2HD1 LEU 4 2HD1 LEU 4 2.345 3.594 -2.922 1143 3HD1 LEU 4 3HD1 LEU 4 3.503 4.228 -4.091 1144 1HD2 LEU 4 1HD2 LEU 4 4.167 4.315 -0.002 1145 2HD2 LEU 4 2HD2 LEU 4 2.843 5.033 -0.920 1146 3HD2 LEU 4 3HD2 LEU 4 2.890 3.290 -0.658 1147 HA PRO 5 HA PRO 5 10.190 1.059 -1.075 1148 1HB PRO 5 1HB PRO 5 9.954 -0.730 0.348 1149 2HB PRO 5 2HB PRO 5 8.379 -1.180 -0.312 1150 1HG PRO 5 1HG PRO 5 7.710 -0.212 1.688 1151 2HG PRO 5 2HG PRO 5 9.066 0.927 1.694 1152 1HD PRO 5 1HD PRO 5 7.456 2.377 0.930 1153 2HD PRO 5 2HD PRO 5 6.473 1.072 0.236 1154 HA PRO 6 HA PRO 6 10.053 -0.902 -5.040 1155 1HB PRO 6 1HB PRO 6 11.083 -3.429 -4.495 1156 2HB PRO 6 2HB PRO 6 12.042 -1.987 -4.844 1157 1HG PRO 6 1HG PRO 6 12.855 -2.478 -2.729 1158 2HG PRO 6 2HG PRO 6 11.321 -3.195 -2.205 1159 1HD PRO 6 1HD PRO 6 11.195 -1.121 -1.152 1160 2HD PRO 6 2HD PRO 6 12.070 -0.299 -2.464 1161 H GLY 7 H GLY 7 8.848 -2.790 -2.318 1162 1HA GLY 7 1HA GLY 7 6.895 -4.058 -4.136 1163 2HA GLY 7 2HA GLY 7 7.466 -4.780 -2.642 1164 H TRP 8 H TRP 8 6.035 -1.647 -3.590 1165 HA TRP 8 HA TRP 8 3.740 -2.118 -1.917 1166 1HB TRP 8 1HB TRP 8 5.926 -0.253 -1.088 1167 2HB TRP 8 2HB TRP 8 4.259 0.231 -0.781 1168 HD1 TRP 8 HD1 TRP 8 7.006 -1.683 0.736 1169 HE1 TRP 8 HE1 TRP 8 6.165 -3.045 2.742 1170 HE3 TRP 8 HE3 TRP 8 1.974 -1.248 -0.047 1171 HZ2 TRP 8 HZ2 TRP 8 3.687 -3.830 3.860 1172 HZ3 TRP 8 HZ3 TRP 8 0.437 -2.331 1.545 1173 HH2 TRP 8 HH2 TRP 8 1.280 -3.593 3.454 1174 H ASP 9 H ASP 9 2.235 -1.600 -3.377 1175 HA ASP 9 HA ASP 9 2.568 0.901 -4.902 1176 1HB ASP 9 1HB ASP 9 1.310 -0.009 -6.654 1177 2HB ASP 9 2HB ASP 9 2.289 -1.370 -6.118 1178 H GLU 10 H GLU 10 0.531 2.122 -5.311 1179 HA GLU 10 HA GLU 10 -1.260 1.890 -2.986 1180 1HB GLU 10 1HB GLU 10 0.307 3.919 -3.187 1181 2HB GLU 10 2HB GLU 10 -1.382 4.208 -2.803 1182 1HG GLU 10 1HG GLU 10 -0.513 4.288 -5.649 1183 2HG GLU 10 2HG GLU 10 -1.830 5.145 -4.848 1184 H TYR 11 H TYR 11 -3.438 2.043 -3.246 1185 HA TYR 11 HA TYR 11 -4.714 2.892 -5.634 1186 1HB TYR 11 1HB TYR 11 -3.935 0.090 -5.444 1187 2HB TYR 11 2HB TYR 11 -5.675 0.277 -5.638 1188 HD1 TYR 11 HD1 TYR 11 -6.325 2.086 -7.518 1189 HD2 TYR 11 HD2 TYR 11 -2.684 -0.111 -7.370 1190 HE1 TYR 11 HE1 TYR 11 -6.023 2.432 -9.934 1191 HE2 TYR 11 HE2 TYR 11 -2.373 0.229 -9.786 1192 HH TYR 11 HH TYR 11 -4.648 2.188 -11.672 1193 H LYS 12 H LYS 12 -7.007 2.937 -5.423 1194 HA LYS 12 HA LYS 12 -7.870 2.813 -2.643 1195 1HB LYS 12 1HB LYS 12 -8.793 4.208 -5.084 1196 2HB LYS 12 2HB LYS 12 -10.044 3.730 -3.949 1197 1HG LYS 12 1HG LYS 12 -8.900 4.947 -2.168 1198 2HG LYS 12 2HG LYS 12 -7.657 5.445 -3.314 1199 1HD LYS 12 1HD LYS 12 -10.556 6.026 -3.819 1200 2HD LYS 12 2HD LYS 12 -9.574 7.085 -2.802 1201 1HE LYS 12 1HE LYS 12 -7.958 6.794 -4.959 1202 2HE LYS 12 2HE LYS 12 -9.548 6.703 -5.717 1203 1HZ LYS 12 1HZ LYS 12 -9.781 8.799 -4.011 1204 2HZ LYS 12 2HZ LYS 12 -8.196 8.963 -4.580 1205 3HZ LYS 12 3HZ LYS 12 -9.486 8.915 -5.673 1206 H THR 13 H THR 13 -9.182 1.300 -1.830 1207 HA THR 13 HA THR 13 -9.901 -0.966 -3.433 1208 HB THR 13 HB THR 13 -11.192 -0.765 -0.806 1209 HG1 THR 13 HG1 THR 13 -8.480 -0.189 -1.133 1210 1HG2 THR 13 1HG2 THR 13 -10.189 -2.742 -2.550 1211 2HG2 THR 13 2HG2 THR 13 -9.249 -2.850 -1.062 1212 3HG2 THR 13 3HG2 THR 13 -11.008 -2.974 -1.005 1213 H HIS 14 H HIS 14 -12.350 -1.765 -2.549 1214 HA HIS 14 HA HIS 14 -14.119 -0.411 -4.244 1215 1HB HIS 14 1HB HIS 14 -14.188 -2.807 -3.032 1216 2HB HIS 14 2HB HIS 14 -15.272 -1.922 -1.962 1217 HD1 HIS 14 HD1 HIS 14 -14.923 -2.901 -5.599 1218 HD2 HIS 14 HD2 HIS 14 -17.805 -1.538 -2.933 1219 HE1 HIS 14 HE1 HIS 14 -17.108 -3.045 -6.838 1220 HE2 HIS 14 HE2 HIS 14 -18.838 -2.216 -5.206 1221 H ASN 15 H ASN 15 -13.523 -0.103 -0.789 1222 HA ASN 15 HA ASN 15 -15.702 1.685 -0.308 1223 1HB ASN 15 1HB ASN 15 -14.104 0.190 1.306 1224 2HB ASN 15 2HB ASN 15 -13.421 1.796 1.527 1225 2HD2 ASN 15 2HD2 ASN 15 -14.099 2.056 3.608 1226 1HD2 ASN 15 1HD2 ASN 15 -15.760 2.242 4.044 1227 H GLY 16 H GLY 16 -12.637 2.013 -1.704 1228 1HA GLY 16 1HA GLY 16 -11.876 3.945 -2.804 1229 2HA GLY 16 2HA GLY 16 -12.973 4.909 -1.830 1230 H LYS 17 H LYS 17 -11.103 2.625 -0.094 1231 HA LYS 17 HA LYS 17 -9.606 4.781 1.143 1232 1HB LYS 17 1HB LYS 17 -10.649 2.762 2.386 1233 2HB LYS 17 2HB LYS 17 -9.043 3.294 2.857 1234 1HG LYS 17 1HG LYS 17 -9.241 1.152 0.813 1235 2HG LYS 17 2HG LYS 17 -8.038 1.412 2.076 1236 1HD LYS 17 1HD LYS 17 -10.148 0.927 3.628 1237 2HD LYS 17 2HD LYS 17 -9.112 -0.359 3.005 1238 1HE LYS 17 1HE LYS 17 -11.703 0.584 1.785 1239 2HE LYS 17 2HE LYS 17 -10.660 -0.673 1.124 1240 1HZ LYS 17 1HZ LYS 17 -11.057 -1.504 3.660 1241 2HZ LYS 17 2HZ LYS 17 -12.554 -0.812 3.284 1242 3HZ LYS 17 3HZ LYS 17 -11.928 -2.048 2.316 1243 H THR 18 H THR 18 -7.624 5.365 0.546 1244 HA THR 18 HA THR 18 -6.353 4.152 -1.693 1245 HB THR 18 HB THR 18 -4.764 5.905 0.114 1246 HG1 THR 18 HG1 THR 18 -6.174 7.561 -1.327 1247 1HG2 THR 18 1HG2 THR 18 -5.155 5.531 -2.833 1248 2HG2 THR 18 2HG2 THR 18 -4.413 7.003 -2.206 1249 3HG2 THR 18 3HG2 THR 18 -3.671 5.436 -1.883 1250 H TYR 19 H TYR 19 -6.225 1.959 -0.910 1251 HA TYR 19 HA TYR 19 -4.432 1.444 1.304 1252 1HB TYR 19 1HB TYR 19 -5.414 -0.595 1.474 1253 2HB TYR 19 2HB TYR 19 -6.693 0.198 0.562 1254 HD1 TYR 19 HD1 TYR 19 -6.817 -0.176 -1.929 1255 HD2 TYR 19 HD2 TYR 19 -4.261 -2.455 0.597 1256 HE1 TYR 19 HE1 TYR 19 -6.641 -1.902 -3.672 1257 HE2 TYR 19 HE2 TYR 19 -4.079 -4.187 -1.138 1258 HH TYR 19 HH TYR 19 -5.872 -3.924 -4.190 1259 H TYR 20 H TYR 20 -2.489 0.480 1.211 1260 HA TYR 20 HA TYR 20 -1.235 0.304 -1.435 1261 1HB TYR 20 1HB TYR 20 0.852 0.703 -0.384 1262 2HB TYR 20 2HB TYR 20 0.212 0.339 1.214 1263 HD1 TYR 20 HD1 TYR 20 -1.438 1.948 2.252 1264 HD2 TYR 20 HD2 TYR 20 0.806 2.910 -1.231 1265 HE1 TYR 20 HE1 TYR 20 -1.889 4.336 2.628 1266 HE2 TYR 20 HE2 TYR 20 0.363 5.300 -0.865 1267 HH TYR 20 HH TYR 20 -0.961 6.773 0.281 1268 H TYR 21 H TYR 21 -0.145 -1.578 -2.055 1269 HA TYR 21 HA TYR 21 -0.529 -3.892 -0.276 1270 1HB TYR 21 1HB TYR 21 -2.185 -3.914 -2.090 1271 2HB TYR 21 2HB TYR 21 -0.890 -3.842 -3.278 1272 HD1 TYR 21 HD1 TYR 21 -0.168 -5.819 -4.226 1273 HD2 TYR 21 HD2 TYR 21 -2.001 -5.938 -0.389 1274 HE1 TYR 21 HE1 TYR 21 -0.049 -8.275 -4.252 1275 HE2 TYR 21 HE2 TYR 21 -1.887 -8.394 -0.404 1276 HH TYR 21 HH TYR 21 -0.977 -10.175 -3.243 1277 H ASN 22 H ASN 22 1.029 -5.435 -0.219 1278 HA ASN 22 HA ASN 22 3.567 -4.776 -1.555 1279 1HB ASN 22 1HB ASN 22 3.715 -4.718 0.881 1280 2HB ASN 22 2HB ASN 22 3.034 -6.338 0.987 1281 2HD2 ASN 22 2HD2 ASN 22 5.021 -6.649 2.260 1282 1HD2 ASN 22 1HD2 ASN 22 6.461 -7.107 1.421 1283 H HIS 23 H HIS 23 3.950 -6.003 -3.269 1284 HA HIS 23 HA HIS 23 2.657 -8.572 -3.575 1285 1HB HIS 23 1HB HIS 23 2.786 -8.137 -5.763 1286 2HB HIS 23 2HB HIS 23 4.527 -7.913 -5.686 1287 HD1 HIS 23 HD1 HIS 23 1.467 -5.865 -4.711 1288 HD2 HIS 23 HD2 HIS 23 5.215 -5.420 -6.446 1289 HE1 HIS 23 HE1 HIS 23 1.642 -3.433 -5.312 1290 HE2 HIS 23 HE2 HIS 23 3.918 -3.182 -6.363 1291 H ASN 24 H ASN 24 5.099 -7.957 -1.748 1292 HA ASN 24 HA ASN 24 6.860 -10.074 -2.782 1293 1HB ASN 24 1HB ASN 24 7.382 -7.929 -0.712 1294 2HB ASN 24 2HB ASN 24 8.527 -9.193 -1.150 1295 2HD2 ASN 24 2HD2 ASN 24 8.732 -6.293 -1.354 1296 1HD2 ASN 24 1HD2 ASN 24 9.070 -5.958 -3.012 1297 H THR 25 H THR 25 4.829 -9.092 -0.141 1298 HA THR 25 HA THR 25 5.107 -11.765 1.035 1299 HB THR 25 HB THR 25 5.263 -10.958 3.259 1300 HG1 THR 25 HG1 THR 25 4.384 -8.571 2.107 1301 1HG2 THR 25 1HG2 THR 25 7.071 -9.462 1.380 1302 2HG2 THR 25 2HG2 THR 25 7.243 -9.335 3.131 1303 3HG2 THR 25 3HG2 THR 25 7.425 -10.900 2.339 1304 H LYS 26 H LYS 26 3.131 -10.020 -0.589 1305 HA LYS 26 HA LYS 26 0.893 -9.653 -0.738 1306 1HB LYS 26 1HB LYS 26 -0.459 -11.498 -0.295 1307 2HB LYS 26 2HB LYS 26 0.443 -11.941 1.148 1308 1HG LYS 26 1HG LYS 26 2.362 -12.304 -0.668 1309 2HG LYS 26 2HG LYS 26 1.204 -13.563 -0.233 1310 1HD LYS 26 1HD LYS 26 -0.245 -12.685 -2.117 1311 2HD LYS 26 2HD LYS 26 1.159 -11.745 -2.622 1312 1HE LYS 26 1HE LYS 26 2.012 -14.403 -2.151 1313 2HE LYS 26 2HE LYS 26 1.975 -13.518 -3.677 1314 1HZ LYS 26 1HZ LYS 26 -0.506 -14.723 -2.671 1315 2HZ LYS 26 2HZ LYS 26 -0.022 -14.436 -4.266 1316 3HZ LYS 26 3HZ LYS 26 0.648 -15.723 -3.398 1317 H THR 27 H THR 27 1.362 -7.688 0.586 1318 HA THR 27 HA THR 27 -0.054 -7.841 3.176 1319 HB THR 27 HB THR 27 1.994 -5.737 2.535 1320 HG1 THR 27 HG1 THR 27 2.350 -8.360 3.538 1321 1HG2 THR 27 1HG2 THR 27 0.668 -6.761 5.032 1322 2HG2 THR 27 2HG2 THR 27 2.138 -5.785 5.077 1323 3HG2 THR 27 3HG2 THR 27 0.659 -5.123 4.377 1324 H SER 28 H SER 28 -2.038 -7.044 2.896 1325 HA SER 28 HA SER 28 -2.364 -4.640 1.233 1326 1HB SER 28 1HB SER 28 -3.781 -6.378 0.426 1327 2HB SER 28 2HB SER 28 -4.316 -6.795 2.053 1328 HG SER 28 HG SER 28 -5.815 -5.352 1.870 1329 H THR 29 H THR 29 -2.377 -2.817 2.350 1330 HA THR 29 HA THR 29 -4.013 -2.632 4.772 1331 HB THR 29 HB THR 29 -1.545 -3.017 5.349 1332 HG1 THR 29 HG1 THR 29 -2.596 -2.228 7.046 1333 1HG2 THR 29 1HG2 THR 29 -1.399 -0.359 4.000 1334 2HG2 THR 29 2HG2 THR 29 -0.349 -0.689 5.378 1335 3HG2 THR 29 3HG2 THR 29 -0.272 -1.714 3.944 1336 H TRP 30 H TRP 30 -4.246 -0.246 5.440 1337 HA TRP 30 HA TRP 30 -4.508 1.347 2.980 1338 1HB TRP 30 1HB TRP 30 -5.912 2.622 5.082 1339 2HB TRP 30 2HB TRP 30 -6.577 1.830 3.659 1340 HD1 TRP 30 HD1 TRP 30 -6.727 1.684 7.300 1341 HE1 TRP 30 HE1 TRP 30 -7.809 -0.515 8.094 1342 HE3 TRP 30 HE3 TRP 30 -6.539 -0.922 2.922 1343 HZ2 TRP 30 HZ2 TRP 30 -8.495 -3.029 6.996 1344 HZ3 TRP 30 HZ3 TRP 30 -7.425 -3.220 2.868 1345 HH2 TRP 30 HH2 TRP 30 -8.385 -4.249 4.865 1346 H THR 31 H THR 31 -2.865 1.124 5.958 1347 HA THR 31 HA THR 31 -2.243 3.910 6.260 1348 HB THR 31 HB THR 31 -0.643 1.679 7.484 1349 HG1 THR 31 HG1 THR 31 -2.216 1.431 9.025 1350 1HG2 THR 31 1HG2 THR 31 -0.067 4.170 7.703 1351 2HG2 THR 31 2HG2 THR 31 -1.498 4.276 8.729 1352 3HG2 THR 31 3HG2 THR 31 -0.162 3.219 9.185 1353 H ASP 32 H ASP 32 -0.249 4.913 5.952 1354 HA ASP 32 HA ASP 32 1.049 4.388 3.544 1355 1HB ASP 32 1HB ASP 32 1.174 6.363 5.578 1356 2HB ASP 32 2HB ASP 32 2.821 5.814 5.288 1357 HA PRO 33 HA PRO 33 3.555 0.897 4.839 1358 1HB PRO 33 1HB PRO 33 4.954 0.740 2.461 1359 2HB PRO 33 2HB PRO 33 3.401 -0.038 2.777 1360 1HG PRO 33 1HG PRO 33 3.998 2.477 1.307 1361 2HG PRO 33 2HG PRO 33 2.757 1.257 0.991 1362 1HD PRO 33 1HD PRO 33 2.213 3.645 2.148 1363 2HD PRO 33 2HD PRO 33 1.295 2.170 2.505 1364 H ARG 34 H ARG 34 4.678 3.938 3.604 1365 HA ARG 34 HA ARG 34 7.449 3.593 4.000 1366 1HB ARG 34 1HB ARG 34 5.953 6.199 4.287 1367 2HB ARG 34 2HB ARG 34 7.630 5.970 3.809 1368 1HG ARG 34 1HG ARG 34 5.996 4.530 1.996 1369 2HG ARG 34 2HG ARG 34 5.327 6.152 2.173 1370 1HD ARG 34 1HD ARG 34 8.219 5.546 1.575 1371 2HD ARG 34 2HD ARG 34 7.011 5.959 0.358 1372 HE ARG 34 HE ARG 34 6.913 8.155 1.249 1373 1HH1 ARG 34 1HH1 ARG 34 9.349 6.151 2.735 1374 2HH1 ARG 34 2HH1 ARG 34 10.230 7.488 3.393 1375 1HH2 ARG 34 1HH2 ARG 34 8.069 9.920 2.113 1376 2HH2 ARG 34 2HH2 ARG 34 9.503 9.630 3.040 1377 H MET 35 H MET 35 4.908 3.756 6.187 1378 HA MET 35 HA MET 35 4.702 4.124 8.427 1379 1HB MET 35 1HB MET 35 6.865 2.322 7.826 1380 2HB MET 35 2HB MET 35 7.134 3.122 9.372 1381 1HG MET 35 1HG MET 35 5.242 2.236 10.315 1382 2HG MET 35 2HG MET 35 4.486 1.907 8.757 1383 1HE MET 35 1HE MET 35 3.657 -0.067 9.318 1384 2HE MET 35 2HE MET 35 4.454 -1.072 8.107 1385 3HE MET 35 3HE MET 35 4.470 -1.555 9.803 1386 H SER 36 H SER 36 4.766 6.423 8.389 1387 HA SER 36 HA SER 36 7.308 7.732 8.902 1388 1HB SER 36 1HB SER 36 4.502 8.832 8.650 1389 2HB SER 36 2HB SER 36 5.944 9.819 8.884 1390 HG SER 36 HG SER 36 6.036 9.769 6.785 1391 H SER 37 H SER 37 7.299 9.443 10.686 1392 HA SER 37 HA SER 37 6.635 8.094 13.165 1393 1HB SER 37 1HB SER 37 7.819 10.216 14.116 1394 2HB SER 37 2HB SER 37 8.782 9.004 13.269 1395 HG SER 37 HG SER 37 8.873 11.437 12.709 1396 H1 SER 1 H1 SER 1 11.845 7.982 -7.836 1397 H2 SER 1 H2 SER 1 13.495 8.107 -8.184 1398 H3 SER 1 H3 SER 1 12.974 7.148 -6.892 1399 HA SER 1 HA SER 1 13.895 9.219 -6.090 1400 1HB SER 1 1HB SER 1 12.499 11.300 -6.658 1401 2HB SER 1 2HB SER 1 13.540 10.669 -7.934 1402 HG SER 1 HG SER 1 11.338 9.402 -8.291 1403 H MET 2 H MET 2 13.216 8.161 -4.223 1404 HA MET 2 HA MET 2 11.987 7.802 -2.348 1405 1HB MET 2 1HB MET 2 10.567 9.572 -1.572 1406 2HB MET 2 2HB MET 2 10.352 10.191 -3.203 1407 1HG MET 2 1HG MET 2 12.630 10.497 -1.337 1408 2HG MET 2 2HG MET 2 12.989 10.409 -3.061 1409 1HE MET 2 1HE MET 2 14.111 12.363 -3.009 1410 2HE MET 2 2HE MET 2 13.342 13.856 -3.548 1411 3HE MET 2 3HE MET 2 13.705 13.620 -1.839 1412 H GLY 3 H GLY 3 9.475 7.781 -1.586 1413 1HA GLY 3 1HA GLY 3 7.223 7.286 -2.416 1414 2HA GLY 3 2HA GLY 3 7.986 6.413 -3.741 1415 H LEU 4 H LEU 4 6.383 4.777 -2.908 1416 HA LEU 4 HA LEU 4 6.954 3.442 -0.438 1417 1HB LEU 4 1HB LEU 4 5.474 2.065 -2.607 1418 2HB LEU 4 2HB LEU 4 5.111 2.158 -0.896 1419 HG LEU 4 HG LEU 4 4.809 4.627 -2.543 1420 1HD1 LEU 4 1HD1 LEU 4 3.396 2.137 -3.033 1421 2HD1 LEU 4 2HD1 LEU 4 2.310 3.464 -2.613 1422 3HD1 LEU 4 3HD1 LEU 4 3.422 3.630 -3.972 1423 1HD2 LEU 4 1HD2 LEU 4 4.488 4.497 -0.041 1424 2HD2 LEU 4 2HD2 LEU 4 3.141 5.167 -0.961 1425 3HD2 LEU 4 3HD2 LEU 4 3.064 3.509 -0.367 1426 HA PRO 5 HA PRO 5 10.183 0.587 -1.434 1427 1HB PRO 5 1HB PRO 5 9.914 -1.311 -0.143 1428 2HB PRO 5 2HB PRO 5 8.238 -1.549 -0.653 1429 1HG PRO 5 1HG PRO 5 7.913 -0.648 1.470 1430 2HG PRO 5 2HG PRO 5 9.357 0.373 1.353 1431 1HD PRO 5 1HD PRO 5 6.631 0.806 0.235 1432 2HD PRO 5 2HD PRO 5 7.810 1.989 0.836 1433 HA PRO 6 HA PRO 6 9.593 -1.002 -5.502 1434 1HB PRO 6 1HB PRO 6 10.916 -3.424 -5.390 1435 2HB PRO 6 2HB PRO 6 11.696 -1.856 -5.617 1436 1HG PRO 6 1HG PRO 6 12.773 -2.547 -3.681 1437 2HG PRO 6 2HG PRO 6 11.364 -3.468 -3.119 1438 1HD PRO 6 1HD PRO 6 11.151 -1.583 -1.782 1439 2HD PRO 6 2HD PRO 6 11.867 -0.516 -3.009 1440 H GLY 7 H GLY 7 8.233 -2.554 -2.840 1441 1HA GLY 7 1HA GLY 7 6.711 -4.359 -4.618 1442 2HA GLY 7 2HA GLY 7 7.125 -4.772 -2.962 1443 H TRP 8 H TRP 8 6.515 -1.702 -2.525 1444 HA TRP 8 HA TRP 8 3.715 -2.196 -1.865 1445 1HB TRP 8 1HB TRP 8 5.795 -0.259 -0.901 1446 2HB TRP 8 2HB TRP 8 4.089 0.080 -0.624 1447 HD1 TRP 8 HD1 TRP 8 6.946 -1.969 0.679 1448 HE1 TRP 8 HE1 TRP 8 6.168 -3.346 2.696 1449 HE3 TRP 8 HE3 TRP 8 1.911 -1.196 0.286 1450 HZ2 TRP 8 HZ2 TRP 8 3.730 -4.021 3.969 1451 HZ3 TRP 8 HZ3 TRP 8 0.425 -2.240 1.947 1452 HH2 TRP 8 HH2 TRP 8 1.320 -3.619 3.747 1453 H ASP 9 H ASP 9 2.121 -1.386 -3.029 1454 HA ASP 9 HA ASP 9 2.601 1.029 -4.638 1455 1HB ASP 9 1HB ASP 9 1.462 -1.599 -5.460 1456 2HB ASP 9 2HB ASP 9 0.737 -0.147 -6.144 1457 H GLU 10 H GLU 10 0.848 2.464 -4.814 1458 HA GLU 10 HA GLU 10 -1.197 2.037 -2.757 1459 1HB GLU 10 1HB GLU 10 -1.364 4.369 -2.530 1460 2HB GLU 10 2HB GLU 10 0.354 4.054 -2.706 1461 1HG GLU 10 1HG GLU 10 0.389 5.582 -4.301 1462 2HG GLU 10 2HG GLU 10 -0.543 4.467 -5.300 1463 H TYR 11 H TYR 11 -3.347 2.184 -3.147 1464 HA TYR 11 HA TYR 11 -4.477 3.182 -5.551 1465 1HB TYR 11 1HB TYR 11 -3.737 0.354 -5.463 1466 2HB TYR 11 2HB TYR 11 -5.448 0.599 -5.802 1467 HD1 TYR 11 HD1 TYR 11 -5.743 2.737 -7.539 1468 HD2 TYR 11 HD2 TYR 11 -2.464 0.032 -7.355 1469 HE1 TYR 11 HE1 TYR 11 -5.218 3.224 -9.890 1470 HE2 TYR 11 HE2 TYR 11 -1.930 0.512 -9.707 1471 HH TYR 11 HH TYR 11 -3.887 2.790 -11.609 1472 H LYS 12 H LYS 12 -6.755 3.273 -5.459 1473 HA LYS 12 HA LYS 12 -7.798 2.976 -2.760 1474 1HB LYS 12 1HB LYS 12 -8.595 4.475 -5.194 1475 2HB LYS 12 2HB LYS 12 -9.885 3.979 -4.111 1476 1HG LYS 12 1HG LYS 12 -8.794 5.130 -2.263 1477 2HG LYS 12 2HG LYS 12 -7.486 5.624 -3.338 1478 1HD LYS 12 1HD LYS 12 -10.345 6.300 -3.950 1479 2HD LYS 12 2HD LYS 12 -9.379 7.303 -2.865 1480 1HE LYS 12 1HE LYS 12 -8.377 8.287 -4.587 1481 2HE LYS 12 2HE LYS 12 -7.880 6.726 -5.239 1482 1HZ LYS 12 1HZ LYS 12 -10.241 6.592 -6.135 1483 2HZ LYS 12 2HZ LYS 12 -10.350 8.248 -5.806 1484 3HZ LYS 12 3HZ LYS 12 -9.188 7.677 -6.897 1485 H THR 13 H THR 13 -9.104 1.395 -2.111 1486 HA THR 13 HA THR 13 -9.713 -0.773 -3.876 1487 HB THR 13 HB THR 13 -11.124 -0.735 -1.299 1488 HG1 THR 13 HG1 THR 13 -8.337 -1.045 -1.118 1489 1HG2 THR 13 1HG2 THR 13 -9.375 -2.596 -2.859 1490 2HG2 THR 13 2HG2 THR 13 -9.715 -2.914 -1.159 1491 3HG2 THR 13 3HG2 THR 13 -11.039 -2.817 -2.320 1492 H HIS 14 H HIS 14 -12.231 -1.597 -2.937 1493 HA HIS 14 HA HIS 14 -13.941 -0.448 -4.788 1494 1HB HIS 14 1HB HIS 14 -14.067 -2.593 -3.080 1495 2HB HIS 14 2HB HIS 14 -15.307 -1.529 -2.425 1496 HD1 HIS 14 HD1 HIS 14 -14.348 -2.712 -5.923 1497 HD2 HIS 14 HD2 HIS 14 -17.694 -2.062 -3.547 1498 HE1 HIS 14 HE1 HIS 14 -16.317 -3.368 -7.343 1499 HE2 HIS 14 HE2 HIS 14 -18.333 -2.967 -5.885 1500 H ASN 15 H ASN 15 -14.184 -0.041 -1.245 1501 HA ASN 15 HA ASN 15 -16.092 1.988 -1.295 1502 1HB ASN 15 1HB ASN 15 -15.207 0.617 0.703 1503 2HB ASN 15 2HB ASN 15 -15.662 2.293 0.990 1504 2HD2 ASN 15 2HD2 ASN 15 -12.857 0.318 0.115 1505 1HD2 ASN 15 1HD2 ASN 15 -11.712 1.230 1.032 1506 H GLY 16 H GLY 16 -12.633 2.112 -1.737 1507 1HA GLY 16 1HA GLY 16 -11.773 3.941 -3.097 1508 2HA GLY 16 2HA GLY 16 -12.877 5.010 -2.247 1509 H LYS 17 H LYS 17 -11.150 2.608 -0.426 1510 HA LYS 17 HA LYS 17 -9.756 4.716 0.992 1511 1HB LYS 17 1HB LYS 17 -10.837 2.662 2.098 1512 2HB LYS 17 2HB LYS 17 -9.236 3.133 2.648 1513 1HG LYS 17 1HG LYS 17 -9.523 1.054 0.521 1514 2HG LYS 17 2HG LYS 17 -8.223 1.306 1.683 1515 1HD LYS 17 1HD LYS 17 -9.236 0.087 3.277 1516 2HD LYS 17 2HD LYS 17 -10.829 0.745 2.900 1517 1HE LYS 17 1HE LYS 17 -10.616 -0.735 0.761 1518 2HE LYS 17 2HE LYS 17 -9.417 -1.605 1.718 1519 1HZ LYS 17 1HZ LYS 17 -11.120 -1.891 3.449 1520 2HZ LYS 17 2HZ LYS 17 -12.261 -1.156 2.440 1521 3HZ LYS 17 3HZ LYS 17 -11.555 -2.626 1.988 1522 H THR 18 H THR 18 -7.756 5.358 0.546 1523 HA THR 18 HA THR 18 -6.317 4.278 -1.658 1524 HB THR 18 HB THR 18 -4.851 5.927 0.328 1525 HG1 THR 18 HG1 THR 18 -7.301 6.646 -0.769 1526 1HG2 THR 18 1HG2 THR 18 -3.913 5.322 -1.874 1527 2HG2 THR 18 2HG2 THR 18 -5.239 6.185 -2.653 1528 3HG2 THR 18 3HG2 THR 18 -4.074 7.067 -1.665 1529 H TYR 19 H TYR 19 -6.205 2.050 -1.003 1530 HA TYR 19 HA TYR 19 -4.587 1.432 1.316 1531 1HB TYR 19 1HB TYR 19 -5.639 -0.563 1.360 1532 2HB TYR 19 2HB TYR 19 -6.790 0.230 0.291 1533 HD1 TYR 19 HD1 TYR 19 -6.496 -0.096 -2.221 1534 HD2 TYR 19 HD2 TYR 19 -4.462 -2.472 0.663 1535 HE1 TYR 19 HE1 TYR 19 -6.084 -1.810 -3.933 1536 HE2 TYR 19 HE2 TYR 19 -4.046 -4.194 -1.042 1537 HH TYR 19 HH TYR 19 -5.346 -3.889 -4.321 1538 H TYR 20 H TYR 20 -2.631 0.555 1.341 1539 HA TYR 20 HA TYR 20 -1.156 0.444 -1.192 1540 1HB TYR 20 1HB TYR 20 0.003 0.459 1.602 1541 2HB TYR 20 2HB TYR 20 0.837 0.812 0.093 1542 HD1 TYR 20 HD1 TYR 20 -1.692 2.093 2.473 1543 HD2 TYR 20 HD2 TYR 20 0.862 3.005 -0.803 1544 HE1 TYR 20 HE1 TYR 20 -2.154 4.486 2.790 1545 HE2 TYR 20 HE2 TYR 20 0.407 5.402 -0.496 1546 HH TYR 20 HH TYR 20 -2.091 6.555 1.532 1547 H TYR 21 H TYR 21 -0.170 -1.456 -1.843 1548 HA TYR 21 HA TYR 21 -0.500 -3.786 -0.074 1549 1HB TYR 21 1HB TYR 21 -2.249 -3.796 -1.792 1550 2HB TYR 21 2HB TYR 21 -1.025 -3.687 -3.053 1551 HD1 TYR 21 HD1 TYR 21 -0.175 -5.632 -4.009 1552 HD2 TYR 21 HD2 TYR 21 -2.122 -5.866 -0.233 1553 HE1 TYR 21 HE1 TYR 21 -0.038 -8.085 -4.096 1554 HE2 TYR 21 HE2 TYR 21 -1.990 -8.320 -0.311 1555 HH TYR 21 HH TYR 21 -0.933 -10.077 -1.362 1556 H ASN 22 H ASN 22 1.055 -5.357 -0.131 1557 HA ASN 22 HA ASN 22 3.489 -4.712 -1.662 1558 1HB ASN 22 1HB ASN 22 3.534 -4.713 0.920 1559 2HB ASN 22 2HB ASN 22 3.424 -6.465 0.786 1560 2HD2 ASN 22 2HD2 ASN 22 5.560 -5.421 2.021 1561 1HD2 ASN 22 1HD2 ASN 22 6.975 -5.582 1.043 1562 H HIS 23 H HIS 23 3.901 -6.042 -3.295 1563 HA HIS 23 HA HIS 23 2.540 -8.598 -3.453 1564 1HB HIS 23 1HB HIS 23 2.560 -8.242 -5.656 1565 2HB HIS 23 2HB HIS 23 4.308 -8.058 -5.676 1566 HD1 HIS 23 HD1 HIS 23 1.410 -5.866 -4.523 1567 HD2 HIS 23 HD2 HIS 23 4.940 -5.645 -6.701 1568 HE1 HIS 23 HE1 HIS 23 1.586 -3.475 -5.271 1569 HE2 HIS 23 HE2 HIS 23 3.730 -3.360 -6.590 1570 H ASN 24 H ASN 24 5.321 -7.653 -2.057 1571 HA ASN 24 HA ASN 24 6.942 -9.905 -2.975 1572 1HB ASN 24 1HB ASN 24 7.614 -7.717 -0.994 1573 2HB ASN 24 2HB ASN 24 8.734 -8.921 -1.622 1574 2HD2 ASN 24 2HD2 ASN 24 8.998 -6.091 -1.786 1575 1HD2 ASN 24 1HD2 ASN 24 9.014 -5.673 -3.462 1576 H THR 25 H THR 25 4.989 -8.868 -0.319 1577 HA THR 25 HA THR 25 5.504 -11.426 1.032 1578 HB THR 25 HB THR 25 5.600 -10.445 3.184 1579 HG1 THR 25 HG1 THR 25 4.327 -8.362 1.929 1580 1HG2 THR 25 1HG2 THR 25 7.254 -9.006 1.143 1581 2HG2 THR 25 2HG2 THR 25 7.382 -8.583 2.852 1582 3HG2 THR 25 3HG2 THR 25 7.746 -10.225 2.321 1583 H LYS 26 H LYS 26 3.330 -9.750 -0.587 1584 HA LYS 26 HA LYS 26 1.066 -9.611 -0.689 1585 1HB LYS 26 1HB LYS 26 -0.152 -11.568 -0.123 1586 2HB LYS 26 2HB LYS 26 1.012 -12.029 1.112 1587 1HG LYS 26 1HG LYS 26 2.662 -12.132 -0.916 1588 2HG LYS 26 2HG LYS 26 1.564 -13.472 -0.582 1589 1HD LYS 26 1HD LYS 26 -0.041 -12.470 -2.203 1590 2HD LYS 26 2HD LYS 26 1.198 -11.283 -2.611 1591 1HE LYS 26 1HE LYS 26 2.261 -12.717 -3.932 1592 2HE LYS 26 2HE LYS 26 2.251 -13.957 -2.680 1593 1HZ LYS 26 1HZ LYS 26 -0.321 -13.578 -3.882 1594 2HZ LYS 26 2HZ LYS 26 0.853 -14.038 -5.011 1595 3HZ LYS 26 3HZ LYS 26 0.560 -15.003 -3.652 1596 H THR 27 H THR 27 1.332 -7.643 0.649 1597 HA THR 27 HA THR 27 -0.083 -7.960 3.220 1598 HB THR 27 HB THR 27 2.045 -5.882 2.726 1599 HG1 THR 27 HG1 THR 27 3.204 -7.347 4.281 1600 1HG2 THR 27 1HG2 THR 27 0.651 -6.839 5.228 1601 2HG2 THR 27 2HG2 THR 27 1.979 -5.678 5.185 1602 3HG2 THR 27 3HG2 THR 27 0.433 -5.278 4.435 1603 H SER 28 H SER 28 -2.036 -7.082 3.024 1604 HA SER 28 HA SER 28 -2.341 -4.669 1.369 1605 1HB SER 28 1HB SER 28 -3.741 -6.481 0.601 1606 2HB SER 28 2HB SER 28 -4.369 -6.744 2.227 1607 HG SER 28 HG SER 28 -5.762 -5.213 1.904 1608 H THR 29 H THR 29 -2.694 -2.794 2.333 1609 HA THR 29 HA THR 29 -4.244 -2.629 4.781 1610 HB THR 29 HB THR 29 -1.874 -2.997 5.534 1611 HG1 THR 29 HG1 THR 29 -1.965 -1.188 7.005 1612 1HG2 THR 29 1HG2 THR 29 -1.454 -0.717 3.737 1613 2HG2 THR 29 2HG2 THR 29 -0.679 -0.561 5.314 1614 3HG2 THR 29 3HG2 THR 29 -0.321 -1.951 4.290 1615 H TRP 30 H TRP 30 -4.473 -0.223 5.432 1616 HA TRP 30 HA TRP 30 -4.713 1.333 2.946 1617 1HB TRP 30 1HB TRP 30 -6.113 2.634 5.050 1618 2HB TRP 30 2HB TRP 30 -6.773 1.875 3.608 1619 HD1 TRP 30 HD1 TRP 30 -7.043 1.715 7.221 1620 HE1 TRP 30 HE1 TRP 30 -8.156 -0.477 7.986 1621 HE3 TRP 30 HE3 TRP 30 -6.695 -0.927 2.866 1622 HZ2 TRP 30 HZ2 TRP 30 -8.804 -2.994 6.881 1623 HZ3 TRP 30 HZ3 TRP 30 -7.583 -3.221 2.799 1624 HH2 TRP 30 HH2 TRP 30 -8.617 -4.231 4.766 1625 H THR 31 H THR 31 -2.941 1.080 5.791 1626 HA THR 31 HA THR 31 -2.291 3.903 6.019 1627 HB THR 31 HB THR 31 -0.800 1.694 7.405 1628 HG1 THR 31 HG1 THR 31 -2.388 1.781 9.040 1629 1HG2 THR 31 1HG2 THR 31 -0.665 4.495 7.445 1630 2HG2 THR 31 2HG2 THR 31 -1.423 4.025 8.966 1631 3HG2 THR 31 3HG2 THR 31 0.151 3.365 8.525 1632 H ASP 32 H ASP 32 -0.347 4.822 5.599 1633 HA ASP 32 HA ASP 32 0.950 4.078 3.264 1634 1HB ASP 32 1HB ASP 32 2.527 5.834 3.785 1635 2HB ASP 32 2HB ASP 32 0.916 6.359 4.239 1636 HA PRO 33 HA PRO 33 3.633 0.840 4.722 1637 1HB PRO 33 1HB PRO 33 5.186 0.601 2.517 1638 2HB PRO 33 2HB PRO 33 3.531 -0.005 2.590 1639 1HG PRO 33 1HG PRO 33 4.566 2.538 1.400 1640 2HG PRO 33 2HG PRO 33 3.377 1.398 0.745 1641 1HD PRO 33 1HD PRO 33 2.669 3.710 1.965 1642 2HD PRO 33 2HD PRO 33 1.667 2.244 2.029 1643 H ARG 34 H ARG 34 4.785 3.871 3.456 1644 HA ARG 34 HA ARG 34 7.501 3.697 4.060 1645 1HB ARG 34 1HB ARG 34 5.782 6.172 4.293 1646 2HB ARG 34 2HB ARG 34 7.518 6.118 4.026 1647 1HG ARG 34 1HG ARG 34 6.269 4.607 1.981 1648 2HG ARG 34 2HG ARG 34 5.430 6.154 2.116 1649 1HD ARG 34 1HD ARG 34 8.413 5.813 1.842 1650 2HD ARG 34 2HD ARG 34 7.315 6.225 0.526 1651 HE ARG 34 HE ARG 34 7.990 7.944 2.811 1652 1HH1 ARG 34 1HH1 ARG 34 6.553 7.501 -0.333 1653 2HH1 ARG 34 2HH1 ARG 34 6.352 9.197 -0.622 1654 1HH2 ARG 34 1HH2 ARG 34 7.731 10.177 2.438 1655 2HH2 ARG 34 2HH2 ARG 34 7.021 10.718 0.954 1656 H MET 35 H MET 35 4.763 3.959 6.105 1657 HA MET 35 HA MET 35 4.457 4.326 8.338 1658 1HB MET 35 1HB MET 35 6.442 2.293 7.823 1659 2HB MET 35 2HB MET 35 6.668 3.011 9.414 1660 1HG MET 35 1HG MET 35 4.607 2.325 10.166 1661 2HG MET 35 2HG MET 35 3.967 2.104 8.538 1662 1HE MET 35 1HE MET 35 2.977 0.060 8.593 1663 2HE MET 35 2HE MET 35 3.705 -1.526 8.854 1664 3HE MET 35 3HE MET 35 3.238 -0.532 10.234 1665 H SER 36 H SER 36 4.773 6.575 8.469 1666 HA SER 36 HA SER 36 7.242 7.865 8.723 1667 1HB SER 36 1HB SER 36 4.471 8.596 9.663 1668 2HB SER 36 2HB SER 36 5.854 9.665 9.899 1669 HG SER 36 HG SER 36 4.866 8.690 7.424 1670 H SER 37 H SER 37 5.043 6.608 11.210 1671 HA SER 37 HA SER 37 7.283 6.714 13.116 1672 1HB SER 37 1HB SER 37 5.440 8.457 13.496 1673 2HB SER 37 2HB SER 37 4.406 7.099 13.940 1674 HG SER 37 HG SER 37 5.476 8.068 15.746 1675 H1 SER 1 H1 SER 1 13.383 6.271 -8.517 1676 H2 SER 1 H2 SER 1 13.092 7.230 -9.880 1677 H3 SER 1 H3 SER 1 13.803 7.909 -8.503 1678 HA SER 1 HA SER 1 11.561 8.603 -8.514 1679 1HB SER 1 1HB SER 1 11.153 6.300 -9.941 1680 2HB SER 1 2HB SER 1 10.410 5.891 -8.394 1681 HG SER 1 HG SER 1 8.794 7.071 -8.993 1682 H MET 2 H MET 2 10.840 9.117 -6.538 1683 HA MET 2 HA MET 2 11.624 7.374 -4.306 1684 1HB MET 2 1HB MET 2 11.220 9.471 -2.926 1685 2HB MET 2 2HB MET 2 12.589 9.516 -4.029 1686 1HG MET 2 1HG MET 2 11.437 10.897 -5.557 1687 2HG MET 2 2HG MET 2 9.897 10.638 -4.740 1688 1HE MET 2 1HE MET 2 8.889 12.383 -3.799 1689 2HE MET 2 2HE MET 2 9.364 11.908 -2.169 1690 3HE MET 2 3HE MET 2 9.529 13.588 -2.682 1691 H GLY 3 H GLY 3 10.161 6.758 -2.734 1692 1HA GLY 3 1HA GLY 3 7.702 7.605 -2.081 1693 2HA GLY 3 2HA GLY 3 7.385 6.745 -3.584 1694 H LEU 4 H LEU 4 6.184 5.095 -2.720 1695 HA LEU 4 HA LEU 4 6.789 3.649 -0.390 1696 1HB LEU 4 1HB LEU 4 5.056 2.238 -0.992 1697 2HB LEU 4 2HB LEU 4 5.427 2.344 -2.701 1698 HG LEU 4 HG LEU 4 4.644 4.845 -2.389 1699 1HD1 LEU 4 1HD1 LEU 4 3.521 2.500 -3.383 1700 2HD1 LEU 4 2HD1 LEU 4 2.254 3.230 -2.398 1701 3HD1 LEU 4 3HD1 LEU 4 2.994 4.153 -3.706 1702 1HD2 LEU 4 1HD2 LEU 4 4.349 4.258 0.142 1703 2HD2 LEU 4 2HD2 LEU 4 3.178 5.288 -0.682 1704 3HD2 LEU 4 3HD2 LEU 4 2.813 3.585 -0.408 1705 HA PRO 5 HA PRO 5 10.176 0.968 -1.290 1706 1HB PRO 5 1HB PRO 5 10.032 -0.833 0.133 1707 2HB PRO 5 2HB PRO 5 8.411 -1.269 -0.417 1708 1HG PRO 5 1HG PRO 5 7.880 -0.313 1.624 1709 2HG PRO 5 2HG PRO 5 9.253 0.803 1.561 1710 1HD PRO 5 1HD PRO 5 7.640 2.300 0.913 1711 2HD PRO 5 2HD PRO 5 6.568 1.025 0.301 1712 HA PRO 6 HA PRO 6 9.764 -0.983 -5.245 1713 1HB PRO 6 1HB PRO 6 10.830 -3.508 -4.761 1714 2HB PRO 6 2HB PRO 6 11.761 -2.069 -5.187 1715 1HG PRO 6 1HG PRO 6 12.725 -2.546 -3.131 1716 2HG PRO 6 2HG PRO 6 11.233 -3.261 -2.494 1717 1HD PRO 6 1HD PRO 6 11.181 -1.180 -1.448 1718 2HD PRO 6 2HD PRO 6 11.953 -0.365 -2.827 1719 H GLY 7 H GLY 7 8.761 -2.871 -2.443 1720 1HA GLY 7 1HA GLY 7 6.708 -4.176 -4.116 1721 2HA GLY 7 2HA GLY 7 7.357 -4.852 -2.630 1722 H TRP 8 H TRP 8 5.986 -1.679 -3.504 1723 HA TRP 8 HA TRP 8 3.710 -2.101 -1.783 1724 1HB TRP 8 1HB TRP 8 5.977 -0.308 -1.008 1725 2HB TRP 8 2HB TRP 8 4.335 0.199 -0.619 1726 HD1 TRP 8 HD1 TRP 8 7.104 -1.788 0.750 1727 HE1 TRP 8 HE1 TRP 8 6.310 -3.199 2.743 1728 HE3 TRP 8 HE3 TRP 8 2.059 -1.283 0.134 1729 HZ2 TRP 8 HZ2 TRP 8 3.855 -3.995 3.913 1730 HZ3 TRP 8 HZ3 TRP 8 0.555 -2.401 1.739 1731 HH2 TRP 8 HH2 TRP 8 1.439 -3.723 3.585 1732 H ASP 9 H ASP 9 2.140 -1.475 -3.114 1733 HA ASP 9 HA ASP 9 2.515 1.038 -4.617 1734 1HB ASP 9 1HB ASP 9 0.936 -1.420 -5.413 1735 2HB ASP 9 2HB ASP 9 0.940 0.100 -6.303 1736 H GLU 10 H GLU 10 0.594 2.326 -4.969 1737 HA GLU 10 HA GLU 10 -1.351 1.968 -2.792 1738 1HB GLU 10 1HB GLU 10 -1.480 4.281 -2.541 1739 2HB GLU 10 2HB GLU 10 0.224 4.007 -2.862 1740 1HG GLU 10 1HG GLU 10 0.085 4.863 -5.021 1741 2HG GLU 10 2HG GLU 10 -1.670 4.704 -5.071 1742 H TYR 11 H TYR 11 -3.522 2.147 -3.155 1743 HA TYR 11 HA TYR 11 -4.644 3.048 -5.607 1744 1HB TYR 11 1HB TYR 11 -3.960 0.222 -5.368 1745 2HB TYR 11 2HB TYR 11 -5.676 0.470 -5.674 1746 HD1 TYR 11 HD1 TYR 11 -6.159 2.273 -7.594 1747 HD2 TYR 11 HD2 TYR 11 -2.581 0.005 -7.201 1748 HE1 TYR 11 HE1 TYR 11 -5.691 2.609 -9.984 1749 HE2 TYR 11 HE2 TYR 11 -2.103 0.335 -9.591 1750 HH TYR 11 HH TYR 11 -3.821 0.879 -11.755 1751 H LYS 12 H LYS 12 -6.908 3.212 -5.522 1752 HA LYS 12 HA LYS 12 -7.967 3.091 -2.813 1753 1HB LYS 12 1HB LYS 12 -8.719 4.495 -5.328 1754 2HB LYS 12 2HB LYS 12 -9.995 4.155 -4.170 1755 1HG LYS 12 1HG LYS 12 -8.697 5.331 -2.435 1756 2HG LYS 12 2HG LYS 12 -7.496 5.744 -3.659 1757 1HD LYS 12 1HD LYS 12 -10.387 6.442 -4.034 1758 2HD LYS 12 2HD LYS 12 -9.313 7.479 -3.091 1759 1HE LYS 12 1HE LYS 12 -8.438 8.351 -4.937 1760 2HE LYS 12 2HE LYS 12 -8.061 6.749 -5.569 1761 1HZ LYS 12 1HZ LYS 12 -10.786 7.880 -5.740 1762 2HZ LYS 12 2HZ LYS 12 -9.620 8.196 -6.923 1763 3HZ LYS 12 3HZ LYS 12 -10.119 6.607 -6.631 1764 H THR 13 H THR 13 -9.233 1.510 -2.111 1765 HA THR 13 HA THR 13 -10.063 -0.604 -3.867 1766 HB THR 13 HB THR 13 -11.325 -0.596 -1.232 1767 HG1 THR 13 HG1 THR 13 -8.526 -0.236 -1.491 1768 1HG2 THR 13 1HG2 THR 13 -9.488 -2.446 -2.741 1769 2HG2 THR 13 2HG2 THR 13 -10.109 -2.800 -1.129 1770 3HG2 THR 13 3HG2 THR 13 -11.223 -2.618 -2.483 1771 H HIS 14 H HIS 14 -12.556 -1.307 -2.785 1772 HA HIS 14 HA HIS 14 -14.312 0.083 -4.453 1773 1HB HIS 14 1HB HIS 14 -14.441 -2.151 -2.717 1774 2HB HIS 14 2HB HIS 14 -15.761 -1.078 -2.265 1775 HD1 HIS 14 HD1 HIS 14 -14.367 -2.206 -5.632 1776 HD2 HIS 14 HD2 HIS 14 -17.971 -1.847 -3.595 1777 HE1 HIS 14 HE1 HIS 14 -16.133 -2.979 -7.248 1778 HE2 HIS 14 HE2 HIS 14 -18.307 -2.753 -5.993 1779 H ASN 15 H ASN 15 -13.882 0.320 -0.926 1780 HA ASN 15 HA ASN 15 -15.808 2.344 -0.530 1781 1HB ASN 15 1HB ASN 15 -14.013 0.856 1.071 1782 2HB ASN 15 2HB ASN 15 -13.709 2.558 1.396 1783 2HD2 ASN 15 2HD2 ASN 15 -14.512 1.681 3.529 1784 1HD2 ASN 15 1HD2 ASN 15 -16.210 1.814 3.823 1785 H GLY 16 H GLY 16 -12.663 2.400 -1.850 1786 1HA GLY 16 1HA GLY 16 -11.792 4.250 -3.034 1787 2HA GLY 16 2HA GLY 16 -12.801 5.317 -2.069 1788 H LYS 17 H LYS 17 -11.097 2.906 -0.321 1789 HA LYS 17 HA LYS 17 -9.458 4.950 0.915 1790 1HB LYS 17 1HB LYS 17 -10.585 3.015 2.172 1791 2HB LYS 17 2HB LYS 17 -8.917 3.382 2.584 1792 1HG LYS 17 1HG LYS 17 -9.203 1.365 0.485 1793 2HG LYS 17 2HG LYS 17 -8.190 1.379 1.930 1794 1HD LYS 17 1HD LYS 17 -9.635 -0.339 2.426 1795 2HD LYS 17 2HD LYS 17 -10.468 1.028 3.170 1796 1HE LYS 17 1HE LYS 17 -11.924 1.235 1.259 1797 2HE LYS 17 2HE LYS 17 -11.040 -0.030 0.407 1798 1HZ LYS 17 1HZ LYS 17 -11.700 -1.358 2.578 1799 2HZ LYS 17 2HZ LYS 17 -12.983 -0.257 2.569 1800 3HZ LYS 17 3HZ LYS 17 -12.724 -1.265 1.236 1801 H THR 18 H THR 18 -7.485 5.467 0.263 1802 HA THR 18 HA THR 18 -6.262 4.130 -1.948 1803 HB THR 18 HB THR 18 -4.705 6.014 -0.228 1804 HG1 THR 18 HG1 THR 18 -6.812 6.944 -0.399 1805 1HG2 THR 18 1HG2 THR 18 -3.954 4.899 -2.437 1806 2HG2 THR 18 2HG2 THR 18 -5.021 6.074 -3.208 1807 3HG2 THR 18 3HG2 THR 18 -3.667 6.626 -2.222 1808 H TYR 19 H TYR 19 -6.236 1.999 -0.923 1809 HA TYR 19 HA TYR 19 -4.485 1.578 1.308 1810 1HB TYR 19 1HB TYR 19 -5.412 -0.499 1.462 1811 2HB TYR 19 2HB TYR 19 -6.680 0.284 0.525 1812 HD1 TYR 19 HD1 TYR 19 -6.681 -0.048 -1.997 1813 HD2 TYR 19 HD2 TYR 19 -4.299 -2.391 0.637 1814 HE1 TYR 19 HE1 TYR 19 -6.458 -1.769 -3.739 1815 HE2 TYR 19 HE2 TYR 19 -4.069 -4.118 -1.097 1816 HH TYR 19 HH TYR 19 -5.987 -4.218 -3.860 1817 H TYR 20 H TYR 20 -2.554 0.579 1.364 1818 HA TYR 20 HA TYR 20 -1.096 0.407 -1.173 1819 1HB TYR 20 1HB TYR 20 0.912 0.743 0.104 1820 2HB TYR 20 2HB TYR 20 0.062 0.464 1.621 1821 HD1 TYR 20 HD1 TYR 20 -1.569 2.174 2.445 1822 HD2 TYR 20 HD2 TYR 20 0.963 2.894 -0.896 1823 HE1 TYR 20 HE1 TYR 20 -1.977 4.589 2.665 1824 HE2 TYR 20 HE2 TYR 20 0.562 5.312 -0.685 1825 HH TYR 20 HH TYR 20 -0.573 6.905 0.371 1826 H TYR 21 H TYR 21 -0.144 -1.499 -1.810 1827 HA TYR 21 HA TYR 21 -0.543 -3.820 -0.043 1828 1HB TYR 21 1HB TYR 21 -2.193 -3.773 -1.881 1829 2HB TYR 21 2HB TYR 21 -0.876 -3.752 -3.049 1830 HD1 TYR 21 HD1 TYR 21 0.210 -5.754 -3.702 1831 HD2 TYR 21 HD2 TYR 21 -2.520 -5.796 -0.439 1832 HE1 TYR 21 HE1 TYR 21 0.250 -8.213 -3.708 1833 HE2 TYR 21 HE2 TYR 21 -2.489 -8.255 -0.438 1834 HH TYR 21 HH TYR 21 -1.914 -10.090 -2.457 1835 H ASN 22 H ASN 22 0.966 -5.444 -0.078 1836 HA ASN 22 HA ASN 22 3.530 -4.798 -1.380 1837 1HB ASN 22 1HB ASN 22 3.431 -4.886 1.163 1838 2HB ASN 22 2HB ASN 22 3.119 -6.610 1.007 1839 2HD2 ASN 22 2HD2 ASN 22 5.335 -5.327 2.298 1840 1HD2 ASN 22 1HD2 ASN 22 6.766 -5.862 1.490 1841 H HIS 23 H HIS 23 3.613 -5.933 -3.236 1842 HA HIS 23 HA HIS 23 2.319 -8.462 -3.539 1843 1HB HIS 23 1HB HIS 23 2.954 -8.295 -5.820 1844 2HB HIS 23 2HB HIS 23 4.252 -7.171 -5.461 1845 HD1 HIS 23 HD1 HIS 23 3.212 -4.818 -4.290 1846 HD2 HIS 23 HD2 HIS 23 0.793 -7.043 -6.834 1847 HE1 HIS 23 HE1 HIS 23 1.408 -3.243 -5.051 1848 HE2 HIS 23 HE2 HIS 23 -0.045 -4.608 -6.591 1849 H ASN 24 H ASN 24 5.201 -7.667 -2.131 1850 HA ASN 24 HA ASN 24 6.646 -10.002 -3.139 1851 1HB ASN 24 1HB ASN 24 7.530 -7.801 -1.259 1852 2HB ASN 24 2HB ASN 24 8.554 -9.113 -1.836 1853 2HD2 ASN 24 2HD2 ASN 24 8.979 -6.316 -2.161 1854 1HD2 ASN 24 1HD2 ASN 24 8.998 -5.996 -3.857 1855 H THR 25 H THR 25 4.898 -8.894 -0.371 1856 HA THR 25 HA THR 25 5.461 -11.452 0.965 1857 HB THR 25 HB THR 25 5.669 -10.453 3.102 1858 HG1 THR 25 HG1 THR 25 5.337 -7.830 2.169 1859 1HG2 THR 25 1HG2 THR 25 7.247 -9.140 0.938 1860 2HG2 THR 25 2HG2 THR 25 7.419 -8.549 2.592 1861 3HG2 THR 25 3HG2 THR 25 7.779 -10.234 2.217 1862 H LYS 26 H LYS 26 3.226 -9.910 -0.607 1863 HA LYS 26 HA LYS 26 0.962 -9.745 -0.609 1864 1HB LYS 26 1HB LYS 26 -0.165 -11.718 -0.121 1865 2HB LYS 26 2HB LYS 26 0.825 -12.055 1.292 1866 1HG LYS 26 1HG LYS 26 2.727 -12.553 -0.222 1867 2HG LYS 26 2HG LYS 26 1.352 -13.646 -0.409 1868 1HD LYS 26 1HD LYS 26 1.544 -11.228 -2.148 1869 2HD LYS 26 2HD LYS 26 2.541 -12.638 -2.512 1870 1HE LYS 26 1HE LYS 26 0.796 -13.816 -3.267 1871 2HE LYS 26 2HE LYS 26 -0.233 -13.305 -1.930 1872 1HZ LYS 26 1HZ LYS 26 0.024 -11.059 -3.438 1873 2HZ LYS 26 2HZ LYS 26 -0.077 -12.282 -4.602 1874 3HZ LYS 26 3HZ LYS 26 -1.304 -12.107 -3.451 1875 H THR 27 H THR 27 1.517 -7.767 0.802 1876 HA THR 27 HA THR 27 0.091 -8.028 3.376 1877 HB THR 27 HB THR 27 2.251 -6.016 2.748 1878 HG1 THR 27 HG1 THR 27 2.421 -8.603 3.487 1879 1HG2 THR 27 1HG2 THR 27 0.269 -5.824 4.605 1880 2HG2 THR 27 2HG2 THR 27 1.535 -6.635 5.529 1881 3HG2 THR 27 3HG2 THR 27 1.862 -5.082 4.761 1882 H SER 28 H SER 28 -1.907 -7.258 3.072 1883 HA SER 28 HA SER 28 -2.279 -4.870 1.414 1884 1HB SER 28 1HB SER 28 -4.763 -5.941 2.355 1885 2HB SER 28 2HB SER 28 -4.143 -5.889 0.704 1886 HG SER 28 HG SER 28 -3.768 -7.915 2.645 1887 H THR 29 H THR 29 -2.607 -2.953 2.308 1888 HA THR 29 HA THR 29 -4.036 -2.686 4.820 1889 HB THR 29 HB THR 29 -1.604 -3.024 5.436 1890 HG1 THR 29 HG1 THR 29 -3.171 -0.799 6.129 1891 1HG2 THR 29 1HG2 THR 29 -1.367 -0.588 3.744 1892 2HG2 THR 29 2HG2 THR 29 -0.348 -0.717 5.177 1893 3HG2 THR 29 3HG2 THR 29 -0.265 -1.953 3.921 1894 H TRP 30 H TRP 30 -4.414 -0.320 5.338 1895 HA TRP 30 HA TRP 30 -4.637 1.172 2.814 1896 1HB TRP 30 1HB TRP 30 -6.089 2.493 4.876 1897 2HB TRP 30 2HB TRP 30 -6.710 1.709 3.429 1898 HD1 TRP 30 HD1 TRP 30 -6.894 1.514 7.087 1899 HE1 TRP 30 HE1 TRP 30 -8.047 -0.667 7.825 1900 HE3 TRP 30 HE3 TRP 30 -6.778 -0.989 2.646 1901 HZ2 TRP 30 HZ2 TRP 30 -8.810 -3.129 6.666 1902 HZ3 TRP 30 HZ3 TRP 30 -7.740 -3.256 2.537 1903 HH2 TRP 30 HH2 TRP 30 -8.735 -4.300 4.507 1904 H THR 31 H THR 31 -2.901 1.037 5.694 1905 HA THR 31 HA THR 31 -2.340 3.881 5.860 1906 HB THR 31 HB THR 31 -0.799 1.799 7.368 1907 HG1 THR 31 HG1 THR 31 -3.016 2.733 8.675 1908 1HG2 THR 31 1HG2 THR 31 -0.591 4.472 7.354 1909 2HG2 THR 31 2HG2 THR 31 -1.824 4.284 8.601 1910 3HG2 THR 31 3HG2 THR 31 -0.259 3.490 8.781 1911 H ASP 32 H ASP 32 -0.358 4.842 5.471 1912 HA ASP 32 HA ASP 32 1.032 4.045 3.208 1913 1HB ASP 32 1HB ASP 32 0.974 6.314 4.630 1914 2HB ASP 32 2HB ASP 32 2.509 5.674 5.209 1915 HA PRO 33 HA PRO 33 3.603 0.781 4.769 1916 1HB PRO 33 1HB PRO 33 5.270 0.570 2.620 1917 2HB PRO 33 2HB PRO 33 3.632 -0.086 2.655 1918 1HG PRO 33 1HG PRO 33 4.635 2.454 1.444 1919 2HG PRO 33 2HG PRO 33 3.461 1.292 0.804 1920 1HD PRO 33 1HD PRO 33 2.728 3.625 1.967 1921 2HD PRO 33 2HD PRO 33 1.736 2.156 2.048 1922 H ARG 34 H ARG 34 4.892 3.803 3.602 1923 HA ARG 34 HA ARG 34 7.508 3.352 4.754 1924 1HB ARG 34 1HB ARG 34 6.286 5.854 3.574 1925 2HB ARG 34 2HB ARG 34 7.972 5.665 4.032 1926 1HG ARG 34 1HG ARG 34 7.318 3.537 2.295 1927 2HG ARG 34 2HG ARG 34 6.703 5.027 1.576 1928 1HD ARG 34 1HD ARG 34 9.473 4.932 2.703 1929 2HD ARG 34 2HD ARG 34 9.149 4.272 1.100 1930 HE ARG 34 HE ARG 34 8.450 6.475 0.410 1931 1HH1 ARG 34 1HH1 ARG 34 10.080 6.289 3.486 1932 2HH1 ARG 34 2HH1 ARG 34 10.544 7.958 3.485 1933 1HH2 ARG 34 1HH2 ARG 34 9.057 8.671 0.402 1934 2HH2 ARG 34 2HH2 ARG 34 9.963 9.311 1.733 1935 H MET 35 H MET 35 4.476 4.611 5.720 1936 HA MET 35 HA MET 35 5.525 6.220 7.878 1937 1HB MET 35 1HB MET 35 2.842 5.637 6.762 1938 2HB MET 35 2HB MET 35 2.958 6.232 8.415 1939 1HG MET 35 1HG MET 35 2.788 7.821 6.292 1940 2HG MET 35 2HG MET 35 3.597 8.276 7.785 1941 1HE MET 35 1HE MET 35 3.465 8.777 4.608 1942 2HE MET 35 2HE MET 35 5.056 9.448 4.248 1943 3HE MET 35 3HE MET 35 4.641 7.824 3.703 1944 H SER 36 H SER 36 3.002 3.718 7.970 1945 HA SER 36 HA SER 36 2.490 2.122 9.504 1946 1HB SER 36 1HB SER 36 5.456 1.978 9.255 1947 2HB SER 36 2HB SER 36 4.704 1.079 10.572 1948 HG SER 36 HG SER 36 3.394 0.766 8.202 1949 H SER 37 H SER 37 1.715 4.137 10.702 1950 HA SER 37 HA SER 37 2.716 3.957 13.426 1951 1HB SER 37 1HB SER 37 2.621 6.542 11.860 1952 2HB SER 37 2HB SER 37 2.699 6.483 13.621 1953 HG SER 37 HG SER 37 4.619 5.027 13.130 1954 H1 SER 1 H1 SER 1 13.907 5.503 -7.466 1955 H2 SER 1 H2 SER 1 12.802 4.343 -8.007 1956 H3 SER 1 H3 SER 1 12.984 5.797 -8.853 1957 HA SER 1 HA SER 1 11.767 7.001 -7.403 1958 1HB SER 1 1HB SER 1 9.777 5.824 -7.021 1959 2HB SER 1 2HB SER 1 10.546 4.874 -8.293 1960 HG SER 1 HG SER 1 9.756 3.588 -6.548 1961 H MET 2 H MET 2 11.456 7.787 -5.352 1962 HA MET 2 HA MET 2 12.894 6.378 -3.201 1963 1HB MET 2 1HB MET 2 12.585 9.288 -3.854 1964 2HB MET 2 2HB MET 2 12.891 8.794 -2.195 1965 1HG MET 2 1HG MET 2 14.924 7.621 -2.958 1966 2HG MET 2 2HG MET 2 14.632 8.235 -4.583 1967 1HE MET 2 1HE MET 2 16.353 9.788 -5.280 1968 2HE MET 2 2HE MET 2 17.324 10.791 -4.201 1969 3HE MET 2 3HE MET 2 17.368 9.033 -4.050 1970 H GLY 3 H GLY 3 9.920 6.557 -4.208 1971 1HA GLY 3 1HA GLY 3 8.572 7.541 -1.840 1972 2HA GLY 3 2HA GLY 3 7.811 6.830 -3.261 1973 H LEU 4 H LEU 4 6.741 5.047 -2.790 1974 HA LEU 4 HA LEU 4 7.071 3.600 -0.387 1975 1HB LEU 4 1HB LEU 4 5.782 2.400 -2.806 1976 2HB LEU 4 2HB LEU 4 5.329 2.242 -1.120 1977 HG LEU 4 HG LEU 4 5.096 4.946 -2.324 1978 1HD1 LEU 4 1HD1 LEU 4 4.152 2.941 -3.848 1979 2HD1 LEU 4 2HD1 LEU 4 2.776 3.182 -2.768 1980 3HD1 LEU 4 3HD1 LEU 4 3.387 4.526 -3.734 1981 1HD2 LEU 4 1HD2 LEU 4 4.474 3.979 0.076 1982 2HD2 LEU 4 2HD2 LEU 4 3.556 5.275 -0.690 1983 3HD2 LEU 4 3HD2 LEU 4 2.963 3.615 -0.760 1984 HA PRO 5 HA PRO 5 10.328 0.703 -1.059 1985 1HB PRO 5 1HB PRO 5 8.360 -1.408 -0.313 1986 2HB PRO 5 2HB PRO 5 9.967 -1.085 0.345 1987 1HG PRO 5 1HG PRO 5 7.782 -0.411 1.703 1988 2HG PRO 5 2HG PRO 5 9.213 0.630 1.698 1989 1HD PRO 5 1HD PRO 5 6.626 0.956 0.259 1990 2HD PRO 5 2HD PRO 5 7.697 2.188 0.955 1991 HA PRO 6 HA PRO 6 10.103 -1.249 -5.022 1992 1HB PRO 6 1HB PRO 6 10.859 -3.869 -4.446 1993 2HB PRO 6 2HB PRO 6 11.961 -2.535 -4.794 1994 1HG PRO 6 1HG PRO 6 12.694 -3.073 -2.663 1995 2HG PRO 6 2HG PRO 6 11.095 -3.643 -2.157 1996 1HD PRO 6 1HD PRO 6 11.146 -1.559 -1.118 1997 2HD PRO 6 2HD PRO 6 12.105 -0.829 -2.424 1998 H GLY 7 H GLY 7 8.652 -3.030 -2.345 1999 1HA GLY 7 1HA GLY 7 6.605 -4.036 -4.228 2000 2HA GLY 7 2HA GLY 7 7.125 -4.916 -2.800 2001 H TRP 8 H TRP 8 5.826 -1.695 -3.621 2002 HA TRP 8 HA TRP 8 3.595 -2.073 -1.843 2003 1HB TRP 8 1HB TRP 8 5.897 -0.317 -1.094 2004 2HB TRP 8 2HB TRP 8 4.270 0.228 -0.701 2005 HD1 TRP 8 HD1 TRP 8 7.004 -1.833 0.652 2006 HE1 TRP 8 HE1 TRP 8 6.201 -3.194 2.672 2007 HE3 TRP 8 HE3 TRP 8 1.964 -1.175 0.120 2008 HZ2 TRP 8 HZ2 TRP 8 3.751 -3.901 3.893 2009 HZ3 TRP 8 HZ3 TRP 8 0.457 -2.227 1.765 2010 HH2 TRP 8 HH2 TRP 8 1.338 -3.557 3.607 2011 H ASP 9 H ASP 9 2.042 -1.460 -3.219 2012 HA ASP 9 HA ASP 9 2.438 1.042 -4.733 2013 1HB ASP 9 1HB ASP 9 0.949 -1.483 -5.428 2014 2HB ASP 9 2HB ASP 9 0.629 0.036 -6.258 2015 H GLU 10 H GLU 10 0.506 2.339 -5.139 2016 HA GLU 10 HA GLU 10 -1.376 2.168 -2.885 2017 1HB GLU 10 1HB GLU 10 -1.610 4.700 -4.098 2018 2HB GLU 10 2HB GLU 10 -0.914 4.317 -2.530 2019 1HG GLU 10 1HG GLU 10 1.234 3.809 -3.880 2020 2HG GLU 10 2HG GLU 10 0.783 5.482 -3.555 2021 H TYR 11 H TYR 11 -3.485 1.919 -3.231 2022 HA TYR 11 HA TYR 11 -4.795 2.798 -5.616 2023 1HB TYR 11 1HB TYR 11 -3.913 0.003 -5.379 2024 2HB TYR 11 2HB TYR 11 -5.626 0.183 -5.746 2025 HD1 TYR 11 HD1 TYR 11 -6.151 1.904 -7.688 2026 HD2 TYR 11 HD2 TYR 11 -2.417 -0.063 -7.144 2027 HE1 TYR 11 HE1 TYR 11 -5.612 2.283 -10.058 2028 HE2 TYR 11 HE2 TYR 11 -1.868 0.312 -9.511 2029 HH TYR 11 HH TYR 11 -3.856 2.318 -11.566 2030 H LYS 12 H LYS 12 -7.061 2.790 -5.402 2031 HA LYS 12 HA LYS 12 -7.940 2.632 -2.649 2032 1HB LYS 12 1HB LYS 12 -8.998 3.807 -5.159 2033 2HB LYS 12 2HB LYS 12 -10.171 3.342 -3.945 2034 1HG LYS 12 1HG LYS 12 -9.384 4.892 -2.430 2035 2HG LYS 12 2HG LYS 12 -7.825 5.032 -3.249 2036 1HD LYS 12 1HD LYS 12 -9.681 5.720 -5.184 2037 2HD LYS 12 2HD LYS 12 -10.286 6.470 -3.712 2038 1HE LYS 12 1HE LYS 12 -7.432 6.701 -4.588 2039 2HE LYS 12 2HE LYS 12 -8.670 7.833 -5.131 2040 1HZ LYS 12 1HZ LYS 12 -8.675 7.453 -2.290 2041 2HZ LYS 12 2HZ LYS 12 -7.200 8.057 -2.856 2042 3HZ LYS 12 3HZ LYS 12 -8.636 8.888 -3.185 2043 H THR 13 H THR 13 -9.144 1.064 -1.762 2044 HA THR 13 HA THR 13 -9.498 -1.390 -3.096 2045 HB THR 13 HB THR 13 -11.138 -0.783 -0.682 2046 HG1 THR 13 HG1 THR 13 -9.036 -1.263 0.476 2047 1HG2 THR 13 1HG2 THR 13 -10.874 -3.044 -1.889 2048 2HG2 THR 13 2HG2 THR 13 -9.276 -3.085 -1.144 2049 3HG2 THR 13 3HG2 THR 13 -10.718 -3.009 -0.132 2050 H HIS 14 H HIS 14 -12.319 -0.220 -1.406 2051 HA HIS 14 HA HIS 14 -13.818 -0.290 -3.941 2052 1HB HIS 14 1HB HIS 14 -14.071 -2.042 -1.757 2053 2HB HIS 14 2HB HIS 14 -15.467 -0.973 -1.671 2054 HD1 HIS 14 HD1 HIS 14 -13.755 -2.600 -4.662 2055 HD2 HIS 14 HD2 HIS 14 -17.491 -2.302 -2.863 2056 HE1 HIS 14 HE1 HIS 14 -15.329 -3.859 -6.167 2057 HE2 HIS 14 HE2 HIS 14 -17.584 -3.665 -5.060 2058 H ASN 15 H ASN 15 -14.400 0.637 -0.538 2059 HA ASN 15 HA ASN 15 -16.266 2.636 -1.106 2060 1HB ASN 15 1HB ASN 15 -15.534 3.542 1.200 2061 2HB ASN 15 2HB ASN 15 -16.218 1.921 1.126 2062 2HD2 ASN 15 2HD2 ASN 15 -14.832 0.128 1.315 2063 1HD2 ASN 15 1HD2 ASN 15 -13.282 0.273 2.064 2064 H GLY 16 H GLY 16 -12.795 2.659 -1.205 2065 1HA GLY 16 1HA GLY 16 -11.951 4.401 -2.790 2066 2HA GLY 16 2HA GLY 16 -12.868 5.547 -1.826 2067 H LYS 17 H LYS 17 -11.230 2.970 -0.170 2068 HA LYS 17 HA LYS 17 -9.493 4.918 1.091 2069 1HB LYS 17 1HB LYS 17 -10.656 3.131 2.408 2070 2HB LYS 17 2HB LYS 17 -8.922 3.185 2.659 2071 1HG LYS 17 1HG LYS 17 -9.433 1.371 0.541 2072 2HG LYS 17 2HG LYS 17 -8.781 1.052 2.144 2073 1HD LYS 17 1HD LYS 17 -11.367 1.308 2.770 2074 2HD LYS 17 2HD LYS 17 -11.525 0.705 1.118 2075 1HE LYS 17 1HE LYS 17 -10.891 -1.355 1.702 2076 2HE LYS 17 2HE LYS 17 -9.537 -0.753 2.657 2077 1HZ LYS 17 1HZ LYS 17 -12.283 -0.536 3.699 2078 2HZ LYS 17 2HZ LYS 17 -11.447 -2.002 3.823 2079 3HZ LYS 17 3HZ LYS 17 -10.822 -0.606 4.547 2080 H THR 18 H THR 18 -7.567 5.406 0.288 2081 HA THR 18 HA THR 18 -6.418 3.984 -1.895 2082 HB THR 18 HB THR 18 -4.679 5.769 -0.276 2083 HG1 THR 18 HG1 THR 18 -6.591 7.003 -1.925 2084 1HG2 THR 18 1HG2 THR 18 -5.189 5.133 -3.140 2085 2HG2 THR 18 2HG2 THR 18 -4.511 6.710 -2.738 2086 3HG2 THR 18 3HG2 THR 18 -3.662 5.238 -2.264 2087 H TYR 19 H TYR 19 -6.368 1.854 -0.971 2088 HA TYR 19 HA TYR 19 -4.663 1.357 1.283 2089 1HB TYR 19 1HB TYR 19 -5.550 -0.757 1.331 2090 2HB TYR 19 2HB TYR 19 -6.846 0.095 0.495 2091 HD1 TYR 19 HD1 TYR 19 -7.244 -0.296 -1.885 2092 HD2 TYR 19 HD2 TYR 19 -4.189 -2.400 0.198 2093 HE1 TYR 19 HE1 TYR 19 -7.111 -1.918 -3.729 2094 HE2 TYR 19 HE2 TYR 19 -4.048 -4.027 -1.639 2095 HH TYR 19 HH TYR 19 -4.591 -4.300 -3.903 2096 H TYR 20 H TYR 20 -2.668 0.586 1.328 2097 HA TYR 20 HA TYR 20 -1.207 0.425 -1.199 2098 1HB TYR 20 1HB TYR 20 0.804 0.684 0.157 2099 2HB TYR 20 2HB TYR 20 -0.142 0.528 1.633 2100 HD1 TYR 20 HD1 TYR 20 -1.686 2.340 2.312 2101 HD2 TYR 20 HD2 TYR 20 0.921 2.763 -1.024 2102 HE1 TYR 20 HE1 TYR 20 -2.025 4.775 2.361 2103 HE2 TYR 20 HE2 TYR 20 0.589 5.198 -0.983 2104 HH TYR 20 HH TYR 20 -1.006 6.827 -0.179 2105 H TYR 21 H TYR 21 -0.224 -1.450 -1.865 2106 HA TYR 21 HA TYR 21 -0.620 -3.808 -0.145 2107 1HB TYR 21 1HB TYR 21 -2.262 -3.792 -1.951 2108 2HB TYR 21 2HB TYR 21 -0.979 -3.619 -3.143 2109 HD1 TYR 21 HD1 TYR 21 -0.083 -5.515 -4.148 2110 HD2 TYR 21 HD2 TYR 21 -2.159 -5.917 -0.455 2111 HE1 TYR 21 HE1 TYR 21 0.086 -7.962 -4.326 2112 HE2 TYR 21 HE2 TYR 21 -1.995 -8.366 -0.624 2113 HH TYR 21 HH TYR 21 -1.545 -10.009 -3.158 2114 H ASN 22 H ASN 22 0.904 -5.391 -0.142 2115 HA ASN 22 HA ASN 22 3.472 -4.744 -1.430 2116 1HB ASN 22 1HB ASN 22 3.402 -4.818 1.090 2117 2HB ASN 22 2HB ASN 22 2.995 -6.526 0.973 2118 2HD2 ASN 22 2HD2 ASN 22 5.185 -5.734 2.363 2119 1HD2 ASN 22 1HD2 ASN 22 6.621 -6.212 1.529 2120 H HIS 23 H HIS 23 3.865 -5.950 -3.170 2121 HA HIS 23 HA HIS 23 2.470 -8.457 -3.552 2122 1HB HIS 23 1HB HIS 23 2.571 -7.918 -5.712 2123 2HB HIS 23 2HB HIS 23 4.328 -7.885 -5.669 2124 HD1 HIS 23 HD1 HIS 23 1.669 -5.499 -4.338 2125 HD2 HIS 23 HD2 HIS 23 5.125 -5.506 -6.645 2126 HE1 HIS 23 HE1 HIS 23 2.062 -3.101 -4.962 2127 HE2 HIS 23 HE2 HIS 23 4.159 -3.123 -6.361 2128 H ASN 24 H ASN 24 5.288 -7.656 -2.062 2129 HA ASN 24 HA ASN 24 6.785 -9.978 -3.024 2130 1HB ASN 24 1HB ASN 24 8.659 -9.070 -1.727 2131 2HB ASN 24 2HB ASN 24 7.614 -7.806 -1.086 2132 2HD2 ASN 24 2HD2 ASN 24 9.050 -6.262 -1.928 2133 1HD2 ASN 24 1HD2 ASN 24 9.045 -5.860 -3.608 2134 H THR 25 H THR 25 4.921 -8.879 -0.336 2135 HA THR 25 HA THR 25 5.409 -11.439 1.018 2136 HB THR 25 HB THR 25 5.600 -10.451 3.166 2137 HG1 THR 25 HG1 THR 25 4.426 -8.297 1.911 2138 1HG2 THR 25 1HG2 THR 25 7.266 -9.110 1.067 2139 2HG2 THR 25 2HG2 THR 25 7.462 -8.683 2.768 2140 3HG2 THR 25 3HG2 THR 25 7.728 -10.345 2.240 2141 H LYS 26 H LYS 26 3.247 -9.920 -0.622 2142 HA LYS 26 HA LYS 26 0.989 -9.644 -0.644 2143 1HB LYS 26 1HB LYS 26 0.902 -12.015 1.210 2144 2HB LYS 26 2HB LYS 26 -0.233 -11.583 -0.062 2145 1HG LYS 26 1HG LYS 26 2.602 -12.515 -0.479 2146 2HG LYS 26 2HG LYS 26 1.147 -13.492 -0.693 2147 1HD LYS 26 1HD LYS 26 0.657 -11.250 -2.227 2148 2HD LYS 26 2HD LYS 26 2.374 -11.561 -2.487 2149 1HE LYS 26 1HE LYS 26 1.114 -14.050 -2.586 2150 2HE LYS 26 2HE LYS 26 1.810 -13.150 -3.930 2151 1HZ LYS 26 1HZ LYS 26 -0.882 -12.413 -3.073 2152 2HZ LYS 26 2HZ LYS 26 -0.213 -12.449 -4.626 2153 3HZ LYS 26 3HZ LYS 26 -0.710 -13.886 -3.887 2154 H THR 27 H THR 27 1.390 -7.665 0.694 2155 HA THR 27 HA THR 27 -0.002 -7.924 3.284 2156 HB THR 27 HB THR 27 2.134 -5.878 2.699 2157 HG1 THR 27 HG1 THR 27 2.446 -8.460 3.194 2158 1HG2 THR 27 1HG2 THR 27 0.482 -5.251 4.408 2159 2HG2 THR 27 2HG2 THR 27 0.828 -6.745 5.281 2160 3HG2 THR 27 3HG2 THR 27 2.080 -5.514 5.109 2161 H SER 28 H SER 28 -1.986 -7.149 2.961 2162 HA SER 28 HA SER 28 -2.324 -4.720 1.345 2163 1HB SER 28 1HB SER 28 -4.758 -5.348 1.373 2164 2HB SER 28 2HB SER 28 -3.717 -6.541 0.597 2165 HG SER 28 HG SER 28 -4.516 -7.907 1.964 2166 H THR 29 H THR 29 -2.716 -2.842 2.308 2167 HA THR 29 HA THR 29 -4.232 -2.690 4.770 2168 HB THR 29 HB THR 29 -1.770 -3.102 5.396 2169 HG1 THR 29 HG1 THR 29 -3.144 -2.331 6.965 2170 1HG2 THR 29 1HG2 THR 29 -1.180 -1.194 3.613 2171 2HG2 THR 29 2HG2 THR 29 -1.304 -0.200 5.065 2172 3HG2 THR 29 3HG2 THR 29 -0.167 -1.548 5.012 2173 H TRP 30 H TRP 30 -4.522 -0.338 5.440 2174 HA TRP 30 HA TRP 30 -4.688 1.303 3.007 2175 1HB TRP 30 1HB TRP 30 -6.034 2.551 5.199 2176 2HB TRP 30 2HB TRP 30 -6.714 1.941 3.697 2177 HD1 TRP 30 HD1 TRP 30 -7.033 1.513 7.283 2178 HE1 TRP 30 HE1 TRP 30 -8.261 -0.675 7.864 2179 HE3 TRP 30 HE3 TRP 30 -6.761 -0.793 2.740 2180 HZ2 TRP 30 HZ2 TRP 30 -9.017 -3.065 6.559 2181 HZ3 TRP 30 HZ3 TRP 30 -7.757 -3.029 2.482 2182 HH2 TRP 30 HH2 TRP 30 -8.864 -4.138 4.354 2183 H THR 31 H THR 31 -2.879 0.874 5.774 2184 HA THR 31 HA THR 31 -2.186 3.628 6.263 2185 HB THR 31 HB THR 31 -0.545 1.298 7.201 2186 HG1 THR 31 HG1 THR 31 -2.325 0.567 8.102 2187 1HG2 THR 31 1HG2 THR 31 0.149 3.674 7.620 2188 2HG2 THR 31 2HG2 THR 31 -1.305 3.856 8.602 2189 3HG2 THR 31 3HG2 THR 31 -0.062 2.696 9.073 2190 H ASP 32 H ASP 32 -0.236 4.627 5.803 2191 HA ASP 32 HA ASP 32 0.910 3.986 3.291 2192 1HB ASP 32 1HB ASP 32 0.940 6.186 5.104 2193 2HB ASP 32 2HB ASP 32 2.609 5.778 4.718 2194 HA PRO 33 HA PRO 33 3.917 1.028 4.784 2195 1HB PRO 33 1HB PRO 33 5.285 0.758 2.445 2196 2HB PRO 33 2HB PRO 33 3.745 -0.044 2.767 2197 1HG PRO 33 1HG PRO 33 4.301 2.451 1.217 2198 2HG PRO 33 2HG PRO 33 3.187 1.125 0.843 2199 1HD PRO 33 1HD PRO 33 2.353 3.471 1.896 2200 2HD PRO 33 2HD PRO 33 1.556 1.925 2.253 2201 H ARG 34 H ARG 34 4.627 4.038 3.216 2202 HA ARG 34 HA ARG 34 7.397 4.153 3.438 2203 1HB ARG 34 1HB ARG 34 5.584 6.517 3.899 2204 2HB ARG 34 2HB ARG 34 7.200 6.515 3.209 2205 1HG ARG 34 1HG ARG 34 5.583 4.839 1.608 2206 2HG ARG 34 2HG ARG 34 4.696 6.337 1.889 2207 1HD ARG 34 1HD ARG 34 6.812 7.558 1.238 2208 2HD ARG 34 2HD ARG 34 7.436 6.001 0.695 2209 HE ARG 34 HE ARG 34 6.161 6.215 -1.180 2210 1HH1 ARG 34 1HH1 ARG 34 4.823 8.272 1.295 2211 2HH1 ARG 34 2HH1 ARG 34 3.630 8.970 0.252 2212 1HH2 ARG 34 1HH2 ARG 34 4.593 7.129 -2.561 2213 2HH2 ARG 34 2HH2 ARG 34 3.500 8.321 -1.940 2214 H MET 35 H MET 35 4.930 4.445 5.860 2215 HA MET 35 HA MET 35 7.018 4.904 7.886 2216 1HB MET 35 1HB MET 35 5.397 6.176 9.205 2217 2HB MET 35 2HB MET 35 4.183 5.953 7.953 2218 1HG MET 35 1HG MET 35 6.652 7.619 7.927 2219 2HG MET 35 2HG MET 35 5.888 7.117 6.419 2220 1HE MET 35 1HE MET 35 5.340 9.276 5.443 2221 2HE MET 35 2HE MET 35 4.474 10.609 6.208 2222 3HE MET 35 3HE MET 35 6.123 10.226 6.706 2223 H SER 36 H SER 36 5.549 4.540 10.158 2224 HA SER 36 HA SER 36 3.938 2.177 10.036 2225 1HB SER 36 1HB SER 36 6.350 1.356 9.761 2226 2HB SER 36 2HB SER 36 6.589 1.850 11.437 2227 HG SER 36 HG SER 36 5.601 -0.415 10.590 2228 H SER 37 H SER 37 2.427 3.013 11.355 2229 HA SER 37 HA SER 37 3.143 3.408 14.144 2230 1HB SER 37 1HB SER 37 2.969 5.637 12.543 2231 2HB SER 37 2HB SER 37 1.336 5.523 13.200 2232 HG SER 37 HG SER 37 2.070 6.092 15.085 2233 H1 SER 1 H1 SER 1 1.869 9.805 -0.648 2234 H2 SER 1 H2 SER 1 1.739 11.464 -0.347 2235 H3 SER 1 H3 SER 1 1.423 10.858 -1.894 2236 HA SER 1 HA SER 1 3.550 11.839 -1.986 2237 1HB SER 1 1HB SER 1 4.674 10.087 0.139 2238 2HB SER 1 2HB SER 1 5.076 11.753 -0.276 2239 HG SER 1 HG SER 1 3.981 11.523 1.758 2240 H MET 2 H MET 2 5.199 10.964 -3.245 2241 HA MET 2 HA MET 2 4.793 8.152 -3.982 2242 1HB MET 2 1HB MET 2 5.696 8.667 -6.112 2243 2HB MET 2 2HB MET 2 6.386 10.179 -5.541 2244 1HG MET 2 1HG MET 2 3.818 9.672 -6.696 2245 2HG MET 2 2HG MET 2 3.626 10.364 -5.086 2246 1HE MET 2 1HE MET 2 4.418 12.280 -4.247 2247 2HE MET 2 2HE MET 2 5.228 13.626 -5.051 2248 3HE MET 2 3HE MET 2 3.483 13.427 -5.207 2249 H GLY 3 H GLY 3 6.187 6.717 -3.209 2250 1HA GLY 3 1HA GLY 3 8.902 6.693 -3.514 2251 2HA GLY 3 2HA GLY 3 8.658 7.535 -1.987 2252 H LEU 4 H LEU 4 6.375 5.105 -2.891 2253 HA LEU 4 HA LEU 4 6.779 3.591 -0.556 2254 1HB LEU 4 1HB LEU 4 5.595 2.364 -3.005 2255 2HB LEU 4 2HB LEU 4 5.101 2.195 -1.332 2256 HG LEU 4 HG LEU 4 4.776 4.857 -2.639 2257 1HD1 LEU 4 1HD1 LEU 4 3.447 2.372 -3.475 2258 2HD1 LEU 4 2HD1 LEU 4 2.368 3.722 -3.121 2259 3HD1 LEU 4 3HD1 LEU 4 3.641 3.902 -4.330 2260 1HD2 LEU 4 1HD2 LEU 4 3.359 3.263 -0.526 2261 2HD2 LEU 4 2HD2 LEU 4 4.191 4.810 -0.364 2262 3HD2 LEU 4 3HD2 LEU 4 2.661 4.717 -1.238 2263 HA PRO 5 HA PRO 5 10.240 0.945 -1.309 2264 1HB PRO 5 1HB PRO 5 10.038 -0.844 0.123 2265 2HB PRO 5 2HB PRO 5 8.436 -1.278 -0.481 2266 1HG PRO 5 1HG PRO 5 7.840 -0.302 1.534 2267 2HG PRO 5 2HG PRO 5 9.214 0.813 1.503 2268 1HD PRO 5 1HD PRO 5 7.621 2.300 0.785 2269 2HD PRO 5 2HD PRO 5 6.575 1.019 0.144 2270 HA PRO 6 HA PRO 6 9.969 -1.041 -5.259 2271 1HB PRO 6 1HB PRO 6 10.981 -3.578 -4.706 2272 2HB PRO 6 2HB PRO 6 11.944 -2.157 -5.121 2273 1HG PRO 6 1HG PRO 6 12.834 -2.603 -3.031 2274 2HG PRO 6 2HG PRO 6 11.322 -3.311 -2.436 2275 1HD PRO 6 1HD PRO 6 11.233 -1.223 -1.409 2276 2HD PRO 6 2HD PRO 6 12.065 -0.421 -2.760 2277 H GLY 7 H GLY 7 8.839 -2.899 -2.485 2278 1HA GLY 7 1HA GLY 7 6.811 -4.162 -4.223 2279 2HA GLY 7 2HA GLY 7 7.415 -4.868 -2.733 2280 H TRP 8 H TRP 8 6.066 -1.693 -3.642 2281 HA TRP 8 HA TRP 8 3.780 -2.098 -1.933 2282 1HB TRP 8 1HB TRP 8 6.045 -0.320 -1.138 2283 2HB TRP 8 2HB TRP 8 4.405 0.224 -0.793 2284 HD1 TRP 8 HD1 TRP 8 7.106 -1.806 0.659 2285 HE1 TRP 8 HE1 TRP 8 6.247 -3.156 2.666 2286 HE3 TRP 8 HE3 TRP 8 2.080 -1.178 -0.037 2287 HZ2 TRP 8 HZ2 TRP 8 3.759 -3.862 3.816 2288 HZ3 TRP 8 HZ3 TRP 8 0.529 -2.226 1.570 2289 HH2 TRP 8 HH2 TRP 8 1.355 -3.535 3.452 2290 H ASP 9 H ASP 9 2.140 -1.338 -3.079 2291 HA ASP 9 HA ASP 9 2.557 1.108 -4.675 2292 1HB ASP 9 1HB ASP 9 1.142 0.267 -6.403 2293 2HB ASP 9 2HB ASP 9 2.319 -0.994 -6.051 2294 H GLU 10 H GLU 10 0.520 2.326 -5.102 2295 HA GLU 10 HA GLU 10 -1.338 2.048 -2.835 2296 1HB GLU 10 1HB GLU 10 -1.294 4.307 -2.413 2297 2HB GLU 10 2HB GLU 10 0.360 4.043 -2.939 2298 1HG GLU 10 1HG GLU 10 -1.831 5.006 -4.759 2299 2HG GLU 10 2HG GLU 10 -0.743 6.076 -3.876 2300 H TYR 11 H TYR 11 -3.495 2.365 -3.164 2301 HA TYR 11 HA TYR 11 -4.637 3.444 -5.513 2302 1HB TYR 11 1HB TYR 11 -3.960 0.614 -5.580 2303 2HB TYR 11 2HB TYR 11 -5.687 0.878 -5.802 2304 HD1 TYR 11 HD1 TYR 11 -6.115 3.042 -7.447 2305 HD2 TYR 11 HD2 TYR 11 -2.773 0.408 -7.541 2306 HE1 TYR 11 HE1 TYR 11 -5.732 3.620 -9.805 2307 HE2 TYR 11 HE2 TYR 11 -2.383 0.979 -9.901 2308 HH TYR 11 HH TYR 11 -3.401 1.917 -11.762 2309 H LYS 12 H LYS 12 -6.966 3.446 -5.436 2310 HA LYS 12 HA LYS 12 -7.931 3.143 -2.696 2311 1HB LYS 12 1HB LYS 12 -8.735 4.763 -5.054 2312 2HB LYS 12 2HB LYS 12 -10.001 4.300 -3.927 2313 1HG LYS 12 1HG LYS 12 -8.770 5.338 -2.100 2314 2HG LYS 12 2HG LYS 12 -7.492 5.801 -3.222 2315 1HD LYS 12 1HD LYS 12 -10.346 6.639 -3.636 2316 2HD LYS 12 2HD LYS 12 -9.235 7.572 -2.629 2317 1HE LYS 12 1HE LYS 12 -7.686 7.354 -4.759 2318 2HE LYS 12 2HE LYS 12 -9.238 7.151 -5.572 2319 1HZ LYS 12 1HZ LYS 12 -9.952 9.251 -4.495 2320 2HZ LYS 12 2HZ LYS 12 -8.374 9.463 -3.927 2321 3HZ LYS 12 3HZ LYS 12 -8.678 9.449 -5.591 2322 H THR 13 H THR 13 -9.317 1.614 -2.076 2323 HA THR 13 HA THR 13 -10.114 -0.417 -3.956 2324 HB THR 13 HB THR 13 -11.335 -0.559 -1.297 2325 HG1 THR 13 HG1 THR 13 -8.586 -0.071 -1.610 2326 1HG2 THR 13 1HG2 THR 13 -10.946 -2.361 -3.137 2327 2HG2 THR 13 2HG2 THR 13 -9.331 -2.466 -2.435 2328 3HG2 THR 13 3HG2 THR 13 -10.750 -2.794 -1.439 2329 H HIS 14 H HIS 14 -12.593 -1.185 -2.830 2330 HA HIS 14 HA HIS 14 -14.388 0.233 -4.427 2331 1HB HIS 14 1HB HIS 14 -14.464 -2.039 -2.740 2332 2HB HIS 14 2HB HIS 14 -15.779 -0.986 -2.230 2333 HD1 HIS 14 HD1 HIS 14 -15.399 -3.753 -4.247 2334 HD2 HIS 14 HD2 HIS 14 -17.087 -0.017 -4.929 2335 HE1 HIS 14 HE1 HIS 14 -16.967 -4.068 -6.188 2336 HE2 HIS 14 HE2 HIS 14 -17.979 -1.795 -6.583 2337 H ASN 15 H ASN 15 -13.992 0.339 -0.887 2338 HA ASN 15 HA ASN 15 -15.882 2.390 -0.461 2339 1HB ASN 15 1HB ASN 15 -13.554 1.928 1.342 2340 2HB ASN 15 2HB ASN 15 -15.190 2.397 1.765 2341 2HD2 ASN 15 2HD2 ASN 15 -13.464 0.173 2.688 2342 1HD2 ASN 15 1HD2 ASN 15 -14.399 -1.258 2.436 2343 H GLY 16 H GLY 16 -12.833 2.472 -1.854 2344 1HA GLY 16 1HA GLY 16 -11.839 4.347 -2.843 2345 2HA GLY 16 2HA GLY 16 -12.848 5.385 -1.849 2346 H LYS 17 H LYS 17 -11.241 2.846 -0.201 2347 HA LYS 17 HA LYS 17 -9.626 4.754 1.242 2348 1HB LYS 17 1HB LYS 17 -10.744 2.763 2.322 2349 2HB LYS 17 2HB LYS 17 -9.044 2.961 2.707 2350 1HG LYS 17 1HG LYS 17 -9.280 1.289 0.411 2351 2HG LYS 17 2HG LYS 17 -8.621 0.920 2.005 2352 1HD LYS 17 1HD LYS 17 -11.153 0.749 2.662 2353 2HD LYS 17 2HD LYS 17 -11.362 0.460 0.933 2354 1HE LYS 17 1HE LYS 17 -9.237 -1.162 1.592 2355 2HE LYS 17 2HE LYS 17 -10.286 -1.282 3.003 2356 1HZ LYS 17 1HZ LYS 17 -11.834 -1.454 0.652 2357 2HZ LYS 17 2HZ LYS 17 -10.572 -2.578 0.569 2358 3HZ LYS 17 3HZ LYS 17 -11.640 -2.602 1.880 2359 H THR 18 H THR 18 -7.621 5.329 0.718 2360 HA THR 18 HA THR 18 -6.343 4.261 -1.598 2361 HB THR 18 HB THR 18 -4.783 5.854 0.385 2362 HG1 THR 18 HG1 THR 18 -7.208 6.610 -0.683 2363 1HG2 THR 18 1HG2 THR 18 -5.099 5.944 -2.616 2364 2HG2 THR 18 2HG2 THR 18 -4.023 6.979 -1.677 2365 3HG2 THR 18 3HG2 THR 18 -3.752 5.238 -1.722 2366 H TYR 19 H TYR 19 -6.325 2.016 -0.937 2367 HA TYR 19 HA TYR 19 -4.690 1.233 1.286 2368 1HB TYR 19 1HB TYR 19 -5.585 -0.857 1.032 2369 2HB TYR 19 2HB TYR 19 -6.830 0.084 0.217 2370 HD1 TYR 19 HD1 TYR 19 -6.922 0.110 -2.271 2371 HD2 TYR 19 HD2 TYR 19 -4.275 -2.457 -0.148 2372 HE1 TYR 19 HE1 TYR 19 -6.642 -1.262 -4.291 2373 HE2 TYR 19 HE2 TYR 19 -3.988 -3.836 -2.163 2374 HH TYR 19 HH TYR 19 -5.977 -3.808 -4.710 2375 H TYR 20 H TYR 20 -2.755 0.231 1.278 2376 HA TYR 20 HA TYR 20 -1.209 0.363 -1.218 2377 1HB TYR 20 1HB TYR 20 -0.124 0.322 1.604 2378 2HB TYR 20 2HB TYR 20 0.765 0.672 0.125 2379 HD1 TYR 20 HD1 TYR 20 -1.731 1.972 2.505 2380 HD2 TYR 20 HD2 TYR 20 0.715 2.853 -0.861 2381 HE1 TYR 20 HE1 TYR 20 -2.200 4.368 2.797 2382 HE2 TYR 20 HE2 TYR 20 0.253 5.251 -0.578 2383 HH TYR 20 HH TYR 20 -1.523 6.675 0.445 2384 H TYR 21 H TYR 21 -0.163 -1.468 -1.939 2385 HA TYR 21 HA TYR 21 -0.568 -3.893 -0.312 2386 1HB TYR 21 1HB TYR 21 -2.115 -3.825 -2.208 2387 2HB TYR 21 2HB TYR 21 -0.765 -3.635 -3.320 2388 HD1 TYR 21 HD1 TYR 21 0.091 -5.520 -4.354 2389 HD2 TYR 21 HD2 TYR 21 -2.005 -5.970 -0.679 2390 HE1 TYR 21 HE1 TYR 21 0.272 -7.963 -4.558 2391 HE2 TYR 21 HE2 TYR 21 -1.831 -8.416 -0.873 2392 HH TYR 21 HH TYR 21 -0.963 -9.979 -3.711 2393 H ASN 22 H ASN 22 0.988 -5.430 -0.258 2394 HA ASN 22 HA ASN 22 3.592 -4.742 -1.457 2395 1HB ASN 22 1HB ASN 22 3.439 -4.785 1.064 2396 2HB ASN 22 2HB ASN 22 3.080 -6.503 0.953 2397 2HD2 ASN 22 2HD2 ASN 22 5.228 -5.511 2.375 2398 1HD2 ASN 22 1HD2 ASN 22 6.692 -6.011 1.607 2399 H HIS 23 H HIS 23 4.105 -5.990 -3.140 2400 HA HIS 23 HA HIS 23 2.744 -8.520 -3.528 2401 1HB HIS 23 1HB HIS 23 2.868 -7.992 -5.688 2402 2HB HIS 23 2HB HIS 23 4.624 -7.953 -5.619 2403 HD1 HIS 23 HD1 HIS 23 1.906 -5.579 -4.400 2404 HD2 HIS 23 HD2 HIS 23 5.461 -5.567 -6.550 2405 HE1 HIS 23 HE1 HIS 23 2.305 -3.182 -5.020 2406 HE2 HIS 23 HE2 HIS 23 4.462 -3.191 -6.323 2407 H ASN 24 H ASN 24 5.198 -7.967 -1.665 2408 HA ASN 24 HA ASN 24 6.873 -10.160 -2.694 2409 1HB ASN 24 1HB ASN 24 7.606 -8.079 -0.623 2410 2HB ASN 24 2HB ASN 24 8.678 -9.296 -1.307 2411 2HD2 ASN 24 2HD2 ASN 24 8.834 -6.363 -1.288 2412 1HD2 ASN 24 1HD2 ASN 24 8.984 -5.898 -2.944 2413 H THR 25 H THR 25 4.939 -9.029 -0.056 2414 HA THR 25 HA THR 25 5.199 -11.662 1.213 2415 HB THR 25 HB THR 25 5.311 -10.767 3.408 2416 HG1 THR 25 HG1 THR 25 4.297 -8.532 2.196 2417 1HG2 THR 25 1HG2 THR 25 7.176 -9.439 1.470 2418 2HG2 THR 25 2HG2 THR 25 7.305 -9.131 3.204 2419 3HG2 THR 25 3HG2 THR 25 7.490 -10.772 2.583 2420 H LYS 26 H LYS 26 3.251 -10.034 -0.523 2421 HA LYS 26 HA LYS 26 1.019 -9.638 -0.710 2422 1HB LYS 26 1HB LYS 26 0.542 -11.938 1.146 2423 2HB LYS 26 2HB LYS 26 -0.275 -11.532 -0.358 2424 1HG LYS 26 1HG LYS 26 2.555 -12.550 -0.169 2425 2HG LYS 26 2HG LYS 26 1.142 -13.552 -0.516 2426 1HD LYS 26 1HD LYS 26 1.450 -11.162 -2.210 2427 2HD LYS 26 2HD LYS 26 2.695 -12.398 -2.409 2428 1HE LYS 26 1HE LYS 26 0.033 -13.530 -2.269 2429 2HE LYS 26 2HE LYS 26 0.191 -12.372 -3.588 2430 1HZ LYS 26 1HZ LYS 26 2.474 -13.942 -3.632 2431 2HZ LYS 26 2HZ LYS 26 1.179 -15.012 -3.427 2432 3HZ LYS 26 3HZ LYS 26 1.199 -13.951 -4.743 2433 H THR 27 H THR 27 1.422 -7.676 0.640 2434 HA THR 27 HA THR 27 -0.030 -7.860 3.207 2435 HB THR 27 HB THR 27 1.968 -5.715 2.522 2436 HG1 THR 27 HG1 THR 27 2.334 -8.255 3.730 2437 1HG2 THR 27 1HG2 THR 27 0.086 -5.849 4.509 2438 2HG2 THR 27 2HG2 THR 27 1.526 -6.486 5.306 2439 3HG2 THR 27 3HG2 THR 27 1.563 -4.886 4.564 2440 H SER 28 H SER 28 -2.034 -7.119 2.966 2441 HA SER 28 HA SER 28 -2.477 -4.782 1.235 2442 1HB SER 28 1HB SER 28 -4.910 -5.514 1.350 2443 2HB SER 28 2HB SER 28 -3.823 -6.601 0.487 2444 HG SER 28 HG SER 28 -5.346 -7.529 2.110 2445 H THR 29 H THR 29 -2.479 -2.955 2.344 2446 HA THR 29 HA THR 29 -4.089 -2.781 4.794 2447 HB THR 29 HB THR 29 -1.578 -3.006 5.279 2448 HG1 THR 29 HG1 THR 29 -1.754 -1.302 6.886 2449 1HG2 THR 29 1HG2 THR 29 -1.396 -0.959 3.406 2450 2HG2 THR 29 2HG2 THR 29 -1.116 -0.168 4.956 2451 3HG2 THR 29 3HG2 THR 29 -0.112 -1.534 4.471 2452 H TRP 30 H TRP 30 -4.114 -0.266 5.437 2453 HA TRP 30 HA TRP 30 -4.613 1.225 2.944 2454 1HB TRP 30 1HB TRP 30 -6.675 1.750 3.621 2455 2HB TRP 30 2HB TRP 30 -6.049 2.390 5.135 2456 HD1 TRP 30 HD1 TRP 30 -6.916 1.239 7.220 2457 HE1 TRP 30 HE1 TRP 30 -8.021 -1.023 7.768 2458 HE3 TRP 30 HE3 TRP 30 -6.630 -0.934 2.608 2459 HZ2 TRP 30 HZ2 TRP 30 -8.685 -3.413 6.416 2460 HZ3 TRP 30 HZ3 TRP 30 -7.520 -3.211 2.317 2461 HH2 TRP 30 HH2 TRP 30 -8.529 -4.421 4.181 2462 H THR 31 H THR 31 -2.750 0.999 5.697 2463 HA THR 31 HA THR 31 -2.247 3.854 5.979 2464 HB THR 31 HB THR 31 -0.645 1.721 7.352 2465 HG1 THR 31 HG1 THR 31 -3.284 1.955 7.528 2466 1HG2 THR 31 1HG2 THR 31 -1.388 4.574 7.917 2467 2HG2 THR 31 2HG2 THR 31 -0.786 3.506 9.185 2468 3HG2 THR 31 3HG2 THR 31 0.218 3.858 7.778 2469 H ASP 32 H ASP 32 -0.294 4.847 5.536 2470 HA ASP 32 HA ASP 32 1.014 4.112 3.200 2471 1HB ASP 32 1HB ASP 32 0.966 6.361 4.654 2472 2HB ASP 32 2HB ASP 32 2.535 5.747 5.164 2473 HA PRO 33 HA PRO 33 3.644 0.799 4.606 2474 1HB PRO 33 1HB PRO 33 5.310 0.794 2.408 2475 2HB PRO 33 2HB PRO 33 3.755 -0.034 2.493 2476 1HG PRO 33 1HG PRO 33 4.442 2.594 1.263 2477 2HG PRO 33 2HG PRO 33 3.332 1.339 0.688 2478 1HD PRO 33 1HD PRO 33 2.462 3.594 1.884 2479 2HD PRO 33 2HD PRO 33 1.622 2.040 2.062 2480 H ARG 34 H ARG 34 4.784 3.907 3.538 2481 HA ARG 34 HA ARG 34 7.443 3.574 4.591 2482 1HB ARG 34 1HB ARG 34 5.958 6.035 3.656 2483 2HB ARG 34 2HB ARG 34 7.656 6.009 4.109 2484 1HG ARG 34 1HG ARG 34 7.280 3.967 2.209 2485 2HG ARG 34 2HG ARG 34 6.446 5.399 1.603 2486 1HD ARG 34 1HD ARG 34 9.255 5.511 2.669 2487 2HD ARG 34 2HD ARG 34 8.906 5.131 0.983 2488 HE ARG 34 HE ARG 34 7.764 7.342 0.901 2489 1HH1 ARG 34 1HH1 ARG 34 10.222 6.718 3.294 2490 2HH1 ARG 34 2HH1 ARG 34 10.650 8.386 3.476 2491 1HH2 ARG 34 1HH2 ARG 34 8.322 9.539 1.136 2492 2HH2 ARG 34 2HH2 ARG 34 9.569 9.989 2.249 2493 H MET 35 H MET 35 4.366 4.582 5.750 2494 HA MET 35 HA MET 35 5.253 6.129 7.965 2495 1HB MET 35 1HB MET 35 2.683 5.011 7.023 2496 2HB MET 35 2HB MET 35 2.806 5.448 8.723 2497 1HG MET 35 1HG MET 35 2.036 7.158 6.882 2498 2HG MET 35 2HG MET 35 2.950 7.649 8.301 2499 1HE MET 35 1HE MET 35 3.162 9.813 6.847 2500 2HE MET 35 2HE MET 35 4.328 10.016 5.539 2501 3HE MET 35 3HE MET 35 2.767 9.263 5.218 2502 H SER 36 H SER 36 3.783 5.121 10.098 2503 HA SER 36 HA SER 36 5.556 3.029 11.010 2504 1HB SER 36 1HB SER 36 4.239 3.318 13.171 2505 2HB SER 36 2HB SER 36 5.113 4.743 12.608 2506 HG SER 36 HG SER 36 2.451 4.389 12.972 2507 H SER 37 H SER 37 5.090 1.067 10.194 2508 HA SER 37 HA SER 37 2.668 -0.223 11.053 2509 1HB SER 37 1HB SER 37 2.703 0.945 8.472 2510 2HB SER 37 2HB SER 37 2.831 -0.799 8.244 2511 HG SER 37 HG SER 37 1.006 -0.837 9.849 No H/Q in entry = 2511 Start of MODEL 1 1 H1 SER 1 H1 SER 1 8.945 11.504 -7.724 2 H2 SER 1 H2 SER 1 8.969 11.653 -9.408 3 H3 SER 1 H3 SER 1 7.530 11.249 -8.615 4 HA SER 1 HA SER 1 8.026 9.151 -9.086 5 1HB SER 1 1HB SER 1 10.133 8.486 -10.023 6 2HB SER 1 2HB SER 1 9.786 10.100 -10.644 7 HG SER 1 HG SER 1 11.089 10.620 -8.528 8 H MET 2 H MET 2 9.450 7.269 -8.197 9 HA MET 2 HA MET 2 10.090 6.043 -6.397 10 1HB MET 2 1HB MET 2 11.339 8.701 -5.804 11 2HB MET 2 2HB MET 2 11.424 7.413 -4.611 12 1HG MET 2 1HG MET 2 12.359 7.125 -7.453 13 2HG MET 2 2HG MET 2 13.403 7.592 -6.111 14 1HE MET 2 1HE MET 2 14.955 6.065 -6.577 15 2HE MET 2 2HE MET 2 15.017 4.533 -5.705 16 3HE MET 2 3HE MET 2 14.547 4.562 -7.405 17 H GLY 3 H GLY 3 9.980 6.006 -3.858 18 1HA GLY 3 1HA GLY 3 8.533 7.401 -2.155 19 2HA GLY 3 2HA GLY 3 7.245 6.820 -3.204 20 H LEU 4 H LEU 4 6.361 4.904 -2.763 21 HA LEU 4 HA LEU 4 7.041 3.487 -0.415 22 1HB LEU 4 1HB LEU 4 5.479 2.164 -2.567 23 2HB LEU 4 2HB LEU 4 5.182 2.204 -0.840 24 HG LEU 4 HG LEU 4 4.853 4.749 -2.340 25 1HD1 LEU 4 1HD1 LEU 4 3.443 2.300 -3.006 26 2HD1 LEU 4 2HD1 LEU 4 2.359 3.596 -2.504 27 3HD1 LEU 4 3HD1 LEU 4 3.477 3.851 -3.844 28 1HD2 LEU 4 1HD2 LEU 4 4.487 4.184 0.201 29 2HD2 LEU 4 2HD2 LEU 4 3.409 5.288 -0.652 30 3HD2 LEU 4 3HD2 LEU 4 2.923 3.614 -0.383 31 HA PRO 5 HA PRO 5 10.180 0.569 -1.490 32 1HB PRO 5 1HB PRO 5 9.907 -1.332 -0.207 33 2HB PRO 5 2HB PRO 5 8.220 -1.545 -0.693 34 1HG PRO 5 1HG PRO 5 7.943 -0.658 1.444 35 2HG PRO 5 2HG PRO 5 9.395 0.349 1.310 36 1HD PRO 5 1HD PRO 5 7.851 1.983 0.832 37 2HD PRO 5 2HD PRO 5 6.655 0.817 0.234 38 HA PRO 6 HA PRO 6 9.476 -0.993 -5.548 39 1HB PRO 6 1HB PRO 6 10.791 -3.413 -5.504 40 2HB PRO 6 2HB PRO 6 11.578 -1.845 -5.704 41 1HG PRO 6 1HG PRO 6 12.676 -2.594 -3.801 42 2HG PRO 6 2HG PRO 6 11.266 -3.510 -3.238 43 1HD PRO 6 1HD PRO 6 11.088 -1.653 -1.860 44 2HD PRO 6 2HD PRO 6 11.808 -0.569 -3.069 45 H GLY 7 H GLY 7 8.079 -2.479 -2.902 46 1HA GLY 7 1HA GLY 7 6.531 -4.271 -4.670 47 2HA GLY 7 2HA GLY 7 6.986 -4.732 -3.037 48 H TRP 8 H TRP 8 6.410 -1.638 -2.577 49 HA TRP 8 HA TRP 8 3.628 -2.124 -1.820 50 1HB TRP 8 1HB TRP 8 5.761 -0.226 -0.893 51 2HB TRP 8 2HB TRP 8 4.070 0.131 -0.557 52 HD1 TRP 8 HD1 TRP 8 6.943 -1.942 0.650 53 HE1 TRP 8 HE1 TRP 8 6.206 -3.351 2.663 54 HE3 TRP 8 HE3 TRP 8 1.900 -1.174 0.363 55 HZ2 TRP 8 HZ2 TRP 8 3.793 -4.051 3.969 56 HZ3 TRP 8 HZ3 TRP 8 0.448 -2.249 2.035 57 HH2 TRP 8 HH2 TRP 8 1.380 -3.651 3.798 58 H ASP 9 H ASP 9 2.011 -1.300 -2.963 59 HA ASP 9 HA ASP 9 2.482 1.161 -4.515 60 1HB ASP 9 1HB ASP 9 1.380 -1.455 -5.409 61 2HB ASP 9 2HB ASP 9 0.632 0.002 -6.058 62 H GLU 10 H GLU 10 0.576 2.468 -4.899 63 HA GLU 10 HA GLU 10 -1.404 2.126 -2.752 64 1HB GLU 10 1HB GLU 10 -1.754 4.680 -3.769 65 2HB GLU 10 2HB GLU 10 -0.884 4.256 -2.303 66 1HG GLU 10 1HG GLU 10 1.142 3.949 -3.871 67 2HG GLU 10 2HG GLU 10 0.189 4.887 -5.020 68 H TYR 11 H TYR 11 -3.568 2.170 -3.126 69 HA TYR 11 HA TYR 11 -4.679 2.886 -5.665 70 1HB TYR 11 1HB TYR 11 -4.074 0.084 -5.082 71 2HB TYR 11 2HB TYR 11 -5.770 0.354 -5.474 72 HD1 TYR 11 HD1 TYR 11 -6.204 1.809 -7.619 73 HD2 TYR 11 HD2 TYR 11 -2.567 -0.246 -6.810 74 HE1 TYR 11 HE1 TYR 11 -5.650 1.860 -10.013 75 HE2 TYR 11 HE2 TYR 11 -2.003 -0.202 -9.203 76 HH TYR 11 HH TYR 11 -3.878 0.102 -11.530 77 H LYS 12 H LYS 12 -6.902 3.148 -5.605 78 HA LYS 12 HA LYS 12 -7.989 3.261 -2.902 79 1HB LYS 12 1HB LYS 12 -8.695 4.597 -5.467 80 2HB LYS 12 2HB LYS 12 -9.789 4.639 -4.100 81 1HG LYS 12 1HG LYS 12 -7.417 5.347 -3.024 82 2HG LYS 12 2HG LYS 12 -7.296 6.046 -4.621 83 1HD LYS 12 1HD LYS 12 -9.894 6.582 -3.632 84 2HD LYS 12 2HD LYS 12 -8.725 7.022 -2.379 85 1HE LYS 12 1HE LYS 12 -7.712 7.783 -4.902 86 2HE LYS 12 2HE LYS 12 -9.356 8.413 -4.759 87 1HZ LYS 12 1HZ LYS 12 -7.267 8.795 -2.686 88 2HZ LYS 12 2HZ LYS 12 -7.584 9.923 -3.907 89 3HZ LYS 12 3HZ LYS 12 -8.779 9.549 -2.768 90 H THR 13 H THR 13 -9.231 1.648 -2.227 91 HA THR 13 HA THR 13 -10.265 -0.344 -3.953 92 HB THR 13 HB THR 13 -11.509 -0.106 -1.288 93 HG1 THR 13 HG1 THR 13 -9.212 -1.044 -0.656 94 1HG2 THR 13 1HG2 THR 13 -10.649 -2.145 -3.165 95 2HG2 THR 13 2HG2 THR 13 -10.121 -2.495 -1.520 96 3HG2 THR 13 3HG2 THR 13 -11.833 -2.242 -1.861 97 H HIS 14 H HIS 14 -12.797 -0.909 -3.033 98 HA HIS 14 HA HIS 14 -14.437 0.458 -4.764 99 1HB HIS 14 1HB HIS 14 -15.248 -0.910 -2.189 100 2HB HIS 14 2HB HIS 14 -16.328 -0.514 -3.523 101 HD1 HIS 14 HD1 HIS 14 -15.922 -1.849 -5.783 102 HD2 HIS 14 HD2 HIS 14 -13.872 -3.273 -2.460 103 HE1 HIS 14 HE1 HIS 14 -15.160 -4.165 -6.402 104 HE2 HIS 14 HE2 HIS 14 -13.921 -5.008 -4.378 105 H ASN 15 H ASN 15 -14.539 0.858 -1.211 106 HA ASN 15 HA ASN 15 -16.208 3.091 -1.212 107 1HB ASN 15 1HB ASN 15 -15.193 3.545 1.072 108 2HB ASN 15 2HB ASN 15 -15.887 1.943 0.844 109 2HD2 ASN 15 2HD2 ASN 15 -14.628 0.186 1.040 110 1HD2 ASN 15 1HD2 ASN 15 -12.942 0.232 1.414 111 H GLY 16 H GLY 16 -12.734 2.836 -1.625 112 1HA GLY 16 1HA GLY 16 -11.722 4.581 -3.031 113 2HA GLY 16 2HA GLY 16 -12.673 5.748 -2.119 114 H LYS 17 H LYS 17 -11.108 3.093 -0.481 115 HA LYS 17 HA LYS 17 -9.468 4.997 0.975 116 1HB LYS 17 1HB LYS 17 -10.673 3.061 2.097 117 2HB LYS 17 2HB LYS 17 -8.976 3.251 2.509 118 1HG LYS 17 1HG LYS 17 -9.253 1.485 0.265 119 2HG LYS 17 2HG LYS 17 -8.533 1.194 1.849 120 1HD LYS 17 1HD LYS 17 -10.963 0.969 2.670 121 2HD LYS 17 2HD LYS 17 -11.365 0.774 0.963 122 1HE LYS 17 1HE LYS 17 -9.296 -0.950 1.194 123 2HE LYS 17 2HE LYS 17 -9.993 -1.060 2.810 124 1HZ LYS 17 1HZ LYS 17 -11.676 -1.294 0.393 125 2HZ LYS 17 2HZ LYS 17 -10.866 -2.635 1.031 126 3HZ LYS 17 3HZ LYS 17 -12.012 -1.813 1.967 127 H THR 18 H THR 18 -7.429 5.462 0.477 128 HA THR 18 HA THR 18 -6.174 4.251 -1.797 129 HB THR 18 HB THR 18 -4.603 5.941 0.097 130 HG1 THR 18 HG1 THR 18 -6.397 7.145 -1.730 131 1HG2 THR 18 1HG2 THR 18 -4.459 5.087 -2.640 132 2HG2 THR 18 2HG2 THR 18 -4.482 6.849 -2.563 133 3HG2 THR 18 3HG2 THR 18 -3.254 5.943 -1.677 134 H TYR 19 H TYR 19 -6.310 2.058 -0.878 135 HA TYR 19 HA TYR 19 -4.639 1.401 1.347 136 1HB TYR 19 1HB TYR 19 -5.566 -0.704 1.250 137 2HB TYR 19 2HB TYR 19 -6.829 0.235 0.464 138 HD1 TYR 19 HD1 TYR 19 -7.122 0.109 -1.987 139 HD2 TYR 19 HD2 TYR 19 -4.308 -2.351 0.043 140 HE1 TYR 19 HE1 TYR 19 -6.988 -1.353 -3.959 141 HE2 TYR 19 HE2 TYR 19 -4.165 -3.820 -1.924 142 HH TYR 19 HH TYR 19 -4.619 -3.898 -4.202 143 H TYR 20 H TYR 20 -2.679 0.509 1.392 144 HA TYR 20 HA TYR 20 -1.189 0.406 -1.131 145 1HB TYR 20 1HB TYR 20 0.820 0.645 0.220 146 2HB TYR 20 2HB TYR 20 -0.120 0.486 1.700 147 HD1 TYR 20 HD1 TYR 20 -1.672 2.316 2.377 148 HD2 TYR 20 HD2 TYR 20 1.003 2.732 -0.906 149 HE1 TYR 20 HE1 TYR 20 -1.962 4.757 2.458 150 HE2 TYR 20 HE2 TYR 20 0.719 5.175 -0.835 151 HH TYR 20 HH TYR 20 -1.420 6.750 0.180 152 H TYR 21 H TYR 21 -0.221 -1.468 -1.798 153 HA TYR 21 HA TYR 21 -0.560 -3.821 -0.062 154 1HB TYR 21 1HB TYR 21 -2.287 -3.856 -1.782 155 2HB TYR 21 2HB TYR 21 -1.072 -3.649 -3.040 156 HD1 TYR 21 HD1 TYR 21 -0.647 -5.545 -4.264 157 HD2 TYR 21 HD2 TYR 21 -1.590 -5.959 -0.136 158 HE1 TYR 21 HE1 TYR 21 -0.427 -7.985 -4.465 159 HE2 TYR 21 HE2 TYR 21 -1.372 -8.400 -0.325 160 HH TYR 21 HH TYR 21 -1.461 -10.048 -3.080 161 H ASN 22 H ASN 22 1.007 -5.362 -0.092 162 HA ASN 22 HA ASN 22 3.474 -4.697 -1.557 163 1HB ASN 22 1HB ASN 22 3.513 -4.709 0.992 164 2HB ASN 22 2HB ASN 22 3.270 -6.450 0.895 165 2HD2 ASN 22 2HD2 ASN 22 5.274 -4.119 -0.878 166 1HD2 ASN 22 1HD2 ASN 22 6.761 -4.966 -0.650 167 H HIS 23 H HIS 23 3.838 -5.971 -3.250 168 HA HIS 23 HA HIS 23 2.525 -8.547 -3.446 169 1HB HIS 23 1HB HIS 23 2.521 -8.146 -5.641 170 2HB HIS 23 2HB HIS 23 4.266 -7.944 -5.671 171 HD1 HIS 23 HD1 HIS 23 1.403 -5.778 -4.390 172 HD2 HIS 23 HD2 HIS 23 4.826 -5.532 -6.731 173 HE1 HIS 23 HE1 HIS 23 1.543 -3.379 -5.122 174 HE2 HIS 23 HE2 HIS 23 3.622 -3.250 -6.539 175 H ASN 24 H ASN 24 5.275 -7.625 -2.010 176 HA ASN 24 HA ASN 24 6.895 -9.863 -2.989 177 1HB ASN 24 1HB ASN 24 8.740 -8.847 -1.744 178 2HB ASN 24 2HB ASN 24 7.645 -7.644 -1.070 179 2HD2 ASN 24 2HD2 ASN 24 8.933 -5.998 -1.932 180 1HD2 ASN 24 1HD2 ASN 24 8.882 -5.598 -3.610 181 H THR 25 H THR 25 5.032 -8.791 -0.282 182 HA THR 25 HA THR 25 5.632 -11.314 1.097 183 HB THR 25 HB THR 25 5.779 -10.305 3.227 184 HG1 THR 25 HG1 THR 25 4.547 -8.625 3.559 185 1HG2 THR 25 1HG2 THR 25 7.373 -9.025 1.083 186 2HG2 THR 25 2HG2 THR 25 7.428 -8.271 2.677 187 3HG2 THR 25 3HG2 THR 25 7.900 -9.959 2.484 188 H LYS 26 H LYS 26 3.398 -9.826 -0.541 189 HA LYS 26 HA LYS 26 1.130 -9.702 -0.587 190 1HB LYS 26 1HB LYS 26 1.132 -12.058 1.285 191 2HB LYS 26 2HB LYS 26 0.004 -11.693 -0.014 192 1HG LYS 26 1HG LYS 26 2.878 -12.535 -0.336 193 2HG LYS 26 2HG LYS 26 1.453 -13.534 -0.629 194 1HD LYS 26 1HD LYS 26 0.940 -11.349 -2.183 195 2HD LYS 26 2HD LYS 26 2.694 -11.482 -2.311 196 1HE LYS 26 1HE LYS 26 2.477 -13.160 -3.742 197 2HE LYS 26 2HE LYS 26 1.585 -14.081 -2.533 198 1HZ LYS 26 1HZ LYS 26 0.212 -12.015 -4.120 199 2HZ LYS 26 2HZ LYS 26 0.474 -13.551 -4.778 200 3HZ LYS 26 3HZ LYS 26 -0.434 -13.383 -3.361 201 H THR 27 H THR 27 1.399 -7.696 0.724 202 HA THR 27 HA THR 27 -0.019 -7.998 3.295 203 HB THR 27 HB THR 27 2.107 -5.920 2.786 204 HG1 THR 27 HG1 THR 27 3.499 -7.241 3.892 205 1HG2 THR 27 1HG2 THR 27 0.379 -6.674 5.103 206 2HG2 THR 27 2HG2 THR 27 1.981 -5.998 5.396 207 3HG2 THR 27 3HG2 THR 27 0.787 -5.075 4.481 208 H SER 28 H SER 28 -2.004 -7.226 2.939 209 HA SER 28 HA SER 28 -2.306 -4.792 1.324 210 1HB SER 28 1HB SER 28 -4.816 -5.514 1.506 211 2HB SER 28 2HB SER 28 -3.742 -6.381 0.408 212 HG SER 28 HG SER 28 -5.067 -7.725 1.806 213 H THR 29 H THR 29 -2.771 -2.927 2.260 214 HA THR 29 HA THR 29 -4.392 -2.771 4.647 215 HB THR 29 HB THR 29 -2.017 -3.167 5.466 216 HG1 THR 29 HG1 THR 29 -3.906 -1.650 6.383 217 1HG2 THR 29 1HG2 THR 29 -1.010 -1.669 3.684 218 2HG2 THR 29 2HG2 THR 29 -1.569 -0.305 4.652 219 3HG2 THR 29 3HG2 THR 29 -0.405 -1.446 5.325 220 H TRP 30 H TRP 30 -4.488 -0.311 5.339 221 HA TRP 30 HA TRP 30 -4.666 1.237 2.841 222 1HB TRP 30 1HB TRP 30 -6.078 2.573 4.915 223 2HB TRP 30 2HB TRP 30 -6.727 1.830 3.457 224 HD1 TRP 30 HD1 TRP 30 -6.981 1.621 7.098 225 HE1 TRP 30 HE1 TRP 30 -8.181 -0.541 7.816 226 HE3 TRP 30 HE3 TRP 30 -6.804 -0.896 2.666 227 HZ2 TRP 30 HZ2 TRP 30 -8.954 -2.996 6.646 228 HZ3 TRP 30 HZ3 TRP 30 -7.793 -3.148 2.541 229 HH2 TRP 30 HH2 TRP 30 -8.848 -4.173 4.493 230 H THR 31 H THR 31 -2.970 0.933 5.724 231 HA THR 31 HA THR 31 -2.297 3.716 6.078 232 HB THR 31 HB THR 31 -0.726 1.447 7.260 233 HG1 THR 31 HG1 THR 31 -2.396 1.757 9.036 234 1HG2 THR 31 1HG2 THR 31 -0.348 4.077 7.481 235 2HG2 THR 31 2HG2 THR 31 -1.540 3.870 8.764 236 3HG2 THR 31 3HG2 THR 31 -0.028 2.963 8.810 237 H ASP 32 H ASP 32 -0.308 4.678 5.687 238 HA ASP 32 HA ASP 32 0.960 3.974 3.278 239 1HB ASP 32 1HB ASP 32 0.839 6.278 4.328 240 2HB ASP 32 2HB ASP 32 2.127 5.763 5.414 241 HA PRO 33 HA PRO 33 3.721 0.833 4.796 242 1HB PRO 33 1HB PRO 33 5.275 0.608 2.573 243 2HB PRO 33 2HB PRO 33 3.654 -0.080 2.696 244 1HG PRO 33 1HG PRO 33 4.542 2.468 1.406 245 2HG PRO 33 2HG PRO 33 3.389 1.256 0.819 246 1HD PRO 33 1HD PRO 33 2.606 3.575 1.973 247 2HD PRO 33 2HD PRO 33 1.676 2.070 2.121 248 H ARG 34 H ARG 34 4.788 3.865 3.471 249 HA ARG 34 HA ARG 34 7.511 3.670 4.279 250 1HB ARG 34 1HB ARG 34 5.801 6.088 3.679 251 2HB ARG 34 2HB ARG 34 7.545 6.122 3.897 252 1HG ARG 34 1HG ARG 34 6.724 4.165 1.924 253 2HG ARG 34 2HG ARG 34 6.196 5.799 1.521 254 1HD ARG 34 1HD ARG 34 8.802 6.111 2.423 255 2HD ARG 34 2HD ARG 34 8.252 6.167 0.748 256 HE ARG 34 HE ARG 34 8.675 3.665 0.796 257 1HH1 ARG 34 1HH1 ARG 34 10.458 5.938 2.746 258 2HH1 ARG 34 2HH1 ARG 34 11.877 4.951 2.828 259 1HH2 ARG 34 1HH2 ARG 34 10.543 2.360 0.898 260 2HH2 ARG 34 2HH2 ARG 34 11.926 2.918 1.777 261 H MET 35 H MET 35 4.555 4.632 5.825 262 HA MET 35 HA MET 35 5.871 5.902 8.059 263 1HB MET 35 1HB MET 35 3.004 5.266 7.404 264 2HB MET 35 2HB MET 35 3.471 5.851 8.996 265 1HG MET 35 1HG MET 35 4.075 7.916 8.223 266 2HG MET 35 2HG MET 35 4.308 7.354 6.568 267 1HE MET 35 1HE MET 35 1.891 7.680 9.405 268 2HE MET 35 2HE MET 35 1.588 9.319 8.825 269 3HE MET 35 3HE MET 35 0.332 8.088 8.689 270 H SER 36 H SER 36 3.341 3.437 8.327 271 HA SER 36 HA SER 36 5.121 1.915 10.112 272 1HB SER 36 1HB SER 36 3.200 3.288 11.190 273 2HB SER 36 2HB SER 36 2.147 2.033 10.535 274 HG SER 36 HG SER 36 4.043 0.714 11.675 275 H SER 37 H SER 37 1.834 1.361 8.883 276 HA SER 37 HA SER 37 0.884 -0.394 7.798 277 1HB SER 37 1HB SER 37 2.680 0.448 6.104 278 2HB SER 37 2HB SER 37 3.533 -1.035 6.533 279 HG SER 37 HG SER 37 0.922 -1.522 6.038 No H/Q in entry = 279
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