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NMR Restraints Grid |
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Result table
(Save to zip file containing files for each block)
image | mrblock_id | pdb_id | cing | stage | position | program | type |
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6301 |
1iry ![]() ![]() |
cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 1H MET 1 HT1 MET 1 237.935 -23.880 2.954 2 2H MET 1 HT2 MET 1 238.027 -25.565 3.269 3 3H MET 1 HT3 MET 1 238.392 -24.961 1.705 4 HA MET 1 HA MET 1 239.890 -24.327 4.157 5 1HB MET 1 HB2 MET 1 239.852 -26.756 3.206 6 2HB MET 1 HB1 MET 1 240.836 -26.084 1.912 7 1HG MET 1 HG2 MET 1 242.365 -25.217 3.754 8 2HG MET 1 HG1 MET 1 241.479 -26.294 4.831 9 1HE MET 1 HE1 MET 1 243.186 -28.607 5.364 10 2HE MET 1 HE2 MET 1 243.790 -26.950 5.390 11 3HE MET 1 HE3 MET 1 244.707 -28.210 4.563 12 H GLY 2 HN GLY 2 241.272 -22.680 3.918 13 1HA GLY 2 HA2 GLY 2 242.403 -22.000 1.355 14 2HA GLY 2 HA1 GLY 2 241.222 -20.833 1.929 15 H ALA 3 HN ALA 3 243.442 -19.644 1.615 16 HA ALA 3 HA ALA 3 244.315 -18.906 4.211 17 1HB ALA 3 HB1 ALA 3 246.814 -19.529 3.471 18 2HB ALA 3 HB2 ALA 3 245.945 -20.862 2.711 19 3HB ALA 3 HB3 ALA 3 245.803 -20.595 4.448 20 H SER 4 HN SER 4 246.566 -17.583 3.846 21 HA SER 4 HA SER 4 247.442 -15.656 3.017 22 1HB SER 4 HB2 SER 4 248.328 -16.430 1.092 23 2HB SER 4 HB1 SER 4 246.863 -17.314 0.668 24 HG SER 4 HG SER 4 247.469 -15.481 -0.723 25 H ARG 5 HN ARG 5 246.130 -14.255 4.055 26 HA ARG 5 HA ARG 5 243.553 -13.512 3.152 27 1HB ARG 5 HB2 ARG 5 245.525 -12.367 5.096 28 2HB ARG 5 HB1 ARG 5 244.112 -11.427 4.635 29 1HG ARG 5 HG2 ARG 5 243.853 -14.236 5.641 30 2HG ARG 5 HG1 ARG 5 243.972 -12.863 6.744 31 1HD ARG 5 HD2 ARG 5 241.957 -11.950 6.016 32 2HD ARG 5 HD1 ARG 5 241.972 -12.874 4.514 33 HE ARG 5 HE ARG 5 240.970 -13.729 7.070 34 1HH1 ARG 5 HH11 ARG 5 242.217 -14.781 3.985 35 2HH1 ARG 5 HH12 ARG 5 241.456 -16.335 4.067 36 1HH2 ARG 5 HH21 ARG 5 239.969 -15.771 7.180 37 2HH2 ARG 5 HH22 ARG 5 240.180 -16.897 5.879 38 H LEU 6 HN LEU 6 243.545 -12.918 1.039 39 HA LEU 6 HA LEU 6 245.424 -10.935 0.060 40 1HB LEU 6 HB2 LEU 6 244.352 -12.981 -1.212 41 2HB LEU 6 HB1 LEU 6 243.052 -11.845 -1.514 42 HG LEU 6 HG LEU 6 245.860 -11.054 -2.175 43 1HD1 LEU 6 HD11 LEU 6 245.140 -13.398 -3.110 44 2HD1 LEU 6 HD12 LEU 6 245.954 -12.220 -4.140 45 3HD1 LEU 6 HD13 LEU 6 244.204 -12.415 -4.237 46 1HD2 LEU 6 HD21 LEU 6 243.646 -9.625 -2.283 47 2HD2 LEU 6 HD22 LEU 6 243.456 -10.461 -3.823 48 3HD2 LEU 6 HD23 LEU 6 244.891 -9.481 -3.523 49 H TYR 7 HN TYR 7 245.117 -8.878 0.383 50 HA TYR 7 HA TYR 7 242.377 -7.805 0.411 51 1HB TYR 7 HB2 TYR 7 244.742 -7.167 2.153 52 2HB TYR 7 HB1 TYR 7 243.471 -5.977 1.898 53 HD1 TYR 7 HD1 TYR 7 241.979 -5.845 3.638 54 HD2 TYR 7 HD2 TYR 7 243.598 -9.648 2.631 55 HE1 TYR 7 HE1 TYR 7 240.650 -6.879 5.431 56 HE2 TYR 7 HE2 TYR 7 242.271 -10.692 4.418 57 HH TYR 7 HH TYR 7 241.185 -10.054 6.518 58 H THR 8 HN THR 8 242.644 -5.240 0.207 59 HA THR 8 HA THR 8 244.423 -4.733 -2.092 60 HB THR 8 HB THR 8 242.626 -3.276 -2.987 61 HG1 THR 8 HG1 THR 8 240.968 -4.514 -1.058 62 1HG2 THR 8 HG21 THR 8 240.931 -5.242 -3.370 63 2HG2 THR 8 HG22 THR 8 242.240 -6.197 -2.673 64 3HG2 THR 8 HG23 THR 8 242.524 -5.238 -4.124 65 H LEU 9 HN LEU 9 244.575 -2.324 -2.533 66 HA LEU 9 HA LEU 9 244.356 -0.598 -0.223 67 1HB LEU 9 HB2 LEU 9 246.572 -1.954 -0.132 68 2HB LEU 9 HB1 LEU 9 247.077 -0.918 -1.451 69 HG LEU 9 HG LEU 9 246.362 -0.081 1.345 70 1HD1 LEU 9 HD11 LEU 9 248.652 0.672 1.457 71 2HD1 LEU 9 HD12 LEU 9 248.919 0.187 -0.217 72 3HD1 LEU 9 HD13 LEU 9 248.603 -1.034 1.015 73 1HD2 LEU 9 HD21 LEU 9 247.063 2.210 0.502 74 2HD2 LEU 9 HD22 LEU 9 245.468 1.635 0.016 75 3HD2 LEU 9 HD23 LEU 9 246.815 1.566 -1.120 76 H VAL 10 HN VAL 10 243.332 1.062 -1.230 77 HA VAL 10 HA VAL 10 244.406 1.941 -3.808 78 HB VAL 10 HB VAL 10 242.195 1.321 -4.183 79 1HG1 VAL 10 HG11 VAL 10 240.400 2.473 -2.612 80 2HG1 VAL 10 HG12 VAL 10 241.733 2.303 -1.471 81 3HG1 VAL 10 HG13 VAL 10 241.093 0.884 -2.301 82 1HG2 VAL 10 HG21 VAL 10 242.739 3.553 -5.074 83 2HG2 VAL 10 HG22 VAL 10 242.045 4.273 -3.622 84 3HG2 VAL 10 HG23 VAL 10 241.020 3.363 -4.731 85 H LEU 11 HN LEU 11 245.351 3.772 -3.948 86 HA LEU 11 HA LEU 11 244.798 5.865 -1.961 87 1HB LEU 11 HB2 LEU 11 247.259 4.481 -2.586 88 2HB LEU 11 HB1 LEU 11 247.426 6.198 -2.887 89 HG LEU 11 HG LEU 11 246.815 4.815 -0.283 90 1HD1 LEU 11 HD11 LEU 11 249.196 5.446 -1.304 91 2HD1 LEU 11 HD12 LEU 11 248.853 5.523 0.425 92 3HD1 LEU 11 HD13 LEU 11 248.807 6.992 -0.549 93 1HD2 LEU 11 HD21 LEU 11 246.156 7.582 -1.117 94 2HD2 LEU 11 HD22 LEU 11 246.815 7.342 0.501 95 3HD2 LEU 11 HD23 LEU 11 245.336 6.512 0.019 96 H VAL 12 HN VAL 12 243.824 7.472 -3.029 97 HA VAL 12 HA VAL 12 244.194 7.785 -5.867 98 HB VAL 12 HB VAL 12 242.646 9.602 -4.027 99 1HG1 VAL 12 HG11 VAL 12 241.790 9.056 -6.797 100 2HG1 VAL 12 HG12 VAL 12 243.267 10.003 -6.612 101 3HG1 VAL 12 HG13 VAL 12 241.765 10.560 -5.876 102 1HG2 VAL 12 HG21 VAL 12 242.103 6.863 -4.945 103 2HG2 VAL 12 HG22 VAL 12 240.778 8.004 -5.174 104 3HG2 VAL 12 HG23 VAL 12 241.453 7.747 -3.565 105 H LEU 13 HN LEU 13 246.557 8.153 -5.468 106 HA LEU 13 HA LEU 13 247.233 10.879 -4.667 107 1HB LEU 13 HB2 LEU 13 248.509 8.816 -3.926 108 2HB LEU 13 HB1 LEU 13 249.121 8.735 -5.564 109 HG LEU 13 HG LEU 13 250.773 10.067 -4.951 110 1HD1 LEU 13 HD11 LEU 13 248.593 12.073 -4.508 111 2HD1 LEU 13 HD12 LEU 13 249.635 11.882 -5.916 112 3HD1 LEU 13 HD13 LEU 13 250.305 12.466 -4.395 113 1HD2 LEU 13 HD21 LEU 13 250.319 11.290 -2.542 114 2HD2 LEU 13 HD22 LEU 13 251.090 9.722 -2.776 115 3HD2 LEU 13 HD23 LEU 13 249.365 9.811 -2.428 116 H GLN 14 HN GLN 14 247.257 12.421 -6.130 117 HA GLN 14 HA GLN 14 247.707 11.731 -8.950 118 1HB GLN 14 HB2 GLN 14 245.944 13.597 -7.583 119 2HB GLN 14 HB1 GLN 14 246.894 14.397 -8.827 120 1HG GLN 14 HG2 GLN 14 246.065 12.162 -10.133 121 2HG GLN 14 HG1 GLN 14 244.697 12.483 -9.069 122 1HE2 GLN 14 HE21 GLN 14 243.671 12.797 -11.219 123 2HE2 GLN 14 HE22 GLN 14 243.726 14.380 -11.911 124 HA PRO 15 HA PRO 15 251.610 13.773 -9.058 125 1HB PRO 15 HB2 PRO 15 251.508 15.138 -11.422 126 2HB PRO 15 HB1 PRO 15 251.765 13.394 -11.305 127 1HG PRO 15 HG2 PRO 15 249.246 14.904 -11.877 128 2HG PRO 15 HG1 PRO 15 249.870 13.434 -12.647 129 1HD PRO 15 HD2 PRO 15 247.926 13.350 -10.787 130 2HD PRO 15 HD1 PRO 15 249.154 12.073 -10.918 131 H GLN 16 HN GLN 16 249.406 15.228 -7.697 132 HA GLN 16 HA GLN 16 250.691 17.773 -7.511 133 1HB GLN 16 HB2 GLN 16 248.162 17.461 -9.013 134 2HB GLN 16 HB1 GLN 16 248.192 18.773 -7.843 135 1HG GLN 16 HG2 GLN 16 250.589 18.691 -9.476 136 2HG GLN 16 HG1 GLN 16 249.120 18.862 -10.435 137 1HE2 GLN 16 HE21 GLN 16 251.116 20.825 -10.206 138 2HE2 GLN 16 HE22 GLN 16 250.432 22.201 -9.418 139 H ARG 17 HN ARG 17 247.856 15.806 -6.708 140 HA ARG 17 HA ARG 17 248.214 16.537 -3.903 141 1HB ARG 17 HB2 ARG 17 245.667 16.720 -3.725 142 2HB ARG 17 HB1 ARG 17 246.521 18.072 -4.453 143 1HG ARG 17 HG2 ARG 17 244.972 17.902 -6.053 144 2HG ARG 17 HG1 ARG 17 245.964 16.567 -6.641 145 1HD ARG 17 HD2 ARG 17 244.473 15.279 -4.807 146 2HD ARG 17 HD1 ARG 17 243.340 16.539 -5.291 147 HE ARG 17 HE ARG 17 244.256 15.527 -7.646 148 1HH1 ARG 17 HH11 ARG 17 242.766 14.139 -4.813 149 2HH1 ARG 17 HH12 ARG 17 242.005 12.853 -5.689 150 1HH2 ARG 17 HH21 ARG 17 243.254 13.839 -8.801 151 2HH2 ARG 17 HH22 ARG 17 242.283 12.683 -7.953 152 H VAL 18 HN VAL 18 247.026 15.102 -2.420 153 HA VAL 18 HA VAL 18 246.437 12.458 -3.587 154 HB VAL 18 HB VAL 18 248.632 12.265 -2.628 155 1HG1 VAL 18 HG11 VAL 18 249.328 13.105 -0.623 156 2HG1 VAL 18 HG12 VAL 18 247.727 12.985 0.108 157 3HG1 VAL 18 HG13 VAL 18 248.084 14.289 -1.024 158 1HG2 VAL 18 HG21 VAL 18 247.085 10.389 -2.277 159 2HG2 VAL 18 HG22 VAL 18 246.615 11.080 -0.724 160 3HG2 VAL 18 HG23 VAL 18 248.268 10.520 -0.976 161 H LEU 19 HN LEU 19 245.003 11.140 -2.317 162 HA LEU 19 HA LEU 19 243.371 12.679 -0.405 163 1HB LEU 19 HB2 LEU 19 242.163 12.380 -2.490 164 2HB LEU 19 HB1 LEU 19 242.461 10.653 -2.445 165 HG LEU 19 HG LEU 19 241.008 10.372 -0.556 166 1HD1 LEU 19 HD11 LEU 19 239.728 12.732 -0.062 167 2HD1 LEU 19 HD12 LEU 19 241.396 13.257 -0.288 168 3HD1 LEU 19 HD13 LEU 19 241.012 12.042 0.931 169 1HD2 LEU 19 HD21 LEU 19 240.157 10.999 -3.035 170 2HD2 LEU 19 HD22 LEU 19 239.323 12.235 -2.094 171 3HD2 LEU 19 HD23 LEU 19 239.083 10.529 -1.716 172 H LEU 20 HN LEU 20 243.627 11.887 1.576 173 HA LEU 20 HA LEU 20 243.963 8.974 1.878 174 1HB LEU 20 HB2 LEU 20 245.233 11.284 3.247 175 2HB LEU 20 HB1 LEU 20 244.899 9.859 4.211 176 HG LEU 20 HG LEU 20 246.477 9.768 1.648 177 1HD1 LEU 20 HD11 LEU 20 248.487 9.676 3.042 178 2HD1 LEU 20 HD12 LEU 20 247.503 9.965 4.477 179 3HD1 LEU 20 HD13 LEU 20 247.636 11.210 3.236 180 1HD2 LEU 20 HD21 LEU 20 246.263 7.826 3.941 181 2HD2 LEU 20 HD22 LEU 20 247.196 7.606 2.462 182 3HD2 LEU 20 HD23 LEU 20 245.435 7.669 2.392 183 H GLY 21 HN GLY 21 242.710 7.880 3.339 184 1HA GLY 21 HA2 GLY 21 240.358 9.324 4.295 185 2HA GLY 21 HA1 GLY 21 240.533 7.581 4.189 186 H MET 22 HN MET 22 240.057 9.908 6.330 187 HA MET 22 HA MET 22 241.738 8.665 8.404 188 1HB MET 22 HB2 MET 22 242.270 11.008 8.181 189 2HB MET 22 HB1 MET 22 240.569 11.446 8.264 190 1HG MET 22 HG2 MET 22 240.434 10.873 10.552 191 2HG MET 22 HG1 MET 22 242.003 10.074 10.516 192 1HE MET 22 HE1 MET 22 244.403 13.054 9.913 193 2HE MET 22 HE2 MET 22 243.919 11.494 9.251 194 3HE MET 22 HE3 MET 22 244.433 11.618 10.932 195 H LYS 23 HN LYS 23 240.758 7.939 10.308 196 HA LYS 23 HA LYS 23 237.890 7.533 10.103 197 1HB LYS 23 HB2 LYS 23 240.124 6.276 11.554 198 2HB LYS 23 HB1 LYS 23 238.621 6.364 12.462 199 1HG LYS 23 HG2 LYS 23 237.698 5.440 10.109 200 2HG LYS 23 HG1 LYS 23 239.322 4.749 10.106 201 1HD LYS 23 HD2 LYS 23 237.902 3.148 11.132 202 2HD LYS 23 HD1 LYS 23 238.841 3.895 12.427 203 1HE LYS 23 HE2 LYS 23 237.021 4.780 13.394 204 2HE LYS 23 HE1 LYS 23 236.318 5.259 11.849 205 1HZ LYS 23 HZ1 LYS 23 235.044 3.547 13.121 206 2HZ LYS 23 HZ2 LYS 23 236.309 2.462 12.832 207 3HZ LYS 23 HZ3 LYS 23 235.434 3.104 11.535 208 H LYS 24 HN LYS 24 236.391 8.219 11.652 209 HA LYS 24 HA LYS 24 237.236 10.605 13.088 210 1HB LYS 24 HB2 LYS 24 234.603 9.496 12.205 211 2HB LYS 24 HB1 LYS 24 234.633 10.624 13.555 212 1HG LYS 24 HG2 LYS 24 235.027 12.384 12.235 213 2HG LYS 24 HG1 LYS 24 236.185 11.502 11.239 214 1HD LYS 24 HD2 LYS 24 234.561 10.721 9.804 215 2HD LYS 24 HD1 LYS 24 233.283 10.849 11.014 216 1HE LYS 24 HE2 LYS 24 234.040 13.450 10.739 217 2HE LYS 24 HE1 LYS 24 234.288 12.839 9.105 218 1HZ LYS 24 HZ1 LYS 24 232.024 13.756 9.590 219 2HZ LYS 24 HZ2 LYS 24 231.768 12.432 10.612 220 3HZ LYS 24 HZ3 LYS 24 232.039 12.185 8.961 221 H ARG 25 HN ARG 25 236.048 7.377 13.663 222 HA ARG 25 HA ARG 25 237.051 7.349 16.296 223 1HB ARG 25 HB2 ARG 25 234.835 6.936 17.442 224 2HB ARG 25 HB1 ARG 25 235.151 8.599 16.967 225 1HG ARG 25 HG2 ARG 25 233.564 6.738 15.234 226 2HG ARG 25 HG1 ARG 25 232.823 7.669 16.538 227 1HD ARG 25 HD2 ARG 25 234.200 9.620 15.329 228 2HD ARG 25 HD1 ARG 25 233.919 8.565 13.946 229 HE ARG 25 HE ARG 25 231.736 9.225 13.960 230 1HH1 ARG 25 HH11 ARG 25 233.098 9.876 17.107 231 2HH1 ARG 25 HH12 ARG 25 231.682 10.684 17.691 232 1HH2 ARG 25 HH21 ARG 25 229.872 10.286 14.728 233 2HH2 ARG 25 HH22 ARG 25 229.850 10.915 16.341 234 H GLY 26 HN GLY 26 237.762 5.347 16.521 235 1HA GLY 26 HA2 GLY 26 236.622 3.002 16.727 236 2HA GLY 26 HA1 GLY 26 236.474 3.207 14.988 237 H PHE 27 HN PHE 27 238.059 2.399 13.790 238 HA PHE 27 HA PHE 27 240.563 1.663 15.124 239 1HB PHE 27 HB2 PHE 27 240.892 0.309 12.959 240 2HB PHE 27 HB1 PHE 27 239.664 -0.240 14.095 241 HD1 PHE 27 HD1 PHE 27 240.303 1.154 10.798 242 HD2 PHE 27 HD2 PHE 27 237.292 0.030 13.586 243 HE1 PHE 27 HE1 PHE 27 238.622 1.220 9.003 244 HE2 PHE 27 HE2 PHE 27 235.605 0.094 11.796 245 HZ PHE 27 HZ PHE 27 236.269 0.689 9.501 246 H GLY 28 HN GLY 28 241.224 3.961 15.031 247 1HA GLY 28 HA2 GLY 28 243.210 4.887 13.874 248 2HA GLY 28 HA1 GLY 28 242.346 4.605 12.372 249 H ALA 29 HN ALA 29 240.603 5.814 15.124 250 HA ALA 29 HA ALA 29 239.554 8.025 13.808 251 1HB ALA 29 HB1 ALA 29 238.933 6.867 16.067 252 2HB ALA 29 HB2 ALA 29 238.514 8.550 15.748 253 3HB ALA 29 HB3 ALA 29 239.920 8.163 16.740 254 H GLY 30 HN GLY 30 241.128 9.268 12.777 255 1HA GLY 30 HA2 GLY 30 242.138 11.469 13.120 256 2HA GLY 30 HA1 GLY 30 242.836 10.841 14.604 257 H ARG 31 HN ARG 31 242.843 8.703 11.928 258 HA ARG 31 HA ARG 31 245.608 9.434 11.253 259 1HB ARG 31 HB2 ARG 31 244.572 6.837 12.273 260 2HB ARG 31 HB1 ARG 31 245.787 6.778 11.003 261 1HG ARG 31 HG2 ARG 31 247.223 6.818 12.722 262 2HG ARG 31 HG1 ARG 31 246.925 8.556 12.685 263 1HD ARG 31 HD2 ARG 31 246.693 7.837 14.944 264 2HD ARG 31 HD1 ARG 31 245.078 8.190 14.329 265 HE ARG 31 HE ARG 31 245.339 5.537 13.882 266 1HH1 ARG 31 HH11 ARG 31 245.792 7.532 16.709 267 2HH1 ARG 31 HH12 ARG 31 245.351 6.279 17.819 268 1HH2 ARG 31 HH21 ARG 31 244.758 3.887 15.340 269 2HH2 ARG 31 HH22 ARG 31 244.764 4.209 17.042 270 H TRP 32 HN TRP 32 246.067 9.374 9.116 271 HA TRP 32 HA TRP 32 243.875 8.650 7.327 272 1HB TRP 32 HB2 TRP 32 246.104 9.734 5.884 273 2HB TRP 32 HB1 TRP 32 244.487 10.391 6.075 274 HD1 TRP 32 HD1 TRP 32 247.712 10.302 8.261 275 HE1 TRP 32 HE1 TRP 32 247.986 12.626 9.331 276 HE3 TRP 32 HE3 TRP 32 243.543 12.570 6.366 277 HZ2 TRP 32 HZ2 TRP 32 246.630 15.097 9.356 278 HZ3 TRP 32 HZ3 TRP 32 243.106 14.917 6.959 279 HH2 TRP 32 HH2 TRP 32 244.618 16.154 8.422 280 H ASN 33 HN ASN 33 244.221 7.361 5.443 281 HA ASN 33 HA ASN 33 246.608 6.017 4.855 282 1HB ASN 33 HB2 ASN 33 246.131 3.775 5.719 283 2HB ASN 33 HB1 ASN 33 246.256 4.936 7.037 284 1HD2 ASN 33 HD21 ASN 33 244.779 4.726 8.537 285 2HD2 ASN 33 HD22 ASN 33 243.181 4.107 8.322 286 H GLY 34 HN GLY 34 246.284 4.221 3.300 287 1HA GLY 34 HA2 GLY 34 244.411 4.919 1.326 288 2HA GLY 34 HA1 GLY 34 245.342 3.428 1.364 289 H PHE 35 HN PHE 35 242.842 3.331 0.352 290 HA PHE 35 HA PHE 35 241.117 2.315 2.495 291 1HB PHE 35 HB2 PHE 35 240.196 2.467 -0.340 292 2HB PHE 35 HB1 PHE 35 239.290 2.720 1.141 293 HD1 PHE 35 HD1 PHE 35 239.796 4.858 2.473 294 HD2 PHE 35 HD2 PHE 35 240.960 4.274 -1.578 295 HE1 PHE 35 HE1 PHE 35 240.020 7.291 2.190 296 HE2 PHE 35 HE2 PHE 35 241.186 6.707 -1.868 297 HZ PHE 35 HZ PHE 35 240.716 8.218 0.018 298 H GLY 36 HN GLY 36 241.843 0.284 2.940 299 1HA GLY 36 HA2 GLY 36 242.394 -1.532 0.724 300 2HA GLY 36 HA1 GLY 36 242.731 -1.837 2.420 301 H GLY 37 HN GLY 37 241.529 -3.676 0.655 302 1HA GLY 37 HA2 GLY 37 239.128 -4.256 2.168 303 2HA GLY 37 HA1 GLY 37 238.858 -3.943 0.461 304 H LYS 38 HN LYS 38 238.513 -6.409 2.093 305 HA LYS 38 HA LYS 38 240.546 -8.212 1.092 306 1HB LYS 38 HB2 LYS 38 239.370 -9.932 2.329 307 2HB LYS 38 HB1 LYS 38 239.580 -8.512 3.343 308 1HG LYS 38 HG2 LYS 38 237.224 -7.861 2.674 309 2HG LYS 38 HG1 LYS 38 237.075 -9.490 2.012 310 1HD LYS 38 HD2 LYS 38 238.136 -9.340 4.753 311 2HD LYS 38 HD1 LYS 38 236.463 -8.812 4.565 312 1HE LYS 38 HE2 LYS 38 235.732 -10.889 3.946 313 2HE LYS 38 HE1 LYS 38 237.286 -11.346 3.249 314 1HZ LYS 38 HZ1 LYS 38 236.462 -12.359 5.501 315 2HZ LYS 38 HZ2 LYS 38 237.126 -10.944 6.147 316 3HZ LYS 38 HZ3 LYS 38 238.099 -12.005 5.258 317 H VAL 39 HN VAL 39 240.271 -9.810 -0.438 318 HA VAL 39 HA VAL 39 238.323 -9.283 -2.476 319 HB VAL 39 HB VAL 39 240.081 -11.730 -2.372 320 1HG1 VAL 39 HG11 VAL 39 240.035 -11.509 -4.803 321 2HG1 VAL 39 HG12 VAL 39 239.040 -10.060 -4.659 322 3HG1 VAL 39 HG13 VAL 39 238.402 -11.623 -4.149 323 1HG2 VAL 39 HG21 VAL 39 240.855 -8.907 -2.687 324 2HG2 VAL 39 HG22 VAL 39 241.529 -10.033 -3.865 325 3HG2 VAL 39 HG23 VAL 39 241.798 -10.293 -2.142 326 H GLN 40 HN GLN 40 236.275 -9.885 -2.240 327 HA GLN 40 HA GLN 40 235.174 -11.612 -0.438 328 1HB GLN 40 HB2 GLN 40 234.317 -10.624 -3.111 329 2HB GLN 40 HB1 GLN 40 233.398 -11.942 -2.398 330 1HG GLN 40 HG2 GLN 40 233.920 -9.736 -0.558 331 2HG GLN 40 HG1 GLN 40 232.959 -9.288 -1.966 332 1HE2 GLN 40 HE21 GLN 40 233.134 -11.346 0.848 333 2HE2 GLN 40 HE22 GLN 40 231.451 -11.731 0.914 334 H GLU 41 HN GLU 41 233.926 -13.685 -1.028 335 HA GLU 41 HA GLU 41 235.837 -15.685 -1.641 336 1HB GLU 41 HB2 GLU 41 232.831 -15.923 -1.421 337 2HB GLU 41 HB1 GLU 41 233.972 -17.260 -1.389 338 1HG GLU 41 HG2 GLU 41 233.827 -17.050 0.827 339 2HG GLU 41 HG1 GLU 41 234.935 -15.697 0.608 340 H GLY 42 HN GLY 42 236.316 -14.550 -3.806 341 1HA GLY 42 HA2 GLY 42 236.378 -15.719 -5.988 342 2HA GLY 42 HA1 GLY 42 234.627 -15.799 -5.884 343 H GLU 43 HN GLU 43 236.819 -13.060 -5.224 344 HA GLU 43 HA GLU 43 235.613 -11.679 -7.504 345 1HB GLU 43 HB2 GLU 43 235.052 -9.817 -6.315 346 2HB GLU 43 HB1 GLU 43 234.884 -10.994 -5.025 347 1HG GLU 43 HG2 GLU 43 236.935 -10.365 -4.054 348 2HG GLU 43 HG1 GLU 43 237.414 -9.442 -5.478 349 H THR 44 HN THR 44 237.022 -9.641 -7.968 350 HA THR 44 HA THR 44 239.764 -10.644 -8.071 351 HB THR 44 HB THR 44 240.034 -9.041 -9.918 352 HG1 THR 44 HG1 THR 44 237.255 -8.577 -9.691 353 1HG2 THR 44 HG21 THR 44 237.923 -11.122 -9.931 354 2HG2 THR 44 HG22 THR 44 239.445 -11.050 -10.819 355 3HG2 THR 44 HG23 THR 44 238.071 -10.076 -11.343 356 H ILE 45 HN ILE 45 241.505 -9.465 -7.410 357 HA ILE 45 HA ILE 45 241.289 -7.906 -5.167 358 HB ILE 45 HB ILE 45 243.534 -7.563 -7.144 359 1HG1 ILE 45 HG12 ILE 45 244.405 -9.469 -5.398 360 2HG1 ILE 45 HG11 ILE 45 242.717 -9.925 -5.597 361 1HG2 ILE 45 HG21 ILE 45 243.226 -7.190 -4.194 362 2HG2 ILE 45 HG22 ILE 45 243.804 -6.045 -5.405 363 3HG2 ILE 45 HG23 ILE 45 244.810 -7.416 -4.935 364 1HD1 ILE 45 HD11 ILE 45 244.915 -10.402 -7.328 365 2HD1 ILE 45 HD12 ILE 45 243.748 -9.378 -8.165 366 3HD1 ILE 45 HD13 ILE 45 243.239 -10.927 -7.493 367 H GLU 46 HN GLU 46 241.180 -6.908 -8.527 368 HA GLU 46 HA GLU 46 241.352 -4.094 -7.995 369 1HB GLU 46 HB2 GLU 46 241.758 -5.462 -10.224 370 2HB GLU 46 HB1 GLU 46 240.038 -5.179 -10.455 371 1HG GLU 46 HG2 GLU 46 240.309 -2.874 -10.591 372 2HG GLU 46 HG1 GLU 46 241.900 -2.922 -9.833 373 H ASP 47 HN ASP 47 238.861 -6.503 -8.106 374 HA ASP 47 HA ASP 47 236.696 -4.608 -8.177 375 1HB ASP 47 HB2 ASP 47 236.941 -7.574 -8.020 376 2HB ASP 47 HB1 ASP 47 235.459 -6.850 -7.404 377 H GLY 48 HN GLY 48 238.465 -6.489 -5.808 378 1HA GLY 48 HA2 GLY 48 236.750 -5.884 -3.598 379 2HA GLY 48 HA1 GLY 48 238.395 -6.501 -3.498 380 H ALA 49 HN ALA 49 239.612 -4.395 -4.984 381 HA ALA 49 HA ALA 49 239.927 -2.457 -2.888 382 1HB ALA 49 HB1 ALA 49 241.088 -1.963 -5.570 383 2HB ALA 49 HB2 ALA 49 241.634 -3.400 -4.710 384 3HB ALA 49 HB3 ALA 49 241.818 -1.810 -3.973 385 H ARG 50 HN ARG 50 238.268 -2.680 -5.951 386 HA ARG 50 HA ARG 50 237.674 0.118 -6.127 387 1HB ARG 50 HB2 ARG 50 236.929 -2.332 -7.652 388 2HB ARG 50 HB1 ARG 50 235.905 -0.914 -7.820 389 1HG ARG 50 HG2 ARG 50 238.069 0.352 -8.338 390 2HG ARG 50 HG1 ARG 50 238.784 -1.245 -8.567 391 1HD ARG 50 HD2 ARG 50 236.645 -1.592 -10.078 392 2HD ARG 50 HD1 ARG 50 236.717 0.168 -10.174 393 HE ARG 50 HE ARG 50 239.261 -0.667 -10.731 394 1HH1 ARG 50 HH11 ARG 50 236.102 -1.303 -12.071 395 2HH1 ARG 50 HH12 ARG 50 236.699 -1.578 -13.673 396 1HH2 ARG 50 HH21 ARG 50 240.048 -1.026 -12.837 397 2HH2 ARG 50 HH22 ARG 50 238.939 -1.421 -14.109 398 H ARG 51 HN ARG 51 235.726 -2.786 -5.457 399 HA ARG 51 HA ARG 51 233.346 -1.433 -4.837 400 1HB ARG 51 HB2 ARG 51 234.410 -4.167 -4.241 401 2HB ARG 51 HB1 ARG 51 232.915 -3.634 -3.486 402 1HG ARG 51 HG2 ARG 51 233.259 -3.405 -6.443 403 2HG ARG 51 HG1 ARG 51 232.830 -4.953 -5.711 404 1HD ARG 51 HD2 ARG 51 230.765 -4.228 -5.057 405 2HD ARG 51 HD1 ARG 51 231.286 -2.552 -4.893 406 HE ARG 51 HE ARG 51 231.261 -3.490 -7.608 407 1HH1 ARG 51 HH11 ARG 51 229.346 -2.083 -5.052 408 2HH1 ARG 51 HH12 ARG 51 228.195 -1.374 -6.135 409 1HH2 ARG 51 HH21 ARG 51 229.749 -2.558 -9.033 410 2HH2 ARG 51 HH22 ARG 51 228.423 -1.644 -8.395 411 H GLU 52 HN GLU 52 236.120 -2.269 -2.867 412 HA GLU 52 HA GLU 52 234.821 -1.460 -0.410 413 1HB GLU 52 HB2 GLU 52 237.684 -2.247 -0.986 414 2HB GLU 52 HB1 GLU 52 237.045 -1.899 0.614 415 1HG GLU 52 HG2 GLU 52 235.538 -3.909 -0.895 416 2HG GLU 52 HG1 GLU 52 237.193 -4.366 -0.496 417 H LEU 53 HN LEU 53 236.636 -0.012 -2.918 418 HA LEU 53 HA LEU 53 237.777 2.128 -1.431 419 1HB LEU 53 HB2 LEU 53 238.816 1.649 -3.476 420 2HB LEU 53 HB1 LEU 53 237.293 1.593 -4.344 421 HG LEU 53 HG LEU 53 237.078 4.043 -4.042 422 1HD1 LEU 53 HD11 LEU 53 238.504 5.266 -2.822 423 2HD1 LEU 53 HD12 LEU 53 239.910 4.347 -3.357 424 3HD1 LEU 53 HD13 LEU 53 238.894 3.726 -2.056 425 1HD2 LEU 53 HD21 LEU 53 239.250 4.520 -5.477 426 2HD2 LEU 53 HD22 LEU 53 237.881 3.624 -6.135 427 3HD2 LEU 53 HD23 LEU 53 239.298 2.758 -5.540 428 H GLN 54 HN GLN 54 234.909 1.792 -3.478 429 HA GLN 54 HA GLN 54 234.000 4.441 -3.283 430 1HB GLN 54 HB2 GLN 54 232.927 3.264 -4.944 431 2HB GLN 54 HB1 GLN 54 232.755 1.819 -3.962 432 1HG GLN 54 HG2 GLN 54 230.958 2.843 -2.708 433 2HG GLN 54 HG1 GLN 54 231.165 4.350 -3.599 434 1HE2 GLN 54 HE21 GLN 54 231.070 0.960 -4.632 435 2HE2 GLN 54 HE22 GLN 54 229.767 1.157 -5.750 436 H GLU 55 HN GLU 55 233.878 1.805 -1.058 437 HA GLU 55 HA GLU 55 231.746 2.897 0.539 438 1HB GLU 55 HB2 GLU 55 233.507 0.494 0.700 439 2HB GLU 55 HB1 GLU 55 232.641 1.014 2.139 440 1HG GLU 55 HG2 GLU 55 231.001 0.860 -0.282 441 2HG GLU 55 HG1 GLU 55 231.664 -0.680 0.263 442 H GLU 56 HN GLU 56 235.204 3.188 0.495 443 HA GLU 56 HA GLU 56 235.442 3.883 3.252 444 1HB GLU 56 HB2 GLU 56 237.219 3.402 1.065 445 2HB GLU 56 HB1 GLU 56 237.665 4.911 1.849 446 1HG GLU 56 HG2 GLU 56 237.444 2.190 3.104 447 2HG GLU 56 HG1 GLU 56 238.897 3.161 2.881 448 H SER 57 HN SER 57 235.343 5.823 0.261 449 HA SER 57 HA SER 57 234.737 8.146 1.958 450 1HB SER 57 HB2 SER 57 237.038 8.463 1.443 451 2HB SER 57 HB1 SER 57 236.797 8.004 -0.242 452 HG SER 57 HG SER 57 236.870 10.196 -0.233 453 H GLY 58 HN GLY 58 233.112 6.340 0.204 454 1HA GLY 58 HA2 GLY 58 231.403 6.526 -1.318 455 2HA GLY 58 HA1 GLY 58 231.359 8.220 -0.857 456 H LEU 59 HN LEU 59 234.363 7.212 -2.107 457 HA LEU 59 HA LEU 59 233.773 8.579 -4.634 458 1HB LEU 59 HB2 LEU 59 236.359 8.056 -3.176 459 2HB LEU 59 HB1 LEU 59 236.289 8.697 -4.805 460 HG LEU 59 HG LEU 59 235.470 10.016 -2.235 461 1HD1 LEU 59 HD11 LEU 59 237.163 11.437 -2.656 462 2HD1 LEU 59 HD12 LEU 59 236.882 11.429 -4.396 463 3HD1 LEU 59 HD13 LEU 59 237.766 10.103 -3.640 464 1HD2 LEU 59 HD21 LEU 59 233.568 10.448 -3.562 465 2HD2 LEU 59 HD22 LEU 59 234.536 10.677 -5.017 466 3HD2 LEU 59 HD23 LEU 59 234.591 11.875 -3.724 467 H THR 60 HN THR 60 233.316 7.281 -6.234 468 HA THR 60 HA THR 60 234.437 4.583 -6.306 469 HB THR 60 HB THR 60 232.558 5.358 -8.427 470 HG1 THR 60 HG1 THR 60 231.161 6.278 -7.187 471 1HG2 THR 60 HG21 THR 60 233.235 3.041 -6.891 472 2HG2 THR 60 HG22 THR 60 232.275 3.164 -8.366 473 3HG2 THR 60 HG23 THR 60 231.500 3.341 -6.792 474 H VAL 61 HN VAL 61 235.838 3.904 -7.868 475 HA VAL 61 HA VAL 61 236.778 5.985 -9.716 476 HB VAL 61 HB VAL 61 238.867 4.777 -9.868 477 1HG1 VAL 61 HG11 VAL 61 237.837 5.349 -7.111 478 2HG1 VAL 61 HG12 VAL 61 238.886 6.336 -8.128 479 3HG1 VAL 61 HG13 VAL 61 239.506 4.857 -7.394 480 1HG2 VAL 61 HG21 VAL 61 237.292 2.635 -8.670 481 2HG2 VAL 61 HG22 VAL 61 238.864 2.858 -7.901 482 3HG2 VAL 61 HG23 VAL 61 238.766 2.556 -9.636 483 H ASP 62 HN ASP 62 236.902 5.670 -11.870 484 HA ASP 62 HA ASP 62 235.334 3.524 -12.982 485 1HB ASP 62 HB2 ASP 62 235.641 6.063 -13.763 486 2HB ASP 62 HB1 ASP 62 236.921 5.339 -14.732 487 H ALA 63 HN ALA 63 238.645 4.147 -12.319 488 HA ALA 63 HA ALA 63 239.495 1.572 -12.963 489 1HB ALA 63 HB1 ALA 63 240.799 3.292 -14.963 490 2HB ALA 63 HB2 ALA 63 239.107 2.910 -15.279 491 3HB ALA 63 HB3 ALA 63 240.281 1.611 -15.075 492 H LEU 64 HN LEU 64 240.735 1.588 -11.148 493 HA LEU 64 HA LEU 64 242.397 3.748 -10.336 494 1HB LEU 64 HB2 LEU 64 242.620 0.821 -9.611 495 2HB LEU 64 HB1 LEU 64 243.362 2.158 -8.754 496 HG LEU 64 HG LEU 64 240.598 2.704 -8.860 497 1HD1 LEU 64 HD11 LEU 64 241.260 -0.154 -8.273 498 2HD1 LEU 64 HD12 LEU 64 239.963 0.505 -9.271 499 3HD1 LEU 64 HD13 LEU 64 239.881 0.641 -7.514 500 1HD2 LEU 64 HD21 LEU 64 241.716 1.591 -6.381 501 2HD2 LEU 64 HD22 LEU 64 240.915 3.135 -6.678 502 3HD2 LEU 64 HD23 LEU 64 242.620 2.932 -7.085 503 H HIS 65 HN HIS 65 244.845 2.806 -9.790 504 HA HIS 65 HA HIS 65 245.977 1.792 -12.299 505 1HB HIS 65 HB2 HIS 65 246.101 4.435 -11.745 506 2HB HIS 65 HB1 HIS 65 247.548 3.885 -10.906 507 HD1 HIS 65 HD1 HIS 65 249.586 3.613 -12.303 508 HD2 HIS 65 HD2 HIS 65 246.117 3.671 -14.590 509 HE1 HIS 65 HE1 HIS 65 250.357 3.606 -14.696 510 HE2 HIS 65 HE2 HIS 65 248.244 3.728 -16.060 511 H LYS 66 HN LYS 66 246.645 -0.164 -11.555 512 HA LYS 66 HA LYS 66 247.644 -0.685 -8.976 513 1HB LYS 66 HB2 LYS 66 248.559 -2.782 -10.011 514 2HB LYS 66 HB1 LYS 66 246.846 -2.517 -10.295 515 1HG LYS 66 HG2 LYS 66 247.959 -1.323 -12.476 516 2HG LYS 66 HG1 LYS 66 249.070 -2.662 -12.185 517 1HD LYS 66 HD2 LYS 66 246.126 -3.160 -12.145 518 2HD LYS 66 HD1 LYS 66 246.957 -2.996 -13.694 519 1HE LYS 66 HE2 LYS 66 248.303 -4.867 -13.299 520 2HE LYS 66 HE1 LYS 66 247.978 -4.848 -11.566 521 1HZ LYS 66 HZ1 LYS 66 245.527 -5.218 -12.491 522 2HZ LYS 66 HZ2 LYS 66 246.576 -6.500 -12.147 523 3HZ LYS 66 HZ3 LYS 66 246.395 -5.961 -13.741 524 H VAL 67 HN VAL 67 249.621 -0.437 -8.075 525 HA VAL 67 HA VAL 67 251.796 0.362 -9.911 526 HB VAL 67 HB VAL 67 252.737 1.748 -8.104 527 1HG1 VAL 67 HG11 VAL 67 251.636 3.132 -9.525 528 2HG1 VAL 67 HG12 VAL 67 250.630 3.383 -8.098 529 3HG1 VAL 67 HG13 VAL 67 250.108 2.268 -9.361 530 1HG2 VAL 67 HG21 VAL 67 252.010 1.031 -6.066 531 2HG2 VAL 67 HG22 VAL 67 250.376 0.697 -6.641 532 3HG2 VAL 67 HG23 VAL 67 250.877 2.357 -6.328 533 H GLY 68 HN GLY 68 251.172 -1.093 -6.705 534 1HA GLY 68 HA2 GLY 68 253.382 -2.932 -7.249 535 2HA GLY 68 HA1 GLY 68 253.502 -1.936 -5.808 536 H GLN 69 HN GLN 69 253.640 -4.526 -5.389 537 HA GLN 69 HA GLN 69 251.028 -5.181 -4.215 538 1HB GLN 69 HB2 GLN 69 252.701 -6.804 -6.043 539 2HB GLN 69 HB1 GLN 69 252.008 -7.655 -4.669 540 1HG GLN 69 HG2 GLN 69 249.921 -7.552 -5.487 541 2HG GLN 69 HG1 GLN 69 250.145 -5.933 -6.147 542 1HE2 GLN 69 HE21 GLN 69 250.548 -5.702 -8.260 543 2HE2 GLN 69 HE22 GLN 69 250.790 -7.005 -9.368 544 H ILE 70 HN ILE 70 251.255 -5.156 -2.087 545 HA ILE 70 HA ILE 70 253.847 -5.871 -0.908 546 HB ILE 70 HB ILE 70 251.487 -4.535 0.418 547 1HG1 ILE 70 HG12 ILE 70 254.055 -3.240 -0.500 548 2HG1 ILE 70 HG11 ILE 70 252.577 -3.230 -1.458 549 1HG2 ILE 70 HG21 ILE 70 252.656 -5.345 2.198 550 2HG2 ILE 70 HG22 ILE 70 253.542 -3.842 1.941 551 3HG2 ILE 70 HG23 ILE 70 254.187 -5.362 1.324 552 1HD1 ILE 70 HD11 ILE 70 253.250 -1.752 1.014 553 2HD1 ILE 70 HD12 ILE 70 251.575 -2.256 0.790 554 3HD1 ILE 70 HD13 ILE 70 252.357 -1.232 -0.415 555 H VAL 71 HN VAL 71 253.979 -7.325 0.817 556 HA VAL 71 HA VAL 71 251.658 -9.099 1.180 557 HB VAL 71 HB VAL 71 254.530 -10.022 1.058 558 1HG1 VAL 71 HG11 VAL 71 253.612 -12.237 0.997 559 2HG1 VAL 71 HG12 VAL 71 251.969 -11.599 0.935 560 3HG1 VAL 71 HG13 VAL 71 252.943 -11.384 2.389 561 1HG2 VAL 71 HG21 VAL 71 252.413 -10.252 -1.079 562 2HG2 VAL 71 HG22 VAL 71 254.051 -10.903 -1.150 563 3HG2 VAL 71 HG23 VAL 71 253.795 -9.158 -1.126 564 H PHE 72 HN PHE 72 251.458 -10.078 3.222 565 HA PHE 72 HA PHE 72 253.249 -9.040 5.307 566 1HB PHE 72 HB2 PHE 72 250.241 -9.251 5.493 567 2HB PHE 72 HB1 PHE 72 251.314 -8.748 6.793 568 HD1 PHE 72 HD1 PHE 72 250.447 -7.854 3.280 569 HD2 PHE 72 HD2 PHE 72 251.665 -6.502 7.127 570 HE1 PHE 72 HE1 PHE 72 250.274 -5.524 2.512 571 HE2 PHE 72 HE2 PHE 72 251.494 -4.167 6.365 572 HZ PHE 72 HZ PHE 72 250.797 -3.677 4.055 573 H GLU 73 HN GLU 73 254.213 -10.648 6.330 574 HA GLU 73 HA GLU 73 252.903 -13.274 6.413 575 1HB GLU 73 HB2 GLU 73 255.132 -13.290 5.446 576 2HB GLU 73 HB1 GLU 73 255.787 -12.481 6.862 577 1HG GLU 73 HG2 GLU 73 255.954 -14.381 8.020 578 2HG GLU 73 HG1 GLU 73 254.387 -14.970 7.467 579 H PHE 74 HN PHE 74 252.271 -14.183 8.301 580 HA PHE 74 HA PHE 74 252.613 -12.552 10.712 581 1HB PHE 74 HB2 PHE 74 250.377 -13.727 9.688 582 2HB PHE 74 HB1 PHE 74 250.895 -14.946 10.847 583 HD1 PHE 74 HD1 PHE 74 250.894 -14.488 13.221 584 HD2 PHE 74 HD2 PHE 74 249.631 -11.550 10.414 585 HE1 PHE 74 HE1 PHE 74 249.871 -13.191 15.045 586 HE2 PHE 74 HE2 PHE 74 248.605 -10.248 12.232 587 HZ PHE 74 HZ PHE 74 248.724 -11.069 14.551 588 H VAL 75 HN VAL 75 253.824 -13.096 12.331 589 HA VAL 75 HA VAL 75 255.514 -15.392 12.133 590 HB VAL 75 HB VAL 75 255.465 -14.055 14.737 591 1HG1 VAL 75 HG11 VAL 75 257.931 -13.715 13.784 592 2HG1 VAL 75 HG12 VAL 75 257.393 -15.016 12.720 593 3HG1 VAL 75 HG13 VAL 75 257.372 -15.241 14.469 594 1HG2 VAL 75 HG21 VAL 75 255.695 -12.458 12.234 595 2HG2 VAL 75 HG22 VAL 75 256.727 -12.058 13.605 596 3HG2 VAL 75 HG23 VAL 75 254.974 -12.028 13.786 597 H GLY 76 HN GLY 76 255.136 -17.365 12.870 598 1HA GLY 76 HA2 GLY 76 254.503 -18.939 14.513 599 2HA GLY 76 HA1 GLY 76 253.461 -17.724 15.240 600 H GLU 77 HN GLU 77 252.489 -17.149 12.364 601 HA GLU 77 HA GLU 77 250.602 -19.414 12.269 602 1HB GLU 77 HB2 GLU 77 250.033 -16.650 11.216 603 2HB GLU 77 HB1 GLU 77 248.890 -17.942 11.550 604 1HG GLU 77 HG2 GLU 77 249.341 -17.713 13.946 605 2HG GLU 77 HG1 GLU 77 250.465 -16.399 13.599 606 HA PRO 78 HA PRO 78 252.146 -20.241 8.201 607 1HB PRO 78 HB2 PRO 78 250.079 -21.697 7.224 608 2HB PRO 78 HB1 PRO 78 251.211 -22.331 8.425 609 1HG PRO 78 HG2 PRO 78 248.468 -21.196 8.821 610 2HG PRO 78 HG1 PRO 78 249.201 -22.634 9.556 611 1HD PRO 78 HD2 PRO 78 249.019 -20.262 10.852 612 2HD PRO 78 HD1 PRO 78 250.354 -21.400 11.122 613 H GLU 79 HN GLU 79 248.830 -19.043 8.543 614 HA GLU 79 HA GLU 79 248.395 -18.287 5.892 615 1HB GLU 79 HB2 GLU 79 246.997 -18.123 8.300 616 2HB GLU 79 HB1 GLU 79 247.168 -16.452 7.777 617 1HG GLU 79 HG2 GLU 79 246.116 -16.938 5.681 618 2HG GLU 79 HG1 GLU 79 246.085 -18.662 6.050 619 H LEU 80 HN LEU 80 248.166 -16.008 5.124 620 HA LEU 80 HA LEU 80 250.101 -14.139 6.257 621 1HB LEU 80 HB2 LEU 80 250.240 -14.438 3.315 622 2HB LEU 80 HB1 LEU 80 251.499 -14.023 4.460 623 HG LEU 80 HG LEU 80 250.458 -16.822 4.397 624 1HD1 LEU 80 HD11 LEU 80 252.540 -15.741 2.508 625 2HD1 LEU 80 HD12 LEU 80 250.907 -16.227 2.055 626 3HD1 LEU 80 HD13 LEU 80 252.044 -17.425 2.675 627 1HD2 LEU 80 HD21 LEU 80 252.759 -15.354 5.465 628 2HD2 LEU 80 HD22 LEU 80 253.161 -16.893 4.702 629 3HD2 LEU 80 HD23 LEU 80 252.000 -16.843 6.028 630 H MET 81 HN MET 81 250.069 -12.311 4.119 631 HA MET 81 HA MET 81 247.274 -11.762 3.561 632 1HB MET 81 HB2 MET 81 248.693 -10.484 5.687 633 2HB MET 81 HB1 MET 81 248.365 -9.292 4.438 634 1HG MET 81 HG2 MET 81 245.957 -10.207 4.512 635 2HG MET 81 HG1 MET 81 246.439 -10.903 6.058 636 1HE MET 81 HE1 MET 81 246.524 -6.398 5.117 637 2HE MET 81 HE2 MET 81 246.507 -7.705 3.933 638 3HE MET 81 HE3 MET 81 247.966 -7.384 4.870 639 H ASP 82 HN ASP 82 247.288 -11.469 1.419 640 HA ASP 82 HA ASP 82 249.596 -10.149 0.181 641 1HB ASP 82 HB2 ASP 82 248.944 -12.300 -0.782 642 2HB ASP 82 HB1 ASP 82 247.311 -11.703 -1.059 643 H VAL 83 HN VAL 83 249.338 -7.991 0.291 644 HA VAL 83 HA VAL 83 246.721 -6.839 -0.407 645 HB VAL 83 HB VAL 83 249.058 -5.427 0.876 646 1HG1 VAL 83 HG11 VAL 83 246.256 -4.541 1.214 647 2HG1 VAL 83 HG12 VAL 83 246.993 -4.290 -0.367 648 3HG1 VAL 83 HG13 VAL 83 247.737 -3.596 1.074 649 1HG2 VAL 83 HG21 VAL 83 247.717 -5.641 2.982 650 2HG2 VAL 83 HG22 VAL 83 248.423 -7.145 2.392 651 3HG2 VAL 83 HG23 VAL 83 246.708 -6.818 2.141 652 H HIS 84 HN HIS 84 246.468 -5.971 -2.336 653 HA HIS 84 HA HIS 84 248.811 -5.343 -3.965 654 1HB HIS 84 HB2 HIS 84 245.894 -5.762 -4.551 655 2HB HIS 84 HB1 HIS 84 246.913 -4.919 -5.712 656 HD1 HIS 84 HD1 HIS 84 247.384 -8.131 -3.708 657 HD2 HIS 84 HD2 HIS 84 247.666 -6.690 -7.596 658 HE1 HIS 84 HE1 HIS 84 248.161 -10.081 -5.094 659 HE2 HIS 84 HE2 HIS 84 248.403 -9.164 -7.428 660 H VAL 85 HN VAL 85 249.116 -3.267 -4.913 661 HA VAL 85 HA VAL 85 247.721 -1.137 -3.436 662 HB VAL 85 HB VAL 85 250.389 -1.006 -4.866 663 1HG1 VAL 85 HG11 VAL 85 249.130 1.004 -3.007 664 2HG1 VAL 85 HG12 VAL 85 249.103 1.128 -4.766 665 3HG1 VAL 85 HG13 VAL 85 250.639 1.173 -3.903 666 1HG2 VAL 85 HG21 VAL 85 249.615 -1.550 -2.038 667 2HG2 VAL 85 HG22 VAL 85 251.101 -0.658 -2.367 668 3HG2 VAL 85 HG23 VAL 85 250.885 -2.282 -3.019 669 H PHE 86 HN PHE 86 246.624 0.396 -4.496 670 HA PHE 86 HA PHE 86 246.794 0.546 -7.420 671 1HB PHE 86 HB2 PHE 86 244.567 -0.461 -5.825 672 2HB PHE 86 HB1 PHE 86 244.081 0.899 -6.828 673 HD1 PHE 86 HD1 PHE 86 244.972 0.731 -9.336 674 HD2 PHE 86 HD2 PHE 86 244.373 -2.559 -6.709 675 HE1 PHE 86 HE1 PHE 86 244.750 -0.769 -11.274 676 HE2 PHE 86 HE2 PHE 86 244.152 -4.067 -8.639 677 HZ PHE 86 HZ PHE 86 244.340 -3.172 -10.926 678 H CYS 87 HN CYS 87 246.761 2.620 -8.150 679 HA CYS 87 HA CYS 87 245.841 4.700 -6.264 680 1HB CYS 87 HB2 CYS 87 248.234 4.583 -8.054 681 2HB CYS 87 HB1 CYS 87 247.462 6.143 -7.793 682 HG CYS 87 HG CYS 87 248.304 6.205 -5.460 683 H THR 88 HN THR 88 243.998 5.591 -6.980 684 HA THR 88 HA THR 88 243.368 5.398 -9.823 685 HB THR 88 HB THR 88 241.765 4.616 -8.044 686 HG1 THR 88 HG1 THR 88 241.200 5.328 -10.258 687 1HG2 THR 88 HG21 THR 88 240.582 7.210 -7.671 688 2HG2 THR 88 HG22 THR 88 242.177 7.090 -6.928 689 3HG2 THR 88 HG23 THR 88 240.917 5.932 -6.502 690 H ASP 89 HN ASP 89 241.674 7.369 -10.307 691 HA ASP 89 HA ASP 89 242.601 9.941 -9.450 692 1HB ASP 89 HB2 ASP 89 243.233 10.669 -11.789 693 2HB ASP 89 HB1 ASP 89 244.376 9.576 -11.015 694 H SER 90 HN SER 90 240.856 8.083 -11.885 695 HA SER 90 HA SER 90 238.904 10.185 -12.272 696 1HB SER 90 HB2 SER 90 239.840 8.142 -13.875 697 2HB SER 90 HB1 SER 90 238.263 7.536 -13.368 698 HG SER 90 HG SER 90 237.335 8.987 -14.573 699 H ILE 91 HN ILE 91 237.694 10.452 -10.447 700 HA ILE 91 HA ILE 91 236.480 8.063 -9.251 701 HB ILE 91 HB ILE 91 235.903 9.452 -7.327 702 1HG1 ILE 91 HG12 ILE 91 237.392 11.691 -8.717 703 2HG1 ILE 91 HG11 ILE 91 235.638 11.585 -8.621 704 1HG2 ILE 91 HG21 ILE 91 238.761 9.471 -8.245 705 2HG2 ILE 91 HG22 ILE 91 237.973 8.379 -7.107 706 3HG2 ILE 91 HG23 ILE 91 238.288 10.052 -6.649 707 1HD1 ILE 91 HD11 ILE 91 237.501 11.770 -6.264 708 2HD1 ILE 91 HD12 ILE 91 235.739 11.736 -6.204 709 3HD1 ILE 91 HD13 ILE 91 236.569 13.103 -6.947 710 H GLN 92 HN GLN 92 234.209 8.718 -8.215 711 HA GLN 92 HA GLN 92 232.617 10.079 -10.272 712 1HB GLN 92 HB2 GLN 92 232.214 7.337 -9.120 713 2HB GLN 92 HB1 GLN 92 230.868 8.247 -9.793 714 1HG GLN 92 HG2 GLN 92 233.350 7.855 -11.401 715 2HG GLN 92 HG1 GLN 92 232.166 6.555 -11.270 716 1HE2 GLN 92 HE21 GLN 92 232.634 7.484 -13.711 717 2HE2 GLN 92 HE22 GLN 92 231.328 8.461 -14.279 718 H GLY 93 HN GLY 93 232.018 8.385 -7.201 719 1HA GLY 93 HA2 GLY 93 229.949 10.048 -6.345 720 2HA GLY 93 HA1 GLY 93 230.935 9.046 -5.292 721 H THR 94 HN THR 94 230.564 10.853 -3.783 722 HA THR 94 HA THR 94 232.523 12.994 -4.208 723 HB THR 94 HB THR 94 230.293 13.540 -2.375 724 HG1 THR 94 HG1 THR 94 229.129 12.532 -3.992 725 1HG2 THR 94 HG21 THR 94 232.063 15.035 -4.111 726 2HG2 THR 94 HG22 THR 94 231.153 15.560 -2.695 727 3HG2 THR 94 HG23 THR 94 230.378 15.527 -4.279 728 HA PRO 95 HA PRO 95 234.424 11.924 -0.418 729 1HB PRO 95 HB2 PRO 95 234.560 14.748 0.397 730 2HB PRO 95 HB1 PRO 95 235.874 13.638 -0.002 731 1HG PRO 95 HG2 PRO 95 235.202 15.671 -1.613 732 2HG PRO 95 HG1 PRO 95 235.775 14.116 -2.248 733 1HD PRO 95 HD2 PRO 95 232.974 15.163 -2.043 734 2HD PRO 95 HD1 PRO 95 233.757 14.303 -3.387 735 H VAL 96 HN VAL 96 232.030 11.326 -0.119 736 HA VAL 96 HA VAL 96 230.493 12.929 1.691 737 HB VAL 96 HB VAL 96 230.003 9.993 1.340 738 1HG1 VAL 96 HG11 VAL 96 228.158 12.370 1.526 739 2HG1 VAL 96 HG12 VAL 96 228.581 11.285 2.851 740 3HG1 VAL 96 HG13 VAL 96 227.672 10.677 1.468 741 1HG2 VAL 96 HG21 VAL 96 230.161 10.298 -0.894 742 2HG2 VAL 96 HG22 VAL 96 229.951 12.045 -0.781 743 3HG2 VAL 96 HG23 VAL 96 228.548 10.981 -0.691 744 H GLU 97 HN GLU 97 232.613 12.990 3.044 745 HA GLU 97 HA GLU 97 233.520 10.975 4.663 746 1HB GLU 97 HB2 GLU 97 234.233 12.667 6.218 747 2HB GLU 97 HB1 GLU 97 234.389 13.315 4.592 748 1HG GLU 97 HG2 GLU 97 231.980 14.248 5.100 749 2HG GLU 97 HG1 GLU 97 232.524 14.077 6.768 750 H SER 98 HN SER 98 232.370 9.543 5.787 751 HA SER 98 HA SER 98 229.816 10.281 6.951 752 1HB SER 98 HB2 SER 98 230.056 7.743 7.714 753 2HB SER 98 HB1 SER 98 229.592 8.169 6.067 754 HG SER 98 HG SER 98 231.664 6.742 6.828 755 H ASP 99 HN ASP 99 229.515 8.967 9.202 756 HA ASP 99 HA ASP 99 231.038 10.471 11.082 757 1HB ASP 99 HB2 ASP 99 229.097 8.195 11.533 758 2HB ASP 99 HB1 ASP 99 229.719 9.270 12.782 759 H GLU 100 HN GLU 100 231.712 7.605 9.464 760 HA GLU 100 HA GLU 100 233.457 6.659 11.635 761 1HB GLU 100 HB2 GLU 100 231.735 5.290 9.786 762 2HB GLU 100 HB1 GLU 100 233.392 4.749 9.554 763 1HG GLU 100 HG2 GLU 100 233.570 4.008 11.780 764 2HG GLU 100 HG1 GLU 100 232.102 4.856 12.260 765 H MET 101 HN MET 101 233.372 7.801 8.344 766 HA MET 101 HA MET 101 236.311 7.625 8.265 767 1HB MET 101 HB2 MET 101 234.506 6.440 6.499 768 2HB MET 101 HB1 MET 101 235.090 7.860 5.642 769 1HG MET 101 HG2 MET 101 236.407 5.844 5.169 770 2HG MET 101 HG1 MET 101 237.368 7.133 5.888 771 1HE MET 101 HE1 MET 101 238.715 6.613 8.531 772 2HE MET 101 HE2 MET 101 239.138 6.431 6.828 773 3HE MET 101 HE3 MET 101 239.424 5.104 7.954 774 H ARG 102 HN ARG 102 237.385 9.293 7.010 775 HA ARG 102 HA ARG 102 235.958 11.679 6.293 776 1HB ARG 102 HB2 ARG 102 236.089 11.870 8.774 777 2HB ARG 102 HB1 ARG 102 237.842 11.787 8.662 778 1HG ARG 102 HG2 ARG 102 237.364 13.823 6.969 779 2HG ARG 102 HG1 ARG 102 236.006 14.015 8.081 780 1HD ARG 102 HD2 ARG 102 238.629 13.522 9.331 781 2HD ARG 102 HD1 ARG 102 238.462 15.063 8.492 782 HE ARG 102 HE ARG 102 236.274 14.487 10.257 783 1HH1 ARG 102 HH11 ARG 102 239.497 15.809 10.056 784 2HH1 ARG 102 HH12 ARG 102 239.312 16.805 11.461 785 1HH2 ARG 102 HH21 ARG 102 236.028 15.794 12.106 786 2HH2 ARG 102 HH22 ARG 102 237.343 16.795 12.625 787 HA PRO 103 HA PRO 103 239.837 11.127 3.935 788 1HB PRO 103 HB2 PRO 103 238.930 12.128 1.615 789 2HB PRO 103 HB1 PRO 103 238.527 10.488 2.139 790 1HG PRO 103 HG2 PRO 103 236.902 12.999 2.366 791 2HG PRO 103 HG1 PRO 103 236.396 11.393 1.810 792 1HD PRO 103 HD2 PRO 103 235.921 12.271 4.330 793 2HD PRO 103 HD1 PRO 103 236.224 10.561 3.961 794 H CYS 104 HN CYS 104 241.309 12.622 2.968 795 HA CYS 104 HA CYS 104 240.697 15.457 3.228 796 1HB CYS 104 HB2 CYS 104 241.859 14.348 5.356 797 2HB CYS 104 HB1 CYS 104 243.304 14.596 4.381 798 HG CYS 104 HG CYS 104 242.180 17.208 4.332 799 H TRP 105 HN TRP 105 241.293 16.396 1.412 800 HA TRP 105 HA TRP 105 243.200 15.106 -0.351 801 1HB TRP 105 HB2 TRP 105 241.564 17.628 -0.718 802 2HB TRP 105 HB1 TRP 105 242.532 16.849 -1.966 803 HD1 TRP 105 HD1 TRP 105 239.927 15.292 0.474 804 HE1 TRP 105 HE1 TRP 105 238.201 13.999 -0.937 805 HE3 TRP 105 HE3 TRP 105 241.701 16.403 -4.192 806 HZ2 TRP 105 HZ2 TRP 105 237.666 13.522 -3.667 807 HZ3 TRP 105 HZ3 TRP 105 240.524 15.489 -6.149 808 HH2 TRP 105 HH2 TRP 105 238.549 14.078 -5.890 809 H PHE 106 HN PHE 106 245.304 15.519 -0.213 810 HA PHE 106 HA PHE 106 246.158 18.225 0.582 811 1HB PHE 106 HB2 PHE 106 247.158 15.552 1.540 812 2HB PHE 106 HB1 PHE 106 248.179 16.982 1.618 813 HD1 PHE 106 HD1 PHE 106 246.303 19.072 2.387 814 HD2 PHE 106 HD2 PHE 106 246.594 15.040 3.715 815 HE1 PHE 106 HE1 PHE 106 245.258 19.705 4.523 816 HE2 PHE 106 HE2 PHE 106 245.549 15.665 5.854 817 HZ PHE 106 HZ PHE 106 244.880 18.000 6.259 818 H GLN 107 HN GLN 107 248.885 17.905 0.264 819 HA GLN 107 HA GLN 107 249.071 17.802 -2.632 820 1HB GLN 107 HB2 GLN 107 250.934 18.743 -0.459 821 2HB GLN 107 HB1 GLN 107 251.451 18.612 -2.135 822 1HG GLN 107 HG2 GLN 107 249.798 20.215 -2.823 823 2HG GLN 107 HG1 GLN 107 249.123 20.270 -1.195 824 1HE2 GLN 107 HE21 GLN 107 252.177 20.759 -2.925 825 2HE2 GLN 107 HE22 GLN 107 252.704 22.099 -1.970 826 H LEU 108 HN LEU 108 250.765 16.642 -3.721 827 HA LEU 108 HA LEU 108 251.044 13.963 -2.748 828 1HB LEU 108 HB2 LEU 108 251.919 13.432 -4.851 829 2HB LEU 108 HB1 LEU 108 250.761 14.707 -5.174 830 HG LEU 108 HG LEU 108 253.756 15.063 -5.012 831 1HD1 LEU 108 HD11 LEU 108 251.870 14.549 -7.240 832 2HD1 LEU 108 HD12 LEU 108 253.551 14.055 -7.038 833 3HD1 LEU 108 HD13 LEU 108 253.170 15.709 -7.515 834 1HD2 LEU 108 HD21 LEU 108 253.270 17.313 -5.913 835 2HD2 LEU 108 HD22 LEU 108 252.619 17.065 -4.293 836 3HD2 LEU 108 HD23 LEU 108 251.549 17.000 -5.693 837 H ASP 109 HN ASP 109 252.715 16.686 -1.974 838 HA ASP 109 HA ASP 109 255.183 15.170 -1.461 839 1HB ASP 109 HB2 ASP 109 256.287 17.458 -1.379 840 2HB ASP 109 HB1 ASP 109 255.754 16.921 -2.969 841 H GLN 110 HN GLN 110 252.597 15.606 0.084 842 HA GLN 110 HA GLN 110 253.900 16.250 2.605 843 1HB GLN 110 HB2 GLN 110 251.410 17.610 1.584 844 2HB GLN 110 HB1 GLN 110 251.887 17.622 3.275 845 1HG GLN 110 HG2 GLN 110 254.069 18.637 2.529 846 2HG GLN 110 HG1 GLN 110 253.331 18.838 0.941 847 1HE2 GLN 110 HE21 GLN 110 252.451 20.738 0.590 848 2HE2 GLN 110 HE22 GLN 110 251.821 21.811 1.787 849 H ILE 111 HN ILE 111 252.711 13.849 1.177 850 HA ILE 111 HA ILE 111 250.384 13.139 2.701 851 HB ILE 111 HB ILE 111 251.836 10.808 1.782 852 1HG1 ILE 111 HG12 ILE 111 251.250 11.468 -0.709 853 2HG1 ILE 111 HG11 ILE 111 251.566 13.095 -0.114 854 1HG2 ILE 111 HG21 ILE 111 249.405 11.386 0.373 855 2HG2 ILE 111 HG22 ILE 111 249.220 11.643 2.108 856 3HG2 ILE 111 HG23 ILE 111 249.784 10.086 1.500 857 1HD1 ILE 111 HD11 ILE 111 253.600 12.318 -0.996 858 2HD1 ILE 111 HD12 ILE 111 253.433 10.751 -0.203 859 3HD1 ILE 111 HD13 ILE 111 253.764 12.194 0.755 860 HA PRO 112 HA PRO 112 252.799 11.855 6.212 861 1HB PRO 112 HB2 PRO 112 250.827 11.708 7.988 862 2HB PRO 112 HB1 PRO 112 251.295 13.269 7.300 863 1HG PRO 112 HG2 PRO 112 248.969 11.519 6.619 864 2HG PRO 112 HG1 PRO 112 249.045 13.286 6.732 865 1HD PRO 112 HD2 PRO 112 249.209 11.784 4.379 866 2HD PRO 112 HD1 PRO 112 249.680 13.485 4.561 867 H PHE 113 HN PHE 113 253.529 9.845 5.623 868 HA PHE 113 HA PHE 113 251.816 7.555 5.571 869 1HB PHE 113 HB2 PHE 113 254.749 7.229 5.900 870 2HB PHE 113 HB1 PHE 113 253.633 6.344 4.881 871 HD1 PHE 113 HD1 PHE 113 252.533 9.170 3.711 872 HD2 PHE 113 HD2 PHE 113 256.316 7.244 4.097 873 HE1 PHE 113 HE1 PHE 113 253.386 10.402 1.761 874 HE2 PHE 113 HE2 PHE 113 257.155 8.464 2.151 875 HZ PHE 113 HZ PHE 113 255.689 10.060 0.976 876 H LYS 114 HN LYS 114 253.456 9.245 8.054 877 HA LYS 114 HA LYS 114 253.847 7.049 9.830 878 1HB LYS 114 HB2 LYS 114 254.092 10.009 9.987 879 2HB LYS 114 HB1 LYS 114 253.899 9.134 11.499 880 1HG LYS 114 HG2 LYS 114 256.199 9.301 11.240 881 2HG LYS 114 HG1 LYS 114 255.833 7.669 10.677 882 1HD LYS 114 HD2 LYS 114 257.066 8.272 8.891 883 2HD LYS 114 HD1 LYS 114 255.581 9.072 8.373 884 1HE LYS 114 HE2 LYS 114 257.935 10.301 9.794 885 2HE LYS 114 HE1 LYS 114 257.372 10.638 8.157 886 1HZ LYS 114 HZ1 LYS 114 256.719 12.361 9.747 887 2HZ LYS 114 HZ2 LYS 114 255.843 11.221 10.636 888 3HZ LYS 114 HZ3 LYS 114 255.372 11.605 9.058 889 H ASP 115 HN ASP 115 251.238 9.181 9.060 890 HA ASP 115 HA ASP 115 249.749 8.344 11.418 891 1HB ASP 115 HB2 ASP 115 249.429 10.525 9.404 892 2HB ASP 115 HB1 ASP 115 248.000 9.953 10.260 893 H MET 116 HN MET 116 250.417 6.516 9.199 894 HA MET 116 HA MET 116 247.672 5.680 8.571 895 1HB MET 116 HB2 MET 116 249.742 5.121 6.518 896 2HB MET 116 HB1 MET 116 248.028 5.457 6.326 897 1HG MET 116 HG2 MET 116 248.714 7.858 7.089 898 2HG MET 116 HG1 MET 116 250.314 7.345 6.562 899 1HE MET 116 HE1 MET 116 250.780 7.672 3.409 900 2HE MET 116 HE2 MET 116 249.856 6.208 3.071 901 3HE MET 116 HE3 MET 116 250.831 6.317 4.535 902 H TRP 117 HN TRP 117 250.910 4.370 7.815 903 HA TRP 117 HA TRP 117 250.557 2.206 9.687 904 1HB TRP 117 HB2 TRP 117 249.682 1.901 6.977 905 2HB TRP 117 HB1 TRP 117 251.080 0.864 7.236 906 HD1 TRP 117 HD1 TRP 117 248.892 1.367 10.269 907 HE1 TRP 117 HE1 TRP 117 247.553 -0.782 10.724 908 HE3 TRP 117 HE3 TRP 117 249.920 -1.166 5.946 909 HZ2 TRP 117 HZ2 TRP 117 247.003 -3.227 9.426 910 HZ3 TRP 117 HZ3 TRP 117 248.948 -3.403 5.632 911 HH2 TRP 117 HH2 TRP 117 247.520 -4.411 7.336 912 HA PRO 118 HA PRO 118 254.960 2.019 9.361 913 1HB PRO 118 HB2 PRO 118 255.538 -0.488 10.026 914 2HB PRO 118 HB1 PRO 118 254.711 0.584 11.159 915 1HG PRO 118 HG2 PRO 118 253.587 -1.591 9.447 916 2HG PRO 118 HG1 PRO 118 253.184 -1.158 11.117 917 1HD PRO 118 HD2 PRO 118 251.737 -0.402 8.868 918 2HD PRO 118 HD1 PRO 118 251.655 0.391 10.453 919 H ASP 119 HN ASP 119 253.303 1.008 6.824 920 HA ASP 119 HA ASP 119 255.679 -0.087 5.473 921 1HB ASP 119 HB2 ASP 119 253.931 -1.237 3.945 922 2HB ASP 119 HB1 ASP 119 254.266 -1.943 5.522 923 H ASP 120 HN ASP 120 253.070 2.170 5.437 924 HA ASP 120 HA ASP 120 252.706 2.872 2.842 925 1HB ASP 120 HB2 ASP 120 252.924 4.618 5.279 926 2HB ASP 120 HB1 ASP 120 252.417 5.236 3.709 927 H SER 121 HN SER 121 255.317 4.168 4.891 928 HA SER 121 HA SER 121 256.527 5.759 2.925 929 1HB SER 121 HB2 SER 121 258.263 4.469 4.970 930 2HB SER 121 HB1 SER 121 258.156 6.161 4.484 931 HG SER 121 HG SER 121 256.848 4.830 6.476 932 H TYR 122 HN TYR 122 256.490 2.339 3.228 933 HA TYR 122 HA TYR 122 258.983 1.949 1.831 934 1HB TYR 122 HB2 TYR 122 256.872 0.089 2.884 935 2HB TYR 122 HB1 TYR 122 258.158 -0.491 1.833 936 HD1 TYR 122 HD1 TYR 122 257.368 0.883 5.142 937 HD2 TYR 122 HD2 TYR 122 260.443 -0.627 2.619 938 HE1 TYR 122 HE1 TYR 122 258.857 0.681 7.087 939 HE2 TYR 122 HE2 TYR 122 261.940 -0.834 4.558 940 HH TYR 122 HH TYR 122 260.830 -0.543 7.778 941 H TRP 123 HN TRP 123 255.548 1.972 1.026 942 HA TRP 123 HA TRP 123 256.307 1.276 -1.719 943 1HB TRP 123 HB2 TRP 123 253.980 0.637 -2.115 944 2HB TRP 123 HB1 TRP 123 254.680 -0.265 -0.778 945 HD1 TRP 123 HD1 TRP 123 253.806 0.398 1.717 946 HE1 TRP 123 HE1 TRP 123 251.543 1.359 2.482 947 HE3 TRP 123 HE3 TRP 123 252.115 2.174 -2.770 948 HZ2 TRP 123 HZ2 TRP 123 249.334 2.712 1.334 949 HZ3 TRP 123 HZ3 TRP 123 249.916 3.278 -2.846 950 HH2 TRP 123 HH2 TRP 123 248.560 3.533 -0.840 951 H PHE 124 HN PHE 124 255.668 3.964 0.068 952 HA PHE 124 HA PHE 124 254.007 5.390 -1.788 953 1HB PHE 124 HB2 PHE 124 255.263 5.917 0.799 954 2HB PHE 124 HB1 PHE 124 255.290 7.313 -0.272 955 HD1 PHE 124 HD1 PHE 124 252.901 4.651 0.791 956 HD2 PHE 124 HD2 PHE 124 253.511 8.764 -0.124 957 HE1 PHE 124 HE1 PHE 124 250.564 5.131 1.380 958 HE2 PHE 124 HE2 PHE 124 251.181 9.245 0.462 959 HZ PHE 124 HZ PHE 124 249.701 7.431 1.217 960 HA PRO 125 HA PRO 125 258.440 7.574 -2.581 961 1HB PRO 125 HB2 PRO 125 259.888 4.966 -2.371 962 2HB PRO 125 HB1 PRO 125 260.463 6.602 -2.031 963 1HG PRO 125 HG2 PRO 125 259.788 4.973 -0.042 964 2HG PRO 125 HG1 PRO 125 259.386 6.699 0.022 965 1HD PRO 125 HD2 PRO 125 257.621 4.359 -0.484 966 2HD PRO 125 HD1 PRO 125 257.250 5.908 0.299 967 H LEU 126 HN LEU 126 257.649 4.252 -3.597 968 HA LEU 126 HA LEU 126 258.729 4.684 -6.231 969 1HB LEU 126 HB2 LEU 126 257.579 2.463 -6.712 970 2HB LEU 126 HB1 LEU 126 258.889 2.459 -5.549 971 HG LEU 126 HG LEU 126 256.422 2.864 -4.151 972 1HD1 LEU 126 HD11 LEU 126 256.463 0.402 -5.888 973 2HD1 LEU 126 HD12 LEU 126 255.406 1.792 -6.130 974 3HD1 LEU 126 HD13 LEU 126 255.260 0.818 -4.667 975 1HD2 LEU 126 HD21 LEU 126 257.181 0.526 -3.276 976 2HD2 LEU 126 HD22 LEU 126 258.150 1.957 -2.925 977 3HD2 LEU 126 HD23 LEU 126 258.634 0.859 -4.218 978 H LEU 127 HN LEU 127 255.588 4.756 -4.689 979 HA LEU 127 HA LEU 127 253.952 4.833 -6.960 980 1HB LEU 127 HB2 LEU 127 253.637 6.162 -4.268 981 2HB LEU 127 HB1 LEU 127 252.378 6.122 -5.483 982 HG LEU 127 HG LEU 127 252.942 4.229 -3.465 983 1HD1 LEU 127 HD11 LEU 127 250.967 4.383 -5.718 984 2HD1 LEU 127 HD12 LEU 127 250.726 4.803 -4.022 985 3HD1 LEU 127 HD13 LEU 127 250.922 3.115 -4.495 986 1HD2 LEU 127 HD21 LEU 127 253.024 2.148 -4.787 987 2HD2 LEU 127 HD22 LEU 127 254.488 3.112 -4.952 988 3HD2 LEU 127 HD23 LEU 127 253.289 3.106 -6.243 989 H LEU 128 HN LEU 128 255.280 7.461 -5.006 990 HA LEU 128 HA LEU 128 254.436 9.602 -6.595 991 1HB LEU 128 HB2 LEU 128 256.465 9.177 -4.487 992 2HB LEU 128 HB1 LEU 128 256.720 10.572 -5.520 993 HG LEU 128 HG LEU 128 254.130 10.070 -4.064 994 1HD1 LEU 128 HD11 LEU 128 255.016 11.913 -2.541 995 2HD1 LEU 128 HD12 LEU 128 256.610 11.507 -3.178 996 3HD1 LEU 128 HD13 LEU 128 255.669 10.291 -2.315 997 1HD2 LEU 128 HD21 LEU 128 255.314 12.531 -5.345 998 2HD2 LEU 128 HD22 LEU 128 253.783 12.460 -4.472 999 3HD2 LEU 128 HD23 LEU 128 253.981 11.565 -5.979 1000 H GLN 129 HN GLN 129 257.124 7.417 -6.942 1001 HA GLN 129 HA GLN 129 258.439 9.038 -8.948 1002 1HB GLN 129 HB2 GLN 129 258.996 6.405 -7.642 1003 2HB GLN 129 HB1 GLN 129 259.806 6.805 -9.150 1004 1HG GLN 129 HG2 GLN 129 260.999 8.536 -8.209 1005 2HG GLN 129 HG1 GLN 129 259.852 8.745 -6.887 1006 1HE2 GLN 129 HE21 GLN 129 261.358 5.773 -8.035 1007 2HE2 GLN 129 HE22 GLN 129 262.201 5.419 -6.570 1008 H LYS 130 HN LYS 130 255.841 6.906 -8.931 1009 HA LYS 130 HA LYS 130 254.570 6.026 -10.601 1010 1HB LYS 130 HB2 LYS 130 256.478 7.271 -12.578 1011 2HB LYS 130 HB1 LYS 130 254.798 6.820 -12.839 1012 1HG LYS 130 HG2 LYS 130 254.043 8.766 -12.061 1013 2HG LYS 130 HG1 LYS 130 255.129 8.731 -10.670 1014 1HD LYS 130 HD2 LYS 130 256.320 9.278 -13.334 1015 2HD LYS 130 HD1 LYS 130 255.345 10.552 -12.597 1016 1HE LYS 130 HE2 LYS 130 256.879 9.797 -10.495 1017 2HE LYS 130 HE1 LYS 130 257.986 9.503 -11.834 1018 1HZ LYS 130 HZ1 LYS 130 256.810 12.035 -10.922 1019 2HZ LYS 130 HZ2 LYS 130 257.234 11.867 -12.550 1020 3HZ LYS 130 HZ3 LYS 130 258.410 11.686 -11.348 1021 H LYS 131 HN LYS 131 256.525 4.451 -9.426 1022 HA LYS 131 HA LYS 131 257.382 2.756 -11.682 1023 1HB LYS 131 HB2 LYS 131 258.724 3.094 -8.993 1024 2HB LYS 131 HB1 LYS 131 259.231 1.968 -10.244 1025 1HG LYS 131 HG2 LYS 131 259.491 4.006 -11.746 1026 2HG LYS 131 HG1 LYS 131 259.352 4.964 -10.271 1027 1HD LYS 131 HD2 LYS 131 261.663 4.670 -10.601 1028 2HD LYS 131 HD1 LYS 131 261.225 3.516 -9.340 1029 1HE LYS 131 HE2 LYS 131 262.616 2.322 -10.811 1030 2HE LYS 131 HE1 LYS 131 260.978 1.807 -11.205 1031 1HZ LYS 131 HZ1 LYS 131 261.181 3.766 -12.915 1032 2HZ LYS 131 HZ2 LYS 131 261.784 2.228 -13.276 1033 3HZ LYS 131 HZ3 LYS 131 262.835 3.449 -12.762 1034 H LYS 132 HN LYS 132 257.450 0.434 -11.218 1035 HA LYS 132 HA LYS 132 255.281 -0.311 -9.385 1036 1HB LYS 132 HB2 LYS 132 256.385 -1.603 -11.871 1037 2HB LYS 132 HB1 LYS 132 255.357 -2.489 -10.752 1038 1HG LYS 132 HG2 LYS 132 253.560 -0.903 -11.098 1039 2HG LYS 132 HG1 LYS 132 254.590 0.062 -12.159 1040 1HD LYS 132 HD2 LYS 132 254.592 -1.574 -13.834 1041 2HD LYS 132 HD1 LYS 132 254.033 -2.832 -12.729 1042 1HE LYS 132 HE2 LYS 132 251.864 -2.239 -12.943 1043 2HE LYS 132 HE1 LYS 132 252.236 -0.518 -13.049 1044 1HZ LYS 132 HZ1 LYS 132 253.220 -1.333 -15.358 1045 2HZ LYS 132 HZ2 LYS 132 251.605 -0.865 -15.175 1046 3HZ LYS 132 HZ3 LYS 132 252.015 -2.506 -15.167 1047 H PHE 133 HN PHE 133 255.606 -1.708 -7.729 1048 HA PHE 133 HA PHE 133 258.061 -3.254 -7.598 1049 1HB PHE 133 HB2 PHE 133 259.139 -2.028 -6.065 1050 2HB PHE 133 HB1 PHE 133 257.981 -0.748 -6.398 1051 HD1 PHE 133 HD1 PHE 133 259.509 -2.445 -3.854 1052 HD2 PHE 133 HD2 PHE 133 255.620 -1.228 -5.082 1053 HE1 PHE 133 HE1 PHE 133 258.739 -2.556 -1.521 1054 HE2 PHE 133 HE2 PHE 133 254.846 -1.333 -2.750 1055 HZ PHE 133 HZ PHE 133 256.407 -1.997 -0.965 1056 H HIS 134 HN HIS 134 258.118 -4.536 -5.500 1057 HA HIS 134 HA HIS 134 255.490 -5.186 -4.420 1058 1HB HIS 134 HB2 HIS 134 255.726 -6.707 -6.334 1059 2HB HIS 134 HB1 HIS 134 257.295 -7.235 -5.737 1060 HD1 HIS 134 HD1 HIS 134 257.052 -8.249 -3.108 1061 HD2 HIS 134 HD2 HIS 134 253.775 -8.436 -5.656 1062 HE1 HIS 134 HE1 HIS 134 255.555 -10.028 -2.149 1063 HE2 HIS 134 HE2 HIS 134 253.618 -10.181 -3.753 1064 H GLY 135 HN GLY 135 255.681 -5.382 -2.252 1065 1HA GLY 135 HA2 GLY 135 258.343 -6.143 -1.214 1066 2HA GLY 135 HA1 GLY 135 257.396 -4.849 -0.498 1067 H TYR 136 HN TYR 136 258.455 -7.304 0.665 1068 HA TYR 136 HA TYR 136 255.935 -8.487 1.626 1069 1HB TYR 136 HB2 TYR 136 257.641 -9.942 0.256 1070 2HB TYR 136 HB1 TYR 136 258.543 -9.966 1.765 1071 HD1 TYR 136 HD1 TYR 136 257.323 -12.337 0.267 1072 HD2 TYR 136 HD2 TYR 136 255.893 -9.944 3.480 1073 HE1 TYR 136 HE1 TYR 136 255.949 -14.219 1.049 1074 HE2 TYR 136 HE2 TYR 136 254.516 -11.819 4.269 1075 HH TYR 136 HH TYR 136 253.453 -13.929 3.140 1076 H PHE 137 HN PHE 137 255.541 -7.722 3.613 1077 HA PHE 137 HA PHE 137 257.837 -7.226 5.392 1078 1HB PHE 137 HB2 PHE 137 255.093 -5.981 5.578 1079 2HB PHE 137 HB1 PHE 137 256.535 -5.525 6.480 1080 HD1 PHE 137 HD1 PHE 137 255.065 -5.625 3.085 1081 HD2 PHE 137 HD2 PHE 137 258.048 -3.963 5.623 1082 HE1 PHE 137 HE1 PHE 137 255.639 -3.993 1.335 1083 HE2 PHE 137 HE2 PHE 137 258.627 -2.329 3.878 1084 HZ PHE 137 HZ PHE 137 257.421 -2.341 1.731 1085 H LYS 138 HN LYS 138 258.006 -8.395 7.196 1086 HA LYS 138 HA LYS 138 255.875 -10.234 7.932 1087 1HB LYS 138 HB2 LYS 138 258.674 -10.348 8.016 1088 2HB LYS 138 HB1 LYS 138 258.171 -10.258 9.698 1089 1HG LYS 138 HG2 LYS 138 256.465 -12.124 8.866 1090 2HG LYS 138 HG1 LYS 138 257.760 -12.398 7.700 1091 1HD LYS 138 HD2 LYS 138 259.138 -13.263 9.253 1092 2HD LYS 138 HD1 LYS 138 258.673 -12.070 10.467 1093 1HE LYS 138 HE2 LYS 138 257.219 -13.468 11.419 1094 2HE LYS 138 HE1 LYS 138 256.520 -13.921 9.865 1095 1HZ LYS 138 HZ1 LYS 138 258.939 -15.075 11.140 1096 2HZ LYS 138 HZ2 LYS 138 258.456 -15.419 9.556 1097 3HZ LYS 138 HZ3 LYS 138 257.463 -15.853 10.856 1098 H PHE 139 HN PHE 139 254.518 -9.885 9.628 1099 HA PHE 139 HA PHE 139 255.065 -7.502 11.267 1100 1HB PHE 139 HB2 PHE 139 252.544 -8.782 10.283 1101 2HB PHE 139 HB1 PHE 139 252.502 -7.831 11.765 1102 HD1 PHE 139 HD1 PHE 139 251.376 -5.889 11.226 1103 HD2 PHE 139 HD2 PHE 139 254.443 -7.293 8.635 1104 HE1 PHE 139 HE1 PHE 139 251.195 -3.823 9.901 1105 HE2 PHE 139 HE2 PHE 139 254.270 -5.231 7.305 1106 HZ PHE 139 HZ PHE 139 252.644 -3.493 7.938 1107 H GLN 140 HN GLN 140 254.840 -7.534 13.471 1108 HA GLN 140 HA GLN 140 255.275 -10.099 14.732 1109 1HB GLN 140 HB2 GLN 140 256.711 -8.440 15.538 1110 2HB GLN 140 HB1 GLN 140 255.442 -7.232 15.594 1111 1HG GLN 140 HG2 GLN 140 256.159 -7.904 17.817 1112 2HG GLN 140 HG1 GLN 140 254.466 -8.302 17.531 1113 1HE2 GLN 140 HE21 GLN 140 254.182 -10.004 18.839 1114 2HE2 GLN 140 HE22 GLN 140 255.081 -11.477 18.754 1115 H GLY 141 HN GLY 141 252.549 -8.475 13.852 1116 1HA GLY 141 HA2 GLY 141 250.781 -10.090 15.250 1117 2HA GLY 141 HA1 GLY 141 250.967 -8.628 16.204 1118 H GLN 142 HN GLN 142 251.125 -6.678 14.268 1119 HA GLN 142 HA GLN 142 249.304 -6.826 12.171 1120 1HB GLN 142 HB2 GLN 142 248.072 -6.505 14.809 1121 2HB GLN 142 HB1 GLN 142 247.587 -5.270 13.656 1122 1HG GLN 142 HG2 GLN 142 246.279 -6.680 12.550 1123 2HG GLN 142 HG1 GLN 142 247.532 -7.919 12.491 1124 1HE2 GLN 142 HE21 GLN 142 244.728 -8.310 12.904 1125 2HE2 GLN 142 HE22 GLN 142 244.538 -9.041 14.458 1126 H ASP 143 HN ASP 143 250.778 -4.853 14.673 1127 HA ASP 143 HA ASP 143 250.800 -2.596 12.776 1128 1HB ASP 143 HB2 ASP 143 251.043 -2.340 15.771 1129 2HB ASP 143 HB1 ASP 143 250.747 -1.063 14.596 1130 H THR 144 HN THR 144 252.719 -4.718 14.715 1131 HA THR 144 HA THR 144 255.087 -3.038 14.415 1132 HB THR 144 HB THR 144 254.549 -5.578 15.940 1133 HG1 THR 144 HG1 THR 144 254.576 -4.294 17.620 1134 1HG2 THR 144 HG21 THR 144 256.793 -5.810 15.070 1135 2HG2 THR 144 HG22 THR 144 256.837 -5.460 16.797 1136 3HG2 THR 144 HG23 THR 144 257.200 -4.188 15.631 1137 H ILE 145 HN ILE 145 256.784 -3.495 13.107 1138 HA ILE 145 HA ILE 145 256.469 -5.826 11.346 1139 HB ILE 145 HB ILE 145 258.008 -3.293 10.772 1140 1HG1 ILE 145 HG12 ILE 145 255.380 -4.272 9.631 1141 2HG1 ILE 145 HG11 ILE 145 255.557 -2.955 10.787 1142 1HG2 ILE 145 HG21 ILE 145 257.641 -4.540 8.386 1143 2HG2 ILE 145 HG22 ILE 145 257.843 -5.919 9.466 1144 3HG2 ILE 145 HG23 ILE 145 259.095 -4.681 9.373 1145 1HD1 ILE 145 HD11 ILE 145 256.655 -3.010 7.986 1146 2HD1 ILE 145 HD12 ILE 145 256.845 -1.692 9.143 1147 3HD1 ILE 145 HD13 ILE 145 255.243 -2.111 8.539 1148 H LEU 146 HN LEU 146 258.127 -7.229 11.059 1149 HA LEU 146 HA LEU 146 260.546 -6.764 12.673 1150 1HB LEU 146 HB2 LEU 146 259.430 -9.487 12.077 1151 2HB LEU 146 HB1 LEU 146 260.603 -9.032 13.300 1152 HG LEU 146 HG LEU 146 257.794 -7.989 13.433 1153 1HD1 LEU 146 HD11 LEU 146 257.062 -10.097 13.579 1154 2HD1 LEU 146 HD12 LEU 146 257.795 -10.072 15.182 1155 3HD1 LEU 146 HD13 LEU 146 258.682 -10.751 13.818 1156 1HD2 LEU 146 HD21 LEU 146 260.000 -7.409 14.886 1157 2HD2 LEU 146 HD22 LEU 146 259.325 -8.736 15.831 1158 3HD2 LEU 146 HD23 LEU 146 258.351 -7.303 15.504 1159 H ASP 147 HN ASP 147 259.287 -7.365 9.579 1160 HA ASP 147 HA ASP 147 261.953 -7.555 8.486 1161 1HB ASP 147 HB2 ASP 147 260.456 -9.911 8.890 1162 2HB ASP 147 HB1 ASP 147 260.366 -9.572 7.164 1163 H TYR 148 HN TYR 148 262.095 -6.581 6.506 1164 HA TYR 148 HA TYR 148 259.613 -6.158 5.022 1165 1HB TYR 148 HB2 TYR 148 260.006 -3.801 4.726 1166 2HB TYR 148 HB1 TYR 148 259.952 -4.171 6.445 1167 HD1 TYR 148 HD1 TYR 148 262.235 -3.408 3.631 1168 HD2 TYR 148 HD2 TYR 148 261.797 -3.699 7.852 1169 HE1 TYR 148 HE1 TYR 148 264.420 -2.320 3.926 1170 HE2 TYR 148 HE2 TYR 148 263.982 -2.612 8.159 1171 HH TYR 148 HH TYR 148 266.171 -2.413 6.624 1172 H THR 149 HN THR 149 259.821 -6.401 2.888 1173 HA THR 149 HA THR 149 262.521 -6.262 1.727 1174 HB THR 149 HB THR 149 261.342 -8.120 0.143 1175 HG1 THR 149 HG1 THR 149 260.451 -8.659 2.780 1176 1HG2 THR 149 HG21 THR 149 263.280 -8.204 2.304 1177 2HG2 THR 149 HG22 THR 149 263.301 -8.986 0.723 1178 3HG2 THR 149 HG23 THR 149 262.436 -9.734 2.065 1179 H LEU 150 HN LEU 150 262.671 -5.401 -0.308 1180 HA LEU 150 HA LEU 150 260.185 -4.529 -1.595 1181 1HB LEU 150 HB2 LEU 150 262.595 -2.814 -1.015 1182 2HB LEU 150 HB1 LEU 150 261.319 -2.354 -2.128 1183 HG LEU 150 HG LEU 150 259.847 -2.893 0.076 1184 1HD1 LEU 150 HD11 LEU 150 262.073 -1.429 1.350 1185 2HD1 LEU 150 HD12 LEU 150 262.274 -3.170 1.152 1186 3HD1 LEU 150 HD13 LEU 150 260.892 -2.537 2.047 1187 1HD2 LEU 150 HD21 LEU 150 260.513 -0.254 0.467 1188 2HD2 LEU 150 HD22 LEU 150 259.286 -0.855 -0.647 1189 3HD2 LEU 150 HD23 LEU 150 260.916 -0.518 -1.229 1190 H ARG 151 HN ARG 151 260.109 -5.084 -3.658 1191 HA ARG 151 HA ARG 151 262.623 -5.329 -5.164 1192 1HB ARG 151 HB2 ARG 151 260.316 -7.233 -5.526 1193 2HB ARG 151 HB1 ARG 151 261.946 -7.375 -6.168 1194 1HG ARG 151 HG2 ARG 151 261.170 -7.583 -3.266 1195 2HG ARG 151 HG1 ARG 151 261.572 -8.929 -4.335 1196 1HD ARG 151 HD2 ARG 151 263.548 -6.728 -4.088 1197 2HD ARG 151 HD1 ARG 151 263.357 -7.808 -2.710 1198 HE ARG 151 HE ARG 151 264.258 -9.539 -3.953 1199 1HH1 ARG 151 HH11 ARG 151 263.796 -6.723 -5.971 1200 2HH1 ARG 151 HH12 ARG 151 264.755 -7.348 -7.269 1201 1HH2 ARG 151 HH21 ARG 151 265.517 -10.355 -5.663 1202 2HH2 ARG 151 HH22 ARG 151 265.730 -9.406 -7.096 1203 H GLU 152 HN GLU 152 262.590 -4.014 -6.868 1204 HA GLU 152 HA GLU 152 260.123 -2.838 -7.771 1205 1HB GLU 152 HB2 GLU 152 262.796 -2.532 -9.118 1206 2HB GLU 152 HB1 GLU 152 261.447 -1.406 -9.100 1207 1HG GLU 152 HG2 GLU 152 262.004 -1.579 -6.456 1208 2HG GLU 152 HG1 GLU 152 263.607 -1.803 -7.157 1209 H VAL 153 HN VAL 153 259.074 -3.154 -9.691 1210 HA VAL 153 HA VAL 153 260.115 -5.247 -11.477 1211 HB VAL 153 HB VAL 153 257.785 -6.086 -11.769 1212 1HG1 VAL 153 HG11 VAL 153 259.185 -7.415 -10.426 1213 2HG1 VAL 153 HG12 VAL 153 257.698 -7.227 -9.497 1214 3HG1 VAL 153 HG13 VAL 153 259.122 -6.272 -9.085 1215 1HG2 VAL 153 HG21 VAL 153 256.932 -3.842 -10.639 1216 2HG2 VAL 153 HG22 VAL 153 256.994 -4.846 -9.191 1217 3HG2 VAL 153 HG23 VAL 153 256.001 -5.339 -10.563 1218 H ASP 154 HN ASP 154 258.887 -5.283 -13.593 1219 HA ASP 154 HA ASP 154 257.443 -2.990 -14.435 1220 1HB ASP 154 HB2 ASP 154 260.393 -2.998 -14.775 1221 2HB ASP 154 HB1 ASP 154 259.440 -2.473 -16.159 1222 H THR 155 HN THR 155 259.594 -5.619 -15.433 1223 HA THR 155 HA THR 155 257.953 -6.027 -17.831 1224 HB THR 155 HB THR 155 260.384 -7.666 -17.377 1225 HG1 THR 155 HG1 THR 155 261.450 -5.907 -16.879 1226 1HG2 THR 155 HG21 THR 155 260.695 -6.624 -19.805 1227 2HG2 THR 155 HG22 THR 155 258.943 -6.478 -19.661 1228 3HG2 THR 155 HG23 THR 155 259.714 -8.056 -19.494 1229 H VAL 156 HN VAL 156 258.060 -8.567 -18.415 1230 HA VAL 156 HA VAL 156 257.211 -10.060 -16.026 1231 HB VAL 156 HB VAL 156 255.816 -10.236 -18.697 1232 1HG1 VAL 156 HG11 VAL 156 255.148 -11.345 -15.973 1233 2HG1 VAL 156 HG12 VAL 156 255.665 -12.263 -17.387 1234 3HG1 VAL 156 HG13 VAL 156 254.105 -11.442 -17.391 1235 1HG2 VAL 156 HG21 VAL 156 253.969 -9.010 -17.649 1236 2HG2 VAL 156 HG22 VAL 156 255.435 -8.033 -17.731 1237 3HG2 VAL 156 HG23 VAL 156 254.952 -8.772 -16.204 Start of MODEL 2 1 1H MET 1 HT1 MET 1 241.091 -25.818 -0.640 2 2H MET 1 HT2 MET 1 241.926 -25.351 -2.065 3 3H MET 1 HT3 MET 1 241.194 -24.162 -1.068 4 HA MET 1 HA MET 1 242.693 -24.990 0.738 5 1HB MET 1 HB2 MET 1 243.978 -26.180 -1.729 6 2HB MET 1 HB1 MET 1 244.793 -26.009 -0.181 7 1HG MET 1 HG2 MET 1 243.689 -27.738 0.749 8 2HG MET 1 HG1 MET 1 242.199 -27.402 -0.130 9 1HE MET 1 HE1 MET 1 241.817 -30.081 -2.205 10 2HE MET 1 HE2 MET 1 241.423 -29.283 -0.682 11 3HE MET 1 HE3 MET 1 242.422 -30.737 -0.684 12 H GLY 2 HN GLY 2 243.121 -22.902 1.153 13 1HA GLY 2 HA2 GLY 2 245.179 -21.587 -0.396 14 2HA GLY 2 HA1 GLY 2 243.607 -20.808 -0.483 15 H ALA 3 HN ALA 3 246.492 -20.760 1.075 16 HA ALA 3 HA ALA 3 245.307 -19.557 3.492 17 1HB ALA 3 HB1 ALA 3 247.586 -21.415 3.161 18 2HB ALA 3 HB2 ALA 3 246.421 -21.270 4.477 19 3HB ALA 3 HB3 ALA 3 247.765 -20.134 4.361 20 H SER 4 HN SER 4 245.238 -17.498 2.505 21 HA SER 4 HA SER 4 247.491 -15.886 2.940 22 1HB SER 4 HB2 SER 4 248.652 -16.268 1.046 23 2HB SER 4 HB1 SER 4 247.288 -17.073 0.273 24 HG SER 4 HG SER 4 247.844 -14.301 0.404 25 H ARG 5 HN ARG 5 246.162 -14.527 3.968 26 HA ARG 5 HA ARG 5 243.652 -13.669 3.118 27 1HB ARG 5 HB2 ARG 5 245.703 -12.296 4.860 28 2HB ARG 5 HB1 ARG 5 244.061 -11.706 4.639 29 1HG ARG 5 HG2 ARG 5 244.310 -14.522 5.465 30 2HG ARG 5 HG1 ARG 5 244.820 -13.317 6.649 31 1HD ARG 5 HD2 ARG 5 242.715 -12.439 6.866 32 2HD ARG 5 HD1 ARG 5 242.235 -12.909 5.237 33 HE ARG 5 HE ARG 5 241.985 -14.469 7.639 34 1HH1 ARG 5 HH11 ARG 5 242.213 -14.591 4.158 35 2HH1 ARG 5 HH12 ARG 5 241.428 -16.128 4.035 36 1HH2 ARG 5 HH21 ARG 5 240.950 -16.492 7.479 37 2HH2 ARG 5 HH22 ARG 5 240.710 -17.208 5.920 38 H LEU 6 HN LEU 6 243.610 -13.121 0.976 39 HA LEU 6 HA LEU 6 245.425 -11.104 -0.050 40 1HB LEU 6 HB2 LEU 6 244.252 -13.214 -1.235 41 2HB LEU 6 HB1 LEU 6 243.080 -11.977 -1.643 42 HG LEU 6 HG LEU 6 245.990 -11.533 -2.212 43 1HD1 LEU 6 HD11 LEU 6 244.091 -13.316 -3.659 44 2HD1 LEU 6 HD12 LEU 6 245.819 -13.510 -3.365 45 3HD1 LEU 6 HD13 LEU 6 245.256 -12.364 -4.580 46 1HD2 LEU 6 HD21 LEU 6 245.282 -9.847 -3.567 47 2HD2 LEU 6 HD22 LEU 6 243.946 -9.845 -2.416 48 3HD2 LEU 6 HD23 LEU 6 243.769 -10.657 -3.971 49 H TYR 7 HN TYR 7 245.067 -9.041 0.243 50 HA TYR 7 HA TYR 7 242.296 -8.056 0.349 51 1HB TYR 7 HB2 TYR 7 244.673 -7.379 2.046 52 2HB TYR 7 HB1 TYR 7 243.401 -6.187 1.801 53 HD1 TYR 7 HD1 TYR 7 241.880 -6.065 3.520 54 HD2 TYR 7 HD2 TYR 7 243.571 -9.850 2.564 55 HE1 TYR 7 HE1 TYR 7 240.560 -7.101 5.317 56 HE2 TYR 7 HE2 TYR 7 242.255 -10.896 4.359 57 HH TYR 7 HH TYR 7 241.176 -10.122 6.544 58 H THR 8 HN THR 8 242.469 -5.482 0.183 59 HA THR 8 HA THR 8 244.121 -4.858 -2.184 60 HB THR 8 HB THR 8 242.281 -3.592 -3.091 61 HG1 THR 8 HG1 THR 8 240.187 -4.070 -1.769 62 1HG2 THR 8 HG21 THR 8 240.530 -5.351 -3.362 63 2HG2 THR 8 HG22 THR 8 241.443 -6.341 -2.228 64 3HG2 THR 8 HG23 THR 8 242.167 -5.863 -3.762 65 H LEU 9 HN LEU 9 244.257 -2.450 -2.544 66 HA LEU 9 HA LEU 9 244.010 -0.777 -0.200 67 1HB LEU 9 HB2 LEU 9 246.207 -2.101 -0.036 68 2HB LEU 9 HB1 LEU 9 246.750 -1.133 -1.391 69 HG LEU 9 HG LEU 9 245.958 -0.111 1.327 70 1HD1 LEU 9 HD11 LEU 9 248.219 0.312 1.715 71 2HD1 LEU 9 HD12 LEU 9 248.640 0.105 0.014 72 3HD1 LEU 9 HD13 LEU 9 248.193 -1.296 0.989 73 1HD2 LEU 9 HD21 LEU 9 246.912 2.055 0.371 74 2HD2 LEU 9 HD22 LEU 9 245.289 1.582 -0.134 75 3HD2 LEU 9 HD23 LEU 9 246.660 1.315 -1.210 76 H VAL 10 HN VAL 10 243.014 0.925 -1.170 77 HA VAL 10 HA VAL 10 244.111 1.848 -3.728 78 HB VAL 10 HB VAL 10 241.859 1.279 -4.071 79 1HG1 VAL 10 HG11 VAL 10 240.177 2.593 -2.464 80 2HG1 VAL 10 HG12 VAL 10 241.508 2.268 -1.359 81 3HG1 VAL 10 HG13 VAL 10 240.718 0.938 -2.206 82 1HG2 VAL 10 HG21 VAL 10 241.633 4.216 -3.528 83 2HG2 VAL 10 HG22 VAL 10 240.887 3.277 -4.819 84 3HG2 VAL 10 HG23 VAL 10 242.621 3.587 -4.847 85 H LEU 11 HN LEU 11 245.123 3.652 -3.812 86 HA LEU 11 HA LEU 11 244.609 5.718 -1.787 87 1HB LEU 11 HB2 LEU 11 247.034 4.271 -2.398 88 2HB LEU 11 HB1 LEU 11 247.261 5.986 -2.676 89 HG LEU 11 HG LEU 11 246.557 4.597 -0.093 90 1HD1 LEU 11 HD11 LEU 11 248.984 5.243 -1.116 91 2HD1 LEU 11 HD12 LEU 11 248.631 5.103 0.606 92 3HD1 LEU 11 HD13 LEU 11 248.621 6.687 -0.169 93 1HD2 LEU 11 HD21 LEU 11 245.156 6.345 0.228 94 2HD2 LEU 11 HD22 LEU 11 246.005 7.383 -0.918 95 3HD2 LEU 11 HD23 LEU 11 246.662 7.131 0.700 96 H VAL 12 HN VAL 12 243.701 7.375 -2.821 97 HA VAL 12 HA VAL 12 244.096 7.745 -5.647 98 HB VAL 12 HB VAL 12 242.581 9.532 -3.748 99 1HG1 VAL 12 HG11 VAL 12 241.292 10.048 -5.836 100 2HG1 VAL 12 HG12 VAL 12 242.525 9.166 -6.738 101 3HG1 VAL 12 HG13 VAL 12 242.960 10.619 -5.839 102 1HG2 VAL 12 HG21 VAL 12 241.985 6.863 -4.827 103 2HG2 VAL 12 HG22 VAL 12 240.694 8.050 -5.009 104 3HG2 VAL 12 HG23 VAL 12 241.336 7.685 -3.408 105 H LEU 13 HN LEU 13 246.329 8.183 -5.700 106 HA LEU 13 HA LEU 13 247.121 10.838 -4.711 107 1HB LEU 13 HB2 LEU 13 248.382 8.767 -3.979 108 2HB LEU 13 HB1 LEU 13 248.962 8.661 -5.628 109 HG LEU 13 HG LEU 13 250.646 9.967 -5.054 110 1HD1 LEU 13 HD11 LEU 13 250.224 12.385 -4.524 111 2HD1 LEU 13 HD12 LEU 13 248.507 12.017 -4.623 112 3HD1 LEU 13 HD13 LEU 13 249.539 11.788 -6.033 113 1HD2 LEU 13 HD21 LEU 13 250.958 9.613 -2.873 114 2HD2 LEU 13 HD22 LEU 13 249.248 9.830 -2.503 115 3HD2 LEU 13 HD23 LEU 13 250.299 11.236 -2.673 116 H GLN 14 HN GLN 14 247.150 12.379 -6.175 117 HA GLN 14 HA GLN 14 247.546 11.677 -9.001 118 1HB GLN 14 HB2 GLN 14 246.120 13.918 -7.610 119 2HB GLN 14 HB1 GLN 14 246.709 14.152 -9.250 120 1HG GLN 14 HG2 GLN 14 245.421 11.765 -9.467 121 2HG GLN 14 HG1 GLN 14 244.438 12.597 -8.263 122 1HE2 GLN 14 HE21 GLN 14 242.695 13.264 -9.318 123 2HE2 GLN 14 HE22 GLN 14 242.695 14.183 -10.781 124 HA PRO 15 HA PRO 15 251.482 13.651 -9.163 125 1HB PRO 15 HB2 PRO 15 251.377 15.003 -11.534 126 2HB PRO 15 HB1 PRO 15 251.603 13.255 -11.409 127 1HG PRO 15 HG2 PRO 15 249.106 14.808 -11.961 128 2HG PRO 15 HG1 PRO 15 249.693 13.322 -12.730 129 1HD PRO 15 HD2 PRO 15 247.771 13.286 -10.846 130 2HD PRO 15 HD1 PRO 15 248.972 11.985 -10.986 131 H GLN 16 HN GLN 16 249.281 15.163 -7.818 132 HA GLN 16 HA GLN 16 250.635 17.672 -7.632 133 1HB GLN 16 HB2 GLN 16 248.490 18.981 -8.087 134 2HB GLN 16 HB1 GLN 16 249.342 18.343 -9.485 135 1HG GLN 16 HG2 GLN 16 247.774 16.436 -9.522 136 2HG GLN 16 HG1 GLN 16 246.889 17.178 -8.191 137 1HE2 GLN 16 HE21 GLN 16 246.840 19.792 -8.879 138 2HE2 GLN 16 HE22 GLN 16 245.963 20.011 -10.352 139 H ARG 17 HN ARG 17 247.798 15.728 -6.815 140 HA ARG 17 HA ARG 17 248.107 16.553 -4.031 141 1HB ARG 17 HB2 ARG 17 245.327 16.385 -5.118 142 2HB ARG 17 HB1 ARG 17 245.924 17.270 -3.724 143 1HG ARG 17 HG2 ARG 17 247.190 18.679 -5.518 144 2HG ARG 17 HG1 ARG 17 245.964 18.023 -6.605 145 1HD ARG 17 HD2 ARG 17 244.364 19.340 -5.764 146 2HD ARG 17 HD1 ARG 17 244.853 19.012 -4.101 147 HE ARG 17 HE ARG 17 246.060 20.958 -4.106 148 1HH1 ARG 17 HH11 ARG 17 245.248 20.124 -7.396 149 2HH1 ARG 17 HH12 ARG 17 245.818 21.623 -8.048 150 1HH2 ARG 17 HH21 ARG 17 246.811 22.930 -4.963 151 2HH2 ARG 17 HH22 ARG 17 246.707 23.216 -6.667 152 H VAL 18 HN VAL 18 246.919 15.123 -2.517 153 HA VAL 18 HA VAL 18 246.398 12.451 -3.644 154 HB VAL 18 HB VAL 18 248.582 12.245 -2.734 155 1HG1 VAL 18 HG11 VAL 18 248.266 14.378 -1.307 156 2HG1 VAL 18 HG12 VAL 18 249.355 13.117 -0.733 157 3HG1 VAL 18 HG13 VAL 18 247.735 13.259 -0.052 158 1HG2 VAL 18 HG21 VAL 18 247.028 10.422 -2.174 159 2HG2 VAL 18 HG22 VAL 18 246.664 11.221 -0.645 160 3HG2 VAL 18 HG23 VAL 18 248.291 10.619 -0.960 161 H LEU 19 HN LEU 19 245.063 11.082 -2.301 162 HA LEU 19 HA LEU 19 243.352 12.599 -0.442 163 1HB LEU 19 HB2 LEU 19 242.670 11.205 -2.843 164 2HB LEU 19 HB1 LEU 19 241.896 10.414 -1.482 165 HG LEU 19 HG LEU 19 240.343 11.990 -2.269 166 1HD1 LEU 19 HD11 LEU 19 241.165 12.057 0.279 167 2HD1 LEU 19 HD12 LEU 19 239.834 13.036 -0.339 168 3HD1 LEU 19 HD13 LEU 19 241.442 13.741 -0.172 169 1HD2 LEU 19 HD21 LEU 19 242.472 13.313 -3.321 170 2HD2 LEU 19 HD22 LEU 19 241.977 14.402 -2.025 171 3HD2 LEU 19 HD23 LEU 19 240.823 13.932 -3.271 172 H LEU 20 HN LEU 20 243.376 11.844 1.568 173 HA LEU 20 HA LEU 20 243.891 8.976 1.989 174 1HB LEU 20 HB2 LEU 20 245.282 11.329 3.093 175 2HB LEU 20 HB1 LEU 20 244.866 10.096 4.268 176 HG LEU 20 HG LEU 20 246.413 9.521 1.745 177 1HD1 LEU 20 HD11 LEU 20 247.527 9.880 4.520 178 2HD1 LEU 20 HD12 LEU 20 247.592 11.115 3.263 179 3HD1 LEU 20 HD13 LEU 20 248.424 9.576 3.031 180 1HD2 LEU 20 HD21 LEU 20 246.841 7.408 2.670 181 2HD2 LEU 20 HD22 LEU 20 245.124 7.688 2.956 182 3HD2 LEU 20 HD23 LEU 20 246.282 7.900 4.268 183 H GLY 21 HN GLY 21 242.520 7.949 3.329 184 1HA GLY 21 HA2 GLY 21 240.314 9.505 4.435 185 2HA GLY 21 HA1 GLY 21 240.378 7.757 4.278 186 H MET 22 HN MET 22 240.150 10.067 6.494 187 HA MET 22 HA MET 22 241.847 8.680 8.456 188 1HB MET 22 HB2 MET 22 242.463 11.005 8.256 189 2HB MET 22 HB1 MET 22 240.788 11.509 8.435 190 1HG MET 22 HG2 MET 22 240.748 10.917 10.715 191 2HG MET 22 HG1 MET 22 242.260 10.022 10.584 192 1HE MET 22 HE1 MET 22 244.856 12.805 9.999 193 2HE MET 22 HE2 MET 22 244.244 11.289 9.338 194 3HE MET 22 HE3 MET 22 244.773 11.369 11.017 195 H LYS 23 HN LYS 23 240.950 7.946 10.380 196 HA LYS 23 HA LYS 23 238.085 7.572 10.323 197 1HB LYS 23 HB2 LYS 23 240.369 6.308 11.605 198 2HB LYS 23 HB1 LYS 23 239.043 6.550 12.733 199 1HG LYS 23 HG2 LYS 23 237.551 5.437 11.034 200 2HG LYS 23 HG1 LYS 23 239.020 5.003 10.158 201 1HD LYS 23 HD2 LYS 23 238.869 3.135 11.429 202 2HD LYS 23 HD1 LYS 23 239.696 4.152 12.611 203 1HE LYS 23 HE2 LYS 23 237.958 4.070 13.998 204 2HE LYS 23 HE1 LYS 23 236.846 4.565 12.722 205 1HZ LYS 23 HZ1 LYS 23 236.401 2.341 13.749 206 2HZ LYS 23 HZ2 LYS 23 237.820 1.782 13.016 207 3HZ LYS 23 HZ3 LYS 23 236.537 2.335 12.063 208 H LYS 24 HN LYS 24 236.638 8.315 11.897 209 HA LYS 24 HA LYS 24 237.547 10.735 13.240 210 1HB LYS 24 HB2 LYS 24 234.912 9.678 12.351 211 2HB LYS 24 HB1 LYS 24 234.919 10.729 13.761 212 1HG LYS 24 HG2 LYS 24 235.243 12.552 12.528 213 2HG LYS 24 HG1 LYS 24 236.519 11.786 11.579 214 1HD LYS 24 HD2 LYS 24 234.992 10.879 10.051 215 2HD LYS 24 HD1 LYS 24 233.624 11.129 11.137 216 1HE LYS 24 HE2 LYS 24 235.095 13.560 10.367 217 2HE LYS 24 HE1 LYS 24 234.232 12.750 9.059 218 1HZ LYS 24 HZ1 LYS 24 232.650 14.170 9.903 219 2HZ LYS 24 HZ2 LYS 24 233.153 13.979 11.507 220 3HZ LYS 24 HZ3 LYS 24 232.291 12.742 10.740 221 H ARG 25 HN ARG 25 236.492 7.508 13.916 222 HA ARG 25 HA ARG 25 237.426 7.641 16.574 223 1HB ARG 25 HB2 ARG 25 235.100 7.007 17.556 224 2HB ARG 25 HB1 ARG 25 235.494 8.700 17.296 225 1HG ARG 25 HG2 ARG 25 233.205 8.073 16.585 226 2HG ARG 25 HG1 ARG 25 234.188 8.766 15.294 227 1HD ARG 25 HD2 ARG 25 234.435 6.733 14.213 228 2HD ARG 25 HD1 ARG 25 234.080 5.803 15.668 229 HE ARG 25 HE ARG 25 232.195 6.803 13.755 230 1HH1 ARG 25 HH11 ARG 25 232.627 5.887 17.095 231 2HH1 ARG 25 HH12 ARG 25 230.951 5.532 17.345 232 1HH2 ARG 25 HH21 ARG 25 229.991 6.337 14.082 233 2HH2 ARG 25 HH22 ARG 25 229.454 5.787 15.634 234 H GLY 26 HN GLY 26 237.402 5.600 17.645 235 1HA GLY 26 HA2 GLY 26 236.755 3.266 17.682 236 2HA GLY 26 HA1 GLY 26 236.583 3.342 15.934 237 H PHE 27 HN PHE 27 238.081 2.104 15.024 238 HA PHE 27 HA PHE 27 240.743 1.960 16.243 239 1HB PHE 27 HB2 PHE 27 239.116 -0.035 15.316 240 2HB PHE 27 HB1 PHE 27 240.178 0.222 13.936 241 HD1 PHE 27 HD1 PHE 27 242.760 0.622 14.823 242 HD2 PHE 27 HD2 PHE 27 239.754 -1.761 16.666 243 HE1 PHE 27 HE1 PHE 27 244.504 -0.728 15.912 244 HE2 PHE 27 HE2 PHE 27 241.492 -3.116 17.760 245 HZ PHE 27 HZ PHE 27 243.871 -2.600 17.384 246 H GLY 28 HN GLY 28 241.369 4.067 15.461 247 1HA GLY 28 HA2 GLY 28 243.138 4.432 13.633 248 2HA GLY 28 HA1 GLY 28 241.780 4.201 12.547 249 H ALA 29 HN ALA 29 240.450 5.725 15.113 250 HA ALA 29 HA ALA 29 239.814 8.081 13.904 251 1HB ALA 29 HB1 ALA 29 239.249 7.025 16.278 252 2HB ALA 29 HB2 ALA 29 238.902 8.700 15.847 253 3HB ALA 29 HB3 ALA 29 240.346 8.311 16.782 254 H GLY 30 HN GLY 30 240.987 9.732 13.142 255 1HA GLY 30 HA2 GLY 30 242.495 11.506 13.237 256 2HA GLY 30 HA1 GLY 30 243.143 10.842 14.727 257 H ARG 31 HN ARG 31 242.848 8.754 11.983 258 HA ARG 31 HA ARG 31 245.680 9.130 11.317 259 1HB ARG 31 HB2 ARG 31 244.516 6.837 12.649 260 2HB ARG 31 HB1 ARG 31 245.234 6.369 11.113 261 1HG ARG 31 HG2 ARG 31 246.997 6.117 12.564 262 2HG ARG 31 HG1 ARG 31 247.272 7.747 11.944 263 1HD ARG 31 HD2 ARG 31 245.939 8.552 13.966 264 2HD ARG 31 HD1 ARG 31 246.137 6.919 14.601 265 HE ARG 31 HE ARG 31 248.128 8.977 14.472 266 1HH1 ARG 31 HH11 ARG 31 247.611 5.527 14.535 267 2HH1 ARG 31 HH12 ARG 31 249.179 5.178 15.184 268 1HH2 ARG 31 HH21 ARG 31 250.191 8.520 15.323 269 2HH2 ARG 31 HH22 ARG 31 250.643 6.878 15.631 270 H TRP 32 HN TRP 32 246.023 9.208 9.192 271 HA TRP 32 HA TRP 32 243.808 8.538 7.407 272 1HB TRP 32 HB2 TRP 32 245.934 9.600 5.875 273 2HB TRP 32 HB1 TRP 32 244.415 10.376 6.291 274 HD1 TRP 32 HD1 TRP 32 247.742 9.826 8.247 275 HE1 TRP 32 HE1 TRP 32 248.384 12.069 9.329 276 HE3 TRP 32 HE3 TRP 32 243.865 12.692 6.553 277 HZ2 TRP 32 HZ2 TRP 32 247.399 14.707 9.436 278 HZ3 TRP 32 HZ3 TRP 32 243.792 15.070 7.187 279 HH2 TRP 32 HH2 TRP 32 245.522 16.054 8.599 280 H ASN 33 HN ASN 33 244.086 7.231 5.541 281 HA ASN 33 HA ASN 33 246.450 5.900 4.850 282 1HB ASN 33 HB2 ASN 33 246.266 4.808 7.024 283 2HB ASN 33 HB1 ASN 33 244.615 4.316 6.663 284 1HD2 ASN 33 HD21 ASN 33 247.593 4.218 4.737 285 2HD2 ASN 33 HD22 ASN 33 247.547 2.516 4.444 286 H GLY 34 HN GLY 34 246.165 4.408 3.129 287 1HA GLY 34 HA2 GLY 34 244.187 4.963 1.305 288 2HA GLY 34 HA1 GLY 34 245.097 3.460 1.326 289 H PHE 35 HN PHE 35 242.642 3.249 0.374 290 HA PHE 35 HA PHE 35 240.956 2.312 2.592 291 1HB PHE 35 HB2 PHE 35 239.953 2.517 -0.220 292 2HB PHE 35 HB1 PHE 35 239.077 2.705 1.289 293 HD1 PHE 35 HD1 PHE 35 240.754 4.374 -1.380 294 HD2 PHE 35 HD2 PHE 35 239.509 4.797 2.667 295 HE1 PHE 35 HE1 PHE 35 240.956 6.818 -1.578 296 HE2 PHE 35 HE2 PHE 35 239.706 7.242 2.476 297 HZ PHE 35 HZ PHE 35 240.431 8.256 0.351 298 H GLY 36 HN GLY 36 241.781 0.296 2.987 299 1HA GLY 36 HA2 GLY 36 242.392 -1.525 0.855 300 2HA GLY 36 HA1 GLY 36 242.414 -1.889 2.572 301 H GLY 37 HN GLY 37 241.456 -3.676 0.668 302 1HA GLY 37 HA2 GLY 37 238.759 -4.063 1.665 303 2HA GLY 37 HA1 GLY 37 238.876 -3.803 -0.069 304 H LYS 38 HN LYS 38 238.374 -6.164 1.974 305 HA LYS 38 HA LYS 38 240.348 -8.090 1.197 306 1HB LYS 38 HB2 LYS 38 239.036 -9.681 2.458 307 2HB LYS 38 HB1 LYS 38 239.170 -8.184 3.371 308 1HG LYS 38 HG2 LYS 38 236.880 -7.632 2.241 309 2HG LYS 38 HG1 LYS 38 236.794 -9.382 2.033 310 1HD LYS 38 HD2 LYS 38 237.561 -8.359 4.711 311 2HD LYS 38 HD1 LYS 38 235.880 -8.155 4.214 312 1HE LYS 38 HE2 LYS 38 235.444 -10.369 4.313 313 2HE LYS 38 HE1 LYS 38 237.044 -10.817 3.727 314 1HZ LYS 38 HZ1 LYS 38 236.911 -11.541 5.949 315 2HZ LYS 38 HZ2 LYS 38 236.269 -10.071 6.487 316 3HZ LYS 38 HZ3 LYS 38 237.881 -10.155 5.983 317 H VAL 39 HN VAL 39 240.273 -9.625 -0.347 318 HA VAL 39 HA VAL 39 238.296 -9.343 -2.451 319 HB VAL 39 HB VAL 39 240.323 -11.545 -2.464 320 1HG1 VAL 39 HG11 VAL 39 238.848 -11.360 -4.347 321 2HG1 VAL 39 HG12 VAL 39 240.469 -10.879 -4.847 322 3HG1 VAL 39 HG13 VAL 39 239.240 -9.652 -4.540 323 1HG2 VAL 39 HG21 VAL 39 241.673 -9.444 -3.620 324 2HG2 VAL 39 HG22 VAL 39 242.013 -10.154 -2.044 325 3HG2 VAL 39 HG23 VAL 39 240.982 -8.729 -2.164 326 H GLN 40 HN GLN 40 236.352 -10.155 -1.805 327 HA GLN 40 HA GLN 40 235.796 -12.248 -0.140 328 1HB GLN 40 HB2 GLN 40 234.181 -10.633 -1.293 329 2HB GLN 40 HB1 GLN 40 234.188 -11.765 -2.639 330 1HG GLN 40 HG2 GLN 40 233.191 -13.462 -1.356 331 2HG GLN 40 HG1 GLN 40 233.505 -12.611 0.157 332 1HE2 GLN 40 HE21 GLN 40 231.672 -11.960 1.009 333 2HE2 GLN 40 HE22 GLN 40 230.344 -11.251 0.162 334 H GLU 41 HN GLU 41 234.830 -14.406 -0.715 335 HA GLU 41 HA GLU 41 236.744 -16.055 -1.884 336 1HB GLU 41 HB2 GLU 41 234.697 -16.577 -0.316 337 2HB GLU 41 HB1 GLU 41 233.870 -16.888 -1.837 338 1HG GLU 41 HG2 GLU 41 234.979 -18.805 -2.203 339 2HG GLU 41 HG1 GLU 41 236.492 -18.180 -1.547 340 H GLY 42 HN GLY 42 237.294 -15.212 -3.917 341 1HA GLY 42 HA2 GLY 42 237.141 -15.831 -6.225 342 2HA GLY 42 HA1 GLY 42 235.399 -15.967 -6.035 343 H GLU 43 HN GLU 43 237.662 -13.351 -5.173 344 HA GLU 43 HA GLU 43 236.183 -11.591 -7.010 345 1HB GLU 43 HB2 GLU 43 236.269 -11.400 -4.205 346 2HB GLU 43 HB1 GLU 43 237.364 -10.159 -4.789 347 1HG GLU 43 HG2 GLU 43 235.714 -8.867 -5.497 348 2HG GLU 43 HG1 GLU 43 234.852 -10.215 -6.237 349 H THR 44 HN THR 44 237.533 -9.514 -7.360 350 HA THR 44 HA THR 44 240.320 -10.351 -7.790 351 HB THR 44 HB THR 44 240.337 -8.726 -9.662 352 HG1 THR 44 HG1 THR 44 237.531 -8.611 -9.352 353 1HG2 THR 44 HG21 THR 44 239.920 -10.587 -10.802 354 2HG2 THR 44 HG22 THR 44 238.237 -10.059 -10.839 355 3HG2 THR 44 HG23 THR 44 238.785 -11.172 -9.585 356 H ILE 45 HN ILE 45 241.949 -9.048 -7.125 357 HA ILE 45 HA ILE 45 241.648 -7.429 -4.945 358 HB ILE 45 HB ILE 45 243.794 -7.432 -7.053 359 1HG1 ILE 45 HG12 ILE 45 244.373 -8.249 -4.302 360 2HG1 ILE 45 HG11 ILE 45 243.186 -9.251 -5.131 361 1HG2 ILE 45 HG21 ILE 45 244.784 -6.323 -4.636 362 2HG2 ILE 45 HG22 ILE 45 243.376 -5.390 -5.127 363 3HG2 ILE 45 HG23 ILE 45 244.727 -5.591 -6.239 364 1HD1 ILE 45 HD11 ILE 45 246.073 -8.896 -5.656 365 2HD1 ILE 45 HD12 ILE 45 245.018 -9.158 -7.045 366 3HD1 ILE 45 HD13 ILE 45 245.070 -10.344 -5.741 367 H GLU 46 HN GLU 46 241.331 -6.557 -8.324 368 HA GLU 46 HA GLU 46 241.287 -3.720 -7.843 369 1HB GLU 46 HB2 GLU 46 241.904 -4.942 -10.033 370 2HB GLU 46 HB1 GLU 46 240.169 -5.079 -10.285 371 1HG GLU 46 HG2 GLU 46 239.933 -2.679 -10.254 372 2HG GLU 46 HG1 GLU 46 241.644 -2.488 -9.874 373 H ASP 47 HN ASP 47 238.967 -6.320 -7.952 374 HA ASP 47 HA ASP 47 236.697 -4.552 -8.076 375 1HB ASP 47 HB2 ASP 47 237.066 -7.510 -7.791 376 2HB ASP 47 HB1 ASP 47 235.512 -6.797 -7.374 377 H GLY 48 HN GLY 48 238.347 -6.488 -5.623 378 1HA GLY 48 HA2 GLY 48 236.577 -5.849 -3.495 379 2HA GLY 48 HA1 GLY 48 238.217 -6.465 -3.326 380 H ALA 49 HN ALA 49 239.414 -4.282 -4.829 381 HA ALA 49 HA ALA 49 239.726 -2.421 -2.676 382 1HB ALA 49 HB1 ALA 49 240.789 -1.658 -5.311 383 2HB ALA 49 HB2 ALA 49 241.355 -3.207 -4.696 384 3HB ALA 49 HB3 ALA 49 241.592 -1.745 -3.744 385 H ARG 50 HN ARG 50 238.191 -2.462 -5.837 386 HA ARG 50 HA ARG 50 237.419 0.262 -5.847 387 1HB ARG 50 HB2 ARG 50 236.696 -2.163 -7.427 388 2HB ARG 50 HB1 ARG 50 235.657 -0.750 -7.545 389 1HG ARG 50 HG2 ARG 50 237.872 0.517 -8.013 390 2HG ARG 50 HG1 ARG 50 238.495 -1.087 -8.399 391 1HD ARG 50 HD2 ARG 50 236.394 -1.291 -9.886 392 2HD ARG 50 HD1 ARG 50 236.310 0.463 -9.738 393 HE ARG 50 HE ARG 50 238.908 -0.321 -10.517 394 1HH1 ARG 50 HH11 ARG 50 235.660 -0.045 -11.764 395 2HH1 ARG 50 HH12 ARG 50 236.175 0.191 -13.401 396 1HH2 ARG 50 HH21 ARG 50 239.587 -0.009 -12.668 397 2HH2 ARG 50 HH22 ARG 50 238.403 0.211 -13.915 398 H ARG 51 HN ARG 51 235.518 -2.705 -5.317 399 HA ARG 51 HA ARG 51 233.125 -1.467 -4.604 400 1HB ARG 51 HB2 ARG 51 233.867 -4.023 -4.988 401 2HB ARG 51 HB1 ARG 51 233.796 -4.006 -3.231 402 1HG ARG 51 HG2 ARG 51 231.524 -3.608 -3.192 403 2HG ARG 51 HG1 ARG 51 231.511 -2.928 -4.820 404 1HD ARG 51 HD2 ARG 51 230.673 -4.942 -5.380 405 2HD ARG 51 HD1 ARG 51 232.364 -5.435 -5.343 406 HE ARG 51 HE ARG 51 231.531 -5.805 -2.787 407 1HH1 ARG 51 HH11 ARG 51 230.354 -6.883 -5.890 408 2HH1 ARG 51 HH12 ARG 51 229.694 -8.358 -5.267 409 1HH2 ARG 51 HH21 ARG 51 230.664 -7.744 -1.965 410 2HH2 ARG 51 HH22 ARG 51 229.869 -8.847 -3.040 411 H GLU 52 HN GLU 52 235.935 -2.259 -2.655 412 HA GLU 52 HA GLU 52 234.632 -1.488 -0.189 413 1HB GLU 52 HB2 GLU 52 237.496 -2.251 -0.782 414 2HB GLU 52 HB1 GLU 52 236.868 -1.909 0.824 415 1HG GLU 52 HG2 GLU 52 235.358 -3.923 -0.673 416 2HG GLU 52 HG1 GLU 52 237.019 -4.373 -0.294 417 H LEU 53 HN LEU 53 236.563 -0.055 -2.649 418 HA LEU 53 HA LEU 53 237.658 2.094 -1.180 419 1HB LEU 53 HB2 LEU 53 238.666 1.663 -3.244 420 2HB LEU 53 HB1 LEU 53 237.129 1.566 -4.083 421 HG LEU 53 HG LEU 53 236.853 4.008 -3.793 422 1HD1 LEU 53 HD11 LEU 53 238.687 3.760 -1.822 423 2HD1 LEU 53 HD12 LEU 53 238.255 5.282 -2.600 424 3HD1 LEU 53 HD13 LEU 53 239.683 4.393 -3.133 425 1HD2 LEU 53 HD21 LEU 53 237.649 3.605 -5.891 426 2HD2 LEU 53 HD22 LEU 53 239.087 2.770 -5.308 427 3HD2 LEU 53 HD23 LEU 53 239.006 4.532 -5.252 428 H GLN 54 HN GLN 54 234.811 1.844 -3.280 429 HA GLN 54 HA GLN 54 233.905 4.480 -2.964 430 1HB GLN 54 HB2 GLN 54 232.891 3.337 -4.713 431 2HB GLN 54 HB1 GLN 54 232.609 1.897 -3.747 432 1HG GLN 54 HG2 GLN 54 230.719 2.787 -2.740 433 2HG GLN 54 HG1 GLN 54 231.168 4.445 -3.134 434 1HE2 GLN 54 HE21 GLN 54 229.536 5.152 -4.343 435 2HE2 GLN 54 HE22 GLN 54 228.951 4.389 -5.778 436 H GLU 55 HN GLU 55 233.694 1.717 -0.903 437 HA GLU 55 HA GLU 55 231.574 2.772 0.735 438 1HB GLU 55 HB2 GLU 55 233.324 0.338 0.889 439 2HB GLU 55 HB1 GLU 55 232.261 0.781 2.217 440 1HG GLU 55 HG2 GLU 55 230.349 0.352 1.012 441 2HG GLU 55 HG1 GLU 55 231.154 0.566 -0.542 442 H GLU 56 HN GLU 56 235.038 2.984 0.722 443 HA GLU 56 HA GLU 56 235.297 3.484 3.517 444 1HB GLU 56 HB2 GLU 56 237.041 3.023 1.364 445 2HB GLU 56 HB1 GLU 56 237.476 4.596 2.018 446 1HG GLU 56 HG2 GLU 56 237.371 1.969 3.473 447 2HG GLU 56 HG1 GLU 56 238.790 2.954 3.124 448 H SER 57 HN SER 57 235.208 5.638 0.670 449 HA SER 57 HA SER 57 234.507 7.814 2.505 450 1HB SER 57 HB2 SER 57 237.019 7.783 1.979 451 2HB SER 57 HB1 SER 57 236.560 8.263 0.346 452 HG SER 57 HG SER 57 236.380 10.211 1.075 453 H GLY 58 HN GLY 58 232.987 6.261 0.539 454 1HA GLY 58 HA2 GLY 58 231.480 6.588 -1.166 455 2HA GLY 58 HA1 GLY 58 231.426 8.247 -0.589 456 H LEU 59 HN LEU 59 234.516 7.229 -1.608 457 HA LEU 59 HA LEU 59 234.249 8.833 -4.048 458 1HB LEU 59 HB2 LEU 59 236.661 7.948 -2.466 459 2HB LEU 59 HB1 LEU 59 236.757 8.796 -3.996 460 HG LEU 59 HG LEU 59 236.005 9.824 -1.303 461 1HD1 LEU 59 HD11 LEU 59 237.185 11.840 -2.553 462 2HD1 LEU 59 HD12 LEU 59 237.793 10.530 -3.566 463 3HD1 LEU 59 HD13 LEU 59 238.110 10.524 -1.831 464 1HD2 LEU 59 HD21 LEU 59 234.914 11.779 -2.303 465 2HD2 LEU 59 HD22 LEU 59 234.002 10.297 -2.596 466 3HD2 LEU 59 HD23 LEU 59 234.981 11.001 -3.884 467 H THR 60 HN THR 60 233.729 7.659 -5.744 468 HA THR 60 HA THR 60 234.703 4.920 -5.957 469 HB THR 60 HB THR 60 233.156 5.950 -8.209 470 HG1 THR 60 HG1 THR 60 231.259 6.269 -7.080 471 1HG2 THR 60 HG21 THR 60 233.583 3.510 -7.179 472 2HG2 THR 60 HG22 THR 60 232.193 3.920 -8.184 473 3HG2 THR 60 HG23 THR 60 232.036 3.899 -6.427 474 H VAL 61 HN VAL 61 235.274 4.360 -8.419 475 HA VAL 61 HA VAL 61 236.960 6.477 -9.522 476 HB VAL 61 HB VAL 61 238.911 5.082 -9.701 477 1HG1 VAL 61 HG11 VAL 61 237.744 5.215 -6.933 478 2HG1 VAL 61 HG12 VAL 61 238.843 6.356 -7.703 479 3HG1 VAL 61 HG13 VAL 61 239.413 4.748 -7.255 480 1HG2 VAL 61 HG21 VAL 61 238.549 2.878 -9.870 481 2HG2 VAL 61 HG22 VAL 61 237.036 2.964 -8.967 482 3HG2 VAL 61 HG23 VAL 61 238.573 2.881 -8.107 483 H ASP 62 HN ASP 62 237.159 6.461 -11.683 484 HA ASP 62 HA ASP 62 235.443 4.682 -13.162 485 1HB ASP 62 HB2 ASP 62 235.789 7.172 -13.633 486 2HB ASP 62 HB1 ASP 62 237.342 6.716 -14.330 487 H ALA 63 HN ALA 63 238.756 4.806 -12.274 488 HA ALA 63 HA ALA 63 239.346 2.273 -13.275 489 1HB ALA 63 HB1 ALA 63 240.962 4.084 -14.931 490 2HB ALA 63 HB2 ALA 63 239.257 3.993 -15.366 491 3HB ALA 63 HB3 ALA 63 240.235 2.526 -15.325 492 H LEU 64 HN LEU 64 240.337 2.028 -11.278 493 HA LEU 64 HA LEU 64 242.231 3.754 -10.120 494 1HB LEU 64 HB2 LEU 64 241.667 0.814 -9.866 495 2HB LEU 64 HB1 LEU 64 243.049 1.519 -9.052 496 HG LEU 64 HG LEU 64 240.513 2.926 -8.573 497 1HD1 LEU 64 HD11 LEU 64 239.519 1.301 -7.190 498 2HD1 LEU 64 HD12 LEU 64 240.924 0.239 -7.295 499 3HD1 LEU 64 HD13 LEU 64 239.889 0.476 -8.705 500 1HD2 LEU 64 HD21 LEU 64 243.001 2.879 -7.450 501 2HD2 LEU 64 HD22 LEU 64 242.083 1.853 -6.347 502 3HD2 LEU 64 HD23 LEU 64 241.548 3.501 -6.669 503 H HIS 65 HN HIS 65 244.586 2.812 -9.703 504 HA HIS 65 HA HIS 65 245.701 1.801 -12.220 505 1HB HIS 65 HB2 HIS 65 245.880 4.433 -11.653 506 2HB HIS 65 HB1 HIS 65 247.316 3.850 -10.819 507 HD1 HIS 65 HD1 HIS 65 249.071 4.728 -12.396 508 HD2 HIS 65 HD2 HIS 65 246.148 2.495 -14.328 509 HE1 HIS 65 HE1 HIS 65 249.908 4.417 -14.747 510 HE2 HIS 65 HE2 HIS 65 248.083 3.136 -15.920 511 H LYS 66 HN LYS 66 246.340 -0.174 -11.510 512 HA LYS 66 HA LYS 66 247.379 -0.725 -8.944 513 1HB LYS 66 HB2 LYS 66 248.319 -2.808 -10.127 514 2HB LYS 66 HB1 LYS 66 246.575 -2.601 -10.108 515 1HG LYS 66 HG2 LYS 66 246.503 -2.003 -12.365 516 2HG LYS 66 HG1 LYS 66 248.234 -1.661 -12.419 517 1HD LYS 66 HD2 LYS 66 247.519 -4.413 -11.662 518 2HD LYS 66 HD1 LYS 66 247.101 -3.954 -13.314 519 1HE LYS 66 HE2 LYS 66 249.597 -2.967 -13.176 520 2HE LYS 66 HE1 LYS 66 249.746 -4.311 -12.046 521 1HZ LYS 66 HZ1 LYS 66 249.083 -4.388 -14.922 522 2HZ LYS 66 HZ2 LYS 66 248.677 -5.676 -13.905 523 3HZ LYS 66 HZ3 LYS 66 250.296 -5.225 -14.091 524 H VAL 67 HN VAL 67 249.325 -0.297 -8.092 525 HA VAL 67 HA VAL 67 251.486 0.359 -10.002 526 HB VAL 67 HB VAL 67 252.439 1.829 -8.231 527 1HG1 VAL 67 HG11 VAL 67 249.694 2.830 -8.809 528 2HG1 VAL 67 HG12 VAL 67 250.770 2.463 -10.157 529 3HG1 VAL 67 HG13 VAL 67 251.248 3.653 -8.945 530 1HG2 VAL 67 HG21 VAL 67 250.722 2.618 -6.517 531 2HG2 VAL 67 HG22 VAL 67 251.498 1.062 -6.228 532 3HG2 VAL 67 HG23 VAL 67 249.858 1.124 -6.871 533 H GLY 68 HN GLY 68 250.945 -0.872 -6.686 534 1HA GLY 68 HA2 GLY 68 253.281 -2.611 -7.126 535 2HA GLY 68 HA1 GLY 68 253.193 -1.634 -5.671 536 H GLN 69 HN GLN 69 253.521 -4.257 -5.370 537 HA GLN 69 HA GLN 69 250.915 -5.130 -4.326 538 1HB GLN 69 HB2 GLN 69 251.611 -6.353 -6.447 539 2HB GLN 69 HB1 GLN 69 252.938 -7.030 -5.513 540 1HG GLN 69 HG2 GLN 69 251.435 -8.159 -4.053 541 2HG GLN 69 HG1 GLN 69 250.045 -7.326 -4.748 542 1HE2 GLN 69 HE21 GLN 69 249.828 -9.941 -4.649 543 2HE2 GLN 69 HE22 GLN 69 250.057 -10.671 -6.197 544 H ILE 70 HN ILE 70 251.075 -5.180 -2.184 545 HA ILE 70 HA ILE 70 253.680 -5.788 -0.975 546 HB ILE 70 HB ILE 70 251.246 -4.578 0.337 547 1HG1 ILE 70 HG12 ILE 70 253.656 -2.932 -0.058 548 2HG1 ILE 70 HG11 ILE 70 252.809 -3.359 -1.543 549 1HG2 ILE 70 HG21 ILE 70 252.781 -4.006 2.147 550 2HG2 ILE 70 HG22 ILE 70 254.095 -4.816 1.294 551 3HG2 ILE 70 HG23 ILE 70 252.722 -5.749 1.888 552 1HD1 ILE 70 HD11 ILE 70 251.853 -1.345 -0.935 553 2HD1 ILE 70 HD12 ILE 70 251.845 -1.751 0.781 554 3HD1 ILE 70 HD13 ILE 70 250.705 -2.532 -0.316 555 H VAL 71 HN VAL 71 253.906 -7.307 0.638 556 HA VAL 71 HA VAL 71 251.637 -9.128 1.078 557 HB VAL 71 HB VAL 71 254.499 -10.013 0.711 558 1HG1 VAL 71 HG11 VAL 71 253.161 -12.240 0.386 559 2HG1 VAL 71 HG12 VAL 71 251.934 -11.396 1.330 560 3HG1 VAL 71 HG13 VAL 71 253.545 -11.651 2.004 561 1HG2 VAL 71 HG21 VAL 71 253.396 -11.098 -1.394 562 2HG2 VAL 71 HG22 VAL 71 253.942 -9.422 -1.446 563 3HG2 VAL 71 HG23 VAL 71 252.232 -9.785 -1.218 564 H PHE 72 HN PHE 72 251.587 -10.171 3.106 565 HA PHE 72 HA PHE 72 253.481 -9.110 5.090 566 1HB PHE 72 HB2 PHE 72 250.485 -9.355 5.281 567 2HB PHE 72 HB1 PHE 72 251.505 -9.208 6.708 568 HD1 PHE 72 HD1 PHE 72 249.625 -7.444 4.346 569 HD2 PHE 72 HD2 PHE 72 253.204 -7.195 6.636 570 HE1 PHE 72 HE1 PHE 72 249.611 -4.996 4.094 571 HE2 PHE 72 HE2 PHE 72 253.197 -4.746 6.386 572 HZ PHE 72 HZ PHE 72 251.398 -3.645 5.116 573 H GLU 73 HN GLU 73 254.617 -10.671 5.991 574 HA GLU 73 HA GLU 73 253.503 -13.385 6.075 575 1HB GLU 73 HB2 GLU 73 256.358 -12.484 6.503 576 2HB GLU 73 HB1 GLU 73 255.798 -14.147 6.389 577 1HG GLU 73 HG2 GLU 73 254.891 -13.247 4.051 578 2HG GLU 73 HG1 GLU 73 256.246 -12.141 4.266 579 H PHE 74 HN PHE 74 252.597 -13.984 7.934 580 HA PHE 74 HA PHE 74 253.230 -12.561 10.382 581 1HB PHE 74 HB2 PHE 74 251.151 -14.557 9.564 582 2HB PHE 74 HB1 PHE 74 251.482 -14.310 11.276 583 HD1 PHE 74 HD1 PHE 74 250.786 -12.331 12.399 584 HD2 PHE 74 HD2 PHE 74 250.265 -12.720 8.194 585 HE1 PHE 74 HE1 PHE 74 249.307 -10.365 12.406 586 HE2 PHE 74 HE2 PHE 74 248.785 -10.754 8.191 587 HZ PHE 74 HZ PHE 74 248.306 -9.573 10.299 588 H VAL 75 HN VAL 75 254.323 -13.275 12.071 589 HA VAL 75 HA VAL 75 255.975 -15.609 11.684 590 HB VAL 75 HB VAL 75 256.121 -14.339 14.315 591 1HG1 VAL 75 HG11 VAL 75 257.729 -15.889 12.885 592 2HG1 VAL 75 HG12 VAL 75 258.345 -14.733 14.068 593 3HG1 VAL 75 HG13 VAL 75 258.337 -14.321 12.352 594 1HG2 VAL 75 HG21 VAL 75 256.270 -12.670 11.852 595 2HG2 VAL 75 HG22 VAL 75 257.394 -12.351 13.174 596 3HG2 VAL 75 HG23 VAL 75 255.655 -12.265 13.454 597 H GLY 76 HN GLY 76 255.099 -17.534 12.074 598 1HA GLY 76 HA2 GLY 76 254.545 -19.186 13.719 599 2HA GLY 76 HA1 GLY 76 253.764 -17.927 14.665 600 H GLU 77 HN GLU 77 252.585 -16.964 11.977 601 HA GLU 77 HA GLU 77 250.285 -18.783 12.075 602 1HB GLU 77 HB2 GLU 77 250.434 -16.035 10.830 603 2HB GLU 77 HB1 GLU 77 248.985 -16.980 11.143 604 1HG GLU 77 HG2 GLU 77 250.668 -16.410 13.488 605 2HG GLU 77 HG1 GLU 77 249.882 -15.017 12.744 606 HA PRO 78 HA PRO 78 251.959 -20.592 8.270 607 1HB PRO 78 HB2 PRO 78 249.126 -21.552 8.272 608 2HB PRO 78 HB1 PRO 78 250.614 -22.447 7.945 609 1HG PRO 78 HG2 PRO 78 249.379 -22.686 10.290 610 2HG PRO 78 HG1 PRO 78 251.149 -22.640 10.193 611 1HD PRO 78 HD2 PRO 78 249.248 -20.548 11.116 612 2HD PRO 78 HD1 PRO 78 250.911 -20.876 11.641 613 H GLU 79 HN GLU 79 248.897 -18.872 8.621 614 HA GLU 79 HA GLU 79 248.541 -18.438 5.817 615 1HB GLU 79 HB2 GLU 79 246.997 -18.108 8.151 616 2HB GLU 79 HB1 GLU 79 247.145 -16.508 7.437 617 1HG GLU 79 HG2 GLU 79 246.340 -17.421 5.297 618 2HG GLU 79 HG1 GLU 79 246.117 -18.985 6.078 619 H LEU 80 HN LEU 80 248.181 -16.063 5.096 620 HA LEU 80 HA LEU 80 250.158 -14.225 6.194 621 1HB LEU 80 HB2 LEU 80 250.224 -14.555 3.241 622 2HB LEU 80 HB1 LEU 80 251.496 -14.056 4.340 623 HG LEU 80 HG LEU 80 250.556 -16.894 4.362 624 1HD1 LEU 80 HD11 LEU 80 251.003 -16.906 2.133 625 2HD1 LEU 80 HD12 LEU 80 252.640 -17.136 2.749 626 3HD1 LEU 80 HD13 LEU 80 252.109 -15.535 2.233 627 1HD2 LEU 80 HD21 LEU 80 253.380 -16.023 4.645 628 2HD2 LEU 80 HD22 LEU 80 252.509 -17.324 5.457 629 3HD2 LEU 80 HD23 LEU 80 252.265 -15.653 5.961 630 H MET 81 HN MET 81 250.113 -12.344 4.146 631 HA MET 81 HA MET 81 247.317 -11.802 3.569 632 1HB MET 81 HB2 MET 81 248.533 -10.673 5.814 633 2HB MET 81 HB1 MET 81 248.566 -9.398 4.605 634 1HG MET 81 HG2 MET 81 246.023 -10.303 4.348 635 2HG MET 81 HG1 MET 81 246.311 -10.561 6.067 636 1HE MET 81 HE1 MET 81 246.260 -6.559 3.831 637 2HE MET 81 HE2 MET 81 246.202 -8.177 3.132 638 3HE MET 81 HE3 MET 81 247.731 -7.527 3.723 639 H ASP 82 HN ASP 82 247.364 -11.462 1.438 640 HA ASP 82 HA ASP 82 249.627 -9.955 0.311 641 1HB ASP 82 HB2 ASP 82 249.267 -12.215 -0.624 642 2HB ASP 82 HB1 ASP 82 247.634 -11.754 -1.093 643 H VAL 83 HN VAL 83 249.067 -7.844 0.375 644 HA VAL 83 HA VAL 83 246.415 -7.103 -0.675 645 HB VAL 83 HB VAL 83 246.778 -6.426 1.664 646 1HG1 VAL 83 HG11 VAL 83 249.354 -5.957 0.952 647 2HG1 VAL 83 HG12 VAL 83 248.594 -5.344 2.421 648 3HG1 VAL 83 HG13 VAL 83 248.705 -4.317 0.992 649 1HG2 VAL 83 HG21 VAL 83 246.089 -4.123 1.426 650 2HG2 VAL 83 HG22 VAL 83 245.348 -5.094 0.154 651 3HG2 VAL 83 HG23 VAL 83 246.735 -4.067 -0.214 652 H HIS 84 HN HIS 84 246.452 -6.332 -2.659 653 HA HIS 84 HA HIS 84 248.890 -5.351 -3.843 654 1HB HIS 84 HB2 HIS 84 246.715 -6.617 -4.875 655 2HB HIS 84 HB1 HIS 84 246.342 -4.945 -5.284 656 HD1 HIS 84 HD1 HIS 84 248.111 -3.706 -6.830 657 HD2 HIS 84 HD2 HIS 84 248.636 -7.809 -6.435 658 HE1 HIS 84 HE1 HIS 84 249.665 -4.367 -8.693 659 HE2 HIS 84 HE2 HIS 84 249.897 -6.868 -8.488 660 H VAL 85 HN VAL 85 248.861 -3.228 -5.042 661 HA VAL 85 HA VAL 85 247.446 -1.220 -3.409 662 HB VAL 85 HB VAL 85 250.161 -1.025 -4.741 663 1HG1 VAL 85 HG11 VAL 85 248.832 1.086 -4.883 664 2HG1 VAL 85 HG12 VAL 85 250.314 1.224 -3.942 665 3HG1 VAL 85 HG13 VAL 85 248.758 1.095 -3.121 666 1HG2 VAL 85 HG21 VAL 85 250.731 -2.020 -2.803 667 2HG2 VAL 85 HG22 VAL 85 249.223 -1.571 -2.007 668 3HG2 VAL 85 HG23 VAL 85 250.533 -0.398 -2.138 669 H PHE 86 HN PHE 86 246.272 0.271 -4.432 670 HA PHE 86 HA PHE 86 246.448 0.486 -7.356 671 1HB PHE 86 HB2 PHE 86 244.206 -0.471 -5.722 672 2HB PHE 86 HB1 PHE 86 243.753 0.853 -6.787 673 HD1 PHE 86 HD1 PHE 86 244.763 0.560 -9.268 674 HD2 PHE 86 HD2 PHE 86 243.918 -2.586 -6.531 675 HE1 PHE 86 HE1 PHE 86 244.562 -1.015 -11.147 676 HE2 PHE 86 HE2 PHE 86 243.719 -4.168 -8.405 677 HZ PHE 86 HZ PHE 86 244.040 -3.383 -10.717 678 H CYS 87 HN CYS 87 246.612 2.557 -7.985 679 HA CYS 87 HA CYS 87 245.642 4.637 -6.125 680 1HB CYS 87 HB2 CYS 87 248.093 4.491 -7.845 681 2HB CYS 87 HB1 CYS 87 247.370 6.061 -7.517 682 HG CYS 87 HG CYS 87 247.696 5.044 -4.874 683 H THR 88 HN THR 88 243.867 5.621 -6.920 684 HA THR 88 HA THR 88 243.312 5.413 -9.768 685 HB THR 88 HB THR 88 241.572 4.853 -8.083 686 HG1 THR 88 HG1 THR 88 240.065 6.602 -9.166 687 1HG2 THR 88 HG21 THR 88 240.751 6.253 -6.568 688 2HG2 THR 88 HG22 THR 88 240.835 7.641 -7.654 689 3HG2 THR 88 HG23 THR 88 242.275 7.113 -6.783 690 H ASP 89 HN ASP 89 241.810 7.533 -10.347 691 HA ASP 89 HA ASP 89 243.141 10.001 -9.634 692 1HB ASP 89 HB2 ASP 89 243.567 10.568 -12.055 693 2HB ASP 89 HB1 ASP 89 244.618 9.318 -11.397 694 H SER 90 HN SER 90 240.856 8.390 -11.801 695 HA SER 90 HA SER 90 239.134 10.753 -11.796 696 1HB SER 90 HB2 SER 90 239.768 9.007 -13.806 697 2HB SER 90 HB1 SER 90 238.234 8.344 -13.245 698 HG SER 90 HG SER 90 237.647 9.849 -14.695 699 H ILE 91 HN ILE 91 238.188 10.749 -9.767 700 HA ILE 91 HA ILE 91 236.785 8.305 -8.959 701 HB ILE 91 HB ILE 91 236.508 9.490 -6.735 702 1HG1 ILE 91 HG12 ILE 91 238.753 11.268 -7.655 703 2HG1 ILE 91 HG11 ILE 91 237.079 11.755 -7.900 704 1HG2 ILE 91 HG21 ILE 91 239.000 8.444 -7.924 705 2HG2 ILE 91 HG22 ILE 91 238.106 7.914 -6.499 706 3HG2 ILE 91 HG23 ILE 91 239.176 9.313 -6.399 707 1HD1 ILE 91 HD11 ILE 91 238.670 11.606 -5.430 708 2HD1 ILE 91 HD12 ILE 91 236.985 11.099 -5.304 709 3HD1 ILE 91 HD13 ILE 91 237.379 12.715 -5.891 710 H GLN 92 HN GLN 92 234.776 8.901 -7.524 711 HA GLN 92 HA GLN 92 233.053 10.575 -9.220 712 1HB GLN 92 HB2 GLN 92 232.356 8.330 -7.317 713 2HB GLN 92 HB1 GLN 92 231.175 9.296 -8.193 714 1HG GLN 92 HG2 GLN 92 233.321 7.744 -9.600 715 2HG GLN 92 HG1 GLN 92 231.775 7.023 -9.154 716 1HE2 GLN 92 HE21 GLN 92 231.843 6.760 -11.580 717 2HE2 GLN 92 HE22 GLN 92 231.124 8.024 -12.516 718 H GLY 93 HN GLY 93 234.032 12.397 -8.071 719 1HA GLY 93 HA2 GLY 93 234.268 13.263 -5.664 720 2HA GLY 93 HA1 GLY 93 233.277 14.211 -6.755 721 H THR 94 HN THR 94 233.311 11.995 -4.098 722 HA THR 94 HA THR 94 230.837 13.015 -3.085 723 HB THR 94 HB THR 94 230.985 10.122 -3.949 724 HG1 THR 94 HG1 THR 94 230.246 11.062 -5.689 725 1HG2 THR 94 HG21 THR 94 229.212 11.491 -2.049 726 2HG2 THR 94 HG22 THR 94 229.634 9.784 -2.190 727 3HG2 THR 94 HG23 THR 94 228.417 10.483 -3.259 728 HA PRO 95 HA PRO 95 233.918 11.263 -0.041 729 1HB PRO 95 HB2 PRO 95 234.884 13.571 0.967 730 2HB PRO 95 HB1 PRO 95 235.589 12.808 -0.463 731 1HG PRO 95 HG2 PRO 95 233.730 15.132 -0.274 732 2HG PRO 95 HG1 PRO 95 235.101 14.874 -1.367 733 1HD PRO 95 HD2 PRO 95 232.462 14.493 -2.053 734 2HD PRO 95 HD1 PRO 95 233.833 13.713 -2.863 735 H VAL 96 HN VAL 96 231.584 10.859 0.561 736 HA VAL 96 HA VAL 96 230.271 12.777 2.236 737 HB VAL 96 HB VAL 96 229.584 9.858 2.248 738 1HG1 VAL 96 HG11 VAL 96 228.258 12.418 2.856 739 2HG1 VAL 96 HG12 VAL 96 228.051 10.827 3.586 740 3HG1 VAL 96 HG13 VAL 96 227.264 11.204 2.054 741 1HG2 VAL 96 HG21 VAL 96 228.041 10.677 0.235 742 2HG2 VAL 96 HG22 VAL 96 229.631 9.960 -0.020 743 3HG2 VAL 96 HG23 VAL 96 229.438 11.712 -0.058 744 H GLU 97 HN GLU 97 232.405 12.915 3.478 745 HA GLU 97 HA GLU 97 233.449 11.105 5.208 746 1HB GLU 97 HB2 GLU 97 234.101 12.939 6.638 747 2HB GLU 97 HB1 GLU 97 234.200 13.457 4.962 748 1HG GLU 97 HG2 GLU 97 231.838 14.405 5.342 749 2HG GLU 97 HG1 GLU 97 232.215 14.235 7.056 750 H SER 98 HN SER 98 232.359 9.655 6.381 751 HA SER 98 HA SER 98 229.878 10.369 7.703 752 1HB SER 98 HB2 SER 98 230.402 7.805 8.497 753 2HB SER 98 HB1 SER 98 229.526 8.237 7.028 754 HG SER 98 HG SER 98 232.317 7.754 7.226 755 H ASP 99 HN ASP 99 229.818 8.985 9.983 756 HA ASP 99 HA ASP 99 231.423 10.584 11.733 757 1HB ASP 99 HB2 ASP 99 229.397 8.402 12.190 758 2HB ASP 99 HB1 ASP 99 230.289 9.139 13.517 759 H GLU 100 HN GLU 100 232.034 7.719 10.102 760 HA GLU 100 HA GLU 100 233.924 6.809 12.163 761 1HB GLU 100 HB2 GLU 100 232.126 5.409 10.414 762 2HB GLU 100 HB1 GLU 100 233.777 4.903 10.080 763 1HG GLU 100 HG2 GLU 100 234.104 4.151 12.281 764 2HG GLU 100 HG1 GLU 100 232.661 4.980 12.864 765 H MET 101 HN MET 101 233.615 7.650 8.748 766 HA MET 101 HA MET 101 236.554 7.664 8.562 767 1HB MET 101 HB2 MET 101 234.704 6.372 6.929 768 2HB MET 101 HB1 MET 101 235.179 7.790 6.005 769 1HG MET 101 HG2 MET 101 236.553 5.834 5.489 770 2HG MET 101 HG1 MET 101 237.501 7.162 6.155 771 1HE MET 101 HE1 MET 101 239.252 6.691 7.086 772 2HE MET 101 HE2 MET 101 239.763 5.188 7.854 773 3HE MET 101 HE3 MET 101 239.091 6.494 8.832 774 H ARG 102 HN ARG 102 237.506 9.330 7.195 775 HA ARG 102 HA ARG 102 235.946 11.660 6.547 776 1HB ARG 102 HB2 ARG 102 236.288 11.940 8.981 777 2HB ARG 102 HB1 ARG 102 238.026 11.833 8.739 778 1HG ARG 102 HG2 ARG 102 237.460 13.831 7.042 779 2HG ARG 102 HG1 ARG 102 236.172 14.064 8.225 780 1HD ARG 102 HD2 ARG 102 237.672 14.440 9.966 781 2HD ARG 102 HD1 ARG 102 239.009 13.678 9.104 782 HE ARG 102 HE ARG 102 238.426 15.815 7.559 783 1HH1 ARG 102 HH11 ARG 102 239.075 15.452 10.968 784 2HH1 ARG 102 HH12 ARG 102 239.769 17.031 11.132 785 1HH2 ARG 102 HH21 ARG 102 239.338 17.892 7.772 786 2HH2 ARG 102 HH22 ARG 102 239.917 18.415 9.317 787 HA PRO 103 HA PRO 103 239.489 11.139 3.714 788 1HB PRO 103 HB2 PRO 103 238.406 12.632 1.711 789 2HB PRO 103 HB1 PRO 103 238.021 10.926 1.963 790 1HG PRO 103 HG2 PRO 103 236.490 13.359 2.808 791 2HG PRO 103 HG1 PRO 103 235.889 11.861 2.070 792 1HD PRO 103 HD2 PRO 103 235.694 12.307 4.715 793 2HD PRO 103 HD1 PRO 103 236.002 10.684 4.067 794 H CYS 104 HN CYS 104 241.081 12.564 2.946 795 HA CYS 104 HA CYS 104 240.794 15.394 3.601 796 1HB CYS 104 HB2 CYS 104 243.198 13.821 4.528 797 2HB CYS 104 HB1 CYS 104 242.799 15.495 4.898 798 HG CYS 104 HG CYS 104 241.762 14.609 6.922 799 H TRP 105 HN TRP 105 241.381 16.514 1.889 800 HA TRP 105 HA TRP 105 243.063 15.292 -0.144 801 1HB TRP 105 HB2 TRP 105 241.613 17.950 -0.169 802 2HB TRP 105 HB1 TRP 105 242.382 17.173 -1.549 803 HD1 TRP 105 HD1 TRP 105 239.827 15.742 1.026 804 HE1 TRP 105 HE1 TRP 105 237.868 14.716 -0.295 805 HE3 TRP 105 HE3 TRP 105 241.350 16.914 -3.713 806 HZ2 TRP 105 HZ2 TRP 105 237.079 14.445 -2.990 807 HZ3 TRP 105 HZ3 TRP 105 239.934 16.235 -5.607 808 HH2 TRP 105 HH2 TRP 105 237.843 15.026 -5.251 809 H PHE 106 HN PHE 106 245.176 15.702 -0.341 810 HA PHE 106 HA PHE 106 246.237 18.254 0.635 811 1HB PHE 106 HB2 PHE 106 247.404 15.555 1.354 812 2HB PHE 106 HB1 PHE 106 248.112 17.116 1.752 813 HD1 PHE 106 HD1 PHE 106 246.237 14.490 3.001 814 HD2 PHE 106 HD2 PHE 106 246.399 18.741 3.017 815 HE1 PHE 106 HE1 PHE 106 244.960 14.526 5.101 816 HE2 PHE 106 HE2 PHE 106 245.121 18.786 5.120 817 HZ PHE 106 HZ PHE 106 244.401 16.676 6.165 818 H GLN 107 HN GLN 107 248.889 17.889 0.177 819 HA GLN 107 HA GLN 107 248.943 17.710 -2.723 820 1HB GLN 107 HB2 GLN 107 251.091 18.553 -0.767 821 2HB GLN 107 HB1 GLN 107 251.205 18.668 -2.517 822 1HG GLN 107 HG2 GLN 107 249.206 20.174 -2.456 823 2HG GLN 107 HG1 GLN 107 249.350 20.178 -0.700 824 1HE2 GLN 107 HE21 GLN 107 249.855 22.299 -0.447 825 2HE2 GLN 107 HE22 GLN 107 251.314 23.017 -1.029 826 H LEU 108 HN LEU 108 250.763 16.610 -3.794 827 HA LEU 108 HA LEU 108 251.013 13.916 -2.802 828 1HB LEU 108 HB2 LEU 108 251.825 13.351 -4.922 829 2HB LEU 108 HB1 LEU 108 250.662 14.625 -5.234 830 HG LEU 108 HG LEU 108 253.662 14.974 -5.158 831 1HD1 LEU 108 HD11 LEU 108 253.412 13.938 -7.161 832 2HD1 LEU 108 HD12 LEU 108 252.999 15.580 -7.659 833 3HD1 LEU 108 HD13 LEU 108 251.721 14.411 -7.323 834 1HD2 LEU 108 HD21 LEU 108 252.601 17.002 -4.457 835 2HD2 LEU 108 HD22 LEU 108 251.425 16.896 -5.765 836 3HD2 LEU 108 HD23 LEU 108 253.121 17.206 -6.130 837 H ASP 109 HN ASP 109 252.652 16.612 -2.016 838 HA ASP 109 HA ASP 109 255.158 15.129 -1.595 839 1HB ASP 109 HB2 ASP 109 254.672 17.943 -2.463 840 2HB ASP 109 HB1 ASP 109 256.058 17.626 -1.424 841 H GLN 110 HN GLN 110 252.643 15.476 0.028 842 HA GLN 110 HA GLN 110 253.993 16.138 2.509 843 1HB GLN 110 HB2 GLN 110 251.502 17.548 1.558 844 2HB GLN 110 HB1 GLN 110 252.035 17.553 3.233 845 1HG GLN 110 HG2 GLN 110 254.294 18.360 1.997 846 2HG GLN 110 HG1 GLN 110 253.072 19.020 0.910 847 1HE2 GLN 110 HE21 GLN 110 254.983 19.921 3.266 848 2HE2 GLN 110 HE22 GLN 110 253.994 21.067 4.099 849 H ILE 111 HN ILE 111 252.728 13.756 1.111 850 HA ILE 111 HA ILE 111 250.417 13.101 2.686 851 HB ILE 111 HB ILE 111 251.797 10.729 1.775 852 1HG1 ILE 111 HG12 ILE 111 251.211 11.356 -0.718 853 2HG1 ILE 111 HG11 ILE 111 251.565 12.990 -0.160 854 1HG2 ILE 111 HG21 ILE 111 249.266 11.444 2.246 855 2HG2 ILE 111 HG22 ILE 111 249.738 10.049 1.274 856 3HG2 ILE 111 HG23 ILE 111 249.302 11.567 0.487 857 1HD1 ILE 111 HD11 ILE 111 253.751 12.080 0.698 858 2HD1 ILE 111 HD12 ILE 111 253.566 12.130 -1.055 859 3HD1 ILE 111 HD13 ILE 111 253.380 10.603 -0.192 860 HA PRO 112 HA PRO 112 252.858 11.719 6.145 861 1HB PRO 112 HB2 PRO 112 250.915 11.644 7.957 862 2HB PRO 112 HB1 PRO 112 251.418 13.188 7.255 863 1HG PRO 112 HG2 PRO 112 249.011 11.530 6.656 864 2HG PRO 112 HG1 PRO 112 249.174 13.293 6.706 865 1HD PRO 112 HD2 PRO 112 249.244 11.661 4.409 866 2HD PRO 112 HD1 PRO 112 249.699 13.374 4.502 867 H PHE 113 HN PHE 113 253.505 9.665 5.566 868 HA PHE 113 HA PHE 113 251.646 7.479 5.564 869 1HB PHE 113 HB2 PHE 113 254.512 6.827 5.730 870 2HB PHE 113 HB1 PHE 113 253.278 6.210 4.651 871 HD1 PHE 113 HD1 PHE 113 256.149 6.968 4.064 872 HD2 PHE 113 HD2 PHE 113 252.484 9.097 3.620 873 HE1 PHE 113 HE1 PHE 113 257.141 8.263 2.240 874 HE2 PHE 113 HE2 PHE 113 253.490 10.409 1.800 875 HZ PHE 113 HZ PHE 113 255.811 9.999 1.103 876 H LYS 114 HN LYS 114 253.506 9.058 7.947 877 HA LYS 114 HA LYS 114 253.883 6.859 9.710 878 1HB LYS 114 HB2 LYS 114 254.854 9.409 9.603 879 2HB LYS 114 HB1 LYS 114 253.678 9.547 10.904 880 1HG LYS 114 HG2 LYS 114 255.642 7.301 10.921 881 2HG LYS 114 HG1 LYS 114 256.141 8.915 11.430 882 1HD LYS 114 HD2 LYS 114 255.392 8.281 13.450 883 2HD LYS 114 HD1 LYS 114 253.794 8.618 12.780 884 1HE LYS 114 HE2 LYS 114 253.858 6.181 11.960 885 2HE LYS 114 HE1 LYS 114 255.186 5.980 13.102 886 1HZ LYS 114 HZ1 LYS 114 252.773 5.492 13.845 887 2HZ LYS 114 HZ2 LYS 114 252.651 7.172 14.005 888 3HZ LYS 114 HZ3 LYS 114 253.810 6.319 14.897 889 H ASP 115 HN ASP 115 251.278 8.987 8.965 890 HA ASP 115 HA ASP 115 249.815 8.165 11.346 891 1HB ASP 115 HB2 ASP 115 249.402 10.342 9.319 892 2HB ASP 115 HB1 ASP 115 248.088 9.837 10.378 893 H MET 116 HN MET 116 250.421 6.393 9.043 894 HA MET 116 HA MET 116 247.653 5.600 8.467 895 1HB MET 116 HB2 MET 116 249.670 5.041 6.363 896 2HB MET 116 HB1 MET 116 247.958 5.395 6.212 897 1HG MET 116 HG2 MET 116 248.588 7.783 6.873 898 2HG MET 116 HG1 MET 116 250.241 7.298 6.524 899 1HE MET 116 HE1 MET 116 250.987 7.367 3.356 900 2HE MET 116 HE2 MET 116 250.004 5.942 3.016 901 3HE MET 116 HE3 MET 116 250.881 6.065 4.541 902 H TRP 117 HN TRP 117 250.872 4.296 7.664 903 HA TRP 117 HA TRP 117 250.544 2.098 9.495 904 1HB TRP 117 HB2 TRP 117 250.262 1.713 6.520 905 2HB TRP 117 HB1 TRP 117 250.804 0.408 7.568 906 HD1 TRP 117 HD1 TRP 117 247.835 1.212 5.912 907 HE1 TRP 117 HE1 TRP 117 245.712 0.532 7.198 908 HE3 TRP 117 HE3 TRP 117 249.863 0.594 10.566 909 HZ2 TRP 117 HZ2 TRP 117 244.992 -0.173 9.834 910 HZ3 TRP 117 HZ3 TRP 117 248.389 -0.083 12.414 911 HH2 TRP 117 HH2 TRP 117 246.004 -0.458 12.055 912 HA PRO 118 HA PRO 118 254.949 2.084 9.169 913 1HB PRO 118 HB2 PRO 118 255.594 -0.386 9.955 914 2HB PRO 118 HB1 PRO 118 254.818 0.756 11.057 915 1HG PRO 118 HG2 PRO 118 253.602 -1.500 9.510 916 2HG PRO 118 HG1 PRO 118 253.322 -1.020 11.194 917 1HD PRO 118 HD2 PRO 118 251.665 -0.350 9.116 918 2HD PRO 118 HD1 PRO 118 251.816 0.597 10.607 919 H ASP 119 HN ASP 119 253.231 0.852 6.756 920 HA ASP 119 HA ASP 119 255.589 -0.282 5.409 921 1HB ASP 119 HB2 ASP 119 253.871 -1.573 4.016 922 2HB ASP 119 HB1 ASP 119 254.141 -2.120 5.668 923 H ASP 120 HN ASP 120 253.035 2.025 5.325 924 HA ASP 120 HA ASP 120 252.656 2.508 2.643 925 1HB ASP 120 HB2 ASP 120 252.593 4.263 5.053 926 2HB ASP 120 HB1 ASP 120 252.422 4.982 3.453 927 H SER 121 HN SER 121 255.181 3.936 4.700 928 HA SER 121 HA SER 121 256.399 5.533 2.763 929 1HB SER 121 HB2 SER 121 256.804 5.344 5.336 930 2HB SER 121 HB1 SER 121 258.022 4.153 4.879 931 HG SER 121 HG SER 121 258.807 5.872 3.409 932 H TYR 122 HN TYR 122 256.391 2.100 3.012 933 HA TYR 122 HA TYR 122 258.880 1.752 1.602 934 1HB TYR 122 HB2 TYR 122 256.797 -0.133 2.664 935 2HB TYR 122 HB1 TYR 122 258.072 -0.698 1.590 936 HD1 TYR 122 HD1 TYR 122 260.387 0.856 2.523 937 HD2 TYR 122 HD2 TYR 122 257.297 -1.046 4.744 938 HE1 TYR 122 HE1 TYR 122 261.908 0.640 4.443 939 HE2 TYR 122 HE2 TYR 122 258.809 -1.266 6.670 940 HH TYR 122 HH TYR 122 262.167 -0.722 6.443 941 H TRP 123 HN TRP 123 255.412 1.510 0.839 942 HA TRP 123 HA TRP 123 256.167 0.831 -1.894 943 1HB TRP 123 HB2 TRP 123 253.812 0.229 -2.249 944 2HB TRP 123 HB1 TRP 123 254.545 -0.661 -0.923 945 HD1 TRP 123 HD1 TRP 123 253.683 -0.079 1.565 946 HE1 TRP 123 HE1 TRP 123 251.469 0.947 2.388 947 HE3 TRP 123 HE3 TRP 123 252.032 1.929 -2.835 948 HZ2 TRP 123 HZ2 TRP 123 249.306 2.429 1.311 949 HZ3 TRP 123 HZ3 TRP 123 249.881 3.124 -2.852 950 HH2 TRP 123 HH2 TRP 123 248.551 3.357 -0.826 951 H PHE 124 HN PHE 124 255.310 3.604 -0.185 952 HA PHE 124 HA PHE 124 253.821 4.858 -2.286 953 1HB PHE 124 HB2 PHE 124 254.241 5.414 0.406 954 2HB PHE 124 HB1 PHE 124 255.061 6.722 -0.433 955 HD1 PHE 124 HD1 PHE 124 253.460 8.298 0.563 956 HD2 PHE 124 HD2 PHE 124 252.162 5.196 -2.042 957 HE1 PHE 124 HE1 PHE 124 251.322 9.445 0.277 958 HE2 PHE 124 HE2 PHE 124 250.018 6.351 -2.343 959 HZ PHE 124 HZ PHE 124 249.591 8.477 -1.181 960 HA PRO 125 HA PRO 125 258.225 7.170 -2.719 961 1HB PRO 125 HB2 PRO 125 259.712 4.593 -2.444 962 2HB PRO 125 HB1 PRO 125 260.224 6.236 -2.039 963 1HG PRO 125 HG2 PRO 125 259.469 4.549 -0.130 964 2HG PRO 125 HG1 PRO 125 259.024 6.264 -0.055 965 1HD PRO 125 HD2 PRO 125 257.345 3.896 -0.729 966 2HD PRO 125 HD1 PRO 125 256.894 5.409 0.083 967 H LEU 126 HN LEU 126 257.601 3.816 -3.720 968 HA LEU 126 HA LEU 126 258.769 4.186 -6.311 969 1HB LEU 126 HB2 LEU 126 257.514 1.982 -6.785 970 2HB LEU 126 HB1 LEU 126 258.852 1.968 -5.653 971 HG LEU 126 HG LEU 126 256.449 2.460 -4.193 972 1HD1 LEU 126 HD11 LEU 126 254.910 1.030 -4.934 973 2HD1 LEU 126 HD12 LEU 126 256.104 -0.222 -5.268 974 3HD1 LEU 126 HD13 LEU 126 255.805 1.049 -6.454 975 1HD2 LEU 126 HD21 LEU 126 257.175 0.028 -3.413 976 2HD2 LEU 126 HD22 LEU 126 258.070 1.473 -2.944 977 3HD2 LEU 126 HD23 LEU 126 258.644 0.474 -4.280 978 H LEU 127 HN LEU 127 255.617 4.536 -4.892 979 HA LEU 127 HA LEU 127 254.076 4.542 -7.250 980 1HB LEU 127 HB2 LEU 127 253.614 5.996 -4.644 981 2HB LEU 127 HB1 LEU 127 252.417 5.797 -5.906 982 HG LEU 127 HG LEU 127 253.243 3.960 -3.800 983 1HD1 LEU 127 HD11 LEU 127 250.852 4.431 -5.521 984 2HD1 LEU 127 HD12 LEU 127 251.022 4.619 -3.776 985 3HD1 LEU 127 HD13 LEU 127 250.961 3.006 -4.488 986 1HD2 LEU 127 HD21 LEU 127 252.909 2.907 -6.604 987 2HD2 LEU 127 HD22 LEU 127 252.878 1.920 -5.142 988 3HD2 LEU 127 HD23 LEU 127 254.348 2.780 -5.595 989 H LEU 128 HN LEU 128 255.572 7.129 -5.366 990 HA LEU 128 HA LEU 128 254.769 9.280 -6.989 991 1HB LEU 128 HB2 LEU 128 256.834 8.833 -4.903 992 2HB LEU 128 HB1 LEU 128 257.040 10.233 -5.938 993 HG LEU 128 HG LEU 128 254.405 9.787 -4.596 994 1HD1 LEU 128 HD11 LEU 128 255.076 10.437 -2.542 995 2HD1 LEU 128 HD12 LEU 128 256.372 11.456 -3.166 996 3HD1 LEU 128 HD13 LEU 128 256.600 9.711 -3.053 997 1HD2 LEU 128 HD21 LEU 128 255.695 12.432 -4.846 998 2HD2 LEU 128 HD22 LEU 128 254.017 11.958 -5.101 999 3HD2 LEU 128 HD23 LEU 128 255.221 11.642 -6.350 1000 H GLN 129 HN GLN 129 257.373 6.985 -7.282 1001 HA GLN 129 HA GLN 129 258.766 8.514 -9.301 1002 1HB GLN 129 HB2 GLN 129 259.170 5.807 -8.064 1003 2HB GLN 129 HB1 GLN 129 260.077 6.292 -9.490 1004 1HG GLN 129 HG2 GLN 129 261.323 7.814 -8.358 1005 2HG GLN 129 HG1 GLN 129 260.049 8.153 -7.187 1006 1HE2 GLN 129 HE21 GLN 129 261.974 8.008 -5.747 1007 2HE2 GLN 129 HE22 GLN 129 262.376 6.455 -5.106 1008 H LYS 130 HN LYS 130 255.940 6.904 -9.411 1009 HA LYS 130 HA LYS 130 254.657 6.043 -11.077 1010 1HB LYS 130 HB2 LYS 130 256.797 6.970 -12.991 1011 2HB LYS 130 HB1 LYS 130 255.088 6.722 -13.326 1012 1HG LYS 130 HG2 LYS 130 254.557 8.777 -12.661 1013 2HG LYS 130 HG1 LYS 130 255.528 8.642 -11.193 1014 1HD LYS 130 HD2 LYS 130 256.943 8.972 -13.788 1015 2HD LYS 130 HD1 LYS 130 256.124 10.376 -13.101 1016 1HE LYS 130 HE2 LYS 130 257.375 9.641 -10.915 1017 2HE LYS 130 HE1 LYS 130 258.448 8.827 -12.054 1018 1HZ LYS 130 HZ1 LYS 130 258.802 11.328 -11.303 1019 2HZ LYS 130 HZ2 LYS 130 257.785 11.608 -12.624 1020 3HZ LYS 130 HZ3 LYS 130 259.241 10.777 -12.842 1021 H LYS 131 HN LYS 131 256.706 4.408 -9.801 1022 HA LYS 131 HA LYS 131 257.167 2.448 -11.954 1023 1HB LYS 131 HB2 LYS 131 258.788 2.907 -9.443 1024 2HB LYS 131 HB1 LYS 131 259.070 1.615 -10.601 1025 1HG LYS 131 HG2 LYS 131 259.113 4.497 -11.421 1026 2HG LYS 131 HG1 LYS 131 260.536 3.693 -10.756 1027 1HD LYS 131 HD2 LYS 131 260.672 2.198 -12.554 1028 2HD LYS 131 HD1 LYS 131 259.017 2.529 -13.068 1029 1HE LYS 131 HE2 LYS 131 260.542 3.587 -14.598 1030 2HE LYS 131 HE1 LYS 131 259.706 4.828 -13.666 1031 1HZ LYS 131 HZ1 LYS 131 261.800 5.592 -13.428 1032 2HZ LYS 131 HZ2 LYS 131 262.517 4.078 -13.658 1033 3HZ LYS 131 HZ3 LYS 131 261.850 4.477 -12.155 1034 H LYS 132 HN LYS 132 257.090 0.180 -11.294 1035 HA LYS 132 HA LYS 132 255.126 -0.226 -9.140 1036 1HB LYS 132 HB2 LYS 132 255.676 -1.950 -11.564 1037 2HB LYS 132 HB1 LYS 132 254.458 -2.267 -10.337 1038 1HG LYS 132 HG2 LYS 132 253.210 -0.334 -10.976 1039 2HG LYS 132 HG1 LYS 132 254.496 0.198 -12.061 1040 1HD LYS 132 HD2 LYS 132 253.323 -2.503 -12.486 1041 2HD LYS 132 HD1 LYS 132 252.367 -1.096 -12.956 1042 1HE LYS 132 HE2 LYS 132 254.766 -0.440 -14.012 1043 2HE LYS 132 HE1 LYS 132 254.835 -2.198 -14.132 1044 1HZ LYS 132 HZ1 LYS 132 252.583 -2.042 -15.212 1045 2HZ LYS 132 HZ2 LYS 132 253.876 -1.438 -16.121 1046 3HZ LYS 132 HZ3 LYS 132 252.832 -0.371 -15.324 1047 H PHE 133 HN PHE 133 255.745 -1.311 -7.398 1048 HA PHE 133 HA PHE 133 257.925 -3.264 -7.610 1049 1HB PHE 133 HB2 PHE 133 257.820 -0.862 -5.817 1050 2HB PHE 133 HB1 PHE 133 258.646 -2.316 -5.278 1051 HD1 PHE 133 HD1 PHE 133 258.503 -0.120 -8.299 1052 HD2 PHE 133 HD2 PHE 133 260.895 -2.428 -5.643 1053 HE1 PHE 133 HE1 PHE 133 260.522 0.585 -9.513 1054 HE2 PHE 133 HE2 PHE 133 262.919 -1.727 -6.852 1055 HZ PHE 133 HZ PHE 133 262.735 -0.218 -8.790 1056 H HIS 134 HN HIS 134 257.980 -4.795 -5.847 1057 HA HIS 134 HA HIS 134 255.391 -5.054 -4.462 1058 1HB HIS 134 HB2 HIS 134 257.197 -7.184 -5.617 1059 2HB HIS 134 HB1 HIS 134 255.894 -7.545 -4.490 1060 HD1 HIS 134 HD1 HIS 134 255.186 -9.006 -6.726 1061 HD2 HIS 134 HD2 HIS 134 254.668 -4.887 -6.863 1062 HE1 HIS 134 HE1 HIS 134 253.553 -8.596 -8.594 1063 HE2 HIS 134 HE2 HIS 134 253.188 -6.103 -8.600 1064 H GLY 135 HN GLY 135 255.505 -5.006 -2.285 1065 1HA GLY 135 HA2 GLY 135 258.161 -5.510 -1.089 1066 2HA GLY 135 HA1 GLY 135 257.035 -4.315 -0.471 1067 H TYR 136 HN TYR 136 258.372 -6.963 0.469 1068 HA TYR 136 HA TYR 136 255.922 -8.178 1.563 1069 1HB TYR 136 HB2 TYR 136 258.630 -9.372 0.967 1070 2HB TYR 136 HB1 TYR 136 257.456 -10.176 2.001 1071 HD1 TYR 136 HD1 TYR 136 257.196 -8.370 -1.270 1072 HD2 TYR 136 HD2 TYR 136 256.502 -11.961 0.906 1073 HE1 TYR 136 HE1 TYR 136 256.136 -9.361 -3.254 1074 HE2 TYR 136 HE2 TYR 136 255.440 -12.961 -1.073 1075 HH TYR 136 HH TYR 136 255.707 -11.670 -4.153 1076 H PHE 137 HN PHE 137 255.565 -7.432 3.551 1077 HA PHE 137 HA PHE 137 257.882 -6.907 5.294 1078 1HB PHE 137 HB2 PHE 137 255.082 -5.868 5.716 1079 2HB PHE 137 HB1 PHE 137 256.579 -5.292 6.442 1080 HD1 PHE 137 HD1 PHE 137 258.391 -4.569 4.578 1081 HD2 PHE 137 HD2 PHE 137 254.167 -4.547 4.092 1082 HE1 PHE 137 HE1 PHE 137 258.613 -2.887 2.797 1083 HE2 PHE 137 HE2 PHE 137 254.378 -2.864 2.308 1084 HZ PHE 137 HZ PHE 137 256.602 -2.033 1.659 1085 H LYS 138 HN LYS 138 258.142 -8.055 7.110 1086 HA LYS 138 HA LYS 138 256.214 -10.121 7.784 1087 1HB LYS 138 HB2 LYS 138 258.669 -10.609 7.676 1088 2HB LYS 138 HB1 LYS 138 258.899 -9.526 9.042 1089 1HG LYS 138 HG2 LYS 138 258.517 -11.207 10.424 1090 2HG LYS 138 HG1 LYS 138 256.886 -11.366 9.772 1091 1HD LYS 138 HD2 LYS 138 258.197 -12.640 7.843 1092 2HD LYS 138 HD1 LYS 138 259.346 -12.913 9.155 1093 1HE LYS 138 HE2 LYS 138 257.652 -13.960 10.496 1094 2HE LYS 138 HE1 LYS 138 256.403 -13.537 9.326 1095 1HZ LYS 138 HZ1 LYS 138 258.692 -15.208 8.520 1096 2HZ LYS 138 HZ2 LYS 138 257.149 -15.114 7.834 1097 3HZ LYS 138 HZ3 LYS 138 257.369 -15.903 9.315 1098 H PHE 139 HN PHE 139 254.825 -9.956 9.478 1099 HA PHE 139 HA PHE 139 255.057 -7.531 11.117 1100 1HB PHE 139 HB2 PHE 139 252.789 -9.118 10.063 1101 2HB PHE 139 HB1 PHE 139 252.573 -8.458 11.681 1102 HD1 PHE 139 HD1 PHE 139 254.625 -6.704 9.213 1103 HD2 PHE 139 HD2 PHE 139 250.757 -7.037 10.956 1104 HE1 PHE 139 HE1 PHE 139 254.002 -4.535 8.236 1105 HE2 PHE 139 HE2 PHE 139 250.128 -4.868 9.981 1106 HZ PHE 139 HZ PHE 139 251.752 -3.614 8.619 1107 H GLN 140 HN GLN 140 254.272 -7.677 13.355 1108 HA GLN 140 HA GLN 140 255.045 -10.224 14.621 1109 1HB GLN 140 HB2 GLN 140 256.757 -8.606 15.060 1110 2HB GLN 140 HB1 GLN 140 255.578 -7.378 15.464 1111 1HG GLN 140 HG2 GLN 140 256.867 -8.441 17.366 1112 2HG GLN 140 HG1 GLN 140 255.119 -8.325 17.539 1113 1HE2 GLN 140 HE21 GLN 140 254.462 -10.034 18.635 1114 2HE2 GLN 140 HE22 GLN 140 254.925 -11.671 18.337 1115 H GLY 141 HN GLY 141 252.389 -8.962 13.779 1116 1HA GLY 141 HA2 GLY 141 250.643 -10.018 15.507 1117 2HA GLY 141 HA1 GLY 141 251.067 -8.522 16.328 1118 H GLN 142 HN GLN 142 251.109 -6.602 14.538 1119 HA GLN 142 HA GLN 142 249.223 -6.680 12.468 1120 1HB GLN 142 HB2 GLN 142 248.135 -6.255 15.163 1121 2HB GLN 142 HB1 GLN 142 247.640 -5.044 13.988 1122 1HG GLN 142 HG2 GLN 142 247.255 -7.334 12.584 1123 2HG GLN 142 HG1 GLN 142 246.891 -7.863 14.226 1124 1HE2 GLN 142 HE21 GLN 142 245.779 -6.198 11.498 1125 2HE2 GLN 142 HE22 GLN 142 244.295 -5.610 12.159 1126 H ASP 143 HN ASP 143 250.764 -4.714 14.969 1127 HA ASP 143 HA ASP 143 251.001 -2.549 12.980 1128 1HB ASP 143 HB2 ASP 143 251.047 -0.959 14.883 1129 2HB ASP 143 HB1 ASP 143 249.529 -1.843 14.767 1130 H THR 144 HN THR 144 252.791 -4.905 14.183 1131 HA THR 144 HA THR 144 255.183 -3.205 14.450 1132 HB THR 144 HB THR 144 254.584 -5.859 15.751 1133 HG1 THR 144 HG1 THR 144 255.107 -3.256 16.739 1134 1HG2 THR 144 HG21 THR 144 257.173 -4.327 15.749 1135 2HG2 THR 144 HG22 THR 144 256.887 -5.907 15.021 1136 3HG2 THR 144 HG23 THR 144 256.801 -5.715 16.772 1137 H ILE 145 HN ILE 145 256.853 -3.568 13.107 1138 HA ILE 145 HA ILE 145 256.592 -5.860 11.296 1139 HB ILE 145 HB ILE 145 258.119 -3.315 10.758 1140 1HG1 ILE 145 HG12 ILE 145 255.448 -4.233 9.666 1141 2HG1 ILE 145 HG11 ILE 145 255.673 -2.946 10.847 1142 1HG2 ILE 145 HG21 ILE 145 258.992 -5.322 9.633 1143 2HG2 ILE 145 HG22 ILE 145 258.307 -4.170 8.488 1144 3HG2 ILE 145 HG23 ILE 145 257.399 -5.613 8.936 1145 1HD1 ILE 145 HD11 ILE 145 256.931 -1.660 9.198 1146 2HD1 ILE 145 HD12 ILE 145 255.306 -2.044 8.632 1147 3HD1 ILE 145 HD13 ILE 145 256.690 -2.947 8.016 1148 H LEU 146 HN LEU 146 258.325 -7.153 10.865 1149 HA LEU 146 HA LEU 146 260.701 -6.740 12.553 1150 1HB LEU 146 HB2 LEU 146 259.676 -9.458 11.804 1151 2HB LEU 146 HB1 LEU 146 260.778 -9.018 13.097 1152 HG LEU 146 HG LEU 146 257.906 -8.122 13.117 1153 1HD1 LEU 146 HD11 LEU 146 257.964 -10.181 14.880 1154 2HD1 LEU 146 HD12 LEU 146 258.983 -10.809 13.585 1155 3HD1 LEU 146 HD13 LEU 146 257.336 -10.284 13.236 1156 1HD2 LEU 146 HD21 LEU 146 258.854 -6.956 14.802 1157 2HD2 LEU 146 HD22 LEU 146 260.210 -8.073 14.959 1158 3HD2 LEU 146 HD23 LEU 146 258.650 -8.472 15.678 1159 H ASP 147 HN ASP 147 259.471 -7.264 9.419 1160 HA ASP 147 HA ASP 147 262.145 -7.287 8.336 1161 1HB ASP 147 HB2 ASP 147 260.851 -9.732 8.683 1162 2HB ASP 147 HB1 ASP 147 260.593 -9.346 6.985 1163 H TYR 148 HN TYR 148 262.257 -6.385 6.291 1164 HA TYR 148 HA TYR 148 259.732 -5.921 4.900 1165 1HB TYR 148 HB2 TYR 148 260.132 -3.573 4.593 1166 2HB TYR 148 HB1 TYR 148 260.171 -3.937 6.314 1167 HD1 TYR 148 HD1 TYR 148 262.195 -2.993 3.394 1168 HD2 TYR 148 HD2 TYR 148 262.205 -3.697 7.590 1169 HE1 TYR 148 HE1 TYR 148 264.405 -1.928 3.561 1170 HE2 TYR 148 HE2 TYR 148 264.415 -2.632 7.769 1171 HH TYR 148 HH TYR 148 265.713 -0.699 5.509 1172 H THR 149 HN THR 149 259.866 -6.265 2.775 1173 HA THR 149 HA THR 149 262.527 -6.137 1.523 1174 HB THR 149 HB THR 149 261.121 -8.014 0.045 1175 HG1 THR 149 HG1 THR 149 260.793 -8.588 2.802 1176 1HG2 THR 149 HG21 THR 149 263.489 -7.937 1.627 1177 2HG2 THR 149 HG22 THR 149 263.091 -8.975 0.259 1178 3HG2 THR 149 HG23 THR 149 262.648 -9.464 1.895 1179 H LEU 150 HN LEU 150 262.605 -5.401 -0.580 1180 HA LEU 150 HA LEU 150 260.090 -4.481 -1.769 1181 1HB LEU 150 HB2 LEU 150 262.576 -2.832 -1.344 1182 2HB LEU 150 HB1 LEU 150 261.302 -2.377 -2.461 1183 HG LEU 150 HG LEU 150 259.932 -2.844 -0.103 1184 1HD1 LEU 150 HD11 LEU 150 261.573 -2.883 1.456 1185 2HD1 LEU 150 HD12 LEU 150 261.370 -1.136 1.336 1186 3HD1 LEU 150 HD13 LEU 150 262.687 -1.932 0.474 1187 1HD2 LEU 150 HD21 LEU 150 260.832 -0.080 -0.521 1188 2HD2 LEU 150 HD22 LEU 150 259.202 -0.748 -0.445 1189 3HD2 LEU 150 HD23 LEU 150 260.133 -0.861 -1.940 1190 H ARG 151 HN ARG 151 259.889 -5.111 -3.802 1191 HA ARG 151 HA ARG 151 262.326 -5.627 -5.372 1192 1HB ARG 151 HB2 ARG 151 259.792 -7.275 -5.299 1193 2HB ARG 151 HB1 ARG 151 261.087 -7.499 -6.467 1194 1HG ARG 151 HG2 ARG 151 261.859 -7.548 -3.616 1195 2HG ARG 151 HG1 ARG 151 260.896 -8.904 -4.207 1196 1HD ARG 151 HD2 ARG 151 262.547 -9.153 -6.071 1197 2HD ARG 151 HD1 ARG 151 263.544 -7.936 -5.273 1198 HE ARG 151 HE ARG 151 263.084 -9.820 -3.349 1199 1HH1 ARG 151 HH11 ARG 151 264.431 -9.867 -6.568 1200 2HH1 ARG 151 HH12 ARG 151 265.490 -11.197 -6.240 1201 1HH2 ARG 151 HH21 ARG 151 264.476 -11.568 -2.916 1202 2HH2 ARG 151 HH22 ARG 151 265.516 -12.164 -4.167 1203 H GLU 152 HN GLU 152 261.997 -5.519 -7.723 1204 HA GLU 152 HA GLU 152 260.081 -3.399 -8.370 1205 1HB GLU 152 HB2 GLU 152 261.435 -2.987 -10.340 1206 2HB GLU 152 HB1 GLU 152 262.464 -3.027 -8.916 1207 1HG GLU 152 HG2 GLU 152 263.636 -4.766 -9.668 1208 2HG GLU 152 HG1 GLU 152 262.195 -5.619 -10.220 1209 H VAL 153 HN VAL 153 258.685 -3.543 -10.152 1210 HA VAL 153 HA VAL 153 258.455 -6.124 -11.501 1211 HB VAL 153 HB VAL 153 255.942 -6.053 -11.128 1212 1HG1 VAL 153 HG11 VAL 153 257.013 -7.796 -10.048 1213 2HG1 VAL 153 HG12 VAL 153 256.234 -6.952 -8.709 1214 3HG1 VAL 153 HG13 VAL 153 257.955 -6.717 -9.018 1215 1HG2 VAL 153 HG21 VAL 153 256.020 -3.681 -10.244 1216 2HG2 VAL 153 HG22 VAL 153 256.652 -4.359 -8.744 1217 3HG2 VAL 153 HG23 VAL 153 255.051 -4.825 -9.316 1218 H ASP 154 HN ASP 154 257.377 -6.047 -13.490 1219 HA ASP 154 HA ASP 154 255.952 -3.853 -14.491 1220 1HB ASP 154 HB2 ASP 154 258.419 -2.978 -14.247 1221 2HB ASP 154 HB1 ASP 154 258.677 -3.886 -15.733 1222 H THR 155 HN THR 155 255.797 -6.675 -14.536 1223 HA THR 155 HA THR 155 256.209 -7.285 -17.386 1224 HB THR 155 HB THR 155 255.626 -9.324 -15.250 1225 HG1 THR 155 HG1 THR 155 257.503 -8.162 -14.649 1226 1HG2 THR 155 HG21 THR 155 255.627 -9.769 -17.829 1227 2HG2 THR 155 HG22 THR 155 256.360 -10.916 -16.706 1228 3HG2 THR 155 HG23 THR 155 257.376 -9.789 -17.604 1229 H VAL 156 HN VAL 156 254.434 -6.960 -18.547 1230 HA VAL 156 HA VAL 156 251.811 -6.951 -17.405 1231 HB VAL 156 HB VAL 156 252.392 -5.481 -19.285 1232 1HG1 VAL 156 HG11 VAL 156 253.696 -7.578 -20.354 1233 2HG1 VAL 156 HG12 VAL 156 253.179 -6.171 -21.283 1234 3HG1 VAL 156 HG13 VAL 156 252.200 -7.638 -21.286 1235 1HG2 VAL 156 HG21 VAL 156 250.342 -7.209 -20.519 1236 2HG2 VAL 156 HG22 VAL 156 250.290 -5.493 -20.118 1237 3HG2 VAL 156 HG23 VAL 156 250.035 -6.700 -18.858 Start of MODEL 3 1 1H MET 1 HT1 MET 1 241.160 -17.953 -0.870 2 2H MET 1 HT2 MET 1 241.328 -18.012 -2.578 3 3H MET 1 HT3 MET 1 242.537 -18.697 -1.570 4 HA MET 1 HA MET 1 239.752 -19.616 -1.545 5 1HB MET 1 HB2 MET 1 240.424 -21.348 -3.128 6 2HB MET 1 HB1 MET 1 240.651 -19.755 -3.836 7 1HG MET 1 HG2 MET 1 243.057 -19.900 -3.237 8 2HG MET 1 HG1 MET 1 242.778 -21.556 -2.706 9 1HE MET 1 HE1 MET 1 245.020 -21.529 -4.638 10 2HE MET 1 HE2 MET 1 244.503 -22.677 -5.873 11 3HE MET 1 HE3 MET 1 244.162 -22.998 -4.173 12 H GLY 2 HN GLY 2 241.511 -19.195 0.657 13 1HA GLY 2 HA2 GLY 2 241.277 -21.403 2.173 14 2HA GLY 2 HA1 GLY 2 242.746 -21.745 1.271 15 H ALA 3 HN ALA 3 244.562 -20.320 1.529 16 HA ALA 3 HA ALA 3 244.527 -18.941 4.133 17 1HB ALA 3 HB1 ALA 3 245.992 -20.983 3.882 18 2HB ALA 3 HB2 ALA 3 246.801 -19.518 4.437 19 3HB ALA 3 HB3 ALA 3 246.970 -20.037 2.760 20 H SER 4 HN SER 4 246.900 -17.570 3.955 21 HA SER 4 HA SER 4 247.719 -15.549 3.306 22 1HB SER 4 HB2 SER 4 248.261 -15.287 1.019 23 2HB SER 4 HB1 SER 4 248.274 -17.027 1.299 24 HG SER 4 HG SER 4 246.350 -17.214 0.255 25 H ARG 5 HN ARG 5 246.257 -14.291 4.372 26 HA ARG 5 HA ARG 5 243.717 -13.588 3.401 27 1HB ARG 5 HB2 ARG 5 245.205 -13.074 5.695 28 2HB ARG 5 HB1 ARG 5 244.988 -11.488 4.969 29 1HG ARG 5 HG2 ARG 5 243.094 -11.535 6.187 30 2HG ARG 5 HG1 ARG 5 242.482 -12.387 4.768 31 1HD ARG 5 HD2 ARG 5 243.799 -14.014 6.866 32 2HD ARG 5 HD1 ARG 5 242.218 -13.335 7.249 33 HE ARG 5 HE ARG 5 242.788 -15.466 5.413 34 1HH1 ARG 5 HH11 ARG 5 240.539 -12.920 6.213 35 2HH1 ARG 5 HH12 ARG 5 239.199 -13.685 5.427 36 1HH2 ARG 5 HH21 ARG 5 241.027 -16.473 4.378 37 2HH2 ARG 5 HH22 ARG 5 239.477 -15.702 4.385 38 H LEU 6 HN LEU 6 243.731 -12.963 1.296 39 HA LEU 6 HA LEU 6 245.536 -10.881 0.394 40 1HB LEU 6 HB2 LEU 6 244.560 -12.961 -0.926 41 2HB LEU 6 HB1 LEU 6 243.256 -11.841 -1.272 42 HG LEU 6 HG LEU 6 246.044 -10.929 -1.790 43 1HD1 LEU 6 HD11 LEU 6 245.670 -11.941 -4.149 44 2HD1 LEU 6 HD12 LEU 6 244.616 -13.073 -3.302 45 3HD1 LEU 6 HD13 LEU 6 246.319 -12.955 -2.861 46 1HD2 LEU 6 HD21 LEU 6 243.728 -9.691 -2.118 47 2HD2 LEU 6 HD22 LEU 6 243.744 -10.576 -3.642 48 3HD2 LEU 6 HD23 LEU 6 245.061 -9.470 -3.250 49 H TYR 7 HN TYR 7 245.126 -8.833 0.679 50 HA TYR 7 HA TYR 7 242.334 -7.903 0.710 51 1HB TYR 7 HB2 TYR 7 244.625 -7.279 2.518 52 2HB TYR 7 HB1 TYR 7 243.470 -5.997 2.169 53 HD1 TYR 7 HD1 TYR 7 243.192 -9.659 2.903 54 HD2 TYR 7 HD2 TYR 7 241.960 -5.705 3.878 55 HE1 TYR 7 HE1 TYR 7 241.684 -10.559 4.624 56 HE2 TYR 7 HE2 TYR 7 240.449 -6.596 5.602 57 HH TYR 7 HH TYR 7 240.647 -9.498 6.903 58 H THR 8 HN THR 8 242.468 -5.316 0.519 59 HA THR 8 HA THR 8 244.267 -4.679 -1.726 60 HB THR 8 HB THR 8 242.400 -3.428 -2.754 61 HG1 THR 8 HG1 THR 8 240.730 -4.820 -0.949 62 1HG2 THR 8 HG21 THR 8 240.952 -5.528 -3.266 63 2HG2 THR 8 HG22 THR 8 242.236 -6.374 -2.403 64 3HG2 THR 8 HG23 THR 8 242.615 -5.424 -3.839 65 H LEU 9 HN LEU 9 244.846 -2.523 -1.961 66 HA LEU 9 HA LEU 9 244.067 -0.673 0.182 67 1HB LEU 9 HB2 LEU 9 246.330 -1.884 0.546 68 2HB LEU 9 HB1 LEU 9 246.912 -0.872 -0.761 69 HG LEU 9 HG LEU 9 245.908 0.008 1.932 70 1HD1 LEU 9 HD11 LEU 9 248.143 -0.579 2.136 71 2HD1 LEU 9 HD12 LEU 9 248.202 1.158 1.836 72 3HD1 LEU 9 HD13 LEU 9 248.546 0.026 0.529 73 1HD2 LEU 9 HD21 LEU 9 246.354 1.597 -0.563 74 2HD2 LEU 9 HD22 LEU 9 246.535 2.320 1.034 75 3HD2 LEU 9 HD23 LEU 9 244.984 1.634 0.548 76 H VAL 10 HN VAL 10 243.069 0.914 -0.956 77 HA VAL 10 HA VAL 10 244.275 1.727 -3.496 78 HB VAL 10 HB VAL 10 242.095 1.077 -3.949 79 1HG1 VAL 10 HG11 VAL 10 241.524 2.078 -1.276 80 2HG1 VAL 10 HG12 VAL 10 240.897 0.668 -2.130 81 3HG1 VAL 10 HG13 VAL 10 240.233 2.265 -2.459 82 1HG2 VAL 10 HG21 VAL 10 242.723 3.410 -4.733 83 2HG2 VAL 10 HG22 VAL 10 241.663 4.001 -3.454 84 3HG2 VAL 10 HG23 VAL 10 241.010 3.000 -4.749 85 H LEU 11 HN LEU 11 245.150 3.593 -3.738 86 HA LEU 11 HA LEU 11 244.512 5.769 -1.871 87 1HB LEU 11 HB2 LEU 11 247.004 4.428 -2.288 88 2HB LEU 11 HB1 LEU 11 247.157 6.080 -2.853 89 HG LEU 11 HG LEU 11 246.608 5.084 -0.076 90 1HD1 LEU 11 HD11 LEU 11 248.325 7.375 -0.282 91 2HD1 LEU 11 HD12 LEU 11 248.860 6.121 -1.400 92 3HD1 LEU 11 HD13 LEU 11 248.689 5.757 0.317 93 1HD2 LEU 11 HD21 LEU 11 244.972 6.654 0.006 94 2HD2 LEU 11 HD22 LEU 11 245.684 7.627 -1.281 95 3HD2 LEU 11 HD23 LEU 11 246.362 7.684 0.346 96 H VAL 12 HN VAL 12 243.496 7.292 -3.050 97 HA VAL 12 HA VAL 12 244.038 7.477 -5.897 98 HB VAL 12 HB VAL 12 242.114 9.215 -4.366 99 1HG1 VAL 12 HG11 VAL 12 242.677 8.610 -7.202 100 2HG1 VAL 12 HG12 VAL 12 242.101 10.097 -6.449 101 3HG1 VAL 12 HG13 VAL 12 240.979 8.770 -6.750 102 1HG2 VAL 12 HG21 VAL 12 241.048 7.331 -3.780 103 2HG2 VAL 12 HG22 VAL 12 241.969 6.344 -4.913 104 3HG2 VAL 12 HG23 VAL 12 240.567 7.254 -5.474 105 H LEU 13 HN LEU 13 246.123 8.328 -5.912 106 HA LEU 13 HA LEU 13 246.549 10.978 -4.744 107 1HB LEU 13 HB2 LEU 13 248.194 8.885 -4.821 108 2HB LEU 13 HB1 LEU 13 248.656 9.642 -6.338 109 HG LEU 13 HG LEU 13 248.462 11.599 -4.237 110 1HD1 LEU 13 HD11 LEU 13 250.166 10.904 -2.772 111 2HD1 LEU 13 HD12 LEU 13 250.556 9.505 -3.775 112 3HD1 LEU 13 HD13 LEU 13 249.032 9.558 -2.887 113 1HD2 LEU 13 HD21 LEU 13 251.038 11.594 -5.001 114 2HD2 LEU 13 HD22 LEU 13 249.739 12.394 -5.887 115 3HD2 LEU 13 HD23 LEU 13 250.287 10.791 -6.380 116 H GLN 14 HN GLN 14 247.488 12.673 -6.043 117 HA GLN 14 HA GLN 14 246.934 12.498 -8.919 118 1HB GLN 14 HB2 GLN 14 245.434 14.019 -7.033 119 2HB GLN 14 HB1 GLN 14 246.341 15.148 -8.028 120 1HG GLN 14 HG2 GLN 14 245.046 14.795 -9.801 121 2HG GLN 14 HG1 GLN 14 245.073 13.045 -9.583 122 1HE2 GLN 14 HE21 GLN 14 242.985 15.329 -10.002 123 2HE2 GLN 14 HE22 GLN 14 241.715 14.873 -8.924 124 HA PRO 15 HA PRO 15 250.860 14.428 -9.415 125 1HB PRO 15 HB2 PRO 15 250.462 16.082 -11.541 126 2HB PRO 15 HB1 PRO 15 250.605 14.327 -11.686 127 1HG PRO 15 HG2 PRO 15 248.144 16.028 -11.619 128 2HG PRO 15 HG1 PRO 15 248.521 14.646 -12.664 129 1HD PRO 15 HD2 PRO 15 246.917 14.420 -10.506 130 2HD PRO 15 HD1 PRO 15 247.987 13.102 -11.030 131 H GLN 16 HN GLN 16 248.769 15.828 -7.691 132 HA GLN 16 HA GLN 16 250.305 18.189 -7.209 133 1HB GLN 16 HB2 GLN 16 247.589 18.361 -8.464 134 2HB GLN 16 HB1 GLN 16 248.093 19.600 -7.324 135 1HG GLN 16 HG2 GLN 16 250.161 19.873 -8.768 136 2HG GLN 16 HG1 GLN 16 249.319 18.894 -9.968 137 1HE2 GLN 16 HE21 GLN 16 249.241 20.571 -11.449 138 2HE2 GLN 16 HE22 GLN 16 248.193 21.930 -11.254 139 H ARG 17 HN ARG 17 247.341 16.383 -6.578 140 HA ARG 17 HA ARG 17 247.764 16.827 -3.709 141 1HB ARG 17 HB2 ARG 17 245.212 16.851 -3.507 142 2HB ARG 17 HB1 ARG 17 245.978 18.303 -4.137 143 1HG ARG 17 HG2 ARG 17 244.697 18.197 -5.934 144 2HG ARG 17 HG1 ARG 17 245.395 16.628 -6.340 145 1HD ARG 17 HD2 ARG 17 243.689 15.455 -5.283 146 2HD ARG 17 HD1 ARG 17 243.213 16.841 -4.304 147 HE ARG 17 HE ARG 17 242.210 16.157 -6.858 148 1HH1 ARG 17 HH11 ARG 17 243.119 18.918 -4.927 149 2HH1 ARG 17 HH12 ARG 17 242.035 19.998 -5.736 150 1HH2 ARG 17 HH21 ARG 17 240.782 17.576 -7.923 151 2HH2 ARG 17 HH22 ARG 17 240.707 19.237 -7.437 152 H VAL 18 HN VAL 18 246.673 15.177 -2.354 153 HA VAL 18 HA VAL 18 246.312 12.634 -3.803 154 HB VAL 18 HB VAL 18 248.373 12.277 -2.844 155 1HG1 VAL 18 HG11 VAL 18 247.573 13.454 -0.200 156 2HG1 VAL 18 HG12 VAL 18 248.266 14.431 -1.494 157 3HG1 VAL 18 HG13 VAL 18 249.193 13.103 -0.803 158 1HG2 VAL 18 HG21 VAL 18 246.512 11.354 -0.663 159 2HG2 VAL 18 HG22 VAL 18 248.095 10.684 -1.057 160 3HG2 VAL 18 HG23 VAL 18 246.761 10.524 -2.199 161 H LEU 19 HN LEU 19 244.924 11.089 -2.745 162 HA LEU 19 HA LEU 19 243.005 12.353 -0.900 163 1HB LEU 19 HB2 LEU 19 242.215 11.651 -3.214 164 2HB LEU 19 HB1 LEU 19 242.462 9.997 -2.692 165 HG LEU 19 HG LEU 19 240.779 10.224 -0.975 166 1HD1 LEU 19 HD11 LEU 19 240.947 13.104 -1.705 167 2HD1 LEU 19 HD12 LEU 19 240.842 12.344 -0.117 168 3HD1 LEU 19 HD13 LEU 19 239.408 12.456 -1.137 169 1HD2 LEU 19 HD21 LEU 19 239.403 11.497 -3.272 170 2HD2 LEU 19 HD22 LEU 19 238.981 10.050 -2.356 171 3HD2 LEU 19 HD23 LEU 19 240.260 9.984 -3.569 172 H LEU 20 HN LEU 20 243.472 11.714 1.111 173 HA LEU 20 HA LEU 20 244.170 8.888 1.542 174 1HB LEU 20 HB2 LEU 20 245.093 11.407 2.752 175 2HB LEU 20 HB1 LEU 20 244.781 10.115 3.898 176 HG LEU 20 HG LEU 20 246.600 9.851 1.509 177 1HD1 LEU 20 HD11 LEU 20 248.450 10.017 3.073 178 2HD1 LEU 20 HD12 LEU 20 247.323 10.283 4.402 179 3HD1 LEU 20 HD13 LEU 20 247.472 11.486 3.121 180 1HD2 LEU 20 HD21 LEU 20 245.530 7.773 2.381 181 2HD2 LEU 20 HD22 LEU 20 246.320 8.083 3.926 182 3HD2 LEU 20 HD23 LEU 20 247.290 7.786 2.484 183 H GLY 21 HN GLY 21 242.948 7.632 2.832 184 1HA GLY 21 HA2 GLY 21 240.371 8.670 3.647 185 2HA GLY 21 HA1 GLY 21 240.899 6.994 3.730 186 H MET 22 HN MET 22 239.918 9.457 5.585 187 HA MET 22 HA MET 22 241.667 8.705 7.826 188 1HB MET 22 HB2 MET 22 241.939 11.026 7.476 189 2HB MET 22 HB1 MET 22 240.221 11.272 7.213 190 1HG MET 22 HG2 MET 22 239.723 11.148 9.477 191 2HG MET 22 HG1 MET 22 241.236 10.333 9.863 192 1HE MET 22 HE1 MET 22 243.430 11.811 8.529 193 2HE MET 22 HE2 MET 22 243.577 11.642 10.277 194 3HE MET 22 HE3 MET 22 243.845 13.210 9.519 195 H LYS 23 HN LYS 23 240.745 8.063 9.768 196 HA LYS 23 HA LYS 23 237.960 7.244 9.590 197 1HB LYS 23 HB2 LYS 23 240.298 6.501 11.270 198 2HB LYS 23 HB1 LYS 23 238.700 6.304 11.977 199 1HG LYS 23 HG2 LYS 23 238.818 5.237 9.291 200 2HG LYS 23 HG1 LYS 23 240.035 4.510 10.342 201 1HD LYS 23 HD2 LYS 23 237.086 4.707 10.951 202 2HD LYS 23 HD1 LYS 23 237.919 3.260 10.379 203 1HE LYS 23 HE2 LYS 23 239.419 3.520 12.420 204 2HE LYS 23 HE1 LYS 23 238.230 4.680 13.008 205 1HZ LYS 23 HZ1 LYS 23 238.084 1.802 12.878 206 2HZ LYS 23 HZ2 LYS 23 236.689 2.583 12.325 207 3HZ LYS 23 HZ3 LYS 23 237.263 2.883 13.888 208 H LYS 24 HN LYS 24 236.370 7.879 11.086 209 HA LYS 24 HA LYS 24 236.884 10.494 12.229 210 1HB LYS 24 HB2 LYS 24 234.486 8.962 11.439 211 2HB LYS 24 HB1 LYS 24 234.286 9.994 12.846 212 1HG LYS 24 HG2 LYS 24 234.033 11.749 11.533 213 2HG LYS 24 HG1 LYS 24 235.646 11.493 10.865 214 1HD LYS 24 HD2 LYS 24 234.824 10.177 9.102 215 2HD LYS 24 HD1 LYS 24 233.264 9.944 9.893 216 1HE LYS 24 HE2 LYS 24 233.369 11.588 7.935 217 2HE LYS 24 HE1 LYS 24 232.562 12.120 9.410 218 1HZ LYS 24 HZ1 LYS 24 234.240 13.569 9.915 219 2HZ LYS 24 HZ2 LYS 24 234.289 13.642 8.225 220 3HZ LYS 24 HZ3 LYS 24 235.418 12.702 9.064 221 H ARG 25 HN ARG 25 236.236 7.219 13.273 222 HA ARG 25 HA ARG 25 237.227 7.818 15.872 223 1HB ARG 25 HB2 ARG 25 235.150 6.978 17.066 224 2HB ARG 25 HB1 ARG 25 235.066 8.601 16.395 225 1HG ARG 25 HG2 ARG 25 234.073 6.267 14.818 226 2HG ARG 25 HG1 ARG 25 233.073 6.994 16.078 227 1HD ARG 25 HD2 ARG 25 233.745 9.219 14.854 228 2HD ARG 25 HD1 ARG 25 234.005 8.130 13.493 229 HE ARG 25 HE ARG 25 231.578 7.392 14.171 230 1HH1 ARG 25 HH11 ARG 25 232.870 10.639 14.031 231 2HH1 ARG 25 HH12 ARG 25 231.341 11.359 13.662 232 1HH2 ARG 25 HH21 ARG 25 229.574 8.347 13.685 233 2HH2 ARG 25 HH22 ARG 25 229.472 10.062 13.466 234 H GLY 26 HN GLY 26 237.357 5.896 17.266 235 1HA GLY 26 HA2 GLY 26 237.212 3.525 17.551 236 2HA GLY 26 HA1 GLY 26 237.056 3.361 15.808 237 H PHE 27 HN PHE 27 238.754 2.274 15.073 238 HA PHE 27 HA PHE 27 241.386 2.757 16.270 239 1HB PHE 27 HB2 PHE 27 240.260 0.515 14.605 240 2HB PHE 27 HB1 PHE 27 241.995 0.704 14.839 241 HD1 PHE 27 HD1 PHE 27 242.871 0.738 17.230 242 HD2 PHE 27 HD2 PHE 27 238.956 -0.571 16.195 243 HE1 PHE 27 HE1 PHE 27 242.717 -0.473 19.365 244 HE2 PHE 27 HE2 PHE 27 238.793 -1.784 18.329 245 HZ PHE 27 HZ PHE 27 240.674 -1.736 19.918 246 H GLY 28 HN GLY 28 241.550 4.844 15.178 247 1HA GLY 28 HA2 GLY 28 243.293 5.137 13.228 248 2HA GLY 28 HA1 GLY 28 241.882 4.712 12.272 249 H ALA 29 HN ALA 29 240.368 6.256 14.578 250 HA ALA 29 HA ALA 29 239.630 8.496 13.252 251 1HB ALA 29 HB1 ALA 29 239.967 8.995 16.106 252 2HB ALA 29 HB2 ALA 29 239.110 7.508 15.702 253 3HB ALA 29 HB3 ALA 29 238.527 9.056 15.092 254 H GLY 30 HN GLY 30 240.340 10.593 12.974 255 1HA GLY 30 HA2 GLY 30 241.791 12.373 12.920 256 2HA GLY 30 HA1 GLY 30 242.476 11.762 14.418 257 H ARG 31 HN ARG 31 242.507 9.493 11.879 258 HA ARG 31 HA ARG 31 245.287 10.198 11.206 259 1HB ARG 31 HB2 ARG 31 244.305 7.359 11.440 260 2HB ARG 31 HB1 ARG 31 245.965 7.927 11.323 261 1HG ARG 31 HG2 ARG 31 245.570 9.063 13.562 262 2HG ARG 31 HG1 ARG 31 244.101 8.090 13.667 263 1HD ARG 31 HD2 ARG 31 245.903 6.193 12.998 264 2HD ARG 31 HD1 ARG 31 246.927 7.296 13.916 265 HE ARG 31 HE ARG 31 244.573 6.844 15.366 266 1HH1 ARG 31 HH11 ARG 31 247.431 5.129 14.333 267 2HH1 ARG 31 HH12 ARG 31 247.416 4.040 15.680 268 1HH2 ARG 31 HH21 ARG 31 244.551 5.414 17.137 269 2HH2 ARG 31 HH22 ARG 31 245.781 4.202 17.272 270 H TRP 32 HN TRP 32 245.994 9.570 9.105 271 HA TRP 32 HA TRP 32 243.772 9.149 7.218 272 1HB TRP 32 HB2 TRP 32 246.238 10.125 6.005 273 2HB TRP 32 HB1 TRP 32 244.597 10.732 5.854 274 HD1 TRP 32 HD1 TRP 32 247.282 10.853 8.683 275 HE1 TRP 32 HE1 TRP 32 247.319 13.245 9.616 276 HE3 TRP 32 HE3 TRP 32 243.681 12.949 5.717 277 HZ2 TRP 32 HZ2 TRP 32 246.021 15.702 9.153 278 HZ3 TRP 32 HZ3 TRP 32 243.145 15.331 6.026 279 HH2 TRP 32 HH2 TRP 32 244.291 16.677 7.707 280 H ASN 33 HN ASN 33 244.136 7.787 5.379 281 HA ASN 33 HA ASN 33 246.466 6.338 4.876 282 1HB ASN 33 HB2 ASN 33 245.900 4.133 5.819 283 2HB ASN 33 HB1 ASN 33 246.122 5.336 7.084 284 1HD2 ASN 33 HD21 ASN 33 244.816 4.739 8.669 285 2HD2 ASN 33 HD22 ASN 33 243.130 4.397 8.508 286 H GLY 34 HN GLY 34 246.096 4.475 3.407 287 1HA GLY 34 HA2 GLY 34 244.260 5.112 1.387 288 2HA GLY 34 HA1 GLY 34 245.120 3.588 1.530 289 H PHE 35 HN PHE 35 242.727 3.305 0.499 290 HA PHE 35 HA PHE 35 240.891 2.668 2.698 291 1HB PHE 35 HB2 PHE 35 240.093 2.431 -0.174 292 2HB PHE 35 HB1 PHE 35 239.118 2.843 1.223 293 HD1 PHE 35 HD1 PHE 35 241.127 4.100 -1.483 294 HD2 PHE 35 HD2 PHE 35 239.300 5.118 2.222 295 HE1 PHE 35 HE1 PHE 35 241.341 6.487 -2.037 296 HE2 PHE 35 HE2 PHE 35 239.509 7.508 1.673 297 HZ PHE 35 HZ PHE 35 240.531 8.195 -0.459 298 H GLY 36 HN GLY 36 241.540 0.746 3.476 299 1HA GLY 36 HA2 GLY 36 242.665 -1.354 2.050 300 2HA GLY 36 HA1 GLY 36 241.843 -1.518 3.590 301 H GLY 37 HN GLY 37 241.471 -3.653 2.377 302 1HA GLY 37 HA2 GLY 37 238.762 -3.946 1.840 303 2HA GLY 37 HA1 GLY 37 239.560 -3.767 0.284 304 H LYS 38 HN LYS 38 238.189 -6.104 0.985 305 HA LYS 38 HA LYS 38 240.432 -7.999 1.086 306 1HB LYS 38 HB2 LYS 38 239.190 -9.507 2.504 307 2HB LYS 38 HB1 LYS 38 239.304 -7.937 3.288 308 1HG LYS 38 HG2 LYS 38 236.991 -7.479 2.305 309 2HG LYS 38 HG1 LYS 38 236.923 -9.215 1.992 310 1HD LYS 38 HD2 LYS 38 237.763 -8.435 4.709 311 2HD LYS 38 HD1 LYS 38 236.091 -8.059 4.287 312 1HE LYS 38 HE2 LYS 38 235.596 -10.324 3.832 313 2HE LYS 38 HE1 LYS 38 237.301 -10.773 3.833 314 1HZ LYS 38 HZ1 LYS 38 236.685 -11.471 5.896 315 2HZ LYS 38 HZ2 LYS 38 235.509 -10.272 6.094 316 3HZ LYS 38 HZ3 LYS 38 237.146 -9.889 6.279 317 H VAL 39 HN VAL 39 240.293 -9.763 -0.233 318 HA VAL 39 HA VAL 39 238.345 -9.621 -2.372 319 HB VAL 39 HB VAL 39 240.266 -11.903 -2.138 320 1HG1 VAL 39 HG11 VAL 39 240.459 -11.434 -4.593 321 2HG1 VAL 39 HG12 VAL 39 239.209 -10.206 -4.390 322 3HG1 VAL 39 HG13 VAL 39 238.847 -11.899 -4.051 323 1HG2 VAL 39 HG21 VAL 39 241.020 -9.057 -2.295 324 2HG2 VAL 39 HG22 VAL 39 241.808 -10.136 -3.447 325 3HG2 VAL 39 HG23 VAL 39 241.935 -10.448 -1.716 326 H GLN 40 HN GLN 40 236.359 -10.273 -1.684 327 HA GLN 40 HA GLN 40 235.713 -12.196 0.171 328 1HB GLN 40 HB2 GLN 40 234.166 -10.571 -1.024 329 2HB GLN 40 HB1 GLN 40 234.107 -11.735 -2.339 330 1HG GLN 40 HG2 GLN 40 232.793 -13.172 -1.196 331 2HG GLN 40 HG1 GLN 40 233.517 -12.771 0.360 332 1HE2 GLN 40 HE21 GLN 40 232.499 -11.381 1.665 333 2HE2 GLN 40 HE22 GLN 40 231.068 -10.505 1.256 334 H GLU 41 HN GLU 41 234.616 -14.328 -0.243 335 HA GLU 41 HA GLU 41 236.380 -16.188 -1.270 336 1HB GLU 41 HB2 GLU 41 234.421 -16.608 0.272 337 2HB GLU 41 HB1 GLU 41 233.388 -16.577 -1.150 338 1HG GLU 41 HG2 GLU 41 234.001 -18.629 -1.800 339 2HG GLU 41 HG1 GLU 41 235.688 -18.379 -1.355 340 H GLY 42 HN GLY 42 237.130 -15.747 -3.315 341 1HA GLY 42 HA2 GLY 42 237.074 -16.302 -5.591 342 2HA GLY 42 HA1 GLY 42 235.330 -16.488 -5.481 343 H GLU 43 HN GLU 43 237.551 -13.792 -4.764 344 HA GLU 43 HA GLU 43 236.039 -12.157 -6.681 345 1HB GLU 43 HB2 GLU 43 235.983 -11.793 -3.954 346 2HB GLU 43 HB1 GLU 43 237.269 -10.701 -4.444 347 1HG GLU 43 HG2 GLU 43 235.863 -9.273 -5.432 348 2HG GLU 43 HG1 GLU 43 234.841 -10.557 -6.076 349 H THR 44 HN THR 44 237.369 -10.093 -7.159 350 HA THR 44 HA THR 44 240.137 -10.958 -7.642 351 HB THR 44 HB THR 44 240.111 -9.380 -9.533 352 HG1 THR 44 HG1 THR 44 238.423 -8.151 -9.953 353 1HG2 THR 44 HG21 THR 44 239.001 -11.837 -9.498 354 2HG2 THR 44 HG22 THR 44 239.171 -10.847 -10.947 355 3HG2 THR 44 HG23 THR 44 237.642 -10.870 -10.068 356 H ILE 45 HN ILE 45 241.823 -9.649 -7.081 357 HA ILE 45 HA ILE 45 241.599 -8.013 -4.885 358 HB ILE 45 HB ILE 45 243.741 -7.616 -6.958 359 1HG1 ILE 45 HG12 ILE 45 244.737 -9.425 -5.141 360 2HG1 ILE 45 HG11 ILE 45 243.084 -9.985 -5.380 361 1HG2 ILE 45 HG21 ILE 45 243.562 -7.219 -3.995 362 2HG2 ILE 45 HG22 ILE 45 243.931 -6.028 -5.241 363 3HG2 ILE 45 HG23 ILE 45 245.102 -7.286 -4.850 364 1HD1 ILE 45 HD11 ILE 45 243.677 -9.729 -7.905 365 2HD1 ILE 45 HD12 ILE 45 244.206 -11.148 -7.001 366 3HD1 ILE 45 HD13 ILE 45 245.336 -9.832 -7.318 367 H GLU 46 HN GLU 46 241.224 -7.174 -8.262 368 HA GLU 46 HA GLU 46 241.252 -4.329 -7.819 369 1HB GLU 46 HB2 GLU 46 241.586 -5.848 -10.034 370 2HB GLU 46 HB1 GLU 46 239.890 -5.419 -10.215 371 1HG GLU 46 HG2 GLU 46 240.457 -3.059 -10.091 372 2HG GLU 46 HG1 GLU 46 242.156 -3.469 -9.861 373 H ASP 47 HN ASP 47 238.939 -6.897 -7.681 374 HA ASP 47 HA ASP 47 236.647 -5.137 -7.774 375 1HB ASP 47 HB2 ASP 47 237.045 -8.090 -7.460 376 2HB ASP 47 HB1 ASP 47 235.511 -7.373 -6.979 377 H GLY 48 HN GLY 48 238.537 -6.924 -5.397 378 1HA GLY 48 HA2 GLY 48 236.855 -6.356 -3.172 379 2HA GLY 48 HA1 GLY 48 238.543 -6.846 -3.092 380 H ALA 49 HN ALA 49 239.555 -4.681 -4.665 381 HA ALA 49 HA ALA 49 239.773 -2.688 -2.612 382 1HB ALA 49 HB1 ALA 49 241.596 -1.948 -3.742 383 2HB ALA 49 HB2 ALA 49 240.834 -2.142 -5.320 384 3HB ALA 49 HB3 ALA 49 241.490 -3.547 -4.480 385 H ARG 50 HN ARG 50 238.261 -2.969 -5.783 386 HA ARG 50 HA ARG 50 237.421 -0.283 -5.976 387 1HB ARG 50 HB2 ARG 50 236.757 -2.830 -7.352 388 2HB ARG 50 HB1 ARG 50 235.598 -1.517 -7.499 389 1HG ARG 50 HG2 ARG 50 237.678 -0.107 -8.160 390 2HG ARG 50 HG1 ARG 50 238.406 -1.680 -8.490 391 1HD ARG 50 HD2 ARG 50 237.484 -1.020 -10.537 392 2HD ARG 50 HD1 ARG 50 236.315 -2.161 -9.874 393 HE ARG 50 HE ARG 50 235.646 0.483 -9.124 394 1HH1 ARG 50 HH11 ARG 50 235.613 -1.672 -11.869 395 2HH1 ARG 50 HH12 ARG 50 234.275 -0.880 -12.632 396 1HH2 ARG 50 HH21 ARG 50 233.886 1.524 -10.126 397 2HH2 ARG 50 HH22 ARG 50 233.294 0.934 -11.643 398 H ARG 51 HN ARG 51 235.622 -3.221 -5.068 399 HA ARG 51 HA ARG 51 233.237 -1.916 -4.364 400 1HB ARG 51 HB2 ARG 51 234.411 -4.576 -3.587 401 2HB ARG 51 HB1 ARG 51 232.848 -4.043 -2.985 402 1HG ARG 51 HG2 ARG 51 233.273 -3.912 -5.908 403 2HG ARG 51 HG1 ARG 51 233.126 -5.514 -5.183 404 1HD ARG 51 HD2 ARG 51 231.035 -4.597 -4.031 405 2HD ARG 51 HD1 ARG 51 231.139 -3.261 -5.175 406 HE ARG 51 HE ARG 51 230.283 -5.946 -5.720 407 1HH1 ARG 51 HH11 ARG 51 231.667 -3.059 -7.110 408 2HH1 ARG 51 HH12 ARG 51 231.126 -3.422 -8.714 409 1HH2 ARG 51 HH21 ARG 51 229.572 -6.426 -7.829 410 2HH2 ARG 51 HH22 ARG 51 229.937 -5.333 -9.123 411 H GLU 52 HN GLU 52 236.155 -2.579 -2.543 412 HA GLU 52 HA GLU 52 234.990 -1.707 -0.040 413 1HB GLU 52 HB2 GLU 52 237.807 -2.492 -0.799 414 2HB GLU 52 HB1 GLU 52 237.341 -1.982 0.817 415 1HG GLU 52 HG2 GLU 52 235.750 -4.162 -0.370 416 2HG GLU 52 HG1 GLU 52 237.424 -4.539 0.036 417 H LEU 53 HN LEU 53 236.588 -0.331 -2.721 418 HA LEU 53 HA LEU 53 237.704 1.931 -1.374 419 1HB LEU 53 HB2 LEU 53 238.773 1.319 -3.375 420 2HB LEU 53 HB1 LEU 53 237.256 1.182 -4.246 421 HG LEU 53 HG LEU 53 236.987 3.613 -4.174 422 1HD1 LEU 53 HD11 LEU 53 238.203 4.954 -2.877 423 2HD1 LEU 53 HD12 LEU 53 239.715 4.168 -3.328 424 3HD1 LEU 53 HD13 LEU 53 238.713 3.482 -2.051 425 1HD2 LEU 53 HD21 LEU 53 237.970 3.184 -6.164 426 2HD2 LEU 53 HD22 LEU 53 239.300 2.284 -5.438 427 3HD2 LEU 53 HD23 LEU 53 239.321 4.047 -5.429 428 H GLN 54 HN GLN 54 234.931 1.429 -3.530 429 HA GLN 54 HA GLN 54 233.962 4.053 -3.507 430 1HB GLN 54 HB2 GLN 54 233.025 2.692 -5.139 431 2HB GLN 54 HB1 GLN 54 232.717 1.378 -4.014 432 1HG GLN 54 HG2 GLN 54 230.840 2.487 -3.090 433 2HG GLN 54 HG1 GLN 54 231.240 3.993 -3.917 434 1HE2 GLN 54 HE21 GLN 54 230.761 0.583 -4.800 435 2HE2 GLN 54 HE22 GLN 54 229.721 0.901 -6.142 436 H GLU 55 HN GLU 55 233.608 1.469 -1.208 437 HA GLU 55 HA GLU 55 231.496 2.776 0.261 438 1HB GLU 55 HB2 GLU 55 231.655 0.892 1.797 439 2HB GLU 55 HB1 GLU 55 231.578 0.338 0.130 440 1HG GLU 55 HG2 GLU 55 233.959 -0.066 0.121 441 2HG GLU 55 HG1 GLU 55 234.098 0.572 1.757 442 H GLU 56 HN GLU 56 234.956 2.739 0.377 443 HA GLU 56 HA GLU 56 235.152 3.481 3.127 444 1HB GLU 56 HB2 GLU 56 237.054 3.222 0.854 445 2HB GLU 56 HB1 GLU 56 237.555 4.150 2.261 446 1HG GLU 56 HG2 GLU 56 236.353 1.586 2.943 447 2HG GLU 56 HG1 GLU 56 237.800 1.441 1.947 448 H SER 57 HN SER 57 235.375 5.323 0.083 449 HA SER 57 HA SER 57 235.020 7.757 1.702 450 1HB SER 57 HB2 SER 57 236.687 8.927 0.552 451 2HB SER 57 HB1 SER 57 237.403 7.330 0.770 452 HG SER 57 HG SER 57 237.529 8.282 -1.402 453 H GLY 58 HN GLY 58 233.239 6.000 -0.070 454 1HA GLY 58 HA2 GLY 58 231.517 6.328 -1.550 455 2HA GLY 58 HA1 GLY 58 231.589 8.015 -1.065 456 H LEU 59 HN LEU 59 234.510 6.847 -2.368 457 HA LEU 59 HA LEU 59 233.925 8.202 -4.909 458 1HB LEU 59 HB2 LEU 59 236.530 7.759 -3.465 459 2HB LEU 59 HB1 LEU 59 236.405 8.433 -5.078 460 HG LEU 59 HG LEU 59 235.686 9.660 -2.453 461 1HD1 LEU 59 HD11 LEU 59 237.340 11.064 -2.971 462 2HD1 LEU 59 HD12 LEU 59 236.721 11.320 -4.602 463 3HD1 LEU 59 HD13 LEU 59 237.758 9.936 -4.258 464 1HD2 LEU 59 HD21 LEU 59 234.563 10.548 -5.112 465 2HD2 LEU 59 HD22 LEU 59 234.398 11.394 -3.574 466 3HD2 LEU 59 HD23 LEU 59 233.637 9.820 -3.802 467 H THR 60 HN THR 60 233.439 6.797 -6.411 468 HA THR 60 HA THR 60 234.609 4.145 -6.431 469 HB THR 60 HB THR 60 233.001 4.925 -8.753 470 HG1 THR 60 HG1 THR 60 231.281 5.627 -7.767 471 1HG2 THR 60 HG21 THR 60 233.409 2.635 -7.085 472 2HG2 THR 60 HG22 THR 60 232.651 2.742 -8.675 473 3HG2 THR 60 HG23 THR 60 231.686 2.988 -7.220 474 H VAL 61 HN VAL 61 235.454 3.345 -8.625 475 HA VAL 61 HA VAL 61 236.889 5.490 -10.028 476 HB VAL 61 HB VAL 61 238.956 4.242 -10.047 477 1HG1 VAL 61 HG11 VAL 61 239.393 4.205 -7.519 478 2HG1 VAL 61 HG12 VAL 61 237.724 4.754 -7.363 479 3HG1 VAL 61 HG13 VAL 61 238.894 5.729 -8.251 480 1HG2 VAL 61 HG21 VAL 61 237.254 2.094 -9.053 481 2HG2 VAL 61 HG22 VAL 61 238.764 2.256 -8.158 482 3HG2 VAL 61 HG23 VAL 61 238.795 2.017 -9.905 483 H ASP 62 HN ASP 62 237.178 5.210 -12.178 484 HA ASP 62 HA ASP 62 235.614 3.152 -13.448 485 1HB ASP 62 HB2 ASP 62 235.884 5.615 -14.200 486 2HB ASP 62 HB1 ASP 62 237.415 5.084 -14.890 487 H ALA 63 HN ALA 63 238.907 3.640 -12.573 488 HA ALA 63 HA ALA 63 239.691 1.036 -13.191 489 1HB ALA 63 HB1 ALA 63 241.168 2.721 -15.100 490 2HB ALA 63 HB2 ALA 63 239.484 2.399 -15.514 491 3HB ALA 63 HB3 ALA 63 240.600 1.059 -15.253 492 H LEU 64 HN LEU 64 240.737 1.101 -11.222 493 HA LEU 64 HA LEU 64 242.461 3.160 -10.348 494 1HB LEU 64 HB2 LEU 64 242.376 0.229 -9.614 495 2HB LEU 64 HB1 LEU 64 243.361 1.419 -8.788 496 HG LEU 64 HG LEU 64 240.681 2.378 -8.828 497 1HD1 LEU 64 HD11 LEU 64 239.685 0.541 -7.430 498 2HD1 LEU 64 HD12 LEU 64 241.001 -0.490 -7.991 499 3HD1 LEU 64 HD13 LEU 64 239.855 0.183 -9.149 500 1HD2 LEU 64 HD21 LEU 64 241.715 1.261 -6.326 501 2HD2 LEU 64 HD22 LEU 64 241.190 2.901 -6.709 502 3HD2 LEU 64 HD23 LEU 64 242.817 2.375 -7.136 503 H HIS 65 HN HIS 65 244.858 2.332 -9.718 504 HA HIS 65 HA HIS 65 246.090 1.137 -12.097 505 1HB HIS 65 HB2 HIS 65 246.157 3.736 -12.007 506 2HB HIS 65 HB1 HIS 65 247.372 3.500 -10.756 507 HD1 HIS 65 HD1 HIS 65 248.508 4.893 -13.019 508 HD2 HIS 65 HD2 HIS 65 248.136 0.755 -13.072 509 HE1 HIS 65 HE1 HIS 65 250.163 4.092 -14.734 510 HE2 HIS 65 HE2 HIS 65 249.981 1.580 -14.687 511 H LYS 66 HN LYS 66 246.777 -0.738 -11.179 512 HA LYS 66 HA LYS 66 247.739 -0.996 -8.537 513 1HB LYS 66 HB2 LYS 66 248.785 -3.151 -9.471 514 2HB LYS 66 HB1 LYS 66 247.036 -3.004 -9.537 515 1HG LYS 66 HG2 LYS 66 248.191 -1.941 -11.936 516 2HG LYS 66 HG1 LYS 66 248.798 -3.572 -11.639 517 1HD LYS 66 HD2 LYS 66 246.353 -4.212 -11.236 518 2HD LYS 66 HD1 LYS 66 245.954 -2.661 -11.980 519 1HE LYS 66 HE2 LYS 66 247.578 -3.510 -13.860 520 2HE LYS 66 HE1 LYS 66 247.187 -5.092 -13.189 521 1HZ LYS 66 HZ1 LYS 66 245.097 -3.150 -13.980 522 2HZ LYS 66 HZ2 LYS 66 244.925 -4.806 -13.685 523 3HZ LYS 66 HZ3 LYS 66 245.741 -4.275 -15.067 524 H VAL 67 HN VAL 67 249.669 -0.501 -7.663 525 HA VAL 67 HA VAL 67 251.884 -0.001 -9.557 526 HB VAL 67 HB VAL 67 252.704 1.767 -8.013 527 1HG1 VAL 67 HG11 VAL 67 251.069 2.021 -10.065 528 2HG1 VAL 67 HG12 VAL 67 251.492 3.405 -9.056 529 3HG1 VAL 67 HG13 VAL 67 249.954 2.576 -8.816 530 1HG2 VAL 67 HG21 VAL 67 251.739 1.337 -5.943 531 2HG2 VAL 67 HG22 VAL 67 250.128 1.126 -6.626 532 3HG2 VAL 67 HG23 VAL 67 250.838 2.736 -6.522 533 H GLY 68 HN GLY 68 251.184 -0.714 -6.122 534 1HA GLY 68 HA2 GLY 68 253.592 -2.408 -6.158 535 2HA GLY 68 HA1 GLY 68 253.379 -1.229 -4.877 536 H GLN 69 HN GLN 69 253.307 -4.357 -5.353 537 HA GLN 69 HA GLN 69 250.918 -4.848 -3.710 538 1HB GLN 69 HB2 GLN 69 251.072 -6.100 -5.854 539 2HB GLN 69 HB1 GLN 69 252.568 -6.832 -5.290 540 1HG GLN 69 HG2 GLN 69 251.479 -8.092 -3.661 541 2HG GLN 69 HG1 GLN 69 250.028 -7.093 -3.729 542 1HE2 GLN 69 HE21 GLN 69 250.439 -10.009 -4.040 543 2HE2 GLN 69 HE22 GLN 69 249.721 -10.410 -5.560 544 H ILE 70 HN ILE 70 251.328 -4.965 -1.613 545 HA ILE 70 HA ILE 70 253.969 -5.911 -0.743 546 HB ILE 70 HB ILE 70 251.918 -4.359 0.829 547 1HG1 ILE 70 HG12 ILE 70 254.524 -3.166 0.075 548 2HG1 ILE 70 HG11 ILE 70 253.346 -3.355 -1.220 549 1HG2 ILE 70 HG21 ILE 70 254.783 -5.028 1.481 550 2HG2 ILE 70 HG22 ILE 70 253.359 -5.758 2.224 551 3HG2 ILE 70 HG23 ILE 70 253.697 -4.045 2.462 552 1HD1 ILE 70 HD11 ILE 70 252.941 -1.222 -0.433 553 2HD1 ILE 70 HD12 ILE 70 253.178 -1.689 1.252 554 3HD1 ILE 70 HD13 ILE 70 251.718 -2.186 0.395 555 H VAL 71 HN VAL 71 254.168 -7.387 0.926 556 HA VAL 71 HA VAL 71 251.790 -9.044 1.450 557 HB VAL 71 HB VAL 71 254.644 -10.020 1.316 558 1HG1 VAL 71 HG11 VAL 71 252.047 -11.539 1.261 559 2HG1 VAL 71 HG12 VAL 71 253.058 -11.326 2.690 560 3HG1 VAL 71 HG13 VAL 71 253.674 -12.217 1.298 561 1HG2 VAL 71 HG21 VAL 71 254.342 -9.540 -0.897 562 2HG2 VAL 71 HG22 VAL 71 252.588 -9.704 -0.807 563 3HG2 VAL 71 HG23 VAL 71 253.608 -11.142 -0.839 564 H PHE 72 HN PHE 72 251.615 -9.968 3.538 565 HA PHE 72 HA PHE 72 253.445 -8.839 5.545 566 1HB PHE 72 HB2 PHE 72 250.436 -9.042 5.691 567 2HB PHE 72 HB1 PHE 72 251.462 -8.657 7.069 568 HD1 PHE 72 HD1 PHE 72 251.025 -7.521 3.538 569 HD2 PHE 72 HD2 PHE 72 251.634 -6.445 7.608 570 HE1 PHE 72 HE1 PHE 72 250.968 -5.143 2.913 571 HE2 PHE 72 HE2 PHE 72 251.574 -4.063 6.992 572 HZ PHE 72 HZ PHE 72 251.241 -3.410 4.641 573 H GLU 73 HN GLU 73 254.474 -10.374 6.601 574 HA GLU 73 HA GLU 73 253.238 -13.028 6.835 575 1HB GLU 73 HB2 GLU 73 255.432 -13.050 5.800 576 2HB GLU 73 HB1 GLU 73 256.114 -12.140 7.139 577 1HG GLU 73 HG2 GLU 73 256.341 -13.960 8.426 578 2HG GLU 73 HG1 GLU 73 254.806 -14.650 7.901 579 H PHE 74 HN PHE 74 252.398 -13.618 8.728 580 HA PHE 74 HA PHE 74 253.043 -12.011 11.091 581 1HB PHE 74 HB2 PHE 74 250.744 -13.757 10.307 582 2HB PHE 74 HB1 PHE 74 251.071 -13.503 12.018 583 HD1 PHE 74 HD1 PHE 74 249.568 -12.017 12.900 584 HD2 PHE 74 HD2 PHE 74 251.181 -11.262 9.036 585 HE1 PHE 74 HE1 PHE 74 248.355 -9.879 12.816 586 HE2 PHE 74 HE2 PHE 74 249.972 -9.121 8.944 587 HZ PHE 74 HZ PHE 74 248.556 -8.427 10.837 588 H VAL 75 HN VAL 75 254.148 -12.703 12.734 589 HA VAL 75 HA VAL 75 255.472 -15.237 12.568 590 HB VAL 75 HB VAL 75 255.677 -13.834 15.132 591 1HG1 VAL 75 HG11 VAL 75 257.910 -14.271 13.220 592 2HG1 VAL 75 HG12 VAL 75 257.124 -15.671 13.952 593 3HG1 VAL 75 HG13 VAL 75 257.877 -14.446 14.974 594 1HG2 VAL 75 HG21 VAL 75 256.128 -12.375 12.574 595 2HG2 VAL 75 HG22 VAL 75 257.223 -12.096 13.929 596 3HG2 VAL 75 HG23 VAL 75 255.496 -11.785 14.111 597 H GLY 76 HN GLY 76 254.735 -17.102 13.310 598 1HA GLY 76 HA2 GLY 76 253.894 -18.516 15.018 599 2HA GLY 76 HA1 GLY 76 253.070 -17.132 15.721 600 H GLU 77 HN GLU 77 252.166 -16.424 12.887 601 HA GLU 77 HA GLU 77 249.882 -18.276 12.858 602 1HB GLU 77 HB2 GLU 77 250.074 -15.486 11.709 603 2HB GLU 77 HB1 GLU 77 248.632 -16.492 11.755 604 1HG GLU 77 HG2 GLU 77 250.040 -15.784 14.289 605 2HG GLU 77 HG1 GLU 77 248.961 -14.623 13.516 606 HA PRO 78 HA PRO 78 251.911 -20.019 9.198 607 1HB PRO 78 HB2 PRO 78 249.107 -21.037 8.959 608 2HB PRO 78 HB1 PRO 78 250.637 -21.898 8.746 609 1HG PRO 78 HG2 PRO 78 249.223 -22.182 10.983 610 2HG PRO 78 HG1 PRO 78 250.994 -22.101 11.029 611 1HD PRO 78 HD2 PRO 78 248.984 -20.060 11.820 612 2HD PRO 78 HD1 PRO 78 250.612 -20.353 12.462 613 H GLU 79 HN GLU 79 248.637 -18.626 9.158 614 HA GLU 79 HA GLU 79 248.590 -18.103 6.380 615 1HB GLU 79 HB2 GLU 79 246.817 -17.840 8.558 616 2HB GLU 79 HB1 GLU 79 246.957 -16.239 7.845 617 1HG GLU 79 HG2 GLU 79 246.217 -17.010 5.739 618 2HG GLU 79 HG1 GLU 79 246.369 -18.698 6.227 619 H LEU 80 HN LEU 80 248.286 -15.806 5.542 620 HA LEU 80 HA LEU 80 250.055 -13.872 6.842 621 1HB LEU 80 HB2 LEU 80 250.366 -14.162 3.904 622 2HB LEU 80 HB1 LEU 80 251.536 -13.660 5.109 623 HG LEU 80 HG LEU 80 250.654 -16.517 4.989 624 1HD1 LEU 80 HD11 LEU 80 251.280 -16.338 2.776 625 2HD1 LEU 80 HD12 LEU 80 252.801 -16.776 3.555 626 3HD1 LEU 80 HD13 LEU 80 252.490 -15.098 3.110 627 1HD2 LEU 80 HD21 LEU 80 252.008 -16.401 6.788 628 2HD2 LEU 80 HD22 LEU 80 252.806 -14.932 6.227 629 3HD2 LEU 80 HD23 LEU 80 253.283 -16.500 5.576 630 H MET 81 HN MET 81 250.093 -11.994 4.768 631 HA MET 81 HA MET 81 247.311 -11.543 4.044 632 1HB MET 81 HB2 MET 81 248.302 -10.383 6.334 633 2HB MET 81 HB1 MET 81 248.549 -9.122 5.134 634 1HG MET 81 HG2 MET 81 246.056 -9.694 4.516 635 2HG MET 81 HG1 MET 81 246.027 -10.287 6.175 636 1HE MET 81 HE1 MET 81 246.832 -7.505 3.807 637 2HE MET 81 HE2 MET 81 248.081 -6.895 4.894 638 3HE MET 81 HE3 MET 81 246.568 -6.009 4.701 639 H ASP 82 HN ASP 82 247.436 -11.248 1.912 640 HA ASP 82 HA ASP 82 249.721 -9.752 0.820 641 1HB ASP 82 HB2 ASP 82 249.316 -12.007 -0.118 642 2HB ASP 82 HB1 ASP 82 247.703 -11.503 -0.613 643 H VAL 83 HN VAL 83 249.196 -7.616 0.868 644 HA VAL 83 HA VAL 83 246.540 -6.851 -0.146 645 HB VAL 83 HB VAL 83 246.999 -6.157 2.175 646 1HG1 VAL 83 HG11 VAL 83 249.059 -4.265 1.079 647 2HG1 VAL 83 HG12 VAL 83 249.488 -5.845 1.736 648 3HG1 VAL 83 HG13 VAL 83 248.700 -4.648 2.763 649 1HG2 VAL 83 HG21 VAL 83 246.699 -4.003 0.095 650 2HG2 VAL 83 HG22 VAL 83 246.499 -3.706 1.822 651 3HG2 VAL 83 HG23 VAL 83 245.430 -4.837 0.991 652 H HIS 84 HN HIS 84 246.501 -6.093 -2.125 653 HA HIS 84 HA HIS 84 248.881 -5.120 -3.436 654 1HB HIS 84 HB2 HIS 84 246.898 -6.487 -4.455 655 2HB HIS 84 HB1 HIS 84 246.106 -4.921 -4.578 656 HD1 HIS 84 HD1 HIS 84 249.685 -4.616 -5.147 657 HD2 HIS 84 HD2 HIS 84 246.344 -5.552 -7.431 658 HE1 HIS 84 HE1 HIS 84 250.405 -4.330 -7.537 659 HE2 HIS 84 HE2 HIS 84 248.402 -5.018 -8.902 660 H VAL 85 HN VAL 85 249.191 -2.972 -4.204 661 HA VAL 85 HA VAL 85 247.533 -0.992 -2.779 662 HB VAL 85 HB VAL 85 250.325 -0.532 -3.835 663 1HG1 VAL 85 HG11 VAL 85 249.757 1.576 -3.399 664 2HG1 VAL 85 HG12 VAL 85 249.835 1.135 -1.694 665 3HG1 VAL 85 HG13 VAL 85 248.292 1.092 -2.545 666 1HG2 VAL 85 HG21 VAL 85 249.626 -1.091 -0.964 667 2HG2 VAL 85 HG22 VAL 85 251.223 -1.008 -1.707 668 3HG2 VAL 85 HG23 VAL 85 250.150 -2.359 -2.071 669 H PHE 86 HN PHE 86 246.023 -0.397 -4.192 670 HA PHE 86 HA PHE 86 246.742 0.150 -6.975 671 1HB PHE 86 HB2 PHE 86 244.347 -0.736 -5.550 672 2HB PHE 86 HB1 PHE 86 244.002 0.582 -6.663 673 HD1 PHE 86 HD1 PHE 86 244.359 -2.900 -6.330 674 HD2 PHE 86 HD2 PHE 86 244.964 0.293 -9.076 675 HE1 PHE 86 HE1 PHE 86 244.298 -4.500 -8.197 676 HE2 PHE 86 HE2 PHE 86 244.902 -1.301 -10.949 677 HZ PHE 86 HZ PHE 86 244.568 -3.701 -10.510 678 H CYS 87 HN CYS 87 246.682 2.160 -7.843 679 HA CYS 87 HA CYS 87 245.738 4.373 -6.124 680 1HB CYS 87 HB2 CYS 87 248.175 4.456 -6.286 681 2HB CYS 87 HB1 CYS 87 248.092 4.344 -8.041 682 HG CYS 87 HG CYS 87 246.634 6.799 -7.241 683 H THR 88 HN THR 88 243.956 5.243 -7.024 684 HA THR 88 HA THR 88 243.524 4.871 -9.890 685 HB THR 88 HB THR 88 241.784 4.173 -8.231 686 HG1 THR 88 HG1 THR 88 241.373 4.827 -10.486 687 1HG2 THR 88 HG21 THR 88 240.772 5.537 -6.816 688 2HG2 THR 88 HG22 THR 88 240.661 6.836 -8.004 689 3HG2 THR 88 HG23 THR 88 242.144 6.612 -7.077 690 H ASP 89 HN ASP 89 241.814 6.841 -10.518 691 HA ASP 89 HA ASP 89 242.781 9.440 -9.779 692 1HB ASP 89 HB2 ASP 89 243.519 10.066 -12.070 693 2HB ASP 89 HB1 ASP 89 244.554 8.846 -11.333 694 H SER 90 HN SER 90 241.028 7.519 -12.172 695 HA SER 90 HA SER 90 239.096 9.643 -12.602 696 1HB SER 90 HB2 SER 90 240.054 7.612 -14.208 697 2HB SER 90 HB1 SER 90 238.473 7.000 -13.725 698 HG SER 90 HG SER 90 238.948 8.722 -15.605 699 H ILE 91 HN ILE 91 237.877 9.891 -10.763 700 HA ILE 91 HA ILE 91 236.652 7.482 -9.630 701 HB ILE 91 HB ILE 91 236.071 8.843 -7.672 702 1HG1 ILE 91 HG12 ILE 91 237.711 11.070 -8.885 703 2HG1 ILE 91 HG11 ILE 91 235.959 11.003 -9.047 704 1HG2 ILE 91 HG21 ILE 91 238.265 7.650 -7.882 705 2HG2 ILE 91 HG22 ILE 91 238.263 9.006 -6.752 706 3HG2 ILE 91 HG23 ILE 91 238.986 9.190 -8.350 707 1HD1 ILE 91 HD11 ILE 91 237.457 11.081 -6.439 708 2HD1 ILE 91 HD12 ILE 91 235.706 11.105 -6.644 709 3HD1 ILE 91 HD13 ILE 91 236.679 12.460 -7.217 710 H GLN 92 HN GLN 92 234.401 8.121 -8.552 711 HA GLN 92 HA GLN 92 232.808 9.648 -10.482 712 1HB GLN 92 HB2 GLN 92 232.135 6.850 -9.562 713 2HB GLN 92 HB1 GLN 92 231.118 7.868 -10.573 714 1HG GLN 92 HG2 GLN 92 233.897 7.107 -11.396 715 2HG GLN 92 HG1 GLN 92 232.512 6.063 -11.711 716 1HE2 GLN 92 HE21 GLN 92 232.386 6.219 -13.875 717 2HE2 GLN 92 HE22 GLN 92 232.103 7.690 -14.736 718 H GLY 93 HN GLY 93 232.207 7.562 -7.658 719 1HA GLY 93 HA2 GLY 93 230.083 8.972 -6.597 720 2HA GLY 93 HA1 GLY 93 231.190 7.994 -5.647 721 H THR 94 HN THR 94 230.324 9.895 -4.196 722 HA THR 94 HA THR 94 232.203 12.143 -4.401 723 HB THR 94 HB THR 94 229.928 12.428 -2.576 724 HG1 THR 94 HG1 THR 94 229.536 12.086 -5.352 725 1HG2 THR 94 HG21 THR 94 229.819 14.433 -4.473 726 2HG2 THR 94 HG22 THR 94 231.542 14.109 -4.281 727 3HG2 THR 94 HG23 THR 94 230.562 14.529 -2.876 728 HA PRO 95 HA PRO 95 234.128 11.102 -0.611 729 1HB PRO 95 HB2 PRO 95 233.950 13.875 0.347 730 2HB PRO 95 HB1 PRO 95 235.379 12.933 -0.088 731 1HG PRO 95 HG2 PRO 95 234.508 14.967 -1.603 732 2HG PRO 95 HG1 PRO 95 235.256 13.522 -2.306 733 1HD PRO 95 HD2 PRO 95 232.355 14.242 -2.095 734 2HD PRO 95 HD1 PRO 95 233.245 13.549 -3.469 735 H VAL 96 HN VAL 96 231.747 10.279 -0.423 736 HA VAL 96 HA VAL 96 230.105 11.604 1.520 737 HB VAL 96 HB VAL 96 229.905 8.711 0.688 738 1HG1 VAL 96 HG11 VAL 96 227.627 10.520 1.375 739 2HG1 VAL 96 HG12 VAL 96 228.575 9.754 2.651 740 3HG1 VAL 96 HG13 VAL 96 227.728 8.762 1.464 741 1HG2 VAL 96 HG21 VAL 96 229.262 11.185 -0.810 742 2HG2 VAL 96 HG22 VAL 96 228.097 9.862 -0.890 743 3HG2 VAL 96 HG23 VAL 96 229.766 9.600 -1.397 744 H GLU 97 HN GLU 97 232.264 11.657 2.844 745 HA GLU 97 HA GLU 97 233.350 9.604 4.253 746 1HB GLU 97 HB2 GLU 97 233.829 11.173 6.039 747 2HB GLU 97 HB1 GLU 97 234.003 11.977 4.487 748 1HG GLU 97 HG2 GLU 97 231.424 12.543 5.047 749 2HG GLU 97 HG1 GLU 97 232.107 12.471 6.671 750 H SER 98 HN SER 98 232.525 7.997 5.403 751 HA SER 98 HA SER 98 229.836 8.196 6.476 752 1HB SER 98 HB2 SER 98 231.761 5.858 6.523 753 2HB SER 98 HB1 SER 98 230.043 5.802 6.916 754 HG SER 98 HG SER 98 229.588 6.351 4.769 755 H ASP 99 HN ASP 99 229.716 6.785 8.683 756 HA ASP 99 HA ASP 99 230.717 8.506 10.678 757 1HB ASP 99 HB2 ASP 99 229.502 5.747 10.877 758 2HB ASP 99 HB1 ASP 99 229.850 6.774 12.265 759 H GLU 100 HN GLU 100 232.196 5.911 9.041 760 HA GLU 100 HA GLU 100 234.321 5.852 11.076 761 1HB GLU 100 HB2 GLU 100 232.859 3.622 9.815 762 2HB GLU 100 HB1 GLU 100 234.605 3.427 9.885 763 1HG GLU 100 HG2 GLU 100 234.646 3.382 12.184 764 2HG GLU 100 HG1 GLU 100 233.118 4.251 12.333 765 H MET 101 HN MET 101 233.878 7.321 8.437 766 HA MET 101 HA MET 101 236.574 6.931 7.478 767 1HB MET 101 HB2 MET 101 234.315 5.798 6.073 768 2HB MET 101 HB1 MET 101 235.142 6.986 5.075 769 1HG MET 101 HG2 MET 101 236.653 4.831 6.499 770 2HG MET 101 HG1 MET 101 235.888 4.541 4.938 771 1HE MET 101 HE1 MET 101 238.732 6.778 6.779 772 2HE MET 101 HE2 MET 101 239.939 6.153 5.656 773 3HE MET 101 HE3 MET 101 238.922 5.037 6.567 774 H ARG 102 HN ARG 102 237.282 8.600 6.033 775 HA ARG 102 HA ARG 102 235.657 10.807 5.321 776 1HB ARG 102 HB2 ARG 102 235.717 11.248 7.732 777 2HB ARG 102 HB1 ARG 102 237.473 11.175 7.719 778 1HG ARG 102 HG2 ARG 102 237.154 13.093 5.908 779 2HG ARG 102 HG1 ARG 102 235.653 13.325 6.806 780 1HD ARG 102 HD2 ARG 102 237.362 13.117 8.857 781 2HD ARG 102 HD1 ARG 102 238.458 13.764 7.637 782 HE ARG 102 HE ARG 102 235.990 15.212 7.818 783 1HH1 ARG 102 HH11 ARG 102 239.187 14.862 9.176 784 2HH1 ARG 102 HH12 ARG 102 239.244 16.483 9.780 785 1HH2 ARG 102 HH21 ARG 102 236.065 17.345 8.612 786 2HH2 ARG 102 HH22 ARG 102 237.472 17.894 9.460 787 HA PRO 103 HA PRO 103 239.499 10.556 2.881 788 1HB PRO 103 HB2 PRO 103 238.512 11.754 0.666 789 2HB PRO 103 HB1 PRO 103 238.207 10.053 1.041 790 1HG PRO 103 HG2 PRO 103 236.457 12.441 1.511 791 2HG PRO 103 HG1 PRO 103 236.024 10.855 0.842 792 1HD PRO 103 HD2 PRO 103 235.547 11.508 3.424 793 2HD PRO 103 HD1 PRO 103 235.960 9.853 2.930 794 H CYS 104 HN CYS 104 241.083 12.046 2.530 795 HA CYS 104 HA CYS 104 240.377 14.879 2.881 796 1HB CYS 104 HB2 CYS 104 242.865 13.608 4.025 797 2HB CYS 104 HB1 CYS 104 242.278 15.246 4.291 798 HG CYS 104 HG CYS 104 241.709 13.701 6.348 799 H TRP 105 HN TRP 105 240.946 16.016 1.177 800 HA TRP 105 HA TRP 105 242.827 14.963 -0.747 801 1HB TRP 105 HB2 TRP 105 241.259 17.555 -0.731 802 2HB TRP 105 HB1 TRP 105 242.189 16.934 -2.091 803 HD1 TRP 105 HD1 TRP 105 239.634 15.018 0.133 804 HE1 TRP 105 HE1 TRP 105 237.832 14.016 -1.411 805 HE3 TRP 105 HE3 TRP 105 241.223 16.958 -4.326 806 HZ2 TRP 105 HZ2 TRP 105 237.175 14.052 -4.156 807 HZ3 TRP 105 HZ3 TRP 105 239.950 16.425 -6.362 808 HH2 TRP 105 HH2 TRP 105 237.969 15.001 -6.278 809 H PHE 106 HN PHE 106 244.902 15.109 -0.136 810 HA PHE 106 HA PHE 106 245.851 17.658 0.985 811 1HB PHE 106 HB2 PHE 106 246.062 15.191 2.086 812 2HB PHE 106 HB1 PHE 106 247.564 15.251 1.174 813 HD1 PHE 106 HD1 PHE 106 249.037 15.254 3.014 814 HD2 PHE 106 HD2 PHE 106 245.970 18.195 2.745 815 HE1 PHE 106 HE1 PHE 106 250.096 16.525 4.836 816 HE2 PHE 106 HE2 PHE 106 247.026 19.469 4.562 817 HZ PHE 106 HZ PHE 106 249.092 18.635 5.611 818 H GLN 107 HN GLN 107 248.600 17.171 0.620 819 HA GLN 107 HA GLN 107 248.804 17.657 -2.260 820 1HB GLN 107 HB2 GLN 107 250.935 18.140 -0.181 821 2HB GLN 107 HB1 GLN 107 250.852 18.796 -1.810 822 1HG GLN 107 HG2 GLN 107 248.551 19.754 -0.822 823 2HG GLN 107 HG1 GLN 107 249.503 19.667 0.660 824 1HE2 GLN 107 HE21 GLN 107 249.256 21.093 -2.513 825 2HE2 GLN 107 HE22 GLN 107 250.363 22.391 -2.234 826 H LEU 108 HN LEU 108 250.252 16.562 -3.566 827 HA LEU 108 HA LEU 108 250.786 13.859 -2.845 828 1HB LEU 108 HB2 LEU 108 251.441 13.550 -5.056 829 2HB LEU 108 HB1 LEU 108 250.278 14.856 -5.169 830 HG LEU 108 HG LEU 108 253.282 15.162 -5.222 831 1HD1 LEU 108 HD11 LEU 108 252.824 14.366 -7.316 832 2HD1 LEU 108 HD12 LEU 108 252.549 16.090 -7.569 833 3HD1 LEU 108 HD13 LEU 108 251.180 15.006 -7.321 834 1HD2 LEU 108 HD21 LEU 108 252.889 17.494 -5.653 835 2HD2 LEU 108 HD22 LEU 108 252.080 17.050 -4.150 836 3HD2 LEU 108 HD23 LEU 108 251.144 17.245 -5.631 837 H ASP 109 HN ASP 109 252.452 16.698 -2.212 838 HA ASP 109 HA ASP 109 254.970 15.221 -1.841 839 1HB ASP 109 HB2 ASP 109 255.098 17.086 -3.500 840 2HB ASP 109 HB1 ASP 109 254.645 18.208 -2.219 841 H GLN 110 HN GLN 110 252.503 15.676 -0.111 842 HA GLN 110 HA GLN 110 253.988 16.336 2.296 843 1HB GLN 110 HB2 GLN 110 251.349 17.677 1.710 844 2HB GLN 110 HB1 GLN 110 252.394 17.945 3.098 845 1HG GLN 110 HG2 GLN 110 254.140 18.679 1.341 846 2HG GLN 110 HG1 GLN 110 252.750 18.833 0.270 847 1HE2 GLN 110 HE21 GLN 110 250.865 19.705 2.137 848 2HE2 GLN 110 HE22 GLN 110 251.294 21.299 2.649 849 H ILE 111 HN ILE 111 252.640 13.958 1.010 850 HA ILE 111 HA ILE 111 250.366 13.365 2.654 851 HB ILE 111 HB ILE 111 251.702 10.963 1.742 852 1HG1 ILE 111 HG12 ILE 111 251.061 11.565 -0.743 853 2HG1 ILE 111 HG11 ILE 111 251.424 13.205 -0.211 854 1HG2 ILE 111 HG21 ILE 111 249.135 11.882 2.154 855 2HG2 ILE 111 HG22 ILE 111 249.617 10.304 1.532 856 3HG2 ILE 111 HG23 ILE 111 249.234 11.612 0.414 857 1HD1 ILE 111 HD11 ILE 111 253.234 10.835 -0.379 858 2HD1 ILE 111 HD12 ILE 111 253.620 12.202 0.663 859 3HD1 ILE 111 HD13 ILE 111 253.436 12.442 -1.073 860 HA PRO 112 HA PRO 112 252.870 12.037 6.088 861 1HB PRO 112 HB2 PRO 112 250.967 12.011 7.943 862 2HB PRO 112 HB1 PRO 112 251.469 13.537 7.202 863 1HG PRO 112 HG2 PRO 112 249.035 11.889 6.683 864 2HG PRO 112 HG1 PRO 112 249.214 13.651 6.702 865 1HD PRO 112 HD2 PRO 112 249.216 11.993 4.428 866 2HD PRO 112 HD1 PRO 112 249.703 13.698 4.489 867 H PHE 113 HN PHE 113 253.493 9.981 5.533 868 HA PHE 113 HA PHE 113 251.666 7.781 5.580 869 1HB PHE 113 HB2 PHE 113 254.564 7.231 5.806 870 2HB PHE 113 HB1 PHE 113 253.355 6.485 4.778 871 HD1 PHE 113 HD1 PHE 113 252.440 9.331 3.644 872 HD2 PHE 113 HD2 PHE 113 256.157 7.279 4.054 873 HE1 PHE 113 HE1 PHE 113 253.355 10.566 1.726 874 HE2 PHE 113 HE2 PHE 113 257.062 8.512 2.138 875 HZ PHE 113 HZ PHE 113 255.662 10.168 0.971 876 H LYS 114 HN LYS 114 253.465 9.416 7.977 877 HA LYS 114 HA LYS 114 253.831 7.239 9.772 878 1HB LYS 114 HB2 LYS 114 254.090 10.207 9.921 879 2HB LYS 114 HB1 LYS 114 253.958 9.314 11.430 880 1HG LYS 114 HG2 LYS 114 255.954 8.171 11.072 881 2HG LYS 114 HG1 LYS 114 255.962 8.538 9.345 882 1HD LYS 114 HD2 LYS 114 256.030 11.030 10.301 883 2HD LYS 114 HD1 LYS 114 256.805 10.199 11.651 884 1HE LYS 114 HE2 LYS 114 258.118 9.073 9.588 885 2HE LYS 114 HE1 LYS 114 257.761 10.655 8.896 886 1HZ LYS 114 HZ1 LYS 114 259.447 9.972 11.198 887 2HZ LYS 114 HZ2 LYS 114 258.673 11.475 11.180 888 3HZ LYS 114 HZ3 LYS 114 259.740 11.059 9.935 889 H ASP 115 HN ASP 115 251.226 9.357 8.985 890 HA ASP 115 HA ASP 115 249.759 8.561 11.374 891 1HB ASP 115 HB2 ASP 115 249.301 10.701 9.309 892 2HB ASP 115 HB1 ASP 115 248.046 10.237 10.454 893 H MET 116 HN MET 116 250.353 6.772 9.067 894 HA MET 116 HA MET 116 247.571 6.001 8.514 895 1HB MET 116 HB2 MET 116 249.535 5.437 6.371 896 2HB MET 116 HB1 MET 116 247.836 5.865 6.256 897 1HG MET 116 HG2 MET 116 248.552 8.205 6.958 898 2HG MET 116 HG1 MET 116 250.194 7.672 6.614 899 1HE MET 116 HE1 MET 116 250.934 7.674 3.405 900 2HE MET 116 HE2 MET 116 249.854 6.308 3.121 901 3HE MET 116 HE3 MET 116 250.767 6.412 4.625 902 H TRP 117 HN TRP 117 250.758 4.657 7.630 903 HA TRP 117 HA TRP 117 250.413 2.444 9.448 904 1HB TRP 117 HB2 TRP 117 249.530 2.238 6.710 905 2HB TRP 117 HB1 TRP 117 250.863 1.125 6.993 906 HD1 TRP 117 HD1 TRP 117 248.724 1.677 10.029 907 HE1 TRP 117 HE1 TRP 117 247.227 -0.378 10.422 908 HE3 TRP 117 HE3 TRP 117 249.507 -0.760 5.602 909 HZ2 TRP 117 HZ2 TRP 117 246.476 -2.721 9.040 910 HZ3 TRP 117 HZ3 TRP 117 248.360 -2.902 5.216 911 HH2 TRP 117 HH2 TRP 117 246.876 -3.862 6.903 912 HA PRO 118 HA PRO 118 254.809 2.274 9.036 913 1HB PRO 118 HB2 PRO 118 255.386 -0.212 9.784 914 2HB PRO 118 HB1 PRO 118 254.599 0.910 10.898 915 1HG PRO 118 HG2 PRO 118 253.409 -1.317 9.299 916 2HG PRO 118 HG1 PRO 118 253.060 -0.823 10.964 917 1HD PRO 118 HD2 PRO 118 251.547 -0.131 8.740 918 2HD PRO 118 HD1 PRO 118 251.530 0.725 10.294 919 H ASP 119 HN ASP 119 253.046 1.140 6.610 920 HA ASP 119 HA ASP 119 255.356 -0.058 5.230 921 1HB ASP 119 HB2 ASP 119 253.492 -1.148 3.773 922 2HB ASP 119 HB1 ASP 119 253.878 -1.850 5.341 923 H ASP 120 HN ASP 120 252.912 2.360 5.210 924 HA ASP 120 HA ASP 120 252.575 2.948 2.544 925 1HB ASP 120 HB2 ASP 120 252.626 4.696 4.982 926 2HB ASP 120 HB1 ASP 120 252.296 5.357 3.382 927 H SER 121 HN SER 121 255.136 4.166 4.686 928 HA SER 121 HA SER 121 256.413 5.813 2.814 929 1HB SER 121 HB2 SER 121 256.802 5.755 5.311 930 2HB SER 121 HB1 SER 121 257.792 4.319 5.050 931 HG SER 121 HG SER 121 258.310 6.976 4.442 932 H TYR 122 HN TYR 122 256.299 2.386 2.962 933 HA TYR 122 HA TYR 122 258.812 1.991 1.607 934 1HB TYR 122 HB2 TYR 122 256.621 0.151 2.523 935 2HB TYR 122 HB1 TYR 122 257.907 -0.423 1.469 936 HD1 TYR 122 HD1 TYR 122 260.242 1.022 2.555 937 HD2 TYR 122 HD2 TYR 122 257.020 -0.895 4.565 938 HE1 TYR 122 HE1 TYR 122 261.684 0.663 4.514 939 HE2 TYR 122 HE2 TYR 122 258.453 -1.259 6.529 940 HH TYR 122 HH TYR 122 260.773 -1.383 7.119 941 H TRP 123 HN TRP 123 255.410 2.192 0.720 942 HA TRP 123 HA TRP 123 256.209 1.581 -2.035 943 1HB TRP 123 HB2 TRP 123 253.857 1.049 -2.500 944 2HB TRP 123 HB1 TRP 123 254.526 0.043 -1.224 945 HD1 TRP 123 HD1 TRP 123 253.572 0.425 1.267 946 HE1 TRP 123 HE1 TRP 123 251.353 1.438 2.090 947 HE3 TRP 123 HE3 TRP 123 252.154 2.866 -2.997 948 HZ2 TRP 123 HZ2 TRP 123 249.272 3.070 1.066 949 HZ3 TRP 123 HZ3 TRP 123 250.034 4.116 -2.987 950 HH2 TRP 123 HH2 TRP 123 248.631 4.201 -1.005 951 H PHE 124 HN PHE 124 255.389 4.163 -0.079 952 HA PHE 124 HA PHE 124 253.895 5.729 -1.922 953 1HB PHE 124 HB2 PHE 124 255.130 6.107 0.713 954 2HB PHE 124 HB1 PHE 124 255.135 7.556 -0.284 955 HD1 PHE 124 HD1 PHE 124 253.359 8.972 -0.019 956 HD2 PHE 124 HD2 PHE 124 252.764 4.806 0.603 957 HE1 PHE 124 HE1 PHE 124 251.031 9.406 0.605 958 HE2 PHE 124 HE2 PHE 124 250.425 5.234 1.229 959 HZ PHE 124 HZ PHE 124 249.557 7.538 1.233 960 HA PRO 125 HA PRO 125 258.206 7.868 -2.770 961 1HB PRO 125 HB2 PRO 125 260.357 6.181 -2.420 962 2HB PRO 125 HB1 PRO 125 259.841 7.406 -1.256 963 1HG PRO 125 HG2 PRO 125 259.306 4.468 -1.282 964 2HG PRO 125 HG1 PRO 125 259.676 5.532 0.088 965 1HD PRO 125 HD2 PRO 125 257.179 4.688 -0.430 966 2HD PRO 125 HD1 PRO 125 257.500 6.300 0.239 967 H LEU 126 HN LEU 126 257.476 4.515 -3.358 968 HA LEU 126 HA LEU 126 258.891 4.438 -5.880 969 1HB LEU 126 HB2 LEU 126 257.152 2.509 -4.377 970 2HB LEU 126 HB1 LEU 126 257.558 2.216 -6.057 971 HG LEU 126 HG LEU 126 259.794 2.783 -4.179 972 1HD1 LEU 126 HD11 LEU 126 257.901 0.792 -3.587 973 2HD1 LEU 126 HD12 LEU 126 259.490 1.031 -2.860 974 3HD1 LEU 126 HD13 LEU 126 259.309 -0.034 -4.253 975 1HD2 LEU 126 HD21 LEU 126 259.328 1.354 -6.736 976 2HD2 LEU 126 HD22 LEU 126 260.609 0.756 -5.683 977 3HD2 LEU 126 HD23 LEU 126 260.647 2.424 -6.258 978 H LEU 127 HN LEU 127 255.670 4.977 -4.677 979 HA LEU 127 HA LEU 127 254.219 4.729 -7.081 980 1HB LEU 127 HB2 LEU 127 253.776 6.384 -4.600 981 2HB LEU 127 HB1 LEU 127 252.628 6.336 -5.922 982 HG LEU 127 HG LEU 127 252.896 4.571 -3.706 983 1HD1 LEU 127 HD11 LEU 127 250.782 3.636 -4.752 984 2HD1 LEU 127 HD12 LEU 127 251.009 4.837 -6.023 985 3HD1 LEU 127 HD13 LEU 127 250.780 5.355 -4.354 986 1HD2 LEU 127 HD21 LEU 127 253.036 3.155 -6.363 987 2HD2 LEU 127 HD22 LEU 127 252.869 2.412 -4.774 988 3HD2 LEU 127 HD23 LEU 127 254.360 3.245 -5.203 989 H LEU 128 HN LEU 128 255.403 7.602 -5.385 990 HA LEU 128 HA LEU 128 254.823 9.508 -7.321 991 1HB LEU 128 HB2 LEU 128 256.772 9.314 -5.087 992 2HB LEU 128 HB1 LEU 128 257.034 10.584 -6.268 993 HG LEU 128 HG LEU 128 254.297 10.354 -5.147 994 1HD1 LEU 128 HD11 LEU 128 256.268 10.166 -3.331 995 2HD1 LEU 128 HD12 LEU 128 254.745 11.004 -3.035 996 3HD1 LEU 128 HD13 LEU 128 256.179 11.919 -3.504 997 1HD2 LEU 128 HD21 LEU 128 255.258 12.057 -6.851 998 2HD2 LEU 128 HD22 LEU 128 255.956 12.826 -5.425 999 3HD2 LEU 128 HD23 LEU 128 254.208 12.629 -5.555 1000 H GLN 129 HN GLN 129 257.333 7.131 -7.243 1001 HA GLN 129 HA GLN 129 258.926 8.387 -9.302 1002 1HB GLN 129 HB2 GLN 129 259.747 6.861 -7.374 1003 2HB GLN 129 HB1 GLN 129 259.216 5.537 -8.401 1004 1HG GLN 129 HG2 GLN 129 261.610 6.016 -8.625 1005 2HG GLN 129 HG1 GLN 129 260.732 6.211 -10.141 1006 1HE2 GLN 129 HE21 GLN 129 261.549 7.824 -11.254 1007 2HE2 GLN 129 HE22 GLN 129 262.052 9.352 -10.621 1008 H LYS 130 HN LYS 130 256.022 6.950 -9.424 1009 HA LYS 130 HA LYS 130 254.784 5.850 -10.963 1010 1HB LYS 130 HB2 LYS 130 254.993 6.571 -13.189 1011 2HB LYS 130 HB1 LYS 130 255.595 7.908 -12.223 1012 1HG LYS 130 HG2 LYS 130 257.676 6.031 -13.066 1013 2HG LYS 130 HG1 LYS 130 256.841 6.830 -14.395 1014 1HD LYS 130 HD2 LYS 130 257.575 8.916 -13.786 1015 2HD LYS 130 HD1 LYS 130 257.739 8.479 -12.085 1016 1HE LYS 130 HE2 LYS 130 259.935 8.394 -12.519 1017 2HE LYS 130 HE1 LYS 130 259.571 6.837 -13.262 1018 1HZ LYS 130 HZ1 LYS 130 260.852 8.718 -14.552 1019 2HZ LYS 130 HZ2 LYS 130 259.282 9.234 -14.912 1020 3HZ LYS 130 HZ3 LYS 130 259.781 7.677 -15.347 1021 H LYS 131 HN LYS 131 256.748 4.276 -9.686 1022 HA LYS 131 HA LYS 131 257.378 2.342 -11.821 1023 1HB LYS 131 HB2 LYS 131 258.851 2.708 -9.206 1024 2HB LYS 131 HB1 LYS 131 259.269 1.582 -10.491 1025 1HG LYS 131 HG2 LYS 131 259.315 3.863 -11.887 1026 2HG LYS 131 HG1 LYS 131 259.728 4.489 -10.290 1027 1HD LYS 131 HD2 LYS 131 261.751 3.489 -10.279 1028 2HD LYS 131 HD1 LYS 131 261.151 2.039 -11.088 1029 1HE LYS 131 HE2 LYS 131 262.348 2.814 -12.828 1030 2HE LYS 131 HE1 LYS 131 260.942 3.847 -13.087 1031 1HZ LYS 131 HZ1 LYS 131 263.346 4.615 -11.518 1032 2HZ LYS 131 HZ2 LYS 131 262.022 5.607 -11.874 1033 3HZ LYS 131 HZ3 LYS 131 263.043 5.082 -13.116 1034 H LYS 132 HN LYS 132 257.283 0.076 -11.200 1035 HA LYS 132 HA LYS 132 255.261 -0.383 -9.110 1036 1HB LYS 132 HB2 LYS 132 255.736 -1.608 -11.785 1037 2HB LYS 132 HB1 LYS 132 255.084 -2.636 -10.515 1038 1HG LYS 132 HG2 LYS 132 253.066 -1.670 -10.597 1039 2HG LYS 132 HG1 LYS 132 253.739 -0.049 -10.779 1040 1HD LYS 132 HD2 LYS 132 253.747 -2.057 -13.019 1041 2HD LYS 132 HD1 LYS 132 252.392 -0.963 -12.736 1042 1HE LYS 132 HE2 LYS 132 254.172 0.899 -12.774 1043 2HE LYS 132 HE1 LYS 132 255.209 -0.310 -13.528 1044 1HZ LYS 132 HZ1 LYS 132 253.058 -0.565 -15.034 1045 2HZ LYS 132 HZ2 LYS 132 254.280 0.551 -15.382 1046 3HZ LYS 132 HZ3 LYS 132 252.870 1.058 -14.597 1047 H PHE 133 HN PHE 133 255.633 -1.875 -7.524 1048 HA PHE 133 HA PHE 133 257.939 -3.634 -7.718 1049 1HB PHE 133 HB2 PHE 133 259.194 -2.746 -6.006 1050 2HB PHE 133 HB1 PHE 133 258.514 -1.272 -6.687 1051 HD1 PHE 133 HD1 PHE 133 259.248 -2.820 -3.726 1052 HD2 PHE 133 HD2 PHE 133 256.036 -0.784 -5.634 1053 HE1 PHE 133 HE1 PHE 133 258.305 -2.256 -1.525 1054 HE2 PHE 133 HE2 PHE 133 255.088 -0.214 -3.437 1055 HZ PHE 133 HZ PHE 133 256.223 -0.950 -1.378 1056 H HIS 134 HN HIS 134 258.141 -4.966 -5.662 1057 HA HIS 134 HA HIS 134 255.542 -5.487 -4.403 1058 1HB HIS 134 HB2 HIS 134 256.219 -7.062 -6.406 1059 2HB HIS 134 HB1 HIS 134 257.288 -7.788 -5.211 1060 HD1 HIS 134 HD1 HIS 134 254.088 -8.270 -6.590 1061 HD2 HIS 134 HD2 HIS 134 255.599 -8.410 -2.721 1062 HE1 HIS 134 HE1 HIS 134 252.437 -9.633 -5.273 1063 HE2 HIS 134 HE2 HIS 134 253.324 -9.627 -2.915 1064 H GLY 135 HN GLY 135 255.766 -5.555 -2.225 1065 1HA GLY 135 HA2 GLY 135 258.449 -6.247 -1.186 1066 2HA GLY 135 HA1 GLY 135 257.502 -4.927 -0.525 1067 H TYR 136 HN TYR 136 258.589 -7.323 0.749 1068 HA TYR 136 HA TYR 136 256.076 -8.453 1.791 1069 1HB TYR 136 HB2 TYR 136 257.775 -9.970 0.470 1070 2HB TYR 136 HB1 TYR 136 258.669 -9.944 1.985 1071 HD1 TYR 136 HD1 TYR 136 257.375 -12.334 0.526 1072 HD2 TYR 136 HD2 TYR 136 256.071 -9.852 3.726 1073 HE1 TYR 136 HE1 TYR 136 255.974 -14.169 1.370 1074 HE2 TYR 136 HE2 TYR 136 254.668 -11.681 4.576 1075 HH TYR 136 HH TYR 136 254.718 -14.280 4.396 1076 H PHE 137 HN PHE 137 255.708 -7.547 3.717 1077 HA PHE 137 HA PHE 137 258.011 -6.931 5.443 1078 1HB PHE 137 HB2 PHE 137 255.216 -5.827 5.712 1079 2HB PHE 137 HB1 PHE 137 256.689 -5.232 6.469 1080 HD1 PHE 137 HD1 PHE 137 258.280 -5.644 3.752 1081 HD2 PHE 137 HD2 PHE 137 254.717 -3.599 4.860 1082 HE1 PHE 137 HE1 PHE 137 258.605 -4.076 1.886 1083 HE2 PHE 137 HE2 PHE 137 255.036 -2.029 2.992 1084 HZ PHE 137 HZ PHE 137 256.981 -2.266 1.503 1085 H LYS 138 HN LYS 138 258.296 -8.056 7.253 1086 HA LYS 138 HA LYS 138 256.274 -9.957 8.117 1087 1HB LYS 138 HB2 LYS 138 259.067 -9.976 8.076 1088 2HB LYS 138 HB1 LYS 138 258.654 -9.817 9.778 1089 1HG LYS 138 HG2 LYS 138 256.981 -11.780 9.167 1090 2HG LYS 138 HG1 LYS 138 258.184 -12.066 7.908 1091 1HD LYS 138 HD2 LYS 138 259.702 -12.833 9.373 1092 2HD LYS 138 HD1 LYS 138 259.331 -11.577 10.557 1093 1HE LYS 138 HE2 LYS 138 257.831 -12.866 11.651 1094 2HE LYS 138 HE1 LYS 138 257.258 -13.639 10.173 1095 1HZ LYS 138 HZ1 LYS 138 258.341 -15.373 11.130 1096 2HZ LYS 138 HZ2 LYS 138 259.466 -14.399 11.935 1097 3HZ LYS 138 HZ3 LYS 138 259.645 -14.707 10.281 1098 H PHE 139 HN PHE 139 254.998 -9.663 9.890 1099 HA PHE 139 HA PHE 139 255.442 -7.183 11.402 1100 1HB PHE 139 HB2 PHE 139 253.030 -8.674 10.543 1101 2HB PHE 139 HB1 PHE 139 252.948 -7.926 12.135 1102 HD1 PHE 139 HD1 PHE 139 254.279 -6.956 8.781 1103 HD2 PHE 139 HD2 PHE 139 251.894 -5.900 12.143 1104 HE1 PHE 139 HE1 PHE 139 253.765 -4.790 7.732 1105 HE2 PHE 139 HE2 PHE 139 251.375 -3.732 11.100 1106 HZ PHE 139 HZ PHE 139 252.311 -3.175 8.891 1107 H GLN 140 HN GLN 140 254.771 -7.212 13.699 1108 HA GLN 140 HA GLN 140 255.730 -9.672 14.989 1109 1HB GLN 140 HB2 GLN 140 257.147 -7.959 15.666 1110 2HB GLN 140 HB1 GLN 140 255.862 -6.768 15.688 1111 1HG GLN 140 HG2 GLN 140 256.630 -7.236 17.925 1112 2HG GLN 140 HG1 GLN 140 254.963 -7.769 17.723 1113 1HE2 GLN 140 HE21 GLN 140 254.844 -9.376 19.172 1114 2HE2 GLN 140 HE22 GLN 140 255.838 -10.789 19.163 1115 H GLY 141 HN GLY 141 252.892 -8.093 14.297 1116 1HA GLY 141 HA2 GLY 141 251.298 -9.757 15.879 1117 2HA GLY 141 HA1 GLY 141 251.475 -8.229 16.727 1118 H GLN 142 HN GLN 142 251.154 -6.265 15.114 1119 HA GLN 142 HA GLN 142 249.179 -6.738 13.072 1120 1HB GLN 142 HB2 GLN 142 248.419 -5.756 15.777 1121 2HB GLN 142 HB1 GLN 142 247.629 -5.025 14.389 1122 1HG GLN 142 HG2 GLN 142 247.619 -7.926 15.177 1123 2HG GLN 142 HG1 GLN 142 246.261 -6.803 15.191 1124 1HE2 GLN 142 HE21 GLN 142 246.194 -9.253 13.882 1125 2HE2 GLN 142 HE22 GLN 142 246.089 -8.974 12.180 1126 H ASP 143 HN ASP 143 250.879 -4.375 15.100 1127 HA ASP 143 HA ASP 143 250.926 -2.581 12.763 1128 1HB ASP 143 HB2 ASP 143 250.793 -0.654 14.270 1129 2HB ASP 143 HB1 ASP 143 249.383 -1.694 14.442 1130 H THR 144 HN THR 144 252.880 -4.570 14.174 1131 HA THR 144 HA THR 144 255.127 -2.666 14.289 1132 HB THR 144 HB THR 144 254.698 -5.215 15.838 1133 HG1 THR 144 HG1 THR 144 254.628 -3.912 17.534 1134 1HG2 THR 144 HG21 THR 144 256.923 -4.892 16.795 1135 2HG2 THR 144 HG22 THR 144 257.226 -3.595 15.639 1136 3HG2 THR 144 HG23 THR 144 256.993 -5.246 15.070 1137 H ILE 145 HN ILE 145 256.816 -3.004 12.962 1138 HA ILE 145 HA ILE 145 256.733 -5.445 11.336 1139 HB ILE 145 HB ILE 145 258.025 -2.820 10.604 1140 1HG1 ILE 145 HG12 ILE 145 255.477 -4.072 9.554 1141 2HG1 ILE 145 HG11 ILE 145 255.543 -2.714 10.674 1142 1HG2 ILE 145 HG21 ILE 145 257.701 -4.230 8.295 1143 2HG2 ILE 145 HG22 ILE 145 258.073 -5.513 9.446 1144 3HG2 ILE 145 HG23 ILE 145 259.191 -4.167 9.236 1145 1HD1 ILE 145 HD11 ILE 145 255.128 -1.901 8.461 1146 2HD1 ILE 145 HD12 ILE 145 256.534 -2.762 7.835 1147 3HD1 ILE 145 HD13 ILE 145 256.750 -1.416 8.954 1148 H LEU 146 HN LEU 146 258.459 -6.737 11.174 1149 HA LEU 146 HA LEU 146 260.883 -5.955 12.656 1150 1HB LEU 146 HB2 LEU 146 260.067 -8.812 12.278 1151 2HB LEU 146 HB1 LEU 146 261.129 -8.120 13.488 1152 HG LEU 146 HG LEU 146 258.239 -7.365 13.517 1153 1HD1 LEU 146 HD11 LEU 146 258.987 -10.032 13.509 1154 2HD1 LEU 146 HD12 LEU 146 257.471 -9.363 14.110 1155 3HD1 LEU 146 HD13 LEU 146 258.815 -9.634 15.219 1156 1HD2 LEU 146 HD21 LEU 146 259.768 -8.009 15.954 1157 2HD2 LEU 146 HD22 LEU 146 258.672 -6.668 15.618 1158 3HD2 LEU 146 HD23 LEU 146 260.335 -6.617 15.032 1159 H ASP 147 HN ASP 147 259.590 -6.798 9.657 1160 HA ASP 147 HA ASP 147 262.227 -6.921 8.484 1161 1HB ASP 147 HB2 ASP 147 260.799 -9.315 9.024 1162 2HB ASP 147 HB1 ASP 147 260.732 -9.060 7.283 1163 H TYR 148 HN TYR 148 262.250 -5.977 6.490 1164 HA TYR 148 HA TYR 148 259.716 -5.777 5.051 1165 1HB TYR 148 HB2 TYR 148 259.924 -3.412 4.677 1166 2HB TYR 148 HB1 TYR 148 259.960 -3.724 6.409 1167 HD1 TYR 148 HD1 TYR 148 262.259 -3.793 7.548 1168 HD2 TYR 148 HD2 TYR 148 261.636 -2.180 3.661 1169 HE1 TYR 148 HE1 TYR 148 264.369 -2.546 7.735 1170 HE2 TYR 148 HE2 TYR 148 263.745 -0.929 3.837 1171 HH TYR 148 HH TYR 148 265.446 -0.594 6.781 1172 H THR 149 HN THR 149 259.952 -6.347 3.000 1173 HA THR 149 HA THR 149 262.601 -5.993 1.758 1174 HB THR 149 HB THR 149 261.367 -7.966 0.278 1175 HG1 THR 149 HG1 THR 149 259.825 -8.094 2.073 1176 1HG2 THR 149 HG21 THR 149 263.350 -8.173 2.518 1177 2HG2 THR 149 HG22 THR 149 263.653 -8.162 0.780 1178 3HG2 THR 149 HG23 THR 149 262.869 -9.552 1.531 1179 H LEU 150 HN LEU 150 262.688 -5.239 -0.318 1180 HA LEU 150 HA LEU 150 260.161 -4.507 -1.611 1181 1HB LEU 150 HB2 LEU 150 262.508 -2.690 -1.093 1182 2HB LEU 150 HB1 LEU 150 261.263 -2.328 -2.274 1183 HG LEU 150 HG LEU 150 259.744 -2.800 -0.068 1184 1HD1 LEU 150 HD11 LEU 150 262.102 -2.905 1.108 1185 2HD1 LEU 150 HD12 LEU 150 260.713 -2.150 1.889 1186 3HD1 LEU 150 HD13 LEU 150 261.925 -1.151 1.087 1187 1HD2 LEU 150 HD21 LEU 150 259.223 -0.560 -0.161 1188 2HD2 LEU 150 HD22 LEU 150 259.949 -0.809 -1.748 1189 3HD2 LEU 150 HD23 LEU 150 260.892 -0.072 -0.453 1190 H ARG 151 HN ARG 151 260.089 -5.146 -3.656 1191 HA ARG 151 HA ARG 151 262.622 -5.468 -5.126 1192 1HB ARG 151 HB2 ARG 151 260.222 -7.304 -5.268 1193 2HB ARG 151 HB1 ARG 151 261.691 -7.456 -6.224 1194 1HG ARG 151 HG2 ARG 151 262.071 -7.386 -3.305 1195 2HG ARG 151 HG1 ARG 151 261.233 -8.802 -3.943 1196 1HD ARG 151 HD2 ARG 151 263.870 -7.781 -4.986 1197 2HD ARG 151 HD1 ARG 151 263.713 -9.053 -3.774 1198 HE ARG 151 HE ARG 151 262.178 -9.927 -5.839 1199 1HH1 ARG 151 HH11 ARG 151 265.492 -8.872 -5.563 1200 2HH1 ARG 151 HH12 ARG 151 266.054 -9.887 -6.849 1201 1HH2 ARG 151 HH21 ARG 151 262.913 -11.262 -7.530 1202 2HH2 ARG 151 HH22 ARG 151 264.589 -11.244 -7.966 1203 H GLU 152 HN GLU 152 262.684 -4.193 -6.856 1204 HA GLU 152 HA GLU 152 260.225 -3.045 -7.890 1205 1HB GLU 152 HB2 GLU 152 261.797 -1.714 -9.333 1206 2HB GLU 152 HB1 GLU 152 262.008 -1.494 -7.601 1207 1HG GLU 152 HG2 GLU 152 263.995 -2.707 -7.563 1208 2HG GLU 152 HG1 GLU 152 263.670 -3.462 -9.124 1209 H VAL 153 HN VAL 153 259.399 -3.342 -9.921 1210 HA VAL 153 HA VAL 153 260.661 -5.450 -11.552 1211 HB VAL 153 HB VAL 153 258.384 -6.093 -12.298 1212 1HG1 VAL 153 HG11 VAL 153 259.599 -7.239 -10.434 1213 2HG1 VAL 153 HG12 VAL 153 257.843 -7.395 -10.374 1214 3HG1 VAL 153 HG13 VAL 153 258.664 -6.260 -9.303 1215 1HG2 VAL 153 HG21 VAL 153 256.437 -5.326 -11.060 1216 2HG2 VAL 153 HG22 VAL 153 257.269 -3.961 -11.806 1217 3HG2 VAL 153 HG23 VAL 153 257.456 -4.270 -10.080 1218 H ASP 154 HN ASP 154 260.100 -5.369 -13.864 1219 HA ASP 154 HA ASP 154 259.285 -2.736 -14.840 1220 1HB ASP 154 HB2 ASP 154 261.874 -3.029 -14.593 1221 2HB ASP 154 HB1 ASP 154 261.716 -4.010 -16.047 1222 H THR 155 HN THR 155 258.039 -5.367 -14.828 1223 HA THR 155 HA THR 155 257.760 -5.715 -17.736 1224 HB THR 155 HB THR 155 257.698 -7.945 -15.696 1225 HG1 THR 155 HG1 THR 155 259.805 -7.321 -15.978 1226 1HG2 THR 155 HG21 THR 155 256.312 -8.233 -17.793 1227 2HG2 THR 155 HG22 THR 155 257.523 -9.471 -17.461 1228 3HG2 THR 155 HG23 THR 155 257.839 -8.232 -18.674 1229 H VAL 156 HN VAL 156 255.843 -4.734 -18.065 1230 HA VAL 156 HA VAL 156 253.451 -6.010 -17.344 1231 HB VAL 156 HB VAL 156 253.896 -5.088 -15.114 1232 1HG1 VAL 156 HG11 VAL 156 254.441 -2.940 -14.674 1233 2HG1 VAL 156 HG12 VAL 156 253.423 -2.301 -15.964 1234 3HG1 VAL 156 HG13 VAL 156 255.009 -2.973 -16.343 1235 1HG2 VAL 156 HG21 VAL 156 251.626 -3.550 -16.351 1236 2HG2 VAL 156 HG22 VAL 156 251.743 -4.204 -14.717 1237 3HG2 VAL 156 HG23 VAL 156 251.567 -5.294 -16.092 Start of MODEL 4 1 1H MET 1 HT1 MET 1 239.592 -19.981 4.342 2 2H MET 1 HT2 MET 1 239.888 -21.650 4.611 3 3H MET 1 HT3 MET 1 238.282 -21.085 4.395 4 HA MET 1 HA MET 1 238.817 -22.033 2.401 5 1HB MET 1 HB2 MET 1 239.477 -19.088 2.177 6 2HB MET 1 HB1 MET 1 238.872 -20.118 0.886 7 1HG MET 1 HG2 MET 1 236.760 -20.342 1.936 8 2HG MET 1 HG1 MET 1 237.349 -19.599 3.422 9 1HE MET 1 HE1 MET 1 235.462 -17.785 3.622 10 2HE MET 1 HE2 MET 1 234.684 -18.633 2.286 11 3HE MET 1 HE3 MET 1 234.853 -16.877 2.237 12 H GLY 2 HN GLY 2 241.335 -19.528 2.774 13 1HA GLY 2 HA2 GLY 2 243.332 -21.536 1.964 14 2HA GLY 2 HA1 GLY 2 243.247 -19.997 1.120 15 H ALA 3 HN ALA 3 245.605 -20.651 2.211 16 HA ALA 3 HA ALA 3 245.760 -19.292 4.805 17 1HB ALA 3 HB1 ALA 3 246.942 -21.249 5.026 18 2HB ALA 3 HB2 ALA 3 248.226 -20.130 4.567 19 3HB ALA 3 HB3 ALA 3 247.526 -21.212 3.363 20 H SER 4 HN SER 4 245.207 -17.346 3.282 21 HA SER 4 HA SER 4 247.471 -15.691 3.200 22 1HB SER 4 HB2 SER 4 248.063 -15.555 0.963 23 2HB SER 4 HB1 SER 4 247.734 -17.278 1.138 24 HG SER 4 HG SER 4 246.204 -17.066 -0.272 25 H ARG 5 HN ARG 5 246.185 -14.285 4.268 26 HA ARG 5 HA ARG 5 243.608 -13.500 3.432 27 1HB ARG 5 HB2 ARG 5 245.624 -12.075 5.177 28 2HB ARG 5 HB1 ARG 5 243.950 -11.579 4.983 29 1HG ARG 5 HG2 ARG 5 244.715 -14.307 5.975 30 2HG ARG 5 HG1 ARG 5 244.510 -12.922 7.050 31 1HD ARG 5 HD2 ARG 5 242.213 -12.659 5.916 32 2HD ARG 5 HD1 ARG 5 242.466 -14.309 5.350 33 HE ARG 5 HE ARG 5 242.840 -13.987 8.181 34 1HH1 ARG 5 HH11 ARG 5 240.508 -14.573 5.652 35 2HH1 ARG 5 HH12 ARG 5 239.380 -15.362 6.703 36 1HH2 ARG 5 HH21 ARG 5 241.358 -15.024 9.565 37 2HH2 ARG 5 HH22 ARG 5 239.861 -15.616 8.925 38 H LEU 6 HN LEU 6 243.571 -12.925 1.298 39 HA LEU 6 HA LEU 6 245.417 -10.924 0.300 40 1HB LEU 6 HB2 LEU 6 244.376 -12.987 -0.957 41 2HB LEU 6 HB1 LEU 6 243.052 -11.879 -1.257 42 HG LEU 6 HG LEU 6 245.849 -11.058 -1.942 43 1HD1 LEU 6 HD11 LEU 6 245.092 -11.938 -4.305 44 2HD1 LEU 6 HD12 LEU 6 244.173 -13.083 -3.330 45 3HD1 LEU 6 HD13 LEU 6 245.926 -12.988 -3.160 46 1HD2 LEU 6 HD21 LEU 6 243.410 -10.457 -3.541 47 2HD2 LEU 6 HD22 LEU 6 244.856 -9.484 -3.280 48 3HD2 LEU 6 HD23 LEU 6 243.644 -9.622 -2.007 49 H TYR 7 HN TYR 7 245.086 -8.853 0.527 50 HA TYR 7 HA TYR 7 242.330 -7.824 0.634 51 1HB TYR 7 HB2 TYR 7 244.745 -6.768 2.120 52 2HB TYR 7 HB1 TYR 7 243.132 -6.065 2.156 53 HD1 TYR 7 HD1 TYR 7 244.804 -7.019 4.534 54 HD2 TYR 7 HD2 TYR 7 241.783 -8.923 2.220 55 HE1 TYR 7 HE1 TYR 7 244.232 -8.440 6.457 56 HE2 TYR 7 HE2 TYR 7 241.204 -10.348 4.137 57 HH TYR 7 HH TYR 7 243.076 -10.896 6.653 58 H THR 8 HN THR 8 242.550 -5.250 0.372 59 HA THR 8 HA THR 8 244.225 -4.759 -2.013 60 HB THR 8 HB THR 8 242.425 -3.523 -3.013 61 HG1 THR 8 HG1 THR 8 240.826 -4.152 -0.768 62 1HG2 THR 8 HG21 THR 8 242.026 -5.653 -3.706 63 2HG2 THR 8 HG22 THR 8 240.510 -5.307 -2.876 64 3HG2 THR 8 HG23 THR 8 241.761 -6.256 -2.071 65 H LEU 9 HN LEU 9 244.579 -2.458 -2.459 66 HA LEU 9 HA LEU 9 244.303 -0.645 -0.199 67 1HB LEU 9 HB2 LEU 9 246.516 -2.018 -0.111 68 2HB LEU 9 HB1 LEU 9 247.013 -0.987 -1.439 69 HG LEU 9 HG LEU 9 246.334 -0.155 1.368 70 1HD1 LEU 9 HD11 LEU 9 248.838 -0.119 -0.287 71 2HD1 LEU 9 HD12 LEU 9 248.548 -0.959 1.235 72 3HD1 LEU 9 HD13 LEU 9 248.659 0.800 1.207 73 1HD2 LEU 9 HD21 LEU 9 246.947 2.152 0.545 74 2HD2 LEU 9 HD22 LEU 9 245.376 1.538 0.027 75 3HD2 LEU 9 HD23 LEU 9 246.740 1.524 -1.091 76 H VAL 10 HN VAL 10 243.285 1.004 -1.227 77 HA VAL 10 HA VAL 10 244.340 1.834 -3.832 78 HB VAL 10 HB VAL 10 242.128 1.211 -4.180 79 1HG1 VAL 10 HG11 VAL 10 240.330 2.346 -2.624 80 2HG1 VAL 10 HG12 VAL 10 241.670 2.254 -1.484 81 3HG1 VAL 10 HG13 VAL 10 241.072 0.790 -2.262 82 1HG2 VAL 10 HG21 VAL 10 242.669 3.447 -5.085 83 2HG2 VAL 10 HG22 VAL 10 241.947 4.164 -3.645 84 3HG2 VAL 10 HG23 VAL 10 240.951 3.231 -4.759 85 H LEU 11 HN LEU 11 245.274 3.665 -4.015 86 HA LEU 11 HA LEU 11 244.746 5.799 -2.065 87 1HB LEU 11 HB2 LEU 11 247.200 4.403 -2.694 88 2HB LEU 11 HB1 LEU 11 247.361 6.113 -3.038 89 HG LEU 11 HG LEU 11 246.798 4.789 -0.395 90 1HD1 LEU 11 HD11 LEU 11 248.857 5.486 0.243 91 2HD1 LEU 11 HD12 LEU 11 248.772 6.967 -0.710 92 3HD1 LEU 11 HD13 LEU 11 249.157 5.435 -1.495 93 1HD2 LEU 11 HD21 LEU 11 245.520 6.488 0.226 94 2HD2 LEU 11 HD22 LEU 11 245.789 7.324 -1.304 95 3HD2 LEU 11 HD23 LEU 11 246.918 7.545 0.032 96 H VAL 12 HN VAL 12 243.748 7.380 -3.165 97 HA VAL 12 HA VAL 12 244.100 7.623 -6.015 98 HB VAL 12 HB VAL 12 242.543 9.488 -4.232 99 1HG1 VAL 12 HG11 VAL 12 241.161 9.500 -6.454 100 2HG1 VAL 12 HG12 VAL 12 242.682 8.957 -7.163 101 3HG1 VAL 12 HG13 VAL 12 242.610 10.493 -6.301 102 1HG2 VAL 12 HG21 VAL 12 240.736 7.748 -5.395 103 2HG2 VAL 12 HG22 VAL 12 241.257 7.737 -3.710 104 3HG2 VAL 12 HG23 VAL 12 242.059 6.698 -4.887 105 H LEU 13 HN LEU 13 246.434 8.057 -5.756 106 HA LEU 13 HA LEU 13 247.099 10.782 -4.944 107 1HB LEU 13 HB2 LEU 13 248.449 8.711 -4.320 108 2HB LEU 13 HB1 LEU 13 249.001 8.718 -5.982 109 HG LEU 13 HG LEU 13 250.639 10.062 -5.357 110 1HD1 LEU 13 HD11 LEU 13 250.135 12.432 -4.760 111 2HD1 LEU 13 HD12 LEU 13 248.428 12.007 -4.791 112 3HD1 LEU 13 HD13 LEU 13 249.399 11.860 -6.255 113 1HD2 LEU 13 HD21 LEU 13 251.012 9.675 -3.197 114 2HD2 LEU 13 HD22 LEU 13 249.293 9.710 -2.810 115 3HD2 LEU 13 HD23 LEU 13 250.206 11.217 -2.909 116 H GLN 14 HN GLN 14 247.019 12.345 -6.380 117 HA GLN 14 HA GLN 14 247.348 11.703 -9.229 118 1HB GLN 14 HB2 GLN 14 245.768 13.738 -7.738 119 2HB GLN 14 HB1 GLN 14 246.406 14.205 -9.309 120 1HG GLN 14 HG2 GLN 14 245.017 12.830 -10.439 121 2HG GLN 14 HG1 GLN 14 245.020 11.603 -9.173 122 1HE2 GLN 14 HE21 GLN 14 243.816 14.835 -9.939 123 2HE2 GLN 14 HE22 GLN 14 242.349 14.696 -9.038 124 HA PRO 15 HA PRO 15 251.167 13.882 -9.514 125 1HB PRO 15 HB2 PRO 15 250.201 15.309 -11.909 126 2HB PRO 15 HB1 PRO 15 251.543 14.175 -11.741 127 1HG PRO 15 HG2 PRO 15 249.282 13.484 -13.000 128 2HG PRO 15 HG1 PRO 15 250.188 12.322 -12.014 129 1HD PRO 15 HD2 PRO 15 247.697 13.842 -11.343 130 2HD PRO 15 HD1 PRO 15 248.114 12.151 -10.992 131 H GLN 16 HN GLN 16 248.937 15.239 -8.031 132 HA GLN 16 HA GLN 16 250.169 17.815 -7.815 133 1HB GLN 16 HB2 GLN 16 247.259 17.679 -8.631 134 2HB GLN 16 HB1 GLN 16 248.169 19.136 -8.262 135 1HG GLN 16 HG2 GLN 16 249.656 18.603 -10.193 136 2HG GLN 16 HG1 GLN 16 248.554 17.289 -10.602 137 1HE2 GLN 16 HE21 GLN 16 246.121 18.384 -10.162 138 2HE2 GLN 16 HE22 GLN 16 245.855 19.713 -11.235 139 H ARG 17 HN ARG 17 247.431 15.735 -6.950 140 HA ARG 17 HA ARG 17 247.864 16.435 -4.145 141 1HB ARG 17 HB2 ARG 17 245.331 16.532 -3.864 142 2HB ARG 17 HB1 ARG 17 246.095 17.914 -4.634 143 1HG ARG 17 HG2 ARG 17 245.503 16.419 -6.800 144 2HG ARG 17 HG1 ARG 17 244.191 15.955 -5.716 145 1HD ARG 17 HD2 ARG 17 243.806 18.424 -5.336 146 2HD ARG 17 HD1 ARG 17 244.918 18.714 -6.673 147 HE ARG 17 HE ARG 17 242.779 16.913 -7.328 148 1HH1 ARG 17 HH11 ARG 17 243.731 20.264 -7.127 149 2HH1 ARG 17 HH12 ARG 17 242.563 20.796 -8.290 150 1HH2 ARG 17 HH21 ARG 17 241.242 17.610 -8.859 151 2HH2 ARG 17 HH22 ARG 17 241.150 19.289 -9.272 152 H VAL 18 HN VAL 18 246.787 14.938 -2.642 153 HA VAL 18 HA VAL 18 246.266 12.286 -3.824 154 HB VAL 18 HB VAL 18 248.490 12.180 -2.915 155 1HG1 VAL 18 HG11 VAL 18 249.190 13.300 -1.122 156 2HG1 VAL 18 HG12 VAL 18 247.902 12.638 -0.116 157 3HG1 VAL 18 HG13 VAL 18 247.606 14.074 -1.095 158 1HG2 VAL 18 HG21 VAL 18 248.243 10.389 -1.307 159 2HG2 VAL 18 HG22 VAL 18 247.005 10.243 -2.555 160 3HG2 VAL 18 HG23 VAL 18 246.586 10.886 -0.967 161 H LEU 19 HN LEU 19 244.932 10.890 -2.504 162 HA LEU 19 HA LEU 19 243.269 12.367 -0.569 163 1HB LEU 19 HB2 LEU 19 242.111 11.924 -2.716 164 2HB LEU 19 HB1 LEU 19 242.359 10.207 -2.468 165 HG LEU 19 HG LEU 19 240.906 10.198 -0.553 166 1HD1 LEU 19 HD11 LEU 19 241.031 12.074 0.683 167 2HD1 LEU 19 HD12 LEU 19 239.652 12.567 -0.300 168 3HD1 LEU 19 HD13 LEU 19 241.275 13.114 -0.721 169 1HD2 LEU 19 HD21 LEU 19 238.963 10.278 -1.711 170 2HD2 LEU 19 HD22 LEU 19 240.061 10.462 -3.078 171 3HD2 LEU 19 HD23 LEU 19 239.292 11.881 -2.369 172 H LEU 20 HN LEU 20 243.553 11.602 1.413 173 HA LEU 20 HA LEU 20 244.021 8.710 1.744 174 1HB LEU 20 HB2 LEU 20 245.179 11.076 3.168 175 2HB LEU 20 HB1 LEU 20 245.051 9.535 3.995 176 HG LEU 20 HG LEU 20 246.467 9.852 1.360 177 1HD1 LEU 20 HD11 LEU 20 247.661 11.258 2.852 178 2HD1 LEU 20 HD12 LEU 20 248.558 9.742 2.755 179 3HD1 LEU 20 HD13 LEU 20 247.544 10.080 4.159 180 1HD2 LEU 20 HD21 LEU 20 245.774 7.595 1.863 181 2HD2 LEU 20 HD22 LEU 20 246.492 7.703 3.470 182 3HD2 LEU 20 HD23 LEU 20 247.523 7.733 2.040 183 H GLY 21 HN GLY 21 242.803 7.602 3.205 184 1HA GLY 21 HA2 GLY 21 240.437 8.979 4.191 185 2HA GLY 21 HA1 GLY 21 240.699 7.243 4.168 186 H MET 22 HN MET 22 240.197 9.697 6.182 187 HA MET 22 HA MET 22 241.980 8.656 8.278 188 1HB MET 22 HB2 MET 22 242.297 11.031 7.916 189 2HB MET 22 HB1 MET 22 240.570 11.321 8.069 190 1HG MET 22 HG2 MET 22 240.592 10.841 10.378 191 2HG MET 22 HG1 MET 22 242.218 10.166 10.295 192 1HE MET 22 HE1 MET 22 244.385 13.256 9.551 193 2HE MET 22 HE2 MET 22 244.010 11.625 8.995 194 3HE MET 22 HE3 MET 22 244.510 11.896 10.663 195 H LYS 23 HN LYS 23 241.096 7.946 10.241 196 HA LYS 23 HA LYS 23 238.262 7.317 10.118 197 1HB LYS 23 HB2 LYS 23 240.536 6.441 11.877 198 2HB LYS 23 HB1 LYS 23 238.871 6.110 12.328 199 1HG LYS 23 HG2 LYS 23 239.639 5.352 9.588 200 2HG LYS 23 HG1 LYS 23 240.395 4.434 10.892 201 1HD LYS 23 HD2 LYS 23 237.429 4.854 10.524 202 2HD LYS 23 HD1 LYS 23 238.316 3.382 10.124 203 1HE LYS 23 HE2 LYS 23 239.065 3.785 12.710 204 2HE LYS 23 HE1 LYS 23 237.412 4.399 12.724 205 1HZ LYS 23 HZ1 LYS 23 236.926 2.245 13.061 206 2HZ LYS 23 HZ2 LYS 23 238.375 1.683 12.394 207 3HZ LYS 23 HZ3 LYS 23 237.092 2.121 11.382 208 H LYS 24 HN LYS 24 236.757 7.967 11.676 209 HA LYS 24 HA LYS 24 237.491 10.446 13.006 210 1HB LYS 24 HB2 LYS 24 234.932 9.180 12.168 211 2HB LYS 24 HB1 LYS 24 234.883 10.253 13.561 212 1HG LYS 24 HG2 LYS 24 234.991 12.059 12.281 213 2HG LYS 24 HG1 LYS 24 236.379 11.427 11.392 214 1HD LYS 24 HD2 LYS 24 235.068 10.472 9.760 215 2HD LYS 24 HD1 LYS 24 233.671 10.315 10.826 216 1HE LYS 24 HE2 LYS 24 233.555 12.072 8.971 217 2HE LYS 24 HE1 LYS 24 233.098 12.571 10.599 218 1HZ LYS 24 HZ1 LYS 24 234.824 13.974 10.739 219 2HZ LYS 24 HZ2 LYS 24 234.835 13.890 9.050 220 3HZ LYS 24 HZ3 LYS 24 235.896 12.929 9.949 221 H ARG 25 HN ARG 25 236.587 7.161 13.706 222 HA ARG 25 HA ARG 25 237.651 7.259 16.300 223 1HB ARG 25 HB2 ARG 25 235.522 6.776 17.558 224 2HB ARG 25 HB1 ARG 25 235.706 8.433 17.002 225 1HG ARG 25 HG2 ARG 25 234.150 6.400 15.440 226 2HG ARG 25 HG1 ARG 25 233.424 7.357 16.733 227 1HD ARG 25 HD2 ARG 25 234.583 9.327 15.381 228 2HD ARG 25 HD1 ARG 25 234.382 8.185 14.053 229 HE ARG 25 HE ARG 25 232.145 8.634 14.075 230 1HH1 ARG 25 HH11 ARG 25 233.495 9.619 17.138 231 2HH1 ARG 25 HH12 ARG 25 232.023 10.340 17.697 232 1HH2 ARG 25 HH21 ARG 25 230.207 9.581 14.809 233 2HH2 ARG 25 HH22 ARG 25 230.156 10.318 16.376 234 H GLY 26 HN GLY 26 238.640 5.348 16.150 235 1HA GLY 26 HA2 GLY 26 237.300 2.923 16.411 236 2HA GLY 26 HA1 GLY 26 237.623 3.138 14.697 237 H PHE 27 HN PHE 27 239.424 2.214 14.007 238 HA PHE 27 HA PHE 27 241.533 1.619 15.953 239 1HB PHE 27 HB2 PHE 27 240.598 0.360 13.432 240 2HB PHE 27 HB1 PHE 27 242.323 0.267 13.770 241 HD1 PHE 27 HD1 PHE 27 243.167 -1.257 15.338 242 HD2 PHE 27 HD2 PHE 27 238.978 -0.540 15.127 243 HE1 PHE 27 HE1 PHE 27 242.770 -3.163 16.844 244 HE2 PHE 27 HE2 PHE 27 238.573 -2.444 16.634 245 HZ PHE 27 HZ PHE 27 240.470 -3.757 17.494 246 H GLY 28 HN GLY 28 241.067 4.262 14.593 247 1HA GLY 28 HA2 GLY 28 243.730 5.020 14.243 248 2HA GLY 28 HA1 GLY 28 243.080 4.672 12.649 249 H ALA 29 HN ALA 29 241.174 6.018 15.274 250 HA ALA 29 HA ALA 29 240.054 8.078 13.787 251 1HB ALA 29 HB1 ALA 29 239.607 7.094 16.222 252 2HB ALA 29 HB2 ALA 29 238.977 8.646 15.672 253 3HB ALA 29 HB3 ALA 29 240.436 8.587 16.660 254 H GLY 30 HN GLY 30 241.324 9.502 12.694 255 1HA GLY 30 HA2 GLY 30 242.356 11.669 12.824 256 2HA GLY 30 HA1 GLY 30 243.124 11.169 14.322 257 H ARG 31 HN ARG 31 243.093 8.910 11.724 258 HA ARG 31 HA ARG 31 245.834 9.649 10.966 259 1HB ARG 31 HB2 ARG 31 244.829 6.964 11.883 260 2HB ARG 31 HB1 ARG 31 246.241 7.101 10.844 261 1HG ARG 31 HG2 ARG 31 247.194 8.672 12.593 262 2HG ARG 31 HG1 ARG 31 245.886 8.123 13.642 263 1HD ARG 31 HD2 ARG 31 246.834 5.753 12.777 264 2HD ARG 31 HD1 ARG 31 248.312 6.714 12.731 265 HE ARG 31 HE ARG 31 246.895 5.822 15.066 266 1HH1 ARG 31 HH11 ARG 31 249.092 8.220 13.801 267 2HH1 ARG 31 HH12 ARG 31 249.784 8.582 15.346 268 1HH2 ARG 31 HH21 ARG 31 247.803 6.297 17.098 269 2HH2 ARG 31 HH22 ARG 31 249.053 7.490 17.219 270 H TRP 32 HN TRP 32 246.160 9.671 8.827 271 HA TRP 32 HA TRP 32 243.972 8.811 7.104 272 1HB TRP 32 HB2 TRP 32 246.177 9.893 5.604 273 2HB TRP 32 HB1 TRP 32 244.540 10.505 5.767 274 HD1 TRP 32 HD1 TRP 32 247.814 10.633 7.872 275 HE1 TRP 32 HE1 TRP 32 247.990 12.989 8.888 276 HE3 TRP 32 HE3 TRP 32 243.451 12.623 6.097 277 HZ2 TRP 32 HZ2 TRP 32 246.499 15.380 8.919 278 HZ3 TRP 32 HZ3 TRP 32 242.904 14.953 6.665 279 HH2 TRP 32 HH2 TRP 32 244.396 16.303 8.046 280 H ASN 33 HN ASN 33 244.308 7.475 5.243 281 HA ASN 33 HA ASN 33 246.710 6.148 4.664 282 1HB ASN 33 HB2 ASN 33 246.274 3.927 5.597 283 2HB ASN 33 HB1 ASN 33 246.387 5.127 6.882 284 1HD2 ASN 33 HD21 ASN 33 244.288 3.000 5.120 285 2HD2 ASN 33 HD22 ASN 33 242.945 3.099 6.201 286 H GLY 34 HN GLY 34 246.375 4.266 3.192 287 1HA GLY 34 HA2 GLY 34 244.516 4.889 1.186 288 2HA GLY 34 HA1 GLY 34 245.409 3.380 1.307 289 H PHE 35 HN PHE 35 242.890 3.315 0.303 290 HA PHE 35 HA PHE 35 241.166 2.433 2.508 291 1HB PHE 35 HB2 PHE 35 240.177 2.502 -0.303 292 2HB PHE 35 HB1 PHE 35 239.335 2.877 1.192 293 HD1 PHE 35 HD1 PHE 35 240.953 4.210 -1.665 294 HD2 PHE 35 HD2 PHE 35 240.000 5.047 2.397 295 HE1 PHE 35 HE1 PHE 35 241.279 6.611 -2.087 296 HE2 PHE 35 HE2 PHE 35 240.322 7.451 1.981 297 HZ PHE 35 HZ PHE 35 240.963 8.235 -0.263 298 H GLY 36 HN GLY 36 241.766 0.388 3.017 299 1HA GLY 36 HA2 GLY 36 242.009 -1.539 0.801 300 2HA GLY 36 HA1 GLY 36 242.737 -1.738 2.387 301 H GLY 37 HN GLY 37 241.198 -3.706 1.128 302 1HA GLY 37 HA2 GLY 37 239.065 -3.979 3.115 303 2HA GLY 37 HA1 GLY 37 238.616 -4.101 1.419 304 H LYS 38 HN LYS 38 238.354 -6.145 0.820 305 HA LYS 38 HA LYS 38 240.422 -8.071 1.134 306 1HB LYS 38 HB2 LYS 38 239.268 -9.665 2.538 307 2HB LYS 38 HB1 LYS 38 239.426 -8.140 3.398 308 1HG LYS 38 HG2 LYS 38 237.054 -7.647 2.552 309 2HG LYS 38 HG1 LYS 38 236.977 -9.374 2.198 310 1HD LYS 38 HD2 LYS 38 237.983 -8.689 4.876 311 2HD LYS 38 HD1 LYS 38 236.296 -8.264 4.578 312 1HE LYS 38 HE2 LYS 38 235.964 -10.616 3.750 313 2HE LYS 38 HE1 LYS 38 237.583 -10.977 4.347 314 1HZ LYS 38 HZ1 LYS 38 236.592 -9.929 6.525 315 2HZ LYS 38 HZ2 LYS 38 236.350 -11.561 6.148 316 3HZ LYS 38 HZ3 LYS 38 235.127 -10.433 5.842 317 H VAL 39 HN VAL 39 240.230 -9.721 -0.316 318 HA VAL 39 HA VAL 39 238.224 -9.447 -2.347 319 HB VAL 39 HB VAL 39 240.104 -11.790 -2.141 320 1HG1 VAL 39 HG11 VAL 39 238.398 -11.783 -3.916 321 2HG1 VAL 39 HG12 VAL 39 240.035 -11.699 -4.564 322 3HG1 VAL 39 HG13 VAL 39 239.038 -10.247 -4.502 323 1HG2 VAL 39 HG21 VAL 39 241.773 -10.292 -1.981 324 2HG2 VAL 39 HG22 VAL 39 240.768 -8.954 -2.541 325 3HG2 VAL 39 HG23 VAL 39 241.472 -10.077 -3.706 326 H GLN 40 HN GLN 40 236.213 -10.105 -1.936 327 HA GLN 40 HA GLN 40 235.318 -11.868 -0.041 328 1HB GLN 40 HB2 GLN 40 234.123 -11.337 -2.766 329 2HB GLN 40 HB1 GLN 40 233.278 -12.115 -1.435 330 1HG GLN 40 HG2 GLN 40 234.480 -9.412 -1.052 331 2HG GLN 40 HG1 GLN 40 232.940 -9.584 -1.894 332 1HE2 GLN 40 HE21 GLN 40 231.523 -8.818 -0.461 333 2HE2 GLN 40 HE22 GLN 40 231.315 -9.412 1.148 334 H GLU 41 HN GLU 41 234.039 -13.966 -0.656 335 HA GLU 41 HA GLU 41 235.986 -15.907 -1.362 336 1HB GLU 41 HB2 GLU 41 233.866 -16.061 0.187 337 2HB GLU 41 HB1 GLU 41 233.066 -16.550 -1.301 338 1HG GLU 41 HG2 GLU 41 235.598 -17.917 -0.614 339 2HG GLU 41 HG1 GLU 41 234.183 -18.284 0.370 340 H GLY 42 HN GLY 42 236.320 -14.683 -3.530 341 1HA GLY 42 HA2 GLY 42 236.319 -15.863 -5.727 342 2HA GLY 42 HA1 GLY 42 234.574 -15.940 -5.555 343 H GLU 43 HN GLU 43 236.783 -13.204 -4.944 344 HA GLU 43 HA GLU 43 235.500 -11.806 -7.173 345 1HB GLU 43 HB2 GLU 43 234.989 -9.948 -5.953 346 2HB GLU 43 HB1 GLU 43 234.845 -11.139 -4.673 347 1HG GLU 43 HG2 GLU 43 236.927 -10.535 -3.747 348 2HG GLU 43 HG1 GLU 43 237.375 -9.599 -5.173 349 H THR 44 HN THR 44 236.879 -9.762 -7.666 350 HA THR 44 HA THR 44 239.630 -10.733 -7.860 351 HB THR 44 HB THR 44 239.832 -9.166 -9.722 352 HG1 THR 44 HG1 THR 44 238.090 -7.940 -10.360 353 1HG2 THR 44 HG21 THR 44 237.733 -11.228 -9.631 354 2HG2 THR 44 HG22 THR 44 239.132 -11.079 -10.693 355 3HG2 THR 44 HG23 THR 44 237.683 -10.122 -11.003 356 H ILE 45 HN ILE 45 241.358 -9.559 -7.167 357 HA ILE 45 HA ILE 45 241.110 -7.966 -4.947 358 HB ILE 45 HB ILE 45 243.390 -7.613 -6.879 359 1HG1 ILE 45 HG12 ILE 45 244.225 -9.551 -5.148 360 2HG1 ILE 45 HG11 ILE 45 242.544 -10.008 -5.399 361 1HG2 ILE 45 HG21 ILE 45 244.624 -7.486 -4.658 362 2HG2 ILE 45 HG22 ILE 45 243.030 -7.329 -3.920 363 3HG2 ILE 45 HG23 ILE 45 243.585 -6.127 -5.087 364 1HD1 ILE 45 HD11 ILE 45 243.484 -11.161 -7.101 365 2HD1 ILE 45 HD12 ILE 45 244.826 -10.030 -7.277 366 3HD1 ILE 45 HD13 ILE 45 243.239 -9.627 -7.934 367 H GLU 46 HN GLU 46 241.021 -7.026 -8.321 368 HA GLU 46 HA GLU 46 241.179 -4.200 -7.834 369 1HB GLU 46 HB2 GLU 46 241.657 -5.560 -10.030 370 2HB GLU 46 HB1 GLU 46 239.927 -5.385 -10.290 371 1HG GLU 46 HG2 GLU 46 240.540 -2.842 -9.736 372 2HG GLU 46 HG1 GLU 46 242.079 -3.373 -10.412 373 H ASP 47 HN ASP 47 238.709 -6.627 -7.898 374 HA ASP 47 HA ASP 47 236.528 -4.749 -8.045 375 1HB ASP 47 HB2 ASP 47 236.772 -7.719 -7.739 376 2HB ASP 47 HB1 ASP 47 235.262 -6.943 -7.273 377 H GLY 48 HN GLY 48 238.256 -6.609 -5.616 378 1HA GLY 48 HA2 GLY 48 236.533 -5.918 -3.436 379 2HA GLY 48 HA1 GLY 48 238.164 -6.563 -3.306 380 H ALA 49 HN ALA 49 239.399 -4.498 -4.868 381 HA ALA 49 HA ALA 49 239.782 -2.530 -2.814 382 1HB ALA 49 HB1 ALA 49 240.881 -2.058 -5.519 383 2HB ALA 49 HB2 ALA 49 241.415 -3.523 -4.696 384 3HB ALA 49 HB3 ALA 49 241.661 -1.949 -3.941 385 H ARG 50 HN ARG 50 238.099 -2.764 -5.872 386 HA ARG 50 HA ARG 50 237.509 0.028 -6.061 387 1HB ARG 50 HB2 ARG 50 236.676 -2.434 -7.534 388 2HB ARG 50 HB1 ARG 50 235.723 -0.968 -7.727 389 1HG ARG 50 HG2 ARG 50 237.831 0.212 -8.371 390 2HG ARG 50 HG1 ARG 50 238.632 -1.359 -8.376 391 1HD ARG 50 HD2 ARG 50 237.968 -0.793 -10.622 392 2HD ARG 50 HD1 ARG 50 236.997 -2.148 -10.051 393 HE ARG 50 HE ARG 50 236.082 0.550 -10.617 394 1HH1 ARG 50 HH11 ARG 50 235.343 -2.568 -9.226 395 2HH1 ARG 50 HH12 ARG 50 233.631 -2.332 -9.303 396 1HH2 ARG 50 HH21 ARG 50 233.830 0.858 -10.713 397 2HH2 ARG 50 HH22 ARG 50 232.772 -0.390 -10.145 398 H ARG 51 HN ARG 51 235.533 -2.847 -5.348 399 HA ARG 51 HA ARG 51 233.175 -1.479 -4.712 400 1HB ARG 51 HB2 ARG 51 233.801 -4.074 -5.004 401 2HB ARG 51 HB1 ARG 51 233.753 -3.993 -3.249 402 1HG ARG 51 HG2 ARG 51 231.574 -4.412 -3.503 403 2HG ARG 51 HG1 ARG 51 231.459 -2.696 -3.900 404 1HD ARG 51 HD2 ARG 51 230.465 -3.464 -5.770 405 2HD ARG 51 HD1 ARG 51 232.127 -3.699 -6.309 406 HE ARG 51 HE ARG 51 231.035 -5.957 -4.906 407 1HH1 ARG 51 HH11 ARG 51 231.337 -4.391 -8.010 408 2HH1 ARG 51 HH12 ARG 51 231.092 -5.849 -8.910 409 1HH2 ARG 51 HH21 ARG 51 230.712 -7.877 -6.088 410 2HH2 ARG 51 HH22 ARG 51 230.735 -7.829 -7.819 411 H GLU 52 HN GLU 52 235.970 -2.283 -2.753 412 HA GLU 52 HA GLU 52 234.709 -1.397 -0.303 413 1HB GLU 52 HB2 GLU 52 237.551 -2.238 -0.895 414 2HB GLU 52 HB1 GLU 52 236.943 -1.832 0.704 415 1HG GLU 52 HG2 GLU 52 235.455 -3.897 -0.791 416 2HG GLU 52 HG1 GLU 52 237.069 -4.329 -0.230 417 H LEU 53 HN LEU 53 236.567 -0.051 -2.853 418 HA LEU 53 HA LEU 53 237.739 2.107 -1.436 419 1HB LEU 53 HB2 LEU 53 238.737 1.562 -3.488 420 2HB LEU 53 HB1 LEU 53 237.198 1.529 -4.332 421 HG LEU 53 HG LEU 53 237.043 3.977 -4.088 422 1HD1 LEU 53 HD11 LEU 53 238.889 3.631 -2.100 423 2HD1 LEU 53 HD12 LEU 53 238.434 5.175 -2.820 424 3HD1 LEU 53 HD13 LEU 53 239.856 4.315 -3.406 425 1HD2 LEU 53 HD21 LEU 53 239.250 4.388 -5.507 426 2HD2 LEU 53 HD22 LEU 53 237.858 3.527 -6.166 427 3HD2 LEU 53 HD23 LEU 53 239.242 2.624 -5.550 428 H GLN 54 HN GLN 54 234.848 1.796 -3.459 429 HA GLN 54 HA GLN 54 233.998 4.468 -3.285 430 1HB GLN 54 HB2 GLN 54 232.905 3.288 -4.936 431 2HB GLN 54 HB1 GLN 54 232.680 1.869 -3.925 432 1HG GLN 54 HG2 GLN 54 230.904 2.951 -2.716 433 2HG GLN 54 HG1 GLN 54 231.185 4.460 -3.583 434 1HE2 GLN 54 HE21 GLN 54 229.499 4.784 -4.851 435 2HE2 GLN 54 HE22 GLN 54 228.788 3.620 -5.911 436 H GLU 55 HN GLU 55 233.783 1.827 -1.064 437 HA GLU 55 HA GLU 55 231.707 3.006 0.547 438 1HB GLU 55 HB2 GLU 55 233.386 0.535 0.742 439 2HB GLU 55 HB1 GLU 55 232.452 1.078 2.129 440 1HG GLU 55 HG2 GLU 55 230.934 0.987 -0.364 441 2HG GLU 55 HG1 GLU 55 231.548 -0.577 0.168 442 H GLU 56 HN GLU 56 235.174 3.125 0.488 443 HA GLU 56 HA GLU 56 235.442 3.818 3.249 444 1HB GLU 56 HB2 GLU 56 237.208 3.278 1.024 445 2HB GLU 56 HB1 GLU 56 237.763 4.662 1.959 446 1HG GLU 56 HG2 GLU 56 236.929 2.475 3.662 447 2HG GLU 56 HG1 GLU 56 238.192 1.989 2.532 448 H SER 57 HN SER 57 235.508 5.714 0.229 449 HA SER 57 HA SER 57 235.083 8.099 1.898 450 1HB SER 57 HB2 SER 57 237.051 7.814 -0.376 451 2HB SER 57 HB1 SER 57 236.560 9.369 0.298 452 HG SER 57 HG SER 57 238.533 8.315 1.175 453 H GLY 58 HN GLY 58 233.287 6.395 0.209 454 1HA GLY 58 HA2 GLY 58 231.594 6.675 -1.316 455 2HA GLY 58 HA1 GLY 58 231.631 8.359 -0.818 456 H LEU 59 HN LEU 59 234.556 7.194 -2.161 457 HA LEU 59 HA LEU 59 233.967 8.627 -4.656 458 1HB LEU 59 HB2 LEU 59 236.581 8.058 -3.271 459 2HB LEU 59 HB1 LEU 59 236.450 8.783 -4.862 460 HG LEU 59 HG LEU 59 235.856 9.956 -2.190 461 1HD1 LEU 59 HD11 LEU 59 236.819 11.536 -4.483 462 2HD1 LEU 59 HD12 LEU 59 237.886 10.241 -3.937 463 3HD1 LEU 59 HD13 LEU 59 237.378 11.501 -2.811 464 1HD2 LEU 59 HD21 LEU 59 233.734 10.195 -3.368 465 2HD2 LEU 59 HD22 LEU 59 234.569 10.879 -4.761 466 3HD2 LEU 59 HD23 LEU 59 234.550 11.751 -3.228 467 H THR 60 HN THR 60 233.326 7.241 -6.110 468 HA THR 60 HA THR 60 234.445 4.576 -6.277 469 HB THR 60 HB THR 60 232.685 5.434 -8.455 470 HG1 THR 60 HG1 THR 60 230.867 5.706 -7.168 471 1HG2 THR 60 HG21 THR 60 231.468 3.499 -6.816 472 2HG2 THR 60 HG22 THR 60 233.184 3.103 -6.893 473 3HG2 THR 60 HG23 THR 60 232.248 3.267 -8.379 474 H VAL 61 HN VAL 61 235.502 3.776 -8.193 475 HA VAL 61 HA VAL 61 236.723 5.928 -9.798 476 HB VAL 61 HB VAL 61 238.765 4.621 -9.955 477 1HG1 VAL 61 HG11 VAL 61 239.389 4.668 -7.480 478 2HG1 VAL 61 HG12 VAL 61 237.735 5.212 -7.198 479 3HG1 VAL 61 HG13 VAL 61 238.820 6.174 -8.202 480 1HG2 VAL 61 HG21 VAL 61 237.080 2.550 -8.774 481 2HG2 VAL 61 HG22 VAL 61 238.661 2.694 -8.005 482 3HG2 VAL 61 HG23 VAL 61 238.548 2.404 -9.740 483 H ASP 62 HN ASP 62 236.934 5.647 -11.961 484 HA ASP 62 HA ASP 62 235.268 3.633 -13.173 485 1HB ASP 62 HB2 ASP 62 236.960 5.849 -14.346 486 2HB ASP 62 HB1 ASP 62 235.970 4.759 -15.312 487 H ALA 63 HN ALA 63 238.596 4.023 -12.410 488 HA ALA 63 HA ALA 63 239.303 1.412 -13.049 489 1HB ALA 63 HB1 ALA 63 240.894 2.080 -15.013 490 2HB ALA 63 HB2 ALA 63 239.730 3.385 -15.248 491 3HB ALA 63 HB3 ALA 63 239.201 1.704 -15.331 492 H LEU 64 HN LEU 64 240.468 1.451 -11.165 493 HA LEU 64 HA LEU 64 242.243 3.482 -10.350 494 1HB LEU 64 HB2 LEU 64 242.267 0.530 -9.693 495 2HB LEU 64 HB1 LEU 64 243.206 1.748 -8.856 496 HG LEU 64 HG LEU 64 240.469 2.549 -8.830 497 1HD1 LEU 64 HD11 LEU 64 239.861 0.254 -9.177 498 2HD1 LEU 64 HD12 LEU 64 239.567 0.672 -7.489 499 3HD1 LEU 64 HD13 LEU 64 240.988 -0.276 -7.928 500 1HD2 LEU 64 HD21 LEU 64 242.641 2.676 -7.191 501 2HD2 LEU 64 HD22 LEU 64 241.636 1.487 -6.364 502 3HD2 LEU 64 HD23 LEU 64 240.994 3.091 -6.721 503 H HIS 65 HN HIS 65 244.668 2.553 -9.845 504 HA HIS 65 HA HIS 65 245.774 1.483 -12.343 505 1HB HIS 65 HB2 HIS 65 245.909 4.132 -11.870 506 2HB HIS 65 HB1 HIS 65 247.349 3.611 -11.000 507 HD1 HIS 65 HD1 HIS 65 245.995 2.392 -14.339 508 HD2 HIS 65 HD2 HIS 65 249.368 4.191 -12.711 509 HE1 HIS 65 HE1 HIS 65 247.653 2.542 -16.225 510 HE2 HIS 65 HE2 HIS 65 249.653 3.713 -15.237 511 H LYS 66 HN LYS 66 246.446 -0.456 -11.569 512 HA LYS 66 HA LYS 66 247.475 -0.919 -8.989 513 1HB LYS 66 HB2 LYS 66 248.178 -3.085 -9.834 514 2HB LYS 66 HB1 LYS 66 246.581 -2.699 -10.458 515 1HG LYS 66 HG2 LYS 66 248.078 -1.738 -12.460 516 2HG LYS 66 HG1 LYS 66 249.146 -3.015 -11.875 517 1HD LYS 66 HD2 LYS 66 247.777 -4.661 -12.586 518 2HD LYS 66 HD1 LYS 66 246.316 -3.772 -12.152 519 1HE LYS 66 HE2 LYS 66 247.959 -2.836 -14.459 520 2HE LYS 66 HE1 LYS 66 246.911 -4.239 -14.666 521 1HZ LYS 66 HZ1 LYS 66 245.088 -2.785 -13.737 522 2HZ LYS 66 HZ2 LYS 66 245.638 -2.388 -15.287 523 3HZ LYS 66 HZ3 LYS 66 246.134 -1.473 -13.953 524 H VAL 67 HN VAL 67 249.513 -0.796 -8.142 525 HA VAL 67 HA VAL 67 251.639 0.016 -10.025 526 HB VAL 67 HB VAL 67 252.622 1.419 -8.270 527 1HG1 VAL 67 HG11 VAL 67 251.442 2.814 -9.603 528 2HG1 VAL 67 HG12 VAL 67 250.470 3.009 -8.144 529 3HG1 VAL 67 HG13 VAL 67 249.942 1.904 -9.414 530 1HG2 VAL 67 HG21 VAL 67 250.899 2.005 -6.383 531 2HG2 VAL 67 HG22 VAL 67 251.994 0.633 -6.210 532 3HG2 VAL 67 HG23 VAL 67 250.320 0.371 -6.699 533 H GLY 68 HN GLY 68 251.045 -1.451 -6.826 534 1HA GLY 68 HA2 GLY 68 253.204 -3.335 -7.395 535 2HA GLY 68 HA1 GLY 68 253.400 -2.318 -5.977 536 H GLN 69 HN GLN 69 253.503 -4.800 -5.352 537 HA GLN 69 HA GLN 69 250.865 -5.416 -4.211 538 1HB GLN 69 HB2 GLN 69 251.717 -6.895 -6.219 539 2HB GLN 69 HB1 GLN 69 252.709 -7.642 -4.976 540 1HG GLN 69 HG2 GLN 69 250.843 -8.408 -3.786 541 2HG GLN 69 HG1 GLN 69 249.745 -7.340 -4.660 542 1HE2 GLN 69 HE21 GLN 69 252.055 -9.962 -5.276 543 2HE2 GLN 69 HE22 GLN 69 251.098 -10.755 -6.475 544 H ILE 70 HN ILE 70 251.033 -5.224 -2.083 545 HA ILE 70 HA ILE 70 253.611 -5.778 -0.801 546 HB ILE 70 HB ILE 70 251.191 -4.469 0.433 547 1HG1 ILE 70 HG12 ILE 70 253.619 -3.197 -0.850 548 2HG1 ILE 70 HG11 ILE 70 251.974 -3.145 -1.476 549 1HG2 ILE 70 HG21 ILE 70 253.977 -4.030 1.364 550 2HG2 ILE 70 HG22 ILE 70 253.195 -5.560 1.762 551 3HG2 ILE 70 HG23 ILE 70 252.467 -4.037 2.274 552 1HD1 ILE 70 HD11 ILE 70 253.217 -1.625 0.724 553 2HD1 ILE 70 HD12 ILE 70 251.532 -2.102 0.935 554 3HD1 ILE 70 HD13 ILE 70 252.007 -1.134 -0.460 555 H VAL 71 HN VAL 71 253.903 -7.390 0.595 556 HA VAL 71 HA VAL 71 251.574 -9.035 1.336 557 HB VAL 71 HB VAL 71 254.390 -10.000 0.815 558 1HG1 VAL 71 HG11 VAL 71 253.079 -12.243 0.822 559 2HG1 VAL 71 HG12 VAL 71 251.893 -11.336 1.761 560 3HG1 VAL 71 HG13 VAL 71 253.547 -11.500 2.352 561 1HG2 VAL 71 HG21 VAL 71 253.102 -11.238 -1.077 562 2HG2 VAL 71 HG22 VAL 71 253.598 -9.561 -1.311 563 3HG2 VAL 71 HG23 VAL 71 251.930 -9.935 -0.880 564 H PHE 72 HN PHE 72 251.587 -9.972 3.412 565 HA PHE 72 HA PHE 72 253.630 -8.926 5.250 566 1HB PHE 72 HB2 PHE 72 250.647 -9.041 5.731 567 2HB PHE 72 HB1 PHE 72 251.845 -8.620 6.949 568 HD1 PHE 72 HD1 PHE 72 252.130 -6.391 7.368 569 HD2 PHE 72 HD2 PHE 72 250.943 -7.609 3.468 570 HE1 PHE 72 HE1 PHE 72 252.012 -4.033 6.672 571 HE2 PHE 72 HE2 PHE 72 250.824 -5.256 2.764 572 HZ PHE 72 HZ PHE 72 251.359 -3.464 4.367 573 H GLU 73 HN GLU 73 254.677 -10.528 6.192 574 HA GLU 73 HA GLU 73 253.395 -13.148 6.408 575 1HB GLU 73 HB2 GLU 73 255.642 -14.017 6.810 576 2HB GLU 73 HB1 GLU 73 255.604 -13.057 5.337 577 1HG GLU 73 HG2 GLU 73 256.528 -11.148 6.623 578 2HG GLU 73 HG1 GLU 73 256.683 -12.217 8.015 579 H PHE 74 HN PHE 74 252.730 -13.953 8.296 580 HA PHE 74 HA PHE 74 253.197 -12.363 10.701 581 1HB PHE 74 HB2 PHE 74 251.169 -14.378 9.858 582 2HB PHE 74 HB1 PHE 74 251.515 -14.237 11.580 583 HD1 PHE 74 HD1 PHE 74 249.848 -13.072 12.634 584 HD2 PHE 74 HD2 PHE 74 251.191 -11.744 8.820 585 HE1 PHE 74 HE1 PHE 74 248.336 -11.136 12.779 586 HE2 PHE 74 HE2 PHE 74 249.683 -9.806 8.958 587 HZ PHE 74 HZ PHE 74 248.253 -9.500 10.941 588 H VAL 75 HN VAL 75 254.349 -12.968 12.376 589 HA VAL 75 HA VAL 75 256.058 -15.267 12.088 590 HB VAL 75 HB VAL 75 256.171 -13.874 14.659 591 1HG1 VAL 75 HG11 VAL 75 258.397 -14.229 14.430 592 2HG1 VAL 75 HG12 VAL 75 258.387 -13.866 12.703 593 3HG1 VAL 75 HG13 VAL 75 257.822 -15.435 13.279 594 1HG2 VAL 75 HG21 VAL 75 256.285 -12.319 12.115 595 2HG2 VAL 75 HG22 VAL 75 257.368 -11.896 13.441 596 3HG2 VAL 75 HG23 VAL 75 255.622 -11.862 13.684 597 H GLY 76 HN GLY 76 255.251 -17.202 12.570 598 1HA GLY 76 HA2 GLY 76 254.756 -18.792 14.295 599 2HA GLY 76 HA1 GLY 76 253.925 -17.520 15.178 600 H GLU 77 HN GLU 77 252.700 -16.706 12.483 601 HA GLU 77 HA GLU 77 250.528 -18.685 12.579 602 1HB GLU 77 HB2 GLU 77 250.397 -15.889 11.451 603 2HB GLU 77 HB1 GLU 77 249.050 -16.964 11.802 604 1HG GLU 77 HG2 GLU 77 250.754 -16.388 14.107 605 2HG GLU 77 HG1 GLU 77 249.945 -14.976 13.429 606 HA PRO 78 HA PRO 78 252.066 -20.163 8.621 607 1HB PRO 78 HB2 PRO 78 249.259 -21.168 8.511 608 2HB PRO 78 HB1 PRO 78 250.774 -22.025 8.201 609 1HG PRO 78 HG2 PRO 78 249.452 -22.400 10.478 610 2HG PRO 78 HG1 PRO 78 251.223 -22.318 10.459 611 1HD PRO 78 HD2 PRO 78 249.239 -20.279 11.353 612 2HD PRO 78 HD1 PRO 78 250.850 -20.649 12.001 613 H GLU 79 HN GLU 79 248.771 -18.837 8.913 614 HA GLU 79 HA GLU 79 248.405 -18.163 6.233 615 1HB GLU 79 HB2 GLU 79 246.910 -17.970 8.528 616 2HB GLU 79 HB1 GLU 79 247.202 -16.282 8.133 617 1HG GLU 79 HG2 GLU 79 246.432 -16.942 5.764 618 2HG GLU 79 HG1 GLU 79 245.758 -18.366 6.555 619 H LEU 80 HN LEU 80 248.131 -15.834 5.470 620 HA LEU 80 HA LEU 80 250.132 -14.000 6.532 621 1HB LEU 80 HB2 LEU 80 250.192 -14.392 3.588 622 2HB LEU 80 HB1 LEU 80 251.470 -13.883 4.674 623 HG LEU 80 HG LEU 80 250.489 -16.712 4.736 624 1HD1 LEU 80 HD11 LEU 80 251.645 -17.363 2.898 625 2HD1 LEU 80 HD12 LEU 80 252.827 -16.062 3.042 626 3HD1 LEU 80 HD13 LEU 80 251.228 -15.732 2.375 627 1HD2 LEU 80 HD21 LEU 80 252.597 -15.165 5.951 628 2HD2 LEU 80 HD22 LEU 80 253.259 -16.531 5.054 629 3HD2 LEU 80 HD23 LEU 80 252.055 -16.804 6.313 630 H MET 81 HN MET 81 250.128 -12.134 4.509 631 HA MET 81 HA MET 81 247.330 -11.544 3.933 632 1HB MET 81 HB2 MET 81 249.004 -10.124 5.878 633 2HB MET 81 HB1 MET 81 248.244 -9.069 4.694 634 1HG MET 81 HG2 MET 81 246.059 -9.978 5.283 635 2HG MET 81 HG1 MET 81 246.819 -11.043 6.464 636 1HE MET 81 HE1 MET 81 246.855 -7.465 5.232 637 2HE MET 81 HE2 MET 81 248.302 -7.254 6.217 638 3HE MET 81 HE3 MET 81 246.795 -6.463 6.682 639 H ASP 82 HN ASP 82 247.331 -11.292 1.787 640 HA ASP 82 HA ASP 82 249.619 -9.921 0.542 641 1HB ASP 82 HB2 ASP 82 249.119 -12.223 -0.263 642 2HB ASP 82 HB1 ASP 82 247.526 -11.671 -0.773 643 H VAL 83 HN VAL 83 249.134 -7.788 0.528 644 HA VAL 83 HA VAL 83 246.474 -7.003 -0.458 645 HB VAL 83 HB VAL 83 246.991 -6.202 1.812 646 1HG1 VAL 83 HG11 VAL 83 249.124 -4.471 0.594 647 2HG1 VAL 83 HG12 VAL 83 249.482 -6.023 1.352 648 3HG1 VAL 83 HG13 VAL 83 248.757 -4.724 2.300 649 1HG2 VAL 83 HG21 VAL 83 246.698 -4.197 -0.402 650 2HG2 VAL 83 HG22 VAL 83 246.654 -3.719 1.294 651 3HG2 VAL 83 HG23 VAL 83 245.459 -4.853 0.667 652 H HIS 84 HN HIS 84 246.424 -6.357 -2.481 653 HA HIS 84 HA HIS 84 248.814 -5.544 -3.874 654 1HB HIS 84 HB2 HIS 84 246.396 -6.687 -4.631 655 2HB HIS 84 HB1 HIS 84 246.292 -5.049 -5.265 656 HD1 HIS 84 HD1 HIS 84 249.589 -5.158 -5.693 657 HD2 HIS 84 HD2 HIS 84 246.633 -7.578 -7.326 658 HE1 HIS 84 HE1 HIS 84 250.588 -6.113 -7.793 659 HE2 HIS 84 HE2 HIS 84 248.811 -7.642 -8.718 660 H VAL 85 HN VAL 85 249.148 -3.465 -4.827 661 HA VAL 85 HA VAL 85 247.737 -1.343 -3.362 662 HB VAL 85 HB VAL 85 250.406 -1.216 -4.797 663 1HG1 VAL 85 HG11 VAL 85 249.013 0.913 -4.615 664 2HG1 VAL 85 HG12 VAL 85 250.653 0.972 -3.974 665 3HG1 VAL 85 HG13 VAL 85 249.284 0.804 -2.876 666 1HG2 VAL 85 HG21 VAL 85 250.132 -2.609 -2.623 667 2HG2 VAL 85 HG22 VAL 85 250.041 -1.034 -1.835 668 3HG2 VAL 85 HG23 VAL 85 251.475 -1.474 -2.762 669 H PHE 86 HN PHE 86 246.682 0.231 -4.417 670 HA PHE 86 HA PHE 86 246.814 0.344 -7.342 671 1HB PHE 86 HB2 PHE 86 244.455 -0.314 -5.632 672 2HB PHE 86 HB1 PHE 86 244.181 0.704 -7.042 673 HD1 PHE 86 HD1 PHE 86 245.533 -2.573 -5.968 674 HD2 PHE 86 HD2 PHE 86 244.024 -0.228 -9.182 675 HE1 PHE 86 HE1 PHE 86 245.449 -4.581 -7.386 676 HE2 PHE 86 HE2 PHE 86 243.935 -2.233 -10.607 677 HZ PHE 86 HZ PHE 86 244.648 -4.412 -9.709 678 H CYS 87 HN CYS 87 246.451 2.360 -8.203 679 HA CYS 87 HA CYS 87 245.724 4.516 -6.336 680 1HB CYS 87 HB2 CYS 87 248.120 4.314 -8.119 681 2HB CYS 87 HB1 CYS 87 247.378 5.893 -7.883 682 HG CYS 87 HG CYS 87 248.593 4.231 -5.548 683 H THR 88 HN THR 88 243.898 5.414 -7.088 684 HA THR 88 HA THR 88 243.272 5.134 -9.924 685 HB THR 88 HB THR 88 241.640 4.467 -8.131 686 HG1 THR 88 HG1 THR 88 240.747 4.754 -10.089 687 1HG2 THR 88 HG21 THR 88 240.544 7.116 -7.845 688 2HG2 THR 88 HG22 THR 88 242.121 6.949 -7.070 689 3HG2 THR 88 HG23 THR 88 240.805 5.854 -6.641 690 H ASP 89 HN ASP 89 241.631 7.142 -10.474 691 HA ASP 89 HA ASP 89 242.664 9.712 -9.729 692 1HB ASP 89 HB2 ASP 89 244.162 8.560 -11.640 693 2HB ASP 89 HB1 ASP 89 242.898 9.243 -12.658 694 H SER 90 HN SER 90 240.829 7.855 -12.109 695 HA SER 90 HA SER 90 238.931 10.015 -12.484 696 1HB SER 90 HB2 SER 90 239.796 7.961 -14.107 697 2HB SER 90 HB1 SER 90 238.221 7.377 -13.571 698 HG SER 90 HG SER 90 238.325 8.781 -15.523 699 H ILE 91 HN ILE 91 237.753 10.308 -10.633 700 HA ILE 91 HA ILE 91 236.517 7.937 -9.434 701 HB ILE 91 HB ILE 91 236.010 9.317 -7.480 702 1HG1 ILE 91 HG12 ILE 91 237.565 11.544 -8.808 703 2HG1 ILE 91 HG11 ILE 91 235.807 11.464 -8.830 704 1HG2 ILE 91 HG21 ILE 91 238.875 9.920 -7.991 705 2HG2 ILE 91 HG22 ILE 91 238.354 8.237 -8.056 706 3HG2 ILE 91 HG23 ILE 91 238.104 9.182 -6.588 707 1HD1 ILE 91 HD11 ILE 91 235.781 11.535 -6.385 708 2HD1 ILE 91 HD12 ILE 91 236.586 12.942 -7.078 709 3HD1 ILE 91 HD13 ILE 91 237.542 11.636 -6.377 710 H GLN 92 HN GLN 92 234.292 8.630 -8.327 711 HA GLN 92 HA GLN 92 232.678 10.183 -10.203 712 1HB GLN 92 HB2 GLN 92 232.174 7.301 -9.478 713 2HB GLN 92 HB1 GLN 92 230.958 8.342 -10.206 714 1HG GLN 92 HG2 GLN 92 233.064 8.674 -11.903 715 2HG GLN 92 HG1 GLN 92 233.250 6.991 -11.413 716 1HE2 GLN 92 HE21 GLN 92 232.691 7.646 -14.010 717 2HE2 GLN 92 HE22 GLN 92 231.085 7.143 -14.405 718 H GLY 93 HN GLY 93 232.242 8.018 -7.414 719 1HA GLY 93 HA2 GLY 93 230.063 9.278 -6.275 720 2HA GLY 93 HA1 GLY 93 231.257 8.361 -5.372 721 H THR 94 HN THR 94 230.356 10.159 -3.846 722 HA THR 94 HA THR 94 232.052 12.543 -4.086 723 HB THR 94 HB THR 94 229.862 12.658 -2.161 724 HG1 THR 94 HG1 THR 94 229.317 12.268 -4.907 725 1HG2 THR 94 HG21 THR 94 230.436 14.783 -2.532 726 2HG2 THR 94 HG22 THR 94 229.402 14.639 -3.954 727 3HG2 THR 94 HG23 THR 94 231.146 14.420 -4.106 728 HA PRO 95 HA PRO 95 234.158 11.352 -0.439 729 1HB PRO 95 HB2 PRO 95 234.912 13.778 0.540 730 2HB PRO 95 HB1 PRO 95 235.701 13.010 -0.840 731 1HG PRO 95 HG2 PRO 95 233.735 15.230 -0.776 732 2HG PRO 95 HG1 PRO 95 235.076 14.943 -1.896 733 1HD PRO 95 HD2 PRO 95 232.416 14.433 -2.433 734 2HD PRO 95 HD1 PRO 95 233.782 13.698 -3.286 735 H VAL 96 HN VAL 96 231.747 10.888 0.024 736 HA VAL 96 HA VAL 96 230.423 12.633 1.871 737 HB VAL 96 HB VAL 96 229.761 9.719 1.647 738 1HG1 VAL 96 HG11 VAL 96 228.220 12.252 2.115 739 2HG1 VAL 96 HG12 VAL 96 228.407 10.862 3.185 740 3HG1 VAL 96 HG13 VAL 96 227.429 10.725 1.724 741 1HG2 VAL 96 HG21 VAL 96 229.608 9.862 -0.574 742 2HG2 VAL 96 HG22 VAL 96 229.827 11.611 -0.556 743 3HG2 VAL 96 HG23 VAL 96 228.223 10.922 -0.304 744 H GLU 97 HN GLU 97 232.612 12.626 3.083 745 HA GLU 97 HA GLU 97 233.573 10.641 4.686 746 1HB GLU 97 HB2 GLU 97 234.343 12.355 6.216 747 2HB GLU 97 HB1 GLU 97 234.488 12.940 4.565 748 1HG GLU 97 HG2 GLU 97 233.439 14.766 5.243 749 2HG GLU 97 HG1 GLU 97 231.977 13.785 5.329 750 H SER 98 HN SER 98 232.457 9.221 5.861 751 HA SER 98 HA SER 98 229.991 9.994 7.178 752 1HB SER 98 HB2 SER 98 231.325 7.449 6.462 753 2HB SER 98 HB1 SER 98 230.353 7.420 7.933 754 HG SER 98 HG SER 98 228.610 8.253 6.675 755 H ASP 99 HN ASP 99 229.836 8.621 9.435 756 HA ASP 99 HA ASP 99 231.443 10.132 11.236 757 1HB ASP 99 HB2 ASP 99 229.440 7.913 11.640 758 2HB ASP 99 HB1 ASP 99 230.289 8.680 12.979 759 H GLU 100 HN GLU 100 232.044 7.270 9.567 760 HA GLU 100 HA GLU 100 233.938 6.345 11.618 761 1HB GLU 100 HB2 GLU 100 232.145 4.963 9.844 762 2HB GLU 100 HB1 GLU 100 233.799 4.454 9.526 763 1HG GLU 100 HG2 GLU 100 234.093 3.651 11.697 764 2HG GLU 100 HG1 GLU 100 232.696 4.536 12.309 765 H MET 101 HN MET 101 233.625 7.235 8.222 766 HA MET 101 HA MET 101 236.561 7.195 7.999 767 1HB MET 101 HB2 MET 101 234.537 6.172 6.288 768 2HB MET 101 HB1 MET 101 235.308 7.509 5.447 769 1HG MET 101 HG2 MET 101 236.310 5.283 4.992 770 2HG MET 101 HG1 MET 101 237.446 6.480 5.607 771 1HE MET 101 HE1 MET 101 239.228 5.122 6.279 772 2HE MET 101 HE2 MET 101 239.302 4.240 7.804 773 3HE MET 101 HE3 MET 101 238.992 5.976 7.804 774 H ARG 102 HN ARG 102 237.560 8.902 6.746 775 HA ARG 102 HA ARG 102 236.098 11.301 6.162 776 1HB ARG 102 HB2 ARG 102 236.282 11.510 8.603 777 2HB ARG 102 HB1 ARG 102 238.022 11.286 8.503 778 1HG ARG 102 HG2 ARG 102 237.867 13.371 6.907 779 2HG ARG 102 HG1 ARG 102 236.367 13.650 7.792 780 1HD ARG 102 HD2 ARG 102 237.916 13.207 9.877 781 2HD ARG 102 HD1 ARG 102 239.184 13.697 8.755 782 HE ARG 102 HE ARG 102 237.145 15.591 8.610 783 1HH1 ARG 102 HH11 ARG 102 239.469 14.422 10.938 784 2HH1 ARG 102 HH12 ARG 102 239.579 15.934 11.774 785 1HH2 ARG 102 HH21 ARG 102 237.290 17.581 9.709 786 2HH2 ARG 102 HH22 ARG 102 238.342 17.727 11.077 787 HA PRO 103 HA PRO 103 239.889 10.776 3.634 788 1HB PRO 103 HB2 PRO 103 238.878 11.860 1.379 789 2HB PRO 103 HB1 PRO 103 238.558 10.186 1.849 790 1HG PRO 103 HG2 PRO 103 236.846 12.617 2.224 791 2HG PRO 103 HG1 PRO 103 236.383 11.007 1.638 792 1HD PRO 103 HD2 PRO 103 235.955 11.784 4.194 793 2HD PRO 103 HD1 PRO 103 236.341 10.104 3.772 794 H CYS 104 HN CYS 104 241.315 12.304 2.645 795 HA CYS 104 HA CYS 104 240.704 15.128 3.013 796 1HB CYS 104 HB2 CYS 104 241.742 14.469 5.133 797 2HB CYS 104 HB1 CYS 104 243.117 13.799 4.264 798 HG CYS 104 HG CYS 104 242.601 16.784 4.779 799 H TRP 105 HN TRP 105 241.221 16.119 1.199 800 HA TRP 105 HA TRP 105 243.051 14.883 -0.679 801 1HB TRP 105 HB2 TRP 105 241.421 17.425 -0.904 802 2HB TRP 105 HB1 TRP 105 242.318 16.665 -2.215 803 HD1 TRP 105 HD1 TRP 105 239.766 15.153 0.317 804 HE1 TRP 105 HE1 TRP 105 237.978 13.876 -1.031 805 HE3 TRP 105 HE3 TRP 105 241.443 16.169 -4.406 806 HZ2 TRP 105 HZ2 TRP 105 237.365 13.376 -3.740 807 HZ3 TRP 105 HZ3 TRP 105 240.198 15.253 -6.321 808 HH2 TRP 105 HH2 TRP 105 238.202 13.885 -5.994 809 H PHE 106 HN PHE 106 245.156 15.192 -0.341 810 HA PHE 106 HA PHE 106 246.067 17.874 0.482 811 1HB PHE 106 HB2 PHE 106 246.856 15.143 1.324 812 2HB PHE 106 HB1 PHE 106 248.163 16.304 1.145 813 HD1 PHE 106 HD1 PHE 106 246.625 14.835 3.597 814 HD2 PHE 106 HD2 PHE 106 246.887 18.788 2.047 815 HE1 PHE 106 HE1 PHE 106 246.115 15.738 5.828 816 HE2 PHE 106 HE2 PHE 106 246.376 19.700 4.275 817 HZ PHE 106 HZ PHE 106 245.991 18.175 6.169 818 H GLN 107 HN GLN 107 248.761 17.601 0.013 819 HA GLN 107 HA GLN 107 248.822 17.652 -2.899 820 1HB GLN 107 HB2 GLN 107 251.030 18.414 -0.986 821 2HB GLN 107 HB1 GLN 107 250.898 18.837 -2.689 822 1HG GLN 107 HG2 GLN 107 248.798 19.713 -0.755 823 2HG GLN 107 HG1 GLN 107 250.321 20.592 -0.880 824 1HE2 GLN 107 HE21 GLN 107 247.421 19.626 -2.569 825 2HE2 GLN 107 HE22 GLN 107 247.525 20.807 -3.825 826 H LEU 108 HN LEU 108 250.353 16.508 -4.127 827 HA LEU 108 HA LEU 108 250.856 13.861 -3.239 828 1HB LEU 108 HB2 LEU 108 251.698 13.442 -5.387 829 2HB LEU 108 HB1 LEU 108 250.452 14.652 -5.622 830 HG LEU 108 HG LEU 108 253.430 15.157 -5.593 831 1HD1 LEU 108 HD11 LEU 108 251.466 14.582 -7.699 832 2HD1 LEU 108 HD12 LEU 108 253.217 14.376 -7.687 833 3HD1 LEU 108 HD13 LEU 108 252.518 15.963 -8.009 834 1HD2 LEU 108 HD21 LEU 108 252.842 17.439 -6.254 835 2HD2 LEU 108 HD22 LEU 108 252.203 17.043 -4.659 836 3HD2 LEU 108 HD23 LEU 108 251.132 17.054 -6.059 837 H ASP 109 HN ASP 109 252.511 16.684 -2.595 838 HA ASP 109 HA ASP 109 255.009 15.211 -2.110 839 1HB ASP 109 HB2 ASP 109 254.835 17.354 -3.708 840 2HB ASP 109 HB1 ASP 109 255.019 18.186 -2.167 841 H GLN 110 HN GLN 110 252.460 15.671 -0.497 842 HA GLN 110 HA GLN 110 253.839 16.385 1.966 843 1HB GLN 110 HB2 GLN 110 251.417 17.769 0.866 844 2HB GLN 110 HB1 GLN 110 251.669 17.669 2.602 845 1HG GLN 110 HG2 GLN 110 254.095 18.552 1.752 846 2HG GLN 110 HG1 GLN 110 253.008 19.318 0.595 847 1HE2 GLN 110 HE21 GLN 110 254.567 20.683 2.506 848 2HE2 GLN 110 HE22 GLN 110 253.494 21.475 3.604 849 H ILE 111 HN ILE 111 252.641 13.930 0.640 850 HA ILE 111 HA ILE 111 250.372 13.235 2.257 851 HB ILE 111 HB ILE 111 251.831 10.895 1.376 852 1HG1 ILE 111 HG12 ILE 111 251.156 11.465 -1.120 853 2HG1 ILE 111 HG11 ILE 111 251.487 13.111 -0.585 854 1HG2 ILE 111 HG21 ILE 111 249.192 11.760 1.686 855 2HG2 ILE 111 HG22 ILE 111 249.778 10.150 1.265 856 3HG2 ILE 111 HG23 ILE 111 249.382 11.304 -0.006 857 1HD1 ILE 111 HD11 ILE 111 253.357 10.766 -0.621 858 2HD1 ILE 111 HD12 ILE 111 253.710 12.267 0.234 859 3HD1 ILE 111 HD13 ILE 111 253.489 12.280 -1.515 860 HA PRO 112 HA PRO 112 252.909 12.075 5.722 861 1HB PRO 112 HB2 PRO 112 250.999 11.988 7.567 862 2HB PRO 112 HB1 PRO 112 251.434 13.525 6.806 863 1HG PRO 112 HG2 PRO 112 249.090 11.747 6.283 864 2HG PRO 112 HG1 PRO 112 249.171 13.517 6.303 865 1HD PRO 112 HD2 PRO 112 249.268 11.877 4.028 866 2HD PRO 112 HD1 PRO 112 249.701 13.597 4.099 867 H PHE 113 HN PHE 113 253.632 10.046 5.197 868 HA PHE 113 HA PHE 113 251.915 7.759 5.277 869 1HB PHE 113 HB2 PHE 113 254.844 7.392 5.535 870 2HB PHE 113 HB1 PHE 113 253.689 6.526 4.541 871 HD1 PHE 113 HD1 PHE 113 252.602 9.297 3.322 872 HD2 PHE 113 HD2 PHE 113 256.414 7.437 3.753 873 HE1 PHE 113 HE1 PHE 113 253.440 10.509 1.353 874 HE2 PHE 113 HE2 PHE 113 257.239 8.642 1.788 875 HZ PHE 113 HZ PHE 113 255.752 10.192 0.582 876 H LYS 114 HN LYS 114 253.620 9.540 7.640 877 HA LYS 114 HA LYS 114 254.035 7.417 9.502 878 1HB LYS 114 HB2 LYS 114 255.047 9.908 9.296 879 2HB LYS 114 HB1 LYS 114 253.792 10.201 10.491 880 1HG LYS 114 HG2 LYS 114 255.366 9.607 11.963 881 2HG LYS 114 HG1 LYS 114 254.948 7.960 11.489 882 1HD LYS 114 HD2 LYS 114 257.126 9.625 10.227 883 2HD LYS 114 HD1 LYS 114 257.385 8.387 11.458 884 1HE LYS 114 HE2 LYS 114 256.816 6.658 10.019 885 2HE LYS 114 HE1 LYS 114 255.928 7.724 8.931 886 1HZ LYS 114 HZ1 LYS 114 258.859 7.429 9.210 887 2HZ LYS 114 HZ2 LYS 114 258.164 8.759 8.432 888 3HZ LYS 114 HZ3 LYS 114 257.909 7.200 7.828 889 H ASP 115 HN ASP 115 251.417 9.492 8.647 890 HA ASP 115 HA ASP 115 249.945 8.789 11.061 891 1HB ASP 115 HB2 ASP 115 249.564 10.840 8.911 892 2HB ASP 115 HB1 ASP 115 248.193 10.350 9.902 893 H MET 116 HN MET 116 250.598 6.858 8.915 894 HA MET 116 HA MET 116 247.852 5.974 8.389 895 1HB MET 116 HB2 MET 116 249.822 5.355 6.266 896 2HB MET 116 HB1 MET 116 248.111 5.718 6.141 897 1HG MET 116 HG2 MET 116 248.803 8.121 6.734 898 2HG MET 116 HG1 MET 116 250.427 7.594 6.307 899 1HE MET 116 HE1 MET 116 251.014 6.420 4.353 900 2HE MET 116 HE2 MET 116 251.009 7.683 3.124 901 3HE MET 116 HE3 MET 116 250.073 6.209 2.877 902 H TRP 117 HN TRP 117 250.926 4.544 7.328 903 HA TRP 117 HA TRP 117 250.693 2.468 9.360 904 1HB TRP 117 HB2 TRP 117 250.215 2.075 6.452 905 2HB TRP 117 HB1 TRP 117 251.158 0.842 7.277 906 HD1 TRP 117 HD1 TRP 117 247.768 2.659 7.877 907 HE1 TRP 117 HE1 TRP 117 246.092 0.921 8.767 908 HE3 TRP 117 HE3 TRP 117 250.840 -1.428 8.040 909 HZ2 TRP 117 HZ2 TRP 117 246.072 -1.818 9.446 910 HZ3 TRP 117 HZ3 TRP 117 249.912 -3.568 8.822 911 HH2 TRP 117 HH2 TRP 117 247.578 -3.757 9.509 912 HA PRO 118 HA PRO 118 255.106 2.443 9.077 913 1HB PRO 118 HB2 PRO 118 255.749 -0.011 9.878 914 2HB PRO 118 HB1 PRO 118 254.908 1.107 10.958 915 1HG PRO 118 HG2 PRO 118 253.792 -1.150 9.334 916 2HG PRO 118 HG1 PRO 118 253.445 -0.706 11.014 917 1HD PRO 118 HD2 PRO 118 251.859 -0.025 8.880 918 2HD PRO 118 HD1 PRO 118 251.925 0.886 10.401 919 H ASP 119 HN ASP 119 253.485 1.308 6.592 920 HA ASP 119 HA ASP 119 255.867 0.150 5.308 921 1HB ASP 119 HB2 ASP 119 254.155 -1.108 3.847 922 2HB ASP 119 HB1 ASP 119 254.443 -1.702 5.481 923 H ASP 120 HN ASP 120 253.273 2.411 5.161 924 HA ASP 120 HA ASP 120 252.922 2.931 2.503 925 1HB ASP 120 HB2 ASP 120 252.937 4.735 4.890 926 2HB ASP 120 HB1 ASP 120 252.618 5.371 3.278 927 H SER 121 HN SER 121 255.482 4.345 4.534 928 HA SER 121 HA SER 121 256.653 5.948 2.567 929 1HB SER 121 HB2 SER 121 258.538 6.122 4.020 930 2HB SER 121 HB1 SER 121 257.117 5.981 5.055 931 HG SER 121 HG SER 121 259.044 4.005 4.440 932 H TYR 122 HN TYR 122 256.674 2.528 2.840 933 HA TYR 122 HA TYR 122 259.153 2.178 1.413 934 1HB TYR 122 HB2 TYR 122 257.047 0.241 2.360 935 2HB TYR 122 HB1 TYR 122 258.476 -0.253 1.459 936 HD1 TYR 122 HD1 TYR 122 260.579 -0.478 2.532 937 HD2 TYR 122 HD2 TYR 122 257.324 1.306 4.611 938 HE1 TYR 122 HE1 TYR 122 261.865 -0.584 4.625 939 HE2 TYR 122 HE2 TYR 122 258.601 1.206 6.709 940 HH TYR 122 HH TYR 122 261.578 1.029 7.045 941 H TRP 123 HN TRP 123 255.685 1.970 0.684 942 HA TRP 123 HA TRP 123 256.411 1.357 -2.082 943 1HB TRP 123 HB2 TRP 123 254.076 0.699 -2.424 944 2HB TRP 123 HB1 TRP 123 254.816 -0.194 -1.104 945 HD1 TRP 123 HD1 TRP 123 254.004 0.481 1.415 946 HE1 TRP 123 HE1 TRP 123 251.747 1.418 2.229 947 HE3 TRP 123 HE3 TRP 123 252.180 2.199 -3.043 948 HZ2 TRP 123 HZ2 TRP 123 249.489 2.739 1.120 949 HZ3 TRP 123 HZ3 TRP 123 249.966 3.274 -3.075 950 HH2 TRP 123 HH2 TRP 123 248.655 3.528 -1.042 951 H PHE 124 HN PHE 124 255.749 4.050 -0.288 952 HA PHE 124 HA PHE 124 254.046 5.430 -2.138 953 1HB PHE 124 HB2 PHE 124 255.338 6.019 0.426 954 2HB PHE 124 HB1 PHE 124 255.293 7.400 -0.662 955 HD1 PHE 124 HD1 PHE 124 253.507 8.812 -0.381 956 HD2 PHE 124 HD2 PHE 124 252.986 4.659 0.391 957 HE1 PHE 124 HE1 PHE 124 251.181 9.231 0.263 958 HE2 PHE 124 HE2 PHE 124 250.650 5.075 1.038 959 HZ PHE 124 HZ PHE 124 249.746 7.363 0.976 960 HA PRO 125 HA PRO 125 258.318 7.681 -3.171 961 1HB PRO 125 HB2 PRO 125 260.095 5.358 -2.627 962 2HB PRO 125 HB1 PRO 125 260.383 7.082 -2.367 963 1HG PRO 125 HG2 PRO 125 259.865 5.464 -0.316 964 2HG PRO 125 HG1 PRO 125 259.210 7.111 -0.366 965 1HD PRO 125 HD2 PRO 125 257.843 4.508 -0.895 966 2HD PRO 125 HD1 PRO 125 257.226 5.967 -0.095 967 H LEU 126 HN LEU 126 257.655 4.271 -3.687 968 HA LEU 126 HA LEU 126 258.876 4.243 -6.301 969 1HB LEU 126 HB2 LEU 126 257.343 2.255 -4.664 970 2HB LEU 126 HB1 LEU 126 257.618 1.964 -6.371 971 HG LEU 126 HG LEU 126 259.983 2.654 -4.710 972 1HD1 LEU 126 HD11 LEU 126 259.520 -0.196 -4.710 973 2HD1 LEU 126 HD12 LEU 126 258.261 0.665 -3.826 974 3HD1 LEU 126 HD13 LEU 126 259.953 0.878 -3.382 975 1HD2 LEU 126 HD21 LEU 126 259.590 0.578 -6.857 976 2HD2 LEU 126 HD22 LEU 126 261.113 1.219 -6.240 977 3HD2 LEU 126 HD23 LEU 126 260.039 2.253 -7.180 978 H LEU 127 HN LEU 127 255.676 4.568 -4.920 979 HA LEU 127 HA LEU 127 254.126 4.254 -7.240 980 1HB LEU 127 HB2 LEU 127 253.729 5.949 -4.776 981 2HB LEU 127 HB1 LEU 127 252.521 5.808 -6.035 982 HG LEU 127 HG LEU 127 252.988 4.122 -3.791 983 1HD1 LEU 127 HD11 LEU 127 250.975 4.275 -6.001 984 2HD1 LEU 127 HD12 LEU 127 250.803 4.739 -4.308 985 3HD1 LEU 127 HD13 LEU 127 250.884 3.034 -4.751 986 1HD2 LEU 127 HD21 LEU 127 252.952 1.926 -4.860 987 2HD2 LEU 127 HD22 LEU 127 254.438 2.793 -5.245 988 3HD2 LEU 127 HD23 LEU 127 253.146 2.686 -6.439 989 H LEU 128 HN LEU 128 255.312 7.189 -5.665 990 HA LEU 128 HA LEU 128 254.541 9.040 -7.599 991 1HB LEU 128 HB2 LEU 128 256.542 8.967 -5.414 992 2HB LEU 128 HB1 LEU 128 256.765 10.209 -6.633 993 HG LEU 128 HG LEU 128 254.074 9.910 -5.376 994 1HD1 LEU 128 HD11 LEU 128 254.619 10.822 -3.384 995 2HD1 LEU 128 HD12 LEU 128 255.965 11.746 -4.049 996 3HD1 LEU 128 HD13 LEU 128 256.161 10.028 -3.701 997 1HD2 LEU 128 HD21 LEU 128 253.939 11.554 -6.940 998 2HD2 LEU 128 HD22 LEU 128 255.647 11.977 -6.806 999 3HD2 LEU 128 HD23 LEU 128 254.505 12.524 -5.579 1000 H GLN 129 HN GLN 129 257.172 6.787 -7.587 1001 HA GLN 129 HA GLN 129 258.619 8.107 -9.714 1002 1HB GLN 129 HB2 GLN 129 259.639 6.694 -7.835 1003 2HB GLN 129 HB1 GLN 129 259.074 5.296 -8.740 1004 1HG GLN 129 HG2 GLN 129 261.360 5.666 -9.284 1005 2HG GLN 129 HG1 GLN 129 260.385 6.099 -10.688 1006 1HE2 GLN 129 HE21 GLN 129 262.515 7.181 -11.152 1007 2HE2 GLN 129 HE22 GLN 129 262.697 8.811 -10.607 1008 H LYS 130 HN LYS 130 255.797 6.500 -9.727 1009 HA LYS 130 HA LYS 130 254.554 5.418 -11.274 1010 1HB LYS 130 HB2 LYS 130 254.664 6.270 -13.377 1011 2HB LYS 130 HB1 LYS 130 255.752 7.407 -12.599 1012 1HG LYS 130 HG2 LYS 130 257.483 5.446 -13.356 1013 2HG LYS 130 HG1 LYS 130 256.281 5.376 -14.643 1014 1HD LYS 130 HD2 LYS 130 257.596 6.996 -15.529 1015 2HD LYS 130 HD1 LYS 130 256.600 8.028 -14.502 1016 1HE LYS 130 HE2 LYS 130 258.982 8.545 -14.267 1017 2HE LYS 130 HE1 LYS 130 258.290 7.956 -12.756 1018 1HZ LYS 130 HZ1 LYS 130 259.504 6.065 -12.830 1019 2HZ LYS 130 HZ2 LYS 130 260.556 7.036 -13.731 1020 3HZ LYS 130 HZ3 LYS 130 259.504 5.975 -14.520 1021 H LYS 131 HN LYS 131 256.892 4.059 -9.978 1022 HA LYS 131 HA LYS 131 257.428 1.973 -11.975 1023 1HB LYS 131 HB2 LYS 131 258.778 2.598 -9.344 1024 2HB LYS 131 HB1 LYS 131 259.176 1.213 -10.351 1025 1HG LYS 131 HG2 LYS 131 259.433 3.165 -12.168 1026 2HG LYS 131 HG1 LYS 131 259.829 4.066 -10.703 1027 1HD LYS 131 HD2 LYS 131 261.113 1.455 -11.496 1028 2HD LYS 131 HD1 LYS 131 261.803 3.045 -11.830 1029 1HE LYS 131 HE2 LYS 131 262.252 3.465 -9.605 1030 2HE LYS 131 HE1 LYS 131 261.022 2.337 -9.037 1031 1HZ LYS 131 HZ1 LYS 131 262.500 0.545 -10.004 1032 2HZ LYS 131 HZ2 LYS 131 263.063 1.310 -8.605 1033 3HZ LYS 131 HZ3 LYS 131 263.709 1.723 -10.113 1034 H LYS 132 HN LYS 132 257.336 -0.281 -11.263 1035 HA LYS 132 HA LYS 132 255.237 -0.685 -9.235 1036 1HB LYS 132 HB2 LYS 132 255.806 -2.211 -11.777 1037 2HB LYS 132 HB1 LYS 132 254.712 -2.792 -10.529 1038 1HG LYS 132 HG2 LYS 132 253.176 -1.771 -11.818 1039 2HG LYS 132 HG1 LYS 132 253.685 -0.348 -10.907 1040 1HD LYS 132 HD2 LYS 132 254.854 0.531 -12.670 1041 2HD LYS 132 HD1 LYS 132 255.185 -1.051 -13.379 1042 1HE LYS 132 HE2 LYS 132 252.691 -1.168 -13.878 1043 2HE LYS 132 HE1 LYS 132 252.645 0.552 -13.490 1044 1HZ LYS 132 HZ1 LYS 132 254.540 0.707 -15.202 1045 2HZ LYS 132 HZ2 LYS 132 252.954 0.533 -15.764 1046 3HZ LYS 132 HZ3 LYS 132 253.992 -0.803 -15.734 1047 H PHE 133 HN PHE 133 255.652 -2.010 -7.569 1048 HA PHE 133 HA PHE 133 257.780 -3.981 -7.757 1049 1HB PHE 133 HB2 PHE 133 259.205 -3.095 -6.183 1050 2HB PHE 133 HB1 PHE 133 258.607 -1.612 -6.917 1051 HD1 PHE 133 HD1 PHE 133 256.174 -0.957 -5.757 1052 HD2 PHE 133 HD2 PHE 133 259.459 -2.939 -3.918 1053 HE1 PHE 133 HE1 PHE 133 255.402 -0.183 -3.554 1054 HE2 PHE 133 HE2 PHE 133 258.693 -2.169 -1.710 1055 HZ PHE 133 HZ PHE 133 256.662 -0.788 -1.526 1056 H HIS 134 HN HIS 134 257.964 -5.208 -5.631 1057 HA HIS 134 HA HIS 134 255.323 -5.474 -4.352 1058 1HB HIS 134 HB2 HIS 134 257.169 -7.590 -5.431 1059 2HB HIS 134 HB1 HIS 134 256.069 -7.962 -4.108 1060 HD1 HIS 134 HD1 HIS 134 254.738 -9.608 -5.589 1061 HD2 HIS 134 HD2 HIS 134 254.765 -5.700 -6.999 1062 HE1 HIS 134 HE1 HIS 134 252.966 -9.523 -7.371 1063 HE2 HIS 134 HE2 HIS 134 252.937 -7.126 -8.144 1064 H GLY 135 HN GLY 135 255.400 -5.220 -2.185 1065 1HA GLY 135 HA2 GLY 135 258.047 -5.505 -0.908 1066 2HA GLY 135 HA1 GLY 135 256.846 -4.332 -0.403 1067 H TYR 136 HN TYR 136 258.293 -7.019 0.571 1068 HA TYR 136 HA TYR 136 255.884 -8.165 1.821 1069 1HB TYR 136 HB2 TYR 136 258.573 -9.355 1.156 1070 2HB TYR 136 HB1 TYR 136 257.487 -10.119 2.311 1071 HD1 TYR 136 HD1 TYR 136 256.963 -8.498 -1.022 1072 HD2 TYR 136 HD2 TYR 136 256.507 -11.982 1.377 1073 HE1 TYR 136 HE1 TYR 136 255.793 -9.613 -2.875 1074 HE2 TYR 136 HE2 TYR 136 255.337 -13.107 -0.469 1075 HH TYR 136 HH TYR 136 254.165 -11.470 -3.173 1076 H PHE 137 HN PHE 137 255.574 -7.556 3.867 1077 HA PHE 137 HA PHE 137 257.948 -6.899 5.490 1078 1HB PHE 137 HB2 PHE 137 255.167 -5.745 5.746 1079 2HB PHE 137 HB1 PHE 137 256.582 -5.283 6.688 1080 HD1 PHE 137 HD1 PHE 137 257.858 -3.496 6.005 1081 HD2 PHE 137 HD2 PHE 137 255.386 -5.479 3.167 1082 HE1 PHE 137 HE1 PHE 137 258.425 -1.793 4.327 1083 HE2 PHE 137 HE2 PHE 137 255.949 -3.777 1.481 1084 HZ PHE 137 HZ PHE 137 257.471 -1.931 2.060 1085 H LYS 138 HN LYS 138 258.218 -7.916 7.386 1086 HA LYS 138 HA LYS 138 256.276 -9.915 8.219 1087 1HB LYS 138 HB2 LYS 138 258.689 -10.494 8.131 1088 2HB LYS 138 HB1 LYS 138 259.011 -9.259 9.341 1089 1HG LYS 138 HG2 LYS 138 257.898 -10.459 11.022 1090 2HG LYS 138 HG1 LYS 138 257.126 -11.535 9.856 1091 1HD LYS 138 HD2 LYS 138 260.071 -11.514 9.803 1092 2HD LYS 138 HD1 LYS 138 259.345 -12.166 11.274 1093 1HE LYS 138 HE2 LYS 138 257.829 -13.412 9.456 1094 2HE LYS 138 HE1 LYS 138 259.296 -13.205 8.501 1095 1HZ LYS 138 HZ1 LYS 138 260.429 -14.664 9.764 1096 2HZ LYS 138 HZ2 LYS 138 258.888 -15.261 10.126 1097 3HZ LYS 138 HZ3 LYS 138 259.662 -14.211 11.204 1098 H PHE 139 HN PHE 139 254.876 -9.575 9.893 1099 HA PHE 139 HA PHE 139 255.258 -7.069 11.393 1100 1HB PHE 139 HB2 PHE 139 252.880 -8.488 10.347 1101 2HB PHE 139 HB1 PHE 139 252.687 -7.717 11.918 1102 HD1 PHE 139 HD1 PHE 139 251.494 -5.776 11.651 1103 HD2 PHE 139 HD2 PHE 139 254.554 -6.718 8.848 1104 HE1 PHE 139 HE1 PHE 139 251.145 -3.605 10.547 1105 HE2 PHE 139 HE2 PHE 139 254.212 -4.549 7.739 1106 HZ PHE 139 HZ PHE 139 252.505 -2.989 8.589 1107 H GLN 140 HN GLN 140 254.391 -7.018 13.603 1108 HA GLN 140 HA GLN 140 254.583 -9.564 15.045 1109 1HB GLN 140 HB2 GLN 140 256.747 -8.752 15.413 1110 2HB GLN 140 HB1 GLN 140 256.219 -7.081 15.470 1111 1HG GLN 140 HG2 GLN 140 256.983 -8.122 17.639 1112 2HG GLN 140 HG1 GLN 140 255.430 -7.291 17.666 1113 1HE2 GLN 140 HE21 GLN 140 256.879 -10.495 17.283 1114 2HE2 GLN 140 HE22 GLN 140 255.592 -11.363 18.041 1115 H GLY 141 HN GLY 141 252.263 -9.355 15.120 1116 1HA GLY 141 HA2 GLY 141 250.712 -9.005 16.984 1117 2HA GLY 141 HA1 GLY 141 251.395 -7.394 17.154 1118 H GLN 142 HN GLN 142 251.236 -6.079 14.994 1119 HA GLN 142 HA GLN 142 249.180 -6.604 13.170 1120 1HB GLN 142 HB2 GLN 142 248.327 -5.450 15.731 1121 2HB GLN 142 HB1 GLN 142 247.771 -4.557 14.322 1122 1HG GLN 142 HG2 GLN 142 247.207 -7.105 13.584 1123 2HG GLN 142 HG1 GLN 142 246.970 -7.187 15.329 1124 1HE2 GLN 142 HE21 GLN 142 245.754 -5.146 16.166 1125 2HE2 GLN 142 HE22 GLN 142 244.316 -4.755 15.292 1126 H ASP 143 HN ASP 143 250.955 -4.115 14.948 1127 HA ASP 143 HA ASP 143 251.088 -2.569 12.442 1128 1HB ASP 143 HB2 ASP 143 249.917 -1.703 14.741 1129 2HB ASP 143 HB1 ASP 143 251.552 -1.081 14.940 1130 H THR 144 HN THR 144 252.897 -4.235 14.785 1131 HA THR 144 HA THR 144 255.303 -2.664 14.477 1132 HB THR 144 HB THR 144 254.750 -5.298 15.837 1133 HG1 THR 144 HG1 THR 144 255.403 -2.722 16.828 1134 1HG2 THR 144 HG21 THR 144 256.974 -5.177 16.799 1135 2HG2 THR 144 HG22 THR 144 257.340 -3.768 15.804 1136 3HG2 THR 144 HG23 THR 144 257.051 -5.333 15.045 1137 H ILE 145 HN ILE 145 256.984 -3.044 13.126 1138 HA ILE 145 HA ILE 145 256.721 -5.378 11.363 1139 HB ILE 145 HB ILE 145 258.243 -2.850 10.738 1140 1HG1 ILE 145 HG12 ILE 145 255.509 -3.759 9.804 1141 2HG1 ILE 145 HG11 ILE 145 255.850 -2.369 10.830 1142 1HG2 ILE 145 HG21 ILE 145 258.092 -5.480 9.532 1143 2HG2 ILE 145 HG22 ILE 145 259.197 -4.148 9.195 1144 3HG2 ILE 145 HG23 ILE 145 257.626 -4.213 8.397 1145 1HD1 ILE 145 HD11 ILE 145 256.795 -2.679 7.991 1146 2HD1 ILE 145 HD12 ILE 145 256.986 -1.261 9.020 1147 3HD1 ILE 145 HD13 ILE 145 255.378 -1.759 8.495 1148 H LEU 146 HN LEU 146 258.413 -6.730 11.051 1149 HA LEU 146 HA LEU 146 260.831 -6.206 12.650 1150 1HB LEU 146 HB2 LEU 146 259.917 -8.982 12.017 1151 2HB LEU 146 HB1 LEU 146 260.943 -8.425 13.325 1152 HG LEU 146 HG LEU 146 258.136 -7.473 13.363 1153 1HD1 LEU 146 HD11 LEU 146 258.719 -10.239 13.040 1154 2HD1 LEU 146 HD12 LEU 146 257.165 -9.457 13.323 1155 3HD1 LEU 146 HD13 LEU 146 258.155 -9.968 14.689 1156 1HD2 LEU 146 HD21 LEU 146 258.699 -8.383 15.824 1157 2HD2 LEU 146 HD22 LEU 146 259.147 -6.773 15.259 1158 3HD2 LEU 146 HD23 LEU 146 260.334 -8.077 15.239 1159 H ASP 147 HN ASP 147 259.532 -6.914 9.571 1160 HA ASP 147 HA ASP 147 262.182 -6.937 8.422 1161 1HB ASP 147 HB2 ASP 147 260.952 -9.380 8.943 1162 2HB ASP 147 HB1 ASP 147 260.622 -9.096 7.237 1163 H TYR 148 HN TYR 148 262.227 -6.118 6.353 1164 HA TYR 148 HA TYR 148 259.675 -5.809 4.966 1165 1HB TYR 148 HB2 TYR 148 260.030 -3.464 4.516 1166 2HB TYR 148 HB1 TYR 148 260.020 -3.742 6.255 1167 HD1 TYR 148 HD1 TYR 148 261.840 -3.076 7.585 1168 HD2 TYR 148 HD2 TYR 148 262.279 -3.198 3.356 1169 HE1 TYR 148 HE1 TYR 148 264.016 -1.947 7.785 1170 HE2 TYR 148 HE2 TYR 148 264.456 -2.070 3.542 1171 HH TYR 148 HH TYR 148 265.530 -0.619 6.449 1172 H THR 149 HN THR 149 259.800 -6.093 2.804 1173 HA THR 149 HA THR 149 262.478 -6.049 1.587 1174 HB THR 149 HB THR 149 261.029 -7.935 0.141 1175 HG1 THR 149 HG1 THR 149 260.441 -9.421 1.820 1176 1HG2 THR 149 HG21 THR 149 262.524 -9.577 1.513 1177 2HG2 THR 149 HG22 THR 149 263.263 -8.084 2.093 1178 3HG2 THR 149 HG23 THR 149 263.241 -8.444 0.367 1179 H LEU 150 HN LEU 150 262.597 -5.356 -0.516 1180 HA LEU 150 HA LEU 150 260.117 -4.429 -1.778 1181 1HB LEU 150 HB2 LEU 150 262.621 -2.797 -1.375 1182 2HB LEU 150 HB1 LEU 150 261.332 -2.346 -2.475 1183 HG LEU 150 HG LEU 150 259.905 -2.675 -0.205 1184 1HD1 LEU 150 HD11 LEU 150 261.024 -2.264 1.714 1185 2HD1 LEU 150 HD12 LEU 150 262.239 -1.259 0.923 1186 3HD1 LEU 150 HD13 LEU 150 262.346 -3.017 0.821 1187 1HD2 LEU 150 HD21 LEU 150 260.413 -0.645 -1.874 1188 2HD2 LEU 150 HD22 LEU 150 261.251 -0.054 -0.438 1189 3HD2 LEU 150 HD23 LEU 150 259.534 -0.448 -0.359 1190 H ARG 151 HN ARG 151 259.968 -5.421 -3.683 1191 HA ARG 151 HA ARG 151 262.442 -5.804 -5.244 1192 1HB ARG 151 HB2 ARG 151 260.016 -7.607 -5.266 1193 2HB ARG 151 HB1 ARG 151 261.521 -7.862 -6.138 1194 1HG ARG 151 HG2 ARG 151 261.798 -7.554 -3.229 1195 2HG ARG 151 HG1 ARG 151 260.925 -8.991 -3.762 1196 1HD ARG 151 HD2 ARG 151 263.038 -8.994 -5.468 1197 2HD ARG 151 HD1 ARG 151 263.769 -8.295 -4.024 1198 HE ARG 151 HE ARG 151 263.754 -10.378 -3.120 1199 1HH1 ARG 151 HH11 ARG 151 261.213 -10.227 -5.507 1200 2HH1 ARG 151 HH12 ARG 151 260.757 -11.887 -5.311 1201 1HH2 ARG 151 HH21 ARG 151 263.156 -12.562 -2.860 1202 2HH2 ARG 151 HH22 ARG 151 261.860 -13.211 -3.808 1203 H GLU 152 HN GLU 152 262.469 -4.652 -7.052 1204 HA GLU 152 HA GLU 152 260.034 -3.475 -8.077 1205 1HB GLU 152 HB2 GLU 152 261.523 -2.305 -9.647 1206 2HB GLU 152 HB1 GLU 152 262.051 -2.116 -7.980 1207 1HG GLU 152 HG2 GLU 152 263.448 -4.322 -8.764 1208 2HG GLU 152 HG1 GLU 152 263.391 -3.374 -10.249 1209 H VAL 153 HN VAL 153 259.047 -3.914 -10.005 1210 HA VAL 153 HA VAL 153 260.165 -6.061 -11.666 1211 HB VAL 153 HB VAL 153 257.893 -7.044 -11.908 1212 1HG1 VAL 153 HG11 VAL 153 257.857 -7.891 -9.411 1213 2HG1 VAL 153 HG12 VAL 153 259.405 -7.048 -9.348 1214 3HG1 VAL 153 HG13 VAL 153 259.156 -8.345 -10.516 1215 1HG2 VAL 153 HG21 VAL 153 257.180 -5.340 -9.525 1216 2HG2 VAL 153 HG22 VAL 153 256.137 -6.485 -10.368 1217 3HG2 VAL 153 HG23 VAL 153 256.662 -5.009 -11.179 1218 H ASP 154 HN ASP 154 259.154 -6.191 -13.814 1219 HA ASP 154 HA ASP 154 258.407 -3.511 -14.751 1220 1HB ASP 154 HB2 ASP 154 260.421 -4.913 -15.676 1221 2HB ASP 154 HB1 ASP 154 259.170 -5.750 -16.593 1222 H THR 155 HN THR 155 257.377 -6.858 -14.699 1223 HA THR 155 HA THR 155 254.954 -6.152 -16.202 1224 HB THR 155 HB THR 155 256.218 -8.093 -17.027 1225 HG1 THR 155 HG1 THR 155 254.254 -8.614 -17.537 1226 1HG2 THR 155 HG21 THR 155 256.219 -8.858 -14.234 1227 2HG2 THR 155 HG22 THR 155 257.222 -9.426 -15.569 1228 3HG2 THR 155 HG23 THR 155 255.635 -10.144 -15.290 1229 H VAL 156 HN VAL 156 252.885 -6.886 -15.421 1230 HA VAL 156 HA VAL 156 252.784 -7.331 -12.513 1231 HB VAL 156 HB VAL 156 250.866 -5.540 -14.004 1232 1HG1 VAL 156 HG11 VAL 156 249.759 -5.246 -12.054 1233 2HG1 VAL 156 HG12 VAL 156 251.219 -5.390 -11.076 1234 3HG1 VAL 156 HG13 VAL 156 250.429 -6.839 -11.698 1235 1HG2 VAL 156 HG21 VAL 156 253.474 -4.972 -12.738 1236 2HG2 VAL 156 HG22 VAL 156 252.162 -3.852 -12.372 1237 3HG2 VAL 156 HG23 VAL 156 252.639 -4.134 -14.046 Start of MODEL 5 1 1H MET 1 HT1 MET 1 241.233 -23.004 -0.859 2 2H MET 1 HT2 MET 1 241.330 -24.521 -0.063 3 3H MET 1 HT3 MET 1 242.224 -24.246 -1.502 4 HA MET 1 HA MET 1 243.696 -24.128 0.289 5 1HB MET 1 HB2 MET 1 242.903 -21.427 -0.815 6 2HB MET 1 HB1 MET 1 244.404 -21.726 0.051 7 1HG MET 1 HG2 MET 1 245.237 -22.047 -1.998 8 2HG MET 1 HG1 MET 1 244.532 -23.653 -1.831 9 1HE MET 1 HE1 MET 1 243.502 -24.660 -3.248 10 2HE MET 1 HE2 MET 1 243.346 -24.072 -4.903 11 3HE MET 1 HE3 MET 1 241.923 -24.173 -3.866 12 H GLY 2 HN GLY 2 241.673 -21.233 0.750 13 1HA GLY 2 HA2 GLY 2 240.590 -20.455 2.642 14 2HA GLY 2 HA1 GLY 2 240.950 -21.984 3.430 15 H ALA 3 HN ALA 3 243.416 -19.979 1.970 16 HA ALA 3 HA ALA 3 244.239 -18.987 4.598 17 1HB ALA 3 HB1 ALA 3 245.723 -20.684 4.697 18 2HB ALA 3 HB2 ALA 3 246.662 -19.644 3.626 19 3HB ALA 3 HB3 ALA 3 245.693 -20.956 2.956 20 H SER 4 HN SER 4 246.493 -17.707 4.086 21 HA SER 4 HA SER 4 247.303 -15.740 3.278 22 1HB SER 4 HB2 SER 4 247.652 -15.602 0.933 23 2HB SER 4 HB1 SER 4 247.687 -17.321 1.324 24 HG SER 4 HG SER 4 246.390 -16.960 -0.490 25 H ARG 5 HN ARG 5 245.832 -14.493 4.448 26 HA ARG 5 HA ARG 5 243.299 -13.728 3.503 27 1HB ARG 5 HB2 ARG 5 245.033 -13.057 5.707 28 2HB ARG 5 HB1 ARG 5 244.314 -11.597 5.042 29 1HG ARG 5 HG2 ARG 5 242.831 -12.275 6.705 30 2HG ARG 5 HG1 ARG 5 242.085 -12.825 5.203 31 1HD ARG 5 HD2 ARG 5 243.912 -14.731 6.520 32 2HD ARG 5 HD1 ARG 5 242.411 -14.384 7.376 33 HE ARG 5 HE ARG 5 242.052 -15.009 4.590 34 1HH1 ARG 5 HH11 ARG 5 242.329 -16.323 7.811 35 2HH1 ARG 5 HH12 ARG 5 241.482 -17.781 7.423 36 1HH2 ARG 5 HH21 ARG 5 240.939 -16.928 4.079 37 2HH2 ARG 5 HH22 ARG 5 240.693 -18.126 5.304 38 H LEU 6 HN LEU 6 243.315 -13.080 1.400 39 HA LEU 6 HA LEU 6 245.161 -11.023 0.519 40 1HB LEU 6 HB2 LEU 6 244.119 -13.075 -0.816 41 2HB LEU 6 HB1 LEU 6 242.869 -11.898 -1.168 42 HG LEU 6 HG LEU 6 245.729 -11.173 -1.659 43 1HD1 LEU 6 HD11 LEU 6 244.039 -13.009 -3.325 44 2HD1 LEU 6 HD12 LEU 6 245.705 -13.225 -2.784 45 3HD1 LEU 6 HD13 LEU 6 245.328 -12.031 -4.026 46 1HD2 LEU 6 HD21 LEU 6 243.482 -10.492 -3.471 47 2HD2 LEU 6 HD22 LEU 6 244.877 -9.530 -2.981 48 3HD2 LEU 6 HD23 LEU 6 243.509 -9.721 -1.886 49 H TYR 7 HN TYR 7 244.789 -8.962 0.782 50 HA TYR 7 HA TYR 7 242.011 -7.991 0.855 51 1HB TYR 7 HB2 TYR 7 244.360 -7.318 2.591 52 2HB TYR 7 HB1 TYR 7 243.103 -6.116 2.318 53 HD1 TYR 7 HD1 TYR 7 241.581 -5.965 4.033 54 HD2 TYR 7 HD2 TYR 7 243.197 -9.783 3.077 55 HE1 TYR 7 HE1 TYR 7 240.220 -6.979 5.812 56 HE2 TYR 7 HE2 TYR 7 241.839 -10.808 4.851 57 HH TYR 7 HH TYR 7 239.466 -10.025 6.040 58 H THR 8 HN THR 8 242.181 -5.410 0.671 59 HA THR 8 HA THR 8 243.905 -4.824 -1.652 60 HB THR 8 HB THR 8 242.121 -3.628 -2.696 61 HG1 THR 8 HG1 THR 8 240.474 -4.224 -0.479 62 1HG2 THR 8 HG21 THR 8 240.199 -5.385 -2.617 63 2HG2 THR 8 HG22 THR 8 241.386 -6.340 -1.728 64 3HG2 THR 8 HG23 THR 8 241.747 -5.783 -3.361 65 H LEU 9 HN LEU 9 244.120 -2.460 -2.044 66 HA LEU 9 HA LEU 9 243.743 -0.693 0.207 67 1HB LEU 9 HB2 LEU 9 245.929 -2.070 0.520 68 2HB LEU 9 HB1 LEU 9 246.561 -1.055 -0.763 69 HG LEU 9 HG LEU 9 245.578 -0.156 1.936 70 1HD1 LEU 9 HD11 LEU 9 248.273 0.471 0.901 71 2HD1 LEU 9 HD12 LEU 9 247.965 -1.198 1.379 72 3HD1 LEU 9 HD13 LEU 9 247.741 0.108 2.543 73 1HD2 LEU 9 HD21 LEU 9 244.884 1.555 0.495 74 2HD2 LEU 9 HD22 LEU 9 246.329 1.412 -0.507 75 3HD2 LEU 9 HD23 LEU 9 246.444 2.094 1.116 76 H VAL 10 HN VAL 10 242.837 0.958 -0.912 77 HA VAL 10 HA VAL 10 244.091 1.745 -3.438 78 HB VAL 10 HB VAL 10 241.884 1.175 -3.910 79 1HG1 VAL 10 HG11 VAL 10 240.045 2.398 -2.466 80 2HG1 VAL 10 HG12 VAL 10 241.317 2.264 -1.256 81 3HG1 VAL 10 HG13 VAL 10 240.703 0.817 -2.056 82 1HG2 VAL 10 HG21 VAL 10 242.603 3.461 -4.717 83 2HG2 VAL 10 HG22 VAL 10 241.609 4.121 -3.419 84 3HG2 VAL 10 HG23 VAL 10 240.867 3.157 -4.694 85 H LEU 11 HN LEU 11 245.147 3.522 -3.542 86 HA LEU 11 HA LEU 11 244.496 5.721 -1.704 87 1HB LEU 11 HB2 LEU 11 246.919 4.211 -1.936 88 2HB LEU 11 HB1 LEU 11 247.232 5.859 -2.443 89 HG LEU 11 HG LEU 11 246.302 4.884 0.253 90 1HD1 LEU 11 HD11 LEU 11 248.538 4.978 0.506 91 2HD1 LEU 11 HD12 LEU 11 248.234 6.699 0.723 92 3HD1 LEU 11 HD13 LEU 11 248.756 6.088 -0.848 93 1HD2 LEU 11 HD21 LEU 11 245.933 7.562 -0.988 94 2HD2 LEU 11 HD22 LEU 11 246.338 7.463 0.726 95 3HD2 LEU 11 HD23 LEU 11 244.885 6.673 0.116 96 H VAL 12 HN VAL 12 243.687 7.304 -2.909 97 HA VAL 12 HA VAL 12 244.243 7.483 -5.715 98 HB VAL 12 HB VAL 12 242.750 9.477 -4.016 99 1HG1 VAL 12 HG11 VAL 12 242.147 10.496 -5.919 100 2HG1 VAL 12 HG12 VAL 12 241.900 8.970 -6.768 101 3HG1 VAL 12 HG13 VAL 12 243.520 9.654 -6.634 102 1HG2 VAL 12 HG21 VAL 12 242.054 6.759 -4.884 103 2HG2 VAL 12 HG22 VAL 12 240.832 7.985 -5.224 104 3HG2 VAL 12 HG23 VAL 12 241.396 7.736 -3.572 105 H LEU 13 HN LEU 13 246.454 7.880 -5.828 106 HA LEU 13 HA LEU 13 247.325 10.553 -4.945 107 1HB LEU 13 HB2 LEU 13 248.497 8.479 -4.064 108 2HB LEU 13 HB1 LEU 13 249.126 8.279 -5.687 109 HG LEU 13 HG LEU 13 250.831 9.556 -5.098 110 1HD1 LEU 13 HD11 LEU 13 248.743 11.696 -4.905 111 2HD1 LEU 13 HD12 LEU 13 249.816 11.334 -6.255 112 3HD1 LEU 13 HD13 LEU 13 250.470 12.013 -4.766 113 1HD2 LEU 13 HD21 LEU 13 249.350 9.541 -2.616 114 2HD2 LEU 13 HD22 LEU 13 250.312 11.005 -2.809 115 3HD2 LEU 13 HD23 LEU 13 251.086 9.424 -2.896 116 H GLN 14 HN GLN 14 247.432 11.993 -6.508 117 HA GLN 14 HA GLN 14 247.876 11.092 -9.270 118 1HB GLN 14 HB2 GLN 14 246.352 13.336 -8.050 119 2HB GLN 14 HB1 GLN 14 247.108 13.632 -9.609 120 1HG GLN 14 HG2 GLN 14 245.622 11.118 -9.453 121 2HG GLN 14 HG1 GLN 14 244.637 12.564 -9.238 122 1HE2 GLN 14 HE21 GLN 14 244.793 14.219 -10.899 123 2HE2 GLN 14 HE22 GLN 14 245.093 13.744 -12.533 124 HA PRO 15 HA PRO 15 251.833 13.020 -9.483 125 1HB PRO 15 HB2 PRO 15 251.794 14.190 -11.949 126 2HB PRO 15 HB1 PRO 15 251.994 12.454 -11.690 127 1HG PRO 15 HG2 PRO 15 249.529 13.992 -12.408 128 2HG PRO 15 HG1 PRO 15 250.113 12.447 -13.056 129 1HD PRO 15 HD2 PRO 15 248.152 12.570 -11.215 130 2HD PRO 15 HD1 PRO 15 249.337 11.248 -11.236 131 H GLN 16 HN GLN 16 249.594 14.647 -8.323 132 HA GLN 16 HA GLN 16 250.966 17.155 -8.278 133 1HB GLN 16 HB2 GLN 16 248.417 16.828 -9.787 134 2HB GLN 16 HB1 GLN 16 248.616 18.287 -8.826 135 1HG GLN 16 HG2 GLN 16 250.812 18.623 -10.028 136 2HG GLN 16 HG1 GLN 16 250.299 17.339 -11.122 137 1HE2 GLN 16 HE21 GLN 16 248.382 17.670 -12.367 138 2HE2 GLN 16 HE22 GLN 16 247.872 19.269 -12.773 139 H ARG 17 HN ARG 17 248.089 15.295 -7.418 140 HA ARG 17 HA ARG 17 248.302 16.325 -4.692 141 1HB ARG 17 HB2 ARG 17 245.563 16.062 -5.866 142 2HB ARG 17 HB1 ARG 17 246.106 17.051 -4.519 143 1HG ARG 17 HG2 ARG 17 247.441 18.315 -6.383 144 2HG ARG 17 HG1 ARG 17 246.226 17.595 -7.441 145 1HD ARG 17 HD2 ARG 17 244.668 18.540 -5.436 146 2HD ARG 17 HD1 ARG 17 245.969 19.730 -5.434 147 HE ARG 17 HE ARG 17 243.932 19.406 -7.416 148 1HH1 ARG 17 HH11 ARG 17 247.208 20.481 -6.880 149 2HH1 ARG 17 HH12 ARG 17 247.207 21.564 -8.232 150 1HH2 ARG 17 HH21 ARG 17 243.928 20.828 -9.196 151 2HH2 ARG 17 HH22 ARG 17 245.345 21.762 -9.546 152 H VAL 18 HN VAL 18 247.061 15.000 -3.120 153 HA VAL 18 HA VAL 18 246.578 12.254 -4.076 154 HB VAL 18 HB VAL 18 248.747 12.158 -3.083 155 1HG1 VAL 18 HG11 VAL 18 248.339 14.333 -1.766 156 2HG1 VAL 18 HG12 VAL 18 249.392 13.108 -1.061 157 3HG1 VAL 18 HG13 VAL 18 247.730 13.272 -0.496 158 1HG2 VAL 18 HG21 VAL 18 247.225 10.315 -2.530 159 2HG2 VAL 18 HG22 VAL 18 246.736 11.166 -1.065 160 3HG2 VAL 18 HG23 VAL 18 248.397 10.604 -1.244 161 H LEU 19 HN LEU 19 245.166 11.001 -2.749 162 HA LEU 19 HA LEU 19 243.434 12.612 -0.990 163 1HB LEU 19 HB2 LEU 19 242.774 11.231 -3.361 164 2HB LEU 19 HB1 LEU 19 242.062 10.328 -2.037 165 HG LEU 19 HG LEU 19 240.391 11.817 -2.689 166 1HD1 LEU 19 HD11 LEU 19 241.662 13.460 -0.540 167 2HD1 LEU 19 HD12 LEU 19 241.057 11.837 -0.207 168 3HD1 LEU 19 HD13 LEU 19 239.957 13.085 -0.796 169 1HD2 LEU 19 HD21 LEU 19 240.692 13.808 -3.679 170 2HD2 LEU 19 HD22 LEU 19 242.363 13.270 -3.842 171 3HD2 LEU 19 HD23 LEU 19 241.903 14.321 -2.503 172 H LEU 20 HN LEU 20 243.706 12.000 1.053 173 HA LEU 20 HA LEU 20 244.245 9.156 1.597 174 1HB LEU 20 HB2 LEU 20 245.422 11.625 2.601 175 2HB LEU 20 HB1 LEU 20 244.914 10.554 3.891 176 HG LEU 20 HG LEU 20 246.694 9.662 1.630 177 1HD1 LEU 20 HD11 LEU 20 247.656 10.350 4.383 178 2HD1 LEU 20 HD12 LEU 20 247.597 11.561 3.103 179 3HD1 LEU 20 HD13 LEU 20 248.590 10.116 2.905 180 1HD2 LEU 20 HD21 LEU 20 246.065 8.491 4.337 181 2HD2 LEU 20 HD22 LEU 20 247.246 7.848 3.196 182 3HD2 LEU 20 HD23 LEU 20 245.534 7.869 2.774 183 H GLY 21 HN GLY 21 242.951 8.046 2.952 184 1HA GLY 21 HA2 GLY 21 240.542 9.417 3.892 185 2HA GLY 21 HA1 GLY 21 240.757 7.678 3.753 186 H MET 22 HN MET 22 240.263 9.983 5.942 187 HA MET 22 HA MET 22 241.969 8.704 7.972 188 1HB MET 22 HB2 MET 22 242.531 11.021 7.834 189 2HB MET 22 HB1 MET 22 240.839 11.498 7.837 190 1HG MET 22 HG2 MET 22 240.587 10.925 10.120 191 2HG MET 22 HG1 MET 22 242.147 10.108 10.155 192 1HE MET 22 HE1 MET 22 244.586 11.648 10.640 193 2HE MET 22 HE2 MET 22 244.585 13.070 9.601 194 3HE MET 22 HE3 MET 22 244.112 11.502 8.948 195 H LYS 23 HN LYS 23 241.029 7.949 9.870 196 HA LYS 23 HA LYS 23 238.143 7.596 9.745 197 1HB LYS 23 HB2 LYS 23 240.389 6.271 11.168 198 2HB LYS 23 HB1 LYS 23 238.826 6.266 11.973 199 1HG LYS 23 HG2 LYS 23 238.719 5.503 9.152 200 2HG LYS 23 HG1 LYS 23 239.674 4.417 10.164 201 1HD LYS 23 HD2 LYS 23 236.883 5.305 10.868 202 2HD LYS 23 HD1 LYS 23 237.228 3.842 9.946 203 1HE LYS 23 HE2 LYS 23 238.913 3.744 12.180 204 2HE LYS 23 HE1 LYS 23 237.350 4.290 12.787 205 1HZ LYS 23 HZ1 LYS 23 236.930 2.098 12.831 206 2HZ LYS 23 HZ2 LYS 23 238.113 1.720 11.683 207 3HZ LYS 23 HZ3 LYS 23 236.604 2.298 11.182 208 H LYS 24 HN LYS 24 236.733 8.281 11.389 209 HA LYS 24 HA LYS 24 237.724 10.601 12.827 210 1HB LYS 24 HB2 LYS 24 235.024 9.568 12.089 211 2HB LYS 24 HB1 LYS 24 235.151 10.638 13.477 212 1HG LYS 24 HG2 LYS 24 235.353 12.429 12.186 213 2HG LYS 24 HG1 LYS 24 236.623 11.673 11.220 214 1HD LYS 24 HD2 LYS 24 235.067 10.688 9.754 215 2HD LYS 24 HD1 LYS 24 233.720 10.987 10.855 216 1HE LYS 24 HE2 LYS 24 235.252 13.329 9.856 217 2HE LYS 24 HE1 LYS 24 234.169 12.510 8.731 218 1HZ LYS 24 HZ1 LYS 24 232.406 12.768 10.468 219 2HZ LYS 24 HZ2 LYS 24 232.933 14.215 9.769 220 3HZ LYS 24 HZ3 LYS 24 233.465 13.781 11.314 221 H ARG 25 HN ARG 25 236.549 7.377 13.439 222 HA ARG 25 HA ARG 25 237.721 7.291 15.998 223 1HB ARG 25 HB2 ARG 25 235.592 6.923 17.301 224 2HB ARG 25 HB1 ARG 25 235.903 8.582 16.811 225 1HG ARG 25 HG2 ARG 25 234.146 6.764 15.200 226 2HG ARG 25 HG1 ARG 25 233.530 7.703 16.562 227 1HD ARG 25 HD2 ARG 25 234.831 9.638 15.269 228 2HD ARG 25 HD1 ARG 25 234.462 8.593 13.898 229 HE ARG 25 HE ARG 25 232.253 9.177 14.087 230 1HH1 ARG 25 HH11 ARG 25 233.932 10.134 16.993 231 2HH1 ARG 25 HH12 ARG 25 232.587 11.023 17.625 232 1HH2 ARG 25 HH21 ARG 25 230.485 10.346 14.917 233 2HH2 ARG 25 HH22 ARG 25 230.630 11.143 16.448 234 H GLY 26 HN GLY 26 238.452 5.282 16.026 235 1HA GLY 26 HA2 GLY 26 236.993 2.980 16.183 236 2HA GLY 26 HA1 GLY 26 237.227 3.210 14.456 237 H PHE 27 HN PHE 27 238.882 2.110 13.663 238 HA PHE 27 HA PHE 27 241.076 1.374 15.459 239 1HB PHE 27 HB2 PHE 27 239.722 0.071 13.238 240 2HB PHE 27 HB1 PHE 27 241.472 0.041 13.050 241 HD1 PHE 27 HD1 PHE 27 242.857 -0.849 14.992 242 HD2 PHE 27 HD2 PHE 27 238.653 -1.423 14.664 243 HE1 PHE 27 HE1 PHE 27 242.995 -2.734 16.567 244 HE2 PHE 27 HE2 PHE 27 238.783 -3.309 16.238 245 HZ PHE 27 HZ PHE 27 240.956 -3.966 17.192 246 H GLY 28 HN GLY 28 240.723 4.033 14.095 247 1HA GLY 28 HA2 GLY 28 243.418 4.532 13.510 248 2HA GLY 28 HA1 GLY 28 242.577 4.279 11.989 249 H ALA 29 HN ALA 29 241.051 5.764 14.780 250 HA ALA 29 HA ALA 29 240.052 7.961 13.408 251 1HB ALA 29 HB1 ALA 29 240.696 8.375 16.253 252 2HB ALA 29 HB2 ALA 29 239.680 6.987 15.863 253 3HB ALA 29 HB3 ALA 29 239.183 8.607 15.378 254 H GLY 30 HN GLY 30 240.696 10.121 13.218 255 1HA GLY 30 HA2 GLY 30 242.202 11.814 12.848 256 2HA GLY 30 HA1 GLY 30 242.899 11.335 14.387 257 H ARG 31 HN ARG 31 242.822 9.036 11.798 258 HA ARG 31 HA ARG 31 245.640 9.590 11.170 259 1HB ARG 31 HB2 ARG 31 244.489 7.172 12.389 260 2HB ARG 31 HB1 ARG 31 245.529 6.858 11.007 261 1HG ARG 31 HG2 ARG 31 247.361 8.005 12.058 262 2HG ARG 31 HG1 ARG 31 246.325 8.506 13.398 263 1HD ARG 31 HD2 ARG 31 247.762 6.577 13.960 264 2HD ARG 31 HD1 ARG 31 246.042 6.215 14.094 265 HE ARG 31 HE ARG 31 246.879 5.485 11.535 266 1HH1 ARG 31 HH11 ARG 31 247.422 4.534 14.848 267 2HH1 ARG 31 HH12 ARG 31 247.759 2.883 14.450 268 1HH2 ARG 31 HH21 ARG 31 247.321 3.313 11.010 269 2HH2 ARG 31 HH22 ARG 31 247.701 2.189 12.271 270 H TRP 32 HN TRP 32 246.168 9.407 9.059 271 HA TRP 32 HA TRP 32 244.001 8.880 7.191 272 1HB TRP 32 HB2 TRP 32 246.575 9.508 5.969 273 2HB TRP 32 HB1 TRP 32 245.017 10.294 5.776 274 HD1 TRP 32 HD1 TRP 32 247.987 10.316 8.276 275 HE1 TRP 32 HE1 TRP 32 248.181 12.693 9.240 276 HE3 TRP 32 HE3 TRP 32 243.923 12.446 6.024 277 HZ2 TRP 32 HZ2 TRP 32 246.807 15.150 9.061 278 HZ3 TRP 32 HZ3 TRP 32 243.435 14.814 6.472 279 HH2 TRP 32 HH2 TRP 32 244.848 16.138 7.959 280 H ASN 33 HN ASN 33 244.222 7.452 5.381 281 HA ASN 33 HA ASN 33 246.356 5.724 4.921 282 1HB ASN 33 HB2 ASN 33 245.356 3.600 5.892 283 2HB ASN 33 HB1 ASN 33 246.055 4.719 7.057 284 1HD2 ASN 33 HD21 ASN 33 244.903 4.587 8.842 285 2HD2 ASN 33 HD22 ASN 33 243.178 4.631 8.942 286 H GLY 34 HN GLY 34 245.922 4.183 3.287 287 1HA GLY 34 HA2 GLY 34 243.972 4.922 1.429 288 2HA GLY 34 HA1 GLY 34 244.856 3.402 1.411 289 H PHE 35 HN PHE 35 242.347 3.339 0.492 290 HA PHE 35 HA PHE 35 240.628 2.437 2.685 291 1HB PHE 35 HB2 PHE 35 239.711 2.480 -0.160 292 2HB PHE 35 HB1 PHE 35 238.804 2.801 1.309 293 HD1 PHE 35 HD1 PHE 35 239.057 4.987 2.461 294 HD2 PHE 35 HD2 PHE 35 240.779 4.220 -1.354 295 HE1 PHE 35 HE1 PHE 35 239.313 7.406 2.094 296 HE2 PHE 35 HE2 PHE 35 241.040 6.638 -1.727 297 HZ PHE 35 HZ PHE 35 240.306 8.235 -0.002 298 H GLY 36 HN GLY 36 241.122 0.394 3.243 299 1HA GLY 36 HA2 GLY 36 241.879 -1.538 1.217 300 2HA GLY 36 HA1 GLY 36 241.857 -1.805 2.952 301 H GLY 37 HN GLY 37 240.964 -3.825 1.547 302 1HA GLY 37 HA2 GLY 37 238.354 -4.263 2.452 303 2HA GLY 37 HA1 GLY 37 238.260 -3.800 0.759 304 H LYS 38 HN LYS 38 238.410 -6.378 2.788 305 HA LYS 38 HA LYS 38 240.202 -8.150 1.585 306 1HB LYS 38 HB2 LYS 38 238.952 -9.920 2.666 307 2HB LYS 38 HB1 LYS 38 239.088 -8.546 3.755 308 1HG LYS 38 HG2 LYS 38 236.783 -7.866 2.979 309 2HG LYS 38 HG1 LYS 38 236.681 -9.447 2.203 310 1HD LYS 38 HD2 LYS 38 237.555 -9.487 5.010 311 2HD LYS 38 HD1 LYS 38 235.899 -8.935 4.750 312 1HE LYS 38 HE2 LYS 38 235.801 -11.052 3.184 313 2HE LYS 38 HE1 LYS 38 237.130 -11.593 4.208 314 1HZ LYS 38 HZ1 LYS 38 234.642 -10.574 5.417 315 2HZ LYS 38 HZ2 LYS 38 235.788 -11.632 6.071 316 3HZ LYS 38 HZ3 LYS 38 234.729 -12.173 4.870 317 H VAL 39 HN VAL 39 239.985 -9.739 0.011 318 HA VAL 39 HA VAL 39 238.227 -9.084 -2.158 319 HB VAL 39 HB VAL 39 239.913 -11.581 -1.958 320 1HG1 VAL 39 HG11 VAL 39 238.980 -9.916 -4.295 321 2HG1 VAL 39 HG12 VAL 39 238.365 -11.503 -3.830 322 3HG1 VAL 39 HG13 VAL 39 240.025 -11.332 -4.401 323 1HG2 VAL 39 HG21 VAL 39 241.590 -10.096 -1.579 324 2HG2 VAL 39 HG22 VAL 39 240.730 -8.758 -2.340 325 3HG2 VAL 39 HG23 VAL 39 241.512 -9.986 -3.336 326 H GLN 40 HN GLN 40 236.156 -9.640 -2.160 327 HA GLN 40 HA GLN 40 234.814 -11.321 -0.490 328 1HB GLN 40 HB2 GLN 40 234.076 -9.756 -2.555 329 2HB GLN 40 HB1 GLN 40 233.847 -11.336 -3.290 330 1HG GLN 40 HG2 GLN 40 232.654 -11.653 -0.852 331 2HG GLN 40 HG1 GLN 40 232.287 -9.972 -1.240 332 1HE2 GLN 40 HE21 GLN 40 230.633 -12.464 -1.126 333 2HE2 GLN 40 HE22 GLN 40 229.819 -12.519 -2.649 334 H GLU 41 HN GLU 41 233.626 -13.381 -1.108 335 HA GLU 41 HA GLU 41 235.515 -15.434 -1.513 336 1HB GLU 41 HB2 GLU 41 233.551 -16.945 -1.515 337 2HB GLU 41 HB1 GLU 41 233.549 -15.821 -0.163 338 1HG GLU 41 HG2 GLU 41 231.651 -14.844 -0.818 339 2HG GLU 41 HG1 GLU 41 232.118 -14.848 -2.518 340 H GLY 42 HN GLY 42 236.418 -14.655 -3.576 341 1HA GLY 42 HA2 GLY 42 236.687 -15.684 -5.733 342 2HA GLY 42 HA1 GLY 42 234.942 -15.861 -5.819 343 H GLU 43 HN GLU 43 236.947 -13.010 -5.045 344 HA GLU 43 HA GLU 43 235.882 -11.732 -7.449 345 1HB GLU 43 HB2 GLU 43 235.144 -9.876 -6.355 346 2HB GLU 43 HB1 GLU 43 234.938 -11.023 -5.044 347 1HG GLU 43 HG2 GLU 43 236.868 -10.265 -3.941 348 2HG GLU 43 HG1 GLU 43 237.431 -9.382 -5.358 349 H THR 44 HN THR 44 237.250 -9.656 -7.855 350 HA THR 44 HA THR 44 240.025 -10.556 -7.720 351 HB THR 44 HB THR 44 240.385 -8.977 -9.566 352 HG1 THR 44 HG1 THR 44 237.588 -8.576 -9.567 353 1HG2 THR 44 HG21 THR 44 239.558 -10.374 -11.149 354 2HG2 THR 44 HG22 THR 44 237.955 -10.430 -10.413 355 3HG2 THR 44 HG23 THR 44 239.271 -11.388 -9.735 356 H ILE 45 HN ILE 45 241.671 -9.294 -6.958 357 HA ILE 45 HA ILE 45 241.221 -7.734 -4.747 358 HB ILE 45 HB ILE 45 243.605 -7.256 -6.512 359 1HG1 ILE 45 HG12 ILE 45 244.411 -9.211 -4.801 360 2HG1 ILE 45 HG11 ILE 45 242.766 -9.727 -5.159 361 1HG2 ILE 45 HG21 ILE 45 243.142 -7.188 -3.547 362 2HG2 ILE 45 HG22 ILE 45 243.484 -5.825 -4.612 363 3HG2 ILE 45 HG23 ILE 45 244.726 -7.040 -4.306 364 1HD1 ILE 45 HD11 ILE 45 245.096 -10.081 -6.703 365 2HD1 ILE 45 HD12 ILE 45 244.037 -8.986 -7.590 366 3HD1 ILE 45 HD13 ILE 45 243.444 -10.568 -7.083 367 H GLU 46 HN GLU 46 241.327 -6.752 -8.112 368 HA GLU 46 HA GLU 46 241.350 -3.932 -7.567 369 1HB GLU 46 HB2 GLU 46 242.097 -5.121 -9.728 370 2HB GLU 46 HB1 GLU 46 240.385 -5.211 -10.119 371 1HG GLU 46 HG2 GLU 46 240.207 -2.805 -10.066 372 2HG GLU 46 HG1 GLU 46 241.889 -2.666 -9.555 373 H ASP 47 HN ASP 47 238.983 -6.436 -7.829 374 HA ASP 47 HA ASP 47 236.755 -4.620 -8.101 375 1HB ASP 47 HB2 ASP 47 237.096 -7.580 -7.941 376 2HB ASP 47 HB1 ASP 47 235.537 -6.911 -7.470 377 H GLY 48 HN GLY 48 238.357 -6.506 -5.607 378 1HA GLY 48 HA2 GLY 48 236.438 -5.958 -3.554 379 2HA GLY 48 HA1 GLY 48 238.076 -6.558 -3.314 380 H ALA 49 HN ALA 49 239.362 -4.388 -4.689 381 HA ALA 49 HA ALA 49 239.517 -2.511 -2.531 382 1HB ALA 49 HB1 ALA 49 240.782 -1.764 -5.074 383 2HB ALA 49 HB2 ALA 49 241.277 -3.332 -4.439 384 3HB ALA 49 HB3 ALA 49 241.469 -1.882 -3.455 385 H ARG 50 HN ARG 50 238.232 -2.571 -5.803 386 HA ARG 50 HA ARG 50 237.485 0.152 -5.912 387 1HB ARG 50 HB2 ARG 50 236.885 -2.294 -7.494 388 2HB ARG 50 HB1 ARG 50 235.801 -0.922 -7.681 389 1HG ARG 50 HG2 ARG 50 238.038 0.400 -8.018 390 2HG ARG 50 HG1 ARG 50 238.665 -1.196 -8.434 391 1HD ARG 50 HD2 ARG 50 237.912 -0.025 -10.426 392 2HD ARG 50 HD1 ARG 50 236.907 -1.441 -10.121 393 HE ARG 50 HE ARG 50 235.808 0.929 -8.972 394 1HH1 ARG 50 HH11 ARG 50 236.131 -0.855 -11.954 395 2HH1 ARG 50 HH12 ARG 50 234.691 -0.194 -12.652 396 1HH2 ARG 50 HH21 ARG 50 233.912 1.798 -9.887 397 2HH2 ARG 50 HH22 ARG 50 233.431 1.313 -11.479 398 H ARG 51 HN ARG 51 235.516 -2.779 -5.441 399 HA ARG 51 HA ARG 51 233.101 -1.487 -4.901 400 1HB ARG 51 HB2 ARG 51 234.047 -4.148 -3.823 401 2HB ARG 51 HB1 ARG 51 232.378 -3.602 -3.902 402 1HG ARG 51 HG2 ARG 51 233.860 -3.585 -6.448 403 2HG ARG 51 HG1 ARG 51 233.522 -5.171 -5.750 404 1HD ARG 51 HD2 ARG 51 231.134 -4.521 -5.566 405 2HD ARG 51 HD1 ARG 51 231.517 -3.014 -6.397 406 HE ARG 51 HE ARG 51 231.481 -4.160 -8.364 407 1HH1 ARG 51 HH11 ARG 51 231.985 -6.449 -5.777 408 2HH1 ARG 51 HH12 ARG 51 231.897 -7.832 -6.816 409 1HH2 ARG 51 HH21 ARG 51 231.366 -5.978 -9.732 410 2HH2 ARG 51 HH22 ARG 51 231.547 -7.565 -9.061 411 H GLU 52 HN GLU 52 235.782 -2.281 -2.790 412 HA GLU 52 HA GLU 52 234.358 -1.463 -0.406 413 1HB GLU 52 HB2 GLU 52 237.233 -2.287 -0.853 414 2HB GLU 52 HB1 GLU 52 236.556 -1.877 0.717 415 1HG GLU 52 HG2 GLU 52 235.051 -3.909 -0.760 416 2HG GLU 52 HG1 GLU 52 236.691 -4.381 -0.315 417 H LEU 53 HN LEU 53 236.438 -0.098 -2.782 418 HA LEU 53 HA LEU 53 237.496 2.056 -1.307 419 1HB LEU 53 HB2 LEU 53 238.564 1.566 -3.335 420 2HB LEU 53 HB1 LEU 53 237.054 1.520 -4.225 421 HG LEU 53 HG LEU 53 236.844 3.961 -3.948 422 1HD1 LEU 53 HD11 LEU 53 238.246 5.208 -2.714 423 2HD1 LEU 53 HD12 LEU 53 239.655 4.235 -3.136 424 3HD1 LEU 53 HD13 LEU 53 238.543 3.681 -1.885 425 1HD2 LEU 53 HD21 LEU 53 239.088 4.427 -5.299 426 2HD2 LEU 53 HD22 LEU 53 237.724 3.563 -6.010 427 3HD2 LEU 53 HD23 LEU 53 239.101 2.665 -5.373 428 H GLN 54 HN GLN 54 234.749 1.845 -3.540 429 HA GLN 54 HA GLN 54 233.882 4.504 -3.241 430 1HB GLN 54 HB2 GLN 54 232.971 3.416 -5.080 431 2HB GLN 54 HB1 GLN 54 232.586 1.967 -4.165 432 1HG GLN 54 HG2 GLN 54 230.597 2.781 -3.441 433 2HG GLN 54 HG1 GLN 54 231.160 4.451 -3.420 434 1HE2 GLN 54 HE21 GLN 54 230.522 1.828 -5.725 435 2HE2 GLN 54 HE22 GLN 54 229.803 2.832 -6.932 436 H GLU 55 HN GLU 55 233.511 1.718 -1.247 437 HA GLU 55 HA GLU 55 231.296 2.760 0.268 438 1HB GLU 55 HB2 GLU 55 232.951 0.287 0.328 439 2HB GLU 55 HB1 GLU 55 232.077 0.734 1.787 440 1HG GLU 55 HG2 GLU 55 230.466 0.854 -0.646 441 2HG GLU 55 HG1 GLU 55 231.077 -0.754 -0.262 442 H GLU 56 HN GLU 56 234.750 2.988 0.455 443 HA GLU 56 HA GLU 56 234.817 3.465 3.276 444 1HB GLU 56 HB2 GLU 56 236.737 3.154 1.148 445 2HB GLU 56 HB1 GLU 56 237.166 4.511 2.182 446 1HG GLU 56 HG2 GLU 56 236.344 2.106 3.632 447 2HG GLU 56 HG1 GLU 56 237.803 1.911 2.662 448 H SER 57 HN SER 57 234.982 5.621 0.426 449 HA SER 57 HA SER 57 234.240 7.809 2.239 450 1HB SER 57 HB2 SER 57 236.809 7.589 1.505 451 2HB SER 57 HB1 SER 57 236.201 8.498 0.121 452 HG SER 57 HG SER 57 236.960 9.613 2.206 453 H GLY 58 HN GLY 58 233.276 6.134 -0.317 454 1HA GLY 58 HA2 GLY 58 231.544 6.616 -1.787 455 2HA GLY 58 HA1 GLY 58 231.657 8.305 -1.316 456 H LEU 59 HN LEU 59 234.725 7.703 -1.932 457 HA LEU 59 HA LEU 59 234.633 8.872 -4.557 458 1HB LEU 59 HB2 LEU 59 236.932 7.939 -2.842 459 2HB LEU 59 HB1 LEU 59 237.118 8.744 -4.386 460 HG LEU 59 HG LEU 59 236.353 9.862 -1.742 461 1HD1 LEU 59 HD11 LEU 59 237.651 11.791 -2.793 462 2HD1 LEU 59 HD12 LEU 59 238.038 10.666 -4.095 463 3HD1 LEU 59 HD13 LEU 59 238.547 10.313 -2.443 464 1HD2 LEU 59 HD21 LEU 59 235.285 11.799 -2.751 465 2HD2 LEU 59 HD22 LEU 59 234.373 10.334 -3.112 466 3HD2 LEU 59 HD23 LEU 59 235.404 11.057 -4.346 467 H THR 60 HN THR 60 234.073 7.596 -6.176 468 HA THR 60 HA THR 60 234.995 4.833 -6.231 469 HB THR 60 HB THR 60 233.526 5.817 -8.570 470 HG1 THR 60 HG1 THR 60 231.714 6.403 -7.582 471 1HG2 THR 60 HG21 THR 60 233.130 3.636 -8.602 472 2HG2 THR 60 HG22 THR 60 232.010 3.907 -7.266 473 3HG2 THR 60 HG23 THR 60 233.679 3.441 -6.937 474 H VAL 61 HN VAL 61 235.639 4.144 -8.641 475 HA VAL 61 HA VAL 61 237.412 6.178 -9.775 476 HB VAL 61 HB VAL 61 239.313 4.686 -9.870 477 1HG1 VAL 61 HG11 VAL 61 239.720 4.430 -7.372 478 2HG1 VAL 61 HG12 VAL 61 238.099 5.088 -7.153 479 3HG1 VAL 61 HG13 VAL 61 239.337 6.049 -7.959 480 1HG2 VAL 61 HG21 VAL 61 237.333 2.696 -9.072 481 2HG2 VAL 61 HG22 VAL 61 238.833 2.598 -8.150 482 3HG2 VAL 61 HG23 VAL 61 238.871 2.494 -9.911 483 H ASP 62 HN ASP 62 237.672 6.078 -11.932 484 HA ASP 62 HA ASP 62 235.942 4.298 -13.395 485 1HB ASP 62 HB2 ASP 62 237.898 6.381 -14.396 486 2HB ASP 62 HB1 ASP 62 236.686 5.558 -15.373 487 H ALA 63 HN ALA 63 239.218 4.351 -12.396 488 HA ALA 63 HA ALA 63 239.778 1.768 -13.255 489 1HB ALA 63 HB1 ALA 63 241.508 3.390 -14.967 490 2HB ALA 63 HB2 ALA 63 239.808 3.424 -15.430 491 3HB ALA 63 HB3 ALA 63 240.657 1.883 -15.313 492 H LEU 64 HN LEU 64 240.655 1.718 -11.154 493 HA LEU 64 HA LEU 64 242.564 3.441 -10.071 494 1HB LEU 64 HB2 LEU 64 242.010 0.511 -9.677 495 2HB LEU 64 HB1 LEU 64 243.335 1.292 -8.840 496 HG LEU 64 HG LEU 64 240.796 2.713 -8.544 497 1HD1 LEU 64 HD11 LEU 64 239.701 1.127 -7.154 498 2HD1 LEU 64 HD12 LEU 64 241.058 0.005 -7.261 499 3HD1 LEU 64 HD13 LEU 64 240.061 0.322 -8.681 500 1HD2 LEU 64 HD21 LEU 64 242.220 1.613 -6.220 501 2HD2 LEU 64 HD22 LEU 64 241.685 3.260 -6.551 502 3HD2 LEU 64 HD23 LEU 64 243.185 2.661 -7.262 503 H HIS 65 HN HIS 65 244.894 2.499 -9.529 504 HA HIS 65 HA HIS 65 246.075 1.353 -11.957 505 1HB HIS 65 HB2 HIS 65 246.258 3.963 -11.689 506 2HB HIS 65 HB1 HIS 65 247.527 3.553 -10.541 507 HD1 HIS 65 HD1 HIS 65 249.543 4.261 -11.860 508 HD2 HIS 65 HD2 HIS 65 247.032 1.738 -14.003 509 HE1 HIS 65 HE1 HIS 65 250.799 3.690 -13.963 510 HE2 HIS 65 HE2 HIS 65 249.225 2.229 -15.281 511 H LYS 66 HN LYS 66 246.667 -0.589 -11.127 512 HA LYS 66 HA LYS 66 247.607 -1.031 -8.504 513 1HB LYS 66 HB2 LYS 66 248.548 -3.176 -9.519 514 2HB LYS 66 HB1 LYS 66 246.815 -2.933 -9.669 515 1HG LYS 66 HG2 LYS 66 248.013 -1.783 -11.951 516 2HG LYS 66 HG1 LYS 66 248.750 -3.368 -11.710 517 1HD LYS 66 HD2 LYS 66 246.702 -4.478 -11.886 518 2HD LYS 66 HD1 LYS 66 245.776 -3.007 -11.585 519 1HE LYS 66 HE2 LYS 66 247.508 -2.897 -13.949 520 2HE LYS 66 HE1 LYS 66 246.221 -4.098 -14.042 521 1HZ LYS 66 HZ1 LYS 66 245.901 -1.540 -14.695 522 2HZ LYS 66 HZ2 LYS 66 245.433 -1.478 -13.071 523 3HZ LYS 66 HZ3 LYS 66 244.640 -2.523 -14.140 524 H VAL 67 HN VAL 67 249.551 -0.631 -7.593 525 HA VAL 67 HA VAL 67 251.807 -0.199 -9.455 526 HB VAL 67 HB VAL 67 252.657 1.568 -7.914 527 1HG1 VAL 67 HG11 VAL 67 251.180 3.312 -8.775 528 2HG1 VAL 67 HG12 VAL 67 249.979 2.091 -9.199 529 3HG1 VAL 67 HG13 VAL 67 251.542 2.111 -10.016 530 1HG2 VAL 67 HG21 VAL 67 251.637 1.393 -5.878 531 2HG2 VAL 67 HG22 VAL 67 250.073 0.966 -6.573 532 3HG2 VAL 67 HG23 VAL 67 250.627 2.639 -6.611 533 H GLY 68 HN GLY 68 251.011 -0.840 -6.026 534 1HA GLY 68 HA2 GLY 68 253.418 -2.543 -5.981 535 2HA GLY 68 HA1 GLY 68 253.139 -1.379 -4.701 536 H GLN 69 HN GLN 69 253.099 -4.508 -5.246 537 HA GLN 69 HA GLN 69 250.659 -5.049 -3.697 538 1HB GLN 69 HB2 GLN 69 250.848 -6.320 -5.782 539 2HB GLN 69 HB1 GLN 69 252.423 -6.926 -5.287 540 1HG GLN 69 HG2 GLN 69 251.529 -8.554 -4.066 541 2HG GLN 69 HG1 GLN 69 250.358 -7.466 -3.320 542 1HE2 GLN 69 HE21 GLN 69 251.029 -9.304 -6.255 543 2HE2 GLN 69 HE22 GLN 69 249.376 -9.583 -6.675 544 H ILE 70 HN ILE 70 250.985 -5.158 -1.575 545 HA ILE 70 HA ILE 70 253.615 -6.042 -0.611 546 HB ILE 70 HB ILE 70 251.507 -4.573 0.961 547 1HG1 ILE 70 HG12 ILE 70 253.971 -3.423 -0.358 548 2HG1 ILE 70 HG11 ILE 70 252.342 -3.273 -1.008 549 1HG2 ILE 70 HG21 ILE 70 252.922 -4.584 2.706 550 2HG2 ILE 70 HG22 ILE 70 254.345 -4.380 1.685 551 3HG2 ILE 70 HG23 ILE 70 253.627 -5.978 1.887 552 1HD1 ILE 70 HD11 ILE 70 253.659 -1.766 1.086 553 2HD1 ILE 70 HD12 ILE 70 252.078 -2.373 1.577 554 3HD1 ILE 70 HD13 ILE 70 252.228 -1.373 0.133 555 H VAL 71 HN VAL 71 253.850 -7.705 0.754 556 HA VAL 71 HA VAL 71 251.445 -9.271 1.405 557 HB VAL 71 HB VAL 71 254.279 -10.283 1.147 558 1HG1 VAL 71 HG11 VAL 71 252.893 -11.607 2.640 559 2HG1 VAL 71 HG12 VAL 71 253.221 -12.491 1.149 560 3HG1 VAL 71 HG13 VAL 71 251.648 -11.731 1.396 561 1HG2 VAL 71 HG21 VAL 71 252.056 -10.062 -0.832 562 2HG2 VAL 71 HG22 VAL 71 253.168 -11.427 -0.924 563 3HG2 VAL 71 HG23 VAL 71 253.783 -9.778 -1.046 564 H PHE 72 HN PHE 72 251.294 -10.222 3.470 565 HA PHE 72 HA PHE 72 253.161 -9.142 5.472 566 1HB PHE 72 HB2 PHE 72 250.156 -9.397 5.671 567 2HB PHE 72 HB1 PHE 72 251.206 -9.005 7.028 568 HD1 PHE 72 HD1 PHE 72 250.716 -7.834 3.512 569 HD2 PHE 72 HD2 PHE 72 251.287 -6.796 7.599 570 HE1 PHE 72 HE1 PHE 72 250.592 -5.450 2.920 571 HE2 PHE 72 HE2 PHE 72 251.160 -4.410 7.015 572 HZ PHE 72 HZ PHE 72 250.812 -3.733 4.672 573 H GLU 73 HN GLU 73 254.219 -10.702 6.470 574 HA GLU 73 HA GLU 73 253.010 -13.372 6.632 575 1HB GLU 73 HB2 GLU 73 255.885 -12.582 7.133 576 2HB GLU 73 HB1 GLU 73 255.250 -14.216 6.992 577 1HG GLU 73 HG2 GLU 73 254.532 -13.510 4.629 578 2HG GLU 73 HG1 GLU 73 255.650 -12.164 4.853 579 H PHE 74 HN PHE 74 252.269 -14.105 8.523 580 HA PHE 74 HA PHE 74 252.700 -12.489 10.903 581 1HB PHE 74 HB2 PHE 74 250.961 -14.927 10.467 582 2HB PHE 74 HB1 PHE 74 250.992 -13.950 11.931 583 HD1 PHE 74 HD1 PHE 74 249.298 -14.516 8.948 584 HD2 PHE 74 HD2 PHE 74 250.601 -11.355 11.481 585 HE1 PHE 74 HE1 PHE 74 247.570 -13.047 7.995 586 HE2 PHE 74 HE2 PHE 74 248.874 -9.879 10.534 587 HZ PHE 74 HZ PHE 74 247.355 -10.725 8.789 588 H VAL 75 HN VAL 75 253.929 -12.958 12.552 589 HA VAL 75 HA VAL 75 255.755 -15.161 12.328 590 HB VAL 75 HB VAL 75 255.739 -13.757 14.896 591 1HG1 VAL 75 HG11 VAL 75 257.991 -13.600 12.997 592 2HG1 VAL 75 HG12 VAL 75 257.505 -15.213 13.521 593 3HG1 VAL 75 HG13 VAL 75 257.979 -14.002 14.714 594 1HG2 VAL 75 HG21 VAL 75 256.862 -11.732 13.641 595 2HG2 VAL 75 HG22 VAL 75 255.126 -11.770 13.950 596 3HG2 VAL 75 HG23 VAL 75 255.750 -12.207 12.359 597 H GLY 76 HN GLY 76 255.200 -17.148 12.891 598 1HA GLY 76 HA2 GLY 76 254.759 -18.748 14.605 599 2HA GLY 76 HA1 GLY 76 253.802 -17.536 15.445 600 H GLU 77 HN GLU 77 252.586 -16.876 12.698 601 HA GLU 77 HA GLU 77 250.571 -19.013 12.806 602 1HB GLU 77 HB2 GLU 77 250.466 -16.104 12.135 603 2HB GLU 77 HB1 GLU 77 249.292 -17.180 11.390 604 1HG GLU 77 HG2 GLU 77 248.777 -17.983 13.750 605 2HG GLU 77 HG1 GLU 77 249.687 -16.576 14.300 606 HA PRO 78 HA PRO 78 251.872 -20.400 8.804 607 1HB PRO 78 HB2 PRO 78 249.636 -21.730 8.041 608 2HB PRO 78 HB1 PRO 78 250.749 -22.354 9.263 609 1HG PRO 78 HG2 PRO 78 248.144 -20.924 9.628 610 2HG PRO 78 HG1 PRO 78 248.772 -22.344 10.486 611 1HD PRO 78 HD2 PRO 78 248.863 -19.846 11.532 612 2HD PRO 78 HD1 PRO 78 250.095 -21.075 11.880 613 H GLU 79 HN GLU 79 248.563 -19.086 8.974 614 HA GLU 79 HA GLU 79 248.314 -18.441 6.264 615 1HB GLU 79 HB2 GLU 79 246.752 -18.191 8.579 616 2HB GLU 79 HB1 GLU 79 246.907 -16.557 7.946 617 1HG GLU 79 HG2 GLU 79 245.917 -17.137 5.904 618 2HG GLU 79 HG1 GLU 79 246.101 -18.863 6.212 619 H LEU 80 HN LEU 80 247.921 -16.057 5.586 620 HA LEU 80 HA LEU 80 249.844 -14.192 6.717 621 1HB LEU 80 HB2 LEU 80 250.034 -14.471 3.775 622 2HB LEU 80 HB1 LEU 80 251.268 -14.041 4.944 623 HG LEU 80 HG LEU 80 250.271 -16.858 4.805 624 1HD1 LEU 80 HD11 LEU 80 252.657 -16.116 3.216 625 2HD1 LEU 80 HD12 LEU 80 251.073 -15.769 2.523 626 3HD1 LEU 80 HD13 LEU 80 251.494 -17.420 2.979 627 1HD2 LEU 80 HD21 LEU 80 253.096 -16.102 5.259 628 2HD2 LEU 80 HD22 LEU 80 252.126 -17.370 6.009 629 3HD2 LEU 80 HD23 LEU 80 251.940 -15.695 6.526 630 H MET 81 HN MET 81 249.820 -12.316 4.660 631 HA MET 81 HA MET 81 247.026 -11.842 4.006 632 1HB MET 81 HB2 MET 81 248.122 -10.693 6.281 633 2HB MET 81 HB1 MET 81 248.248 -9.419 5.075 634 1HG MET 81 HG2 MET 81 245.786 -9.884 4.587 635 2HG MET 81 HG1 MET 81 245.790 -10.792 6.099 636 1HE MET 81 HE1 MET 81 247.218 -7.798 4.519 637 2HE MET 81 HE2 MET 81 247.647 -6.804 5.910 638 3HE MET 81 HE3 MET 81 246.121 -6.532 5.070 639 H ASP 82 HN ASP 82 247.116 -11.520 1.873 640 HA ASP 82 HA ASP 82 249.387 -10.010 0.772 641 1HB ASP 82 HB2 ASP 82 248.957 -12.278 -0.160 642 2HB ASP 82 HB1 ASP 82 247.368 -11.732 -0.688 643 H VAL 83 HN VAL 83 248.853 -7.879 0.838 644 HA VAL 83 HA VAL 83 246.203 -7.114 -0.201 645 HB VAL 83 HB VAL 83 246.574 -6.466 2.142 646 1HG1 VAL 83 HG11 VAL 83 248.505 -4.354 1.482 647 2HG1 VAL 83 HG12 VAL 83 249.148 -5.996 1.436 648 3HG1 VAL 83 HG13 VAL 83 248.391 -5.386 2.907 649 1HG2 VAL 83 HG21 VAL 83 246.064 -4.035 1.862 650 2HG2 VAL 83 HG22 VAL 83 245.078 -5.107 0.867 651 3HG2 VAL 83 HG23 VAL 83 246.416 -4.216 0.143 652 H HIS 84 HN HIS 84 246.224 -6.324 -2.165 653 HA HIS 84 HA HIS 84 248.628 -5.336 -3.401 654 1HB HIS 84 HB2 HIS 84 246.648 -6.621 -4.504 655 2HB HIS 84 HB1 HIS 84 245.865 -5.046 -4.557 656 HD1 HIS 84 HD1 HIS 84 246.015 -5.577 -7.222 657 HD2 HIS 84 HD2 HIS 84 249.578 -4.686 -5.280 658 HE1 HIS 84 HE1 HIS 84 247.636 -4.961 -9.041 659 HE2 HIS 84 HE2 HIS 84 249.809 -4.509 -7.849 660 H VAL 85 HN VAL 85 248.918 -3.160 -4.198 661 HA VAL 85 HA VAL 85 247.287 -1.209 -2.705 662 HB VAL 85 HB VAL 85 250.123 -0.721 -3.619 663 1HG1 VAL 85 HG11 VAL 85 249.778 0.883 -1.533 664 2HG1 VAL 85 HG12 VAL 85 248.092 0.737 -2.026 665 3HG1 VAL 85 HG13 VAL 85 249.293 1.346 -3.163 666 1HG2 VAL 85 HG21 VAL 85 249.909 -1.063 -0.780 667 2HG2 VAL 85 HG22 VAL 85 250.946 -1.909 -1.927 668 3HG2 VAL 85 HG23 VAL 85 249.323 -2.511 -1.596 669 H PHE 86 HN PHE 86 245.876 -0.461 -4.099 670 HA PHE 86 HA PHE 86 246.655 0.131 -6.855 671 1HB PHE 86 HB2 PHE 86 244.178 -0.605 -5.448 672 2HB PHE 86 HB1 PHE 86 243.955 0.704 -6.600 673 HD1 PHE 86 HD1 PHE 86 245.009 0.276 -8.975 674 HD2 PHE 86 HD2 PHE 86 244.002 -2.771 -6.180 675 HE1 PHE 86 HE1 PHE 86 244.874 -1.358 -10.810 676 HE2 PHE 86 HE2 PHE 86 243.870 -4.411 -8.009 677 HZ PHE 86 HZ PHE 86 244.306 -3.705 -10.327 678 H CYS 87 HN CYS 87 246.760 2.176 -7.633 679 HA CYS 87 HA CYS 87 245.869 4.362 -5.860 680 1HB CYS 87 HB2 CYS 87 247.710 5.736 -6.727 681 2HB CYS 87 HB1 CYS 87 248.335 4.281 -5.963 682 HG CYS 87 HG CYS 87 248.824 5.098 -8.799 683 H THR 88 HN THR 88 244.176 5.375 -6.780 684 HA THR 88 HA THR 88 243.762 5.071 -9.648 685 HB THR 88 HB THR 88 241.947 4.575 -7.995 686 HG1 THR 88 HG1 THR 88 241.605 5.211 -10.252 687 1HG2 THR 88 HG21 THR 88 241.017 6.068 -6.643 688 2HG2 THR 88 HG22 THR 88 241.156 7.373 -7.820 689 3HG2 THR 88 HG23 THR 88 242.543 6.932 -6.825 690 H ASP 89 HN ASP 89 242.449 7.096 -10.541 691 HA ASP 89 HA ASP 89 243.718 9.611 -9.789 692 1HB ASP 89 HB2 ASP 89 244.233 10.079 -12.213 693 2HB ASP 89 HB1 ASP 89 245.243 8.839 -11.474 694 H SER 90 HN SER 90 241.502 7.954 -11.997 695 HA SER 90 HA SER 90 239.812 10.326 -12.162 696 1HB SER 90 HB2 SER 90 240.451 8.427 -14.027 697 2HB SER 90 HB1 SER 90 238.892 7.833 -13.452 698 HG SER 90 HG SER 90 238.296 9.238 -14.964 699 H ILE 91 HN ILE 91 238.799 10.501 -10.185 700 HA ILE 91 HA ILE 91 237.366 8.143 -9.197 701 HB ILE 91 HB ILE 91 237.069 9.443 -7.085 702 1HG1 ILE 91 HG12 ILE 91 239.227 11.317 -7.881 703 2HG1 ILE 91 HG11 ILE 91 237.636 11.633 -8.566 704 1HG2 ILE 91 HG21 ILE 91 239.972 9.506 -7.357 705 2HG2 ILE 91 HG22 ILE 91 239.249 8.027 -7.990 706 3HG2 ILE 91 HG23 ILE 91 238.950 8.511 -6.320 707 1HD1 ILE 91 HD11 ILE 91 237.101 11.178 -5.908 708 2HD1 ILE 91 HD12 ILE 91 237.224 12.751 -6.696 709 3HD1 ILE 91 HD13 ILE 91 238.626 12.062 -5.878 710 H GLN 92 HN GLN 92 235.290 8.709 -7.991 711 HA GLN 92 HA GLN 92 233.639 10.334 -9.799 712 1HB GLN 92 HB2 GLN 92 232.956 8.051 -7.945 713 2HB GLN 92 HB1 GLN 92 231.734 9.044 -8.726 714 1HG GLN 92 HG2 GLN 92 232.824 8.404 -10.922 715 2HG GLN 92 HG1 GLN 92 233.716 7.192 -10.003 716 1HE2 GLN 92 HE21 GLN 92 231.673 6.953 -12.134 717 2HE2 GLN 92 HE22 GLN 92 230.444 5.934 -11.474 718 H GLY 93 HN GLY 93 234.454 12.225 -8.679 719 1HA GLY 93 HA2 GLY 93 234.577 13.183 -6.297 720 2HA GLY 93 HA1 GLY 93 233.550 14.034 -7.433 721 H THR 94 HN THR 94 233.664 11.895 -4.709 722 HA THR 94 HA THR 94 231.093 12.771 -3.794 723 HB THR 94 HB THR 94 231.477 9.856 -4.500 724 HG1 THR 94 HG1 THR 94 229.860 10.231 -6.002 725 1HG2 THR 94 HG21 THR 94 229.531 11.219 -2.787 726 2HG2 THR 94 HG22 THR 94 230.018 9.525 -2.839 727 3HG2 THR 94 HG23 THR 94 228.839 10.139 -3.999 728 HA PRO 95 HA PRO 95 234.191 11.276 -0.617 729 1HB PRO 95 HB2 PRO 95 235.124 13.642 0.274 730 2HB PRO 95 HB1 PRO 95 235.848 12.816 -1.110 731 1HG PRO 95 HG2 PRO 95 233.969 15.128 -1.054 732 2HG PRO 95 HG1 PRO 95 235.345 14.823 -2.127 733 1HD PRO 95 HD2 PRO 95 232.704 14.382 -2.789 734 2HD PRO 95 HD1 PRO 95 234.086 13.593 -3.570 735 H VAL 96 HN VAL 96 231.854 10.880 -0.023 736 HA VAL 96 HA VAL 96 230.515 12.870 1.550 737 HB VAL 96 HB VAL 96 229.803 9.969 1.729 738 1HG1 VAL 96 HG11 VAL 96 228.318 11.197 2.968 739 2HG1 VAL 96 HG12 VAL 96 227.493 11.169 1.410 740 3HG1 VAL 96 HG13 VAL 96 228.410 12.595 1.897 741 1HG2 VAL 96 HG21 VAL 96 228.407 10.380 -0.388 742 2HG2 VAL 96 HG22 VAL 96 230.125 10.032 -0.583 743 3HG2 VAL 96 HG23 VAL 96 229.541 11.691 -0.714 744 H GLU 97 HN GLU 97 232.669 13.039 2.794 745 HA GLU 97 HA GLU 97 233.665 11.290 4.617 746 1HB GLU 97 HB2 GLU 97 234.316 13.188 5.987 747 2HB GLU 97 HB1 GLU 97 234.503 13.585 4.285 748 1HG GLU 97 HG2 GLU 97 233.405 15.453 4.773 749 2HG GLU 97 HG1 GLU 97 231.960 14.442 4.804 750 H SER 98 HN SER 98 232.478 9.906 5.783 751 HA SER 98 HA SER 98 230.039 10.782 7.094 752 1HB SER 98 HB2 SER 98 230.369 8.526 5.897 753 2HB SER 98 HB1 SER 98 231.267 8.041 7.334 754 HG SER 98 HG SER 98 228.543 8.697 7.077 755 H ASP 99 HN ASP 99 229.890 9.395 9.371 756 HA ASP 99 HA ASP 99 231.558 10.904 11.138 757 1HB ASP 99 HB2 ASP 99 229.563 8.700 11.694 758 2HB ASP 99 HB1 ASP 99 230.340 9.683 12.930 759 H GLU 100 HN GLU 100 232.011 7.999 9.501 760 HA GLU 100 HA GLU 100 233.880 6.998 11.538 761 1HB GLU 100 HB2 GLU 100 232.100 5.705 9.620 762 2HB GLU 100 HB1 GLU 100 233.738 5.069 9.553 763 1HG GLU 100 HG2 GLU 100 233.553 4.040 11.527 764 2HG GLU 100 HG1 GLU 100 232.683 5.385 12.263 765 H MET 101 HN MET 101 233.588 7.836 8.117 766 HA MET 101 HA MET 101 236.517 7.700 7.884 767 1HB MET 101 HB2 MET 101 234.338 7.006 6.090 768 2HB MET 101 HB1 MET 101 235.490 8.095 5.327 769 1HG MET 101 HG2 MET 101 236.712 5.887 6.809 770 2HG MET 101 HG1 MET 101 235.722 5.389 5.439 771 1HE MET 101 HE1 MET 101 238.748 6.495 6.844 772 2HE MET 101 HE2 MET 101 238.978 8.066 6.076 773 3HE MET 101 HE3 MET 101 239.889 6.666 5.511 774 H ARG 102 HN ARG 102 237.566 9.383 6.587 775 HA ARG 102 HA ARG 102 236.210 11.851 6.087 776 1HB ARG 102 HB2 ARG 102 236.469 11.920 8.567 777 2HB ARG 102 HB1 ARG 102 238.210 11.791 8.360 778 1HG ARG 102 HG2 ARG 102 238.000 13.909 6.928 779 2HG ARG 102 HG1 ARG 102 236.400 14.071 7.656 780 1HD ARG 102 HD2 ARG 102 237.244 14.475 9.751 781 2HD ARG 102 HD1 ARG 102 238.737 13.592 9.437 782 HE ARG 102 HE ARG 102 238.691 15.851 7.791 783 1HH1 ARG 102 HH11 ARG 102 238.914 15.053 11.181 784 2HH1 ARG 102 HH12 ARG 102 239.831 16.466 11.582 785 1HH2 ARG 102 HH21 ARG 102 239.897 17.710 8.317 786 2HH2 ARG 102 HH22 ARG 102 240.388 17.975 9.957 787 HA PRO 103 HA PRO 103 239.960 11.253 3.527 788 1HB PRO 103 HB2 PRO 103 238.967 12.361 1.282 789 2HB PRO 103 HB1 PRO 103 238.573 10.706 1.765 790 1HG PRO 103 HG2 PRO 103 236.977 13.217 2.136 791 2HG PRO 103 HG1 PRO 103 236.435 11.623 1.575 792 1HD PRO 103 HD2 PRO 103 236.093 12.470 4.132 793 2HD PRO 103 HD1 PRO 103 236.341 10.763 3.715 794 H CYS 104 HN CYS 104 241.434 12.745 2.543 795 HA CYS 104 HA CYS 104 240.901 15.586 2.945 796 1HB CYS 104 HB2 CYS 104 242.153 14.389 4.952 797 2HB CYS 104 HB1 CYS 104 243.547 14.578 3.893 798 HG CYS 104 HG CYS 104 242.051 16.862 5.312 799 H TRP 105 HN TRP 105 241.504 16.675 1.212 800 HA TRP 105 HA TRP 105 243.177 15.384 -0.782 801 1HB TRP 105 HB2 TRP 105 241.720 18.037 -0.881 802 2HB TRP 105 HB1 TRP 105 242.490 17.230 -2.242 803 HD1 TRP 105 HD1 TRP 105 239.989 15.801 0.382 804 HE1 TRP 105 HE1 TRP 105 238.026 14.737 -0.897 805 HE3 TRP 105 HE3 TRP 105 241.411 16.965 -4.391 806 HZ2 TRP 105 HZ2 TRP 105 237.191 14.436 -3.577 807 HZ3 TRP 105 HZ3 TRP 105 239.972 16.252 -6.255 808 HH2 TRP 105 HH2 TRP 105 237.906 15.013 -5.854 809 H PHE 106 HN PHE 106 245.285 15.787 -1.032 810 HA PHE 106 HA PHE 106 246.371 18.372 -0.201 811 1HB PHE 106 HB2 PHE 106 247.213 15.694 0.891 812 2HB PHE 106 HB1 PHE 106 248.317 17.062 0.873 813 HD1 PHE 106 HD1 PHE 106 246.538 19.291 1.547 814 HD2 PHE 106 HD2 PHE 106 246.712 15.339 3.117 815 HE1 PHE 106 HE1 PHE 106 245.577 20.094 3.664 816 HE2 PHE 106 HE2 PHE 106 245.751 16.136 5.237 817 HZ PHE 106 HZ PHE 106 245.181 18.516 5.513 818 H GLN 107 HN GLN 107 249.017 17.974 -0.608 819 HA GLN 107 HA GLN 107 249.100 17.532 -3.478 820 1HB GLN 107 HB2 GLN 107 250.197 19.477 -2.064 821 2HB GLN 107 HB1 GLN 107 251.510 18.319 -1.906 822 1HG GLN 107 HG2 GLN 107 251.860 18.255 -4.241 823 2HG GLN 107 HG1 GLN 107 250.354 19.113 -4.560 824 1HE2 GLN 107 HE21 GLN 107 253.011 19.796 -5.437 825 2HE2 GLN 107 HE22 GLN 107 253.362 21.362 -4.796 826 H LEU 108 HN LEU 108 250.887 16.321 -4.445 827 HA LEU 108 HA LEU 108 251.139 13.733 -3.228 828 1HB LEU 108 HB2 LEU 108 252.015 13.006 -5.269 829 2HB LEU 108 HB1 LEU 108 250.866 14.252 -5.715 830 HG LEU 108 HG LEU 108 253.866 14.580 -5.588 831 1HD1 LEU 108 HD11 LEU 108 253.695 13.503 -7.558 832 2HD1 LEU 108 HD12 LEU 108 253.164 15.081 -8.140 833 3HD1 LEU 108 HD13 LEU 108 251.974 13.850 -7.720 834 1HD2 LEU 108 HD21 LEU 108 252.766 16.649 -5.003 835 2HD2 LEU 108 HD22 LEU 108 251.696 16.509 -6.396 836 3HD2 LEU 108 HD23 LEU 108 253.422 16.770 -6.636 837 H ASP 109 HN ASP 109 252.794 16.504 -2.666 838 HA ASP 109 HA ASP 109 255.273 15.045 -2.046 839 1HB ASP 109 HB2 ASP 109 255.547 16.809 -3.791 840 2HB ASP 109 HB1 ASP 109 255.002 18.005 -2.618 841 H GLN 110 HN GLN 110 252.718 15.544 -0.508 842 HA GLN 110 HA GLN 110 254.033 16.418 1.931 843 1HB GLN 110 HB2 GLN 110 251.490 17.655 0.876 844 2HB GLN 110 HB1 GLN 110 252.065 17.851 2.526 845 1HG GLN 110 HG2 GLN 110 253.678 18.635 0.116 846 2HG GLN 110 HG1 GLN 110 252.581 19.734 0.951 847 1HE2 GLN 110 HE21 GLN 110 253.494 20.982 2.404 848 2HE2 GLN 110 HE22 GLN 110 254.933 20.634 3.294 849 H ILE 111 HN ILE 111 252.805 13.916 0.689 850 HA ILE 111 HA ILE 111 250.534 13.324 2.346 851 HB ILE 111 HB ILE 111 251.920 10.922 1.529 852 1HG1 ILE 111 HG12 ILE 111 251.250 11.430 -0.979 853 2HG1 ILE 111 HG11 ILE 111 251.631 13.082 -0.503 854 1HG2 ILE 111 HG21 ILE 111 249.406 11.590 0.225 855 2HG2 ILE 111 HG22 ILE 111 249.371 11.704 1.985 856 3HG2 ILE 111 HG23 ILE 111 249.857 10.196 1.207 857 1HD1 ILE 111 HD11 ILE 111 253.631 12.269 -1.347 858 2HD1 ILE 111 HD12 ILE 111 253.415 10.690 -0.595 859 3HD1 ILE 111 HD13 ILE 111 253.819 12.090 0.397 860 HA PRO 112 HA PRO 112 253.085 12.207 5.816 861 1HB PRO 112 HB2 PRO 112 251.208 12.291 7.688 862 2HB PRO 112 HB1 PRO 112 251.675 13.770 6.836 863 1HG PRO 112 HG2 PRO 112 249.267 12.041 6.450 864 2HG PRO 112 HG1 PRO 112 249.404 13.804 6.371 865 1HD PRO 112 HD2 PRO 112 249.421 12.029 4.192 866 2HD PRO 112 HD1 PRO 112 249.881 13.743 4.157 867 H PHE 113 HN PHE 113 253.701 10.106 5.351 868 HA PHE 113 HA PHE 113 251.840 7.932 5.661 869 1HB PHE 113 HB2 PHE 113 254.705 7.262 5.705 870 2HB PHE 113 HB1 PHE 113 253.405 6.594 4.735 871 HD1 PHE 113 HD1 PHE 113 252.583 9.372 3.516 872 HD2 PHE 113 HD2 PHE 113 256.282 7.305 3.987 873 HE1 PHE 113 HE1 PHE 113 253.504 10.529 1.550 874 HE2 PHE 113 HE2 PHE 113 257.192 8.460 2.026 875 HZ PHE 113 HZ PHE 113 255.801 10.084 0.802 876 H LYS 114 HN LYS 114 253.861 9.729 7.751 877 HA LYS 114 HA LYS 114 254.442 7.756 9.685 878 1HB LYS 114 HB2 LYS 114 254.178 10.761 9.932 879 2HB LYS 114 HB1 LYS 114 254.775 9.714 11.213 880 1HG LYS 114 HG2 LYS 114 256.784 9.416 10.223 881 2HG LYS 114 HG1 LYS 114 256.114 9.476 8.593 882 1HD LYS 114 HD2 LYS 114 256.100 11.961 10.236 883 2HD LYS 114 HD1 LYS 114 257.624 11.426 9.523 884 1HE LYS 114 HE2 LYS 114 255.971 11.176 7.403 885 2HE LYS 114 HE1 LYS 114 255.207 12.524 8.242 886 1HZ LYS 114 HZ1 LYS 114 257.343 13.675 8.233 887 2HZ LYS 114 HZ2 LYS 114 256.841 13.308 6.661 888 3HZ LYS 114 HZ3 LYS 114 258.052 12.386 7.397 889 H ASP 115 HN ASP 115 251.704 9.770 8.982 890 HA ASP 115 HA ASP 115 250.336 8.806 11.368 891 1HB ASP 115 HB2 ASP 115 249.855 11.112 9.511 892 2HB ASP 115 HB1 ASP 115 248.547 10.502 10.520 893 H MET 116 HN MET 116 250.922 7.144 9.047 894 HA MET 116 HA MET 116 248.170 6.477 8.271 895 1HB MET 116 HB2 MET 116 250.581 6.843 6.602 896 2HB MET 116 HB1 MET 116 249.581 5.454 6.204 897 1HG MET 116 HG2 MET 116 247.886 6.720 5.427 898 2HG MET 116 HG1 MET 116 248.167 8.011 6.591 899 1HE MET 116 HE1 MET 116 251.022 6.504 4.463 900 2HE MET 116 HE2 MET 116 251.017 7.493 3.005 901 3HE MET 116 HE3 MET 116 249.713 6.340 3.291 902 H TRP 117 HN TRP 117 251.171 4.762 7.529 903 HA TRP 117 HA TRP 117 250.600 2.729 9.515 904 1HB TRP 117 HB2 TRP 117 249.922 2.425 6.690 905 2HB TRP 117 HB1 TRP 117 250.989 1.151 7.268 906 HD1 TRP 117 HD1 TRP 117 249.562 1.245 10.296 907 HE1 TRP 117 HE1 TRP 117 247.323 0.001 10.539 908 HE3 TRP 117 HE3 TRP 117 248.225 1.002 5.366 909 HZ2 TRP 117 HZ2 TRP 117 245.263 -0.958 8.866 910 HZ3 TRP 117 HZ3 TRP 117 246.104 -0.096 4.772 911 HH2 TRP 117 HH2 TRP 117 244.656 -1.056 6.488 912 HA PRO 118 HA PRO 118 254.965 2.092 9.253 913 1HB PRO 118 HB2 PRO 118 255.279 -0.456 9.972 914 2HB PRO 118 HB1 PRO 118 254.580 0.729 11.080 915 1HG PRO 118 HG2 PRO 118 253.224 -1.373 9.454 916 2HG PRO 118 HG1 PRO 118 252.857 -0.809 11.092 917 1HD PRO 118 HD2 PRO 118 251.538 -0.019 8.767 918 2HD PRO 118 HD1 PRO 118 251.489 0.829 10.324 919 H ASP 119 HN ASP 119 253.250 1.232 6.719 920 HA ASP 119 HA ASP 119 255.521 -0.086 5.399 921 1HB ASP 119 HB2 ASP 119 253.792 -1.289 3.974 922 2HB ASP 119 HB1 ASP 119 253.944 -1.835 5.641 923 H ASP 120 HN ASP 120 253.031 2.311 5.300 924 HA ASP 120 HA ASP 120 252.720 2.875 2.636 925 1HB ASP 120 HB2 ASP 120 252.677 4.559 5.090 926 2HB ASP 120 HB1 ASP 120 252.593 5.346 3.516 927 H SER 121 HN SER 121 255.248 4.237 4.741 928 HA SER 121 HA SER 121 256.519 5.803 2.816 929 1HB SER 121 HB2 SER 121 258.298 6.019 4.348 930 2HB SER 121 HB1 SER 121 256.879 5.744 5.357 931 HG SER 121 HG SER 121 257.517 3.647 5.672 932 H TYR 122 HN TYR 122 256.476 2.382 3.079 933 HA TYR 122 HA TYR 122 259.001 2.000 1.744 934 1HB TYR 122 HB2 TYR 122 256.833 0.121 2.655 935 2HB TYR 122 HB1 TYR 122 258.217 -0.426 1.714 936 HD1 TYR 122 HD1 TYR 122 260.405 -0.588 2.701 937 HD2 TYR 122 HD2 TYR 122 257.139 0.959 4.944 938 HE1 TYR 122 HE1 TYR 122 261.733 -0.786 4.761 939 HE2 TYR 122 HE2 TYR 122 258.457 0.765 7.011 940 HH TYR 122 HH TYR 122 260.714 -0.966 7.598 941 H TRP 123 HN TRP 123 255.580 2.001 0.862 942 HA TRP 123 HA TRP 123 256.398 1.348 -1.873 943 1HB TRP 123 HB2 TRP 123 254.077 0.704 -2.309 944 2HB TRP 123 HB1 TRP 123 254.769 -0.208 -0.976 945 HD1 TRP 123 HD1 TRP 123 253.793 0.275 1.480 946 HE1 TRP 123 HE1 TRP 123 251.551 1.285 2.248 947 HE3 TRP 123 HE3 TRP 123 252.337 2.457 -2.908 948 HZ2 TRP 123 HZ2 TRP 123 249.443 2.817 1.138 949 HZ3 TRP 123 HZ3 TRP 123 250.194 3.666 -2.966 950 HH2 TRP 123 HH2 TRP 123 248.784 3.834 -0.996 951 H PHE 124 HN PHE 124 255.703 4.016 -0.079 952 HA PHE 124 HA PHE 124 254.065 5.440 -1.954 953 1HB PHE 124 HB2 PHE 124 255.200 5.928 0.677 954 2HB PHE 124 HB1 PHE 124 255.354 7.338 -0.364 955 HD1 PHE 124 HD1 PHE 124 253.642 8.863 -0.275 956 HD2 PHE 124 HD2 PHE 124 252.779 4.766 0.475 957 HE1 PHE 124 HE1 PHE 124 251.306 9.446 0.166 958 HE2 PHE 124 HE2 PHE 124 250.429 5.346 0.920 959 HZ PHE 124 HZ PHE 124 249.694 7.693 0.766 960 HA PRO 125 HA PRO 125 258.447 7.613 -2.770 961 1HB PRO 125 HB2 PRO 125 260.065 5.138 -2.411 962 2HB PRO 125 HB1 PRO 125 260.476 6.817 -2.042 963 1HG PRO 125 HG2 PRO 125 259.847 5.124 -0.092 964 2HG PRO 125 HG1 PRO 125 259.291 6.808 -0.047 965 1HD PRO 125 HD2 PRO 125 257.774 4.325 -0.727 966 2HD PRO 125 HD1 PRO 125 257.238 5.772 0.152 967 H LEU 126 HN LEU 126 257.792 4.221 -3.611 968 HA LEU 126 HA LEU 126 258.970 4.521 -6.223 969 1HB LEU 126 HB2 LEU 126 257.909 2.252 -6.631 970 2HB LEU 126 HB1 LEU 126 259.149 2.344 -5.397 971 HG LEU 126 HG LEU 126 256.697 2.748 -4.065 972 1HD1 LEU 126 HD11 LEU 126 255.356 0.878 -4.662 973 2HD1 LEU 126 HD12 LEU 126 256.563 0.303 -5.812 974 3HD1 LEU 126 HD13 LEU 126 255.671 1.789 -6.139 975 1HD2 LEU 126 HD21 LEU 126 257.313 0.325 -3.294 976 2HD2 LEU 126 HD22 LEU 126 258.350 1.686 -2.870 977 3HD2 LEU 126 HD23 LEU 126 258.789 0.626 -4.211 978 H LEU 127 HN LEU 127 255.776 4.667 -4.805 979 HA LEU 127 HA LEU 127 254.191 4.553 -7.102 980 1HB LEU 127 HB2 LEU 127 253.893 6.126 -4.549 981 2HB LEU 127 HB1 LEU 127 252.668 6.126 -5.799 982 HG LEU 127 HG LEU 127 253.006 4.323 -3.658 983 1HD1 LEU 127 HD11 LEU 127 250.859 5.006 -4.257 984 2HD1 LEU 127 HD12 LEU 127 250.924 3.316 -4.760 985 3HD1 LEU 127 HD13 LEU 127 251.104 4.600 -5.955 986 1HD2 LEU 127 HD21 LEU 127 253.021 2.167 -4.755 987 2HD2 LEU 127 HD22 LEU 127 254.502 3.040 -5.141 988 3HD2 LEU 127 HD23 LEU 127 253.204 2.937 -6.330 989 H LEU 128 HN LEU 128 255.546 7.329 -5.411 990 HA LEU 128 HA LEU 128 254.820 9.350 -7.176 991 1HB LEU 128 HB2 LEU 128 256.931 8.983 -5.131 992 2HB LEU 128 HB1 LEU 128 257.192 10.276 -6.286 993 HG LEU 128 HG LEU 128 254.559 10.120 -4.891 994 1HD1 LEU 128 HD11 LEU 128 256.730 9.952 -3.336 995 2HD1 LEU 128 HD12 LEU 128 255.286 10.856 -2.883 996 3HD1 LEU 128 HD13 LEU 128 256.674 11.699 -3.569 997 1HD2 LEU 128 HD21 LEU 128 255.144 12.687 -4.962 998 2HD2 LEU 128 HD22 LEU 128 254.518 11.852 -6.384 999 3HD2 LEU 128 HD23 LEU 128 256.247 12.166 -6.237 1000 H GLN 129 HN GLN 129 257.262 6.916 -7.471 1001 HA GLN 129 HA GLN 129 258.601 8.254 -9.676 1002 1HB GLN 129 HB2 GLN 129 259.137 5.908 -7.961 1003 2HB GLN 129 HB1 GLN 129 259.704 5.781 -9.620 1004 1HG GLN 129 HG2 GLN 129 261.098 7.669 -9.394 1005 2HG GLN 129 HG1 GLN 129 260.340 8.135 -7.872 1006 1HE2 GLN 129 HE21 GLN 129 263.114 7.779 -8.287 1007 2HE2 GLN 129 HE22 GLN 129 263.636 6.473 -7.285 1008 H LYS 130 HN LYS 130 255.776 6.680 -9.447 1009 HA LYS 130 HA LYS 130 254.410 5.542 -10.842 1010 1HB LYS 130 HB2 LYS 130 254.282 6.356 -12.984 1011 2HB LYS 130 HB1 LYS 130 255.255 7.604 -12.228 1012 1HG LYS 130 HG2 LYS 130 257.120 5.784 -13.179 1013 2HG LYS 130 HG1 LYS 130 255.882 5.835 -14.430 1014 1HD LYS 130 HD2 LYS 130 257.522 7.510 -14.929 1015 2HD LYS 130 HD1 LYS 130 256.046 8.321 -14.401 1016 1HE LYS 130 HE2 LYS 130 257.081 8.397 -12.090 1017 2HE LYS 130 HE1 LYS 130 258.590 7.894 -12.851 1018 1HZ LYS 130 HZ1 LYS 130 257.098 10.264 -13.795 1019 2HZ LYS 130 HZ2 LYS 130 258.721 9.869 -14.056 1020 3HZ LYS 130 HZ3 LYS 130 258.209 10.369 -12.523 1021 H LYS 131 HN LYS 131 256.596 4.069 -9.742 1022 HA LYS 131 HA LYS 131 257.084 2.105 -11.885 1023 1HB LYS 131 HB2 LYS 131 258.667 2.668 -9.373 1024 2HB LYS 131 HB1 LYS 131 258.985 1.321 -10.458 1025 1HG LYS 131 HG2 LYS 131 258.884 3.972 -11.727 1026 2HG LYS 131 HG1 LYS 131 260.220 3.706 -10.607 1027 1HD LYS 131 HD2 LYS 131 261.238 2.802 -12.398 1028 2HD LYS 131 HD1 LYS 131 260.252 1.388 -12.021 1029 1HE LYS 131 HE2 LYS 131 258.923 3.428 -13.666 1030 2HE LYS 131 HE1 LYS 131 260.302 2.641 -14.431 1031 1HZ LYS 131 HZ1 LYS 131 258.735 1.143 -14.984 1032 2HZ LYS 131 HZ2 LYS 131 257.712 1.544 -13.698 1033 3HZ LYS 131 HZ3 LYS 131 259.041 0.532 -13.436 1034 H LYS 132 HN LYS 132 257.084 -0.170 -11.237 1035 HA LYS 132 HA LYS 132 255.038 -0.667 -9.189 1036 1HB LYS 132 HB2 LYS 132 255.949 -2.356 -11.526 1037 2HB LYS 132 HB1 LYS 132 254.758 -2.867 -10.338 1038 1HG LYS 132 HG2 LYS 132 253.133 -1.535 -11.185 1039 2HG LYS 132 HG1 LYS 132 254.269 -0.290 -11.707 1040 1HD LYS 132 HD2 LYS 132 254.127 -2.979 -13.041 1041 2HD LYS 132 HD1 LYS 132 253.087 -1.638 -13.527 1042 1HE LYS 132 HE2 LYS 132 256.052 -1.274 -13.332 1043 2HE LYS 132 HE1 LYS 132 255.334 -2.017 -14.761 1044 1HZ LYS 132 HZ1 LYS 132 254.447 -0.075 -15.434 1045 2HZ LYS 132 HZ2 LYS 132 255.684 0.598 -14.497 1046 3HZ LYS 132 HZ3 LYS 132 254.121 0.468 -13.865 1047 H PHE 133 HN PHE 133 255.388 -2.077 -7.509 1048 HA PHE 133 HA PHE 133 257.860 -3.603 -7.417 1049 1HB PHE 133 HB2 PHE 133 258.960 -2.381 -5.875 1050 2HB PHE 133 HB1 PHE 133 257.890 -1.075 -6.362 1051 HD1 PHE 133 HD1 PHE 133 255.445 -1.371 -5.105 1052 HD2 PHE 133 HD2 PHE 133 259.256 -2.547 -3.619 1053 HE1 PHE 133 HE1 PHE 133 254.590 -1.220 -2.803 1054 HE2 PHE 133 HE2 PHE 133 258.407 -2.398 -1.315 1055 HZ PHE 133 HZ PHE 133 256.072 -1.734 -0.904 1056 H HIS 134 HN HIS 134 258.004 -4.826 -5.284 1057 HA HIS 134 HA HIS 134 255.369 -5.530 -4.200 1058 1HB HIS 134 HB2 HIS 134 257.292 -7.333 -5.619 1059 2HB HIS 134 HB1 HIS 134 256.391 -7.980 -4.253 1060 HD1 HIS 134 HD1 HIS 134 255.423 -5.899 -7.302 1061 HD2 HIS 134 HD2 HIS 134 254.203 -9.248 -5.168 1062 HE1 HIS 134 HE1 HIS 134 253.370 -6.740 -8.487 1063 HE2 HIS 134 HE2 HIS 134 252.704 -8.820 -7.231 1064 H GLY 135 HN GLY 135 255.453 -5.525 -2.006 1065 1HA GLY 135 HA2 GLY 135 258.105 -5.979 -0.783 1066 2HA GLY 135 HA1 GLY 135 257.023 -4.717 -0.219 1067 H TYR 136 HN TYR 136 258.249 -7.389 0.824 1068 HA TYR 136 HA TYR 136 255.744 -8.478 1.927 1069 1HB TYR 136 HB2 TYR 136 258.432 -9.753 1.433 1070 2HB TYR 136 HB1 TYR 136 257.239 -10.482 2.500 1071 HD1 TYR 136 HD1 TYR 136 256.222 -12.287 1.499 1072 HD2 TYR 136 HD2 TYR 136 257.066 -8.854 -0.868 1073 HE1 TYR 136 HE1 TYR 136 255.152 -13.364 -0.435 1074 HE2 TYR 136 HE2 TYR 136 255.996 -9.920 -2.808 1075 HH TYR 136 HH TYR 136 255.417 -12.113 -3.616 1076 H PHE 137 HN PHE 137 255.344 -7.780 3.926 1077 HA PHE 137 HA PHE 137 257.642 -7.171 5.670 1078 1HB PHE 137 HB2 PHE 137 254.865 -5.978 5.697 1079 2HB PHE 137 HB1 PHE 137 256.162 -5.570 6.816 1080 HD1 PHE 137 HD1 PHE 137 257.368 -3.676 6.374 1081 HD2 PHE 137 HD2 PHE 137 255.587 -5.783 3.134 1082 HE1 PHE 137 HE1 PHE 137 258.174 -1.952 4.814 1083 HE2 PHE 137 HE2 PHE 137 256.390 -4.064 1.570 1084 HZ PHE 137 HZ PHE 137 257.686 -2.148 2.409 1085 H LYS 138 HN LYS 138 257.874 -8.305 7.473 1086 HA LYS 138 HA LYS 138 255.817 -10.192 8.286 1087 1HB LYS 138 HB2 LYS 138 258.619 -10.226 8.305 1088 2HB LYS 138 HB1 LYS 138 258.156 -10.113 9.997 1089 1HG LYS 138 HG2 LYS 138 256.465 -12.047 9.072 1090 2HG LYS 138 HG1 LYS 138 257.923 -12.341 8.124 1091 1HD LYS 138 HD2 LYS 138 259.206 -12.795 9.997 1092 2HD LYS 138 HD1 LYS 138 258.124 -11.913 11.076 1093 1HE LYS 138 HE2 LYS 138 256.745 -13.681 11.358 1094 2HE LYS 138 HE1 LYS 138 256.948 -14.237 9.697 1095 1HZ LYS 138 HZ1 LYS 138 257.911 -15.639 11.603 1096 2HZ LYS 138 HZ2 LYS 138 259.155 -14.496 11.633 1097 3HZ LYS 138 HZ3 LYS 138 258.862 -15.389 10.227 1098 H PHE 139 HN PHE 139 254.390 -9.706 9.862 1099 HA PHE 139 HA PHE 139 255.021 -7.405 11.590 1100 1HB PHE 139 HB2 PHE 139 252.454 -8.481 10.471 1101 2HB PHE 139 HB1 PHE 139 252.426 -7.535 11.954 1102 HD1 PHE 139 HD1 PHE 139 253.708 -7.395 8.458 1103 HD2 PHE 139 HD2 PHE 139 252.237 -5.248 11.824 1104 HE1 PHE 139 HE1 PHE 139 253.685 -5.326 7.125 1105 HE2 PHE 139 HE2 PHE 139 252.212 -3.176 10.498 1106 HZ PHE 139 HZ PHE 139 252.935 -3.213 8.145 1107 H GLN 140 HN GLN 140 254.232 -7.455 13.797 1108 HA GLN 140 HA GLN 140 254.713 -10.003 15.065 1109 1HB GLN 140 HB2 GLN 140 254.516 -7.186 15.889 1110 2HB GLN 140 HB1 GLN 140 253.878 -8.321 17.068 1111 1HG GLN 140 HG2 GLN 140 256.656 -8.237 15.935 1112 2HG GLN 140 HG1 GLN 140 256.159 -7.882 17.585 1113 1HE2 GLN 140 HE21 GLN 140 258.107 -9.624 17.387 1114 2HE2 GLN 140 HE22 GLN 140 257.568 -11.242 17.659 1115 H GLY 141 HN GLY 141 252.042 -8.460 13.762 1116 1HA GLY 141 HA2 GLY 141 250.205 -10.433 14.529 1117 2HA GLY 141 HA1 GLY 141 249.982 -9.035 15.574 1118 H GLN 142 HN GLN 142 250.192 -6.890 14.092 1119 HA GLN 142 HA GLN 142 249.216 -6.923 11.486 1120 1HB GLN 142 HB2 GLN 142 247.172 -7.272 13.551 1121 2HB GLN 142 HB1 GLN 142 246.844 -5.925 12.469 1122 1HG GLN 142 HG2 GLN 142 247.680 -8.362 11.098 1123 2HG GLN 142 HG1 GLN 142 246.182 -8.530 12.012 1124 1HE2 GLN 142 HE21 GLN 142 244.387 -7.311 11.424 1125 2HE2 GLN 142 HE22 GLN 142 244.272 -6.524 9.891 1126 H ASP 143 HN ASP 143 250.969 -5.430 13.349 1127 HA ASP 143 HA ASP 143 250.356 -2.798 12.364 1128 1HB ASP 143 HB2 ASP 143 250.496 -3.182 15.359 1129 2HB ASP 143 HB1 ASP 143 250.254 -1.666 14.499 1130 H THR 144 HN THR 144 252.319 -4.616 14.707 1131 HA THR 144 HA THR 144 254.596 -2.886 14.280 1132 HB THR 144 HB THR 144 254.119 -5.334 15.960 1133 HG1 THR 144 HG1 THR 144 253.472 -3.623 17.067 1134 1HG2 THR 144 HG21 THR 144 256.375 -5.639 15.283 1135 2HG2 THR 144 HG22 THR 144 256.391 -4.966 16.914 1136 3HG2 THR 144 HG23 THR 144 256.741 -3.932 15.528 1137 H ILE 145 HN ILE 145 256.371 -3.288 13.061 1138 HA ILE 145 HA ILE 145 256.302 -5.741 11.446 1139 HB ILE 145 HB ILE 145 257.677 -3.146 10.758 1140 1HG1 ILE 145 HG12 ILE 145 255.168 -4.358 9.590 1141 2HG1 ILE 145 HG11 ILE 145 255.184 -3.023 10.737 1142 1HG2 ILE 145 HG21 ILE 145 257.229 -5.645 9.125 1143 2HG2 ILE 145 HG22 ILE 145 258.765 -5.132 9.825 1144 3HG2 ILE 145 HG23 ILE 145 258.003 -4.164 8.562 1145 1HD1 ILE 145 HD11 ILE 145 256.549 -1.743 9.072 1146 2HD1 ILE 145 HD12 ILE 145 254.894 -2.099 8.580 1147 3HD1 ILE 145 HD13 ILE 145 256.232 -3.042 7.923 1148 H LEU 146 HN LEU 146 258.041 -7.036 11.293 1149 HA LEU 146 HA LEU 146 260.417 -6.307 12.875 1150 1HB LEU 146 HB2 LEU 146 259.519 -9.143 12.502 1151 2HB LEU 146 HB1 LEU 146 260.598 -8.483 13.717 1152 HG LEU 146 HG LEU 146 257.786 -7.530 13.761 1153 1HD1 LEU 146 HD11 LEU 146 258.126 -10.204 13.482 1154 2HD1 LEU 146 HD12 LEU 146 256.798 -9.448 14.361 1155 3HD1 LEU 146 HD13 LEU 146 258.217 -10.028 15.234 1156 1HD2 LEU 146 HD21 LEU 146 259.209 -8.503 16.154 1157 2HD2 LEU 146 HD22 LEU 146 258.254 -7.039 15.914 1158 3HD2 LEU 146 HD23 LEU 146 259.920 -7.109 15.340 1159 H ASP 147 HN ASP 147 259.195 -7.144 9.852 1160 HA ASP 147 HA ASP 147 261.856 -7.345 8.747 1161 1HB ASP 147 HB2 ASP 147 260.349 -9.695 9.264 1162 2HB ASP 147 HB1 ASP 147 260.328 -9.446 7.522 1163 H TYR 148 HN TYR 148 261.944 -6.435 6.732 1164 HA TYR 148 HA TYR 148 259.432 -6.140 5.264 1165 1HB TYR 148 HB2 TYR 148 259.852 -3.775 4.823 1166 2HB TYR 148 HB1 TYR 148 259.671 -4.083 6.546 1167 HD1 TYR 148 HD1 TYR 148 262.126 -3.357 3.878 1168 HD2 TYR 148 HD2 TYR 148 261.436 -3.607 8.069 1169 HE1 TYR 148 HE1 TYR 148 264.282 -2.250 4.292 1170 HE2 TYR 148 HE2 TYR 148 263.589 -2.499 8.495 1171 HH TYR 148 HH TYR 148 265.406 -0.990 6.009 1172 H THR 149 HN THR 149 259.628 -6.556 3.160 1173 HA THR 149 HA THR 149 262.327 -6.438 1.984 1174 HB THR 149 HB THR 149 260.859 -8.257 0.460 1175 HG1 THR 149 HG1 THR 149 260.569 -8.843 3.217 1176 1HG2 THR 149 HG21 THR 149 262.711 -9.437 0.676 1177 2HG2 THR 149 HG22 THR 149 262.461 -9.620 2.412 1178 3HG2 THR 149 HG23 THR 149 263.302 -8.202 1.786 1179 H LEU 150 HN LEU 150 262.496 -5.679 -0.100 1180 HA LEU 150 HA LEU 150 260.054 -4.672 -1.367 1181 1HB LEU 150 HB2 LEU 150 262.553 -3.094 -0.789 1182 2HB LEU 150 HB1 LEU 150 261.374 -2.595 -1.989 1183 HG LEU 150 HG LEU 150 259.791 -2.997 0.212 1184 1HD1 LEU 150 HD11 LEU 150 262.203 -3.169 1.347 1185 2HD1 LEU 150 HD12 LEU 150 260.803 -2.471 2.161 1186 3HD1 LEU 150 HD13 LEU 150 261.991 -1.418 1.391 1187 1HD2 LEU 150 HD21 LEU 150 260.071 -1.039 -1.479 1188 2HD2 LEU 150 HD22 LEU 150 261.089 -0.340 -0.220 1189 3HD2 LEU 150 HD23 LEU 150 259.402 -0.724 0.122 1190 H ARG 151 HN ARG 151 259.912 -5.256 -3.415 1191 HA ARG 151 HA ARG 151 262.385 -5.765 -4.927 1192 1HB ARG 151 HB2 ARG 151 259.857 -7.418 -5.069 1193 2HB ARG 151 HB1 ARG 151 261.317 -7.677 -6.013 1194 1HG ARG 151 HG2 ARG 151 261.183 -7.846 -3.011 1195 2HG ARG 151 HG1 ARG 151 261.067 -9.229 -4.101 1196 1HD ARG 151 HD2 ARG 151 263.314 -8.203 -5.048 1197 2HD ARG 151 HD1 ARG 151 263.408 -7.526 -3.422 1198 HE ARG 151 HE ARG 151 263.882 -9.615 -2.623 1199 1HH1 ARG 151 HH11 ARG 151 262.556 -9.921 -5.837 1200 2HH1 ARG 151 HH12 ARG 151 262.877 -11.620 -5.943 1201 1HH2 ARG 151 HH21 ARG 151 264.306 -11.849 -2.762 1202 2HH2 ARG 151 HH22 ARG 151 263.870 -12.714 -4.196 1203 H GLU 152 HN GLU 152 262.252 -5.401 -7.197 1204 HA GLU 152 HA GLU 152 260.136 -3.496 -7.904 1205 1HB GLU 152 HB2 GLU 152 261.699 -2.924 -9.811 1206 2HB GLU 152 HB1 GLU 152 262.280 -2.534 -8.199 1207 1HG GLU 152 HG2 GLU 152 263.998 -3.963 -8.330 1208 2HG GLU 152 HG1 GLU 152 263.047 -5.192 -9.164 1209 H VAL 153 HN VAL 153 258.976 -3.664 -9.830 1210 HA VAL 153 HA VAL 153 259.300 -6.108 -11.406 1211 HB VAL 153 HB VAL 153 256.845 -6.515 -11.359 1212 1HG1 VAL 153 HG11 VAL 153 258.674 -7.533 -9.768 1213 2HG1 VAL 153 HG12 VAL 153 256.962 -7.886 -9.526 1214 3HG1 VAL 153 HG13 VAL 153 257.761 -6.671 -8.530 1215 1HG2 VAL 153 HG21 VAL 153 255.649 -5.526 -9.335 1216 2HG2 VAL 153 HG22 VAL 153 255.920 -4.455 -10.709 1217 3HG2 VAL 153 HG23 VAL 153 256.955 -4.342 -9.286 1218 H ASP 154 HN ASP 154 258.519 -5.975 -13.517 1219 HA ASP 154 HA ASP 154 257.208 -3.527 -14.384 1220 1HB ASP 154 HB2 ASP 154 259.859 -4.391 -15.558 1221 2HB ASP 154 HB1 ASP 154 258.881 -3.028 -16.092 1222 H THR 155 HN THR 155 258.779 -6.524 -15.488 1223 HA THR 155 HA THR 155 257.217 -6.768 -17.841 1224 HB THR 155 HB THR 155 258.586 -9.014 -16.359 1225 HG1 THR 155 HG1 THR 155 259.733 -7.274 -18.279 1226 1HG2 THR 155 HG21 THR 155 257.938 -10.228 -18.089 1227 2HG2 THR 155 HG22 THR 155 259.020 -9.254 -19.084 1228 3HG2 THR 155 HG23 THR 155 257.319 -8.811 -18.937 1229 H VAL 156 HN VAL 156 255.110 -7.145 -17.918 1230 HA VAL 156 HA VAL 156 253.949 -9.056 -16.004 1231 HB VAL 156 HB VAL 156 252.537 -6.559 -16.944 1232 1HG1 VAL 156 HG11 VAL 156 251.323 -8.750 -16.184 1233 2HG1 VAL 156 HG12 VAL 156 250.763 -7.176 -15.618 1234 3HG1 VAL 156 HG13 VAL 156 251.757 -8.187 -14.570 1235 1HG2 VAL 156 HG21 VAL 156 253.001 -5.526 -14.879 1236 2HG2 VAL 156 HG22 VAL 156 254.545 -6.177 -15.430 1237 3HG2 VAL 156 HG23 VAL 156 253.628 -7.019 -14.180 Start of MODEL 6 1 1H MET 1 HT1 MET 1 239.208 -24.278 6.556 2 2H MET 1 HT2 MET 1 238.526 -23.468 5.204 3 3H MET 1 HT3 MET 1 237.737 -23.415 6.728 4 HA MET 1 HA MET 1 238.747 -21.384 6.528 5 1HB MET 1 HB2 MET 1 240.650 -23.169 8.059 6 2HB MET 1 HB1 MET 1 240.409 -21.446 8.311 7 1HG MET 1 HG2 MET 1 238.166 -21.821 9.087 8 2HG MET 1 HG1 MET 1 238.281 -23.537 8.699 9 1HE MET 1 HE1 MET 1 237.792 -22.555 12.301 10 2HE MET 1 HE2 MET 1 238.062 -24.286 12.095 11 3HE MET 1 HE3 MET 1 237.142 -23.387 10.888 12 H GLY 2 HN GLY 2 239.487 -20.747 4.533 13 1HA GLY 2 HA2 GLY 2 241.676 -21.820 3.155 14 2HA GLY 2 HA1 GLY 2 241.025 -20.206 2.917 15 H ALA 3 HN ALA 3 243.277 -19.628 2.516 16 HA ALA 3 HA ALA 3 244.537 -18.728 4.973 17 1HB ALA 3 HB1 ALA 3 246.791 -19.579 4.013 18 2HB ALA 3 HB2 ALA 3 245.782 -20.716 3.120 19 3HB ALA 3 HB3 ALA 3 245.743 -20.700 4.883 20 H SER 4 HN SER 4 246.706 -17.532 4.265 21 HA SER 4 HA SER 4 247.529 -15.644 3.296 22 1HB SER 4 HB2 SER 4 247.799 -15.676 0.941 23 2HB SER 4 HB1 SER 4 247.797 -17.367 1.444 24 HG SER 4 HG SER 4 245.968 -17.677 0.424 25 H ARG 5 HN ARG 5 246.186 -14.237 4.397 26 HA ARG 5 HA ARG 5 243.623 -13.477 3.460 27 1HB ARG 5 HB2 ARG 5 245.584 -12.292 5.402 28 2HB ARG 5 HB1 ARG 5 244.137 -11.403 4.944 29 1HG ARG 5 HG2 ARG 5 243.836 -14.214 5.859 30 2HG ARG 5 HG1 ARG 5 244.181 -12.965 7.057 31 1HD ARG 5 HD2 ARG 5 242.233 -11.713 6.370 32 2HD ARG 5 HD1 ARG 5 241.921 -12.856 5.065 33 HE ARG 5 HE ARG 5 241.967 -14.240 7.509 34 1HH1 ARG 5 HH11 ARG 5 240.005 -11.939 5.767 35 2HH1 ARG 5 HH12 ARG 5 238.528 -12.442 6.517 36 1HH2 ARG 5 HH21 ARG 5 240.024 -14.903 8.496 37 2HH2 ARG 5 HH22 ARG 5 238.538 -14.124 8.067 38 H LEU 6 HN LEU 6 243.654 -12.901 1.334 39 HA LEU 6 HA LEU 6 245.550 -10.921 0.383 40 1HB LEU 6 HB2 LEU 6 244.529 -12.981 -0.900 41 2HB LEU 6 HB1 LEU 6 243.221 -11.862 -1.237 42 HG LEU 6 HG LEU 6 246.044 -11.068 -1.849 43 1HD1 LEU 6 HD11 LEU 6 244.457 -12.318 -4.006 44 2HD1 LEU 6 HD12 LEU 6 245.189 -13.404 -2.825 45 3HD1 LEU 6 HD13 LEU 6 246.201 -12.291 -3.746 46 1HD2 LEU 6 HD21 LEU 6 245.105 -9.474 -3.196 47 2HD2 LEU 6 HD22 LEU 6 243.840 -9.617 -1.976 48 3HD2 LEU 6 HD23 LEU 6 243.667 -10.439 -3.525 49 H TYR 7 HN TYR 7 245.221 -8.853 0.647 50 HA TYR 7 HA TYR 7 242.467 -7.813 0.630 51 1HB TYR 7 HB2 TYR 7 244.797 -7.133 2.399 52 2HB TYR 7 HB1 TYR 7 243.534 -5.945 2.096 53 HD1 TYR 7 HD1 TYR 7 243.658 -9.600 2.909 54 HD2 TYR 7 HD2 TYR 7 241.981 -5.788 3.783 55 HE1 TYR 7 HE1 TYR 7 242.288 -10.615 4.682 56 HE2 TYR 7 HE2 TYR 7 240.608 -6.792 5.559 57 HH TYR 7 HH TYR 7 239.930 -9.894 5.826 58 H THR 8 HN THR 8 242.706 -5.245 0.390 59 HA THR 8 HA THR 8 244.493 -4.762 -1.908 60 HB THR 8 HB THR 8 242.760 -3.528 -2.996 61 HG1 THR 8 HG1 THR 8 241.617 -2.507 -1.501 62 1HG2 THR 8 HG21 THR 8 242.084 -6.239 -2.077 63 2HG2 THR 8 HG22 THR 8 242.213 -5.586 -3.709 64 3HG2 THR 8 HG23 THR 8 240.764 -5.287 -2.754 65 H LEU 9 HN LEU 9 244.632 -2.354 -2.388 66 HA LEU 9 HA LEU 9 244.363 -0.587 -0.120 67 1HB LEU 9 HB2 LEU 9 246.595 -1.919 0.034 68 2HB LEU 9 HB1 LEU 9 247.112 -0.883 -1.282 69 HG LEU 9 HG LEU 9 246.378 -0.086 1.514 70 1HD1 LEU 9 HD11 LEU 9 248.857 0.405 -0.115 71 2HD1 LEU 9 HD12 LEU 9 248.671 -0.879 1.080 72 3HD1 LEU 9 HD13 LEU 9 248.609 0.811 1.583 73 1HD2 LEU 9 HD21 LEU 9 246.827 2.258 0.743 74 2HD2 LEU 9 HD22 LEU 9 245.313 1.555 0.173 75 3HD2 LEU 9 HD23 LEU 9 246.700 1.658 -0.912 76 H VAL 10 HN VAL 10 243.351 1.047 -1.176 77 HA VAL 10 HA VAL 10 244.474 1.894 -3.748 78 HB VAL 10 HB VAL 10 242.282 1.214 -4.155 79 1HG1 VAL 10 HG11 VAL 10 241.755 2.237 -1.485 80 2HG1 VAL 10 HG12 VAL 10 241.103 0.829 -2.324 81 3HG1 VAL 10 HG13 VAL 10 240.450 2.431 -2.651 82 1HG2 VAL 10 HG21 VAL 10 242.068 4.178 -3.698 83 2HG2 VAL 10 HG22 VAL 10 241.096 3.213 -4.807 84 3HG2 VAL 10 HG23 VAL 10 242.821 3.425 -5.105 85 H LEU 11 HN LEU 11 245.380 3.741 -3.901 86 HA LEU 11 HA LEU 11 244.729 5.870 -1.982 87 1HB LEU 11 HB2 LEU 11 247.239 4.528 -2.508 88 2HB LEU 11 HB1 LEU 11 247.373 6.241 -2.852 89 HG LEU 11 HG LEU 11 246.711 4.924 -0.221 90 1HD1 LEU 11 HD11 LEU 11 248.752 5.561 0.481 91 2HD1 LEU 11 HD12 LEU 11 248.687 7.098 -0.377 92 3HD1 LEU 11 HD13 LEU 11 249.121 5.623 -1.241 93 1HD2 LEU 11 HD21 LEU 11 246.648 7.435 0.524 94 2HD2 LEU 11 HD22 LEU 11 245.199 6.631 -0.080 95 3HD2 LEU 11 HD23 LEU 11 246.126 7.692 -1.141 96 H VAL 12 HN VAL 12 243.734 7.415 -3.131 97 HA VAL 12 HA VAL 12 244.158 7.637 -5.968 98 HB VAL 12 HB VAL 12 242.554 9.517 -4.246 99 1HG1 VAL 12 HG11 VAL 12 241.649 8.831 -6.945 100 2HG1 VAL 12 HG12 VAL 12 243.194 9.679 -6.891 101 3HG1 VAL 12 HG13 VAL 12 241.766 10.401 -6.151 102 1HG2 VAL 12 HG21 VAL 12 241.383 7.675 -3.682 103 2HG2 VAL 12 HG22 VAL 12 242.054 6.720 -5.004 104 3HG2 VAL 12 HG23 VAL 12 240.718 7.831 -5.308 105 H LEU 13 HN LEU 13 246.286 8.249 -6.202 106 HA LEU 13 HA LEU 13 246.994 10.932 -5.225 107 1HB LEU 13 HB2 LEU 13 248.383 8.898 -4.590 108 2HB LEU 13 HB1 LEU 13 248.912 8.882 -6.260 109 HG LEU 13 HG LEU 13 250.541 10.258 -5.679 110 1HD1 LEU 13 HD11 LEU 13 248.305 12.177 -5.129 111 2HD1 LEU 13 HD12 LEU 13 249.271 12.020 -6.594 112 3HD1 LEU 13 HD13 LEU 13 250.006 12.631 -5.115 113 1HD2 LEU 13 HD21 LEU 13 249.181 10.037 -3.098 114 2HD2 LEU 13 HD22 LEU 13 250.224 11.447 -3.276 115 3HD2 LEU 13 HD23 LEU 13 250.883 9.827 -3.507 116 H GLN 14 HN GLN 14 246.875 12.480 -6.672 117 HA GLN 14 HA GLN 14 247.123 11.829 -9.522 118 1HB GLN 14 HB2 GLN 14 245.889 14.158 -8.056 119 2HB GLN 14 HB1 GLN 14 246.190 14.197 -9.788 120 1HG GLN 14 HG2 GLN 14 244.691 12.389 -10.169 121 2HG GLN 14 HG1 GLN 14 244.530 12.085 -8.440 122 1HE2 GLN 14 HE21 GLN 14 242.439 12.472 -8.080 123 2HE2 GLN 14 HE22 GLN 14 241.628 13.957 -8.433 124 HA PRO 15 HA PRO 15 251.032 13.818 -9.922 125 1HB PRO 15 HB2 PRO 15 250.747 15.248 -12.237 126 2HB PRO 15 HB1 PRO 15 251.004 13.502 -12.181 127 1HG PRO 15 HG2 PRO 15 248.455 15.032 -12.512 128 2HG PRO 15 HG1 PRO 15 249.004 13.573 -13.358 129 1HD PRO 15 HD2 PRO 15 247.218 13.462 -11.349 130 2HD PRO 15 HD1 PRO 15 248.426 12.184 -11.600 131 H GLN 16 HN GLN 16 248.888 15.303 -8.413 132 HA GLN 16 HA GLN 16 250.291 17.780 -8.200 133 1HB GLN 16 HB2 GLN 16 247.722 17.631 -9.653 134 2HB GLN 16 HB1 GLN 16 247.829 18.903 -8.444 135 1HG GLN 16 HG2 GLN 16 249.649 18.486 -10.802 136 2HG GLN 16 HG1 GLN 16 248.477 19.783 -10.573 137 1HE2 GLN 16 HE21 GLN 16 251.042 20.408 -11.161 138 2HE2 GLN 16 HE22 GLN 16 251.823 21.100 -9.784 139 H ARG 17 HN ARG 17 247.478 15.837 -7.315 140 HA ARG 17 HA ARG 17 247.903 16.614 -4.531 141 1HB ARG 17 HB2 ARG 17 245.343 16.725 -4.299 142 2HB ARG 17 HB1 ARG 17 246.164 18.102 -5.021 143 1HG ARG 17 HG2 ARG 17 244.845 17.939 -6.786 144 2HG ARG 17 HG1 ARG 17 245.516 16.343 -7.126 145 1HD ARG 17 HD2 ARG 17 243.809 15.252 -5.948 146 2HD ARG 17 HD1 ARG 17 243.321 16.728 -5.116 147 HE ARG 17 HE ARG 17 242.484 15.847 -7.719 148 1HH1 ARG 17 HH11 ARG 17 242.923 18.622 -5.648 149 2HH1 ARG 17 HH12 ARG 17 241.754 19.588 -6.486 150 1HH2 ARG 17 HH21 ARG 17 240.947 17.115 -8.821 151 2HH2 ARG 17 HH22 ARG 17 240.632 18.732 -8.286 152 H VAL 18 HN VAL 18 246.788 15.173 -2.997 153 HA VAL 18 HA VAL 18 246.226 12.505 -4.119 154 HB VAL 18 HB VAL 18 248.439 12.336 -3.235 155 1HG1 VAL 18 HG11 VAL 18 248.072 14.425 -1.748 156 2HG1 VAL 18 HG12 VAL 18 249.196 13.176 -1.216 157 3HG1 VAL 18 HG13 VAL 18 247.576 13.257 -0.524 158 1HG2 VAL 18 HG21 VAL 18 246.541 11.226 -1.169 159 2HG2 VAL 18 HG22 VAL 18 248.174 10.655 -1.512 160 3HG2 VAL 18 HG23 VAL 18 246.904 10.476 -2.723 161 H LEU 19 HN LEU 19 244.895 11.149 -2.752 162 HA LEU 19 HA LEU 19 243.227 12.694 -0.876 163 1HB LEU 19 HB2 LEU 19 242.079 12.088 -2.996 164 2HB LEU 19 HB1 LEU 19 242.358 10.397 -2.627 165 HG LEU 19 HG LEU 19 240.915 10.512 -0.700 166 1HD1 LEU 19 HD11 LEU 19 239.591 12.831 -0.611 167 2HD1 LEU 19 HD12 LEU 19 241.161 13.420 -1.156 168 3HD1 LEU 19 HD13 LEU 19 241.035 12.512 0.349 169 1HD2 LEU 19 HD21 LEU 19 240.064 10.528 -3.235 170 2HD2 LEU 19 HD22 LEU 19 239.254 11.983 -2.654 171 3HD2 LEU 19 HD23 LEU 19 238.969 10.437 -1.856 172 H LEU 20 HN LEU 20 243.758 12.084 1.118 173 HA LEU 20 HA LEU 20 244.372 9.257 1.621 174 1HB LEU 20 HB2 LEU 20 245.410 11.760 2.627 175 2HB LEU 20 HB1 LEU 20 244.875 10.738 3.945 176 HG LEU 20 HG LEU 20 246.770 9.800 1.800 177 1HD1 LEU 20 HD11 LEU 20 247.522 11.777 3.299 178 2HD1 LEU 20 HD12 LEU 20 248.590 10.387 3.095 179 3HD1 LEU 20 HD13 LEU 20 247.625 10.550 4.561 180 1HD2 LEU 20 HD21 LEU 20 245.304 8.301 3.470 181 2HD2 LEU 20 HD22 LEU 20 246.696 8.621 4.504 182 3HD2 LEU 20 HD23 LEU 20 246.923 7.852 2.934 183 H GLY 21 HN GLY 21 243.153 8.028 2.959 184 1HA GLY 21 HA2 GLY 21 240.617 9.181 3.839 185 2HA GLY 21 HA1 GLY 21 241.006 7.469 3.749 186 H MET 22 HN MET 22 240.330 9.869 5.844 187 HA MET 22 HA MET 22 242.067 8.778 7.951 188 1HB MET 22 HB2 MET 22 242.426 11.118 7.793 189 2HB MET 22 HB1 MET 22 240.705 11.451 7.654 190 1HG MET 22 HG2 MET 22 240.330 11.000 9.934 191 2HG MET 22 HG1 MET 22 241.918 10.260 10.128 192 1HE MET 22 HE1 MET 22 243.925 11.722 9.008 193 2HE MET 22 HE2 MET 22 244.212 11.867 10.741 194 3HE MET 22 HE3 MET 22 244.287 13.296 9.713 195 H LYS 23 HN LYS 23 241.157 7.988 9.853 196 HA LYS 23 HA LYS 23 238.340 7.308 9.667 197 1HB LYS 23 HB2 LYS 23 240.689 6.230 11.013 198 2HB LYS 23 HB1 LYS 23 239.299 6.323 12.086 199 1HG LYS 23 HG2 LYS 23 237.984 5.096 10.351 200 2HG LYS 23 HG1 LYS 23 239.489 4.869 9.461 201 1HD LYS 23 HD2 LYS 23 239.531 2.938 10.650 202 2HD LYS 23 HD1 LYS 23 240.275 3.986 11.860 203 1HE LYS 23 HE2 LYS 23 238.527 3.812 13.247 204 2HE LYS 23 HE1 LYS 23 237.358 3.999 11.941 205 1HZ LYS 23 HZ1 LYS 23 238.825 1.482 12.507 206 2HZ LYS 23 HZ2 LYS 23 237.555 1.695 11.410 207 3HZ LYS 23 HZ3 LYS 23 237.264 1.817 13.072 208 H LYS 24 HN LYS 24 236.786 7.904 11.214 209 HA LYS 24 HA LYS 24 237.446 10.385 12.580 210 1HB LYS 24 HB2 LYS 24 234.925 9.072 11.693 211 2HB LYS 24 HB1 LYS 24 234.834 10.150 13.078 212 1HG LYS 24 HG2 LYS 24 234.926 11.949 11.788 213 2HG LYS 24 HG1 LYS 24 236.350 11.347 10.937 214 1HD LYS 24 HD2 LYS 24 235.063 10.235 9.332 215 2HD LYS 24 HD1 LYS 24 233.610 10.282 10.332 216 1HE LYS 24 HE2 LYS 24 234.872 12.829 9.403 217 2HE LYS 24 HE1 LYS 24 233.850 11.902 8.305 218 1HZ LYS 24 HZ1 LYS 24 232.900 13.744 9.943 219 2HZ LYS 24 HZ2 LYS 24 232.782 12.403 10.967 220 3HZ LYS 24 HZ3 LYS 24 231.996 12.395 9.469 221 H ARG 25 HN ARG 25 236.553 7.084 13.268 222 HA ARG 25 HA ARG 25 237.509 7.326 15.937 223 1HB ARG 25 HB2 ARG 25 235.319 6.434 16.943 224 2HB ARG 25 HB1 ARG 25 235.421 8.151 16.581 225 1HG ARG 25 HG2 ARG 25 234.285 6.285 14.553 226 2HG ARG 25 HG1 ARG 25 233.302 6.797 15.928 227 1HD ARG 25 HD2 ARG 25 234.305 9.168 15.158 228 2HD ARG 25 HD1 ARG 25 234.272 8.331 13.608 229 HE ARG 25 HE ARG 25 231.813 7.844 14.480 230 1HH1 ARG 25 HH11 ARG 25 233.636 10.826 14.484 231 2HH1 ARG 25 HH12 ARG 25 232.231 11.826 14.347 232 1HH2 ARG 25 HH21 ARG 25 229.970 9.164 14.300 233 2HH2 ARG 25 HH22 ARG 25 230.151 10.885 14.243 234 H GLY 26 HN GLY 26 237.368 5.223 17.123 235 1HA GLY 26 HA2 GLY 26 237.106 2.855 17.091 236 2HA GLY 26 HA1 GLY 26 237.005 2.921 15.338 237 H PHE 27 HN PHE 27 238.654 1.788 14.547 238 HA PHE 27 HA PHE 27 241.270 1.986 15.855 239 1HB PHE 27 HB2 PHE 27 239.847 -0.113 14.421 240 2HB PHE 27 HB1 PHE 27 241.488 0.104 13.820 241 HD1 PHE 27 HD1 PHE 27 242.809 -1.577 14.656 242 HD2 PHE 27 HD2 PHE 27 240.023 0.339 17.241 243 HE1 PHE 27 HE1 PHE 27 243.676 -2.883 16.553 244 HE2 PHE 27 HE2 PHE 27 240.887 -0.963 19.142 245 HZ PHE 27 HZ PHE 27 242.716 -2.576 18.800 246 H GLY 28 HN GLY 28 241.754 4.094 15.021 247 1HA GLY 28 HA2 GLY 28 243.521 4.575 13.233 248 2HA GLY 28 HA1 GLY 28 242.234 4.167 12.113 249 H ALA 29 HN ALA 29 240.756 5.685 14.651 250 HA ALA 29 HA ALA 29 239.868 7.893 13.320 251 1HB ALA 29 HB1 ALA 29 238.939 8.545 15.255 252 2HB ALA 29 HB2 ALA 29 240.432 8.343 16.173 253 3HB ALA 29 HB3 ALA 29 239.445 6.936 15.769 254 H GLY 30 HN GLY 30 240.475 10.061 13.125 255 1HA GLY 30 HA2 GLY 30 241.967 11.769 12.756 256 2HA GLY 30 HA1 GLY 30 242.608 11.345 14.335 257 H ARG 31 HN ARG 31 242.675 9.002 11.778 258 HA ARG 31 HA ARG 31 245.512 9.579 11.278 259 1HB ARG 31 HB2 ARG 31 244.562 7.415 12.796 260 2HB ARG 31 HB1 ARG 31 245.001 6.734 11.236 261 1HG ARG 31 HG2 ARG 31 247.231 7.761 11.447 262 2HG ARG 31 HG1 ARG 31 246.781 8.352 13.047 263 1HD ARG 31 HD2 ARG 31 246.164 5.624 13.056 264 2HD ARG 31 HD1 ARG 31 247.727 5.749 12.251 265 HE ARG 31 HE ARG 31 248.673 6.358 14.247 266 1HH1 ARG 31 HH11 ARG 31 245.202 6.601 14.514 267 2HH1 ARG 31 HH12 ARG 31 245.228 6.874 16.223 268 1HH2 ARG 31 HH21 ARG 31 248.709 6.718 16.494 269 2HH2 ARG 31 HH22 ARG 31 247.219 6.942 17.348 270 H TRP 32 HN TRP 32 246.100 9.460 9.193 271 HA TRP 32 HA TRP 32 244.053 8.921 7.222 272 1HB TRP 32 HB2 TRP 32 246.812 9.416 6.287 273 2HB TRP 32 HB1 TRP 32 245.297 10.126 5.754 274 HD1 TRP 32 HD1 TRP 32 247.961 10.539 8.513 275 HE1 TRP 32 HE1 TRP 32 247.874 12.968 9.356 276 HE3 TRP 32 HE3 TRP 32 243.878 12.163 5.898 277 HZ2 TRP 32 HZ2 TRP 32 246.295 15.270 8.959 278 HZ3 TRP 32 HZ3 TRP 32 243.148 14.494 6.188 279 HH2 TRP 32 HH2 TRP 32 244.331 16.015 7.685 280 H ASN 33 HN ASN 33 244.303 7.418 5.455 281 HA ASN 33 HA ASN 33 246.379 5.556 5.243 282 1HB ASN 33 HB2 ASN 33 245.040 5.014 7.526 283 2HB ASN 33 HB1 ASN 33 244.093 4.061 6.388 284 1HD2 ASN 33 HD21 ASN 33 244.709 2.036 6.376 285 2HD2 ASN 33 HD22 ASN 33 246.333 1.458 6.500 286 H GLY 34 HN GLY 34 246.117 4.162 3.518 287 1HA GLY 34 HA2 GLY 34 244.344 4.904 1.500 288 2HA GLY 34 HA1 GLY 34 245.231 3.386 1.548 289 H PHE 35 HN PHE 35 242.833 3.269 0.397 290 HA PHE 35 HA PHE 35 240.965 2.316 2.450 291 1HB PHE 35 HB2 PHE 35 240.174 2.458 -0.420 292 2HB PHE 35 HB1 PHE 35 239.221 2.766 1.020 293 HD1 PHE 35 HD1 PHE 35 239.716 4.910 2.325 294 HD2 PHE 35 HD2 PHE 35 241.049 4.223 -1.656 295 HE1 PHE 35 HE1 PHE 35 240.015 7.331 2.012 296 HE2 PHE 35 HE2 PHE 35 241.351 6.643 -1.977 297 HZ PHE 35 HZ PHE 35 240.834 8.202 -0.141 298 H GLY 36 HN GLY 36 241.618 0.282 2.944 299 1HA GLY 36 HA2 GLY 36 242.399 -1.551 0.841 300 2HA GLY 36 HA1 GLY 36 242.386 -1.887 2.565 301 H GLY 37 HN GLY 37 241.493 -3.722 0.695 302 1HA GLY 37 HA2 GLY 37 238.801 -4.148 1.649 303 2HA GLY 37 HA1 GLY 37 238.907 -3.849 -0.079 304 H LYS 38 HN LYS 38 238.679 -6.233 2.120 305 HA LYS 38 HA LYS 38 240.584 -8.120 1.167 306 1HB LYS 38 HB2 LYS 38 239.373 -9.746 2.490 307 2HB LYS 38 HB1 LYS 38 239.534 -8.253 3.405 308 1HG LYS 38 HG2 LYS 38 237.191 -7.692 2.530 309 2HG LYS 38 HG1 LYS 38 237.095 -9.401 2.102 310 1HD LYS 38 HD2 LYS 38 238.049 -8.849 4.829 311 2HD LYS 38 HD1 LYS 38 236.379 -8.377 4.512 312 1HE LYS 38 HE2 LYS 38 236.012 -10.682 3.583 313 2HE LYS 38 HE1 LYS 38 237.616 -11.104 4.182 314 1HZ LYS 38 HZ1 LYS 38 236.922 -11.091 6.323 315 2HZ LYS 38 HZ2 LYS 38 235.439 -11.477 5.606 316 3HZ LYS 38 HZ3 LYS 38 235.760 -9.885 6.078 317 H VAL 39 HN VAL 39 240.397 -9.734 -0.329 318 HA VAL 39 HA VAL 39 238.455 -9.365 -2.405 319 HB VAL 39 HB VAL 39 240.298 -11.739 -2.198 320 1HG1 VAL 39 HG11 VAL 39 239.266 -10.163 -4.553 321 2HG1 VAL 39 HG12 VAL 39 238.635 -11.715 -4.004 322 3HG1 VAL 39 HG13 VAL 39 240.280 -11.603 -4.628 323 1HG2 VAL 39 HG21 VAL 39 241.731 -10.054 -3.703 324 2HG2 VAL 39 HG22 VAL 39 241.954 -10.225 -1.962 325 3HG2 VAL 39 HG23 VAL 39 240.982 -8.899 -2.600 326 H GLN 40 HN GLN 40 236.428 -10.028 -2.143 327 HA GLN 40 HA GLN 40 235.406 -11.774 -0.300 328 1HB GLN 40 HB2 GLN 40 234.479 -10.819 -2.963 329 2HB GLN 40 HB1 GLN 40 233.612 -12.164 -2.232 330 1HG GLN 40 HG2 GLN 40 232.414 -10.345 -1.496 331 2HG GLN 40 HG1 GLN 40 233.504 -10.647 -0.143 332 1HE2 GLN 40 HE21 GLN 40 234.304 -8.866 0.681 333 2HE2 GLN 40 HE22 GLN 40 234.705 -7.425 -0.183 334 H GLU 41 HN GLU 41 234.169 -13.873 -0.948 335 HA GLU 41 HA GLU 41 236.144 -15.825 -1.537 336 1HB GLU 41 HB2 GLU 41 233.963 -15.965 -0.084 337 2HB GLU 41 HB1 GLU 41 233.218 -16.451 -1.601 338 1HG GLU 41 HG2 GLU 41 235.643 -17.807 -0.458 339 2HG GLU 41 HG1 GLU 41 233.992 -18.312 -0.098 340 H GLY 42 HN GLY 42 236.587 -14.634 -3.703 341 1HA GLY 42 HA2 GLY 42 236.696 -15.831 -5.882 342 2HA GLY 42 HA1 GLY 42 234.946 -15.929 -5.792 343 H GLU 43 HN GLU 43 237.088 -13.155 -5.115 344 HA GLU 43 HA GLU 43 235.896 -11.805 -7.421 345 1HB GLU 43 HB2 GLU 43 235.315 -9.928 -6.256 346 2HB GLU 43 HB1 GLU 43 235.099 -11.111 -4.978 347 1HG GLU 43 HG2 GLU 43 237.132 -10.496 -3.943 348 2HG GLU 43 HG1 GLU 43 237.640 -9.551 -5.341 349 H THR 44 HN THR 44 237.271 -9.745 -7.872 350 HA THR 44 HA THR 44 240.037 -10.685 -7.929 351 HB THR 44 HB THR 44 240.309 -9.125 -9.788 352 HG1 THR 44 HG1 THR 44 238.938 -7.577 -10.049 353 1HG2 THR 44 HG21 THR 44 238.402 -10.109 -11.259 354 2HG2 THR 44 HG22 THR 44 238.080 -11.099 -9.835 355 3HG2 THR 44 HG23 THR 44 239.658 -11.170 -10.619 356 H ILE 45 HN ILE 45 241.722 -9.490 -7.178 357 HA ILE 45 HA ILE 45 241.376 -7.898 -4.972 358 HB ILE 45 HB ILE 45 243.716 -7.528 -6.827 359 1HG1 ILE 45 HG12 ILE 45 244.525 -9.432 -5.057 360 2HG1 ILE 45 HG11 ILE 45 242.856 -9.914 -5.339 361 1HG2 ILE 45 HG21 ILE 45 243.281 -7.245 -3.878 362 2HG2 ILE 45 HG22 ILE 45 243.787 -6.014 -5.035 363 3HG2 ILE 45 HG23 ILE 45 244.887 -7.323 -4.601 364 1HD1 ILE 45 HD11 ILE 45 243.424 -10.831 -7.266 365 2HD1 ILE 45 HD12 ILE 45 245.109 -10.437 -6.926 366 3HD1 ILE 45 HD13 ILE 45 244.105 -9.306 -7.833 367 H GLU 46 HN GLU 46 241.414 -6.958 -8.350 368 HA GLU 46 HA GLU 46 241.514 -4.130 -7.855 369 1HB GLU 46 HB2 GLU 46 242.203 -5.285 -10.009 370 2HB GLU 46 HB1 GLU 46 240.491 -5.517 -10.339 371 1HG GLU 46 HG2 GLU 46 240.498 -2.882 -9.859 372 2HG GLU 46 HG1 GLU 46 242.139 -3.077 -10.471 373 H ASP 47 HN ASP 47 239.078 -6.590 -8.060 374 HA ASP 47 HA ASP 47 236.876 -4.753 -8.286 375 1HB ASP 47 HB2 ASP 47 237.161 -7.713 -7.946 376 2HB ASP 47 HB1 ASP 47 235.621 -6.961 -7.541 377 H GLY 48 HN GLY 48 238.592 -6.491 -5.780 378 1HA GLY 48 HA2 GLY 48 236.743 -5.783 -3.685 379 2HA GLY 48 HA1 GLY 48 238.336 -6.498 -3.475 380 H ALA 49 HN ALA 49 239.718 -4.456 -4.986 381 HA ALA 49 HA ALA 49 240.102 -2.550 -2.883 382 1HB ALA 49 HB1 ALA 49 241.291 -2.107 -5.566 383 2HB ALA 49 HB2 ALA 49 241.781 -3.549 -4.679 384 3HB ALA 49 HB3 ALA 49 242.015 -1.955 -3.966 385 H ARG 50 HN ARG 50 238.471 -2.615 -5.989 386 HA ARG 50 HA ARG 50 237.999 0.227 -5.933 387 1HB ARG 50 HB2 ARG 50 236.825 -0.079 -8.026 388 2HB ARG 50 HB1 ARG 50 238.355 -0.941 -8.073 389 1HG ARG 50 HG2 ARG 50 237.080 -2.579 -8.925 390 2HG ARG 50 HG1 ARG 50 236.748 -2.918 -7.228 391 1HD ARG 50 HD2 ARG 50 234.748 -1.456 -7.384 392 2HD ARG 50 HD1 ARG 50 235.064 -1.270 -9.108 393 HE ARG 50 HE ARG 50 234.841 -4.008 -8.252 394 1HH1 ARG 50 HH11 ARG 50 233.089 -1.196 -9.349 395 2HH1 ARG 50 HH12 ARG 50 231.747 -2.112 -9.948 396 1HH2 ARG 50 HH21 ARG 50 233.076 -5.214 -9.039 397 2HH2 ARG 50 HH22 ARG 50 231.739 -4.393 -9.772 398 H ARG 51 HN ARG 51 236.025 -2.714 -5.565 399 HA ARG 51 HA ARG 51 233.576 -1.388 -5.148 400 1HB ARG 51 HB2 ARG 51 234.024 -3.886 -5.620 401 2HB ARG 51 HB1 ARG 51 234.268 -4.030 -3.884 402 1HG ARG 51 HG2 ARG 51 231.765 -2.932 -5.143 403 2HG ARG 51 HG1 ARG 51 231.980 -4.618 -4.667 404 1HD ARG 51 HD2 ARG 51 232.703 -3.418 -2.383 405 2HD ARG 51 HD1 ARG 51 231.586 -2.203 -3.005 406 HE ARG 51 HE ARG 51 229.872 -3.597 -2.461 407 1HH1 ARG 51 HH11 ARG 51 232.771 -5.514 -2.776 408 2HH1 ARG 51 HH12 ARG 51 232.007 -6.981 -2.263 409 1HH2 ARG 51 HH21 ARG 51 228.865 -5.525 -1.787 410 2HH2 ARG 51 HH22 ARG 51 229.789 -6.988 -1.703 411 H GLU 52 HN GLU 52 236.188 -2.267 -2.991 412 HA GLU 52 HA GLU 52 234.731 -1.445 -0.627 413 1HB GLU 52 HB2 GLU 52 237.626 -2.253 -0.989 414 2HB GLU 52 HB1 GLU 52 236.850 -1.941 0.558 415 1HG GLU 52 HG2 GLU 52 236.010 -4.086 -1.378 416 2HG GLU 52 HG1 GLU 52 237.052 -4.341 0.021 417 H LEU 53 HN LEU 53 236.723 -0.055 -3.020 418 HA LEU 53 HA LEU 53 237.847 2.074 -1.524 419 1HB LEU 53 HB2 LEU 53 238.915 1.600 -3.546 420 2HB LEU 53 HB1 LEU 53 237.408 1.520 -4.438 421 HG LEU 53 HG LEU 53 237.176 3.976 -4.181 422 1HD1 LEU 53 HD11 LEU 53 238.975 3.687 -2.167 423 2HD1 LEU 53 HD12 LEU 53 238.566 5.216 -2.944 424 3HD1 LEU 53 HD13 LEU 53 239.991 4.317 -3.462 425 1HD2 LEU 53 HD21 LEU 53 239.400 4.415 -5.578 426 2HD2 LEU 53 HD22 LEU 53 238.012 3.560 -6.252 427 3HD2 LEU 53 HD23 LEU 53 239.392 2.652 -5.636 428 H GLN 54 HN GLN 54 235.020 1.803 -3.638 429 HA GLN 54 HA GLN 54 234.143 4.464 -3.434 430 1HB GLN 54 HB2 GLN 54 233.092 3.321 -5.131 431 2HB GLN 54 HB1 GLN 54 232.881 1.866 -4.172 432 1HG GLN 54 HG2 GLN 54 231.074 2.918 -2.935 433 2HG GLN 54 HG1 GLN 54 231.308 4.413 -3.840 434 1HE2 GLN 54 HE21 GLN 54 229.740 4.680 -5.246 435 2HE2 GLN 54 HE22 GLN 54 229.025 3.452 -6.227 436 H GLU 55 HN GLU 55 233.903 1.783 -1.270 437 HA GLU 55 HA GLU 55 231.768 2.897 0.306 438 1HB GLU 55 HB2 GLU 55 233.443 0.436 0.426 439 2HB GLU 55 HB1 GLU 55 232.595 0.947 1.878 440 1HG GLU 55 HG2 GLU 55 230.938 0.935 -0.530 441 2HG GLU 55 HG1 GLU 55 231.566 -0.648 -0.073 442 H GLU 56 HN GLU 56 235.226 3.132 0.333 443 HA GLU 56 HA GLU 56 235.377 3.764 3.125 444 1HB GLU 56 HB2 GLU 56 237.278 3.449 0.910 445 2HB GLU 56 HB1 GLU 56 237.758 4.616 2.136 446 1HG GLU 56 HG2 GLU 56 236.766 2.257 3.409 447 2HG GLU 56 HG1 GLU 56 237.986 1.814 2.217 448 H SER 57 HN SER 57 235.546 5.707 0.138 449 HA SER 57 HA SER 57 235.060 8.067 1.832 450 1HB SER 57 HB2 SER 57 237.093 7.754 -0.367 451 2HB SER 57 HB1 SER 57 236.497 9.340 0.123 452 HG SER 57 HG SER 57 237.128 8.612 2.327 453 H GLY 58 HN GLY 58 233.343 6.320 0.056 454 1HA GLY 58 HA2 GLY 58 231.609 6.602 -1.417 455 2HA GLY 58 HA1 GLY 58 231.647 8.293 -0.939 456 H LEU 59 HN LEU 59 234.585 7.183 -2.250 457 HA LEU 59 HA LEU 59 233.974 8.536 -4.786 458 1HB LEU 59 HB2 LEU 59 236.579 8.080 -3.349 459 2HB LEU 59 HB1 LEU 59 236.464 8.734 -4.970 460 HG LEU 59 HG LEU 59 235.744 10.000 -2.364 461 1HD1 LEU 59 HD11 LEU 59 237.871 10.219 -4.022 462 2HD1 LEU 59 HD12 LEU 59 237.322 11.501 -2.942 463 3HD1 LEU 59 HD13 LEU 59 236.841 11.511 -4.638 464 1HD2 LEU 59 HD21 LEU 59 233.698 10.190 -3.675 465 2HD2 LEU 59 HD22 LEU 59 234.617 10.814 -5.045 466 3HD2 LEU 59 HD23 LEU 59 234.507 11.752 -3.556 467 H THR 60 HN THR 60 233.439 7.125 -6.269 468 HA THR 60 HA THR 60 234.622 4.481 -6.328 469 HB THR 60 HB THR 60 232.957 5.261 -8.610 470 HG1 THR 60 HG1 THR 60 231.144 5.721 -7.537 471 1HG2 THR 60 HG21 THR 60 231.735 3.299 -6.989 472 2HG2 THR 60 HG22 THR 60 233.464 2.956 -7.036 473 3HG2 THR 60 HG23 THR 60 232.550 3.091 -8.538 474 H VAL 61 HN VAL 61 235.362 3.707 -8.596 475 HA VAL 61 HA VAL 61 236.767 5.859 -10.004 476 HB VAL 61 HB VAL 61 238.841 4.588 -10.092 477 1HG1 VAL 61 HG11 VAL 61 238.801 6.172 -8.359 478 2HG1 VAL 61 HG12 VAL 61 239.404 4.692 -7.613 479 3HG1 VAL 61 HG13 VAL 61 237.729 5.183 -7.366 480 1HG2 VAL 61 HG21 VAL 61 238.718 2.689 -8.118 481 2HG2 VAL 61 HG22 VAL 61 238.660 2.372 -9.851 482 3HG2 VAL 61 HG23 VAL 61 237.163 2.502 -8.928 483 H ASP 62 HN ASP 62 237.075 5.558 -12.159 484 HA ASP 62 HA ASP 62 235.472 3.519 -13.409 485 1HB ASP 62 HB2 ASP 62 235.980 6.044 -14.126 486 2HB ASP 62 HB1 ASP 62 237.276 5.255 -15.020 487 H ALA 63 HN ALA 63 238.769 3.942 -12.533 488 HA ALA 63 HA ALA 63 239.520 1.333 -13.113 489 1HB ALA 63 HB1 ALA 63 239.405 1.666 -15.417 490 2HB ALA 63 HB2 ALA 63 241.117 1.876 -15.051 491 3HB ALA 63 HB3 ALA 63 240.093 3.288 -15.312 492 H LEU 64 HN LEU 64 240.616 1.449 -11.174 493 HA LEU 64 HA LEU 64 242.361 3.499 -10.365 494 1HB LEU 64 HB2 LEU 64 242.452 0.560 -9.657 495 2HB LEU 64 HB1 LEU 64 243.286 1.838 -8.797 496 HG LEU 64 HG LEU 64 240.552 2.556 -8.887 497 1HD1 LEU 64 HD11 LEU 64 239.751 0.421 -9.258 498 2HD1 LEU 64 HD12 LEU 64 239.768 0.520 -7.497 499 3HD1 LEU 64 HD13 LEU 64 241.056 -0.337 -8.345 500 1HD2 LEU 64 HD21 LEU 64 242.639 2.564 -7.097 501 2HD2 LEU 64 HD22 LEU 64 241.501 1.422 -6.380 502 3HD2 LEU 64 HD23 LEU 64 240.982 3.064 -6.759 503 H HIS 65 HN HIS 65 244.800 2.524 -9.788 504 HA HIS 65 HA HIS 65 245.929 1.506 -12.297 505 1HB HIS 65 HB2 HIS 65 246.081 4.105 -11.905 506 2HB HIS 65 HB1 HIS 65 247.393 3.658 -10.819 507 HD1 HIS 65 HD1 HIS 65 249.187 1.905 -12.117 508 HD2 HIS 65 HD2 HIS 65 246.974 4.578 -14.403 509 HE1 HIS 65 HE1 HIS 65 250.422 2.108 -14.298 510 HE2 HIS 65 HE2 HIS 65 249.111 3.797 -15.631 511 H LYS 66 HN LYS 66 246.577 -0.461 -11.576 512 HA LYS 66 HA LYS 66 247.585 -1.014 -9.004 513 1HB LYS 66 HB2 LYS 66 248.305 -3.147 -9.924 514 2HB LYS 66 HB1 LYS 66 246.708 -2.746 -10.539 515 1HG LYS 66 HG2 LYS 66 247.703 -1.994 -12.641 516 2HG LYS 66 HG1 LYS 66 249.305 -2.403 -12.024 517 1HD LYS 66 HD2 LYS 66 247.285 -4.550 -11.893 518 2HD LYS 66 HD1 LYS 66 247.797 -4.071 -13.514 519 1HE LYS 66 HE2 LYS 66 249.443 -5.566 -13.144 520 2HE LYS 66 HE1 LYS 66 250.188 -4.218 -12.286 521 1HZ LYS 66 HZ1 LYS 66 250.299 -5.740 -10.647 522 2HZ LYS 66 HZ2 LYS 66 249.009 -6.660 -11.239 523 3HZ LYS 66 HZ3 LYS 66 248.705 -5.255 -10.348 524 H VAL 67 HN VAL 67 249.605 -0.874 -8.133 525 HA VAL 67 HA VAL 67 251.753 -0.032 -9.981 526 HB VAL 67 HB VAL 67 252.686 1.362 -8.157 527 1HG1 VAL 67 HG11 VAL 67 249.963 2.447 -8.487 528 2HG1 VAL 67 HG12 VAL 67 250.806 2.003 -9.972 529 3HG1 VAL 67 HG13 VAL 67 251.529 3.168 -8.861 530 1HG2 VAL 67 HG21 VAL 67 251.900 0.648 -6.136 531 2HG2 VAL 67 HG22 VAL 67 250.278 0.336 -6.749 532 3HG2 VAL 67 HG23 VAL 67 250.794 1.989 -6.428 533 H GLY 68 HN GLY 68 251.133 -1.456 -6.764 534 1HA GLY 68 HA2 GLY 68 253.315 -3.325 -7.283 535 2HA GLY 68 HA1 GLY 68 253.503 -2.269 -5.893 536 H GLN 69 HN GLN 69 253.643 -4.748 -5.245 537 HA GLN 69 HA GLN 69 251.029 -5.372 -4.054 538 1HB GLN 69 HB2 GLN 69 252.942 -7.501 -4.995 539 2HB GLN 69 HB1 GLN 69 251.273 -7.698 -4.476 540 1HG GLN 69 HG2 GLN 69 250.928 -7.811 -6.698 541 2HG GLN 69 HG1 GLN 69 250.870 -6.056 -6.534 542 1HE2 GLN 69 HE21 GLN 69 252.091 -4.951 -7.878 543 2HE2 GLN 69 HE22 GLN 69 253.493 -5.537 -8.699 544 H ILE 70 HN ILE 70 251.137 -5.400 -1.921 545 HA ILE 70 HA ILE 70 253.749 -5.791 -0.633 546 HB ILE 70 HB ILE 70 251.211 -4.577 0.479 547 1HG1 ILE 70 HG12 ILE 70 253.808 -3.183 -0.172 548 2HG1 ILE 70 HG11 ILE 70 252.468 -3.280 -1.311 549 1HG2 ILE 70 HG21 ILE 70 253.736 -5.408 1.721 550 2HG2 ILE 70 HG22 ILE 70 252.149 -5.142 2.439 551 3HG2 ILE 70 HG23 ILE 70 253.215 -3.773 2.126 552 1HD1 ILE 70 HD11 ILE 70 252.698 -1.746 1.224 553 2HD1 ILE 70 HD12 ILE 70 251.106 -2.277 0.683 554 3HD1 ILE 70 HD13 ILE 70 252.089 -1.244 -0.353 555 H VAL 71 HN VAL 71 254.004 -7.265 1.030 556 HA VAL 71 HA VAL 71 251.768 -9.117 1.504 557 HB VAL 71 HB VAL 71 254.647 -9.985 1.253 558 1HG1 VAL 71 HG11 VAL 71 252.035 -11.462 1.473 559 2HG1 VAL 71 HG12 VAL 71 253.387 -11.478 2.605 560 3HG1 VAL 71 HG13 VAL 71 253.557 -12.228 1.019 561 1HG2 VAL 71 HG21 VAL 71 253.850 -9.144 -0.905 562 2HG2 VAL 71 HG22 VAL 71 252.444 -10.204 -0.800 563 3HG2 VAL 71 HG23 VAL 71 254.062 -10.894 -0.935 564 H PHE 72 HN PHE 72 251.701 -10.093 3.558 565 HA PHE 72 HA PHE 72 253.613 -9.078 5.534 566 1HB PHE 72 HB2 PHE 72 250.607 -8.914 5.690 567 2HB PHE 72 HB1 PHE 72 251.640 -8.775 7.109 568 HD1 PHE 72 HD1 PHE 72 250.080 -7.031 4.462 569 HD2 PHE 72 HD2 PHE 72 253.485 -6.965 7.013 570 HE1 PHE 72 HE1 PHE 72 250.365 -4.629 4.010 571 HE2 PHE 72 HE2 PHE 72 253.778 -4.563 6.565 572 HZ PHE 72 HZ PHE 72 252.216 -3.392 5.063 573 H GLU 73 HN GLU 73 254.476 -10.693 6.627 574 HA GLU 73 HA GLU 73 253.039 -13.246 6.776 575 1HB GLU 73 HB2 GLU 73 255.239 -13.493 5.874 576 2HB GLU 73 HB1 GLU 73 255.945 -12.516 7.152 577 1HG GLU 73 HG2 GLU 73 256.292 -14.312 8.391 578 2HG GLU 73 HG1 GLU 73 254.584 -14.742 8.315 579 H PHE 74 HN PHE 74 252.274 -14.028 8.660 580 HA PHE 74 HA PHE 74 252.674 -12.371 11.044 581 1HB PHE 74 HB2 PHE 74 250.704 -14.632 10.658 582 2HB PHE 74 HB1 PHE 74 250.707 -13.434 11.948 583 HD1 PHE 74 HD1 PHE 74 250.650 -10.919 11.038 584 HD2 PHE 74 HD2 PHE 74 249.207 -14.338 8.954 585 HE1 PHE 74 HE1 PHE 74 249.172 -9.477 9.701 586 HE2 PHE 74 HE2 PHE 74 247.728 -12.901 7.612 587 HZ PHE 74 HZ PHE 74 247.709 -10.467 7.985 588 H VAL 75 HN VAL 75 253.730 -12.983 12.761 589 HA VAL 75 HA VAL 75 255.285 -15.391 12.647 590 HB VAL 75 HB VAL 75 255.255 -13.989 15.220 591 1HG1 VAL 75 HG11 VAL 75 257.247 -14.956 13.220 592 2HG1 VAL 75 HG12 VAL 75 257.022 -15.441 14.901 593 3HG1 VAL 75 HG13 VAL 75 257.747 -13.877 14.523 594 1HG2 VAL 75 HG21 VAL 75 256.671 -12.099 14.109 595 2HG2 VAL 75 HG22 VAL 75 254.913 -11.961 14.183 596 3HG2 VAL 75 HG23 VAL 75 255.696 -12.474 12.688 597 H GLY 76 HN GLY 76 254.631 -17.315 13.308 598 1HA GLY 76 HA2 GLY 76 253.851 -18.818 14.969 599 2HA GLY 76 HA1 GLY 76 252.919 -17.508 15.679 600 H GLU 77 HN GLU 77 252.032 -16.819 12.827 601 HA GLU 77 HA GLU 77 249.919 -18.866 12.690 602 1HB GLU 77 HB2 GLU 77 249.897 -15.928 12.014 603 2HB GLU 77 HB1 GLU 77 248.631 -17.025 11.481 604 1HG GLU 77 HG2 GLU 77 248.626 -17.620 14.080 605 2HG GLU 77 HG1 GLU 77 249.214 -15.960 14.173 606 HA PRO 78 HA PRO 78 252.038 -20.134 8.907 607 1HB PRO 78 HB2 PRO 78 249.331 -21.345 8.533 608 2HB PRO 78 HB1 PRO 78 250.927 -22.068 8.302 609 1HG PRO 78 HG2 PRO 78 249.490 -22.630 10.468 610 2HG PRO 78 HG1 PRO 78 251.246 -22.412 10.573 611 1HD PRO 78 HD2 PRO 78 249.056 -20.587 11.430 612 2HD PRO 78 HD1 PRO 78 250.671 -20.822 12.128 613 H GLU 79 HN GLU 79 248.736 -18.855 9.036 614 HA GLU 79 HA GLU 79 248.441 -18.237 6.327 615 1HB GLU 79 HB2 GLU 79 246.950 -17.895 8.681 616 2HB GLU 79 HB1 GLU 79 247.142 -16.280 8.011 617 1HG GLU 79 HG2 GLU 79 246.065 -16.855 6.018 618 2HG GLU 79 HG1 GLU 79 246.220 -18.583 6.332 619 H LEU 80 HN LEU 80 248.146 -15.872 5.586 620 HA LEU 80 HA LEU 80 250.146 -14.053 6.665 621 1HB LEU 80 HB2 LEU 80 250.280 -14.417 3.726 622 2HB LEU 80 HB1 LEU 80 251.541 -13.971 4.859 623 HG LEU 80 HG LEU 80 250.481 -16.770 4.830 624 1HD1 LEU 80 HD11 LEU 80 252.754 -15.851 3.096 625 2HD1 LEU 80 HD12 LEU 80 251.108 -16.043 2.495 626 3HD1 LEU 80 HD13 LEU 80 251.979 -17.436 3.136 627 1HD2 LEU 80 HD21 LEU 80 252.173 -15.603 6.511 628 2HD2 LEU 80 HD22 LEU 80 253.323 -16.038 5.247 629 3HD2 LEU 80 HD23 LEU 80 252.349 -17.288 6.020 630 H MET 81 HN MET 81 250.171 -12.209 4.594 631 HA MET 81 HA MET 81 247.388 -11.624 3.975 632 1HB MET 81 HB2 MET 81 248.799 -10.370 6.117 633 2HB MET 81 HB1 MET 81 248.527 -9.174 4.859 634 1HG MET 81 HG2 MET 81 246.107 -9.904 4.875 635 2HG MET 81 HG1 MET 81 246.488 -10.793 6.348 636 1HE MET 81 HE1 MET 81 246.947 -6.226 5.948 637 2HE MET 81 HE2 MET 81 246.794 -7.358 4.605 638 3HE MET 81 HE3 MET 81 248.277 -7.318 5.559 639 H ASP 82 HN ASP 82 247.427 -11.339 1.838 640 HA ASP 82 HA ASP 82 249.744 -9.993 0.631 641 1HB ASP 82 HB2 ASP 82 249.171 -12.216 -0.276 642 2HB ASP 82 HB1 ASP 82 247.560 -11.632 -0.683 643 H VAL 83 HN VAL 83 249.373 -7.845 0.694 644 HA VAL 83 HA VAL 83 246.728 -6.849 -0.132 645 HB VAL 83 HB VAL 83 248.910 -5.247 1.192 646 1HG1 VAL 83 HG11 VAL 83 245.969 -4.714 1.319 647 2HG1 VAL 83 HG12 VAL 83 246.916 -4.203 -0.079 648 3HG1 VAL 83 HG13 VAL 83 247.319 -3.599 1.528 649 1HG2 VAL 83 HG21 VAL 83 248.539 -6.769 2.866 650 2HG2 VAL 83 HG22 VAL 83 246.871 -7.065 2.378 651 3HG2 VAL 83 HG23 VAL 83 247.290 -5.577 3.226 652 H HIS 84 HN HIS 84 246.572 -6.190 -2.164 653 HA HIS 84 HA HIS 84 248.935 -5.474 -3.681 654 1HB HIS 84 HB2 HIS 84 246.754 -6.757 -4.470 655 2HB HIS 84 HB1 HIS 84 246.165 -5.123 -4.758 656 HD1 HIS 84 HD1 HIS 84 247.774 -7.765 -6.469 657 HD2 HIS 84 HD2 HIS 84 248.250 -3.638 -6.421 658 HE1 HIS 84 HE1 HIS 84 248.990 -7.204 -8.597 659 HE2 HIS 84 HE2 HIS 84 249.344 -4.712 -8.504 660 H VAL 85 HN VAL 85 249.229 -3.407 -4.701 661 HA VAL 85 HA VAL 85 247.878 -1.250 -3.215 662 HB VAL 85 HB VAL 85 250.581 -1.241 -4.585 663 1HG1 VAL 85 HG11 VAL 85 249.348 0.943 -4.654 664 2HG1 VAL 85 HG12 VAL 85 250.881 0.984 -3.786 665 3HG1 VAL 85 HG13 VAL 85 249.362 0.931 -2.891 666 1HG2 VAL 85 HG21 VAL 85 251.088 -0.694 -2.009 667 2HG2 VAL 85 HG22 VAL 85 251.085 -2.330 -2.667 668 3HG2 VAL 85 HG23 VAL 85 249.665 -1.719 -1.818 669 H PHE 86 HN PHE 86 246.814 0.295 -4.293 670 HA PHE 86 HA PHE 86 247.013 0.415 -7.213 671 1HB PHE 86 HB2 PHE 86 244.609 -0.243 -5.562 672 2HB PHE 86 HB1 PHE 86 244.379 0.740 -7.003 673 HD1 PHE 86 HD1 PHE 86 244.159 -0.274 -9.076 674 HD2 PHE 86 HD2 PHE 86 245.860 -2.469 -5.853 675 HE1 PHE 86 HE1 PHE 86 244.133 -2.312 -10.456 676 HE2 PHE 86 HE2 PHE 86 245.840 -4.510 -7.227 677 HZ PHE 86 HZ PHE 86 244.975 -4.433 -9.532 678 H CYS 87 HN CYS 87 246.675 2.415 -8.082 679 HA CYS 87 HA CYS 87 245.904 4.588 -6.245 680 1HB CYS 87 HB2 CYS 87 248.319 4.334 -7.976 681 2HB CYS 87 HB1 CYS 87 247.537 5.910 -7.928 682 HG CYS 87 HG CYS 87 249.080 6.142 -5.997 683 H THR 88 HN THR 88 244.051 5.453 -7.018 684 HA THR 88 HA THR 88 243.442 5.110 -9.854 685 HB THR 88 HB THR 88 241.803 4.423 -8.074 686 HG1 THR 88 HG1 THR 88 241.297 5.140 -10.339 687 1HG2 THR 88 HG21 THR 88 240.949 5.800 -6.587 688 2HG2 THR 88 HG22 THR 88 240.645 7.042 -7.801 689 3HG2 THR 88 HG23 THR 88 242.227 6.930 -7.031 690 H ASP 89 HN ASP 89 241.776 7.076 -10.462 691 HA ASP 89 HA ASP 89 242.750 9.674 -9.726 692 1HB ASP 89 HB2 ASP 89 244.472 8.855 -11.373 693 2HB ASP 89 HB1 ASP 89 243.194 8.775 -12.582 694 H SER 90 HN SER 90 240.999 7.775 -12.141 695 HA SER 90 HA SER 90 239.069 9.897 -12.562 696 1HB SER 90 HB2 SER 90 240.000 7.849 -14.156 697 2HB SER 90 HB1 SER 90 238.424 7.242 -13.647 698 HG SER 90 HG SER 90 237.913 8.444 -15.356 699 H ILE 91 HN ILE 91 237.858 10.177 -10.727 700 HA ILE 91 HA ILE 91 236.634 7.794 -9.541 701 HB ILE 91 HB ILE 91 236.057 9.209 -7.610 702 1HG1 ILE 91 HG12 ILE 91 237.720 11.382 -8.891 703 2HG1 ILE 91 HG11 ILE 91 235.966 11.334 -9.033 704 1HG2 ILE 91 HG21 ILE 91 238.973 9.398 -8.371 705 2HG2 ILE 91 HG22 ILE 91 238.187 7.982 -7.674 706 3HG2 ILE 91 HG23 ILE 91 238.309 9.473 -6.740 707 1HD1 ILE 91 HD11 ILE 91 237.566 11.576 -6.497 708 2HD1 ILE 91 HD12 ILE 91 235.812 11.397 -6.567 709 3HD1 ILE 91 HD13 ILE 91 236.582 12.824 -7.262 710 H GLN 92 HN GLN 92 234.393 8.463 -8.460 711 HA GLN 92 HA GLN 92 232.791 9.949 -10.417 712 1HB GLN 92 HB2 GLN 92 232.399 7.093 -9.574 713 2HB GLN 92 HB1 GLN 92 231.043 8.066 -10.128 714 1HG GLN 92 HG2 GLN 92 233.464 7.998 -11.832 715 2HG GLN 92 HG1 GLN 92 232.468 6.545 -11.762 716 1HE2 GLN 92 HE21 GLN 92 231.932 6.818 -13.952 717 2HE2 GLN 92 HE22 GLN 92 230.775 7.998 -14.455 718 H GLY 93 HN GLY 93 232.222 7.950 -7.522 719 1HA GLY 93 HA2 GLY 93 230.109 9.396 -6.484 720 2HA GLY 93 HA1 GLY 93 231.225 8.448 -5.516 721 H THR 94 HN THR 94 230.388 10.397 -4.116 722 HA THR 94 HA THR 94 232.257 12.638 -4.431 723 HB THR 94 HB THR 94 230.032 12.972 -2.554 724 HG1 THR 94 HG1 THR 94 229.559 12.571 -5.313 725 1HG2 THR 94 HG21 THR 94 231.591 14.604 -4.354 726 2HG2 THR 94 HG22 THR 94 230.651 15.064 -2.936 727 3HG2 THR 94 HG23 THR 94 229.863 14.917 -4.507 728 HA PRO 95 HA PRO 95 234.289 11.718 -0.664 729 1HB PRO 95 HB2 PRO 95 234.134 14.524 0.202 730 2HB PRO 95 HB1 PRO 95 235.552 13.569 -0.241 731 1HG PRO 95 HG2 PRO 95 234.636 15.551 -1.796 732 2HG PRO 95 HG1 PRO 95 235.366 14.083 -2.473 733 1HD PRO 95 HD2 PRO 95 232.470 14.807 -2.205 734 2HD PRO 95 HD1 PRO 95 233.322 14.071 -3.580 735 H VAL 96 HN VAL 96 231.913 10.904 -0.384 736 HA VAL 96 HA VAL 96 230.318 12.300 1.546 737 HB VAL 96 HB VAL 96 230.056 9.367 0.936 738 1HG1 VAL 96 HG11 VAL 96 227.977 9.526 1.796 739 2HG1 VAL 96 HG12 VAL 96 227.725 11.156 1.173 740 3HG1 VAL 96 HG13 VAL 96 228.673 10.911 2.640 741 1HG2 VAL 96 HG21 VAL 96 229.634 11.654 -0.881 742 2HG2 VAL 96 HG22 VAL 96 228.347 10.448 -0.831 743 3HG2 VAL 96 HG23 VAL 96 229.992 9.965 -1.242 744 H GLU 97 HN GLU 97 232.519 12.394 2.814 745 HA GLU 97 HA GLU 97 233.575 10.345 4.288 746 1HB GLU 97 HB2 GLU 97 234.249 11.981 5.924 747 2HB GLU 97 HB1 GLU 97 234.336 12.718 4.331 748 1HG GLU 97 HG2 GLU 97 231.848 13.438 5.020 749 2HG GLU 97 HG1 GLU 97 232.588 13.342 6.618 750 H SER 98 HN SER 98 232.634 8.833 5.483 751 HA SER 98 HA SER 98 230.034 9.305 6.676 752 1HB SER 98 HB2 SER 98 231.718 6.792 6.766 753 2HB SER 98 HB1 SER 98 229.996 6.930 7.124 754 HG SER 98 HG SER 98 229.827 7.708 4.869 755 H ASP 99 HN ASP 99 229.947 7.881 8.918 756 HA ASP 99 HA ASP 99 231.270 9.567 10.801 757 1HB ASP 99 HB2 ASP 99 229.428 7.207 11.017 758 2HB ASP 99 HB1 ASP 99 230.230 7.845 12.449 759 H GLU 100 HN GLU 100 232.356 6.885 9.126 760 HA GLU 100 HA GLU 100 234.242 6.194 11.279 761 1HB GLU 100 HB2 GLU 100 232.623 4.540 9.603 762 2HB GLU 100 HB1 GLU 100 234.313 4.224 9.233 763 1HG GLU 100 HG2 GLU 100 234.781 3.644 11.492 764 2HG GLU 100 HG1 GLU 100 233.195 4.203 12.023 765 H MET 101 HN MET 101 233.903 7.017 7.879 766 HA MET 101 HA MET 101 236.836 7.191 7.686 767 1HB MET 101 HB2 MET 101 234.952 5.966 5.974 768 2HB MET 101 HB1 MET 101 235.551 7.383 5.123 769 1HG MET 101 HG2 MET 101 236.828 5.337 4.633 770 2HG MET 101 HG1 MET 101 237.814 6.623 5.326 771 1HE MET 101 HE1 MET 101 239.350 6.038 7.802 772 2HE MET 101 HE2 MET 101 239.634 5.739 6.087 773 3HE MET 101 HE3 MET 101 239.896 4.450 7.262 774 H ARG 102 HN ARG 102 237.707 8.948 6.384 775 HA ARG 102 HA ARG 102 236.084 11.222 5.760 776 1HB ARG 102 HB2 ARG 102 236.250 11.422 8.231 777 2HB ARG 102 HB1 ARG 102 238.003 11.445 8.093 778 1HG ARG 102 HG2 ARG 102 237.296 13.454 6.396 779 2HG ARG 102 HG1 ARG 102 236.047 13.572 7.637 780 1HD ARG 102 HD2 ARG 102 239.028 13.580 8.098 781 2HD ARG 102 HD1 ARG 102 237.958 14.978 8.190 782 HE ARG 102 HE ARG 102 237.082 12.942 9.949 783 1HH1 ARG 102 HH11 ARG 102 239.561 15.372 9.589 784 2HH1 ARG 102 HH12 ARG 102 239.799 15.560 11.294 785 1HH2 ARG 102 HH21 ARG 102 237.394 13.189 12.192 786 2HH2 ARG 102 HH22 ARG 102 238.570 14.320 12.772 787 HA PRO 103 HA PRO 103 239.924 10.973 3.288 788 1HB PRO 103 HB2 PRO 103 238.879 11.992 1.022 789 2HB PRO 103 HB1 PRO 103 238.635 10.306 1.495 790 1HG PRO 103 HG2 PRO 103 236.803 12.653 1.842 791 2HG PRO 103 HG1 PRO 103 236.426 11.020 1.261 792 1HD PRO 103 HD2 PRO 103 235.942 11.797 3.810 793 2HD PRO 103 HD1 PRO 103 236.391 10.131 3.395 794 H CYS 104 HN CYS 104 241.278 12.581 2.328 795 HA CYS 104 HA CYS 104 240.505 15.368 2.681 796 1HB CYS 104 HB2 CYS 104 242.122 14.009 4.569 797 2HB CYS 104 HB1 CYS 104 243.184 15.086 3.669 798 HG CYS 104 HG CYS 104 241.061 15.938 5.677 799 H TRP 105 HN TRP 105 241.019 16.405 0.887 800 HA TRP 105 HA TRP 105 242.926 15.252 -0.967 801 1HB TRP 105 HB2 TRP 105 241.202 17.726 -1.231 802 2HB TRP 105 HB1 TRP 105 242.122 16.968 -2.526 803 HD1 TRP 105 HD1 TRP 105 239.580 15.477 0.027 804 HE1 TRP 105 HE1 TRP 105 237.845 14.109 -1.298 805 HE3 TRP 105 HE3 TRP 105 241.312 16.344 -4.705 806 HZ2 TRP 105 HZ2 TRP 105 237.288 13.488 -3.993 807 HZ3 TRP 105 HZ3 TRP 105 240.119 15.327 -6.602 808 HH2 TRP 105 HH2 TRP 105 238.149 13.928 -6.252 809 H PHE 106 HN PHE 106 245.013 15.747 -0.879 810 HA PHE 106 HA PHE 106 245.788 18.491 -0.163 811 1HB PHE 106 HB2 PHE 106 247.025 15.944 0.902 812 2HB PHE 106 HB1 PHE 106 247.726 17.545 1.106 813 HD1 PHE 106 HD1 PHE 106 245.284 19.130 1.665 814 HD2 PHE 106 HD2 PHE 106 246.505 15.304 3.073 815 HE1 PHE 106 HE1 PHE 106 243.948 19.459 3.705 816 HE2 PHE 106 HE2 PHE 106 245.171 15.626 5.114 817 HZ PHE 106 HZ PHE 106 243.890 17.705 5.432 818 H GLN 107 HN GLN 107 248.513 18.256 -0.402 819 HA GLN 107 HA GLN 107 248.794 18.048 -3.267 820 1HB GLN 107 HB2 GLN 107 250.938 18.696 -1.244 821 2HB GLN 107 HB1 GLN 107 250.948 19.058 -2.965 822 1HG GLN 107 HG2 GLN 107 248.837 20.453 -2.440 823 2HG GLN 107 HG1 GLN 107 249.396 20.362 -0.772 824 1HE2 GLN 107 HE21 GLN 107 249.268 22.436 -3.109 825 2HE2 GLN 107 HE22 GLN 107 250.793 23.237 -2.974 826 H LEU 108 HN LEU 108 250.726 16.968 -4.202 827 HA LEU 108 HA LEU 108 250.904 14.252 -3.165 828 1HB LEU 108 HB2 LEU 108 251.597 13.601 -5.297 829 2HB LEU 108 HB1 LEU 108 250.443 14.881 -5.612 830 HG LEU 108 HG LEU 108 253.441 15.241 -5.630 831 1HD1 LEU 108 HD11 LEU 108 251.938 15.487 -8.135 832 2HD1 LEU 108 HD12 LEU 108 252.022 13.851 -7.482 833 3HD1 LEU 108 HD13 LEU 108 253.505 14.744 -7.815 834 1HD2 LEU 108 HD21 LEU 108 252.442 17.317 -5.134 835 2HD2 LEU 108 HD22 LEU 108 251.133 17.048 -6.284 836 3HD2 LEU 108 HD23 LEU 108 252.769 17.349 -6.867 837 H ASP 109 HN ASP 109 252.512 16.936 -2.458 838 HA ASP 109 HA ASP 109 255.064 15.508 -2.136 839 1HB ASP 109 HB2 ASP 109 254.508 18.252 -3.139 840 2HB ASP 109 HB1 ASP 109 255.895 18.062 -2.072 841 H GLN 110 HN GLN 110 252.651 15.818 -0.408 842 HA GLN 110 HA GLN 110 254.083 16.589 1.980 843 1HB GLN 110 HB2 GLN 110 251.602 18.015 1.046 844 2HB GLN 110 HB1 GLN 110 252.120 18.024 2.726 845 1HG GLN 110 HG2 GLN 110 253.770 19.009 0.410 846 2HG GLN 110 HG1 GLN 110 252.814 20.031 1.483 847 1HE2 GLN 110 HE21 GLN 110 253.790 20.832 3.203 848 2HE2 GLN 110 HE22 GLN 110 255.281 20.274 3.875 849 H ILE 111 HN ILE 111 252.722 14.166 0.727 850 HA ILE 111 HA ILE 111 250.490 13.618 2.449 851 HB ILE 111 HB ILE 111 251.764 11.174 1.596 852 1HG1 ILE 111 HG12 ILE 111 251.106 11.652 -0.894 853 2HG1 ILE 111 HG11 ILE 111 251.469 13.324 -0.463 854 1HG2 ILE 111 HG21 ILE 111 249.662 10.535 1.255 855 2HG2 ILE 111 HG22 ILE 111 249.239 12.000 0.368 856 3HG2 ILE 111 HG23 ILE 111 249.274 12.014 2.131 857 1HD1 ILE 111 HD11 ILE 111 253.292 10.948 -0.460 858 2HD1 ILE 111 HD12 ILE 111 253.693 12.440 0.390 859 3HD1 ILE 111 HD13 ILE 111 253.450 12.458 -1.357 860 HA PRO 112 HA PRO 112 253.094 12.362 5.830 861 1HB PRO 112 HB2 PRO 112 251.261 12.436 7.749 862 2HB PRO 112 HB1 PRO 112 251.754 13.926 6.933 863 1HG PRO 112 HG2 PRO 112 249.280 12.297 6.569 864 2HG PRO 112 HG1 PRO 112 249.484 14.055 6.507 865 1HD PRO 112 HD2 PRO 112 249.388 12.294 4.307 866 2HD PRO 112 HD1 PRO 112 249.880 13.999 4.277 867 H PHE 113 HN PHE 113 253.658 10.261 5.328 868 HA PHE 113 HA PHE 113 251.747 8.128 5.614 869 1HB PHE 113 HB2 PHE 113 254.574 7.347 5.580 870 2HB PHE 113 HB1 PHE 113 253.237 6.786 4.597 871 HD1 PHE 113 HD1 PHE 113 252.539 9.621 3.466 872 HD2 PHE 113 HD2 PHE 113 256.147 7.395 3.871 873 HE1 PHE 113 HE1 PHE 113 253.504 10.812 1.546 874 HE2 PHE 113 HE2 PHE 113 257.107 8.574 1.954 875 HZ PHE 113 HZ PHE 113 255.788 10.300 0.786 876 H LYS 114 HN LYS 114 253.848 9.833 7.694 877 HA LYS 114 HA LYS 114 254.412 7.811 9.584 878 1HB LYS 114 HB2 LYS 114 254.112 10.758 10.175 879 2HB LYS 114 HB1 LYS 114 255.085 9.581 11.048 880 1HG LYS 114 HG2 LYS 114 256.770 10.446 9.856 881 2HG LYS 114 HG1 LYS 114 256.166 9.393 8.576 882 1HD LYS 114 HD2 LYS 114 255.370 11.116 7.355 883 2HD LYS 114 HD1 LYS 114 254.844 12.015 8.781 884 1HE LYS 114 HE2 LYS 114 256.636 13.186 7.601 885 2HE LYS 114 HE1 LYS 114 257.144 12.694 9.216 886 1HZ LYS 114 HZ1 LYS 114 258.162 10.699 8.112 887 2HZ LYS 114 HZ2 LYS 114 258.909 12.177 7.770 888 3HZ LYS 114 HZ3 LYS 114 257.888 11.461 6.627 889 H ASP 115 HN ASP 115 251.707 9.876 8.932 890 HA ASP 115 HA ASP 115 250.353 8.964 11.344 891 1HB ASP 115 HB2 ASP 115 249.893 11.235 9.445 892 2HB ASP 115 HB1 ASP 115 248.560 10.644 10.432 893 H MET 116 HN MET 116 250.918 7.263 9.033 894 HA MET 116 HA MET 116 248.161 6.571 8.299 895 1HB MET 116 HB2 MET 116 250.538 6.961 6.616 896 2HB MET 116 HB1 MET 116 249.655 5.479 6.284 897 1HG MET 116 HG2 MET 116 247.950 6.559 5.334 898 2HG MET 116 HG1 MET 116 247.959 7.842 6.541 899 1HE MET 116 HE1 MET 116 249.329 6.511 3.193 900 2HE MET 116 HE2 MET 116 250.865 6.645 4.048 901 3HE MET 116 HE3 MET 116 250.508 7.729 2.703 902 H TRP 117 HN TRP 117 251.203 4.877 7.668 903 HA TRP 117 HA TRP 117 250.699 2.915 9.715 904 1HB TRP 117 HB2 TRP 117 249.625 2.506 7.109 905 2HB TRP 117 HB1 TRP 117 250.958 1.376 7.317 906 HD1 TRP 117 HD1 TRP 117 249.044 2.216 10.464 907 HE1 TRP 117 HE1 TRP 117 247.598 0.200 11.146 908 HE3 TRP 117 HE3 TRP 117 249.583 -0.636 6.253 909 HZ2 TRP 117 HZ2 TRP 117 246.791 -2.270 10.046 910 HZ3 TRP 117 HZ3 TRP 117 248.440 -2.812 6.149 911 HH2 TRP 117 HH2 TRP 117 247.073 -3.611 8.007 912 HA PRO 118 HA PRO 118 255.034 2.224 9.190 913 1HB PRO 118 HB2 PRO 118 255.402 -0.306 9.924 914 2HB PRO 118 HB1 PRO 118 254.726 0.875 11.050 915 1HG PRO 118 HG2 PRO 118 253.334 -1.240 9.464 916 2HG PRO 118 HG1 PRO 118 253.037 -0.709 11.128 917 1HD PRO 118 HD2 PRO 118 251.592 0.100 8.891 918 2HD PRO 118 HD1 PRO 118 251.625 0.940 10.453 919 H ASP 119 HN ASP 119 253.208 1.373 6.752 920 HA ASP 119 HA ASP 119 255.393 0.004 5.337 921 1HB ASP 119 HB2 ASP 119 253.474 -1.034 3.931 922 2HB ASP 119 HB1 ASP 119 253.840 -1.726 5.509 923 H ASP 120 HN ASP 120 252.868 2.393 5.309 924 HA ASP 120 HA ASP 120 252.496 3.074 2.713 925 1HB ASP 120 HB2 ASP 120 252.895 4.905 5.071 926 2HB ASP 120 HB1 ASP 120 252.305 5.447 3.501 927 H SER 121 HN SER 121 255.126 4.459 4.690 928 HA SER 121 HA SER 121 256.381 5.877 2.638 929 1HB SER 121 HB2 SER 121 256.789 5.930 5.193 930 2HB SER 121 HB1 SER 121 257.924 4.614 4.894 931 HG SER 121 HG SER 121 258.987 6.609 4.807 932 H TYR 122 HN TYR 122 256.324 2.475 3.194 933 HA TYR 122 HA TYR 122 258.790 1.971 1.791 934 1HB TYR 122 HB2 TYR 122 256.754 0.274 3.163 935 2HB TYR 122 HB1 TYR 122 257.867 -0.472 2.022 936 HD1 TYR 122 HD1 TYR 122 257.377 0.141 5.372 937 HD2 TYR 122 HD2 TYR 122 260.417 0.434 2.410 938 HE1 TYR 122 HE1 TYR 122 259.093 0.029 7.130 939 HE2 TYR 122 HE2 TYR 122 262.142 0.322 4.160 940 HH TYR 122 HH TYR 122 261.563 0.832 7.348 941 H TRP 123 HN TRP 123 255.432 2.243 0.932 942 HA TRP 123 HA TRP 123 256.141 1.154 -1.703 943 1HB TRP 123 HB2 TRP 123 253.827 0.413 -1.998 944 2HB TRP 123 HB1 TRP 123 254.577 -0.337 -0.595 945 HD1 TRP 123 HD1 TRP 123 253.599 0.288 1.801 946 HE1 TRP 123 HE1 TRP 123 251.378 1.363 2.534 947 HE3 TRP 123 HE3 TRP 123 252.082 2.176 -2.701 948 HZ2 TRP 123 HZ2 TRP 123 249.259 2.830 1.357 949 HZ3 TRP 123 HZ3 TRP 123 249.943 3.389 -2.807 950 HH2 TRP 123 HH2 TRP 123 248.566 3.700 -0.825 951 H PHE 124 HN PHE 124 255.125 3.946 -0.094 952 HA PHE 124 HA PHE 124 253.577 5.047 -2.231 953 1HB PHE 124 HB2 PHE 124 253.837 5.675 0.407 954 2HB PHE 124 HB1 PHE 124 254.821 6.930 -0.332 955 HD1 PHE 124 HD1 PHE 124 253.221 8.554 0.616 956 HD2 PHE 124 HD2 PHE 124 252.009 5.692 -2.286 957 HE1 PHE 124 HE1 PHE 124 251.208 9.865 0.180 958 HE2 PHE 124 HE2 PHE 124 249.987 7.011 -2.738 959 HZ PHE 124 HZ PHE 124 249.581 9.101 -1.501 960 HA PRO 125 HA PRO 125 257.778 7.630 -2.817 961 1HB PRO 125 HB2 PRO 125 259.540 5.304 -2.194 962 2HB PRO 125 HB1 PRO 125 259.821 7.030 -1.937 963 1HG PRO 125 HG2 PRO 125 259.183 5.451 0.100 964 2HG PRO 125 HG1 PRO 125 258.519 7.090 -0.017 965 1HD PRO 125 HD2 PRO 125 257.199 4.468 -0.552 966 2HD PRO 125 HD1 PRO 125 256.518 5.957 0.135 967 H LEU 126 HN LEU 126 257.302 4.201 -3.446 968 HA LEU 126 HA LEU 126 258.651 4.257 -5.989 969 1HB LEU 126 HB2 LEU 126 256.706 2.148 -5.084 970 2HB LEU 126 HB1 LEU 126 258.050 1.981 -6.199 971 HG LEU 126 HG LEU 126 258.562 2.671 -3.327 972 1HD1 LEU 126 HD11 LEU 126 258.058 0.648 -2.549 973 2HD1 LEU 126 HD12 LEU 126 258.810 -0.157 -3.925 974 3HD1 LEU 126 HD13 LEU 126 257.144 0.408 -4.036 975 1HD2 LEU 126 HD21 LEU 126 260.474 0.917 -4.294 976 2HD2 LEU 126 HD22 LEU 126 260.632 2.668 -4.149 977 3HD2 LEU 126 HD23 LEU 126 260.109 1.954 -5.674 978 H LEU 127 HN LEU 127 255.401 4.580 -4.778 979 HA LEU 127 HA LEU 127 253.982 4.305 -7.193 980 1HB LEU 127 HB2 LEU 127 253.358 5.921 -4.719 981 2HB LEU 127 HB1 LEU 127 252.221 5.621 -6.016 982 HG LEU 127 HG LEU 127 252.876 3.994 -3.734 983 1HD1 LEU 127 HD11 LEU 127 250.633 4.561 -4.256 984 2HD1 LEU 127 HD12 LEU 127 250.801 2.822 -4.497 985 3HD1 LEU 127 HD13 LEU 127 250.781 3.907 -5.887 986 1HD2 LEU 127 HD21 LEU 127 252.862 1.809 -4.911 987 2HD2 LEU 127 HD22 LEU 127 254.340 2.734 -5.169 988 3HD2 LEU 127 HD23 LEU 127 253.112 2.667 -6.432 989 H LEU 128 HN LEU 128 255.084 7.188 -5.445 990 HA LEU 128 HA LEU 128 254.298 9.089 -7.345 991 1HB LEU 128 HB2 LEU 128 256.227 9.027 -5.084 992 2HB LEU 128 HB1 LEU 128 256.378 10.340 -6.235 993 HG LEU 128 HG LEU 128 253.672 9.813 -5.127 994 1HD1 LEU 128 HD11 LEU 128 254.621 9.733 -3.050 995 2HD1 LEU 128 HD12 LEU 128 254.458 11.478 -3.249 996 3HD1 LEU 128 HD13 LEU 128 256.017 10.701 -3.527 997 1HD2 LEU 128 HD21 LEU 128 254.428 11.611 -6.833 998 2HD2 LEU 128 HD22 LEU 128 255.054 12.449 -5.414 999 3HD2 LEU 128 HD23 LEU 128 253.336 12.068 -5.525 1000 H GLN 129 HN GLN 129 257.124 7.050 -7.148 1001 HA GLN 129 HA GLN 129 258.666 8.442 -9.099 1002 1HB GLN 129 HB2 GLN 129 259.557 6.853 -7.349 1003 2HB GLN 129 HB1 GLN 129 258.921 5.536 -8.324 1004 1HG GLN 129 HG2 GLN 129 261.215 5.729 -8.841 1005 2HG GLN 129 HG1 GLN 129 260.327 6.384 -10.216 1006 1HE2 GLN 129 HE21 GLN 129 262.997 6.950 -9.763 1007 2HE2 GLN 129 HE22 GLN 129 263.160 8.624 -9.369 1008 H LYS 130 HN LYS 130 255.898 6.550 -9.360 1009 HA LYS 130 HA LYS 130 254.725 5.782 -11.150 1010 1HB LYS 130 HB2 LYS 130 256.911 6.897 -12.909 1011 2HB LYS 130 HB1 LYS 130 255.244 6.555 -13.356 1012 1HG LYS 130 HG2 LYS 130 254.470 8.484 -12.481 1013 2HG LYS 130 HG1 LYS 130 255.633 8.479 -11.154 1014 1HD LYS 130 HD2 LYS 130 256.556 8.953 -13.960 1015 2HD LYS 130 HD1 LYS 130 255.829 10.268 -13.034 1016 1HE LYS 130 HE2 LYS 130 257.562 9.372 -11.208 1017 2HE LYS 130 HE1 LYS 130 258.423 8.885 -12.666 1018 1HZ LYS 130 HZ1 LYS 130 257.402 11.636 -12.250 1019 2HZ LYS 130 HZ2 LYS 130 258.506 11.104 -13.416 1020 3HZ LYS 130 HZ3 LYS 130 258.958 11.157 -11.787 1021 H LYS 131 HN LYS 131 256.605 4.120 -9.812 1022 HA LYS 131 HA LYS 131 257.270 2.265 -12.002 1023 1HB LYS 131 HB2 LYS 131 258.902 2.972 -9.569 1024 2HB LYS 131 HB1 LYS 131 259.164 1.482 -10.467 1025 1HG LYS 131 HG2 LYS 131 259.415 3.001 -12.520 1026 2HG LYS 131 HG1 LYS 131 259.599 4.309 -11.348 1027 1HD LYS 131 HD2 LYS 131 261.319 2.531 -10.308 1028 2HD LYS 131 HD1 LYS 131 261.420 2.073 -12.009 1029 1HE LYS 131 HE2 LYS 131 262.411 4.022 -12.615 1030 2HE LYS 131 HE1 LYS 131 261.542 4.964 -11.405 1031 1HZ LYS 131 HZ1 LYS 131 263.632 4.996 -10.537 1032 2HZ LYS 131 HZ2 LYS 131 264.053 3.479 -11.153 1033 3HZ LYS 131 HZ3 LYS 131 263.057 3.591 -9.790 1034 H LYS 132 HN LYS 132 257.307 -0.016 -11.363 1035 HA LYS 132 HA LYS 132 255.230 -0.542 -9.375 1036 1HB LYS 132 HB2 LYS 132 256.391 -2.247 -11.582 1037 2HB LYS 132 HB1 LYS 132 255.211 -2.835 -10.417 1038 1HG LYS 132 HG2 LYS 132 253.578 -2.074 -11.695 1039 2HG LYS 132 HG1 LYS 132 254.192 -0.432 -11.500 1040 1HD LYS 132 HD2 LYS 132 255.908 -1.354 -13.358 1041 2HD LYS 132 HD1 LYS 132 254.484 -2.318 -13.755 1042 1HE LYS 132 HE2 LYS 132 253.168 -0.392 -14.135 1043 2HE LYS 132 HE1 LYS 132 254.369 0.665 -13.393 1044 1HZ LYS 132 HZ1 LYS 132 254.138 0.349 -16.011 1045 2HZ LYS 132 HZ2 LYS 132 255.256 -0.879 -15.694 1046 3HZ LYS 132 HZ3 LYS 132 255.608 0.717 -15.259 1047 H PHE 133 HN PHE 133 255.550 -1.790 -7.584 1048 HA PHE 133 HA PHE 133 258.129 -3.109 -7.217 1049 1HB PHE 133 HB2 PHE 133 257.137 -0.770 -5.634 1050 2HB PHE 133 HB1 PHE 133 258.098 -2.006 -4.832 1051 HD1 PHE 133 HD1 PHE 133 258.147 0.244 -7.799 1052 HD2 PHE 133 HD2 PHE 133 260.395 -1.858 -4.859 1053 HE1 PHE 133 HE1 PHE 133 260.203 1.332 -8.599 1054 HE2 PHE 133 HE2 PHE 133 262.455 -0.773 -5.654 1055 HZ PHE 133 HZ PHE 133 262.361 0.825 -7.526 1056 H HIS 134 HN HIS 134 258.159 -4.243 -5.039 1057 HA HIS 134 HA HIS 134 255.537 -5.082 -4.079 1058 1HB HIS 134 HB2 HIS 134 256.015 -6.691 -5.852 1059 2HB HIS 134 HB1 HIS 134 257.613 -6.996 -5.180 1060 HD1 HIS 134 HD1 HIS 134 254.545 -8.611 -5.398 1061 HD2 HIS 134 HD2 HIS 134 257.121 -7.869 -2.224 1062 HE1 HIS 134 HE1 HIS 134 253.961 -10.317 -3.646 1063 HE2 HIS 134 HE2 HIS 134 255.618 -9.926 -1.788 1064 H GLY 135 HN GLY 135 255.597 -5.130 -1.896 1065 1HA GLY 135 HA2 GLY 135 258.245 -5.535 -0.657 1066 2HA GLY 135 HA1 GLY 135 257.120 -4.323 -0.076 1067 H TYR 136 HN TYR 136 258.422 -7.041 0.820 1068 HA TYR 136 HA TYR 136 255.970 -8.187 1.983 1069 1HB TYR 136 HB2 TYR 136 257.605 -9.599 0.505 1070 2HB TYR 136 HB1 TYR 136 258.616 -9.610 1.944 1071 HD1 TYR 136 HD1 TYR 136 256.582 -9.872 4.080 1072 HD2 TYR 136 HD2 TYR 136 256.859 -11.787 0.294 1073 HE1 TYR 136 HE1 TYR 136 255.307 -11.774 4.957 1074 HE2 TYR 136 HE2 TYR 136 255.585 -13.700 1.162 1075 HH TYR 136 HH TYR 136 255.257 -14.570 3.975 1076 H PHE 137 HN PHE 137 255.662 -7.694 4.062 1077 HA PHE 137 HA PHE 137 258.038 -7.103 5.705 1078 1HB PHE 137 HB2 PHE 137 255.312 -5.911 6.163 1079 2HB PHE 137 HB1 PHE 137 256.855 -5.390 6.829 1080 HD1 PHE 137 HD1 PHE 137 255.055 -5.756 3.593 1081 HD2 PHE 137 HD2 PHE 137 258.014 -3.668 5.825 1082 HE1 PHE 137 HE1 PHE 137 255.311 -4.152 1.744 1083 HE2 PHE 137 HE2 PHE 137 258.276 -2.063 3.983 1084 HZ PHE 137 HZ PHE 137 256.924 -2.300 1.939 1085 H LYS 138 HN LYS 138 258.210 -8.037 7.677 1086 HA LYS 138 HA LYS 138 256.283 -10.096 8.393 1087 1HB LYS 138 HB2 LYS 138 259.053 -9.901 8.598 1088 2HB LYS 138 HB1 LYS 138 258.493 -9.699 10.251 1089 1HG LYS 138 HG2 LYS 138 257.007 -11.826 9.402 1090 2HG LYS 138 HG1 LYS 138 258.534 -12.074 8.554 1091 1HD LYS 138 HD2 LYS 138 259.630 -12.597 10.442 1092 2HD LYS 138 HD1 LYS 138 258.850 -11.308 11.361 1093 1HE LYS 138 HE2 LYS 138 257.780 -12.970 12.415 1094 2HE LYS 138 HE1 LYS 138 256.783 -13.047 10.962 1095 1HZ LYS 138 HZ1 LYS 138 258.927 -14.835 11.845 1096 2HZ LYS 138 HZ2 LYS 138 258.720 -14.613 10.182 1097 3HZ LYS 138 HZ3 LYS 138 257.444 -15.205 11.121 1098 H PHE 139 HN PHE 139 254.859 -9.885 10.086 1099 HA PHE 139 HA PHE 139 254.912 -7.287 11.452 1100 1HB PHE 139 HB2 PHE 139 252.816 -8.943 10.344 1101 2HB PHE 139 HB1 PHE 139 252.483 -8.579 12.034 1102 HD1 PHE 139 HD1 PHE 139 252.655 -6.101 12.733 1103 HD2 PHE 139 HD2 PHE 139 252.284 -7.410 8.703 1104 HE1 PHE 139 HE1 PHE 139 251.835 -3.874 12.090 1105 HE2 PHE 139 HE2 PHE 139 251.460 -5.184 8.052 1106 HZ PHE 139 HZ PHE 139 251.236 -3.412 9.747 1107 H GLN 140 HN GLN 140 254.089 -7.232 13.685 1108 HA GLN 140 HA GLN 140 255.008 -9.562 15.239 1109 1HB GLN 140 HB2 GLN 140 256.594 -7.757 15.462 1110 2HB GLN 140 HB1 GLN 140 255.316 -6.613 15.807 1111 1HG GLN 140 HG2 GLN 140 256.689 -7.350 17.763 1112 2HG GLN 140 HG1 GLN 140 254.945 -7.514 17.947 1113 1HE2 GLN 140 HE21 GLN 140 257.945 -9.223 17.416 1114 2HE2 GLN 140 HE22 GLN 140 257.371 -10.783 17.887 1115 H GLY 141 HN GLY 141 252.280 -8.414 14.258 1116 1HA GLY 141 HA2 GLY 141 250.578 -9.436 16.070 1117 2HA GLY 141 HA1 GLY 141 250.933 -7.862 16.765 1118 H GLN 142 HN GLN 142 250.890 -6.095 14.820 1119 HA GLN 142 HA GLN 142 248.987 -6.440 12.785 1120 1HB GLN 142 HB2 GLN 142 247.925 -5.786 15.445 1121 2HB GLN 142 HB1 GLN 142 247.366 -4.722 14.162 1122 1HG GLN 142 HG2 GLN 142 247.036 -7.139 12.996 1123 2HG GLN 142 HG1 GLN 142 246.749 -7.541 14.687 1124 1HE2 GLN 142 HE21 GLN 142 244.732 -7.369 15.323 1125 2HE2 GLN 142 HE22 GLN 142 243.531 -6.326 14.647 1126 H ASP 143 HN ASP 143 250.507 -4.196 15.051 1127 HA ASP 143 HA ASP 143 250.651 -2.235 12.854 1128 1HB ASP 143 HB2 ASP 143 250.571 -1.537 15.791 1129 2HB ASP 143 HB1 ASP 143 250.451 -0.436 14.421 1130 H THR 144 HN THR 144 252.524 -4.386 14.289 1131 HA THR 144 HA THR 144 254.850 -2.578 14.389 1132 HB THR 144 HB THR 144 254.333 -5.104 15.952 1133 HG1 THR 144 HG1 THR 144 254.572 -3.720 17.705 1134 1HG2 THR 144 HG21 THR 144 256.880 -3.516 15.757 1135 2HG2 THR 144 HG22 THR 144 256.632 -5.190 15.260 1136 3HG2 THR 144 HG23 THR 144 256.546 -4.755 16.967 1137 H ILE 145 HN ILE 145 256.514 -2.987 13.057 1138 HA ILE 145 HA ILE 145 256.384 -5.485 11.523 1139 HB ILE 145 HB ILE 145 257.756 -2.932 10.686 1140 1HG1 ILE 145 HG12 ILE 145 255.178 -4.151 9.663 1141 2HG1 ILE 145 HG11 ILE 145 255.272 -2.754 10.730 1142 1HG2 ILE 145 HG21 ILE 145 258.798 -4.951 9.795 1143 2HG2 ILE 145 HG22 ILE 145 257.978 -4.056 8.515 1144 3HG2 ILE 145 HG23 ILE 145 257.236 -5.506 9.193 1145 1HD1 ILE 145 HD11 ILE 145 256.236 -2.953 7.893 1146 2HD1 ILE 145 HD12 ILE 145 256.579 -1.589 8.956 1147 3HD1 ILE 145 HD13 ILE 145 254.913 -1.968 8.520 1148 H LEU 146 HN LEU 146 258.189 -6.726 11.256 1149 HA LEU 146 HA LEU 146 260.516 -5.985 12.900 1150 1HB LEU 146 HB2 LEU 146 259.677 -8.826 12.437 1151 2HB LEU 146 HB1 LEU 146 260.703 -8.174 13.703 1152 HG LEU 146 HG LEU 146 257.772 -7.501 13.530 1153 1HD1 LEU 146 HD11 LEU 146 258.653 -10.058 13.876 1154 2HD1 LEU 146 HD12 LEU 146 257.138 -9.408 14.499 1155 3HD1 LEU 146 HD13 LEU 146 258.563 -9.472 15.537 1156 1HD2 LEU 146 HD21 LEU 146 258.445 -7.423 16.132 1157 2HD2 LEU 146 HD22 LEU 146 258.565 -6.034 15.052 1158 3HD2 LEU 146 HD23 LEU 146 259.996 -7.001 15.404 1159 H ASP 147 HN ASP 147 259.387 -6.869 9.822 1160 HA ASP 147 HA ASP 147 262.081 -6.876 8.790 1161 1HB ASP 147 HB2 ASP 147 260.833 -9.335 9.319 1162 2HB ASP 147 HB1 ASP 147 260.685 -9.108 7.579 1163 H TYR 148 HN TYR 148 262.181 -6.049 6.729 1164 HA TYR 148 HA TYR 148 259.683 -5.900 5.219 1165 1HB TYR 148 HB2 TYR 148 259.898 -3.549 4.779 1166 2HB TYR 148 HB1 TYR 148 259.882 -3.810 6.519 1167 HD1 TYR 148 HD1 TYR 148 261.745 -2.513 3.710 1168 HD2 TYR 148 HD2 TYR 148 262.036 -3.663 7.796 1169 HE1 TYR 148 HE1 TYR 148 263.844 -1.249 3.910 1170 HE2 TYR 148 HE2 TYR 148 264.136 -2.400 8.008 1171 HH TYR 148 HH TYR 148 265.292 -0.552 6.913 1172 H THR 149 HN THR 149 259.897 -6.123 3.062 1173 HA THR 149 HA THR 149 262.611 -5.971 1.934 1174 HB THR 149 HB THR 149 261.418 -7.877 0.381 1175 HG1 THR 149 HG1 THR 149 259.713 -7.912 2.054 1176 1HG2 THR 149 HG21 THR 149 262.986 -9.341 1.146 1177 2HG2 THR 149 HG22 THR 149 262.811 -8.828 2.825 1178 3HG2 THR 149 HG23 THR 149 263.688 -7.814 1.679 1179 H LEU 150 HN LEU 150 262.754 -5.181 -0.154 1180 HA LEU 150 HA LEU 150 260.251 -4.346 -1.436 1181 1HB LEU 150 HB2 LEU 150 262.663 -2.604 -0.946 1182 2HB LEU 150 HB1 LEU 150 261.357 -2.181 -2.037 1183 HG LEU 150 HG LEU 150 259.985 -2.719 0.267 1184 1HD1 LEU 150 HD11 LEU 150 261.818 -2.987 1.701 1185 2HD1 LEU 150 HD12 LEU 150 261.252 -1.342 1.987 1186 3HD1 LEU 150 HD13 LEU 150 262.682 -1.623 0.993 1187 1HD2 LEU 150 HD21 LEU 150 261.135 -0.056 -0.560 1188 2HD2 LEU 150 HD22 LEU 150 259.725 -0.313 0.467 1189 3HD2 LEU 150 HD23 LEU 150 259.681 -0.798 -1.229 1190 H ARG 151 HN ARG 151 260.150 -5.006 -3.467 1191 HA ARG 151 HA ARG 151 262.629 -5.222 -5.031 1192 1HB ARG 151 HB2 ARG 151 260.437 -7.295 -5.117 1193 2HB ARG 151 HB1 ARG 151 261.996 -7.356 -5.926 1194 1HG ARG 151 HG2 ARG 151 261.974 -7.141 -2.966 1195 2HG ARG 151 HG1 ARG 151 261.525 -8.684 -3.696 1196 1HD ARG 151 HD2 ARG 151 264.031 -7.217 -4.467 1197 2HD ARG 151 HD1 ARG 151 263.983 -8.340 -3.107 1198 HE ARG 151 HE ARG 151 262.923 -9.712 -5.244 1199 1HH1 ARG 151 HH11 ARG 151 265.953 -8.143 -4.510 1200 2HH1 ARG 151 HH12 ARG 151 266.888 -9.203 -5.509 1201 1HH2 ARG 151 HH21 ARG 151 264.152 -11.109 -6.558 1202 2HH2 ARG 151 HH22 ARG 151 265.866 -10.887 -6.672 1203 H GLU 152 HN GLU 152 262.475 -4.185 -6.918 1204 HA GLU 152 HA GLU 152 259.991 -3.027 -7.744 1205 1HB GLU 152 HB2 GLU 152 262.143 -1.877 -8.067 1206 2HB GLU 152 HB1 GLU 152 262.648 -3.139 -9.181 1207 1HG GLU 152 HG2 GLU 152 260.198 -2.243 -10.159 1208 2HG GLU 152 HG1 GLU 152 261.061 -0.789 -9.661 1209 H VAL 153 HN VAL 153 258.710 -3.535 -9.485 1210 HA VAL 153 HA VAL 153 259.361 -6.026 -10.921 1211 HB VAL 153 HB VAL 153 256.853 -6.417 -11.010 1212 1HG1 VAL 153 HG11 VAL 153 258.625 -7.496 -9.447 1213 2HG1 VAL 153 HG12 VAL 153 256.911 -7.741 -9.115 1214 3HG1 VAL 153 HG13 VAL 153 257.828 -6.555 -8.187 1215 1HG2 VAL 153 HG21 VAL 153 255.416 -5.054 -9.984 1216 2HG2 VAL 153 HG22 VAL 153 256.754 -3.917 -9.826 1217 3HG2 VAL 153 HG23 VAL 153 256.379 -5.026 -8.508 1218 H ASP 154 HN ASP 154 258.020 -6.262 -12.956 1219 HA ASP 154 HA ASP 154 256.818 -4.066 -14.218 1220 1HB ASP 154 HB2 ASP 154 259.341 -3.394 -14.043 1221 2HB ASP 154 HB1 ASP 154 259.545 -4.518 -15.383 1222 H THR 155 HN THR 155 259.089 -6.687 -15.059 1223 HA THR 155 HA THR 155 257.817 -7.401 -17.462 1224 HB THR 155 HB THR 155 259.452 -9.197 -15.661 1225 HG1 THR 155 HG1 THR 155 260.306 -7.423 -17.701 1226 1HG2 THR 155 HG21 THR 155 258.335 -9.564 -18.293 1227 2HG2 THR 155 HG22 THR 155 259.147 -10.719 -17.237 1228 3HG2 THR 155 HG23 THR 155 260.094 -9.685 -18.309 1229 H VAL 156 HN VAL 156 256.041 -8.544 -17.886 1230 HA VAL 156 HA VAL 156 254.682 -9.864 -15.637 1231 HB VAL 156 HB VAL 156 253.458 -9.044 -18.272 1232 1HG1 VAL 156 HG11 VAL 156 252.342 -10.034 -15.662 1233 2HG1 VAL 156 HG12 VAL 156 252.129 -10.713 -17.276 1234 3HG1 VAL 156 HG13 VAL 156 251.353 -9.187 -16.852 1235 1HG2 VAL 156 HG21 VAL 156 253.878 -6.961 -17.464 1236 2HG2 VAL 156 HG22 VAL 156 253.966 -7.507 -15.789 1237 3HG2 VAL 156 HG23 VAL 156 252.397 -7.293 -16.566 Start of MODEL 7 1 1H MET 1 HT1 MET 1 239.852 -18.488 0.754 2 2H MET 1 HT2 MET 1 239.766 -18.078 -0.910 3 3H MET 1 HT3 MET 1 241.273 -18.494 -0.203 4 HA MET 1 HA MET 1 238.959 -20.224 -0.725 5 1HB MET 1 HB2 MET 1 240.830 -19.549 -2.434 6 2HB MET 1 HB1 MET 1 241.814 -20.683 -1.518 7 1HG MET 1 HG2 MET 1 240.142 -22.438 -1.951 8 2HG MET 1 HG1 MET 1 239.230 -21.294 -2.934 9 1HE MET 1 HE1 MET 1 239.003 -22.114 -4.888 10 2HE MET 1 HE2 MET 1 240.174 -22.800 -6.015 11 3HE MET 1 HE3 MET 1 240.027 -21.050 -5.852 12 H GLY 2 HN GLY 2 242.254 -20.167 0.652 13 1HA GLY 2 HA2 GLY 2 241.344 -22.061 2.703 14 2HA GLY 2 HA1 GLY 2 242.742 -22.489 1.730 15 H ALA 3 HN ALA 3 244.275 -20.362 1.581 16 HA ALA 3 HA ALA 3 244.577 -19.265 4.285 17 1HB ALA 3 HB1 ALA 3 246.807 -19.920 4.520 18 2HB ALA 3 HB2 ALA 3 246.965 -20.328 2.811 19 3HB ALA 3 HB3 ALA 3 246.008 -21.355 3.878 20 H SER 4 HN SER 4 246.911 -17.896 3.974 21 HA SER 4 HA SER 4 247.703 -15.891 3.246 22 1HB SER 4 HB2 SER 4 248.163 -15.684 0.938 23 2HB SER 4 HB1 SER 4 248.184 -17.418 1.258 24 HG SER 4 HG SER 4 246.450 -15.921 -0.274 25 H ARG 5 HN ARG 5 246.296 -14.591 4.325 26 HA ARG 5 HA ARG 5 243.723 -13.904 3.387 27 1HB ARG 5 HB2 ARG 5 245.609 -12.524 5.300 28 2HB ARG 5 HB1 ARG 5 243.980 -11.948 4.972 29 1HG ARG 5 HG2 ARG 5 244.185 -14.781 5.733 30 2HG ARG 5 HG1 ARG 5 244.622 -13.618 6.985 31 1HD ARG 5 HD2 ARG 5 242.425 -13.530 7.408 32 2HD ARG 5 HD1 ARG 5 242.337 -12.524 5.963 33 HE ARG 5 HE ARG 5 241.298 -14.246 4.862 34 1HH1 ARG 5 HH11 ARG 5 242.694 -15.462 7.820 35 2HH1 ARG 5 HH12 ARG 5 241.926 -17.009 7.694 36 1HH2 ARG 5 HH21 ARG 5 240.286 -16.280 4.695 37 2HH2 ARG 5 HH22 ARG 5 240.559 -17.474 5.920 38 H LEU 6 HN LEU 6 243.725 -13.251 1.288 39 HA LEU 6 HA LEU 6 245.558 -11.190 0.400 40 1HB LEU 6 HB2 LEU 6 244.583 -13.227 -0.950 41 2HB LEU 6 HB1 LEU 6 243.250 -12.129 -1.249 42 HG LEU 6 HG LEU 6 246.052 -11.248 -1.836 43 1HD1 LEU 6 HD11 LEU 6 244.390 -13.173 -3.407 44 2HD1 LEU 6 HD12 LEU 6 246.118 -13.213 -3.054 45 3HD1 LEU 6 HD13 LEU 6 245.484 -12.057 -4.226 46 1HD2 LEU 6 HD21 LEU 6 243.649 -10.626 -3.482 47 2HD2 LEU 6 HD22 LEU 6 245.074 -9.643 -3.148 48 3HD2 LEU 6 HD23 LEU 6 243.828 -9.837 -1.916 49 H TYR 7 HN TYR 7 245.194 -9.136 0.649 50 HA TYR 7 HA TYR 7 242.424 -8.150 0.754 51 1HB TYR 7 HB2 TYR 7 244.802 -7.482 2.450 52 2HB TYR 7 HB1 TYR 7 243.555 -6.268 2.185 53 HD1 TYR 7 HD1 TYR 7 243.609 -9.933 2.958 54 HD2 TYR 7 HD2 TYR 7 242.069 -6.088 3.929 55 HE1 TYR 7 HE1 TYR 7 242.264 -10.932 4.758 56 HE2 TYR 7 HE2 TYR 7 240.721 -7.076 5.732 57 HH TYR 7 HH TYR 7 239.763 -9.772 6.049 58 H THR 8 HN THR 8 242.614 -5.568 0.546 59 HA THR 8 HA THR 8 244.289 -5.022 -1.822 60 HB THR 8 HB THR 8 242.480 -3.857 -2.846 61 HG1 THR 8 HG1 THR 8 240.382 -4.151 -1.403 62 1HG2 THR 8 HG21 THR 8 240.952 -5.538 -3.324 63 2HG2 THR 8 HG22 THR 8 241.062 -6.228 -1.706 64 3HG2 THR 8 HG23 THR 8 242.399 -6.419 -2.839 65 H LEU 9 HN LEU 9 244.415 -2.628 -2.277 66 HA LEU 9 HA LEU 9 244.145 -0.866 -0.002 67 1HB LEU 9 HB2 LEU 9 246.341 -2.151 0.250 68 2HB LEU 9 HB1 LEU 9 246.889 -1.287 -1.172 69 HG LEU 9 HG LEU 9 246.078 -0.041 1.445 70 1HD1 LEU 9 HD11 LEU 9 248.229 -1.241 1.493 71 2HD1 LEU 9 HD12 LEU 9 248.413 0.500 1.701 72 3HD1 LEU 9 HD13 LEU 9 248.785 -0.247 0.147 73 1HD2 LEU 9 HD21 LEU 9 247.183 1.989 0.296 74 2HD2 LEU 9 HD22 LEU 9 245.517 1.577 -0.108 75 3HD2 LEU 9 HD23 LEU 9 246.827 1.125 -1.199 76 H VAL 10 HN VAL 10 243.130 0.776 -1.049 77 HA VAL 10 HA VAL 10 244.236 1.624 -3.631 78 HB VAL 10 HB VAL 10 242.004 1.000 -3.978 79 1HG1 VAL 10 HG11 VAL 10 241.596 2.053 -1.305 80 2HG1 VAL 10 HG12 VAL 10 240.832 0.697 -2.133 81 3HG1 VAL 10 HG13 VAL 10 240.275 2.339 -2.433 82 1HG2 VAL 10 HG21 VAL 10 241.847 3.969 -3.548 83 2HG2 VAL 10 HG22 VAL 10 240.916 3.004 -4.692 84 3HG2 VAL 10 HG23 VAL 10 242.650 3.216 -4.925 85 H LEU 11 HN LEU 11 245.232 3.438 -3.757 86 HA LEU 11 HA LEU 11 244.657 5.572 -1.819 87 1HB LEU 11 HB2 LEU 11 247.091 4.121 -2.279 88 2HB LEU 11 HB1 LEU 11 247.330 5.797 -2.732 89 HG LEU 11 HG LEU 11 246.619 4.683 -0.022 90 1HD1 LEU 11 HD11 LEU 11 248.640 6.778 -0.220 91 2HD1 LEU 11 HD12 LEU 11 249.039 5.331 -1.148 92 3HD1 LEU 11 HD13 LEU 11 248.704 5.206 0.578 93 1HD2 LEU 11 HD21 LEU 11 246.625 7.224 0.581 94 2HD2 LEU 11 HD22 LEU 11 245.153 6.445 0.002 95 3HD2 LEU 11 HD23 LEU 11 246.130 7.416 -1.101 96 H VAL 12 HN VAL 12 243.740 7.174 -2.927 97 HA VAL 12 HA VAL 12 244.168 7.452 -5.757 98 HB VAL 12 HB VAL 12 242.636 9.312 -3.941 99 1HG1 VAL 12 HG11 VAL 12 241.883 8.793 -6.760 100 2HG1 VAL 12 HG12 VAL 12 243.320 9.775 -6.475 101 3HG1 VAL 12 HG13 VAL 12 241.764 10.273 -5.810 102 1HG2 VAL 12 HG21 VAL 12 240.755 7.771 -5.141 103 2HG2 VAL 12 HG22 VAL 12 241.391 7.481 -3.522 104 3HG2 VAL 12 HG23 VAL 12 242.046 6.595 -4.898 105 H LEU 13 HN LEU 13 246.022 8.255 -6.408 106 HA LEU 13 HA LEU 13 246.914 10.838 -5.329 107 1HB LEU 13 HB2 LEU 13 248.216 8.894 -4.414 108 2HB LEU 13 HB1 LEU 13 248.777 8.600 -6.047 109 HG LEU 13 HG LEU 13 250.446 9.999 -5.704 110 1HD1 LEU 13 HD11 LEU 13 249.318 11.760 -6.719 111 2HD1 LEU 13 HD12 LEU 13 249.989 12.446 -5.243 112 3HD1 LEU 13 HD13 LEU 13 248.283 12.025 -5.319 113 1HD2 LEU 13 HD21 LEU 13 249.200 9.989 -3.075 114 2HD2 LEU 13 HD22 LEU 13 250.207 11.402 -3.382 115 3HD2 LEU 13 HD23 LEU 13 250.890 9.783 -3.529 116 H GLN 14 HN GLN 14 246.927 12.275 -6.910 117 HA GLN 14 HA GLN 14 247.414 11.363 -9.661 118 1HB GLN 14 HB2 GLN 14 246.570 13.918 -9.990 119 2HB GLN 14 HB1 GLN 14 245.501 12.526 -9.999 120 1HG GLN 14 HG2 GLN 14 245.219 12.924 -7.503 121 2HG GLN 14 HG1 GLN 14 245.994 14.483 -7.782 122 1HE2 GLN 14 HE21 GLN 14 244.919 15.083 -10.275 123 2HE2 GLN 14 HE22 GLN 14 243.226 15.371 -10.095 124 HA PRO 15 HA PRO 15 251.317 13.361 -9.900 125 1HB PRO 15 HB2 PRO 15 251.185 14.675 -12.308 126 2HB PRO 15 HB1 PRO 15 251.488 12.944 -12.130 127 1HG PRO 15 HG2 PRO 15 248.932 14.366 -12.754 128 2HG PRO 15 HG1 PRO 15 249.587 12.874 -13.457 129 1HD PRO 15 HD2 PRO 15 247.647 12.821 -11.603 130 2HD PRO 15 HD1 PRO 15 248.921 11.583 -11.650 131 H GLN 16 HN GLN 16 249.117 14.932 -8.594 132 HA GLN 16 HA GLN 16 250.511 17.420 -8.473 133 1HB GLN 16 HB2 GLN 16 248.530 18.819 -9.048 134 2HB GLN 16 HB1 GLN 16 249.186 17.930 -10.416 135 1HG GLN 16 HG2 GLN 16 247.410 16.193 -9.979 136 2HG GLN 16 HG1 GLN 16 246.688 17.346 -8.857 137 1HE2 GLN 16 HE21 GLN 16 245.653 19.145 -9.642 138 2HE2 GLN 16 HE22 GLN 16 245.283 19.365 -11.315 139 H ARG 17 HN ARG 17 247.616 15.579 -7.613 140 HA ARG 17 HA ARG 17 247.899 16.569 -4.869 141 1HB ARG 17 HB2 ARG 17 245.170 16.236 -6.083 142 2HB ARG 17 HB1 ARG 17 245.619 17.094 -4.620 143 1HG ARG 17 HG2 ARG 17 246.838 18.178 -7.045 144 2HG ARG 17 HG1 ARG 17 245.078 18.244 -7.027 145 1HD ARG 17 HD2 ARG 17 245.018 19.753 -5.346 146 2HD ARG 17 HD1 ARG 17 246.423 19.063 -4.535 147 HE ARG 17 HE ARG 17 247.764 20.536 -5.669 148 1HH1 ARG 17 HH11 ARG 17 244.607 20.496 -7.156 149 2HH1 ARG 17 HH12 ARG 17 244.939 21.848 -8.187 150 1HH2 ARG 17 HH21 ARG 17 248.201 22.313 -7.024 151 2HH2 ARG 17 HH22 ARG 17 246.979 22.879 -8.113 152 H VAL 18 HN VAL 18 246.731 15.226 -3.268 153 HA VAL 18 HA VAL 18 246.187 12.484 -4.164 154 HB VAL 18 HB VAL 18 248.448 12.313 -3.431 155 1HG1 VAL 18 HG11 VAL 18 249.403 13.415 -1.697 156 2HG1 VAL 18 HG12 VAL 18 247.962 13.298 -0.687 157 3HG1 VAL 18 HG13 VAL 18 248.051 14.514 -1.961 158 1HG2 VAL 18 HG21 VAL 18 248.271 10.793 -1.528 159 2HG2 VAL 18 HG22 VAL 18 246.973 10.514 -2.690 160 3HG2 VAL 18 HG23 VAL 18 246.646 11.391 -1.195 161 H LEU 19 HN LEU 19 244.872 11.268 -2.702 162 HA LEU 19 HA LEU 19 243.452 12.930 -0.727 163 1HB LEU 19 HB2 LEU 19 242.103 12.466 -2.750 164 2HB LEU 19 HB1 LEU 19 242.276 10.748 -2.447 165 HG LEU 19 HG LEU 19 240.978 10.899 -0.430 166 1HD1 LEU 19 HD11 LEU 19 239.890 13.256 -0.030 167 2HD1 LEU 19 HD12 LEU 19 241.362 13.826 -0.817 168 3HD1 LEU 19 HD13 LEU 19 241.467 12.856 0.652 169 1HD2 LEU 19 HD21 LEU 19 239.852 10.858 -2.702 170 2HD2 LEU 19 HD22 LEU 19 239.532 12.575 -2.460 171 3HD2 LEU 19 HD23 LEU 19 238.864 11.387 -1.341 172 H LEU 20 HN LEU 20 243.360 12.165 1.280 173 HA LEU 20 HA LEU 20 244.037 9.330 1.719 174 1HB LEU 20 HB2 LEU 20 245.246 11.751 2.764 175 2HB LEU 20 HB1 LEU 20 244.693 10.703 4.056 176 HG LEU 20 HG LEU 20 246.468 9.736 1.823 177 1HD1 LEU 20 HD11 LEU 20 247.475 10.387 4.558 178 2HD1 LEU 20 HD12 LEU 20 247.370 11.649 3.330 179 3HD1 LEU 20 HD13 LEU 20 248.365 10.222 3.043 180 1HD2 LEU 20 HD21 LEU 20 246.468 7.750 2.857 181 2HD2 LEU 20 HD22 LEU 20 245.001 8.330 3.647 182 3HD2 LEU 20 HD23 LEU 20 246.558 8.475 4.461 183 H GLY 21 HN GLY 21 242.866 8.201 3.230 184 1HA GLY 21 HA2 GLY 21 240.374 9.481 4.085 185 2HA GLY 21 HA1 GLY 21 240.693 7.752 4.052 186 H MET 22 HN MET 22 240.126 10.217 6.088 187 HA MET 22 HA MET 22 241.875 9.121 8.185 188 1HB MET 22 HB2 MET 22 242.388 11.427 7.883 189 2HB MET 22 HB1 MET 22 240.687 11.871 7.840 190 1HG MET 22 HG2 MET 22 240.430 11.534 10.152 191 2HG MET 22 HG1 MET 22 241.963 10.674 10.277 192 1HE MET 22 HE1 MET 22 244.532 13.496 9.597 193 2HE MET 22 HE2 MET 22 244.003 11.936 8.971 194 3HE MET 22 HE3 MET 22 244.417 12.108 10.677 195 H LYS 23 HN LYS 23 240.987 8.488 10.142 196 HA LYS 23 HA LYS 23 238.123 8.004 10.099 197 1HB LYS 23 HB2 LYS 23 240.438 6.785 11.339 198 2HB LYS 23 HB1 LYS 23 239.186 7.092 12.534 199 1HG LYS 23 HG2 LYS 23 237.584 5.929 10.962 200 2HG LYS 23 HG1 LYS 23 239.003 5.422 10.046 201 1HD LYS 23 HD2 LYS 23 238.949 3.636 11.416 202 2HD LYS 23 HD1 LYS 23 239.744 4.723 12.556 203 1HE LYS 23 HE2 LYS 23 237.985 4.712 13.925 204 2HE LYS 23 HE1 LYS 23 236.865 5.037 12.602 205 1HZ LYS 23 HZ1 LYS 23 236.663 2.755 12.141 206 2HZ LYS 23 HZ2 LYS 23 236.550 2.876 13.824 207 3HZ LYS 23 HZ3 LYS 23 237.987 2.343 13.110 208 H LYS 24 HN LYS 24 236.684 8.778 11.680 209 HA LYS 24 HA LYS 24 237.567 11.267 12.897 210 1HB LYS 24 HB2 LYS 24 234.901 10.067 12.264 211 2HB LYS 24 HB1 LYS 24 235.001 11.311 13.502 212 1HG LYS 24 HG2 LYS 24 235.203 12.933 11.996 213 2HG LYS 24 HG1 LYS 24 236.432 12.050 11.089 214 1HD LYS 24 HD2 LYS 24 234.877 11.014 9.733 215 2HD LYS 24 HD1 LYS 24 233.576 11.193 10.913 216 1HE LYS 24 HE2 LYS 24 234.717 13.704 9.877 217 2HE LYS 24 HE1 LYS 24 233.841 12.723 8.702 218 1HZ LYS 24 HZ1 LYS 24 232.649 14.478 10.266 219 2HZ LYS 24 HZ2 LYS 24 232.561 13.132 11.287 220 3HZ LYS 24 HZ3 LYS 24 231.879 13.065 9.741 221 H ARG 25 HN ARG 25 236.463 8.078 13.786 222 HA ARG 25 HA ARG 25 237.577 8.336 16.385 223 1HB ARG 25 HB2 ARG 25 235.387 7.807 17.582 224 2HB ARG 25 HB1 ARG 25 235.622 9.465 17.048 225 1HG ARG 25 HG2 ARG 25 234.121 7.476 15.383 226 2HG ARG 25 HG1 ARG 25 233.339 8.402 16.667 227 1HD ARG 25 HD2 ARG 25 234.643 10.373 15.366 228 2HD ARG 25 HD1 ARG 25 234.328 9.265 14.030 229 HE ARG 25 HE ARG 25 232.135 9.880 14.116 230 1HH1 ARG 25 HH11 ARG 25 233.606 10.646 17.188 231 2HH1 ARG 25 HH12 ARG 25 232.195 11.432 17.809 232 1HH2 ARG 25 HH21 ARG 25 230.278 10.914 14.933 233 2HH2 ARG 25 HH22 ARG 25 230.304 11.584 16.529 234 H GLY 26 HN GLY 26 237.525 6.341 17.592 235 1HA GLY 26 HA2 GLY 26 236.898 4.012 17.739 236 2HA GLY 26 HA1 GLY 26 236.695 4.008 15.994 237 H PHE 27 HN PHE 27 238.178 2.731 15.114 238 HA PHE 27 HA PHE 27 240.861 2.649 16.289 239 1HB PHE 27 HB2 PHE 27 239.181 0.737 14.799 240 2HB PHE 27 HB1 PHE 27 240.889 0.721 14.368 241 HD1 PHE 27 HD1 PHE 27 241.752 -1.211 15.296 242 HD2 PHE 27 HD2 PHE 27 239.257 1.297 17.661 243 HE1 PHE 27 HE1 PHE 27 242.236 -2.597 17.271 244 HE2 PHE 27 HE2 PHE 27 239.737 -0.083 19.640 245 HZ PHE 27 HZ PHE 27 241.229 -2.034 19.447 246 H GLY 28 HN GLY 28 241.431 4.744 15.383 247 1HA GLY 28 HA2 GLY 28 243.186 5.023 13.528 248 2HA GLY 28 HA1 GLY 28 241.829 4.698 12.464 249 H ALA 29 HN ALA 29 240.603 6.415 15.025 250 HA ALA 29 HA ALA 29 239.847 8.648 13.649 251 1HB ALA 29 HB1 ALA 29 239.047 9.425 15.590 252 2HB ALA 29 HB2 ALA 29 240.562 9.160 16.452 253 3HB ALA 29 HB3 ALA 29 239.466 7.809 16.156 254 H GLY 30 HN GLY 30 240.651 10.702 13.265 255 1HA GLY 30 HA2 GLY 30 242.259 12.273 12.797 256 2HA GLY 30 HA1 GLY 30 242.924 11.859 14.370 257 H ARG 31 HN ARG 31 242.708 9.372 11.979 258 HA ARG 31 HA ARG 31 245.568 9.685 11.362 259 1HB ARG 31 HB2 ARG 31 244.697 7.781 13.058 260 2HB ARG 31 HB1 ARG 31 244.484 6.930 11.534 261 1HG ARG 31 HG2 ARG 31 246.789 7.106 11.011 262 2HG ARG 31 HG1 ARG 31 247.066 8.242 12.333 263 1HD ARG 31 HD2 ARG 31 246.401 5.312 12.521 264 2HD ARG 31 HD1 ARG 31 247.882 6.118 13.035 265 HE ARG 31 HE ARG 31 245.978 7.324 14.526 266 1HH1 ARG 31 HH11 ARG 31 246.799 3.980 13.963 267 2HH1 ARG 31 HH12 ARG 31 246.265 3.455 15.524 268 1HH2 ARG 31 HH21 ARG 31 245.275 6.637 16.581 269 2HH2 ARG 31 HH22 ARG 31 245.399 4.963 17.011 270 H TRP 32 HN TRP 32 246.126 9.383 9.267 271 HA TRP 32 HA TRP 32 243.949 8.938 7.379 272 1HB TRP 32 HB2 TRP 32 246.581 9.428 6.202 273 2HB TRP 32 HB1 TRP 32 245.053 10.247 5.922 274 HD1 TRP 32 HD1 TRP 32 247.858 10.266 8.616 275 HE1 TRP 32 HE1 TRP 32 248.125 12.683 9.451 276 HE3 TRP 32 HE3 TRP 32 244.126 12.480 5.914 277 HZ2 TRP 32 HZ2 TRP 32 246.928 15.199 9.015 278 HZ3 TRP 32 HZ3 TRP 32 243.758 14.899 6.178 279 HH2 TRP 32 HH2 TRP 32 245.129 16.228 7.698 280 H ASN 33 HN ASN 33 244.140 7.435 5.611 281 HA ASN 33 HA ASN 33 246.231 5.592 5.329 282 1HB ASN 33 HB2 ASN 33 244.987 5.032 7.649 283 2HB ASN 33 HB1 ASN 33 243.973 4.103 6.550 284 1HD2 ASN 33 HD21 ASN 33 244.882 2.348 7.906 285 2HD2 ASN 33 HD22 ASN 33 246.374 1.637 7.404 286 H GLY 34 HN GLY 34 245.934 4.216 3.600 287 1HA GLY 34 HA2 GLY 34 244.085 4.952 1.645 288 2HA GLY 34 HA1 GLY 34 245.004 3.454 1.646 289 H PHE 35 HN PHE 35 242.734 3.048 0.547 290 HA PHE 35 HA PHE 35 240.883 2.113 2.639 291 1HB PHE 35 HB2 PHE 35 240.022 2.269 -0.210 292 2HB PHE 35 HB1 PHE 35 239.092 2.531 1.253 293 HD1 PHE 35 HD1 PHE 35 239.565 4.675 2.578 294 HD2 PHE 35 HD2 PHE 35 240.817 4.072 -1.443 295 HE1 PHE 35 HE1 PHE 35 239.795 7.107 2.290 296 HE2 PHE 35 HE2 PHE 35 241.049 6.503 -1.739 297 HZ PHE 35 HZ PHE 35 240.539 8.023 0.129 298 H GLY 36 HN GLY 36 241.889 0.150 3.049 299 1HA GLY 36 HA2 GLY 36 242.234 -1.680 0.786 300 2HA GLY 36 HA1 GLY 36 242.891 -1.904 2.400 301 H GLY 37 HN GLY 37 241.314 -3.714 0.683 302 1HA GLY 37 HA2 GLY 37 239.200 -4.298 2.650 303 2HA GLY 37 HA1 GLY 37 238.833 -4.320 0.932 304 H LYS 38 HN LYS 38 238.176 -6.548 1.335 305 HA LYS 38 HA LYS 38 240.492 -8.358 1.204 306 1HB LYS 38 HB2 LYS 38 239.312 -10.010 2.538 307 2HB LYS 38 HB1 LYS 38 239.463 -8.508 3.439 308 1HG LYS 38 HG2 LYS 38 237.096 -8.003 2.528 309 2HG LYS 38 HG1 LYS 38 237.032 -9.738 2.212 310 1HD LYS 38 HD2 LYS 38 237.977 -9.699 4.759 311 2HD LYS 38 HD1 LYS 38 236.939 -8.272 4.758 312 1HE LYS 38 HE2 LYS 38 235.109 -9.685 3.834 313 2HE LYS 38 HE1 LYS 38 236.155 -11.091 4.030 314 1HZ LYS 38 HZ1 LYS 38 236.286 -10.102 6.469 315 2HZ LYS 38 HZ2 LYS 38 235.073 -11.183 5.997 316 3HZ LYS 38 HZ3 LYS 38 234.753 -9.522 6.047 317 H VAL 39 HN VAL 39 240.377 -9.975 -0.290 318 HA VAL 39 HA VAL 39 238.405 -9.710 -2.356 319 HB VAL 39 HB VAL 39 240.328 -12.016 -2.179 320 1HG1 VAL 39 HG11 VAL 39 239.305 -10.389 -4.502 321 2HG1 VAL 39 HG12 VAL 39 238.688 -11.965 -4.008 322 3HG1 VAL 39 HG13 VAL 39 240.342 -11.810 -4.600 323 1HG2 VAL 39 HG21 VAL 39 240.962 -9.156 -2.438 324 2HG2 VAL 39 HG22 VAL 39 241.719 -10.220 -3.623 325 3HG2 VAL 39 HG23 VAL 39 241.967 -10.501 -1.900 326 H GLN 40 HN GLN 40 236.406 -10.423 -1.995 327 HA GLN 40 HA GLN 40 235.519 -12.255 -0.161 328 1HB GLN 40 HB2 GLN 40 234.312 -10.707 -2.018 329 2HB GLN 40 HB1 GLN 40 234.086 -12.289 -2.750 330 1HG GLN 40 HG2 GLN 40 233.369 -12.740 -0.149 331 2HG GLN 40 HG1 GLN 40 232.801 -11.094 -0.424 332 1HE2 GLN 40 HE21 GLN 40 231.644 -13.995 -0.279 333 2HE2 GLN 40 HE22 GLN 40 230.493 -13.997 -1.568 334 H GLU 41 HN GLU 41 234.286 -14.360 -0.869 335 HA GLU 41 HA GLU 41 236.285 -16.246 -1.572 336 1HB GLU 41 HB2 GLU 41 233.295 -16.612 -1.319 337 2HB GLU 41 HB1 GLU 41 234.479 -17.910 -1.393 338 1HG GLU 41 HG2 GLU 41 235.508 -16.964 0.685 339 2HG GLU 41 HG1 GLU 41 234.128 -15.871 0.787 340 H GLY 42 HN GLY 42 236.666 -14.963 -3.694 341 1HA GLY 42 HA2 GLY 42 236.755 -16.069 -5.923 342 2HA GLY 42 HA1 GLY 42 235.007 -16.197 -5.805 343 H GLU 43 HN GLU 43 237.135 -13.428 -5.062 344 HA GLU 43 HA GLU 43 235.868 -11.997 -7.277 345 1HB GLU 43 HB2 GLU 43 235.274 -10.193 -6.017 346 2HB GLU 43 HB1 GLU 43 235.151 -11.419 -4.768 347 1HG GLU 43 HG2 GLU 43 237.193 -10.768 -3.792 348 2HG GLU 43 HG1 GLU 43 237.640 -9.794 -5.192 349 H THR 44 HN THR 44 237.207 -9.907 -7.683 350 HA THR 44 HA THR 44 239.983 -10.810 -7.852 351 HB THR 44 HB THR 44 240.179 -9.190 -9.673 352 HG1 THR 44 HG1 THR 44 238.703 -7.733 -10.016 353 1HG2 THR 44 HG21 THR 44 238.359 -10.166 -11.173 354 2HG2 THR 44 HG22 THR 44 237.893 -11.120 -9.764 355 3HG2 THR 44 HG23 THR 44 239.509 -11.290 -10.448 356 H ILE 45 HN ILE 45 241.678 -9.611 -7.108 357 HA ILE 45 HA ILE 45 241.353 -8.065 -4.860 358 HB ILE 45 HB ILE 45 243.663 -7.657 -6.745 359 1HG1 ILE 45 HG12 ILE 45 244.519 -9.562 -5.006 360 2HG1 ILE 45 HG11 ILE 45 242.847 -10.056 -5.249 361 1HG2 ILE 45 HG21 ILE 45 244.871 -6.990 -4.883 362 2HG2 ILE 45 HG22 ILE 45 243.735 -7.737 -3.761 363 3HG2 ILE 45 HG23 ILE 45 243.283 -6.267 -4.626 364 1HD1 ILE 45 HD11 ILE 45 244.082 -9.419 -7.761 365 2HD1 ILE 45 HD12 ILE 45 243.343 -10.926 -7.220 366 3HD1 ILE 45 HD13 ILE 45 245.042 -10.605 -6.876 367 H GLU 46 HN GLU 46 241.253 -7.084 -8.215 368 HA GLU 46 HA GLU 46 241.366 -4.257 -7.688 369 1HB GLU 46 HB2 GLU 46 241.921 -5.544 -9.893 370 2HB GLU 46 HB1 GLU 46 240.188 -5.462 -10.175 371 1HG GLU 46 HG2 GLU 46 240.228 -3.077 -10.168 372 2HG GLU 46 HG1 GLU 46 241.909 -3.056 -9.639 373 H ASP 47 HN ASP 47 238.951 -6.732 -7.804 374 HA ASP 47 HA ASP 47 236.726 -4.897 -7.946 375 1HB ASP 47 HB2 ASP 47 237.034 -7.869 -7.703 376 2HB ASP 47 HB1 ASP 47 235.501 -7.135 -7.246 377 H GLY 48 HN GLY 48 238.531 -6.707 -5.553 378 1HA GLY 48 HA2 GLY 48 236.762 -6.144 -3.365 379 2HA GLY 48 HA1 GLY 48 238.413 -6.744 -3.243 380 H ALA 49 HN ALA 49 239.640 -4.631 -4.702 381 HA ALA 49 HA ALA 49 239.910 -2.689 -2.607 382 1HB ALA 49 HB1 ALA 49 241.572 -3.602 -4.567 383 2HB ALA 49 HB2 ALA 49 241.840 -2.141 -3.620 384 3HB ALA 49 HB3 ALA 49 241.088 -2.035 -5.212 385 H ARG 50 HN ARG 50 238.360 -2.899 -5.731 386 HA ARG 50 HA ARG 50 237.689 -0.130 -5.895 387 1HB ARG 50 HB2 ARG 50 237.871 -1.319 -7.947 388 2HB ARG 50 HB1 ARG 50 236.784 -2.583 -7.394 389 1HG ARG 50 HG2 ARG 50 234.924 -1.392 -7.882 390 2HG ARG 50 HG1 ARG 50 235.687 0.160 -7.525 391 1HD ARG 50 HD2 ARG 50 236.996 -0.066 -9.624 392 2HD ARG 50 HD1 ARG 50 236.089 -1.534 -9.988 393 HE ARG 50 HE ARG 50 234.431 0.765 -9.501 394 1HH1 ARG 50 HH11 ARG 50 236.240 -1.003 -11.905 395 2HH1 ARG 50 HH12 ARG 50 235.314 -0.391 -13.234 396 1HH2 ARG 50 HH21 ARG 50 233.210 1.571 -11.247 397 2HH2 ARG 50 HH22 ARG 50 233.594 1.071 -12.860 398 H ARG 51 HN ARG 51 235.760 -3.068 -5.308 399 HA ARG 51 HA ARG 51 233.350 -1.775 -4.720 400 1HB ARG 51 HB2 ARG 51 233.800 -4.267 -5.161 401 2HB ARG 51 HB1 ARG 51 234.184 -4.372 -3.448 402 1HG ARG 51 HG2 ARG 51 231.587 -3.204 -4.362 403 2HG ARG 51 HG1 ARG 51 231.803 -4.951 -4.227 404 1HD ARG 51 HD2 ARG 51 232.794 -4.153 -1.849 405 2HD ARG 51 HD1 ARG 51 231.593 -2.891 -2.127 406 HE ARG 51 HE ARG 51 231.094 -5.623 -1.458 407 1HH1 ARG 51 HH11 ARG 51 229.800 -2.862 -3.155 408 2HH1 ARG 51 HH12 ARG 51 228.155 -3.383 -3.005 409 1HH2 ARG 51 HH21 ARG 51 228.932 -6.311 -1.260 410 2HH2 ARG 51 HH22 ARG 51 227.662 -5.341 -1.930 411 H GLU 52 HN GLU 52 236.109 -2.517 -2.693 412 HA GLU 52 HA GLU 52 234.753 -1.708 -0.267 413 1HB GLU 52 HB2 GLU 52 237.633 -2.461 -0.800 414 2HB GLU 52 HB1 GLU 52 236.990 -2.066 0.787 415 1HG GLU 52 HG2 GLU 52 235.549 -4.163 -0.694 416 2HG GLU 52 HG1 GLU 52 237.186 -4.564 -0.173 417 H LEU 53 HN LEU 53 236.699 -0.299 -2.730 418 HA LEU 53 HA LEU 53 237.758 1.883 -1.288 419 1HB LEU 53 HB2 LEU 53 238.785 1.427 -3.339 420 2HB LEU 53 HB1 LEU 53 237.255 1.312 -4.189 421 HG LEU 53 HG LEU 53 236.963 3.754 -3.922 422 1HD1 LEU 53 HD11 LEU 53 238.390 5.066 -2.778 423 2HD1 LEU 53 HD12 LEU 53 239.802 4.107 -3.225 424 3HD1 LEU 53 HD13 LEU 53 238.741 3.563 -1.925 425 1HD2 LEU 53 HD21 LEU 53 239.157 4.257 -5.361 426 2HD2 LEU 53 HD22 LEU 53 237.767 3.390 -6.013 427 3HD2 LEU 53 HD23 LEU 53 239.172 2.495 -5.438 428 H GLN 54 HN GLN 54 234.907 1.549 -3.368 429 HA GLN 54 HA GLN 54 233.976 4.187 -3.102 430 1HB GLN 54 HB2 GLN 54 232.974 3.022 -4.838 431 2HB GLN 54 HB1 GLN 54 232.724 1.579 -3.866 432 1HG GLN 54 HG2 GLN 54 230.827 2.458 -2.833 433 2HG GLN 54 HG1 GLN 54 231.226 4.111 -3.299 434 1HE2 GLN 54 HE21 GLN 54 230.884 1.025 -5.027 435 2HE2 GLN 54 HE22 GLN 54 229.791 1.622 -6.224 436 H GLU 55 HN GLU 55 233.826 1.469 -0.983 437 HA GLU 55 HA GLU 55 231.663 2.492 0.617 438 1HB GLU 55 HB2 GLU 55 233.432 0.091 0.709 439 2HB GLU 55 HB1 GLU 55 232.563 0.557 2.164 440 1HG GLU 55 HG2 GLU 55 230.566 0.663 0.358 441 2HG GLU 55 HG1 GLU 55 231.569 -0.604 -0.345 442 H GLU 56 HN GLU 56 235.115 2.840 0.610 443 HA GLU 56 HA GLU 56 235.319 3.430 3.399 444 1HB GLU 56 HB2 GLU 56 237.113 2.935 1.288 445 2HB GLU 56 HB1 GLU 56 237.506 4.532 1.910 446 1HG GLU 56 HG2 GLU 56 237.387 1.956 3.456 447 2HG GLU 56 HG1 GLU 56 238.820 2.906 3.070 448 H SER 57 HN SER 57 235.231 5.466 0.468 449 HA SER 57 HA SER 57 234.458 7.699 2.203 450 1HB SER 57 HB2 SER 57 237.037 7.510 1.346 451 2HB SER 57 HB1 SER 57 236.319 8.463 0.047 452 HG SER 57 HG SER 57 236.829 9.145 2.658 453 H GLY 58 HN GLY 58 232.954 6.051 0.337 454 1HA GLY 58 HA2 GLY 58 231.456 6.259 -1.392 455 2HA GLY 58 HA1 GLY 58 231.371 7.943 -0.897 456 H LEU 59 HN LEU 59 234.473 6.908 -1.890 457 HA LEU 59 HA LEU 59 234.162 8.387 -4.406 458 1HB LEU 59 HB2 LEU 59 236.603 7.643 -2.797 459 2HB LEU 59 HB1 LEU 59 236.666 8.425 -4.365 460 HG LEU 59 HG LEU 59 235.911 9.549 -1.715 461 1HD1 LEU 59 HD11 LEU 59 237.230 11.398 -2.482 462 2HD1 LEU 59 HD12 LEU 59 237.278 10.743 -4.120 463 3HD1 LEU 59 HD13 LEU 59 238.113 9.908 -2.811 464 1HD2 LEU 59 HD21 LEU 59 234.796 10.543 -4.335 465 2HD2 LEU 59 HD22 LEU 59 234.757 11.431 -2.812 466 3HD2 LEU 59 HD23 LEU 59 233.874 9.913 -2.970 467 H THR 60 HN THR 60 233.668 7.111 -6.037 468 HA THR 60 HA THR 60 234.723 4.394 -6.108 469 HB THR 60 HB THR 60 233.146 5.241 -8.406 470 HG1 THR 60 HG1 THR 60 231.205 5.454 -7.199 471 1HG2 THR 60 HG21 THR 60 233.469 2.939 -6.757 472 2HG2 THR 60 HG22 THR 60 232.689 3.082 -8.333 473 3HG2 THR 60 HG23 THR 60 231.759 3.358 -6.860 474 H VAL 61 HN VAL 61 235.315 3.728 -8.538 475 HA VAL 61 HA VAL 61 236.931 5.846 -9.744 476 HB VAL 61 HB VAL 61 238.899 4.420 -9.926 477 1HG1 VAL 61 HG11 VAL 61 237.821 4.957 -7.181 478 2HG1 VAL 61 HG12 VAL 61 239.029 5.859 -8.095 479 3HG1 VAL 61 HG13 VAL 61 239.429 4.278 -7.423 480 1HG2 VAL 61 HG21 VAL 61 238.542 2.215 -9.841 481 2HG2 VAL 61 HG22 VAL 61 237.055 2.400 -8.911 482 3HG2 VAL 61 HG23 VAL 61 238.615 2.403 -8.089 483 H ASP 62 HN ASP 62 237.154 5.730 -11.905 484 HA ASP 62 HA ASP 62 235.471 3.856 -13.305 485 1HB ASP 62 HB2 ASP 62 236.068 6.419 -13.812 486 2HB ASP 62 HB1 ASP 62 237.316 5.657 -14.794 487 H ALA 63 HN ALA 63 238.746 4.033 -12.350 488 HA ALA 63 HA ALA 63 239.416 1.484 -13.184 489 1HB ALA 63 HB1 ALA 63 241.129 2.367 -15.023 490 2HB ALA 63 HB2 ALA 63 239.856 3.567 -15.244 491 3HB ALA 63 HB3 ALA 63 239.491 1.851 -15.425 492 H LEU 64 HN LEU 64 240.435 1.460 -11.175 493 HA LEU 64 HA LEU 64 242.280 3.324 -10.188 494 1HB LEU 64 HB2 LEU 64 242.036 0.346 -9.755 495 2HB LEU 64 HB1 LEU 64 243.198 1.334 -8.897 496 HG LEU 64 HG LEU 64 240.521 2.424 -8.678 497 1HD1 LEU 64 HD11 LEU 64 239.884 0.072 -8.925 498 2HD1 LEU 64 HD12 LEU 64 239.581 0.665 -7.291 499 3HD1 LEU 64 HD13 LEU 64 240.981 -0.357 -7.613 500 1HD2 LEU 64 HD21 LEU 64 241.260 2.975 -6.628 501 2HD2 LEU 64 HD22 LEU 64 242.838 2.513 -7.265 502 3HD2 LEU 64 HD23 LEU 64 241.900 1.362 -6.314 503 H HIS 65 HN HIS 65 244.670 2.342 -9.707 504 HA HIS 65 HA HIS 65 245.793 1.364 -12.235 505 1HB HIS 65 HB2 HIS 65 245.978 3.988 -11.635 506 2HB HIS 65 HB1 HIS 65 247.402 3.391 -10.789 507 HD1 HIS 65 HD1 HIS 65 247.767 5.250 -13.170 508 HD2 HIS 65 HD2 HIS 65 247.697 1.108 -13.486 509 HE1 HIS 65 HE1 HIS 65 248.993 4.718 -15.301 510 HE2 HIS 65 HE2 HIS 65 249.013 2.202 -15.426 511 H LYS 66 HN LYS 66 246.414 -0.621 -11.547 512 HA LYS 66 HA LYS 66 247.395 -1.236 -8.983 513 1HB LYS 66 HB2 LYS 66 248.133 -3.351 -9.955 514 2HB LYS 66 HB1 LYS 66 246.526 -2.938 -10.539 515 1HG LYS 66 HG2 LYS 66 247.411 -3.502 -12.526 516 2HG LYS 66 HG1 LYS 66 248.009 -1.843 -12.488 517 1HD LYS 66 HD2 LYS 66 250.071 -2.809 -11.318 518 2HD LYS 66 HD1 LYS 66 249.481 -4.383 -11.855 519 1HE LYS 66 HE2 LYS 66 249.854 -2.093 -13.761 520 2HE LYS 66 HE1 LYS 66 251.179 -3.178 -13.342 521 1HZ LYS 66 HZ1 LYS 66 248.636 -4.339 -14.230 522 2HZ LYS 66 HZ2 LYS 66 250.210 -4.926 -14.420 523 3HZ LYS 66 HZ3 LYS 66 249.659 -3.654 -15.391 524 H VAL 67 HN VAL 67 249.349 -0.945 -8.061 525 HA VAL 67 HA VAL 67 251.542 -0.124 -9.861 526 HB VAL 67 HB VAL 67 252.459 1.209 -8.009 527 1HG1 VAL 67 HG11 VAL 67 249.620 2.073 -8.419 528 2HG1 VAL 67 HG12 VAL 67 250.768 2.050 -9.757 529 3HG1 VAL 67 HG13 VAL 67 251.083 3.055 -8.343 530 1HG2 VAL 67 HG21 VAL 67 250.085 0.108 -6.586 531 2HG2 VAL 67 HG22 VAL 67 250.660 1.722 -6.180 532 3HG2 VAL 67 HG23 VAL 67 251.737 0.337 -6.014 533 H GLY 68 HN GLY 68 250.908 -1.686 -6.706 534 1HA GLY 68 HA2 GLY 68 253.059 -3.558 -7.307 535 2HA GLY 68 HA1 GLY 68 253.289 -2.545 -5.893 536 H GLN 69 HN GLN 69 253.407 -5.031 -5.305 537 HA GLN 69 HA GLN 69 250.807 -5.662 -4.088 538 1HB GLN 69 HB2 GLN 69 251.463 -7.131 -6.099 539 2HB GLN 69 HB1 GLN 69 252.698 -7.802 -5.043 540 1HG GLN 69 HG2 GLN 69 249.797 -7.756 -4.284 541 2HG GLN 69 HG1 GLN 69 250.510 -9.067 -5.222 542 1HE2 GLN 69 HE21 GLN 69 249.637 -8.198 -2.220 543 2HE2 GLN 69 HE22 GLN 69 250.728 -9.160 -1.288 544 H ILE 70 HN ILE 70 250.977 -5.639 -1.949 545 HA ILE 70 HA ILE 70 253.618 -6.094 -0.748 546 HB ILE 70 HB ILE 70 251.204 -4.886 0.592 547 1HG1 ILE 70 HG12 ILE 70 253.520 -3.499 -0.774 548 2HG1 ILE 70 HG11 ILE 70 251.851 -3.511 -1.333 549 1HG2 ILE 70 HG21 ILE 70 253.042 -5.876 1.994 550 2HG2 ILE 70 HG22 ILE 70 252.710 -4.167 2.280 551 3HG2 ILE 70 HG23 ILE 70 254.112 -4.646 1.323 552 1HD1 ILE 70 HD11 ILE 70 252.237 -1.426 -0.284 553 2HD1 ILE 70 HD12 ILE 70 252.955 -2.197 1.131 554 3HD1 ILE 70 HD13 ILE 70 251.229 -2.374 0.809 555 H VAL 71 HN VAL 71 253.993 -7.715 0.628 556 HA VAL 71 HA VAL 71 251.738 -9.476 1.333 557 HB VAL 71 HB VAL 71 254.613 -10.349 1.089 558 1HG1 VAL 71 HG11 VAL 71 253.181 -12.545 0.649 559 2HG1 VAL 71 HG12 VAL 71 252.016 -11.662 1.635 560 3HG1 VAL 71 HG13 VAL 71 253.622 -12.013 2.272 561 1HG2 VAL 71 HG21 VAL 71 254.284 -9.860 -1.113 562 2HG2 VAL 71 HG22 VAL 71 252.530 -10.019 -1.001 563 3HG2 VAL 71 HG23 VAL 71 253.544 -11.461 -1.072 564 H PHE 72 HN PHE 72 251.720 -10.410 3.419 565 HA PHE 72 HA PHE 72 253.651 -9.286 5.324 566 1HB PHE 72 HB2 PHE 72 250.649 -9.367 5.665 567 2HB PHE 72 HB1 PHE 72 251.788 -8.951 6.942 568 HD1 PHE 72 HD1 PHE 72 252.136 -6.725 7.344 569 HD2 PHE 72 HD2 PHE 72 251.029 -7.956 3.424 570 HE1 PHE 72 HE1 PHE 72 252.089 -4.373 6.623 571 HE2 PHE 72 HE2 PHE 72 250.983 -5.607 2.696 572 HZ PHE 72 HZ PHE 72 251.512 -3.812 4.296 573 H GLU 73 HN GLU 73 254.549 -10.768 6.581 574 HA GLU 73 HA GLU 73 253.279 -13.417 6.738 575 1HB GLU 73 HB2 GLU 73 255.478 -13.551 5.802 576 2HB GLU 73 HB1 GLU 73 256.147 -12.535 7.071 577 1HG GLU 73 HG2 GLU 73 256.622 -14.317 8.279 578 2HG GLU 73 HG1 GLU 73 254.925 -14.793 8.287 579 H PHE 74 HN PHE 74 252.633 -14.240 8.652 580 HA PHE 74 HA PHE 74 252.946 -12.515 10.999 581 1HB PHE 74 HB2 PHE 74 251.108 -14.872 10.523 582 2HB PHE 74 HB1 PHE 74 251.138 -13.888 11.984 583 HD1 PHE 74 HD1 PHE 74 249.556 -14.372 8.912 584 HD2 PHE 74 HD2 PHE 74 250.857 -11.294 11.547 585 HE1 PHE 74 HE1 PHE 74 247.938 -12.821 7.895 586 HE2 PHE 74 HE2 PHE 74 249.241 -9.739 10.536 587 HZ PHE 74 HZ PHE 74 247.779 -10.502 8.707 588 H VAL 75 HN VAL 75 254.111 -13.009 12.681 589 HA VAL 75 HA VAL 75 255.830 -15.301 12.571 590 HB VAL 75 HB VAL 75 255.802 -13.829 15.100 591 1HG1 VAL 75 HG11 VAL 75 258.092 -13.862 13.221 592 2HG1 VAL 75 HG12 VAL 75 257.541 -15.403 13.875 593 3HG1 VAL 75 HG13 VAL 75 258.055 -14.116 14.966 594 1HG2 VAL 75 HG21 VAL 75 256.011 -12.351 12.516 595 2HG2 VAL 75 HG22 VAL 75 257.014 -11.865 13.882 596 3HG2 VAL 75 HG23 VAL 75 255.258 -11.862 14.035 597 H GLY 76 HN GLY 76 255.284 -17.245 13.269 598 1HA GLY 76 HA2 GLY 76 254.689 -18.746 15.016 599 2HA GLY 76 HA1 GLY 76 253.699 -17.479 15.727 600 H GLU 77 HN GLU 77 252.670 -16.936 12.887 601 HA GLU 77 HA GLU 77 250.654 -19.079 12.925 602 1HB GLU 77 HB2 GLU 77 250.418 -16.319 11.715 603 2HB GLU 77 HB1 GLU 77 249.133 -17.508 11.879 604 1HG GLU 77 HG2 GLU 77 249.213 -17.317 14.286 605 2HG GLU 77 HG1 GLU 77 250.579 -16.208 14.175 606 HA PRO 78 HA PRO 78 252.169 -20.432 8.986 607 1HB PRO 78 HB2 PRO 78 250.006 -21.818 8.126 608 2HB PRO 78 HB1 PRO 78 251.068 -22.410 9.409 609 1HG PRO 78 HG2 PRO 78 248.420 -21.031 9.627 610 2HG PRO 78 HG1 PRO 78 249.026 -22.437 10.522 611 1HD PRO 78 HD2 PRO 78 249.018 -19.933 11.562 612 2HD PRO 78 HD1 PRO 78 250.250 -21.139 11.980 613 H GLU 79 HN GLU 79 248.853 -19.137 9.042 614 HA GLU 79 HA GLU 79 248.674 -18.529 6.315 615 1HB GLU 79 HB2 GLU 79 247.033 -18.286 8.562 616 2HB GLU 79 HB1 GLU 79 247.223 -16.640 7.972 617 1HG GLU 79 HG2 GLU 79 246.412 -17.271 5.800 618 2HG GLU 79 HG1 GLU 79 246.354 -18.968 6.277 619 H LEU 80 HN LEU 80 248.254 -16.128 5.641 620 HA LEU 80 HA LEU 80 250.165 -14.261 6.785 621 1HB LEU 80 HB2 LEU 80 250.370 -14.560 3.842 622 2HB LEU 80 HB1 LEU 80 251.592 -14.090 5.008 623 HG LEU 80 HG LEU 80 250.639 -16.927 4.878 624 1HD1 LEU 80 HD11 LEU 80 251.268 -16.834 2.691 625 2HD1 LEU 80 HD12 LEU 80 252.839 -17.130 3.435 626 3HD1 LEU 80 HD13 LEU 80 252.386 -15.496 2.952 627 1HD2 LEU 80 HD21 LEU 80 252.268 -15.688 6.621 628 2HD2 LEU 80 HD22 LEU 80 253.443 -16.187 5.404 629 3HD2 LEU 80 HD23 LEU 80 252.418 -17.391 6.186 630 H MET 81 HN MET 81 250.150 -12.385 4.719 631 HA MET 81 HA MET 81 247.358 -11.922 4.050 632 1HB MET 81 HB2 MET 81 248.232 -10.834 6.355 633 2HB MET 81 HB1 MET 81 248.726 -9.576 5.231 634 1HG MET 81 HG2 MET 81 246.236 -9.905 4.374 635 2HG MET 81 HG1 MET 81 246.016 -10.452 6.035 636 1HE MET 81 HE1 MET 81 247.041 -7.885 3.616 637 2HE MET 81 HE2 MET 81 248.264 -7.122 4.632 638 3HE MET 81 HE3 MET 81 246.707 -6.332 4.383 639 H ASP 82 HN ASP 82 247.457 -11.608 1.920 640 HA ASP 82 HA ASP 82 249.726 -10.088 0.829 641 1HB ASP 82 HB2 ASP 82 248.371 -12.463 -0.024 642 2HB ASP 82 HB1 ASP 82 248.157 -11.224 -1.257 643 H VAL 83 HN VAL 83 249.160 -7.975 0.870 644 HA VAL 83 HA VAL 83 246.512 -7.244 -0.190 645 HB VAL 83 HB VAL 83 246.947 -6.475 2.111 646 1HG1 VAL 83 HG11 VAL 83 248.897 -4.442 1.228 647 2HG1 VAL 83 HG12 VAL 83 249.499 -6.093 1.375 648 3HG1 VAL 83 HG13 VAL 83 248.762 -5.296 2.765 649 1HG2 VAL 83 HG21 VAL 83 245.445 -5.193 0.702 650 2HG2 VAL 83 HG22 VAL 83 246.803 -4.273 0.053 651 3HG2 VAL 83 HG23 VAL 83 246.360 -4.112 1.752 652 H HIS 84 HN HIS 84 246.508 -6.558 -2.206 653 HA HIS 84 HA HIS 84 248.918 -5.690 -3.511 654 1HB HIS 84 HB2 HIS 84 246.828 -6.977 -4.486 655 2HB HIS 84 HB1 HIS 84 246.210 -5.349 -4.739 656 HD1 HIS 84 HD1 HIS 84 248.736 -7.771 -5.993 657 HD2 HIS 84 HD2 HIS 84 247.596 -3.835 -6.683 658 HE1 HIS 84 HE1 HIS 84 249.868 -7.109 -8.139 659 HE2 HIS 84 HE2 HIS 84 249.235 -4.696 -8.489 660 H VAL 85 HN VAL 85 248.953 -3.609 -4.759 661 HA VAL 85 HA VAL 85 247.664 -1.487 -3.166 662 HB VAL 85 HB VAL 85 250.365 -1.480 -4.540 663 1HG1 VAL 85 HG11 VAL 85 250.640 0.797 -3.820 664 2HG1 VAL 85 HG12 VAL 85 249.063 0.785 -3.031 665 3HG1 VAL 85 HG13 VAL 85 249.172 0.690 -4.788 666 1HG2 VAL 85 HG21 VAL 85 250.344 -2.637 -2.410 667 2HG2 VAL 85 HG22 VAL 85 249.559 -1.257 -1.642 668 3HG2 VAL 85 HG23 VAL 85 251.206 -1.106 -2.258 669 H PHE 86 HN PHE 86 246.532 0.022 -4.220 670 HA PHE 86 HA PHE 86 246.672 0.142 -7.148 671 1HB PHE 86 HB2 PHE 86 244.329 -0.529 -5.429 672 2HB PHE 86 HB1 PHE 86 244.036 0.504 -6.823 673 HD1 PHE 86 HD1 PHE 86 245.069 -2.829 -5.711 674 HD2 PHE 86 HD2 PHE 86 244.214 -0.353 -9.064 675 HE1 PHE 86 HE1 PHE 86 244.989 -4.819 -7.155 676 HE2 PHE 86 HE2 PHE 86 244.132 -2.338 -10.514 677 HZ PHE 86 HZ PHE 86 244.519 -4.575 -9.561 678 H CYS 87 HN CYS 87 246.616 2.162 -7.944 679 HA CYS 87 HA CYS 87 245.806 4.344 -6.123 680 1HB CYS 87 HB2 CYS 87 248.197 4.467 -6.357 681 2HB CYS 87 HB1 CYS 87 248.103 4.228 -8.096 682 HG CYS 87 HG CYS 87 248.490 6.795 -7.277 683 H THR 88 HN THR 88 243.990 5.272 -6.914 684 HA THR 88 HA THR 88 243.383 4.943 -9.749 685 HB THR 88 HB THR 88 241.708 4.356 -7.986 686 HG1 THR 88 HG1 THR 88 240.871 4.699 -9.975 687 1HG2 THR 88 HG21 THR 88 242.279 6.771 -6.874 688 2HG2 THR 88 HG22 THR 88 240.866 5.775 -6.522 689 3HG2 THR 88 HG23 THR 88 240.756 7.075 -7.709 690 H ASP 89 HN ASP 89 241.963 6.903 -10.577 691 HA ASP 89 HA ASP 89 243.122 9.475 -9.853 692 1HB ASP 89 HB2 ASP 89 243.367 8.221 -12.590 693 2HB ASP 89 HB1 ASP 89 243.534 9.954 -12.319 694 H SER 90 HN SER 90 240.951 7.715 -12.029 695 HA SER 90 HA SER 90 239.158 10.014 -12.171 696 1HB SER 90 HB2 SER 90 239.871 8.107 -14.033 697 2HB SER 90 HB1 SER 90 238.295 7.533 -13.488 698 HG SER 90 HG SER 90 237.361 9.344 -14.223 699 H ILE 91 HN ILE 91 238.168 10.114 -10.164 700 HA ILE 91 HA ILE 91 236.798 7.692 -9.240 701 HB ILE 91 HB ILE 91 236.444 9.002 -7.097 702 1HG1 ILE 91 HG12 ILE 91 238.743 10.736 -7.706 703 2HG1 ILE 91 HG11 ILE 91 237.290 11.138 -8.615 704 1HG2 ILE 91 HG21 ILE 91 239.062 8.865 -6.624 705 2HG2 ILE 91 HG22 ILE 91 239.026 7.994 -8.156 706 3HG2 ILE 91 HG23 ILE 91 238.055 7.428 -6.797 707 1HD1 ILE 91 HD11 ILE 91 236.606 12.278 -6.851 708 2HD1 ILE 91 HD12 ILE 91 237.931 11.654 -5.867 709 3HD1 ILE 91 HD13 ILE 91 236.426 10.745 -5.997 710 H GLN 92 HN GLN 92 234.735 8.291 -7.920 711 HA GLN 92 HA GLN 92 233.035 9.866 -9.725 712 1HB GLN 92 HB2 GLN 92 232.449 7.558 -7.880 713 2HB GLN 92 HB1 GLN 92 231.167 8.576 -8.525 714 1HG GLN 92 HG2 GLN 92 232.594 7.936 -10.770 715 2HG GLN 92 HG1 GLN 92 232.715 6.466 -9.809 716 1HE2 GLN 92 HE21 GLN 92 230.241 6.626 -8.500 717 2HE2 GLN 92 HE22 GLN 92 228.991 6.365 -9.664 718 H GLY 93 HN GLY 93 233.918 11.750 -8.630 719 1HA GLY 93 HA2 GLY 93 234.084 12.724 -6.264 720 2HA GLY 93 HA1 GLY 93 233.078 13.591 -7.406 721 H THR 94 HN THR 94 233.156 11.510 -4.649 722 HA THR 94 HA THR 94 230.638 12.489 -3.710 723 HB THR 94 HB THR 94 230.892 9.567 -4.440 724 HG1 THR 94 HG1 THR 94 229.511 9.994 -6.002 725 1HG2 THR 94 HG21 THR 94 229.552 9.260 -2.665 726 2HG2 THR 94 HG22 THR 94 228.312 9.857 -3.768 727 3HG2 THR 94 HG23 THR 94 229.060 10.952 -2.606 728 HA PRO 95 HA PRO 95 233.772 10.991 -0.576 729 1HB PRO 95 HB2 PRO 95 234.631 13.381 0.336 730 2HB PRO 95 HB1 PRO 95 235.385 12.579 -1.047 731 1HG PRO 95 HG2 PRO 95 233.427 14.828 -0.994 732 2HG PRO 95 HG1 PRO 95 234.827 14.581 -2.052 733 1HD PRO 95 HD2 PRO 95 232.229 14.058 -2.772 734 2HD PRO 95 HD1 PRO 95 233.644 13.278 -3.502 735 H VAL 96 HN VAL 96 231.453 10.519 0.028 736 HA VAL 96 HA VAL 96 230.063 12.445 1.629 737 HB VAL 96 HB VAL 96 229.511 9.492 1.699 738 1HG1 VAL 96 HG11 VAL 96 228.318 11.259 3.131 739 2HG1 VAL 96 HG12 VAL 96 227.331 10.093 2.249 740 3HG1 VAL 96 HG13 VAL 96 227.524 11.733 1.629 741 1HG2 VAL 96 HG21 VAL 96 229.213 11.344 -0.595 742 2HG2 VAL 96 HG22 VAL 96 227.876 10.241 -0.269 743 3HG2 VAL 96 HG23 VAL 96 229.493 9.603 -0.569 744 H GLU 97 HN GLU 97 232.231 12.675 2.847 745 HA GLU 97 HA GLU 97 233.312 10.963 4.648 746 1HB GLU 97 HB2 GLU 97 233.908 12.867 6.019 747 2HB GLU 97 HB1 GLU 97 234.016 13.316 4.322 748 1HG GLU 97 HG2 GLU 97 231.556 14.150 4.728 749 2HG GLU 97 HG1 GLU 97 232.096 14.210 6.405 750 H SER 98 HN SER 98 232.319 9.559 5.937 751 HA SER 98 HA SER 98 229.777 10.211 7.171 752 1HB SER 98 HB2 SER 98 229.656 7.896 7.785 753 2HB SER 98 HB1 SER 98 230.270 7.963 6.133 754 HG SER 98 HG SER 98 231.363 6.639 7.976 755 H ASP 99 HN ASP 99 229.754 8.953 9.525 756 HA ASP 99 HA ASP 99 231.202 10.758 11.212 757 1HB ASP 99 HB2 ASP 99 229.306 8.480 11.746 758 2HB ASP 99 HB1 ASP 99 230.119 9.338 13.052 759 H GLU 100 HN GLU 100 232.046 7.849 9.770 760 HA GLU 100 HA GLU 100 233.947 7.212 11.924 761 1HB GLU 100 HB2 GLU 100 232.234 5.561 10.367 762 2HB GLU 100 HB1 GLU 100 233.890 5.169 9.926 763 1HG GLU 100 HG2 GLU 100 234.417 4.824 12.305 764 2HG GLU 100 HG1 GLU 100 232.731 5.149 12.704 765 H MET 101 HN MET 101 233.633 7.730 8.444 766 HA MET 101 HA MET 101 236.566 7.861 8.256 767 1HB MET 101 HB2 MET 101 234.692 6.530 6.654 768 2HB MET 101 HB1 MET 101 235.215 7.911 5.699 769 1HG MET 101 HG2 MET 101 236.551 5.903 5.268 770 2HG MET 101 HG1 MET 101 237.518 7.235 5.898 771 1HE MET 101 HE1 MET 101 239.701 5.198 7.774 772 2HE MET 101 HE2 MET 101 239.101 6.699 8.479 773 3HE MET 101 HE3 MET 101 239.322 6.571 6.734 774 H ARG 102 HN ARG 102 237.479 9.516 6.845 775 HA ARG 102 HA ARG 102 235.888 11.787 6.110 776 1HB ARG 102 HB2 ARG 102 236.170 12.072 8.589 777 2HB ARG 102 HB1 ARG 102 237.908 12.147 8.335 778 1HG ARG 102 HG2 ARG 102 237.512 14.113 6.832 779 2HG ARG 102 HG1 ARG 102 235.829 14.088 7.359 780 1HD ARG 102 HD2 ARG 102 236.664 14.264 9.718 781 2HD ARG 102 HD1 ARG 102 238.278 14.526 9.058 782 HE ARG 102 HE ARG 102 236.737 16.395 7.815 783 1HH1 ARG 102 HH11 ARG 102 237.354 15.567 11.148 784 2HH1 ARG 102 HH12 ARG 102 237.122 17.184 11.723 785 1HH2 ARG 102 HH21 ARG 102 236.432 18.523 8.569 786 2HH2 ARG 102 HH22 ARG 102 236.598 18.862 10.259 787 HA PRO 103 HA PRO 103 239.630 11.341 3.533 788 1HB PRO 103 HB2 PRO 103 238.558 12.357 1.280 789 2HB PRO 103 HB1 PRO 103 238.242 10.698 1.803 790 1HG PRO 103 HG2 PRO 103 236.550 13.147 2.153 791 2HG PRO 103 HG1 PRO 103 236.066 11.524 1.625 792 1HD PRO 103 HD2 PRO 103 235.716 12.384 4.170 793 2HD PRO 103 HD1 PRO 103 236.056 10.687 3.780 794 H CYS 104 HN CYS 104 241.070 12.844 2.608 795 HA CYS 104 HA CYS 104 240.423 15.677 2.848 796 1HB CYS 104 HB2 CYS 104 242.894 14.495 4.130 797 2HB CYS 104 HB1 CYS 104 242.403 16.186 4.146 798 HG CYS 104 HG CYS 104 240.495 15.587 5.779 799 H TRP 105 HN TRP 105 240.974 16.607 1.008 800 HA TRP 105 HA TRP 105 242.835 15.301 -0.789 801 1HB TRP 105 HB2 TRP 105 241.238 17.844 -1.173 802 2HB TRP 105 HB1 TRP 105 242.100 16.958 -2.427 803 HD1 TRP 105 HD1 TRP 105 239.505 15.737 0.219 804 HE1 TRP 105 HE1 TRP 105 237.668 14.429 -1.027 805 HE3 TRP 105 HE3 TRP 105 241.211 16.313 -4.569 806 HZ2 TRP 105 HZ2 TRP 105 237.032 13.738 -3.688 807 HZ3 TRP 105 HZ3 TRP 105 239.929 15.297 -6.406 808 HH2 TRP 105 HH2 TRP 105 237.883 14.036 -5.974 809 H PHE 106 HN PHE 106 244.882 15.939 -1.213 810 HA PHE 106 HA PHE 106 245.768 18.604 -0.438 811 1HB PHE 106 HB2 PHE 106 247.062 16.095 0.655 812 2HB PHE 106 HB1 PHE 106 247.682 17.730 0.853 813 HD1 PHE 106 HD1 PHE 106 245.951 15.208 2.440 814 HD2 PHE 106 HD2 PHE 106 245.807 19.415 1.815 815 HE1 PHE 106 HE1 PHE 106 244.612 15.464 4.488 816 HE2 PHE 106 HE2 PHE 106 244.468 19.678 3.862 817 HZ PHE 106 HZ PHE 106 243.869 17.700 5.202 818 H GLN 107 HN GLN 107 248.472 18.311 -0.772 819 HA GLN 107 HA GLN 107 248.615 17.853 -3.634 820 1HB GLN 107 HB2 GLN 107 249.594 19.884 -2.542 821 2HB GLN 107 HB1 GLN 107 250.776 18.840 -1.767 822 1HG GLN 107 HG2 GLN 107 251.749 18.255 -3.850 823 2HG GLN 107 HG1 GLN 107 250.437 19.019 -4.746 824 1HE2 GLN 107 HE21 GLN 107 253.508 19.406 -3.445 825 2HE2 GLN 107 HE22 GLN 107 253.660 21.115 -3.648 826 H LEU 108 HN LEU 108 250.571 16.741 -4.523 827 HA LEU 108 HA LEU 108 250.828 14.143 -3.269 828 1HB LEU 108 HB2 LEU 108 251.613 13.368 -5.317 829 2HB LEU 108 HB1 LEU 108 250.476 14.621 -5.775 830 HG LEU 108 HG LEU 108 253.476 14.960 -5.678 831 1HD1 LEU 108 HD11 LEU 108 251.610 14.077 -7.795 832 2HD1 LEU 108 HD12 LEU 108 253.310 13.684 -7.540 833 3HD1 LEU 108 HD13 LEU 108 252.860 15.230 -8.260 834 1HD2 LEU 108 HD21 LEU 108 252.368 17.050 -5.280 835 2HD2 LEU 108 HD22 LEU 108 251.262 16.769 -6.622 836 3HD2 LEU 108 HD23 LEU 108 252.974 17.042 -6.935 837 H ASP 109 HN ASP 109 252.323 16.849 -2.544 838 HA ASP 109 HA ASP 109 254.905 15.511 -2.114 839 1HB ASP 109 HB2 ASP 109 254.676 17.602 -3.776 840 2HB ASP 109 HB1 ASP 109 254.836 18.482 -2.259 841 H GLN 110 HN GLN 110 252.439 15.750 -0.459 842 HA GLN 110 HA GLN 110 253.778 16.611 1.951 843 1HB GLN 110 HB2 GLN 110 251.362 18.000 0.849 844 2HB GLN 110 HB1 GLN 110 251.649 17.949 2.582 845 1HG GLN 110 HG2 GLN 110 253.859 18.990 2.204 846 2HG GLN 110 HG1 GLN 110 253.466 19.126 0.492 847 1HE2 GLN 110 HE21 GLN 110 251.601 20.423 -0.079 848 2HE2 GLN 110 HE22 GLN 110 251.177 21.778 0.906 849 H ILE 111 HN ILE 111 252.476 14.139 0.689 850 HA ILE 111 HA ILE 111 250.254 13.566 2.421 851 HB ILE 111 HB ILE 111 251.554 11.138 1.558 852 1HG1 ILE 111 HG12 ILE 111 250.853 11.624 -0.928 853 2HG1 ILE 111 HG11 ILE 111 251.231 13.290 -0.489 854 1HG2 ILE 111 HG21 ILE 111 249.065 11.921 2.131 855 2HG2 ILE 111 HG22 ILE 111 249.456 10.471 1.204 856 3HG2 ILE 111 HG23 ILE 111 249.000 11.957 0.368 857 1HD1 ILE 111 HD11 ILE 111 253.464 12.422 0.307 858 2HD1 ILE 111 HD12 ILE 111 253.186 12.385 -1.435 859 3HD1 ILE 111 HD13 ILE 111 253.047 10.903 -0.486 860 HA PRO 112 HA PRO 112 252.895 12.342 5.786 861 1HB PRO 112 HB2 PRO 112 251.069 12.375 7.715 862 2HB PRO 112 HB1 PRO 112 251.534 13.876 6.903 863 1HG PRO 112 HG2 PRO 112 249.083 12.213 6.552 864 2HG PRO 112 HG1 PRO 112 249.264 13.975 6.482 865 1HD PRO 112 HD2 PRO 112 249.183 12.197 4.291 866 2HD PRO 112 HD1 PRO 112 249.634 13.912 4.248 867 H PHE 113 HN PHE 113 253.495 10.250 5.271 868 HA PHE 113 HA PHE 113 251.619 8.086 5.577 869 1HB PHE 113 HB2 PHE 113 254.449 7.333 5.482 870 2HB PHE 113 HB1 PHE 113 253.101 6.775 4.511 871 HD1 PHE 113 HD1 PHE 113 252.362 9.604 3.417 872 HD2 PHE 113 HD2 PHE 113 256.006 7.430 3.763 873 HE1 PHE 113 HE1 PHE 113 253.287 10.826 1.498 874 HE2 PHE 113 HE2 PHE 113 256.928 8.642 1.847 875 HZ PHE 113 HZ PHE 113 255.570 10.357 0.708 876 H LYS 114 HN LYS 114 253.734 9.812 7.623 877 HA LYS 114 HA LYS 114 254.384 7.794 9.485 878 1HB LYS 114 HB2 LYS 114 254.282 10.795 9.581 879 2HB LYS 114 HB1 LYS 114 254.538 9.878 11.059 880 1HG LYS 114 HG2 LYS 114 256.643 10.615 10.085 881 2HG LYS 114 HG1 LYS 114 256.525 8.854 10.103 882 1HD LYS 114 HD2 LYS 114 256.043 8.782 7.774 883 2HD LYS 114 HD1 LYS 114 255.818 10.531 7.703 884 1HE LYS 114 HE2 LYS 114 258.438 9.506 8.652 885 2HE LYS 114 HE1 LYS 114 258.074 9.358 6.933 886 1HZ LYS 114 HZ1 LYS 114 259.173 11.516 7.993 887 2HZ LYS 114 HZ2 LYS 114 257.545 11.948 8.152 888 3HZ LYS 114 HZ3 LYS 114 258.177 11.577 6.627 889 H ASP 115 HN ASP 115 251.608 9.792 8.914 890 HA ASP 115 HA ASP 115 250.339 8.818 11.347 891 1HB ASP 115 HB2 ASP 115 249.663 11.045 9.438 892 2HB ASP 115 HB1 ASP 115 248.496 10.458 10.619 893 H MET 116 HN MET 116 250.896 7.208 8.927 894 HA MET 116 HA MET 116 248.139 6.428 8.274 895 1HB MET 116 HB2 MET 116 250.483 6.876 6.558 896 2HB MET 116 HB1 MET 116 249.629 5.376 6.234 897 1HG MET 116 HG2 MET 116 247.874 6.420 5.327 898 2HG MET 116 HG1 MET 116 247.895 7.715 6.520 899 1HE MET 116 HE1 MET 116 249.169 6.358 3.163 900 2HE MET 116 HE2 MET 116 250.746 6.539 3.930 901 3HE MET 116 HE3 MET 116 250.292 7.592 2.591 902 H TRP 117 HN TRP 117 251.262 4.856 7.683 903 HA TRP 117 HA TRP 117 250.838 2.874 9.710 904 1HB TRP 117 HB2 TRP 117 249.723 2.414 7.120 905 2HB TRP 117 HB1 TRP 117 251.063 1.297 7.348 906 HD1 TRP 117 HD1 TRP 117 249.169 2.209 10.485 907 HE1 TRP 117 HE1 TRP 117 247.738 0.206 11.230 908 HE3 TRP 117 HE3 TRP 117 249.689 -0.747 6.345 909 HZ2 TRP 117 HZ2 TRP 117 246.933 -2.296 10.202 910 HZ3 TRP 117 HZ3 TRP 117 248.555 -2.931 6.307 911 HH2 TRP 117 HH2 TRP 117 247.206 -3.687 8.196 912 HA PRO 118 HA PRO 118 255.170 2.270 9.075 913 1HB PRO 118 HB2 PRO 118 255.607 -0.243 9.823 914 2HB PRO 118 HB1 PRO 118 254.931 0.932 10.955 915 1HG PRO 118 HG2 PRO 118 253.544 -1.215 9.404 916 2HG PRO 118 HG1 PRO 118 253.287 -0.700 11.079 917 1HD PRO 118 HD2 PRO 118 251.749 0.088 8.906 918 2HD PRO 118 HD1 PRO 118 251.836 0.941 10.460 919 H ASP 119 HN ASP 119 253.310 1.383 6.684 920 HA ASP 119 HA ASP 119 255.481 0.033 5.231 921 1HB ASP 119 HB2 ASP 119 253.552 -1.057 3.883 922 2HB ASP 119 HB1 ASP 119 253.963 -1.724 5.460 923 H ASP 120 HN ASP 120 252.895 2.359 5.232 924 HA ASP 120 HA ASP 120 252.464 3.011 2.637 925 1HB ASP 120 HB2 ASP 120 252.850 4.867 4.978 926 2HB ASP 120 HB1 ASP 120 252.227 5.386 3.413 927 H SER 121 HN SER 121 255.087 4.476 4.565 928 HA SER 121 HA SER 121 256.274 5.931 2.509 929 1HB SER 121 HB2 SER 121 258.017 4.719 4.610 930 2HB SER 121 HB1 SER 121 257.972 6.372 4.001 931 HG SER 121 HG SER 121 256.996 6.606 5.891 932 H TYR 122 HN TYR 122 256.287 2.520 2.982 933 HA TYR 122 HA TYR 122 258.751 2.092 1.548 934 1HB TYR 122 HB2 TYR 122 256.676 0.164 2.590 935 2HB TYR 122 HB1 TYR 122 258.170 -0.319 1.797 936 HD1 TYR 122 HD1 TYR 122 260.197 -0.436 2.997 937 HD2 TYR 122 HD2 TYR 122 256.815 1.450 4.759 938 HE1 TYR 122 HE1 TYR 122 261.376 -0.348 5.154 939 HE2 TYR 122 HE2 TYR 122 257.985 1.543 6.919 940 HH TYR 122 HH TYR 122 261.329 0.886 7.230 941 H TRP 123 HN TRP 123 255.315 2.102 0.794 942 HA TRP 123 HA TRP 123 256.033 1.202 -1.907 943 1HB TRP 123 HB2 TRP 123 253.723 0.417 -2.174 944 2HB TRP 123 HB1 TRP 123 254.535 -0.364 -0.824 945 HD1 TRP 123 HD1 TRP 123 253.670 0.246 1.646 946 HE1 TRP 123 HE1 TRP 123 251.430 1.201 2.478 947 HE3 TRP 123 HE3 TRP 123 251.845 2.025 -2.787 948 HZ2 TRP 123 HZ2 TRP 123 249.181 2.539 1.395 949 HZ3 TRP 123 HZ3 TRP 123 249.640 3.119 -2.797 950 HH2 TRP 123 HH2 TRP 123 248.340 3.361 -0.754 951 H PHE 124 HN PHE 124 254.976 3.930 -0.211 952 HA PHE 124 HA PHE 124 253.334 5.023 -2.281 953 1HB PHE 124 HB2 PHE 124 253.628 5.613 0.351 954 2HB PHE 124 HB1 PHE 124 254.583 6.899 -0.373 955 HD1 PHE 124 HD1 PHE 124 253.036 8.548 0.529 956 HD2 PHE 124 HD2 PHE 124 251.707 5.584 -2.215 957 HE1 PHE 124 HE1 PHE 124 250.998 9.836 0.141 958 HE2 PHE 124 HE2 PHE 124 249.659 6.879 -2.618 959 HZ PHE 124 HZ PHE 124 249.299 9.008 -1.436 960 HA PRO 125 HA PRO 125 257.390 7.759 -2.992 961 1HB PRO 125 HB2 PRO 125 259.314 5.568 -2.373 962 2HB PRO 125 HB1 PRO 125 259.471 7.309 -2.116 963 1HG PRO 125 HG2 PRO 125 258.978 5.683 -0.074 964 2HG PRO 125 HG1 PRO 125 258.200 7.273 -0.176 965 1HD PRO 125 HD2 PRO 125 257.060 4.565 -0.718 966 2HD PRO 125 HD1 PRO 125 256.290 5.990 0.011 967 H LEU 126 HN LEU 126 257.088 4.299 -3.543 968 HA LEU 126 HA LEU 126 258.385 4.382 -6.112 969 1HB LEU 126 HB2 LEU 126 256.922 2.291 -4.541 970 2HB LEU 126 HB1 LEU 126 257.255 2.030 -6.243 971 HG LEU 126 HG LEU 126 259.533 2.831 -4.510 972 1HD1 LEU 126 HD11 LEU 126 259.576 1.024 -3.217 973 2HD1 LEU 126 HD12 LEU 126 259.212 -0.043 -4.572 974 3HD1 LEU 126 HD13 LEU 126 257.902 0.744 -3.694 975 1HD2 LEU 126 HD21 LEU 126 260.745 1.342 -6.009 976 2HD2 LEU 126 HD22 LEU 126 259.807 2.524 -6.922 977 3HD2 LEU 126 HD23 LEU 126 259.230 0.864 -6.776 978 H LEU 127 HN LEU 127 255.132 4.533 -4.847 979 HA LEU 127 HA LEU 127 253.681 4.122 -7.215 980 1HB LEU 127 HB2 LEU 127 253.067 5.829 -4.800 981 2HB LEU 127 HB1 LEU 127 251.915 5.494 -6.075 982 HG LEU 127 HG LEU 127 252.621 3.918 -3.764 983 1HD1 LEU 127 HD11 LEU 127 250.444 3.896 -5.828 984 2HD1 LEU 127 HD12 LEU 127 250.370 4.454 -4.157 985 3HD1 LEU 127 HD13 LEU 127 250.510 2.731 -4.506 986 1HD2 LEU 127 HD21 LEU 127 252.711 2.518 -6.433 987 2HD2 LEU 127 HD22 LEU 127 252.577 1.715 -4.870 988 3HD2 LEU 127 HD23 LEU 127 254.025 2.637 -5.264 989 H LEU 128 HN LEU 128 254.722 7.108 -5.627 990 HA LEU 128 HA LEU 128 253.873 8.904 -7.601 991 1HB LEU 128 HB2 LEU 128 255.831 8.984 -5.359 992 2HB LEU 128 HB1 LEU 128 255.906 10.266 -6.554 993 HG LEU 128 HG LEU 128 253.219 9.703 -5.463 994 1HD1 LEU 128 HD11 LEU 128 255.413 10.896 -3.776 995 2HD1 LEU 128 HD12 LEU 128 254.471 9.446 -3.430 996 3HD1 LEU 128 HD13 LEU 128 253.691 11.027 -3.420 997 1HD2 LEU 128 HD21 LEU 128 254.848 12.068 -6.292 998 2HD2 LEU 128 HD22 LEU 128 253.407 12.286 -5.299 999 3HD2 LEU 128 HD23 LEU 128 253.279 11.525 -6.885 1000 H GLN 129 HN GLN 129 256.747 6.942 -7.334 1001 HA GLN 129 HA GLN 129 258.248 8.293 -9.349 1002 1HB GLN 129 HB2 GLN 129 259.156 6.782 -7.513 1003 2HB GLN 129 HB1 GLN 129 258.604 5.427 -8.488 1004 1HG GLN 129 HG2 GLN 129 260.770 5.564 -9.169 1005 2HG GLN 129 HG1 GLN 129 260.005 6.614 -10.360 1006 1HE2 GLN 129 HE21 GLN 129 260.261 8.855 -10.183 1007 2HE2 GLN 129 HE22 GLN 129 261.533 9.552 -9.245 1008 H LYS 130 HN LYS 130 255.528 6.331 -9.528 1009 HA LYS 130 HA LYS 130 254.376 5.466 -11.288 1010 1HB LYS 130 HB2 LYS 130 256.565 6.487 -13.097 1011 2HB LYS 130 HB1 LYS 130 254.897 6.132 -13.521 1012 1HG LYS 130 HG2 LYS 130 254.110 8.086 -12.651 1013 2HG LYS 130 HG1 LYS 130 255.399 8.199 -11.450 1014 1HD LYS 130 HD2 LYS 130 256.131 8.413 -14.325 1015 2HD LYS 130 HD1 LYS 130 255.324 9.787 -13.567 1016 1HE LYS 130 HE2 LYS 130 257.186 9.213 -11.696 1017 2HE LYS 130 HE1 LYS 130 258.038 8.713 -13.157 1018 1HZ LYS 130 HZ1 LYS 130 257.196 11.023 -14.003 1019 2HZ LYS 130 HZ2 LYS 130 258.597 10.907 -13.063 1020 3HZ LYS 130 HZ3 LYS 130 257.139 11.384 -12.351 1021 H LYS 131 HN LYS 131 256.329 3.934 -9.846 1022 HA LYS 131 HA LYS 131 257.076 1.983 -11.927 1023 1HB LYS 131 HB2 LYS 131 258.504 2.590 -9.332 1024 2HB LYS 131 HB1 LYS 131 258.923 1.276 -10.423 1025 1HG LYS 131 HG2 LYS 131 258.808 3.972 -11.614 1026 2HG LYS 131 HG1 LYS 131 260.113 3.671 -10.465 1027 1HD LYS 131 HD2 LYS 131 260.924 1.834 -11.751 1028 2HD LYS 131 HD1 LYS 131 259.500 1.861 -12.794 1029 1HE LYS 131 HE2 LYS 131 260.167 4.103 -13.586 1030 2HE LYS 131 HE1 LYS 131 261.623 3.995 -12.597 1031 1HZ LYS 131 HZ1 LYS 131 260.924 2.100 -14.773 1032 2HZ LYS 131 HZ2 LYS 131 262.362 2.129 -13.886 1033 3HZ LYS 131 HZ3 LYS 131 261.995 3.399 -14.940 1034 H LYS 132 HN LYS 132 257.074 -0.274 -11.223 1035 HA LYS 132 HA LYS 132 255.036 -0.745 -9.152 1036 1HB LYS 132 HB2 LYS 132 255.697 -2.455 -11.557 1037 2HB LYS 132 HB1 LYS 132 254.441 -2.786 -10.372 1038 1HG LYS 132 HG2 LYS 132 253.125 -1.801 -11.903 1039 2HG LYS 132 HG1 LYS 132 253.705 -0.319 -11.141 1040 1HD LYS 132 HD2 LYS 132 254.956 0.261 -12.930 1041 2HD LYS 132 HD1 LYS 132 255.427 -1.406 -13.269 1042 1HE LYS 132 HE2 LYS 132 252.839 -1.559 -13.912 1043 2HE LYS 132 HE1 LYS 132 253.103 0.152 -14.239 1044 1HZ LYS 132 HZ1 LYS 132 254.201 -2.190 -15.595 1045 2HZ LYS 132 HZ2 LYS 132 255.196 -0.828 -15.477 1046 3HZ LYS 132 HZ3 LYS 132 253.690 -0.709 -16.236 1047 H PHE 133 HN PHE 133 255.483 -2.089 -7.492 1048 HA PHE 133 HA PHE 133 257.742 -3.907 -7.657 1049 1HB PHE 133 HB2 PHE 133 259.083 -2.941 -6.059 1050 2HB PHE 133 HB1 PHE 133 258.398 -1.495 -6.790 1051 HD1 PHE 133 HD1 PHE 133 259.292 -2.806 -3.791 1052 HD2 PHE 133 HD2 PHE 133 255.923 -0.991 -5.651 1053 HE1 PHE 133 HE1 PHE 133 258.458 -2.103 -1.586 1054 HE2 PHE 133 HE2 PHE 133 255.085 -0.282 -3.449 1055 HZ PHE 133 HZ PHE 133 256.354 -0.837 -1.412 1056 H HIS 134 HN HIS 134 257.975 -5.129 -5.522 1057 HA HIS 134 HA HIS 134 255.340 -5.558 -4.280 1058 1HB HIS 134 HB2 HIS 134 257.291 -7.800 -4.779 1059 2HB HIS 134 HB1 HIS 134 255.581 -7.908 -4.377 1060 HD1 HIS 134 HD1 HIS 134 254.655 -5.848 -6.618 1061 HD2 HIS 134 HD2 HIS 134 257.096 -9.164 -7.176 1062 HE1 HIS 134 HE1 HIS 134 254.424 -6.451 -9.049 1063 HE2 HIS 134 HE2 HIS 134 255.844 -8.511 -9.344 1064 H GLY 135 HN GLY 135 255.399 -5.359 -2.113 1065 1HA GLY 135 HA2 GLY 135 258.050 -5.573 -0.830 1066 2HA GLY 135 HA1 GLY 135 256.811 -4.446 -0.312 1067 H TYR 136 HN TYR 136 258.342 -7.056 0.670 1068 HA TYR 136 HA TYR 136 255.969 -8.324 1.865 1069 1HB TYR 136 HB2 TYR 136 257.121 -10.010 0.700 1070 2HB TYR 136 HB1 TYR 136 258.698 -9.381 1.159 1071 HD1 TYR 136 HD1 TYR 136 259.619 -11.389 2.038 1072 HD2 TYR 136 HD2 TYR 136 255.895 -9.943 3.500 1073 HE1 TYR 136 HE1 TYR 136 259.726 -13.004 3.889 1074 HE2 TYR 136 HE2 TYR 136 255.992 -11.549 5.352 1075 HH TYR 136 HH TYR 136 257.804 -14.167 5.429 1076 H PHE 137 HN PHE 137 255.601 -7.803 3.926 1077 HA PHE 137 HA PHE 137 257.912 -7.046 5.594 1078 1HB PHE 137 HB2 PHE 137 255.107 -5.945 5.795 1079 2HB PHE 137 HB1 PHE 137 256.504 -5.442 6.741 1080 HD1 PHE 137 HD1 PHE 137 255.469 -5.783 3.172 1081 HD2 PHE 137 HD2 PHE 137 257.613 -3.550 6.091 1082 HE1 PHE 137 HE1 PHE 137 256.004 -4.084 1.474 1083 HE2 PHE 137 HE2 PHE 137 258.150 -1.849 4.399 1084 HZ PHE 137 HZ PHE 137 257.346 -2.113 2.087 1085 H LYS 138 HN LYS 138 258.122 -7.991 7.544 1086 HA LYS 138 HA LYS 138 256.226 -10.057 8.328 1087 1HB LYS 138 HB2 LYS 138 258.613 -10.609 8.384 1088 2HB LYS 138 HB1 LYS 138 258.914 -9.261 9.472 1089 1HG LYS 138 HG2 LYS 138 257.976 -10.329 11.278 1090 2HG LYS 138 HG1 LYS 138 256.974 -11.378 10.273 1091 1HD LYS 138 HD2 LYS 138 259.897 -11.683 9.970 1092 2HD LYS 138 HD1 LYS 138 259.215 -12.205 11.512 1093 1HE LYS 138 HE2 LYS 138 258.856 -14.138 10.421 1094 2HE LYS 138 HE1 LYS 138 257.444 -13.297 9.785 1095 1HZ LYS 138 HZ1 LYS 138 258.865 -12.601 7.885 1096 2HZ LYS 138 HZ2 LYS 138 258.599 -14.268 7.970 1097 3HZ LYS 138 HZ3 LYS 138 260.081 -13.623 8.467 1098 H PHE 139 HN PHE 139 254.794 -9.783 10.024 1099 HA PHE 139 HA PHE 139 254.973 -7.186 11.398 1100 1HB PHE 139 HB2 PHE 139 252.730 -8.796 10.364 1101 2HB PHE 139 HB1 PHE 139 252.445 -8.058 11.936 1102 HD1 PHE 139 HD1 PHE 139 250.929 -6.359 11.487 1103 HD2 PHE 139 HD2 PHE 139 254.415 -6.742 9.077 1104 HE1 PHE 139 HE1 PHE 139 250.398 -4.224 10.388 1105 HE2 PHE 139 HE2 PHE 139 253.892 -4.605 7.974 1106 HZ PHE 139 HZ PHE 139 251.881 -3.343 8.629 1107 H GLN 140 HN GLN 140 254.110 -7.087 13.608 1108 HA GLN 140 HA GLN 140 254.413 -9.550 15.163 1109 1HB GLN 140 HB2 GLN 140 256.570 -8.687 15.440 1110 2HB GLN 140 HB1 GLN 140 256.013 -7.026 15.454 1111 1HG GLN 140 HG2 GLN 140 256.849 -8.001 17.637 1112 2HG GLN 140 HG1 GLN 140 255.302 -7.162 17.674 1113 1HE2 GLN 140 HE21 GLN 140 253.601 -8.197 18.485 1114 2HE2 GLN 140 HE22 GLN 140 253.541 -9.880 18.870 1115 H GLY 141 HN GLY 141 252.083 -9.350 15.252 1116 1HA GLY 141 HA2 GLY 141 250.550 -8.969 17.114 1117 2HA GLY 141 HA1 GLY 141 251.247 -7.364 17.273 1118 H GLN 142 HN GLN 142 250.856 -5.829 15.488 1119 HA GLN 142 HA GLN 142 248.758 -6.432 13.621 1120 1HB GLN 142 HB2 GLN 142 248.181 -5.039 16.165 1121 2HB GLN 142 HB1 GLN 142 247.489 -4.316 14.720 1122 1HG GLN 142 HG2 GLN 142 247.066 -7.149 14.689 1123 2HG GLN 142 HG1 GLN 142 246.500 -6.468 16.214 1124 1HE2 GLN 142 HE21 GLN 142 245.767 -7.025 12.996 1125 2HE2 GLN 142 HE22 GLN 142 244.370 -6.019 12.868 1126 H ASP 143 HN ASP 143 250.638 -3.867 15.221 1127 HA ASP 143 HA ASP 143 250.890 -2.582 12.581 1128 1HB ASP 143 HB2 ASP 143 249.481 -1.478 14.620 1129 2HB ASP 143 HB1 ASP 143 251.078 -0.804 14.928 1130 H THR 144 HN THR 144 252.670 -4.453 14.102 1131 HA THR 144 HA THR 144 255.025 -2.686 14.303 1132 HB THR 144 HB THR 144 254.463 -5.309 15.689 1133 HG1 THR 144 HG1 THR 144 253.631 -3.279 16.575 1134 1HG2 THR 144 HG21 THR 144 256.989 -3.679 15.769 1135 2HG2 THR 144 HG22 THR 144 256.799 -5.260 15.012 1136 3HG2 THR 144 HG23 THR 144 256.629 -5.094 16.759 1137 H ILE 145 HN ILE 145 256.708 -3.060 12.964 1138 HA ILE 145 HA ILE 145 256.536 -5.488 11.327 1139 HB ILE 145 HB ILE 145 258.007 -2.974 10.559 1140 1HG1 ILE 145 HG12 ILE 145 255.264 -3.944 9.715 1141 2HG1 ILE 145 HG11 ILE 145 255.603 -2.517 10.689 1142 1HG2 ILE 145 HG21 ILE 145 258.017 -4.027 8.329 1143 2HG2 ILE 145 HG22 ILE 145 257.236 -5.451 9.015 1144 3HG2 ILE 145 HG23 ILE 145 258.860 -5.002 9.532 1145 1HD1 ILE 145 HD11 ILE 145 256.763 -1.503 8.800 1146 2HD1 ILE 145 HD12 ILE 145 255.098 -1.919 8.394 1147 3HD1 ILE 145 HD13 ILE 145 256.424 -2.933 7.825 1148 H LEU 146 HN LEU 146 258.217 -6.833 11.153 1149 HA LEU 146 HA LEU 146 260.608 -6.188 12.745 1150 1HB LEU 146 HB2 LEU 146 259.773 -8.998 12.152 1151 2HB LEU 146 HB1 LEU 146 260.743 -8.388 13.478 1152 HG LEU 146 HG LEU 146 257.882 -7.561 13.351 1153 1HD1 LEU 146 HD11 LEU 146 258.059 -9.921 14.914 1154 2HD1 LEU 146 HD12 LEU 146 258.651 -10.288 13.293 1155 3HD1 LEU 146 HD13 LEU 146 257.044 -9.598 13.509 1156 1HD2 LEU 146 HD21 LEU 146 260.055 -7.779 15.326 1157 2HD2 LEU 146 HD22 LEU 146 258.449 -8.212 15.909 1158 3HD2 LEU 146 HD23 LEU 146 258.733 -6.618 15.212 1159 H ASP 147 HN ASP 147 259.400 -6.957 9.657 1160 HA ASP 147 HA ASP 147 262.069 -6.948 8.560 1161 1HB ASP 147 HB2 ASP 147 260.861 -9.408 9.071 1162 2HB ASP 147 HB1 ASP 147 260.574 -9.138 7.355 1163 H TYR 148 HN TYR 148 262.128 -6.061 6.525 1164 HA TYR 148 HA TYR 148 259.602 -5.857 5.069 1165 1HB TYR 148 HB2 TYR 148 259.837 -3.494 4.676 1166 2HB TYR 148 HB1 TYR 148 259.820 -3.802 6.410 1167 HD1 TYR 148 HD1 TYR 148 261.681 -3.222 7.778 1168 HD2 TYR 148 HD2 TYR 148 261.986 -2.926 3.545 1169 HE1 TYR 148 HE1 TYR 148 263.791 -1.982 8.022 1170 HE2 TYR 148 HE2 TYR 148 264.097 -1.685 3.777 1171 HH TYR 148 HH TYR 148 265.991 -1.666 5.940 1172 H THR 149 HN THR 149 259.785 -6.092 2.918 1173 HA THR 149 HA THR 149 262.476 -5.900 1.742 1174 HB THR 149 HB THR 149 261.184 -7.825 0.231 1175 HG1 THR 149 HG1 THR 149 260.770 -8.430 2.968 1176 1HG2 THR 149 HG21 THR 149 263.576 -7.673 1.320 1177 2HG2 THR 149 HG22 THR 149 262.889 -9.209 0.794 1178 3HG2 THR 149 HG23 THR 149 262.844 -8.760 2.498 1179 H LEU 150 HN LEU 150 262.586 -5.154 -0.351 1180 HA LEU 150 HA LEU 150 260.073 -4.336 -1.624 1181 1HB LEU 150 HB2 LEU 150 262.484 -2.588 -1.150 1182 2HB LEU 150 HB1 LEU 150 261.204 -2.184 -2.280 1183 HG LEU 150 HG LEU 150 259.739 -2.621 -0.049 1184 1HD1 LEU 150 HD11 LEU 150 262.181 -2.824 1.025 1185 2HD1 LEU 150 HD12 LEU 150 260.790 -2.182 1.897 1186 3HD1 LEU 150 HD13 LEU 150 261.949 -1.081 1.154 1187 1HD2 LEU 150 HD21 LEU 150 259.894 -0.619 -1.644 1188 2HD2 LEU 150 HD22 LEU 150 261.055 0.038 -0.491 1189 3HD2 LEU 150 HD23 LEU 150 259.405 -0.312 0.022 1190 H ARG 151 HN ARG 151 259.983 -5.248 -3.568 1191 HA ARG 151 HA ARG 151 262.488 -5.498 -5.105 1192 1HB ARG 151 HB2 ARG 151 260.176 -7.414 -5.343 1193 2HB ARG 151 HB1 ARG 151 261.814 -7.607 -5.952 1194 1HG ARG 151 HG2 ARG 151 262.326 -7.381 -3.324 1195 2HG ARG 151 HG1 ARG 151 260.717 -8.105 -3.264 1196 1HD ARG 151 HD2 ARG 151 261.722 -10.071 -3.563 1197 2HD ARG 151 HD1 ARG 151 262.025 -9.557 -5.222 1198 HE ARG 151 HE ARG 151 264.051 -8.561 -3.540 1199 1HH1 ARG 151 HH11 ARG 151 262.919 -11.558 -4.923 1200 2HH1 ARG 151 HH12 ARG 151 264.485 -12.296 -4.922 1201 1HH2 ARG 151 HH21 ARG 151 266.113 -9.529 -3.537 1202 2HH2 ARG 151 HH22 ARG 151 266.299 -11.144 -4.134 1203 H GLU 152 HN GLU 152 262.473 -4.316 -6.891 1204 HA GLU 152 HA GLU 152 259.977 -3.275 -7.931 1205 1HB GLU 152 HB2 GLU 152 261.401 -1.933 -9.413 1206 2HB GLU 152 HB1 GLU 152 261.888 -1.773 -7.731 1207 1HG GLU 152 HG2 GLU 152 263.462 -3.830 -8.563 1208 2HG GLU 152 HG1 GLU 152 263.348 -2.848 -10.023 1209 H VAL 153 HN VAL 153 259.078 -3.728 -9.900 1210 HA VAL 153 HA VAL 153 260.331 -5.900 -11.451 1211 HB VAL 153 HB VAL 153 257.965 -6.560 -12.077 1212 1HG1 VAL 153 HG11 VAL 153 257.616 -7.845 -10.002 1213 2HG1 VAL 153 HG12 VAL 153 258.840 -6.856 -9.206 1214 3HG1 VAL 153 HG13 VAL 153 259.289 -7.898 -10.557 1215 1HG2 VAL 153 HG21 VAL 153 256.138 -5.671 -11.067 1216 2HG2 VAL 153 HG22 VAL 153 257.195 -4.264 -10.949 1217 3HG2 VAL 153 HG23 VAL 153 256.997 -5.335 -9.563 1218 H ASP 154 HN ASP 154 259.709 -5.971 -13.731 1219 HA ASP 154 HA ASP 154 258.593 -3.544 -14.868 1220 1HB ASP 154 HB2 ASP 154 261.477 -4.285 -15.047 1221 2HB ASP 154 HB1 ASP 154 260.710 -3.593 -16.474 1222 H THR 155 HN THR 155 260.255 -6.609 -15.564 1223 HA THR 155 HA THR 155 258.743 -6.898 -18.038 1224 HB THR 155 HB THR 155 260.695 -8.898 -16.916 1225 HG1 THR 155 HG1 THR 155 262.085 -7.321 -17.036 1226 1HG2 THR 155 HG21 THR 155 261.202 -8.995 -19.465 1227 2HG2 THR 155 HG22 THR 155 259.585 -8.306 -19.613 1228 3HG2 THR 155 HG23 THR 155 259.812 -9.854 -18.799 1229 H VAL 156 HN VAL 156 257.750 -9.053 -18.501 1230 HA VAL 156 HA VAL 156 256.893 -10.657 -16.278 1231 HB VAL 156 HB VAL 156 255.354 -8.767 -16.030 1232 1HG1 VAL 156 HG11 VAL 156 255.076 -9.133 -18.930 1233 2HG1 VAL 156 HG12 VAL 156 254.883 -7.685 -17.942 1234 3HG1 VAL 156 HG13 VAL 156 253.564 -8.849 -18.066 1235 1HG2 VAL 156 HG21 VAL 156 254.713 -11.389 -15.972 1236 2HG2 VAL 156 HG22 VAL 156 253.523 -10.794 -17.131 1237 3HG2 VAL 156 HG23 VAL 156 253.607 -10.095 -15.514 Start of MODEL 8 1 1H MET 1 HT1 MET 1 238.013 -21.344 2.921 2 2H MET 1 HT2 MET 1 236.966 -22.414 3.761 3 3H MET 1 HT3 MET 1 237.799 -22.950 2.358 4 HA MET 1 HA MET 1 239.077 -22.093 4.866 5 1HB MET 1 HB2 MET 1 237.584 -24.305 4.606 6 2HB MET 1 HB1 MET 1 239.083 -24.911 3.917 7 1HG MET 1 HG2 MET 1 240.151 -24.923 5.898 8 2HG MET 1 HG1 MET 1 239.334 -23.470 6.471 9 1HE MET 1 HE1 MET 1 239.092 -27.206 5.738 10 2HE MET 1 HE2 MET 1 238.152 -27.815 7.100 11 3HE MET 1 HE3 MET 1 239.745 -27.109 7.373 12 H GLY 2 HN GLY 2 240.623 -20.887 3.694 13 1HA GLY 2 HA2 GLY 2 242.526 -22.581 2.205 14 2HA GLY 2 HA1 GLY 2 242.066 -20.998 1.597 15 H ALA 3 HN ALA 3 243.631 -19.571 1.896 16 HA ALA 3 HA ALA 3 244.634 -18.902 4.443 17 1HB ALA 3 HB1 ALA 3 245.854 -21.055 4.066 18 2HB ALA 3 HB2 ALA 3 246.893 -19.656 4.339 19 3HB ALA 3 HB3 ALA 3 246.669 -20.283 2.706 20 H SER 4 HN SER 4 246.966 -17.669 3.938 21 HA SER 4 HA SER 4 247.808 -15.717 3.126 22 1HB SER 4 HB2 SER 4 248.147 -15.584 0.782 23 2HB SER 4 HB1 SER 4 248.138 -17.305 1.165 24 HG SER 4 HG SER 4 246.380 -17.546 0.027 25 H ARG 5 HN ARG 5 246.466 -14.356 4.255 26 HA ARG 5 HA ARG 5 243.896 -13.577 3.435 27 1HB ARG 5 HB2 ARG 5 245.963 -12.210 5.157 28 2HB ARG 5 HB1 ARG 5 244.359 -11.544 4.888 29 1HG ARG 5 HG2 ARG 5 244.658 -14.339 5.894 30 2HG ARG 5 HG1 ARG 5 244.835 -12.974 6.999 31 1HD ARG 5 HD2 ARG 5 242.631 -12.723 7.115 32 2HD ARG 5 HD1 ARG 5 242.514 -12.594 5.360 33 HE ARG 5 HE ARG 5 241.828 -14.779 5.275 34 1HH1 ARG 5 HH11 ARG 5 243.158 -14.128 8.435 35 2HH1 ARG 5 HH12 ARG 5 242.644 -15.641 9.101 36 1HH2 ARG 5 HH21 ARG 5 241.150 -16.769 6.150 37 2HH2 ARG 5 HH22 ARG 5 241.504 -17.141 7.804 38 H LEU 6 HN LEU 6 243.799 -13.052 1.298 39 HA LEU 6 HA LEU 6 245.604 -11.066 0.193 40 1HB LEU 6 HB2 LEU 6 244.309 -13.196 -0.902 41 2HB LEU 6 HB1 LEU 6 243.241 -11.889 -1.371 42 HG LEU 6 HG LEU 6 246.171 -11.624 -1.901 43 1HD1 LEU 6 HD11 LEU 6 244.450 -12.868 -3.978 44 2HD1 LEU 6 HD12 LEU 6 245.092 -13.898 -2.698 45 3HD1 LEU 6 HD13 LEU 6 246.192 -12.985 -3.731 46 1HD2 LEU 6 HD21 LEU 6 245.532 -10.081 -3.485 47 2HD2 LEU 6 HD22 LEU 6 244.272 -9.861 -2.271 48 3HD2 LEU 6 HD23 LEU 6 243.946 -10.816 -3.717 49 H TYR 7 HN TYR 7 245.260 -8.992 0.473 50 HA TYR 7 HA TYR 7 242.491 -8.002 0.642 51 1HB TYR 7 HB2 TYR 7 244.908 -7.349 2.280 52 2HB TYR 7 HB1 TYR 7 243.688 -6.106 2.020 53 HD1 TYR 7 HD1 TYR 7 242.233 -5.868 3.783 54 HD2 TYR 7 HD2 TYR 7 243.660 -9.762 2.835 55 HE1 TYR 7 HE1 TYR 7 240.888 -6.802 5.619 56 HE2 TYR 7 HE2 TYR 7 242.319 -10.707 4.666 57 HH TYR 7 HH TYR 7 240.030 -9.825 5.916 58 H THR 8 HN THR 8 242.655 -5.431 0.443 59 HA THR 8 HA THR 8 244.259 -4.817 -1.958 60 HB THR 8 HB THR 8 242.385 -3.652 -2.907 61 HG1 THR 8 HG1 THR 8 240.305 -4.022 -1.589 62 1HG2 THR 8 HG21 THR 8 240.593 -5.490 -2.911 63 2HG2 THR 8 HG22 THR 8 241.747 -6.407 -1.943 64 3HG2 THR 8 HG23 THR 8 242.186 -5.868 -3.562 65 H LEU 9 HN LEU 9 244.399 -2.432 -2.359 66 HA LEU 9 HA LEU 9 244.056 -0.692 -0.075 67 1HB LEU 9 HB2 LEU 9 246.226 -1.915 0.297 68 2HB LEU 9 HB1 LEU 9 246.825 -1.171 -1.170 69 HG LEU 9 HG LEU 9 245.974 0.306 1.319 70 1HD1 LEU 9 HD11 LEU 9 248.147 -1.105 1.264 71 2HD1 LEU 9 HD12 LEU 9 248.204 0.553 1.861 72 3HD1 LEU 9 HD13 LEU 9 248.748 0.187 0.225 73 1HD2 LEU 9 HD21 LEU 9 245.574 1.831 -0.366 74 2HD2 LEU 9 HD22 LEU 9 246.874 1.206 -1.381 75 3HD2 LEU 9 HD23 LEU 9 247.255 2.168 0.047 76 H VAL 10 HN VAL 10 243.065 0.967 -1.116 77 HA VAL 10 HA VAL 10 244.217 1.853 -3.665 78 HB VAL 10 HB VAL 10 242.005 1.217 -4.079 79 1HG1 VAL 10 HG11 VAL 10 240.865 0.831 -2.206 80 2HG1 VAL 10 HG12 VAL 10 240.186 2.413 -2.576 81 3HG1 VAL 10 HG13 VAL 10 241.491 2.268 -1.401 82 1HG2 VAL 10 HG21 VAL 10 240.857 3.251 -4.693 83 2HG2 VAL 10 HG22 VAL 10 242.582 3.435 -4.994 84 3HG2 VAL 10 HG23 VAL 10 241.851 4.178 -3.573 85 H LEU 11 HN LEU 11 245.118 3.721 -3.806 86 HA LEU 11 HA LEU 11 244.506 5.808 -1.830 87 1HB LEU 11 HB2 LEU 11 246.989 4.466 -2.340 88 2HB LEU 11 HB1 LEU 11 247.149 6.149 -2.803 89 HG LEU 11 HG LEU 11 246.590 4.997 -0.084 90 1HD1 LEU 11 HD11 LEU 11 248.601 5.820 0.516 91 2HD1 LEU 11 HD12 LEU 11 248.416 7.279 -0.455 92 3HD1 LEU 11 HD13 LEU 11 248.919 5.771 -1.218 93 1HD2 LEU 11 HD21 LEU 11 246.363 7.493 0.573 94 2HD2 LEU 11 HD22 LEU 11 244.958 6.618 -0.037 95 3HD2 LEU 11 HD23 LEU 11 245.853 7.702 -1.102 96 H VAL 12 HN VAL 12 243.494 7.380 -2.929 97 HA VAL 12 HA VAL 12 243.890 7.652 -5.770 98 HB VAL 12 HB VAL 12 242.230 9.450 -4.015 99 1HG1 VAL 12 HG11 VAL 12 242.564 9.034 -6.920 100 2HG1 VAL 12 HG12 VAL 12 242.152 10.495 -6.021 101 3HG1 VAL 12 HG13 VAL 12 240.916 9.278 -6.342 102 1HG2 VAL 12 HG21 VAL 12 240.857 7.755 -3.591 103 2HG2 VAL 12 HG22 VAL 12 241.899 6.657 -4.494 104 3HG2 VAL 12 HG23 VAL 12 240.614 7.533 -5.323 105 H LEU 13 HN LEU 13 246.079 8.273 -5.832 106 HA LEU 13 HA LEU 13 246.733 10.949 -4.812 107 1HB LEU 13 HB2 LEU 13 248.201 8.735 -4.685 108 2HB LEU 13 HB1 LEU 13 248.737 9.316 -6.256 109 HG LEU 13 HG LEU 13 248.673 11.450 -4.324 110 1HD1 LEU 13 HD11 LEU 13 250.836 9.576 -3.645 111 2HD1 LEU 13 HD12 LEU 13 249.229 9.195 -3.027 112 3HD1 LEU 13 HD13 LEU 13 249.980 10.743 -2.639 113 1HD2 LEU 13 HD21 LEU 13 251.095 11.571 -5.052 114 2HD2 LEU 13 HD22 LEU 13 249.860 11.784 -6.293 115 3HD2 LEU 13 HD23 LEU 13 250.709 10.245 -6.147 116 H GLN 14 HN GLN 14 247.823 12.450 -6.238 117 HA GLN 14 HA GLN 14 247.309 12.064 -9.099 118 1HB GLN 14 HB2 GLN 14 245.849 13.820 -7.398 119 2HB GLN 14 HB1 GLN 14 246.847 14.811 -8.453 120 1HG GLN 14 HG2 GLN 14 245.541 14.419 -10.202 121 2HG GLN 14 HG1 GLN 14 245.547 12.681 -9.911 122 1HE2 GLN 14 HE21 GLN 14 243.367 14.407 -10.761 123 2HE2 GLN 14 HE22 GLN 14 242.116 14.222 -9.584 124 HA PRO 15 HA PRO 15 251.347 13.741 -9.637 125 1HB PRO 15 HB2 PRO 15 251.103 15.185 -11.929 126 2HB PRO 15 HB1 PRO 15 251.145 13.419 -11.895 127 1HG PRO 15 HG2 PRO 15 248.789 15.255 -12.077 128 2HG PRO 15 HG1 PRO 15 249.112 13.757 -12.970 129 1HD PRO 15 HD2 PRO 15 247.440 13.842 -10.850 130 2HD PRO 15 HD1 PRO 15 248.434 12.418 -11.215 131 H GLN 16 HN GLN 16 249.300 15.387 -8.113 132 HA GLN 16 HA GLN 16 250.916 17.726 -7.835 133 1HB GLN 16 HB2 GLN 16 249.060 19.335 -8.249 134 2HB GLN 16 HB1 GLN 16 249.592 18.497 -9.700 135 1HG GLN 16 HG2 GLN 16 247.621 16.855 -8.971 136 2HG GLN 16 HG1 GLN 16 247.022 18.349 -8.252 137 1HE2 GLN 16 HE21 GLN 16 246.219 16.644 -10.622 138 2HE2 GLN 16 HE22 GLN 16 246.061 17.775 -11.919 139 H ARG 17 HN ARG 17 247.938 16.019 -7.056 140 HA ARG 17 HA ARG 17 248.332 16.731 -4.245 141 1HB ARG 17 HB2 ARG 17 245.761 16.907 -4.106 142 2HB ARG 17 HB1 ARG 17 246.650 18.273 -4.764 143 1HG ARG 17 HG2 ARG 17 245.378 18.188 -6.569 144 2HG ARG 17 HG1 ARG 17 246.044 16.597 -6.939 145 1HD ARG 17 HD2 ARG 17 244.200 15.516 -6.226 146 2HD ARG 17 HD1 ARG 17 243.948 16.625 -4.879 147 HE ARG 17 HE ARG 17 242.418 17.702 -6.168 148 1HH1 ARG 17 HH11 ARG 17 244.667 16.087 -8.293 149 2HH1 ARG 17 HH12 ARG 17 243.834 16.558 -9.736 150 1HH2 ARG 17 HH21 ARG 17 241.321 18.322 -8.066 151 2HH2 ARG 17 HH22 ARG 17 241.935 17.827 -9.607 152 H VAL 18 HN VAL 18 247.181 15.274 -2.760 153 HA VAL 18 HA VAL 18 246.578 12.654 -3.974 154 HB VAL 18 HB VAL 18 248.685 12.306 -3.047 155 1HG1 VAL 18 HG11 VAL 18 248.657 12.971 -0.353 156 2HG1 VAL 18 HG12 VAL 18 247.880 14.337 -1.152 157 3HG1 VAL 18 HG13 VAL 18 249.497 13.831 -1.642 158 1HG2 VAL 18 HG21 VAL 18 248.340 10.746 -1.230 159 2HG2 VAL 18 HG22 VAL 18 247.034 10.600 -2.406 160 3HG2 VAL 18 HG23 VAL 18 246.762 11.457 -0.889 161 H LEU 19 HN LEU 19 245.171 11.289 -2.652 162 HA LEU 19 HA LEU 19 243.497 12.836 -0.783 163 1HB LEU 19 HB2 LEU 19 242.334 12.437 -2.901 164 2HB LEU 19 HB1 LEU 19 242.614 10.715 -2.738 165 HG LEU 19 HG LEU 19 241.136 10.572 -0.855 166 1HD1 LEU 19 HD11 LEU 19 241.523 13.477 -0.794 167 2HD1 LEU 19 HD12 LEU 19 241.178 12.346 0.515 168 3HD1 LEU 19 HD13 LEU 19 239.868 12.947 -0.501 169 1HD2 LEU 19 HD21 LEU 19 240.027 12.168 -3.152 170 2HD2 LEU 19 HD22 LEU 19 239.018 11.471 -1.884 171 3HD2 LEU 19 HD23 LEU 19 239.985 10.420 -2.919 172 H LEU 20 HN LEU 20 243.739 12.091 1.214 173 HA LEU 20 HA LEU 20 244.253 9.216 1.591 174 1HB LEU 20 HB2 LEU 20 245.391 11.617 2.787 175 2HB LEU 20 HB1 LEU 20 244.845 10.466 3.992 176 HG LEU 20 HG LEU 20 246.682 9.700 1.732 177 1HD1 LEU 20 HD11 LEU 20 247.360 10.687 4.494 178 2HD1 LEU 20 HD12 LEU 20 247.847 11.387 2.950 179 3HD1 LEU 20 HD13 LEU 20 248.489 9.822 3.450 180 1HD2 LEU 20 HD21 LEU 20 246.739 8.289 4.304 181 2HD2 LEU 20 HD22 LEU 20 246.755 7.656 2.658 182 3HD2 LEU 20 HD23 LEU 20 245.229 8.130 3.405 183 H GLY 21 HN GLY 21 242.998 8.030 2.964 184 1HA GLY 21 HA2 GLY 21 240.476 9.265 3.758 185 2HA GLY 21 HA1 GLY 21 240.819 7.543 3.707 186 H MET 22 HN MET 22 240.036 9.887 5.757 187 HA MET 22 HA MET 22 241.746 8.892 7.933 188 1HB MET 22 HB2 MET 22 241.976 11.251 7.774 189 2HB MET 22 HB1 MET 22 240.244 11.483 7.591 190 1HG MET 22 HG2 MET 22 239.837 10.987 9.863 191 2HG MET 22 HG1 MET 22 241.473 10.376 10.096 192 1HE MET 22 HE1 MET 22 243.364 11.975 8.986 193 2HE MET 22 HE2 MET 22 243.655 12.240 10.704 194 3HE MET 22 HE3 MET 22 243.571 13.612 9.603 195 H LYS 23 HN LYS 23 240.834 8.065 9.799 196 HA LYS 23 HA LYS 23 238.089 7.172 9.542 197 1HB LYS 23 HB2 LYS 23 240.450 6.405 11.136 198 2HB LYS 23 HB1 LYS 23 238.907 6.230 11.959 199 1HG LYS 23 HG2 LYS 23 238.899 5.170 9.242 200 2HG LYS 23 HG1 LYS 23 240.062 4.380 10.309 201 1HD LYS 23 HD2 LYS 23 237.148 4.793 10.967 202 2HD LYS 23 HD1 LYS 23 237.819 3.304 10.296 203 1HE LYS 23 HE2 LYS 23 239.465 3.553 12.351 204 2HE LYS 23 HE1 LYS 23 238.119 4.478 13.012 205 1HZ LYS 23 HZ1 LYS 23 238.402 1.668 12.759 206 2HZ LYS 23 HZ2 LYS 23 237.010 2.186 11.951 207 3HZ LYS 23 HZ3 LYS 23 237.222 2.550 13.589 208 H LYS 24 HN LYS 24 236.439 7.653 11.030 209 HA LYS 24 HA LYS 24 236.781 10.243 12.287 210 1HB LYS 24 HB2 LYS 24 234.574 8.753 11.178 211 2HB LYS 24 HB1 LYS 24 234.181 9.280 12.808 212 1HG LYS 24 HG2 LYS 24 233.499 11.139 11.756 213 2HG LYS 24 HG1 LYS 24 235.213 11.556 11.814 214 1HD LYS 24 HD2 LYS 24 235.556 10.814 9.585 215 2HD LYS 24 HD1 LYS 24 233.962 10.060 9.523 216 1HE LYS 24 HE2 LYS 24 233.992 12.167 8.287 217 2HE LYS 24 HE1 LYS 24 232.907 12.254 9.674 218 1HZ LYS 24 HZ1 LYS 24 234.227 13.740 10.734 219 2HZ LYS 24 HZ2 LYS 24 234.657 14.136 9.147 220 3HZ LYS 24 HZ3 LYS 24 235.663 13.137 10.069 221 H ARG 25 HN ARG 25 236.262 6.904 13.200 222 HA ARG 25 HA ARG 25 237.240 7.398 15.812 223 1HB ARG 25 HB2 ARG 25 235.029 6.436 16.864 224 2HB ARG 25 HB1 ARG 25 235.203 8.158 16.562 225 1HG ARG 25 HG2 ARG 25 233.007 7.200 15.889 226 2HG ARG 25 HG1 ARG 25 233.872 8.027 14.592 227 1HD ARG 25 HD2 ARG 25 234.390 6.054 13.503 228 2HD ARG 25 HD1 ARG 25 234.197 5.080 14.959 229 HE ARG 25 HE ARG 25 232.150 5.827 13.088 230 1HH1 ARG 25 HH11 ARG 25 232.798 4.861 16.377 231 2HH1 ARG 25 HH12 ARG 25 231.205 4.235 16.640 232 1HH2 ARG 25 HH21 ARG 25 230.053 5.005 13.431 233 2HH2 ARG 25 HH22 ARG 25 229.646 4.317 14.967 234 H GLY 26 HN GLY 26 237.622 5.497 17.015 235 1HA GLY 26 HA2 GLY 26 237.325 3.092 17.271 236 2HA GLY 26 HA1 GLY 26 237.164 2.992 15.523 237 H PHE 27 HN PHE 27 238.862 1.998 14.676 238 HA PHE 27 HA PHE 27 241.491 2.358 15.922 239 1HB PHE 27 HB2 PHE 27 240.443 0.296 13.978 240 2HB PHE 27 HB1 PHE 27 242.135 0.408 14.450 241 HD1 PHE 27 HD1 PHE 27 238.951 -0.947 15.242 242 HD2 PHE 27 HD2 PHE 27 242.663 0.236 16.953 243 HE1 PHE 27 HE1 PHE 27 238.488 -2.352 17.208 244 HE2 PHE 27 HE2 PHE 27 242.207 -1.166 18.923 245 HZ PHE 27 HZ PHE 27 240.118 -2.463 19.052 246 H GLY 28 HN GLY 28 241.458 4.584 14.938 247 1HA GLY 28 HA2 GLY 28 243.291 4.992 13.030 248 2HA GLY 28 HA1 GLY 28 241.860 4.678 12.062 249 H ALA 29 HN ALA 29 240.286 6.018 14.371 250 HA ALA 29 HA ALA 29 239.650 8.395 13.284 251 1HB ALA 29 HB1 ALA 29 239.868 8.673 16.159 252 2HB ALA 29 HB2 ALA 29 239.094 7.173 15.646 253 3HB ALA 29 HB3 ALA 29 238.456 8.726 15.104 254 H GLY 30 HN GLY 30 240.600 10.322 12.902 255 1HA GLY 30 HA2 GLY 30 241.983 12.159 13.270 256 2HA GLY 30 HA1 GLY 30 242.693 11.318 14.638 257 H ARG 31 HN ARG 31 242.841 9.099 12.271 258 HA ARG 31 HA ARG 31 245.500 10.017 11.392 259 1HB ARG 31 HB2 ARG 31 244.612 7.140 11.500 260 2HB ARG 31 HB1 ARG 31 246.249 7.769 11.373 261 1HG ARG 31 HG2 ARG 31 246.057 8.661 13.659 262 2HG ARG 31 HG1 ARG 31 244.448 7.948 13.779 263 1HD ARG 31 HD2 ARG 31 246.067 6.501 14.841 264 2HD ARG 31 HD1 ARG 31 245.432 5.723 13.392 265 HE ARG 31 HE ARG 31 248.139 6.668 13.833 266 1HH1 ARG 31 HH11 ARG 31 245.779 5.517 11.526 267 2HH1 ARG 31 HH12 ARG 31 246.969 5.051 10.359 268 1HH2 ARG 31 HH21 ARG 31 249.698 6.053 12.296 269 2HH2 ARG 31 HH22 ARG 31 249.191 5.354 10.794 270 H TRP 32 HN TRP 32 246.174 9.341 9.234 271 HA TRP 32 HA TRP 32 243.868 9.116 7.411 272 1HB TRP 32 HB2 TRP 32 246.452 9.989 6.278 273 2HB TRP 32 HB1 TRP 32 244.828 10.588 5.975 274 HD1 TRP 32 HD1 TRP 32 247.421 10.817 8.870 275 HE1 TRP 32 HE1 TRP 32 247.309 13.200 9.831 276 HE3 TRP 32 HE3 TRP 32 243.663 12.698 5.958 277 HZ2 TRP 32 HZ2 TRP 32 245.835 15.566 9.411 278 HZ3 TRP 32 HZ3 TRP 32 242.963 15.030 6.302 279 HH2 TRP 32 HH2 TRP 32 244.026 16.434 7.992 280 H ASN 33 HN ASN 33 244.077 7.770 5.541 281 HA ASN 33 HA ASN 33 246.317 6.185 4.975 282 1HB ASN 33 HB2 ASN 33 245.534 3.992 5.823 283 2HB ASN 33 HB1 ASN 33 245.910 5.122 7.121 284 1HD2 ASN 33 HD21 ASN 33 243.342 3.563 5.333 285 2HD2 ASN 33 HD22 ASN 33 242.107 3.812 6.516 286 H GLY 34 HN GLY 34 245.893 4.505 3.385 287 1HA GLY 34 HA2 GLY 34 244.011 5.323 1.449 288 2HA GLY 34 HA1 GLY 34 244.933 3.826 1.416 289 H PHE 35 HN PHE 35 242.700 3.301 0.406 290 HA PHE 35 HA PHE 35 240.888 2.420 2.555 291 1HB PHE 35 HB2 PHE 35 239.948 2.482 -0.269 292 2HB PHE 35 HB1 PHE 35 239.064 2.792 1.215 293 HD1 PHE 35 HD1 PHE 35 239.424 4.988 2.400 294 HD2 PHE 35 HD2 PHE 35 240.813 4.239 -1.552 295 HE1 PHE 35 HE1 PHE 35 239.615 7.410 2.013 296 HE2 PHE 35 HE2 PHE 35 241.007 6.660 -1.946 297 HZ PHE 35 HZ PHE 35 240.407 8.249 -0.163 298 H GLY 36 HN GLY 36 241.974 0.486 2.972 299 1HA GLY 36 HA2 GLY 36 242.329 -1.381 0.756 300 2HA GLY 36 HA1 GLY 36 242.922 -1.595 2.397 301 H GLY 37 HN GLY 37 241.292 -3.305 0.519 302 1HA GLY 37 HA2 GLY 37 239.282 -4.056 2.519 303 2HA GLY 37 HA1 GLY 37 238.751 -3.778 0.868 304 H LYS 38 HN LYS 38 238.745 -6.222 2.564 305 HA LYS 38 HA LYS 38 240.702 -8.009 1.515 306 1HB LYS 38 HB2 LYS 38 239.415 -9.761 2.609 307 2HB LYS 38 HB1 LYS 38 239.599 -8.380 3.684 308 1HG LYS 38 HG2 LYS 38 237.272 -7.692 2.697 309 2HG LYS 38 HG1 LYS 38 237.164 -9.413 2.319 310 1HD LYS 38 HD2 LYS 38 237.984 -9.600 4.850 311 2HD LYS 38 HD1 LYS 38 237.175 -8.034 4.944 312 1HE LYS 38 HE2 LYS 38 235.330 -9.460 3.581 313 2HE LYS 38 HE1 LYS 38 236.054 -10.733 4.563 314 1HZ LYS 38 HZ1 LYS 38 234.427 -8.466 5.371 315 2HZ LYS 38 HZ2 LYS 38 235.722 -8.839 6.393 316 3HZ LYS 38 HZ3 LYS 38 234.551 -10.010 6.052 317 H VAL 39 HN VAL 39 240.341 -9.801 0.112 318 HA VAL 39 HA VAL 39 238.562 -9.143 -2.096 319 HB VAL 39 HB VAL 39 240.338 -11.570 -2.028 320 1HG1 VAL 39 HG11 VAL 39 239.083 -11.586 -3.968 321 2HG1 VAL 39 HG12 VAL 39 240.548 -10.755 -4.491 322 3HG1 VAL 39 HG13 VAL 39 239.095 -9.829 -4.115 323 1HG2 VAL 39 HG21 VAL 39 241.377 -8.971 -3.060 324 2HG2 VAL 39 HG22 VAL 39 242.256 -10.409 -2.541 325 3HG2 VAL 39 HG23 VAL 39 241.523 -9.345 -1.344 326 H GLN 40 HN GLN 40 236.501 -9.708 -1.676 327 HA GLN 40 HA GLN 40 235.455 -11.595 -0.044 328 1HB GLN 40 HB2 GLN 40 234.324 -9.893 -1.690 329 2HB GLN 40 HB1 GLN 40 234.219 -11.289 -2.752 330 1HG GLN 40 HG2 GLN 40 233.278 -12.247 -0.347 331 2HG GLN 40 HG1 GLN 40 232.649 -10.602 -0.412 332 1HE2 GLN 40 HE21 GLN 40 230.551 -11.545 -0.570 333 2HE2 GLN 40 HE22 GLN 40 229.973 -12.140 -2.084 334 H GLU 41 HN GLU 41 234.610 -13.728 -0.300 335 HA GLU 41 HA GLU 41 236.360 -15.636 -1.195 336 1HB GLU 41 HB2 GLU 41 233.393 -15.696 -0.752 337 2HB GLU 41 HB1 GLU 41 234.231 -17.123 -1.345 338 1HG GLU 41 HG2 GLU 41 234.724 -15.680 1.248 339 2HG GLU 41 HG1 GLU 41 233.992 -17.270 1.035 340 H GLY 42 HN GLY 42 237.209 -15.354 -3.216 341 1HA GLY 42 HA2 GLY 42 237.249 -16.006 -5.463 342 2HA GLY 42 HA1 GLY 42 235.498 -16.161 -5.426 343 H GLU 43 HN GLU 43 237.667 -13.441 -4.660 344 HA GLU 43 HA GLU 43 236.330 -11.890 -6.767 345 1HB GLU 43 HB2 GLU 43 235.658 -11.305 -4.363 346 2HB GLU 43 HB1 GLU 43 237.297 -10.712 -4.163 347 1HG GLU 43 HG2 GLU 43 236.980 -8.946 -5.605 348 2HG GLU 43 HG1 GLU 43 235.612 -9.715 -6.410 349 H THR 44 HN THR 44 237.698 -9.862 -7.238 350 HA THR 44 HA THR 44 240.496 -10.733 -7.420 351 HB THR 44 HB THR 44 240.617 -9.220 -9.380 352 HG1 THR 44 HG1 THR 44 238.745 -8.310 -10.168 353 1HG2 THR 44 HG21 THR 44 240.229 -11.182 -10.370 354 2HG2 THR 44 HG22 THR 44 238.587 -10.577 -10.598 355 3HG2 THR 44 HG23 THR 44 238.962 -11.613 -9.222 356 H ILE 45 HN ILE 45 242.139 -9.350 -6.850 357 HA ILE 45 HA ILE 45 241.811 -7.638 -4.747 358 HB ILE 45 HB ILE 45 243.933 -7.612 -6.886 359 1HG1 ILE 45 HG12 ILE 45 244.650 -8.430 -4.188 360 2HG1 ILE 45 HG11 ILE 45 243.387 -9.431 -4.899 361 1HG2 ILE 45 HG21 ILE 45 243.462 -5.612 -4.930 362 2HG2 ILE 45 HG22 ILE 45 244.804 -5.747 -6.062 363 3HG2 ILE 45 HG23 ILE 45 244.912 -6.497 -4.470 364 1HD1 ILE 45 HD11 ILE 45 245.037 -10.572 -5.846 365 2HD1 ILE 45 HD12 ILE 45 246.222 -9.319 -5.479 366 3HD1 ILE 45 HD13 ILE 45 245.227 -9.194 -6.930 367 H GLU 46 HN GLU 46 241.405 -6.957 -8.151 368 HA GLU 46 HA GLU 46 241.288 -4.098 -7.821 369 1HB GLU 46 HB2 GLU 46 241.816 -5.615 -9.958 370 2HB GLU 46 HB1 GLU 46 240.087 -5.414 -10.204 371 1HG GLU 46 HG2 GLU 46 240.339 -3.004 -10.192 372 2HG GLU 46 HG1 GLU 46 242.064 -3.171 -9.869 373 H ASP 47 HN ASP 47 239.049 -6.776 -7.776 374 HA ASP 47 HA ASP 47 236.727 -5.077 -7.965 375 1HB ASP 47 HB2 ASP 47 237.224 -7.998 -7.686 376 2HB ASP 47 HB1 ASP 47 235.679 -7.386 -7.102 377 H GLY 48 HN GLY 48 238.590 -6.708 -5.484 378 1HA GLY 48 HA2 GLY 48 236.786 -6.112 -3.340 379 2HA GLY 48 HA1 GLY 48 238.451 -6.655 -3.179 380 H ALA 49 HN ALA 49 239.580 -4.520 -4.755 381 HA ALA 49 HA ALA 49 239.793 -2.527 -2.700 382 1HB ALA 49 HB1 ALA 49 240.925 -1.946 -5.360 383 2HB ALA 49 HB2 ALA 49 241.516 -3.408 -4.577 384 3HB ALA 49 HB3 ALA 49 241.668 -1.854 -3.764 385 H ARG 50 HN ARG 50 238.251 -2.847 -5.831 386 HA ARG 50 HA ARG 50 237.482 -0.123 -6.074 387 1HB ARG 50 HB2 ARG 50 236.798 -2.671 -7.460 388 2HB ARG 50 HB1 ARG 50 235.711 -1.306 -7.668 389 1HG ARG 50 HG2 ARG 50 237.907 -0.016 -8.237 390 2HG ARG 50 HG1 ARG 50 238.533 -1.633 -8.559 391 1HD ARG 50 HD2 ARG 50 236.401 -1.930 -9.979 392 2HD ARG 50 HD1 ARG 50 236.296 -0.171 -9.914 393 HE ARG 50 HE ARG 50 238.866 -0.735 -10.718 394 1HH1 ARG 50 HH11 ARG 50 235.653 -1.397 -11.906 395 2HH1 ARG 50 HH12 ARG 50 236.138 -1.428 -13.568 396 1HH2 ARG 50 HH21 ARG 50 239.507 -0.777 -12.903 397 2HH2 ARG 50 HH22 ARG 50 238.326 -1.077 -14.134 398 H ARG 51 HN ARG 51 235.640 -3.056 -5.241 399 HA ARG 51 HA ARG 51 233.238 -1.744 -4.614 400 1HB ARG 51 HB2 ARG 51 233.938 -4.325 -4.886 401 2HB ARG 51 HB1 ARG 51 233.894 -4.227 -3.131 402 1HG ARG 51 HG2 ARG 51 231.733 -4.757 -3.427 403 2HG ARG 51 HG1 ARG 51 231.563 -3.024 -3.721 404 1HD ARG 51 HD2 ARG 51 232.109 -3.672 -6.185 405 2HD ARG 51 HD1 ARG 51 231.618 -5.286 -5.675 406 HE ARG 51 HE ARG 51 229.915 -3.044 -6.164 407 1HH1 ARG 51 HH11 ARG 51 230.250 -5.964 -4.281 408 2HH1 ARG 51 HH12 ARG 51 228.546 -6.164 -4.056 409 1HH2 ARG 51 HH21 ARG 51 227.672 -3.306 -5.869 410 2HH2 ARG 51 HH22 ARG 51 227.081 -4.655 -4.958 411 H GLU 52 HN GLU 52 236.082 -2.426 -2.686 412 HA GLU 52 HA GLU 52 234.819 -1.570 -0.226 413 1HB GLU 52 HB2 GLU 52 237.673 -2.336 -0.865 414 2HB GLU 52 HB1 GLU 52 237.111 -1.886 0.739 415 1HG GLU 52 HG2 GLU 52 235.541 -3.999 -0.543 416 2HG GLU 52 HG1 GLU 52 237.222 -4.423 -0.222 417 H LEU 53 HN LEU 53 236.531 -0.163 -2.825 418 HA LEU 53 HA LEU 53 237.630 2.062 -1.425 419 1HB LEU 53 HB2 LEU 53 238.673 1.515 -3.458 420 2HB LEU 53 HB1 LEU 53 237.146 1.415 -4.317 421 HG LEU 53 HG LEU 53 236.894 3.854 -4.118 422 1HD1 LEU 53 HD11 LEU 53 238.281 5.172 -2.932 423 2HD1 LEU 53 HD12 LEU 53 239.704 4.205 -3.316 424 3HD1 LEU 53 HD13 LEU 53 238.597 3.680 -2.049 425 1HD2 LEU 53 HD21 LEU 53 239.184 2.579 -5.508 426 2HD2 LEU 53 HD22 LEU 53 239.109 4.341 -5.494 427 3HD2 LEU 53 HD23 LEU 53 237.775 3.408 -6.170 428 H GLN 54 HN GLN 54 234.796 1.592 -3.499 429 HA GLN 54 HA GLN 54 233.822 4.222 -3.380 430 1HB GLN 54 HB2 GLN 54 232.811 2.978 -5.034 431 2HB GLN 54 HB1 GLN 54 232.644 1.557 -4.015 432 1HG GLN 54 HG2 GLN 54 230.807 2.597 -2.821 433 2HG GLN 54 HG1 GLN 54 231.000 4.068 -3.773 434 1HE2 GLN 54 HE21 GLN 54 230.737 0.580 -4.402 435 2HE2 GLN 54 HE22 GLN 54 229.549 0.722 -5.649 436 H GLU 55 HN GLU 55 233.655 1.596 -1.135 437 HA GLU 55 HA GLU 55 231.510 2.723 0.423 438 1HB GLU 55 HB2 GLU 55 233.227 0.289 0.618 439 2HB GLU 55 HB1 GLU 55 232.339 0.824 2.038 440 1HG GLU 55 HG2 GLU 55 230.405 0.904 0.132 441 2HG GLU 55 HG1 GLU 55 231.385 -0.456 -0.411 442 H GLU 56 HN GLU 56 234.966 2.964 0.425 443 HA GLU 56 HA GLU 56 235.123 3.710 3.194 444 1HB GLU 56 HB2 GLU 56 237.008 3.207 1.015 445 2HB GLU 56 HB1 GLU 56 237.516 4.480 2.119 446 1HG GLU 56 HG2 GLU 56 236.493 2.075 3.435 447 2HG GLU 56 HG1 GLU 56 237.957 1.826 2.486 448 H SER 57 HN SER 57 235.341 5.497 0.115 449 HA SER 57 HA SER 57 234.964 7.956 1.698 450 1HB SER 57 HB2 SER 57 236.602 9.107 0.527 451 2HB SER 57 HB1 SER 57 237.314 7.499 0.630 452 HG SER 57 HG SER 57 237.489 7.952 -1.470 453 H GLY 58 HN GLY 58 233.124 6.150 0.054 454 1HA GLY 58 HA2 GLY 58 231.358 6.416 -1.389 455 2HA GLY 58 HA1 GLY 58 231.401 8.106 -0.912 456 H LEU 59 HN LEU 59 234.285 6.944 -2.322 457 HA LEU 59 HA LEU 59 233.618 8.316 -4.833 458 1HB LEU 59 HB2 LEU 59 236.270 7.862 -3.471 459 2HB LEU 59 HB1 LEU 59 236.101 8.531 -5.083 460 HG LEU 59 HG LEU 59 235.338 9.773 -2.455 461 1HD1 LEU 59 HD11 LEU 59 237.602 9.943 -3.892 462 2HD1 LEU 59 HD12 LEU 59 236.979 11.254 -2.888 463 3HD1 LEU 59 HD13 LEU 59 236.674 11.252 -4.625 464 1HD2 LEU 59 HD21 LEU 59 234.347 11.627 -3.829 465 2HD2 LEU 59 HD22 LEU 59 233.397 10.142 -3.783 466 3HD2 LEU 59 HD23 LEU 59 234.365 10.526 -5.206 467 H THR 60 HN THR 60 233.185 6.993 -6.416 468 HA THR 60 HA THR 60 234.321 4.301 -6.435 469 HB THR 60 HB THR 60 232.453 5.017 -8.581 470 HG1 THR 60 HG1 THR 60 231.703 5.289 -5.870 471 1HG2 THR 60 HG21 THR 60 232.161 2.827 -8.455 472 2HG2 THR 60 HG22 THR 60 231.384 3.053 -6.889 473 3HG2 THR 60 HG23 THR 60 233.119 2.747 -6.977 474 H VAL 61 HN VAL 61 235.731 3.597 -7.976 475 HA VAL 61 HA VAL 61 236.679 5.645 -9.854 476 HB VAL 61 HB VAL 61 238.777 4.455 -9.956 477 1HG1 VAL 61 HG11 VAL 61 238.777 6.028 -8.237 478 2HG1 VAL 61 HG12 VAL 61 239.366 4.558 -7.460 479 3HG1 VAL 61 HG13 VAL 61 237.693 5.069 -7.230 480 1HG2 VAL 61 HG21 VAL 61 238.754 2.557 -7.963 481 2HG2 VAL 61 HG22 VAL 61 238.693 2.235 -9.695 482 3HG2 VAL 61 HG23 VAL 61 237.200 2.313 -8.760 483 H ASP 62 HN ASP 62 236.813 5.299 -11.997 484 HA ASP 62 HA ASP 62 235.274 3.118 -13.085 485 1HB ASP 62 HB2 ASP 62 235.232 5.478 -13.988 486 2HB ASP 62 HB1 ASP 62 236.860 5.201 -14.598 487 H ALA 63 HN ALA 63 238.578 3.797 -12.422 488 HA ALA 63 HA ALA 63 239.461 1.219 -13.009 489 1HB ALA 63 HB1 ALA 63 240.748 2.910 -15.043 490 2HB ALA 63 HB2 ALA 63 239.061 2.501 -15.355 491 3HB ALA 63 HB3 ALA 63 240.251 1.220 -15.118 492 H LEU 64 HN LEU 64 240.605 1.388 -11.111 493 HA LEU 64 HA LEU 64 242.274 3.547 -10.375 494 1HB LEU 64 HB2 LEU 64 242.462 0.634 -9.582 495 2HB LEU 64 HB1 LEU 64 243.284 1.958 -8.781 496 HG LEU 64 HG LEU 64 240.560 2.644 -8.799 497 1HD1 LEU 64 HD11 LEU 64 239.732 0.520 -9.175 498 2HD1 LEU 64 HD12 LEU 64 239.789 0.595 -7.414 499 3HD1 LEU 64 HD13 LEU 64 241.051 -0.259 -8.302 500 1HD2 LEU 64 HD21 LEU 64 241.640 1.453 -6.347 501 2HD2 LEU 64 HD22 LEU 64 240.977 3.061 -6.636 502 3HD2 LEU 64 HD23 LEU 64 242.648 2.706 -7.071 503 H HIS 65 HN HIS 65 244.735 2.711 -9.812 504 HA HIS 65 HA HIS 65 245.882 1.611 -12.279 505 1HB HIS 65 HB2 HIS 65 245.997 4.321 -11.599 506 2HB HIS 65 HB1 HIS 65 247.576 3.681 -11.155 507 HD1 HIS 65 HD1 HIS 65 249.226 3.522 -12.997 508 HD2 HIS 65 HD2 HIS 65 245.324 3.692 -14.413 509 HE1 HIS 65 HE1 HIS 65 249.425 3.647 -15.501 510 HE2 HIS 65 HE2 HIS 65 247.053 3.841 -16.330 511 H LYS 66 HN LYS 66 246.606 -0.289 -11.461 512 HA LYS 66 HA LYS 66 247.611 -0.710 -8.878 513 1HB LYS 66 HB2 LYS 66 248.644 -2.778 -9.868 514 2HB LYS 66 HB1 LYS 66 246.922 -2.602 -10.171 515 1HG LYS 66 HG2 LYS 66 248.003 -1.385 -12.360 516 2HG LYS 66 HG1 LYS 66 249.164 -2.675 -12.041 517 1HD LYS 66 HD2 LYS 66 247.730 -3.909 -13.272 518 2HD LYS 66 HD1 LYS 66 246.845 -4.026 -11.749 519 1HE LYS 66 HE2 LYS 66 245.119 -3.253 -12.965 520 2HE LYS 66 HE1 LYS 66 245.887 -1.686 -12.718 521 1HZ LYS 66 HZ1 LYS 66 245.815 -3.364 -15.118 522 2HZ LYS 66 HZ2 LYS 66 247.180 -2.398 -14.865 523 3HZ LYS 66 HZ3 LYS 66 245.649 -1.686 -14.970 524 H VAL 67 HN VAL 67 249.566 -0.392 -7.954 525 HA VAL 67 HA VAL 67 251.728 0.511 -9.754 526 HB VAL 67 HB VAL 67 252.551 1.931 -7.875 527 1HG1 VAL 67 HG11 VAL 67 249.809 2.508 -8.985 528 2HG1 VAL 67 HG12 VAL 67 251.361 2.947 -9.698 529 3HG1 VAL 67 HG13 VAL 67 250.838 3.700 -8.191 530 1HG2 VAL 67 HG21 VAL 67 250.730 2.549 -6.194 531 2HG2 VAL 67 HG22 VAL 67 251.584 1.026 -5.948 532 3HG2 VAL 67 HG23 VAL 67 249.966 1.028 -6.650 533 H GLY 68 HN GLY 68 251.118 -0.908 -6.530 534 1HA GLY 68 HA2 GLY 68 253.474 -2.599 -6.982 535 2HA GLY 68 HA1 GLY 68 253.427 -1.616 -5.530 536 H GLN 69 HN GLN 69 253.724 -4.310 -5.363 537 HA GLN 69 HA GLN 69 251.139 -5.158 -4.236 538 1HB GLN 69 HB2 GLN 69 253.162 -7.112 -5.299 539 2HB GLN 69 HB1 GLN 69 251.456 -7.373 -4.963 540 1HG GLN 69 HG2 GLN 69 251.215 -7.185 -7.172 541 2HG GLN 69 HG1 GLN 69 251.329 -5.451 -6.871 542 1HE2 GLN 69 HE21 GLN 69 252.072 -5.360 -9.086 543 2HE2 GLN 69 HE22 GLN 69 253.737 -5.663 -9.436 544 H ILE 70 HN ILE 70 251.297 -5.181 -2.093 545 HA ILE 70 HA ILE 70 253.911 -5.720 -0.871 546 HB ILE 70 HB ILE 70 251.425 -4.488 0.322 547 1HG1 ILE 70 HG12 ILE 70 254.093 -3.185 -0.217 548 2HG1 ILE 70 HG11 ILE 70 252.764 -3.144 -1.370 549 1HG2 ILE 70 HG21 ILE 70 252.635 -5.707 2.020 550 2HG2 ILE 70 HG22 ILE 70 252.863 -3.975 2.261 551 3HG2 ILE 70 HG23 ILE 70 254.147 -4.943 1.534 552 1HD1 ILE 70 HD11 ILE 70 253.083 -1.739 1.214 553 2HD1 ILE 70 HD12 ILE 70 251.456 -2.229 0.741 554 3HD1 ILE 70 HD13 ILE 70 252.402 -1.175 -0.311 555 H VAL 71 HN VAL 71 254.147 -7.191 0.802 556 HA VAL 71 HA VAL 71 251.941 -9.096 1.201 557 HB VAL 71 HB VAL 71 254.827 -9.948 1.058 558 1HG1 VAL 71 HG11 VAL 71 253.659 -12.157 0.551 559 2HG1 VAL 71 HG12 VAL 71 252.183 -11.364 1.099 560 3HG1 VAL 71 HG13 VAL 71 253.548 -11.543 2.201 561 1HG2 VAL 71 HG21 VAL 71 252.823 -10.190 -1.180 562 2HG2 VAL 71 HG22 VAL 71 254.527 -10.640 -1.207 563 3HG2 VAL 71 HG23 VAL 71 254.066 -8.941 -1.107 564 H PHE 72 HN PHE 72 251.866 -10.099 3.247 565 HA PHE 72 HA PHE 72 253.695 -8.994 5.263 566 1HB PHE 72 HB2 PHE 72 250.685 -9.153 5.413 567 2HB PHE 72 HB1 PHE 72 251.708 -8.887 6.821 568 HD1 PHE 72 HD1 PHE 72 250.425 -7.442 3.718 569 HD2 PHE 72 HD2 PHE 72 252.847 -6.791 7.156 570 HE1 PHE 72 HE1 PHE 72 250.439 -5.028 3.246 571 HE2 PHE 72 HE2 PHE 72 252.865 -4.373 6.687 572 HZ PHE 72 HZ PHE 72 251.658 -3.490 4.732 573 H GLU 73 HN GLU 73 254.728 -10.566 6.256 574 HA GLU 73 HA GLU 73 253.476 -13.219 6.415 575 1HB GLU 73 HB2 GLU 73 255.650 -13.176 5.313 576 2HB GLU 73 HB1 GLU 73 256.367 -12.380 6.707 577 1HG GLU 73 HG2 GLU 73 256.951 -14.407 7.388 578 2HG GLU 73 HG1 GLU 73 255.253 -14.645 7.795 579 H PHE 74 HN PHE 74 252.806 -13.995 8.320 580 HA PHE 74 HA PHE 74 253.420 -12.428 10.719 581 1HB PHE 74 HB2 PHE 74 251.209 -14.287 9.943 582 2HB PHE 74 HB1 PHE 74 251.578 -14.076 11.651 583 HD1 PHE 74 HD1 PHE 74 251.892 -11.491 12.320 584 HD2 PHE 74 HD2 PHE 74 249.570 -12.956 9.069 585 HE1 PHE 74 HE1 PHE 74 250.549 -9.430 12.356 586 HE2 PHE 74 HE2 PHE 74 248.223 -10.897 9.099 587 HZ PHE 74 HZ PHE 74 248.712 -9.130 10.743 588 H VAL 75 HN VAL 75 254.502 -13.161 12.398 589 HA VAL 75 HA VAL 75 256.019 -15.582 12.056 590 HB VAL 75 HB VAL 75 256.207 -14.287 14.676 591 1HG1 VAL 75 HG11 VAL 75 258.403 -14.814 14.462 592 2HG1 VAL 75 HG12 VAL 75 258.442 -14.419 12.742 593 3HG1 VAL 75 HG13 VAL 75 257.740 -15.945 13.282 594 1HG2 VAL 75 HG21 VAL 75 256.480 -12.674 12.185 595 2HG2 VAL 75 HG22 VAL 75 257.597 -12.391 13.520 596 3HG2 VAL 75 HG23 VAL 75 255.861 -12.207 13.769 597 H GLY 76 HN GLY 76 255.342 -17.514 12.671 598 1HA GLY 76 HA2 GLY 76 254.644 -19.068 14.320 599 2HA GLY 76 HA1 GLY 76 253.811 -17.766 15.157 600 H GLU 77 HN GLU 77 252.755 -16.940 12.387 601 HA GLU 77 HA GLU 77 250.534 -18.872 12.369 602 1HB GLU 77 HB2 GLU 77 250.607 -15.967 11.538 603 2HB GLU 77 HB1 GLU 77 249.215 -17.022 11.340 604 1HG GLU 77 HG2 GLU 77 250.306 -16.929 14.058 605 2HG GLU 77 HG1 GLU 77 249.647 -15.405 13.469 606 HA PRO 78 HA PRO 78 252.409 -20.269 8.487 607 1HB PRO 78 HB2 PRO 78 249.642 -21.394 8.328 608 2HB PRO 78 HB1 PRO 78 251.192 -22.169 7.979 609 1HG PRO 78 HG2 PRO 78 249.915 -22.666 10.260 610 2HG PRO 78 HG1 PRO 78 251.681 -22.506 10.220 611 1HD PRO 78 HD2 PRO 78 249.630 -20.613 11.246 612 2HD PRO 78 HD1 PRO 78 251.298 -20.879 11.791 613 H GLU 79 HN GLU 79 249.161 -18.884 8.811 614 HA GLU 79 HA GLU 79 248.794 -18.265 6.086 615 1HB GLU 79 HB2 GLU 79 247.309 -18.030 8.455 616 2HB GLU 79 HB1 GLU 79 247.449 -16.393 7.829 617 1HG GLU 79 HG2 GLU 79 246.462 -17.025 5.755 618 2HG GLU 79 HG1 GLU 79 246.513 -18.732 6.193 619 H LEU 80 HN LEU 80 248.516 -15.967 5.307 620 HA LEU 80 HA LEU 80 250.444 -14.090 6.445 621 1HB LEU 80 HB2 LEU 80 250.542 -14.409 3.496 622 2HB LEU 80 HB1 LEU 80 251.806 -13.933 4.612 623 HG LEU 80 HG LEU 80 250.839 -16.763 4.590 624 1HD1 LEU 80 HD11 LEU 80 251.280 -16.327 2.270 625 2HD1 LEU 80 HD12 LEU 80 252.608 -17.277 2.936 626 3HD1 LEU 80 HD13 LEU 80 252.811 -15.547 2.666 627 1HD2 LEU 80 HD21 LEU 80 252.358 -16.742 6.239 628 2HD2 LEU 80 HD22 LEU 80 253.072 -15.226 5.694 629 3HD2 LEU 80 HD23 LEU 80 253.544 -16.746 4.933 630 H MET 81 HN MET 81 250.388 -12.234 4.344 631 HA MET 81 HA MET 81 247.585 -11.711 3.789 632 1HB MET 81 HB2 MET 81 248.831 -10.532 6.001 633 2HB MET 81 HB1 MET 81 248.810 -9.278 4.769 634 1HG MET 81 HG2 MET 81 246.297 -10.106 4.533 635 2HG MET 81 HG1 MET 81 246.572 -10.565 6.212 636 1HE MET 81 HE1 MET 81 247.086 -7.907 3.611 637 2HE MET 81 HE2 MET 81 248.302 -7.135 4.629 638 3HE MET 81 HE3 MET 81 246.727 -6.374 4.406 639 H ASP 82 HN ASP 82 247.603 -11.398 1.657 640 HA ASP 82 HA ASP 82 249.839 -9.890 0.479 641 1HB ASP 82 HB2 ASP 82 249.508 -12.161 -0.422 642 2HB ASP 82 HB1 ASP 82 247.854 -11.745 -0.862 643 H VAL 83 HN VAL 83 249.260 -7.782 0.511 644 HA VAL 83 HA VAL 83 246.585 -7.089 -0.521 645 HB VAL 83 HB VAL 83 246.959 -6.386 1.810 646 1HG1 VAL 83 HG11 VAL 83 249.041 -4.478 0.785 647 2HG1 VAL 83 HG12 VAL 83 249.454 -6.050 1.468 648 3HG1 VAL 83 HG13 VAL 83 248.620 -4.851 2.456 649 1HG2 VAL 83 HG21 VAL 83 245.407 -5.065 0.648 650 2HG2 VAL 83 HG22 VAL 83 246.663 -4.271 -0.302 651 3HG2 VAL 83 HG23 VAL 83 246.496 -3.908 1.416 652 H HIS 84 HN HIS 84 246.590 -6.338 -2.506 653 HA HIS 84 HA HIS 84 248.988 -5.340 -3.749 654 1HB HIS 84 HB2 HIS 84 246.866 -6.642 -4.753 655 2HB HIS 84 HB1 HIS 84 246.338 -4.990 -5.056 656 HD1 HIS 84 HD1 HIS 84 248.115 -3.509 -6.494 657 HD2 HIS 84 HD2 HIS 84 248.548 -7.639 -6.636 658 HE1 HIS 84 HE1 HIS 84 249.527 -3.967 -8.524 659 HE2 HIS 84 HE2 HIS 84 249.704 -6.478 -8.637 660 H VAL 85 HN VAL 85 249.092 -3.203 -4.786 661 HA VAL 85 HA VAL 85 247.588 -1.213 -3.213 662 HB VAL 85 HB VAL 85 250.315 -0.884 -4.487 663 1HG1 VAL 85 HG11 VAL 85 250.310 1.286 -3.842 664 2HG1 VAL 85 HG12 VAL 85 249.319 0.970 -2.416 665 3HG1 VAL 85 HG13 VAL 85 248.564 1.092 -4.004 666 1HG2 VAL 85 HG21 VAL 85 250.775 -0.632 -1.866 667 2HG2 VAL 85 HG22 VAL 85 250.883 -2.176 -2.711 668 3HG2 VAL 85 HG23 VAL 85 249.425 -1.765 -1.807 669 H PHE 86 HN PHE 86 246.451 0.291 -4.273 670 HA PHE 86 HA PHE 86 246.751 0.495 -7.191 671 1HB PHE 86 HB2 PHE 86 244.467 -0.472 -5.653 672 2HB PHE 86 HB1 PHE 86 244.031 0.886 -6.682 673 HD1 PHE 86 HD1 PHE 86 244.437 -2.598 -6.526 674 HD2 PHE 86 HD2 PHE 86 244.856 0.716 -9.162 675 HE1 PHE 86 HE1 PHE 86 244.280 -4.117 -8.455 676 HE2 PHE 86 HE2 PHE 86 244.699 -0.796 -11.096 677 HZ PHE 86 HZ PHE 86 244.411 -3.217 -10.744 678 H CYS 87 HN CYS 87 246.584 2.522 -8.009 679 HA CYS 87 HA CYS 87 245.720 4.667 -6.176 680 1HB CYS 87 HB2 CYS 87 247.393 6.148 -7.184 681 2HB CYS 87 HB1 CYS 87 248.175 4.737 -6.479 682 HG CYS 87 HG CYS 87 247.851 5.184 -9.540 683 H THR 88 HN THR 88 243.895 5.542 -6.966 684 HA THR 88 HA THR 88 243.344 5.242 -9.821 685 HB THR 88 HB THR 88 241.757 4.492 -7.946 686 HG1 THR 88 HG1 THR 88 240.223 6.028 -9.605 687 1HG2 THR 88 HG21 THR 88 240.451 7.101 -8.053 688 2HG2 THR 88 HG22 THR 88 241.905 7.025 -7.059 689 3HG2 THR 88 HG23 THR 88 240.562 5.928 -6.743 690 H ASP 89 HN ASP 89 241.593 7.147 -10.385 691 HA ASP 89 HA ASP 89 242.434 9.766 -9.573 692 1HB ASP 89 HB2 ASP 89 244.035 8.720 -11.484 693 2HB ASP 89 HB1 ASP 89 242.768 9.403 -12.498 694 H SER 90 HN SER 90 240.773 7.802 -11.992 695 HA SER 90 HA SER 90 238.773 9.840 -12.465 696 1HB SER 90 HB2 SER 90 239.776 7.758 -13.984 697 2HB SER 90 HB1 SER 90 238.199 7.149 -13.484 698 HG SER 90 HG SER 90 237.551 8.324 -15.115 699 H ILE 91 HN ILE 91 237.551 10.134 -10.646 700 HA ILE 91 HA ILE 91 236.363 7.757 -9.401 701 HB ILE 91 HB ILE 91 235.753 9.200 -7.518 702 1HG1 ILE 91 HG12 ILE 91 237.292 11.392 -8.926 703 2HG1 ILE 91 HG11 ILE 91 235.534 11.294 -8.908 704 1HG2 ILE 91 HG21 ILE 91 238.590 9.028 -8.430 705 2HG2 ILE 91 HG22 ILE 91 237.777 8.184 -7.112 706 3HG2 ILE 91 HG23 ILE 91 238.206 9.885 -6.938 707 1HD1 ILE 91 HD11 ILE 91 237.304 11.562 -6.489 708 2HD1 ILE 91 HD12 ILE 91 235.541 11.486 -6.482 709 3HD1 ILE 91 HD13 ILE 91 236.361 12.852 -7.237 710 H GLN 92 HN GLN 92 234.091 8.408 -8.381 711 HA GLN 92 HA GLN 92 232.474 9.717 -10.452 712 1HB GLN 92 HB2 GLN 92 232.064 7.004 -9.217 713 2HB GLN 92 HB1 GLN 92 230.746 7.888 -9.974 714 1HG GLN 92 HG2 GLN 92 232.642 8.015 -11.909 715 2HG GLN 92 HG1 GLN 92 232.995 6.450 -11.179 716 1HE2 GLN 92 HE21 GLN 92 232.004 6.935 -13.814 717 2HE2 GLN 92 HE22 GLN 92 230.461 6.167 -13.930 718 H GLY 93 HN GLY 93 231.880 8.055 -7.362 719 1HA GLY 93 HA2 GLY 93 229.835 9.760 -6.514 720 2HA GLY 93 HA1 GLY 93 230.789 8.726 -5.463 721 H THR 94 HN THR 94 230.348 10.618 -4.008 722 HA THR 94 HA THR 94 232.395 12.688 -4.379 723 HB THR 94 HB THR 94 230.208 13.294 -2.533 724 HG1 THR 94 HG1 THR 94 228.875 12.355 -3.968 725 1HG2 THR 94 HG21 THR 94 231.000 15.316 -2.962 726 2HG2 THR 94 HG22 THR 94 230.265 15.191 -4.560 727 3HG2 THR 94 HG23 THR 94 231.948 14.720 -4.325 728 HA PRO 95 HA PRO 95 234.271 11.605 -0.580 729 1HB PRO 95 HB2 PRO 95 234.191 14.392 0.378 730 2HB PRO 95 HB1 PRO 95 235.588 13.378 -0.003 731 1HG PRO 95 HG2 PRO 95 234.880 15.427 -1.564 732 2HG PRO 95 HG1 PRO 95 235.545 13.926 -2.236 733 1HD PRO 95 HD2 PRO 95 232.695 14.839 -2.091 734 2HD PRO 95 HD1 PRO 95 233.561 14.071 -3.440 735 H VAL 96 HN VAL 96 231.921 10.832 -0.369 736 HA VAL 96 HA VAL 96 230.252 12.217 1.504 737 HB VAL 96 HB VAL 96 230.044 9.289 0.824 738 1HG1 VAL 96 HG11 VAL 96 227.676 11.022 1.126 739 2HG1 VAL 96 HG12 VAL 96 228.620 10.724 2.585 740 3HG1 VAL 96 HG13 VAL 96 227.954 9.369 1.674 741 1HG2 VAL 96 HG21 VAL 96 228.319 10.425 -0.902 742 2HG2 VAL 96 HG22 VAL 96 229.968 9.965 -1.325 743 3HG2 VAL 96 HG23 VAL 96 229.600 11.636 -0.900 744 H GLU 97 HN GLU 97 232.327 12.353 2.890 745 HA GLU 97 HA GLU 97 233.456 10.389 4.385 746 1HB GLU 97 HB2 GLU 97 232.473 12.868 5.772 747 2HB GLU 97 HB1 GLU 97 233.968 11.985 6.031 748 1HG GLU 97 HG2 GLU 97 234.961 13.517 4.780 749 2HG GLU 97 HG1 GLU 97 234.132 12.807 3.396 750 H SER 98 HN SER 98 232.600 8.715 5.421 751 HA SER 98 HA SER 98 229.898 8.853 6.469 752 1HB SER 98 HB2 SER 98 231.837 6.693 5.842 753 2HB SER 98 HB1 SER 98 230.685 6.370 7.138 754 HG SER 98 HG SER 98 229.008 6.746 5.704 755 H ASP 99 HN ASP 99 229.784 7.347 8.628 756 HA ASP 99 HA ASP 99 230.809 9.023 10.679 757 1HB ASP 99 HB2 ASP 99 229.577 6.277 10.965 758 2HB ASP 99 HB1 ASP 99 229.721 7.503 12.222 759 H GLU 100 HN GLU 100 232.219 6.474 8.964 760 HA GLU 100 HA GLU 100 234.278 6.201 11.046 761 1HB GLU 100 HB2 GLU 100 232.727 4.108 9.673 762 2HB GLU 100 HB1 GLU 100 234.462 3.823 9.717 763 1HG GLU 100 HG2 GLU 100 234.083 2.911 11.708 764 2HG GLU 100 HG1 GLU 100 233.942 4.568 12.289 765 H MET 101 HN MET 101 233.959 7.815 8.484 766 HA MET 101 HA MET 101 236.649 7.346 7.546 767 1HB MET 101 HB2 MET 101 234.352 6.403 6.053 768 2HB MET 101 HB1 MET 101 235.270 7.582 5.125 769 1HG MET 101 HG2 MET 101 236.708 5.362 6.493 770 2HG MET 101 HG1 MET 101 235.844 5.044 4.991 771 1HE MET 101 HE1 MET 101 239.087 7.400 6.356 772 2HE MET 101 HE2 MET 101 239.961 6.182 5.426 773 3HE MET 101 HE3 MET 101 238.778 5.686 6.638 774 H ARG 102 HN ARG 102 237.377 9.039 6.040 775 HA ARG 102 HA ARG 102 235.884 11.351 5.483 776 1HB ARG 102 HB2 ARG 102 235.887 11.685 7.899 777 2HB ARG 102 HB1 ARG 102 237.635 11.511 7.949 778 1HG ARG 102 HG2 ARG 102 237.662 13.535 6.353 779 2HG ARG 102 HG1 ARG 102 235.996 13.775 6.883 780 1HD ARG 102 HD2 ARG 102 236.614 14.474 8.931 781 2HD ARG 102 HD1 ARG 102 237.930 13.306 9.043 782 HE ARG 102 HE ARG 102 239.371 14.895 8.237 783 1HH1 ARG 102 HH11 ARG 102 236.091 15.956 7.696 784 2HH1 ARG 102 HH12 ARG 102 236.555 17.546 7.193 785 1HH2 ARG 102 HH21 ARG 102 239.984 16.986 7.575 786 2HH2 ARG 102 HH22 ARG 102 238.765 18.131 7.124 787 HA PRO 103 HA PRO 103 239.844 11.058 3.209 788 1HB PRO 103 HB2 PRO 103 238.913 11.926 0.846 789 2HB PRO 103 HB1 PRO 103 238.621 10.274 1.406 790 1HG PRO 103 HG2 PRO 103 236.810 12.663 1.538 791 2HG PRO 103 HG1 PRO 103 236.436 11.011 1.007 792 1HD PRO 103 HD2 PRO 103 235.843 11.907 3.496 793 2HD PRO 103 HD1 PRO 103 236.274 10.218 3.173 794 H CYS 104 HN CYS 104 241.289 12.633 2.478 795 HA CYS 104 HA CYS 104 240.412 15.422 2.542 796 1HB CYS 104 HB2 CYS 104 241.915 14.193 4.624 797 2HB CYS 104 HB1 CYS 104 242.985 15.304 3.774 798 HG CYS 104 HG CYS 104 241.603 16.451 5.772 799 H TRP 105 HN TRP 105 241.212 16.540 0.891 800 HA TRP 105 HA TRP 105 243.231 15.272 -0.786 801 1HB TRP 105 HB2 TRP 105 241.543 17.724 -1.328 802 2HB TRP 105 HB1 TRP 105 242.545 16.870 -2.497 803 HD1 TRP 105 HD1 TRP 105 239.813 15.559 -0.046 804 HE1 TRP 105 HE1 TRP 105 238.151 14.136 -1.407 805 HE3 TRP 105 HE3 TRP 105 241.870 16.143 -4.691 806 HZ2 TRP 105 HZ2 TRP 105 237.769 13.368 -4.096 807 HZ3 TRP 105 HZ3 TRP 105 240.795 15.029 -6.604 808 HH2 TRP 105 HH2 TRP 105 238.787 13.671 -6.311 809 H PHE 106 HN PHE 106 245.292 15.866 -0.744 810 HA PHE 106 HA PHE 106 245.985 18.622 0.000 811 1HB PHE 106 HB2 PHE 106 247.369 16.163 1.098 812 2HB PHE 106 HB1 PHE 106 247.813 17.834 1.425 813 HD1 PHE 106 HD1 PHE 106 245.171 19.048 1.899 814 HD2 PHE 106 HD2 PHE 106 246.768 15.310 3.158 815 HE1 PHE 106 HE1 PHE 106 243.672 19.069 3.851 816 HE2 PHE 106 HE2 PHE 106 245.273 15.324 5.109 817 HZ PHE 106 HZ PHE 106 243.723 17.205 5.459 818 H GLN 107 HN GLN 107 248.735 18.402 -0.132 819 HA GLN 107 HA GLN 107 249.116 18.151 -2.982 820 1HB GLN 107 HB2 GLN 107 251.461 18.917 -2.417 821 2HB GLN 107 HB1 GLN 107 250.169 20.031 -1.986 822 1HG GLN 107 HG2 GLN 107 250.685 18.276 0.209 823 2HG GLN 107 HG1 GLN 107 252.196 19.000 -0.340 824 1HE2 GLN 107 HE21 GLN 107 249.551 19.400 1.612 825 2HE2 GLN 107 HE22 GLN 107 249.655 21.104 1.876 826 H LEU 108 HN LEU 108 250.907 16.932 -3.915 827 HA LEU 108 HA LEU 108 251.077 14.286 -2.721 828 1HB LEU 108 HB2 LEU 108 251.605 13.491 -4.822 829 2HB LEU 108 HB1 LEU 108 250.603 14.875 -5.212 830 HG LEU 108 HG LEU 108 253.621 14.811 -5.296 831 1HD1 LEU 108 HD11 LEU 108 251.516 14.727 -7.443 832 2HD1 LEU 108 HD12 LEU 108 252.786 13.548 -7.119 833 3HD1 LEU 108 HD13 LEU 108 253.203 15.140 -7.753 834 1HD2 LEU 108 HD21 LEU 108 252.720 17.007 -4.661 835 2HD2 LEU 108 HD22 LEU 108 251.702 16.992 -6.100 836 3HD2 LEU 108 HD23 LEU 108 253.457 17.029 -6.262 837 H ASP 109 HN ASP 109 252.682 16.845 -1.941 838 HA ASP 109 HA ASP 109 255.269 15.456 -1.786 839 1HB ASP 109 HB2 ASP 109 255.056 17.590 -3.314 840 2HB ASP 109 HB1 ASP 109 255.131 18.450 -1.779 841 H GLN 110 HN GLN 110 252.872 15.673 0.011 842 HA GLN 110 HA GLN 110 254.352 16.212 2.426 843 1HB GLN 110 HB2 GLN 110 251.932 17.849 1.670 844 2HB GLN 110 HB1 GLN 110 252.559 17.744 3.310 845 1HG GLN 110 HG2 GLN 110 254.793 18.498 2.218 846 2HG GLN 110 HG1 GLN 110 253.751 19.049 0.908 847 1HE2 GLN 110 HE21 GLN 110 253.646 19.092 4.460 848 2HE2 GLN 110 HE22 GLN 110 253.264 20.772 4.597 849 H ILE 111 HN ILE 111 252.963 13.929 1.098 850 HA ILE 111 HA ILE 111 250.600 13.398 2.641 851 HB ILE 111 HB ILE 111 251.920 10.966 1.775 852 1HG1 ILE 111 HG12 ILE 111 251.297 11.645 -0.731 853 2HG1 ILE 111 HG11 ILE 111 251.827 13.222 -0.153 854 1HG2 ILE 111 HG21 ILE 111 249.729 10.884 0.410 855 2HG2 ILE 111 HG22 ILE 111 249.287 12.282 1.393 856 3HG2 ILE 111 HG23 ILE 111 249.691 10.750 2.166 857 1HD1 ILE 111 HD11 ILE 111 253.704 12.133 -1.110 858 2HD1 ILE 111 HD12 ILE 111 253.389 10.660 -0.197 859 3HD1 ILE 111 HD13 ILE 111 253.926 12.115 0.638 860 HA PRO 112 HA PRO 112 252.949 11.989 6.145 861 1HB PRO 112 HB2 PRO 112 250.993 12.015 7.943 862 2HB PRO 112 HB1 PRO 112 251.552 13.525 7.211 863 1HG PRO 112 HG2 PRO 112 249.092 11.941 6.636 864 2HG PRO 112 HG1 PRO 112 249.321 13.697 6.636 865 1HD PRO 112 HD2 PRO 112 249.352 11.993 4.387 866 2HD PRO 112 HD1 PRO 112 249.853 13.695 4.434 867 H PHE 113 HN PHE 113 253.540 9.908 5.607 868 HA PHE 113 HA PHE 113 251.595 7.781 5.753 869 1HB PHE 113 HB2 PHE 113 254.386 6.917 5.759 870 2HB PHE 113 HB1 PHE 113 253.079 6.498 4.672 871 HD1 PHE 113 HD1 PHE 113 252.501 9.321 3.646 872 HD2 PHE 113 HD2 PHE 113 256.111 7.132 4.234 873 HE1 PHE 113 HE1 PHE 113 253.591 10.612 1.865 874 HE2 PHE 113 HE2 PHE 113 257.197 8.430 2.456 875 HZ PHE 113 HZ PHE 113 255.937 10.179 1.265 876 H LYS 114 HN LYS 114 253.655 9.395 7.945 877 HA LYS 114 HA LYS 114 254.214 7.327 9.766 878 1HB LYS 114 HB2 LYS 114 254.016 10.321 10.029 879 2HB LYS 114 HB1 LYS 114 254.332 9.302 11.426 880 1HG LYS 114 HG2 LYS 114 256.054 8.826 9.088 881 2HG LYS 114 HG1 LYS 114 256.252 10.385 9.889 882 1HD LYS 114 HD2 LYS 114 256.143 7.915 11.553 883 2HD LYS 114 HD1 LYS 114 257.623 8.275 10.663 884 1HE LYS 114 HE2 LYS 114 257.773 9.189 12.895 885 2HE LYS 114 HE1 LYS 114 257.685 10.500 11.720 886 1HZ LYS 114 HZ1 LYS 114 256.267 10.868 13.671 887 2HZ LYS 114 HZ2 LYS 114 255.378 9.482 13.287 888 3HZ LYS 114 HZ3 LYS 114 255.373 10.807 12.236 889 H ASP 115 HN ASP 115 251.462 9.356 9.166 890 HA ASP 115 HA ASP 115 250.075 8.212 11.458 891 1HB ASP 115 HB2 ASP 115 249.552 10.621 9.738 892 2HB ASP 115 HB1 ASP 115 248.275 9.935 10.738 893 H MET 116 HN MET 116 250.714 6.658 9.155 894 HA MET 116 HA MET 116 248.009 6.005 8.206 895 1HB MET 116 HB2 MET 116 249.492 7.160 6.492 896 2HB MET 116 HB1 MET 116 250.505 5.724 6.534 897 1HG MET 116 HG2 MET 116 248.951 4.426 5.473 898 2HG MET 116 HG1 MET 116 247.599 5.407 6.025 899 1HE MET 116 HE1 MET 116 250.675 5.755 3.054 900 2HE MET 116 HE2 MET 116 250.889 6.389 4.681 901 3HE MET 116 HE3 MET 116 250.536 7.488 3.349 902 H TRP 117 HN TRP 117 251.291 4.632 7.989 903 HA TRP 117 HA TRP 117 250.732 2.424 9.665 904 1HB TRP 117 HB2 TRP 117 249.764 2.172 7.017 905 2HB TRP 117 HB1 TRP 117 251.194 1.152 7.120 906 HD1 TRP 117 HD1 TRP 117 249.873 0.989 10.473 907 HE1 TRP 117 HE1 TRP 117 248.336 -1.044 10.804 908 HE3 TRP 117 HE3 TRP 117 249.058 -0.222 5.571 909 HZ2 TRP 117 HZ2 TRP 117 246.958 -2.916 9.203 910 HZ3 TRP 117 HZ3 TRP 117 247.617 -2.149 5.058 911 HH2 TRP 117 HH2 TRP 117 246.590 -3.468 6.838 912 HA PRO 118 HA PRO 118 255.133 2.137 9.372 913 1HB PRO 118 HB2 PRO 118 255.650 -0.354 10.164 914 2HB PRO 118 HB1 PRO 118 254.874 0.804 11.250 915 1HG PRO 118 HG2 PRO 118 253.652 -1.415 9.661 916 2HG PRO 118 HG1 PRO 118 253.298 -0.897 11.319 917 1HD PRO 118 HD2 PRO 118 251.814 -0.200 9.089 918 2HD PRO 118 HD1 PRO 118 251.824 0.695 10.621 919 H ASP 119 HN ASP 119 253.426 1.043 6.908 920 HA ASP 119 HA ASP 119 255.778 -0.101 5.574 921 1HB ASP 119 HB2 ASP 119 252.934 -1.071 5.238 922 2HB ASP 119 HB1 ASP 119 254.340 -1.674 4.367 923 H ASP 120 HN ASP 120 253.498 2.332 5.594 924 HA ASP 120 HA ASP 120 252.845 2.637 2.882 925 1HB ASP 120 HB2 ASP 120 253.042 4.626 5.128 926 2HB ASP 120 HB1 ASP 120 252.458 5.047 3.521 927 H SER 121 HN SER 121 255.463 4.104 4.775 928 HA SER 121 HA SER 121 256.576 5.692 2.791 929 1HB SER 121 HB2 SER 121 257.164 5.403 5.336 930 2HB SER 121 HB1 SER 121 258.364 4.266 4.724 931 HG SER 121 HG SER 121 258.799 6.722 4.939 932 H TYR 122 HN TYR 122 256.496 2.272 2.957 933 HA TYR 122 HA TYR 122 258.878 1.845 1.407 934 1HB TYR 122 HB2 TYR 122 256.714 0.056 2.477 935 2HB TYR 122 HB1 TYR 122 257.915 -0.547 1.340 936 HD1 TYR 122 HD1 TYR 122 260.362 0.794 2.227 937 HD2 TYR 122 HD2 TYR 122 257.220 -0.929 4.521 938 HE1 TYR 122 HE1 TYR 122 261.930 0.420 4.083 939 HE2 TYR 122 HE2 TYR 122 258.781 -1.307 6.385 940 HH TYR 122 HH TYR 122 261.850 0.115 6.528 941 H TRP 123 HN TRP 123 255.372 1.872 0.785 942 HA TRP 123 HA TRP 123 255.990 1.314 -2.015 943 1HB TRP 123 HB2 TRP 123 253.624 0.800 -2.335 944 2HB TRP 123 HB1 TRP 123 254.329 -0.168 -1.049 945 HD1 TRP 123 HD1 TRP 123 253.574 0.456 1.489 946 HE1 TRP 123 HE1 TRP 123 251.382 1.496 2.361 947 HE3 TRP 123 HE3 TRP 123 251.824 2.458 -2.877 948 HZ2 TRP 123 HZ2 TRP 123 249.201 2.984 1.332 949 HZ3 TRP 123 HZ3 TRP 123 249.675 3.661 -2.843 950 HH2 TRP 123 HH2 TRP 123 248.398 3.907 -0.788 951 H PHE 124 HN PHE 124 255.494 3.976 -0.119 952 HA PHE 124 HA PHE 124 253.874 5.512 -1.907 953 1HB PHE 124 HB2 PHE 124 255.177 5.928 0.673 954 2HB PHE 124 HB1 PHE 124 255.228 7.353 -0.360 955 HD1 PHE 124 HD1 PHE 124 253.584 8.856 0.224 956 HD2 PHE 124 HD2 PHE 124 252.687 4.698 0.263 957 HE1 PHE 124 HE1 PHE 124 251.266 9.372 0.832 958 HE2 PHE 124 HE2 PHE 124 250.363 5.207 0.871 959 HZ PHE 124 HZ PHE 124 249.646 7.546 1.157 960 HA PRO 125 HA PRO 125 258.246 7.565 -2.912 961 1HB PRO 125 HB2 PRO 125 260.222 5.598 -2.952 962 2HB PRO 125 HB1 PRO 125 260.025 6.844 -1.718 963 1HG PRO 125 HG2 PRO 125 259.153 3.994 -1.696 964 2HG PRO 125 HG1 PRO 125 259.775 4.992 -0.369 965 1HD PRO 125 HD2 PRO 125 257.174 4.421 -0.592 966 2HD PRO 125 HD1 PRO 125 257.720 6.000 0.000 967 H LEU 126 HN LEU 126 257.390 4.241 -3.752 968 HA LEU 126 HA LEU 126 258.472 4.486 -6.416 969 1HB LEU 126 HB2 LEU 126 256.992 2.324 -6.710 970 2HB LEU 126 HB1 LEU 126 258.534 2.274 -5.882 971 HG LEU 126 HG LEU 126 256.246 2.799 -4.118 972 1HD1 LEU 126 HD11 LEU 126 256.239 0.512 -5.967 973 2HD1 LEU 126 HD12 LEU 126 254.911 1.270 -5.088 974 3HD1 LEU 126 HD13 LEU 126 255.969 0.122 -4.269 975 1HD2 LEU 126 HD21 LEU 126 258.796 1.299 -4.139 976 2HD2 LEU 126 HD22 LEU 126 257.516 0.691 -3.089 977 3HD2 LEU 126 HD23 LEU 126 258.102 2.344 -2.899 978 H LEU 127 HN LEU 127 255.378 4.823 -4.837 979 HA LEU 127 HA LEU 127 253.698 4.886 -7.082 980 1HB LEU 127 HB2 LEU 127 253.532 6.316 -4.430 981 2HB LEU 127 HB1 LEU 127 252.249 6.351 -5.621 982 HG LEU 127 HG LEU 127 252.736 4.447 -3.578 983 1HD1 LEU 127 HD11 LEU 127 250.659 4.835 -5.702 984 2HD1 LEU 127 HD12 LEU 127 250.557 5.185 -3.976 985 3HD1 LEU 127 HD13 LEU 127 250.567 3.514 -4.537 986 1HD2 LEU 127 HD21 LEU 127 254.090 3.182 -5.148 987 2HD2 LEU 127 HD22 LEU 127 252.806 3.266 -6.353 988 3HD2 LEU 127 HD23 LEU 127 252.559 2.356 -4.863 989 H LEU 128 HN LEU 128 255.180 7.528 -5.259 990 HA LEU 128 HA LEU 128 254.429 9.608 -6.997 991 1HB LEU 128 HB2 LEU 128 256.390 9.265 -4.799 992 2HB LEU 128 HB1 LEU 128 256.650 10.621 -5.881 993 HG LEU 128 HG LEU 128 253.971 10.196 -4.600 994 1HD1 LEU 128 HD11 LEU 128 255.881 12.045 -3.306 995 2HD1 LEU 128 HD12 LEU 128 256.113 10.322 -3.011 996 3HD1 LEU 128 HD13 LEU 128 254.576 11.086 -2.609 997 1HD2 LEU 128 HD21 LEU 128 254.027 12.728 -4.786 998 2HD2 LEU 128 HD22 LEU 128 253.928 11.826 -6.298 999 3HD2 LEU 128 HD23 LEU 128 255.465 12.519 -5.785 1000 H GLN 129 HN GLN 129 257.110 7.374 -7.055 1001 HA GLN 129 HA GLN 129 258.603 8.827 -9.034 1002 1HB GLN 129 HB2 GLN 129 259.616 7.277 -7.334 1003 2HB GLN 129 HB1 GLN 129 258.916 5.934 -8.228 1004 1HG GLN 129 HG2 GLN 129 261.265 6.263 -8.781 1005 2HG GLN 129 HG1 GLN 129 260.226 6.518 -10.182 1006 1HE2 GLN 129 HE21 GLN 129 262.698 7.775 -8.307 1007 2HE2 GLN 129 HE22 GLN 129 262.718 9.382 -8.945 1008 H LYS 130 HN LYS 130 255.783 7.102 -9.229 1009 HA LYS 130 HA LYS 130 254.563 6.282 -10.962 1010 1HB LYS 130 HB2 LYS 130 256.728 7.340 -12.779 1011 2HB LYS 130 HB1 LYS 130 255.049 7.019 -13.191 1012 1HG LYS 130 HG2 LYS 130 254.320 8.970 -12.327 1013 2HG LYS 130 HG1 LYS 130 255.499 8.955 -11.014 1014 1HD LYS 130 HD2 LYS 130 256.245 9.491 -13.881 1015 2HD LYS 130 HD1 LYS 130 255.794 10.769 -12.751 1016 1HE LYS 130 HE2 LYS 130 257.616 9.653 -11.237 1017 2HE LYS 130 HE1 LYS 130 258.205 9.010 -12.770 1018 1HZ LYS 130 HZ1 LYS 130 258.765 11.077 -13.528 1019 2HZ LYS 130 HZ2 LYS 130 259.054 11.288 -11.875 1020 3HZ LYS 130 HZ3 LYS 130 257.629 11.881 -12.566 1021 H LYS 131 HN LYS 131 256.627 4.677 -9.675 1022 HA LYS 131 HA LYS 131 257.138 2.756 -11.851 1023 1HB LYS 131 HB2 LYS 131 258.820 3.132 -9.369 1024 2HB LYS 131 HB1 LYS 131 259.153 2.044 -10.709 1025 1HG LYS 131 HG2 LYS 131 258.912 4.981 -11.191 1026 2HG LYS 131 HG1 LYS 131 260.407 4.301 -10.546 1027 1HD LYS 131 HD2 LYS 131 260.452 2.733 -12.478 1028 2HD LYS 131 HD1 LYS 131 259.051 3.575 -13.141 1029 1HE LYS 131 HE2 LYS 131 260.387 5.679 -13.103 1030 2HE LYS 131 HE1 LYS 131 261.789 4.725 -12.617 1031 1HZ LYS 131 HZ1 LYS 131 261.384 5.266 -15.107 1032 2HZ LYS 131 HZ2 LYS 131 260.304 3.966 -15.037 1033 3HZ LYS 131 HZ3 LYS 131 261.936 3.730 -14.662 1034 H LYS 132 HN LYS 132 257.171 0.485 -11.184 1035 HA LYS 132 HA LYS 132 255.263 0.019 -8.997 1036 1HB LYS 132 HB2 LYS 132 255.902 -1.759 -11.357 1037 2HB LYS 132 HB1 LYS 132 254.666 -2.055 -10.142 1038 1HG LYS 132 HG2 LYS 132 253.569 0.077 -10.870 1039 2HG LYS 132 HG1 LYS 132 254.719 0.128 -12.208 1040 1HD LYS 132 HD2 LYS 132 253.086 -2.332 -11.732 1041 2HD LYS 132 HD1 LYS 132 252.373 -0.947 -12.559 1042 1HE LYS 132 HE2 LYS 132 255.034 -1.886 -13.478 1043 2HE LYS 132 HE1 LYS 132 253.634 -2.887 -13.866 1044 1HZ LYS 132 HZ1 LYS 132 254.181 -0.100 -14.680 1045 2HZ LYS 132 HZ2 LYS 132 252.615 -0.737 -14.727 1046 3HZ LYS 132 HZ3 LYS 132 253.840 -1.438 -15.658 1047 H PHE 133 HN PHE 133 255.791 -1.227 -7.303 1048 HA PHE 133 HA PHE 133 258.139 -2.960 -7.458 1049 1HB PHE 133 HB2 PHE 133 257.797 -0.662 -5.544 1050 2HB PHE 133 HB1 PHE 133 258.817 -2.040 -5.149 1051 HD1 PHE 133 HD1 PHE 133 261.042 -1.985 -5.734 1052 HD2 PHE 133 HD2 PHE 133 258.292 0.483 -7.844 1053 HE1 PHE 133 HE1 PHE 133 262.911 -0.953 -6.953 1054 HE2 PHE 133 HE2 PHE 133 260.158 1.516 -9.069 1055 HZ PHE 133 HZ PHE 133 262.470 0.800 -8.625 1056 H HIS 134 HN HIS 134 258.292 -4.467 -5.665 1057 HA HIS 134 HA HIS 134 255.691 -4.997 -4.383 1058 1HB HIS 134 HB2 HIS 134 256.118 -6.683 -6.075 1059 2HB HIS 134 HB1 HIS 134 257.739 -6.956 -5.448 1060 HD1 HIS 134 HD1 HIS 134 257.598 -7.739 -2.720 1061 HD2 HIS 134 HD2 HIS 134 254.420 -8.601 -5.254 1062 HE1 HIS 134 HE1 HIS 134 256.337 -9.605 -1.605 1063 HE2 HIS 134 HE2 HIS 134 254.471 -10.172 -3.202 1064 H GLY 135 HN GLY 135 255.740 -4.974 -2.200 1065 1HA GLY 135 HA2 GLY 135 258.388 -5.295 -0.928 1066 2HA GLY 135 HA1 GLY 135 257.181 -4.161 -0.348 1067 H TYR 136 HN TYR 136 258.633 -6.773 0.585 1068 HA TYR 136 HA TYR 136 256.229 -8.085 1.669 1069 1HB TYR 136 HB2 TYR 136 257.365 -9.732 0.436 1070 2HB TYR 136 HB1 TYR 136 258.947 -9.152 0.938 1071 HD1 TYR 136 HD1 TYR 136 259.708 -9.593 3.302 1072 HD2 TYR 136 HD2 TYR 136 256.239 -11.418 1.647 1073 HE1 TYR 136 HE1 TYR 136 259.782 -11.309 5.058 1074 HE2 TYR 136 HE2 TYR 136 256.302 -13.140 3.403 1075 HH TYR 136 HH TYR 136 257.871 -14.146 4.938 1076 H PHE 137 HN PHE 137 255.841 -7.439 3.679 1077 HA PHE 137 HA PHE 137 258.138 -6.828 5.423 1078 1HB PHE 137 HB2 PHE 137 255.337 -5.804 5.844 1079 2HB PHE 137 HB1 PHE 137 256.843 -5.187 6.516 1080 HD1 PHE 137 HD1 PHE 137 254.368 -4.547 4.196 1081 HD2 PHE 137 HD2 PHE 137 258.603 -4.499 4.591 1082 HE1 PHE 137 HE1 PHE 137 254.520 -2.926 2.350 1083 HE2 PHE 137 HE2 PHE 137 258.763 -2.880 2.748 1084 HZ PHE 137 HZ PHE 137 256.719 -2.091 1.624 1085 H LYS 138 HN LYS 138 258.392 -7.965 7.244 1086 HA LYS 138 HA LYS 138 256.477 -10.045 7.914 1087 1HB LYS 138 HB2 LYS 138 258.893 -10.572 7.833 1088 2HB LYS 138 HB1 LYS 138 259.178 -9.405 9.116 1089 1HG LYS 138 HG2 LYS 138 258.908 -11.052 10.569 1090 2HG LYS 138 HG1 LYS 138 257.204 -11.098 10.113 1091 1HD LYS 138 HD2 LYS 138 257.962 -12.618 8.189 1092 2HD LYS 138 HD1 LYS 138 259.470 -12.783 9.092 1093 1HE LYS 138 HE2 LYS 138 257.974 -13.412 11.081 1094 2HE LYS 138 HE1 LYS 138 256.701 -13.631 9.880 1095 1HZ LYS 138 HZ1 LYS 138 258.111 -15.643 10.544 1096 2HZ LYS 138 HZ2 LYS 138 259.315 -14.964 9.569 1097 3HZ LYS 138 HZ3 LYS 138 257.821 -15.387 8.896 1098 H PHE 139 HN PHE 139 255.148 -9.971 9.679 1099 HA PHE 139 HA PHE 139 255.302 -7.517 11.298 1100 1HB PHE 139 HB2 PHE 139 253.061 -9.207 10.308 1101 2HB PHE 139 HB1 PHE 139 252.857 -8.461 11.888 1102 HD1 PHE 139 HD1 PHE 139 254.889 -6.687 9.472 1103 HD2 PHE 139 HD2 PHE 139 250.932 -7.245 10.935 1104 HE1 PHE 139 HE1 PHE 139 254.195 -4.594 8.383 1105 HE2 PHE 139 HE2 PHE 139 250.232 -5.152 9.848 1106 HZ PHE 139 HZ PHE 139 251.864 -3.824 8.571 1107 H GLN 140 HN GLN 140 254.550 -7.713 13.556 1108 HA GLN 140 HA GLN 140 255.481 -10.233 14.768 1109 1HB GLN 140 HB2 GLN 140 257.038 -8.559 15.353 1110 2HB GLN 140 HB1 GLN 140 255.785 -7.364 15.618 1111 1HG GLN 140 HG2 GLN 140 256.869 -8.160 17.686 1112 2HG GLN 140 HG1 GLN 140 255.125 -8.408 17.660 1113 1HE2 GLN 140 HE21 GLN 140 257.993 -10.167 16.517 1114 2HE2 GLN 140 HE22 GLN 140 257.541 -11.689 17.196 1115 H GLY 141 HN GLY 141 252.733 -8.746 14.019 1116 1HA GLY 141 HA2 GLY 141 251.070 -10.191 15.676 1117 2HA GLY 141 HA1 GLY 141 251.330 -8.661 16.500 1118 H GLN 142 HN GLN 142 251.367 -6.860 14.444 1119 HA GLN 142 HA GLN 142 249.451 -7.117 12.454 1120 1HB GLN 142 HB2 GLN 142 247.590 -5.752 13.548 1121 2HB GLN 142 HB1 GLN 142 247.719 -7.443 14.009 1122 1HG GLN 142 HG2 GLN 142 249.125 -6.576 15.980 1123 2HG GLN 142 HG1 GLN 142 248.431 -5.004 15.585 1124 1HE2 GLN 142 HE21 GLN 142 247.917 -5.925 18.013 1125 2HE2 GLN 142 HE22 GLN 142 246.290 -6.489 18.149 1126 H ASP 143 HN ASP 143 250.940 -4.991 14.832 1127 HA ASP 143 HA ASP 143 250.967 -2.858 12.796 1128 1HB ASP 143 HB2 ASP 143 250.705 -2.714 15.787 1129 2HB ASP 143 HB1 ASP 143 251.286 -1.335 14.859 1130 H THR 144 HN THR 144 252.889 -4.884 14.810 1131 HA THR 144 HA THR 144 255.233 -3.175 14.562 1132 HB THR 144 HB THR 144 254.774 -5.813 15.946 1133 HG1 THR 144 HG1 THR 144 254.899 -4.619 17.759 1134 1HG2 THR 144 HG21 THR 144 257.332 -4.239 15.787 1135 2HG2 THR 144 HG22 THR 144 257.046 -5.850 15.128 1136 3HG2 THR 144 HG23 THR 144 257.029 -5.594 16.874 1137 H ILE 145 HN ILE 145 256.936 -3.531 13.245 1138 HA ILE 145 HA ILE 145 256.704 -5.808 11.408 1139 HB ILE 145 HB ILE 145 258.189 -3.228 10.910 1140 1HG1 ILE 145 HG12 ILE 145 255.542 -4.197 9.806 1141 2HG1 ILE 145 HG11 ILE 145 255.747 -2.894 10.972 1142 1HG2 ILE 145 HG21 ILE 145 258.428 -4.050 8.635 1143 2HG2 ILE 145 HG22 ILE 145 257.541 -5.517 9.050 1144 3HG2 ILE 145 HG23 ILE 145 259.118 -5.206 9.774 1145 1HD1 ILE 145 HD11 ILE 145 257.002 -1.620 9.295 1146 2HD1 ILE 145 HD12 ILE 145 255.365 -2.004 8.764 1147 3HD1 ILE 145 HD13 ILE 145 256.734 -2.917 8.130 1148 H LEU 146 HN LEU 146 258.464 -7.077 10.972 1149 HA LEU 146 HA LEU 146 260.817 -6.644 12.688 1150 1HB LEU 146 HB2 LEU 146 259.801 -9.353 11.874 1151 2HB LEU 146 HB1 LEU 146 260.955 -8.957 13.135 1152 HG LEU 146 HG LEU 146 258.142 -7.958 13.351 1153 1HD1 LEU 146 HD11 LEU 146 258.713 -10.502 14.697 1154 2HD1 LEU 146 HD12 LEU 146 258.546 -10.604 12.943 1155 3HD1 LEU 146 HD13 LEU 146 257.239 -9.930 13.916 1156 1HD2 LEU 146 HD21 LEU 146 260.363 -7.600 14.879 1157 2HD2 LEU 146 HD22 LEU 146 259.608 -8.979 15.677 1158 3HD2 LEU 146 HD23 LEU 146 258.706 -7.477 15.469 1159 H ASP 147 HN ASP 147 259.640 -7.154 9.523 1160 HA ASP 147 HA ASP 147 262.331 -7.089 8.483 1161 1HB ASP 147 HB2 ASP 147 261.137 -9.571 8.797 1162 2HB ASP 147 HB1 ASP 147 260.825 -9.180 7.109 1163 H TYR 148 HN TYR 148 262.454 -6.158 6.450 1164 HA TYR 148 HA TYR 148 259.942 -5.756 5.020 1165 1HB TYR 148 HB2 TYR 148 260.261 -3.395 4.750 1166 2HB TYR 148 HB1 TYR 148 260.292 -3.777 6.469 1167 HD1 TYR 148 HD1 TYR 148 262.384 -2.853 3.567 1168 HD2 TYR 148 HD2 TYR 148 262.234 -3.356 7.788 1169 HE1 TYR 148 HE1 TYR 148 264.553 -1.714 3.774 1170 HE2 TYR 148 HE2 TYR 148 264.403 -2.218 8.007 1171 HH TYR 148 HH TYR 148 266.531 -1.901 5.930 1172 H THR 149 HN THR 149 260.109 -5.969 2.869 1173 HA THR 149 HA THR 149 262.794 -5.785 1.676 1174 HB THR 149 HB THR 149 261.482 -7.645 0.112 1175 HG1 THR 149 HG1 THR 149 260.788 -9.207 1.669 1176 1HG2 THR 149 HG21 THR 149 262.894 -9.327 1.514 1177 2HG2 THR 149 HG22 THR 149 263.561 -7.856 2.224 1178 3HG2 THR 149 HG23 THR 149 263.681 -8.129 0.485 1179 H LEU 150 HN LEU 150 262.893 -4.991 -0.413 1180 HA LEU 150 HA LEU 150 260.374 -4.082 -1.607 1181 1HB LEU 150 HB2 LEU 150 262.787 -2.429 -0.952 1182 2HB LEU 150 HB1 LEU 150 261.736 -1.979 -2.283 1183 HG LEU 150 HG LEU 150 260.012 -2.429 -0.121 1184 1HD1 LEU 150 HD11 LEU 150 260.889 -1.600 1.775 1185 2HD1 LEU 150 HD12 LEU 150 261.900 -0.430 0.925 1186 3HD1 LEU 150 HD13 LEU 150 262.414 -2.112 1.053 1187 1HD2 LEU 150 HD21 LEU 150 260.839 0.347 -0.630 1188 2HD2 LEU 150 HD22 LEU 150 259.240 -0.396 -0.695 1189 3HD2 LEU 150 HD23 LEU 150 260.349 -0.571 -2.056 1190 H ARG 151 HN ARG 151 260.197 -4.750 -3.629 1191 HA ARG 151 HA ARG 151 262.653 -5.134 -5.211 1192 1HB ARG 151 HB2 ARG 151 260.175 -6.867 -5.274 1193 2HB ARG 151 HB1 ARG 151 261.596 -7.068 -6.290 1194 1HG ARG 151 HG2 ARG 151 262.151 -7.038 -3.413 1195 2HG ARG 151 HG1 ARG 151 261.152 -8.385 -3.962 1196 1HD ARG 151 HD2 ARG 151 263.568 -7.722 -5.553 1197 2HD ARG 151 HD1 ARG 151 263.811 -8.479 -3.979 1198 HE ARG 151 HE ARG 151 262.948 -9.761 -6.336 1199 1HH1 ARG 151 HH11 ARG 151 262.314 -9.693 -2.905 1200 2HH1 ARG 151 HH12 ARG 151 261.767 -11.335 -2.846 1201 1HH2 ARG 151 HH21 ARG 151 262.228 -11.921 -6.261 1202 2HH2 ARG 151 HH22 ARG 151 261.718 -12.600 -4.751 1203 H GLU 152 HN GLU 152 262.325 -4.996 -7.557 1204 HA GLU 152 HA GLU 152 260.312 -2.958 -8.176 1205 1HB GLU 152 HB2 GLU 152 261.662 -2.446 -10.133 1206 2HB GLU 152 HB1 GLU 152 262.666 -2.435 -8.690 1207 1HG GLU 152 HG2 GLU 152 263.936 -4.127 -9.407 1208 2HG GLU 152 HG1 GLU 152 262.562 -5.016 -10.060 1209 H VAL 153 HN VAL 153 258.940 -3.131 -9.970 1210 HA VAL 153 HA VAL 153 258.863 -5.674 -11.401 1211 HB VAL 153 HB VAL 153 256.378 -5.831 -11.018 1212 1HG1 VAL 153 HG11 VAL 153 258.081 -6.147 -8.550 1213 2HG1 VAL 153 HG12 VAL 153 258.037 -7.284 -9.897 1214 3HG1 VAL 153 HG13 VAL 153 256.590 -7.011 -8.927 1215 1HG2 VAL 153 HG21 VAL 153 255.831 -3.671 -10.220 1216 2HG2 VAL 153 HG22 VAL 153 257.038 -3.760 -8.937 1217 3HG2 VAL 153 HG23 VAL 153 255.595 -4.772 -8.862 1218 H ASP 154 HN ASP 154 257.493 -5.625 -13.295 1219 HA ASP 154 HA ASP 154 256.553 -2.999 -14.151 1220 1HB ASP 154 HB2 ASP 154 258.813 -4.513 -15.393 1221 2HB ASP 154 HB1 ASP 154 257.741 -3.580 -16.432 1222 H THR 155 HN THR 155 256.993 -6.402 -15.082 1223 HA THR 155 HA THR 155 254.671 -6.326 -16.804 1224 HB THR 155 HB THR 155 255.931 -8.910 -16.043 1225 HG1 THR 155 HG1 THR 155 257.802 -7.870 -16.279 1226 1HG2 THR 155 HG21 THR 155 254.939 -9.566 -17.898 1227 2HG2 THR 155 HG22 THR 155 255.931 -8.439 -18.824 1228 3HG2 THR 155 HG23 THR 155 254.366 -7.925 -18.193 1229 H VAL 156 HN VAL 156 253.055 -8.187 -16.556 1230 HA VAL 156 HA VAL 156 252.332 -8.484 -13.713 1231 HB VAL 156 HB VAL 156 250.840 -6.880 -14.822 1232 1HG1 VAL 156 HG11 VAL 156 249.826 -7.207 -16.806 1233 2HG1 VAL 156 HG12 VAL 156 249.537 -8.919 -16.496 1234 3HG1 VAL 156 HG13 VAL 156 251.122 -8.379 -17.050 1235 1HG2 VAL 156 HG21 VAL 156 249.855 -8.087 -13.042 1236 2HG2 VAL 156 HG22 VAL 156 249.656 -9.531 -14.034 1237 3HG2 VAL 156 HG23 VAL 156 248.675 -8.100 -14.353 Start of MODEL 9 1 1H MET 1 HT1 MET 1 240.322 -17.160 1.071 2 2H MET 1 HT2 MET 1 241.644 -17.848 0.221 3 3H MET 1 HT3 MET 1 241.731 -17.638 1.921 4 HA MET 1 HA MET 1 239.759 -19.130 2.064 5 1HB MET 1 HB2 MET 1 239.430 -20.610 0.146 6 2HB MET 1 HB1 MET 1 239.160 -18.935 -0.312 7 1HG MET 1 HG2 MET 1 240.910 -18.893 -1.726 8 2HG MET 1 HG1 MET 1 241.892 -19.951 -0.716 9 1HE MET 1 HE1 MET 1 241.343 -23.413 -1.978 10 2HE MET 1 HE2 MET 1 241.436 -22.510 -0.466 11 3HE MET 1 HE3 MET 1 242.621 -22.221 -1.739 12 H GLY 2 HN GLY 2 243.034 -19.113 0.890 13 1HA GLY 2 HA2 GLY 2 243.515 -21.747 2.114 14 2HA GLY 2 HA1 GLY 2 244.567 -20.964 0.945 15 H ALA 3 HN ALA 3 246.440 -20.492 1.873 16 HA ALA 3 HA ALA 3 246.419 -19.471 4.637 17 1HB ALA 3 HB1 ALA 3 247.720 -21.332 4.836 18 2HB ALA 3 HB2 ALA 3 248.960 -20.163 4.382 19 3HB ALA 3 HB3 ALA 3 248.287 -21.251 3.168 20 H SER 4 HN SER 4 245.825 -17.469 3.177 21 HA SER 4 HA SER 4 247.986 -15.685 3.332 22 1HB SER 4 HB2 SER 4 248.691 -15.377 1.143 23 2HB SER 4 HB1 SER 4 248.472 -17.125 1.206 24 HG SER 4 HG SER 4 246.750 -15.184 0.075 25 H ARG 5 HN ARG 5 246.555 -14.427 4.397 26 HA ARG 5 HA ARG 5 243.985 -13.745 3.492 27 1HB ARG 5 HB2 ARG 5 244.703 -13.444 5.820 28 2HB ARG 5 HB1 ARG 5 245.846 -12.207 5.316 29 1HG ARG 5 HG2 ARG 5 244.143 -10.879 6.006 30 2HG ARG 5 HG1 ARG 5 243.662 -11.100 4.323 31 1HD ARG 5 HD2 ARG 5 242.604 -12.542 6.746 32 2HD ARG 5 HD1 ARG 5 241.733 -11.439 5.685 33 HE ARG 5 HE ARG 5 241.615 -13.119 4.055 34 1HH1 ARG 5 HH11 ARG 5 243.271 -14.225 6.930 35 2HH1 ARG 5 HH12 ARG 5 243.120 -15.899 6.516 36 1HH2 ARG 5 HH21 ARG 5 241.423 -15.318 3.520 37 2HH2 ARG 5 HH22 ARG 5 242.075 -16.519 4.584 38 H LEU 6 HN LEU 6 243.971 -13.104 1.378 39 HA LEU 6 HA LEU 6 245.731 -10.978 0.492 40 1HB LEU 6 HB2 LEU 6 244.792 -13.059 -0.847 41 2HB LEU 6 HB1 LEU 6 243.468 -11.958 -1.181 42 HG LEU 6 HG LEU 6 246.252 -11.015 -1.693 43 1HD1 LEU 6 HD11 LEU 6 245.815 -11.963 -4.081 44 2HD1 LEU 6 HD12 LEU 6 244.810 -13.132 -3.222 45 3HD1 LEU 6 HD13 LEU 6 246.526 -12.992 -2.837 46 1HD2 LEU 6 HD21 LEU 6 244.294 -9.519 -1.940 47 2HD2 LEU 6 HD22 LEU 6 243.655 -10.607 -3.171 48 3HD2 LEU 6 HD23 LEU 6 245.174 -9.756 -3.449 49 H TYR 7 HN TYR 7 245.301 -8.945 0.761 50 HA TYR 7 HA TYR 7 242.505 -8.027 0.856 51 1HB TYR 7 HB2 TYR 7 244.796 -7.511 2.658 52 2HB TYR 7 HB1 TYR 7 243.826 -6.103 2.242 53 HD1 TYR 7 HD1 TYR 7 242.824 -5.667 4.333 54 HD2 TYR 7 HD2 TYR 7 242.567 -9.568 2.657 55 HE1 TYR 7 HE1 TYR 7 241.181 -6.292 6.052 56 HE2 TYR 7 HE2 TYR 7 240.922 -10.202 4.369 57 HH TYR 7 HH TYR 7 240.440 -9.240 6.904 58 H THR 8 HN THR 8 242.637 -5.436 0.654 59 HA THR 8 HA THR 8 244.359 -4.817 -1.660 60 HB THR 8 HB THR 8 242.472 -3.565 -2.629 61 HG1 THR 8 HG1 THR 8 240.900 -4.804 -0.627 62 1HG2 THR 8 HG21 THR 8 240.934 -5.590 -3.037 63 2HG2 THR 8 HG22 THR 8 242.153 -6.488 -2.135 64 3HG2 THR 8 HG23 THR 8 242.596 -5.641 -3.617 65 H LEU 9 HN LEU 9 244.471 -2.452 -2.095 66 HA LEU 9 HA LEU 9 243.957 -0.677 0.134 67 1HB LEU 9 HB2 LEU 9 246.174 -1.841 0.573 68 2HB LEU 9 HB1 LEU 9 246.784 -1.032 -0.856 69 HG LEU 9 HG LEU 9 245.742 0.358 1.605 70 1HD1 LEU 9 HD11 LEU 9 248.570 0.001 0.634 71 2HD1 LEU 9 HD12 LEU 9 247.844 -0.837 2.005 72 3HD1 LEU 9 HD13 LEU 9 248.060 0.912 2.055 73 1HD2 LEU 9 HD21 LEU 9 247.042 2.278 0.429 74 2HD2 LEU 9 HD22 LEU 9 245.396 1.894 -0.074 75 3HD2 LEU 9 HD23 LEU 9 246.764 1.319 -1.025 76 H VAL 10 HN VAL 10 242.933 0.902 -1.005 77 HA VAL 10 HA VAL 10 244.112 1.721 -3.558 78 HB VAL 10 HB VAL 10 241.928 1.109 -4.006 79 1HG1 VAL 10 HG11 VAL 10 240.045 2.140 -2.507 80 2HG1 VAL 10 HG12 VAL 10 241.343 2.120 -1.316 81 3HG1 VAL 10 HG13 VAL 10 240.848 0.624 -2.107 82 1HG2 VAL 10 HG21 VAL 10 241.702 4.053 -3.424 83 2HG2 VAL 10 HG22 VAL 10 240.694 3.130 -4.536 84 3HG2 VAL 10 HG23 VAL 10 242.408 3.353 -4.880 85 H LEU 11 HN LEU 11 245.135 3.513 -3.686 86 HA LEU 11 HA LEU 11 244.469 5.726 -1.868 87 1HB LEU 11 HB2 LEU 11 246.913 4.259 -2.115 88 2HB LEU 11 HB1 LEU 11 247.189 5.892 -2.687 89 HG LEU 11 HG LEU 11 246.343 5.000 0.064 90 1HD1 LEU 11 HD11 LEU 11 248.326 6.997 0.145 91 2HD1 LEU 11 HD12 LEU 11 248.798 5.871 -1.126 92 3HD1 LEU 11 HD13 LEU 11 248.501 5.277 0.504 93 1HD2 LEU 11 HD21 LEU 11 244.916 6.770 -0.060 94 2HD2 LEU 11 HD22 LEU 11 245.886 7.614 -1.268 95 3HD2 LEU 11 HD23 LEU 11 246.388 7.612 0.423 96 H VAL 12 HN VAL 12 243.595 7.270 -3.100 97 HA VAL 12 HA VAL 12 244.092 7.399 -5.918 98 HB VAL 12 HB VAL 12 242.641 9.465 -4.277 99 1HG1 VAL 12 HG11 VAL 12 242.483 10.431 -6.282 100 2HG1 VAL 12 HG12 VAL 12 241.365 9.131 -6.698 101 3HG1 VAL 12 HG13 VAL 12 243.074 8.991 -7.111 102 1HG2 VAL 12 HG21 VAL 12 241.895 6.696 -4.957 103 2HG2 VAL 12 HG22 VAL 12 240.661 7.920 -5.253 104 3HG2 VAL 12 HG23 VAL 12 241.344 7.729 -3.638 105 H LEU 13 HN LEU 13 246.093 8.001 -6.460 106 HA LEU 13 HA LEU 13 247.037 10.621 -5.498 107 1HB LEU 13 HB2 LEU 13 248.300 8.583 -4.680 108 2HB LEU 13 HB1 LEU 13 248.829 8.373 -6.336 109 HG LEU 13 HG LEU 13 250.541 9.694 -5.889 110 1HD1 LEU 13 HD11 LEU 13 248.433 11.788 -5.515 111 2HD1 LEU 13 HD12 LEU 13 249.410 11.462 -6.944 112 3HD1 LEU 13 HD13 LEU 13 250.157 12.141 -5.501 113 1HD2 LEU 13 HD21 LEU 13 249.219 9.712 -3.296 114 2HD2 LEU 13 HD22 LEU 13 250.261 11.107 -3.576 115 3HD2 LEU 13 HD23 LEU 13 250.918 9.475 -3.702 116 H GLN 14 HN GLN 14 247.032 12.066 -7.054 117 HA GLN 14 HA GLN 14 247.327 11.189 -9.842 118 1HB GLN 14 HB2 GLN 14 246.057 13.622 -8.596 119 2HB GLN 14 HB1 GLN 14 246.439 13.551 -10.311 120 1HG GLN 14 HG2 GLN 14 245.057 11.416 -10.364 121 2HG GLN 14 HG1 GLN 14 244.483 11.887 -8.765 122 1HE2 GLN 14 HE21 GLN 14 243.140 13.660 -8.551 123 2HE2 GLN 14 HE22 GLN 14 242.350 14.395 -9.901 124 HA PRO 15 HA PRO 15 251.268 13.116 -10.261 125 1HB PRO 15 HB2 PRO 15 251.080 14.341 -12.696 126 2HB PRO 15 HB1 PRO 15 251.306 12.602 -12.485 127 1HG PRO 15 HG2 PRO 15 248.794 14.133 -13.029 128 2HG PRO 15 HG1 PRO 15 249.349 12.603 -13.735 129 1HD PRO 15 HD2 PRO 15 247.496 12.679 -11.785 130 2HD PRO 15 HD1 PRO 15 248.691 11.369 -11.891 131 H GLN 16 HN GLN 16 249.119 14.725 -8.928 132 HA GLN 16 HA GLN 16 250.506 17.222 -8.919 133 1HB GLN 16 HB2 GLN 16 248.474 18.585 -9.441 134 2HB GLN 16 HB1 GLN 16 249.115 17.696 -10.815 135 1HG GLN 16 HG2 GLN 16 247.309 15.923 -9.839 136 2HG GLN 16 HG1 GLN 16 246.536 17.460 -9.450 137 1HE2 GLN 16 HE21 GLN 16 245.957 15.297 -11.447 138 2HE2 GLN 16 HE22 GLN 16 245.802 16.127 -12.953 139 H ARG 17 HN ARG 17 247.675 15.361 -7.911 140 HA ARG 17 HA ARG 17 248.083 16.339 -5.189 141 1HB ARG 17 HB2 ARG 17 245.530 16.496 -4.980 142 2HB ARG 17 HB1 ARG 17 246.363 17.803 -5.811 143 1HG ARG 17 HG2 ARG 17 245.812 16.252 -7.915 144 2HG ARG 17 HG1 ARG 17 244.482 15.782 -6.854 145 1HD ARG 17 HD2 ARG 17 243.960 18.200 -6.558 146 2HD ARG 17 HD1 ARG 17 245.186 18.565 -7.772 147 HE ARG 17 HE ARG 17 243.576 16.810 -9.045 148 1HH1 ARG 17 HH11 ARG 17 242.947 19.757 -7.286 149 2HH1 ARG 17 HH12 ARG 17 241.549 20.165 -8.223 150 1HH2 ARG 17 HH21 ARG 17 241.739 17.344 -10.278 151 2HH2 ARG 17 HH22 ARG 17 240.862 18.795 -9.922 152 H VAL 18 HN VAL 18 246.951 15.028 -3.565 153 HA VAL 18 HA VAL 18 246.331 12.295 -4.479 154 HB VAL 18 HB VAL 18 248.561 12.136 -3.648 155 1HG1 VAL 18 HG11 VAL 18 249.368 13.067 -1.653 156 2HG1 VAL 18 HG12 VAL 18 247.744 13.372 -1.037 157 3HG1 VAL 18 HG13 VAL 18 248.377 14.336 -2.372 158 1HG2 VAL 18 HG21 VAL 18 247.013 10.358 -2.936 159 2HG2 VAL 18 HG22 VAL 18 246.705 11.245 -1.443 160 3HG2 VAL 18 HG23 VAL 18 248.316 10.614 -1.776 161 H LEU 19 HN LEU 19 245.009 11.069 -2.985 162 HA LEU 19 HA LEU 19 243.462 12.771 -1.142 163 1HB LEU 19 HB2 LEU 19 242.252 12.115 -3.244 164 2HB LEU 19 HB1 LEU 19 242.384 10.446 -2.726 165 HG LEU 19 HG LEU 19 240.959 10.818 -0.849 166 1HD1 LEU 19 HD11 LEU 19 241.416 13.699 -1.479 167 2HD1 LEU 19 HD12 LEU 19 241.503 12.857 0.069 168 3HD1 LEU 19 HD13 LEU 19 239.935 13.203 -0.660 169 1HD2 LEU 19 HD21 LEU 19 240.015 11.933 -3.456 170 2HD2 LEU 19 HD22 LEU 19 238.943 11.921 -2.056 171 3HD2 LEU 19 HD23 LEU 19 239.603 10.407 -2.674 172 H LEU 20 HN LEU 20 243.687 12.169 0.901 173 HA LEU 20 HA LEU 20 244.334 9.355 1.474 174 1HB LEU 20 HB2 LEU 20 245.334 11.883 2.501 175 2HB LEU 20 HB1 LEU 20 244.801 10.822 3.791 176 HG LEU 20 HG LEU 20 246.710 9.911 1.648 177 1HD1 LEU 20 HD11 LEU 20 247.604 10.754 4.372 178 2HD1 LEU 20 HD12 LEU 20 247.452 11.945 3.080 179 3HD1 LEU 20 HD13 LEU 20 248.541 10.570 2.890 180 1HD2 LEU 20 HD21 LEU 20 246.707 8.813 4.388 181 2HD2 LEU 20 HD22 LEU 20 246.920 8.001 2.838 182 3HD2 LEU 20 HD23 LEU 20 245.303 8.435 3.390 183 H GLY 21 HN GLY 21 243.308 8.309 3.241 184 1HA GLY 21 HA2 GLY 21 240.622 9.383 3.756 185 2HA GLY 21 HA1 GLY 21 241.091 7.696 3.888 186 H MET 22 HN MET 22 240.312 10.404 5.602 187 HA MET 22 HA MET 22 241.968 9.775 7.921 188 1HB MET 22 HB2 MET 22 240.014 12.010 7.363 189 2HB MET 22 HB1 MET 22 240.822 11.791 8.908 190 1HG MET 22 HG2 MET 22 242.954 11.783 7.301 191 2HG MET 22 HG1 MET 22 241.868 12.788 6.341 192 1HE MET 22 HE1 MET 22 244.178 12.281 8.926 193 2HE MET 22 HE2 MET 22 243.315 12.829 10.364 194 3HE MET 22 HE3 MET 22 244.511 13.877 9.600 195 H LYS 23 HN LYS 23 241.120 9.013 9.874 196 HA LYS 23 HA LYS 23 238.521 7.737 9.662 197 1HB LYS 23 HB2 LYS 23 240.939 7.392 11.275 198 2HB LYS 23 HB1 LYS 23 239.457 7.228 12.207 199 1HG LYS 23 HG2 LYS 23 239.720 5.770 9.622 200 2HG LYS 23 HG1 LYS 23 240.551 5.157 11.052 201 1HD LYS 23 HD2 LYS 23 237.646 5.878 11.166 202 2HD LYS 23 HD1 LYS 23 238.160 4.314 10.529 203 1HE LYS 23 HE2 LYS 23 238.913 5.397 13.241 204 2HE LYS 23 HE1 LYS 23 237.590 4.270 12.944 205 1HZ LYS 23 HZ1 LYS 23 240.485 3.794 12.516 206 2HZ LYS 23 HZ2 LYS 23 239.279 2.746 11.963 207 3HZ LYS 23 HZ3 LYS 23 239.467 3.017 13.622 208 H LYS 24 HN LYS 24 236.775 8.181 11.060 209 HA LYS 24 HA LYS 24 236.822 10.905 12.064 210 1HB LYS 24 HB2 LYS 24 234.857 9.270 10.854 211 2HB LYS 24 HB1 LYS 24 234.290 9.609 12.484 212 1HG LYS 24 HG2 LYS 24 233.434 11.437 11.493 213 2HG LYS 24 HG1 LYS 24 235.059 12.073 11.757 214 1HD LYS 24 HD2 LYS 24 235.681 11.311 9.485 215 2HD LYS 24 HD1 LYS 24 234.012 10.797 9.234 216 1HE LYS 24 HE2 LYS 24 234.833 13.616 9.912 217 2HE LYS 24 HE1 LYS 24 234.561 13.035 8.271 218 1HZ LYS 24 HZ1 LYS 24 232.428 12.578 10.206 219 2HZ LYS 24 HZ2 LYS 24 232.333 12.972 8.563 220 3HZ LYS 24 HZ3 LYS 24 232.669 14.175 9.702 221 H ARG 25 HN ARG 25 236.436 7.625 13.278 222 HA ARG 25 HA ARG 25 237.242 8.451 15.872 223 1HB ARG 25 HB2 ARG 25 235.081 7.520 16.957 224 2HB ARG 25 HB1 ARG 25 235.084 9.167 16.342 225 1HG ARG 25 HG2 ARG 25 233.037 7.927 15.773 226 2HG ARG 25 HG1 ARG 25 233.925 8.475 14.349 227 1HD ARG 25 HD2 ARG 25 234.623 6.344 13.801 228 2HD ARG 25 HD1 ARG 25 234.431 5.748 15.449 229 HE ARG 25 HE ARG 25 231.969 6.511 14.147 230 1HH1 ARG 25 HH11 ARG 25 234.228 3.922 14.768 231 2HH1 ARG 25 HH12 ARG 25 233.063 2.672 14.485 232 1HH2 ARG 25 HH21 ARG 25 230.439 4.868 13.774 233 2HH2 ARG 25 HH22 ARG 25 230.914 3.208 13.920 234 H GLY 26 HN GLY 26 237.110 6.589 17.471 235 1HA GLY 26 HA2 GLY 26 237.137 4.264 17.901 236 2HA GLY 26 HA1 GLY 26 237.103 3.968 16.167 237 H PHE 27 HN PHE 27 238.887 2.874 15.665 238 HA PHE 27 HA PHE 27 241.415 3.608 16.952 239 1HB PHE 27 HB2 PHE 27 240.453 1.145 15.529 240 2HB PHE 27 HB1 PHE 27 242.177 1.444 15.724 241 HD1 PHE 27 HD1 PHE 27 243.245 0.728 17.639 242 HD2 PHE 27 HD2 PHE 27 239.023 1.255 17.692 243 HE1 PHE 27 HE1 PHE 27 243.157 -0.237 19.900 244 HE2 PHE 27 HE2 PHE 27 238.927 0.291 19.953 245 HZ PHE 27 HZ PHE 27 240.996 -0.456 21.061 246 H GLY 28 HN GLY 28 241.356 5.608 15.566 247 1HA GLY 28 HA2 GLY 28 243.276 5.674 13.670 248 2HA GLY 28 HA1 GLY 28 241.858 5.219 12.742 249 H ALA 29 HN ALA 29 240.256 6.950 14.754 250 HA ALA 29 HA ALA 29 239.660 9.111 13.281 251 1HB ALA 29 HB1 ALA 29 239.144 8.345 15.858 252 2HB ALA 29 HB2 ALA 29 238.470 9.744 15.023 253 3HB ALA 29 HB3 ALA 29 239.895 9.929 16.043 254 H GLY 30 HN GLY 30 240.784 10.746 12.397 255 1HA GLY 30 HA2 GLY 30 242.148 12.662 12.471 256 2HA GLY 30 HA1 GLY 30 242.849 12.078 13.972 257 H ARG 31 HN ARG 31 242.944 9.443 12.092 258 HA ARG 31 HA ARG 31 245.655 10.072 11.151 259 1HB ARG 31 HB2 ARG 31 244.651 7.913 12.651 260 2HB ARG 31 HB1 ARG 31 245.008 7.259 11.059 261 1HG ARG 31 HG2 ARG 31 246.961 6.960 12.318 262 2HG ARG 31 HG1 ARG 31 247.285 8.348 11.278 263 1HD ARG 31 HD2 ARG 31 247.117 9.862 13.032 264 2HD ARG 31 HD1 ARG 31 246.198 8.743 14.037 265 HE ARG 31 HE ARG 31 248.602 7.521 13.764 266 1HH1 ARG 31 HH11 ARG 31 247.630 10.711 14.794 267 2HH1 ARG 31 HH12 ARG 31 248.975 10.911 15.867 268 1HH2 ARG 31 HH21 ARG 31 250.371 7.781 15.175 269 2HH2 ARG 31 HH22 ARG 31 250.531 9.248 16.083 270 H TRP 32 HN TRP 32 246.281 9.583 9.054 271 HA TRP 32 HA TRP 32 244.064 9.286 7.168 272 1HB TRP 32 HB2 TRP 32 246.780 9.791 6.115 273 2HB TRP 32 HB1 TRP 32 245.244 10.515 5.665 274 HD1 TRP 32 HD1 TRP 32 247.727 10.765 8.657 275 HE1 TRP 32 HE1 TRP 32 247.797 13.224 9.408 276 HE3 TRP 32 HE3 TRP 32 244.277 12.703 5.420 277 HZ2 TRP 32 HZ2 TRP 32 246.565 15.664 8.715 278 HZ3 TRP 32 HZ3 TRP 32 243.785 15.111 5.528 279 HH2 TRP 32 HH2 TRP 32 244.905 16.560 7.140 280 H ASN 33 HN ASN 33 244.200 7.813 5.392 281 HA ASN 33 HA ASN 33 246.241 5.968 4.962 282 1HB ASN 33 HB2 ASN 33 245.096 5.376 7.360 283 2HB ASN 33 HB1 ASN 33 244.112 4.397 6.276 284 1HD2 ASN 33 HD21 ASN 33 245.581 3.115 8.095 285 2HD2 ASN 33 HD22 ASN 33 246.934 2.328 7.362 286 H GLY 34 HN GLY 34 245.812 4.600 3.246 287 1HA GLY 34 HA2 GLY 34 243.823 5.371 1.445 288 2HA GLY 34 HA1 GLY 34 244.738 3.873 1.353 289 H PHE 35 HN PHE 35 242.522 3.285 0.428 290 HA PHE 35 HA PHE 35 240.723 2.469 2.612 291 1HB PHE 35 HB2 PHE 35 239.804 2.385 -0.221 292 2HB PHE 35 HB1 PHE 35 238.902 2.754 1.238 293 HD1 PHE 35 HD1 PHE 35 240.679 4.093 -1.569 294 HD2 PHE 35 HD2 PHE 35 239.213 5.007 2.319 295 HE1 PHE 35 HE1 PHE 35 240.852 6.495 -2.072 296 HE2 PHE 35 HE2 PHE 35 239.381 7.410 1.823 297 HZ PHE 35 HZ PHE 35 240.201 8.157 -0.376 298 H GLY 36 HN GLY 36 241.802 0.562 3.137 299 1HA GLY 36 HA2 GLY 36 242.371 -1.370 1.062 300 2HA GLY 36 HA1 GLY 36 242.678 -1.567 2.779 301 H GLY 37 HN GLY 37 241.456 -3.381 0.793 302 1HA GLY 37 HA2 GLY 37 238.918 -3.846 2.229 303 2HA GLY 37 HA1 GLY 37 239.029 -4.031 0.484 304 H LYS 38 HN LYS 38 238.312 -6.222 0.761 305 HA LYS 38 HA LYS 38 240.545 -8.024 1.210 306 1HB LYS 38 HB2 LYS 38 239.418 -9.438 2.785 307 2HB LYS 38 HB1 LYS 38 239.399 -7.798 3.419 308 1HG LYS 38 HG2 LYS 38 237.056 -7.703 2.251 309 2HG LYS 38 HG1 LYS 38 237.157 -9.460 2.386 310 1HD LYS 38 HD2 LYS 38 237.925 -8.688 4.878 311 2HD LYS 38 HD1 LYS 38 236.769 -7.421 4.466 312 1HE LYS 38 HE2 LYS 38 235.344 -9.513 3.667 313 2HE LYS 38 HE1 LYS 38 236.344 -10.334 4.865 314 1HZ LYS 38 HZ1 LYS 38 234.071 -9.129 5.468 315 2HZ LYS 38 HZ2 LYS 38 235.121 -7.824 5.689 316 3HZ LYS 38 HZ3 LYS 38 235.355 -9.252 6.563 317 H VAL 39 HN VAL 39 240.438 -9.884 0.011 318 HA VAL 39 HA VAL 39 238.367 -9.953 -2.033 319 HB VAL 39 HB VAL 39 240.455 -12.074 -1.914 320 1HG1 VAL 39 HG11 VAL 39 240.478 -11.637 -4.354 321 2HG1 VAL 39 HG12 VAL 39 239.251 -10.395 -4.106 322 3HG1 VAL 39 HG13 VAL 39 238.887 -12.080 -3.736 323 1HG2 VAL 39 HG21 VAL 39 241.054 -9.204 -2.003 324 2HG2 VAL 39 HG22 VAL 39 241.781 -10.154 -3.298 325 3HG2 VAL 39 HG23 VAL 39 242.096 -10.574 -1.615 326 H GLN 40 HN GLN 40 236.504 -10.759 -1.193 327 HA GLN 40 HA GLN 40 236.207 -12.706 0.746 328 1HB GLN 40 HB2 GLN 40 234.382 -12.130 -1.594 329 2HB GLN 40 HB1 GLN 40 233.931 -13.042 -0.160 330 1HG GLN 40 HG2 GLN 40 234.175 -11.114 1.227 331 2HG GLN 40 HG1 GLN 40 234.857 -10.182 -0.106 332 1HE2 GLN 40 HE21 GLN 40 233.517 -8.926 -1.185 333 2HE2 GLN 40 HE22 GLN 40 231.796 -9.063 -1.215 334 H GLU 41 HN GLU 41 235.011 -14.878 0.244 335 HA GLU 41 HA GLU 41 236.875 -16.619 -0.907 336 1HB GLU 41 HB2 GLU 41 233.935 -17.157 -0.456 337 2HB GLU 41 HB1 GLU 41 235.211 -18.357 -0.602 338 1HG GLU 41 HG2 GLU 41 235.908 -18.075 1.520 339 2HG GLU 41 HG1 GLU 41 235.578 -16.344 1.515 340 H GLY 42 HN GLY 42 237.342 -15.845 -3.001 341 1HA GLY 42 HA2 GLY 42 237.096 -16.544 -5.271 342 2HA GLY 42 HA1 GLY 42 235.369 -16.712 -4.998 343 H GLU 43 HN GLU 43 237.628 -14.018 -4.401 344 HA GLU 43 HA GLU 43 236.013 -12.379 -6.229 345 1HB GLU 43 HB2 GLU 43 236.229 -12.041 -3.451 346 2HB GLU 43 HB1 GLU 43 237.286 -10.820 -4.143 347 1HG GLU 43 HG2 GLU 43 235.584 -9.594 -4.891 348 2HG GLU 43 HG1 GLU 43 234.688 -11.003 -5.456 349 H THR 44 HN THR 44 237.307 -10.296 -6.753 350 HA THR 44 HA THR 44 240.064 -11.133 -7.342 351 HB THR 44 HB THR 44 239.947 -9.542 -9.234 352 HG1 THR 44 HG1 THR 44 238.175 -8.418 -9.644 353 1HG2 THR 44 HG21 THR 44 239.343 -11.933 -9.533 354 2HG2 THR 44 HG22 THR 44 238.556 -10.843 -10.674 355 3HG2 THR 44 HG23 THR 44 237.654 -11.484 -9.301 356 H ILE 45 HN ILE 45 241.736 -9.826 -6.847 357 HA ILE 45 HA ILE 45 241.594 -8.182 -4.655 358 HB ILE 45 HB ILE 45 243.669 -7.638 -6.744 359 1HG1 ILE 45 HG12 ILE 45 243.533 -10.069 -4.953 360 2HG1 ILE 45 HG11 ILE 45 243.479 -10.066 -6.710 361 1HG2 ILE 45 HG21 ILE 45 243.480 -7.539 -3.771 362 2HG2 ILE 45 HG22 ILE 45 243.979 -6.283 -4.904 363 3HG2 ILE 45 HG23 ILE 45 245.048 -7.645 -4.569 364 1HD1 ILE 45 HD11 ILE 45 245.668 -10.707 -5.634 365 2HD1 ILE 45 HD12 ILE 45 245.830 -9.008 -5.187 366 3HD1 ILE 45 HD13 ILE 45 245.733 -9.468 -6.887 367 H GLU 46 HN GLU 46 241.146 -7.343 -8.027 368 HA GLU 46 HA GLU 46 241.154 -4.499 -7.581 369 1HB GLU 46 HB2 GLU 46 241.477 -6.023 -9.796 370 2HB GLU 46 HB1 GLU 46 239.780 -5.596 -9.965 371 1HG GLU 46 HG2 GLU 46 240.263 -3.293 -10.045 372 2HG GLU 46 HG1 GLU 46 241.915 -3.544 -9.486 373 H ASP 47 HN ASP 47 238.863 -7.078 -7.393 374 HA ASP 47 HA ASP 47 236.554 -5.342 -7.517 375 1HB ASP 47 HB2 ASP 47 236.987 -8.275 -7.138 376 2HB ASP 47 HB1 ASP 47 235.467 -7.575 -6.597 377 H GLY 48 HN GLY 48 238.399 -7.104 -5.079 378 1HA GLY 48 HA2 GLY 48 236.744 -6.411 -2.876 379 2HA GLY 48 HA1 GLY 48 238.421 -6.937 -2.779 380 H ALA 49 HN ALA 49 239.477 -4.850 -4.427 381 HA ALA 49 HA ALA 49 239.758 -2.795 -2.443 382 1HB ALA 49 HB1 ALA 49 241.438 -3.751 -4.295 383 2HB ALA 49 HB2 ALA 49 241.583 -2.131 -3.614 384 3HB ALA 49 HB3 ALA 49 240.804 -2.362 -5.178 385 H ARG 50 HN ARG 50 238.110 -3.202 -5.520 386 HA ARG 50 HA ARG 50 237.342 -0.473 -5.787 387 1HB ARG 50 HB2 ARG 50 236.687 -3.026 -7.153 388 2HB ARG 50 HB1 ARG 50 235.531 -1.715 -7.319 389 1HG ARG 50 HG2 ARG 50 237.644 -0.321 -7.959 390 2HG ARG 50 HG1 ARG 50 238.332 -1.908 -8.309 391 1HD ARG 50 HD2 ARG 50 236.089 -2.257 -9.611 392 2HD ARG 50 HD1 ARG 50 236.047 -0.496 -9.611 393 HE ARG 50 HE ARG 50 237.794 -0.474 -11.106 394 1HH1 ARG 50 HH11 ARG 50 237.393 -3.703 -9.838 395 2HH1 ARG 50 HH12 ARG 50 238.470 -4.422 -10.988 396 1HH2 ARG 50 HH21 ARG 50 239.211 -1.420 -12.617 397 2HH2 ARG 50 HH22 ARG 50 239.502 -3.127 -12.565 398 H ARG 51 HN ARG 51 235.535 -3.402 -4.879 399 HA ARG 51 HA ARG 51 233.126 -2.112 -4.243 400 1HB ARG 51 HB2 ARG 51 234.302 -4.739 -3.350 401 2HB ARG 51 HB1 ARG 51 232.696 -4.211 -2.867 402 1HG ARG 51 HG2 ARG 51 233.518 -4.405 -5.747 403 2HG ARG 51 HG1 ARG 51 232.848 -5.772 -4.856 404 1HD ARG 51 HD2 ARG 51 230.904 -4.249 -4.272 405 2HD ARG 51 HD1 ARG 51 231.540 -3.137 -5.484 406 HE ARG 51 HE ARG 51 230.644 -4.477 -7.091 407 1HH1 ARG 51 HH11 ARG 51 231.025 -6.371 -4.185 408 2HH1 ARG 51 HH12 ARG 51 230.248 -7.771 -4.845 409 1HH2 ARG 51 HH21 ARG 51 229.623 -6.317 -7.962 410 2HH2 ARG 51 HH22 ARG 51 229.453 -7.741 -6.990 411 H GLU 52 HN GLU 52 236.003 -2.719 -2.331 412 HA GLU 52 HA GLU 52 234.756 -1.815 0.119 413 1HB GLU 52 HB2 GLU 52 237.614 -2.554 -0.534 414 2HB GLU 52 HB1 GLU 52 237.060 -2.076 1.064 415 1HG GLU 52 HG2 GLU 52 235.505 -4.238 -0.142 416 2HG GLU 52 HG1 GLU 52 237.198 -4.633 0.149 417 H LEU 53 HN LEU 53 236.417 -0.464 -2.537 418 HA LEU 53 HA LEU 53 237.499 1.826 -1.228 419 1HB LEU 53 HB2 LEU 53 238.530 1.217 -3.251 420 2HB LEU 53 HB1 LEU 53 236.996 1.056 -4.087 421 HG LEU 53 HG LEU 53 236.704 3.494 -4.001 422 1HD1 LEU 53 HD11 LEU 53 239.482 4.024 -3.272 423 2HD1 LEU 53 HD12 LEU 53 238.495 3.396 -1.952 424 3HD1 LEU 53 HD13 LEU 53 238.002 4.859 -2.803 425 1HD2 LEU 53 HD21 LEU 53 238.848 3.993 -5.427 426 2HD2 LEU 53 HD22 LEU 53 237.604 2.896 -6.027 427 3HD2 LEU 53 HD23 LEU 53 239.078 2.249 -5.305 428 H GLN 54 HN GLN 54 234.662 1.246 -3.273 429 HA GLN 54 HA GLN 54 233.646 3.863 -3.234 430 1HB GLN 54 HB2 GLN 54 232.655 2.550 -4.847 431 2HB GLN 54 HB1 GLN 54 232.510 1.160 -3.783 432 1HG GLN 54 HG2 GLN 54 230.657 2.210 -2.621 433 2HG GLN 54 HG1 GLN 54 230.826 3.652 -3.622 434 1HE2 GLN 54 HE21 GLN 54 229.320 3.769 -5.110 435 2HE2 GLN 54 HE22 GLN 54 228.633 2.445 -5.982 436 H GLU 55 HN GLU 55 233.527 1.312 -0.899 437 HA GLU 55 HA GLU 55 231.358 2.451 0.616 438 1HB GLU 55 HB2 GLU 55 233.110 0.055 0.870 439 2HB GLU 55 HB1 GLU 55 232.268 0.631 2.303 440 1HG GLU 55 HG2 GLU 55 230.173 0.590 0.783 441 2HG GLU 55 HG1 GLU 55 231.146 -0.473 -0.233 442 H GLU 56 HN GLU 56 234.802 2.794 0.601 443 HA GLU 56 HA GLU 56 234.996 3.581 3.342 444 1HB GLU 56 HB2 GLU 56 236.841 3.312 1.066 445 2HB GLU 56 HB1 GLU 56 237.288 4.524 2.260 446 1HG GLU 56 HG2 GLU 56 236.470 2.147 3.608 447 2HG GLU 56 HG1 GLU 56 237.662 1.735 2.377 448 H SER 57 HN SER 57 234.940 5.407 0.276 449 HA SER 57 HA SER 57 234.286 7.782 1.878 450 1HB SER 57 HB2 SER 57 236.767 7.467 0.790 451 2HB SER 57 HB1 SER 57 235.933 8.336 -0.500 452 HG SER 57 HG SER 57 235.234 9.778 1.318 453 H GLY 58 HN GLY 58 232.731 5.903 0.129 454 1HA GLY 58 HA2 GLY 58 231.038 6.039 -1.412 455 2HA GLY 58 HA1 GLY 58 230.992 7.752 -1.026 456 H LEU 59 HN LEU 59 234.016 6.696 -2.181 457 HA LEU 59 HA LEU 59 233.459 7.946 -4.775 458 1HB LEU 59 HB2 LEU 59 236.029 7.476 -3.273 459 2HB LEU 59 HB1 LEU 59 235.977 8.047 -4.928 460 HG LEU 59 HG LEU 59 235.143 9.477 -2.425 461 1HD1 LEU 59 HD11 LEU 59 236.469 11.282 -3.684 462 2HD1 LEU 59 HD12 LEU 59 237.032 9.952 -4.698 463 3HD1 LEU 59 HD13 LEU 59 237.356 9.938 -2.965 464 1HD2 LEU 59 HD21 LEU 59 234.294 10.116 -5.247 465 2HD2 LEU 59 HD22 LEU 59 234.217 11.258 -3.904 466 3HD2 LEU 59 HD23 LEU 59 233.252 9.782 -3.863 467 H THR 60 HN THR 60 233.013 6.581 -6.326 468 HA THR 60 HA THR 60 234.128 3.878 -6.266 469 HB THR 60 HB THR 60 232.265 4.555 -8.433 470 HG1 THR 60 HG1 THR 60 230.915 5.597 -7.228 471 1HG2 THR 60 HG21 THR 60 231.961 2.370 -8.267 472 2HG2 THR 60 HG22 THR 60 231.196 2.623 -6.699 473 3HG2 THR 60 HG23 THR 60 232.929 2.311 -6.794 474 H VAL 61 HN VAL 61 235.535 3.127 -7.786 475 HA VAL 61 HA VAL 61 236.502 5.118 -9.714 476 HB VAL 61 HB VAL 61 238.574 3.860 -9.814 477 1HG1 VAL 61 HG11 VAL 61 239.241 4.108 -7.377 478 2HG1 VAL 61 HG12 VAL 61 237.570 4.585 -7.079 479 3HG1 VAL 61 HG13 VAL 61 238.578 5.537 -8.169 480 1HG2 VAL 61 HG21 VAL 61 236.960 1.823 -8.497 481 2HG2 VAL 61 HG22 VAL 61 238.526 2.066 -7.725 482 3HG2 VAL 61 HG23 VAL 61 238.441 1.660 -9.439 483 H ASP 62 HN ASP 62 236.603 4.730 -11.851 484 HA ASP 62 HA ASP 62 235.042 2.536 -12.880 485 1HB ASP 62 HB2 ASP 62 236.328 4.976 -14.037 486 2HB ASP 62 HB1 ASP 62 235.924 3.647 -15.120 487 H ALA 63 HN ALA 63 238.329 3.159 -12.188 488 HA ALA 63 HA ALA 63 239.209 0.589 -12.730 489 1HB ALA 63 HB1 ALA 63 239.382 2.445 -15.042 490 2HB ALA 63 HB2 ALA 63 239.132 0.699 -15.006 491 3HB ALA 63 HB3 ALA 63 240.745 1.365 -14.749 492 H LEU 64 HN LEU 64 240.329 0.878 -10.814 493 HA LEU 64 HA LEU 64 242.001 3.040 -10.166 494 1HB LEU 64 HB2 LEU 64 242.201 0.148 -9.306 495 2HB LEU 64 HB1 LEU 64 243.056 1.478 -8.554 496 HG LEU 64 HG LEU 64 240.355 2.217 -8.511 497 1HD1 LEU 64 HD11 LEU 64 239.532 0.067 -8.922 498 2HD1 LEU 64 HD12 LEU 64 239.481 0.232 -7.167 499 3HD1 LEU 64 HD13 LEU 64 240.775 -0.694 -7.930 500 1HD2 LEU 64 HD21 LEU 64 242.496 2.153 -6.806 501 2HD2 LEU 64 HD22 LEU 64 241.383 1.005 -6.064 502 3HD2 LEU 64 HD23 LEU 64 240.861 2.658 -6.382 503 H HIS 65 HN HIS 65 244.478 2.210 -9.586 504 HA HIS 65 HA HIS 65 245.618 1.107 -12.054 505 1HB HIS 65 HB2 HIS 65 245.699 3.805 -11.473 506 2HB HIS 65 HB1 HIS 65 247.250 3.230 -10.872 507 HD1 HIS 65 HD1 HIS 65 247.974 4.896 -12.962 508 HD2 HIS 65 HD2 HIS 65 246.365 1.182 -13.903 509 HE1 HIS 65 HE1 HIS 65 248.654 4.452 -15.342 510 HE2 HIS 65 HE2 HIS 65 247.598 2.238 -15.917 511 H LYS 66 HN LYS 66 246.349 -0.789 -11.236 512 HA LYS 66 HA LYS 66 247.435 -1.120 -8.644 513 1HB LYS 66 HB2 LYS 66 248.131 -3.325 -9.408 514 2HB LYS 66 HB1 LYS 66 246.502 -2.984 -9.971 515 1HG LYS 66 HG2 LYS 66 247.285 -3.730 -11.930 516 2HG LYS 66 HG1 LYS 66 247.946 -2.100 -12.076 517 1HD LYS 66 HD2 LYS 66 249.891 -3.189 -12.411 518 2HD LYS 66 HD1 LYS 66 249.902 -3.310 -10.650 519 1HE LYS 66 HE2 LYS 66 248.586 -5.490 -10.999 520 2HE LYS 66 HE1 LYS 66 249.124 -5.382 -12.674 521 1HZ LYS 66 HZ1 LYS 66 251.437 -5.219 -11.758 522 2HZ LYS 66 HZ2 LYS 66 250.681 -6.717 -11.539 523 3HZ LYS 66 HZ3 LYS 66 250.803 -5.635 -10.245 524 H VAL 67 HN VAL 67 249.500 -0.929 -7.879 525 HA VAL 67 HA VAL 67 251.572 -0.298 -9.889 526 HB VAL 67 HB VAL 67 252.542 1.369 -8.391 527 1HG1 VAL 67 HG11 VAL 67 249.626 1.822 -9.009 528 2HG1 VAL 67 HG12 VAL 67 250.991 2.132 -10.081 529 3HG1 VAL 67 HG13 VAL 67 250.787 3.089 -8.615 530 1HG2 VAL 67 HG21 VAL 67 250.273 0.561 -6.619 531 2HG2 VAL 67 HG22 VAL 67 250.989 2.164 -6.502 532 3HG2 VAL 67 HG23 VAL 67 251.983 0.735 -6.228 533 H GLY 68 HN GLY 68 251.052 -1.296 -6.499 534 1HA GLY 68 HA2 GLY 68 253.366 -3.081 -6.820 535 2HA GLY 68 HA1 GLY 68 253.324 -1.979 -5.453 536 H GLN 69 HN GLN 69 253.593 -4.621 -5.005 537 HA GLN 69 HA GLN 69 250.996 -5.323 -3.812 538 1HB GLN 69 HB2 GLN 69 251.745 -6.713 -5.877 539 2HB GLN 69 HB1 GLN 69 252.910 -7.432 -4.772 540 1HG GLN 69 HG2 GLN 69 250.899 -7.922 -3.270 541 2HG GLN 69 HG1 GLN 69 249.920 -7.569 -4.692 542 1HE2 GLN 69 HE21 GLN 69 252.765 -9.477 -3.766 543 2HE2 GLN 69 HE22 GLN 69 252.351 -10.868 -4.702 544 H ILE 70 HN ILE 70 251.198 -5.233 -1.675 545 HA ILE 70 HA ILE 70 253.820 -5.794 -0.482 546 HB ILE 70 HB ILE 70 251.449 -4.463 0.824 547 1HG1 ILE 70 HG12 ILE 70 253.902 -3.228 -0.447 548 2HG1 ILE 70 HG11 ILE 70 252.257 -3.125 -1.065 549 1HG2 ILE 70 HG21 ILE 70 254.341 -4.703 1.636 550 2HG2 ILE 70 HG22 ILE 70 252.955 -5.456 2.423 551 3HG2 ILE 70 HG23 ILE 70 253.144 -3.703 2.458 552 1HD1 ILE 70 HD11 ILE 70 252.278 -1.153 0.000 553 2HD1 ILE 70 HD12 ILE 70 253.561 -1.641 1.107 554 3HD1 ILE 70 HD13 ILE 70 251.897 -2.140 1.411 555 H VAL 71 HN VAL 71 254.144 -7.440 0.860 556 HA VAL 71 HA VAL 71 251.835 -9.122 1.578 557 HB VAL 71 HB VAL 71 254.702 -10.019 1.284 558 1HG1 VAL 71 HG11 VAL 71 253.491 -11.431 2.777 559 2HG1 VAL 71 HG12 VAL 71 253.633 -12.275 1.235 560 3HG1 VAL 71 HG13 VAL 71 252.112 -11.500 1.680 561 1HG2 VAL 71 HG21 VAL 71 254.170 -9.556 -0.909 562 2HG2 VAL 71 HG22 VAL 71 252.457 -9.904 -0.678 563 3HG2 VAL 71 HG23 VAL 71 253.620 -11.226 -0.766 564 H PHE 72 HN PHE 72 251.784 -10.044 3.668 565 HA PHE 72 HA PHE 72 253.666 -8.846 5.587 566 1HB PHE 72 HB2 PHE 72 250.681 -9.197 5.902 567 2HB PHE 72 HB1 PHE 72 251.767 -8.714 7.200 568 HD1 PHE 72 HD1 PHE 72 251.797 -6.483 7.681 569 HD2 PHE 72 HD2 PHE 72 251.078 -7.700 3.668 570 HE1 PHE 72 HE1 PHE 72 251.553 -4.127 7.014 571 HE2 PHE 72 HE2 PHE 72 250.836 -5.348 2.994 572 HZ PHE 72 HZ PHE 72 251.073 -3.557 4.667 573 H GLU 73 HN GLU 73 254.798 -10.342 6.597 574 HA GLU 73 HA GLU 73 253.736 -13.062 6.799 575 1HB GLU 73 HB2 GLU 73 256.528 -12.049 7.373 576 2HB GLU 73 HB1 GLU 73 256.024 -13.732 7.311 577 1HG GLU 73 HG2 GLU 73 255.331 -13.222 4.893 578 2HG GLU 73 HG1 GLU 73 256.326 -11.777 5.066 579 H PHE 74 HN PHE 74 252.886 -13.754 8.647 580 HA PHE 74 HA PHE 74 253.188 -12.124 11.039 581 1HB PHE 74 HB2 PHE 74 251.422 -14.484 10.380 582 2HB PHE 74 HB1 PHE 74 251.476 -13.742 11.975 583 HD1 PHE 74 HD1 PHE 74 251.087 -11.148 12.005 584 HD2 PHE 74 HD2 PHE 74 249.866 -13.741 8.860 585 HE1 PHE 74 HE1 PHE 74 249.415 -9.490 11.294 586 HE2 PHE 74 HE2 PHE 74 248.192 -12.087 8.142 587 HZ PHE 74 HZ PHE 74 247.964 -9.958 9.359 588 H VAL 75 HN VAL 75 254.322 -12.593 12.750 589 HA VAL 75 HA VAL 75 256.148 -14.806 12.641 590 HB VAL 75 HB VAL 75 256.028 -13.351 15.178 591 1HG1 VAL 75 HG11 VAL 75 258.003 -14.321 13.216 592 2HG1 VAL 75 HG12 VAL 75 257.995 -14.440 14.976 593 3HG1 VAL 75 HG13 VAL 75 258.479 -12.934 14.195 594 1HG2 VAL 75 HG21 VAL 75 257.189 -11.339 13.975 595 2HG2 VAL 75 HG22 VAL 75 255.433 -11.396 14.125 596 3HG2 VAL 75 HG23 VAL 75 256.203 -11.851 12.605 597 H GLY 76 HN GLY 76 255.426 -16.774 13.129 598 1HA GLY 76 HA2 GLY 76 254.920 -18.352 14.859 599 2HA GLY 76 HA1 GLY 76 253.979 -17.109 15.667 600 H GLU 77 HN GLU 77 252.854 -16.422 12.894 601 HA GLU 77 HA GLU 77 250.771 -18.493 12.949 602 1HB GLU 77 HB2 GLU 77 250.777 -15.592 12.206 603 2HB GLU 77 HB1 GLU 77 249.557 -16.659 11.524 604 1HG GLU 77 HG2 GLU 77 249.905 -16.866 14.431 605 2HG GLU 77 HG1 GLU 77 249.298 -15.315 13.852 606 HA PRO 78 HA PRO 78 252.578 -20.120 9.172 607 1HB PRO 78 HB2 PRO 78 249.803 -21.190 8.933 608 2HB PRO 78 HB1 PRO 78 251.350 -22.027 8.760 609 1HG PRO 78 HG2 PRO 78 249.894 -22.324 10.966 610 2HG PRO 78 HG1 PRO 78 251.662 -22.205 11.053 611 1HD PRO 78 HD2 PRO 78 249.588 -20.171 11.727 612 2HD PRO 78 HD1 PRO 78 251.164 -20.473 12.485 613 H GLU 79 HN GLU 79 249.202 -18.959 9.123 614 HA GLU 79 HA GLU 79 249.102 -18.357 6.397 615 1HB GLU 79 HB2 GLU 79 247.320 -18.298 8.469 616 2HB GLU 79 HB1 GLU 79 247.531 -16.583 8.138 617 1HG GLU 79 HG2 GLU 79 247.179 -17.398 5.649 618 2HG GLU 79 HG1 GLU 79 246.329 -18.710 6.465 619 H LEU 80 HN LEU 80 248.534 -15.947 5.754 620 HA LEU 80 HA LEU 80 250.349 -14.007 6.928 621 1HB LEU 80 HB2 LEU 80 250.601 -14.260 3.987 622 2HB LEU 80 HB1 LEU 80 251.789 -13.760 5.174 623 HG LEU 80 HG LEU 80 250.956 -16.631 4.993 624 1HD1 LEU 80 HD11 LEU 80 251.619 -16.557 2.835 625 2HD1 LEU 80 HD12 LEU 80 253.219 -16.653 3.571 626 3HD1 LEU 80 HD13 LEU 80 252.575 -15.093 3.062 627 1HD2 LEU 80 HD21 LEU 80 252.527 -15.347 6.761 628 2HD2 LEU 80 HD22 LEU 80 253.726 -15.785 5.544 629 3HD2 LEU 80 HD23 LEU 80 252.746 -17.037 6.307 630 H MET 81 HN MET 81 250.280 -12.103 4.921 631 HA MET 81 HA MET 81 247.500 -11.767 4.149 632 1HB MET 81 HB2 MET 81 248.011 -10.765 6.514 633 2HB MET 81 HB1 MET 81 248.795 -9.487 5.598 634 1HG MET 81 HG2 MET 81 246.016 -10.278 4.888 635 2HG MET 81 HG1 MET 81 246.294 -9.285 6.317 636 1HE MET 81 HE1 MET 81 248.594 -6.639 4.865 637 2HE MET 81 HE2 MET 81 248.026 -7.535 6.274 638 3HE MET 81 HE3 MET 81 247.092 -6.170 5.663 639 H ASP 82 HN ASP 82 247.695 -11.385 2.033 640 HA ASP 82 HA ASP 82 249.918 -9.691 1.113 641 1HB ASP 82 HB2 ASP 82 249.546 -12.081 0.202 642 2HB ASP 82 HB1 ASP 82 248.185 -11.387 -0.674 643 H VAL 83 HN VAL 83 249.199 -7.624 1.153 644 HA VAL 83 HA VAL 83 246.554 -7.063 -0.008 645 HB VAL 83 HB VAL 83 246.882 -6.262 2.297 646 1HG1 VAL 83 HG11 VAL 83 248.643 -5.062 3.000 647 2HG1 VAL 83 HG12 VAL 83 248.691 -4.085 1.533 648 3HG1 VAL 83 HG13 VAL 83 249.430 -5.685 1.551 649 1HG2 VAL 83 HG21 VAL 83 245.676 -4.969 0.275 650 2HG2 VAL 83 HG22 VAL 83 246.826 -3.732 0.778 651 3HG2 VAL 83 HG23 VAL 83 245.672 -4.386 1.939 652 H HIS 84 HN HIS 84 246.557 -6.387 -2.029 653 HA HIS 84 HA HIS 84 248.912 -5.453 -3.340 654 1HB HIS 84 HB2 HIS 84 246.739 -6.640 -4.289 655 2HB HIS 84 HB1 HIS 84 246.193 -4.979 -4.490 656 HD1 HIS 84 HD1 HIS 84 248.240 -7.556 -6.060 657 HD2 HIS 84 HD2 HIS 84 247.944 -3.415 -6.224 658 HE1 HIS 84 HE1 HIS 84 249.442 -6.879 -8.162 659 HE2 HIS 84 HE2 HIS 84 249.328 -4.363 -8.193 660 H VAL 85 HN VAL 85 249.142 -3.320 -4.346 661 HA VAL 85 HA VAL 85 247.777 -1.250 -2.748 662 HB VAL 85 HB VAL 85 250.574 -1.173 -3.911 663 1HG1 VAL 85 HG11 VAL 85 248.821 0.950 -3.278 664 2HG1 VAL 85 HG12 VAL 85 250.530 1.039 -3.698 665 3HG1 VAL 85 HG13 VAL 85 250.046 0.893 -2.009 666 1HG2 VAL 85 HG21 VAL 85 250.035 -2.586 -1.816 667 2HG2 VAL 85 HG22 VAL 85 249.863 -1.029 -1.005 668 3HG2 VAL 85 HG23 VAL 85 251.397 -1.467 -1.758 669 H PHE 86 HN PHE 86 246.236 -0.508 -4.012 670 HA PHE 86 HA PHE 86 246.788 0.027 -6.841 671 1HB PHE 86 HB2 PHE 86 244.315 -0.551 -5.248 672 2HB PHE 86 HB1 PHE 86 244.167 0.387 -6.730 673 HD1 PHE 86 HD1 PHE 86 245.676 -2.779 -5.471 674 HD2 PHE 86 HD2 PHE 86 243.851 -0.726 -8.720 675 HE1 PHE 86 HE1 PHE 86 245.665 -4.865 -6.777 676 HE2 PHE 86 HE2 PHE 86 243.834 -2.807 -10.031 677 HZ PHE 86 HZ PHE 86 244.743 -4.881 -9.060 678 H CYS 87 HN CYS 87 246.269 2.014 -7.753 679 HA CYS 87 HA CYS 87 245.581 4.208 -5.923 680 1HB CYS 87 HB2 CYS 87 247.241 5.660 -7.057 681 2HB CYS 87 HB1 CYS 87 248.009 4.320 -6.215 682 HG CYS 87 HG CYS 87 248.254 4.900 -9.143 683 H THR 88 HN THR 88 243.750 5.080 -6.720 684 HA THR 88 HA THR 88 243.183 4.733 -9.570 685 HB THR 88 HB THR 88 241.617 4.053 -7.591 686 HG1 THR 88 HG1 THR 88 240.152 5.403 -9.503 687 1HG2 THR 88 HG21 THR 88 240.319 5.564 -6.588 688 2HG2 THR 88 HG22 THR 88 240.246 6.607 -8.008 689 3HG2 THR 88 HG23 THR 88 241.656 6.654 -6.950 690 H ASP 89 HN ASP 89 241.456 6.619 -10.191 691 HA ASP 89 HA ASP 89 242.258 9.254 -9.401 692 1HB ASP 89 HB2 ASP 89 242.998 9.935 -11.693 693 2HB ASP 89 HB1 ASP 89 244.105 8.819 -10.901 694 H SER 90 HN SER 90 240.668 7.226 -11.808 695 HA SER 90 HA SER 90 238.670 9.232 -12.389 696 1HB SER 90 HB2 SER 90 239.705 7.074 -13.793 697 2HB SER 90 HB1 SER 90 238.101 6.514 -13.320 698 HG SER 90 HG SER 90 237.213 7.944 -14.604 699 H ILE 91 HN ILE 91 237.403 9.596 -10.628 700 HA ILE 91 HA ILE 91 236.204 7.277 -9.287 701 HB ILE 91 HB ILE 91 235.540 8.810 -7.499 702 1HG1 ILE 91 HG12 ILE 91 237.051 10.940 -9.031 703 2HG1 ILE 91 HG11 ILE 91 235.294 10.827 -8.965 704 1HG2 ILE 91 HG21 ILE 91 238.405 8.671 -8.340 705 2HG2 ILE 91 HG22 ILE 91 237.578 7.833 -7.026 706 3HG2 ILE 91 HG23 ILE 91 237.952 9.551 -6.880 707 1HD1 ILE 91 HD11 ILE 91 237.222 11.705 -6.901 708 2HD1 ILE 91 HD12 ILE 91 235.774 10.857 -6.359 709 3HD1 ILE 91 HD13 ILE 91 235.626 12.336 -7.311 710 H GLN 92 HN GLN 92 233.891 7.960 -8.362 711 HA GLN 92 HA GLN 92 232.331 9.149 -10.547 712 1HB GLN 92 HB2 GLN 92 231.903 6.483 -9.224 713 2HB GLN 92 HB1 GLN 92 230.607 7.322 -10.064 714 1HG GLN 92 HG2 GLN 92 233.129 7.005 -11.555 715 2HG GLN 92 HG1 GLN 92 232.223 5.530 -11.226 716 1HE2 GLN 92 HE21 GLN 92 230.046 5.396 -11.981 717 2HE2 GLN 92 HE22 GLN 92 229.540 6.314 -13.354 718 H GLY 93 HN GLY 93 231.739 7.653 -7.367 719 1HA GLY 93 HA2 GLY 93 229.585 9.305 -6.680 720 2HA GLY 93 HA1 GLY 93 230.564 8.393 -5.543 721 H THR 94 HN THR 94 230.458 10.060 -4.008 722 HA THR 94 HA THR 94 232.285 12.263 -4.571 723 HB THR 94 HB THR 94 229.720 12.821 -4.676 724 HG1 THR 94 HG1 THR 94 230.227 14.906 -3.935 725 1HG2 THR 94 HG21 THR 94 228.915 13.738 -2.526 726 2HG2 THR 94 HG22 THR 94 230.240 12.905 -1.716 727 3HG2 THR 94 HG23 THR 94 229.003 11.978 -2.565 728 HA PRO 95 HA PRO 95 234.136 11.484 -0.718 729 1HB PRO 95 HB2 PRO 95 234.007 14.308 0.094 730 2HB PRO 95 HB1 PRO 95 235.420 13.310 -0.264 731 1HG PRO 95 HG2 PRO 95 234.630 15.269 -1.907 732 2HG PRO 95 HG1 PRO 95 235.333 13.758 -2.516 733 1HD PRO 95 HD2 PRO 95 232.457 14.586 -2.372 734 2HD PRO 95 HD1 PRO 95 233.330 13.787 -3.699 735 H VAL 96 HN VAL 96 231.818 10.656 -0.440 736 HA VAL 96 HA VAL 96 230.133 12.094 1.386 737 HB VAL 96 HB VAL 96 230.045 9.138 0.761 738 1HG1 VAL 96 HG11 VAL 96 227.700 10.848 1.476 739 2HG1 VAL 96 HG12 VAL 96 228.747 10.199 2.737 740 3HG1 VAL 96 HG13 VAL 96 227.907 9.104 1.639 741 1HG2 VAL 96 HG21 VAL 96 229.933 10.884 -1.191 742 2HG2 VAL 96 HG22 VAL 96 228.287 11.116 -0.606 743 3HG2 VAL 96 HG23 VAL 96 228.818 9.520 -1.137 744 H GLU 97 HN GLU 97 232.209 12.384 2.729 745 HA GLU 97 HA GLU 97 233.493 10.604 4.289 746 1HB GLU 97 HB2 GLU 97 232.273 13.017 5.605 747 2HB GLU 97 HB1 GLU 97 233.844 12.286 5.897 748 1HG GLU 97 HG2 GLU 97 234.673 13.895 4.614 749 2HG GLU 97 HG1 GLU 97 233.982 13.019 3.250 750 H SER 98 HN SER 98 232.877 8.925 5.464 751 HA SER 98 HA SER 98 230.160 8.760 6.471 752 1HB SER 98 HB2 SER 98 231.389 6.461 7.316 753 2HB SER 98 HB1 SER 98 230.577 6.653 5.761 754 HG SER 98 HG SER 98 232.958 5.914 5.970 755 H ASP 99 HN ASP 99 230.263 7.336 8.717 756 HA ASP 99 HA ASP 99 231.033 9.276 10.667 757 1HB ASP 99 HB2 ASP 99 229.832 6.520 10.838 758 2HB ASP 99 HB1 ASP 99 230.278 7.427 12.280 759 H GLU 100 HN GLU 100 232.749 6.835 9.111 760 HA GLU 100 HA GLU 100 234.807 6.932 11.203 761 1HB GLU 100 HB2 GLU 100 233.298 4.660 10.602 762 2HB GLU 100 HB1 GLU 100 234.831 4.402 9.779 763 1HG GLU 100 HG2 GLU 100 235.886 5.067 12.040 764 2HG GLU 100 HG1 GLU 100 234.286 4.728 12.698 765 H MET 101 HN MET 101 234.362 8.260 8.539 766 HA MET 101 HA MET 101 237.057 7.852 7.566 767 1HB MET 101 HB2 MET 101 234.790 6.685 6.225 768 2HB MET 101 HB1 MET 101 235.543 7.894 5.192 769 1HG MET 101 HG2 MET 101 237.044 5.661 6.531 770 2HG MET 101 HG1 MET 101 236.401 5.577 4.892 771 1HE MET 101 HE1 MET 101 239.389 7.286 7.121 772 2HE MET 101 HE2 MET 101 240.456 6.617 5.887 773 3HE MET 101 HE3 MET 101 239.243 5.591 6.654 774 H ARG 102 HN ARG 102 237.689 9.480 5.969 775 HA ARG 102 HA ARG 102 236.051 11.706 5.366 776 1HB ARG 102 HB2 ARG 102 236.284 12.181 7.750 777 2HB ARG 102 HB1 ARG 102 238.034 12.056 7.628 778 1HG ARG 102 HG2 ARG 102 237.957 13.991 6.027 779 2HG ARG 102 HG1 ARG 102 236.254 14.174 6.450 780 1HD ARG 102 HD2 ARG 102 236.712 14.963 8.530 781 2HD ARG 102 HD1 ARG 102 238.177 13.996 8.692 782 HE ARG 102 HE ARG 102 238.480 16.050 6.743 783 1HH1 ARG 102 HH11 ARG 102 238.479 15.445 10.179 784 2HH1 ARG 102 HH12 ARG 102 239.506 16.791 10.543 785 1HH2 ARG 102 HH21 ARG 102 239.831 17.820 7.219 786 2HH2 ARG 102 HH22 ARG 102 240.274 18.140 8.863 787 HA PRO 103 HA PRO 103 239.707 11.376 2.669 788 1HB PRO 103 HB2 PRO 103 238.546 12.390 0.460 789 2HB PRO 103 HB1 PRO 103 238.268 10.725 0.987 790 1HG PRO 103 HG2 PRO 103 236.560 13.152 1.404 791 2HG PRO 103 HG1 PRO 103 236.079 11.525 0.889 792 1HD PRO 103 HD2 PRO 103 235.812 12.381 3.448 793 2HD PRO 103 HD1 PRO 103 236.145 10.686 3.042 794 H CYS 104 HN CYS 104 241.213 12.852 2.024 795 HA CYS 104 HA CYS 104 240.525 15.698 2.145 796 1HB CYS 104 HB2 CYS 104 242.928 14.460 3.507 797 2HB CYS 104 HB1 CYS 104 242.571 16.182 3.418 798 HG CYS 104 HG CYS 104 240.751 15.917 5.141 799 H TRP 105 HN TRP 105 241.141 16.668 0.338 800 HA TRP 105 HA TRP 105 243.041 15.344 -1.421 801 1HB TRP 105 HB2 TRP 105 241.365 17.819 -1.894 802 2HB TRP 105 HB1 TRP 105 242.290 16.945 -3.111 803 HD1 TRP 105 HD1 TRP 105 239.674 15.718 -0.497 804 HE1 TRP 105 HE1 TRP 105 237.934 14.281 -1.739 805 HE3 TRP 105 HE3 TRP 105 241.510 16.156 -5.249 806 HZ2 TRP 105 HZ2 TRP 105 237.411 13.450 -4.386 807 HZ3 TRP 105 HZ3 TRP 105 240.331 15.010 -7.079 808 HH2 TRP 105 HH2 TRP 105 238.324 13.685 -6.654 809 H PHE 106 HN PHE 106 245.094 15.950 -1.677 810 HA PHE 106 HA PHE 106 245.905 18.687 -1.077 811 1HB PHE 106 HB2 PHE 106 247.151 16.275 0.258 812 2HB PHE 106 HB1 PHE 106 247.784 17.914 0.343 813 HD1 PHE 106 HD1 PHE 106 245.671 19.634 0.934 814 HD2 PHE 106 HD2 PHE 106 246.187 15.609 2.211 815 HE1 PHE 106 HE1 PHE 106 244.256 20.082 2.897 816 HE2 PHE 106 HE2 PHE 106 244.774 16.049 4.174 817 HZ PHE 106 HZ PHE 106 243.805 18.286 4.521 818 H GLN 107 HN GLN 107 248.595 18.485 -1.271 819 HA GLN 107 HA GLN 107 248.951 17.956 -4.072 820 1HB GLN 107 HB2 GLN 107 251.114 18.705 -2.114 821 2HB GLN 107 HB1 GLN 107 251.073 18.996 -3.847 822 1HG GLN 107 HG2 GLN 107 250.497 21.065 -3.195 823 2HG GLN 107 HG1 GLN 107 248.884 20.355 -3.121 824 1HE2 GLN 107 HE21 GLN 107 247.812 20.612 -1.301 825 2HE2 GLN 107 HE22 GLN 107 248.497 20.991 0.240 826 H LEU 108 HN LEU 108 250.752 16.689 -4.913 827 HA LEU 108 HA LEU 108 250.869 14.099 -3.622 828 1HB LEU 108 HB2 LEU 108 251.627 13.255 -5.661 829 2HB LEU 108 HB1 LEU 108 250.530 14.539 -6.129 830 HG LEU 108 HG LEU 108 253.540 14.780 -6.061 831 1HD1 LEU 108 HD11 LEU 108 253.274 13.437 -7.880 832 2HD1 LEU 108 HD12 LEU 108 252.974 15.002 -8.635 833 3HD1 LEU 108 HD13 LEU 108 251.620 13.971 -8.175 834 1HD2 LEU 108 HD21 LEU 108 252.551 16.921 -5.710 835 2HD2 LEU 108 HD22 LEU 108 251.362 16.643 -6.982 836 3HD2 LEU 108 HD23 LEU 108 253.063 16.844 -7.396 837 H ASP 109 HN ASP 109 252.560 16.800 -3.101 838 HA ASP 109 HA ASP 109 255.050 15.320 -2.580 839 1HB ASP 109 HB2 ASP 109 254.947 17.329 -4.327 840 2HB ASP 109 HB1 ASP 109 255.108 18.288 -2.859 841 H GLN 110 HN GLN 110 252.544 15.903 -0.956 842 HA GLN 110 HA GLN 110 253.982 16.772 1.418 843 1HB GLN 110 HB2 GLN 110 251.513 18.105 0.337 844 2HB GLN 110 HB1 GLN 110 251.943 18.195 2.040 845 1HG GLN 110 HG2 GLN 110 253.893 18.983 -0.088 846 2HG GLN 110 HG1 GLN 110 252.657 20.104 0.480 847 1HE2 GLN 110 HE21 GLN 110 253.867 21.546 1.558 848 2HE2 GLN 110 HE22 GLN 110 254.869 21.170 2.914 849 H ILE 111 HN ILE 111 252.624 14.275 0.276 850 HA ILE 111 HA ILE 111 250.426 13.784 2.063 851 HB ILE 111 HB ILE 111 251.695 11.323 1.234 852 1HG1 ILE 111 HG12 ILE 111 250.888 11.804 -1.249 853 2HG1 ILE 111 HG11 ILE 111 251.394 13.440 -0.836 854 1HG2 ILE 111 HG21 ILE 111 249.593 10.651 0.933 855 2HG2 ILE 111 HG22 ILE 111 249.117 12.125 0.088 856 3HG2 ILE 111 HG23 ILE 111 249.224 12.113 1.849 857 1HD1 ILE 111 HD11 ILE 111 253.595 12.497 -0.155 858 2HD1 ILE 111 HD12 ILE 111 253.222 12.320 -1.871 859 3HD1 ILE 111 HD13 ILE 111 253.058 10.939 -0.784 860 HA PRO 112 HA PRO 112 253.112 12.594 5.411 861 1HB PRO 112 HB2 PRO 112 251.321 12.696 7.370 862 2HB PRO 112 HB1 PRO 112 251.791 14.172 6.518 863 1HG PRO 112 HG2 PRO 112 249.309 12.542 6.254 864 2HG PRO 112 HG1 PRO 112 249.519 14.296 6.128 865 1HD PRO 112 HD2 PRO 112 249.376 12.450 3.992 866 2HD PRO 112 HD1 PRO 112 249.832 14.160 3.889 867 H PHE 113 HN PHE 113 253.676 10.484 4.941 868 HA PHE 113 HA PHE 113 251.769 8.354 5.315 869 1HB PHE 113 HB2 PHE 113 254.574 7.535 5.180 870 2HB PHE 113 HB1 PHE 113 253.202 7.015 4.224 871 HD1 PHE 113 HD1 PHE 113 252.503 9.817 3.110 872 HD2 PHE 113 HD2 PHE 113 256.140 7.630 3.473 873 HE1 PHE 113 HE1 PHE 113 253.431 11.018 1.178 874 HE2 PHE 113 HE2 PHE 113 257.067 8.827 1.547 875 HZ PHE 113 HZ PHE 113 255.713 10.535 0.394 876 H LYS 114 HN LYS 114 253.949 10.072 7.297 877 HA LYS 114 HA LYS 114 254.603 8.072 9.174 878 1HB LYS 114 HB2 LYS 114 254.329 11.063 9.563 879 2HB LYS 114 HB1 LYS 114 255.101 9.958 10.692 880 1HG LYS 114 HG2 LYS 114 256.984 9.791 9.457 881 2HG LYS 114 HG1 LYS 114 256.122 9.926 7.923 882 1HD LYS 114 HD2 LYS 114 255.718 12.398 8.938 883 2HD LYS 114 HD1 LYS 114 257.296 12.019 9.632 884 1HE LYS 114 HE2 LYS 114 257.706 13.096 7.561 885 2HE LYS 114 HE1 LYS 114 258.038 11.383 7.314 886 1HZ LYS 114 HZ1 LYS 114 255.475 11.487 6.624 887 2HZ LYS 114 HZ2 LYS 114 256.739 11.702 5.522 888 3HZ LYS 114 HZ3 LYS 114 255.951 13.048 6.175 889 H ASP 115 HN ASP 115 251.818 10.033 8.581 890 HA ASP 115 HA ASP 115 250.573 9.099 11.045 891 1HB ASP 115 HB2 ASP 115 249.879 11.329 9.143 892 2HB ASP 115 HB1 ASP 115 248.752 10.768 10.373 893 H MET 116 HN MET 116 251.072 7.440 8.678 894 HA MET 116 HA MET 116 248.292 6.725 8.043 895 1HB MET 116 HB2 MET 116 250.613 7.133 6.281 896 2HB MET 116 HB1 MET 116 249.708 5.660 5.965 897 1HG MET 116 HG2 MET 116 247.930 6.764 5.154 898 2HG MET 116 HG1 MET 116 248.092 8.092 6.299 899 1HE MET 116 HE1 MET 116 250.385 7.670 2.324 900 2HE MET 116 HE2 MET 116 249.350 6.447 3.062 901 3HE MET 116 HE3 MET 116 250.943 6.783 3.743 902 H TRP 117 HN TRP 117 251.313 5.058 7.277 903 HA TRP 117 HA TRP 117 250.860 3.056 9.314 904 1HB TRP 117 HB2 TRP 117 249.816 2.677 6.696 905 2HB TRP 117 HB1 TRP 117 251.187 1.588 6.878 906 HD1 TRP 117 HD1 TRP 117 249.006 2.408 9.904 907 HE1 TRP 117 HE1 TRP 117 247.725 0.288 10.600 908 HE3 TRP 117 HE3 TRP 117 250.225 -0.609 5.959 909 HZ2 TRP 117 HZ2 TRP 117 247.289 -2.319 9.608 910 HZ3 TRP 117 HZ3 TRP 117 249.335 -2.902 5.910 911 HH2 TRP 117 HH2 TRP 117 247.897 -3.738 7.697 912 HA PRO 118 HA PRO 118 255.220 2.531 8.824 913 1HB PRO 118 HB2 PRO 118 255.668 0.031 9.598 914 2HB PRO 118 HB1 PRO 118 254.938 1.201 10.701 915 1HG PRO 118 HG2 PRO 118 253.637 -0.981 9.126 916 2HG PRO 118 HG1 PRO 118 253.311 -0.448 10.784 917 1HD PRO 118 HD2 PRO 118 251.852 0.293 8.534 918 2HD PRO 118 HD1 PRO 118 251.849 1.151 10.086 919 H ASP 119 HN ASP 119 253.422 1.565 6.390 920 HA ASP 119 HA ASP 119 255.665 0.260 5.005 921 1HB ASP 119 HB2 ASP 119 254.073 -1.085 3.717 922 2HB ASP 119 HB1 ASP 119 253.910 -1.398 5.442 923 H ASP 120 HN ASP 120 253.100 2.594 4.942 924 HA ASP 120 HA ASP 120 252.696 3.223 2.337 925 1HB ASP 120 HB2 ASP 120 253.079 5.111 4.652 926 2HB ASP 120 HB1 ASP 120 252.435 5.593 3.085 927 H SER 121 HN SER 121 255.304 4.667 4.288 928 HA SER 121 HA SER 121 256.521 6.111 2.239 929 1HB SER 121 HB2 SER 121 258.357 6.402 3.713 930 2HB SER 121 HB1 SER 121 256.934 6.267 4.746 931 HG SER 121 HG SER 121 257.499 4.151 5.202 932 H TYR 122 HN TYR 122 256.529 2.705 2.727 933 HA TYR 122 HA TYR 122 259.042 2.277 1.386 934 1HB TYR 122 HB2 TYR 122 256.930 0.388 2.413 935 2HB TYR 122 HB1 TYR 122 258.381 -0.151 1.575 936 HD1 TYR 122 HD1 TYR 122 260.484 -0.236 2.684 937 HD2 TYR 122 HD2 TYR 122 257.135 1.544 4.610 938 HE1 TYR 122 HE1 TYR 122 261.730 -0.200 4.804 939 HE2 TYR 122 HE2 TYR 122 258.372 1.587 6.735 940 HH TYR 122 HH TYR 122 261.239 -0.135 7.228 941 H TRP 123 HN TRP 123 255.705 2.524 0.434 942 HA TRP 123 HA TRP 123 256.508 1.525 -2.208 943 1HB TRP 123 HB2 TRP 123 254.162 0.869 -2.606 944 2HB TRP 123 HB1 TRP 123 254.904 0.002 -1.269 945 HD1 TRP 123 HD1 TRP 123 253.961 0.503 1.193 946 HE1 TRP 123 HE1 TRP 123 251.729 1.504 1.992 947 HE3 TRP 123 HE3 TRP 123 252.403 2.618 -3.192 948 HZ2 TRP 123 HZ2 TRP 123 249.584 3.004 0.904 949 HZ3 TRP 123 HZ3 TRP 123 250.250 3.808 -3.224 950 HH2 TRP 123 HH2 TRP 123 248.875 3.985 -1.226 951 H PHE 124 HN PHE 124 254.890 4.104 -0.500 952 HA PHE 124 HA PHE 124 253.635 5.371 -2.630 953 1HB PHE 124 HB2 PHE 124 254.051 5.940 0.056 954 2HB PHE 124 HB1 PHE 124 254.851 7.265 -0.777 955 HD1 PHE 124 HD1 PHE 124 251.932 5.640 -2.295 956 HD2 PHE 124 HD2 PHE 124 253.277 8.866 0.126 957 HE1 PHE 124 HE1 PHE 124 249.770 6.768 -2.589 958 HE2 PHE 124 HE2 PHE 124 251.127 9.989 -0.153 959 HZ PHE 124 HZ PHE 124 249.360 8.945 -1.516 960 HA PRO 125 HA PRO 125 257.794 7.878 -3.313 961 1HB PRO 125 HB2 PRO 125 259.998 6.254 -2.829 962 2HB PRO 125 HB1 PRO 125 259.449 7.569 -1.788 963 1HG PRO 125 HG2 PRO 125 258.997 4.635 -1.537 964 2HG PRO 125 HG1 PRO 125 259.267 5.846 -0.273 965 1HD PRO 125 HD2 PRO 125 256.827 4.844 -0.781 966 2HD PRO 125 HD1 PRO 125 257.055 6.530 -0.279 967 H LEU 126 HN LEU 126 257.245 4.470 -3.747 968 HA LEU 126 HA LEU 126 258.710 4.307 -6.231 969 1HB LEU 126 HB2 LEU 126 256.829 2.396 -4.842 970 2HB LEU 126 HB1 LEU 126 257.614 2.041 -6.370 971 HG LEU 126 HG LEU 126 259.280 2.779 -3.997 972 1HD1 LEU 126 HD11 LEU 126 259.005 0.842 -2.915 973 2HD1 LEU 126 HD12 LEU 126 258.895 -0.089 -4.409 974 3HD1 LEU 126 HD13 LEU 126 257.473 0.747 -3.784 975 1HD2 LEU 126 HD21 LEU 126 260.647 0.905 -5.277 976 2HD2 LEU 126 HD22 LEU 126 260.674 2.593 -5.788 977 3HD2 LEU 126 HD23 LEU 126 259.635 1.437 -6.619 978 H LEU 127 HN LEU 127 255.428 4.767 -5.131 979 HA LEU 127 HA LEU 127 254.038 4.399 -7.540 980 1HB LEU 127 HB2 LEU 127 253.512 6.224 -5.194 981 2HB LEU 127 HB1 LEU 127 252.386 6.012 -6.515 982 HG LEU 127 HG LEU 127 252.690 4.465 -4.144 983 1HD1 LEU 127 HD11 LEU 127 250.619 3.385 -5.062 984 2HD1 LEU 127 HD12 LEU 127 250.833 4.371 -6.509 985 3HD1 LEU 127 HD13 LEU 127 250.563 5.144 -4.946 986 1HD2 LEU 127 HD21 LEU 127 254.209 3.022 -5.367 987 2HD2 LEU 127 HD22 LEU 127 253.055 2.892 -6.693 988 3HD2 LEU 127 HD23 LEU 127 252.668 2.204 -5.116 989 H LEU 128 HN LEU 128 255.174 7.381 -6.004 990 HA LEU 128 HA LEU 128 254.605 9.159 -8.064 991 1HB LEU 128 HB2 LEU 128 256.559 9.125 -5.814 992 2HB LEU 128 HB1 LEU 128 256.741 10.358 -7.047 993 HG LEU 128 HG LEU 128 254.006 10.117 -6.013 994 1HD1 LEU 128 HD11 LEU 128 255.310 9.613 -3.974 995 2HD1 LEU 128 HD12 LEU 128 254.434 11.141 -3.877 996 3HD1 LEU 128 HD13 LEU 128 256.171 11.138 -4.183 997 1HD2 LEU 128 HD21 LEU 128 255.684 12.579 -5.950 998 2HD2 LEU 128 HD22 LEU 128 253.971 12.390 -6.328 999 3HD2 LEU 128 HD23 LEU 128 255.193 11.912 -7.507 1000 H GLN 129 HN GLN 129 257.123 6.808 -7.786 1001 HA GLN 129 HA GLN 129 258.756 7.946 -9.881 1002 1HB GLN 129 HB2 GLN 129 259.233 6.211 -7.780 1003 2HB GLN 129 HB1 GLN 129 259.290 5.161 -9.188 1004 1HG GLN 129 HG2 GLN 129 260.768 7.688 -9.438 1005 2HG GLN 129 HG1 GLN 129 261.390 6.553 -8.240 1006 1HE2 GLN 129 HE21 GLN 129 263.261 6.402 -9.597 1007 2HE2 GLN 129 HE22 GLN 129 263.247 5.367 -10.980 1008 H LYS 130 HN LYS 130 255.864 6.476 -9.977 1009 HA LYS 130 HA LYS 130 254.665 5.309 -11.496 1010 1HB LYS 130 HB2 LYS 130 254.855 6.034 -13.660 1011 2HB LYS 130 HB1 LYS 130 255.791 7.273 -12.843 1012 1HG LYS 130 HG2 LYS 130 257.665 5.326 -13.453 1013 2HG LYS 130 HG1 LYS 130 256.598 5.352 -14.854 1014 1HD LYS 130 HD2 LYS 130 258.361 6.925 -15.234 1015 2HD LYS 130 HD1 LYS 130 256.876 7.829 -14.935 1016 1HE LYS 130 HE2 LYS 130 257.625 7.991 -12.521 1017 2HE LYS 130 HE1 LYS 130 259.187 7.380 -13.061 1018 1HZ LYS 130 HZ1 LYS 130 258.843 9.355 -14.787 1019 2HZ LYS 130 HZ2 LYS 130 259.593 9.573 -13.286 1020 3HZ LYS 130 HZ3 LYS 130 257.965 9.987 -13.486 1021 H LYS 131 HN LYS 131 256.755 3.892 -10.053 1022 HA LYS 131 HA LYS 131 257.308 1.742 -11.995 1023 1HB LYS 131 HB2 LYS 131 258.928 2.900 -9.791 1024 2HB LYS 131 HB1 LYS 131 259.033 1.161 -10.026 1025 1HG LYS 131 HG2 LYS 131 259.382 3.022 -12.338 1026 2HG LYS 131 HG1 LYS 131 260.715 2.704 -11.227 1027 1HD LYS 131 HD2 LYS 131 261.137 0.998 -12.645 1028 2HD LYS 131 HD1 LYS 131 259.883 0.185 -11.708 1029 1HE LYS 131 HE2 LYS 131 258.289 0.458 -13.352 1030 2HE LYS 131 HE1 LYS 131 259.106 1.854 -14.056 1031 1HZ LYS 131 HZ1 LYS 131 260.866 0.304 -14.817 1032 2HZ LYS 131 HZ2 LYS 131 259.357 0.009 -15.522 1033 3HZ LYS 131 HZ3 LYS 131 259.919 -0.992 -14.280 1034 H LYS 132 HN LYS 132 257.113 -0.435 -11.252 1035 HA LYS 132 HA LYS 132 255.177 -0.706 -9.058 1036 1HB LYS 132 HB2 LYS 132 255.746 -2.523 -11.405 1037 2HB LYS 132 HB1 LYS 132 254.602 -2.886 -10.119 1038 1HG LYS 132 HG2 LYS 132 253.059 -1.403 -10.880 1039 2HG LYS 132 HG1 LYS 132 254.274 -0.315 -11.555 1040 1HD LYS 132 HD2 LYS 132 254.017 -2.994 -12.796 1041 2HD LYS 132 HD1 LYS 132 252.704 -1.850 -13.076 1042 1HE LYS 132 HE2 LYS 132 253.998 -1.155 -14.780 1043 2HE LYS 132 HE1 LYS 132 254.852 -0.267 -13.519 1044 1HZ LYS 132 HZ1 LYS 132 256.592 -1.347 -14.453 1045 2HZ LYS 132 HZ2 LYS 132 255.664 -2.655 -14.987 1046 3HZ LYS 132 HZ3 LYS 132 256.130 -2.558 -13.365 1047 H PHE 133 HN PHE 133 255.731 -1.757 -7.256 1048 HA PHE 133 HA PHE 133 257.964 -3.651 -7.321 1049 1HB PHE 133 HB2 PHE 133 257.800 -1.140 -5.695 1050 2HB PHE 133 HB1 PHE 133 258.626 -2.543 -5.033 1051 HD1 PHE 133 HD1 PHE 133 260.880 -2.700 -5.364 1052 HD2 PHE 133 HD2 PHE 133 258.542 -0.532 -8.183 1053 HE1 PHE 133 HE1 PHE 133 262.928 -2.066 -6.570 1054 HE2 PHE 133 HE2 PHE 133 260.584 0.101 -9.396 1055 HZ PHE 133 HZ PHE 133 262.782 -0.665 -8.590 1056 H HIS 134 HN HIS 134 258.045 -5.053 -5.454 1057 HA HIS 134 HA HIS 134 255.464 -5.276 -4.048 1058 1HB HIS 134 HB2 HIS 134 257.221 -7.401 -5.254 1059 2HB HIS 134 HB1 HIS 134 256.105 -7.785 -3.949 1060 HD1 HIS 134 HD1 HIS 134 254.877 -9.351 -5.689 1061 HD2 HIS 134 HD2 HIS 134 254.733 -5.287 -6.541 1062 HE1 HIS 134 HE1 HIS 134 253.062 -9.089 -7.411 1063 HE2 HIS 134 HE2 HIS 134 252.934 -6.611 -7.846 1064 H GLY 135 HN GLY 135 255.616 -5.125 -1.881 1065 1HA GLY 135 HA2 GLY 135 258.289 -5.558 -0.705 1066 2HA GLY 135 HA1 GLY 135 257.163 -4.344 -0.126 1067 H TYR 136 HN TYR 136 258.530 -7.013 0.840 1068 HA TYR 136 HA TYR 136 256.110 -8.175 2.048 1069 1HB TYR 136 HB2 TYR 136 258.832 -9.356 1.489 1070 2HB TYR 136 HB1 TYR 136 257.670 -10.130 2.560 1071 HD1 TYR 136 HD1 TYR 136 257.425 -8.486 -0.797 1072 HD2 TYR 136 HD2 TYR 136 256.692 -11.954 1.557 1073 HE1 TYR 136 HE1 TYR 136 256.373 -9.571 -2.735 1074 HE2 TYR 136 HE2 TYR 136 255.639 -13.050 -0.375 1075 HH TYR 136 HH TYR 136 256.020 -12.179 -3.417 1076 H PHE 137 HN PHE 137 255.759 -7.398 4.031 1077 HA PHE 137 HA PHE 137 258.102 -6.785 5.711 1078 1HB PHE 137 HB2 PHE 137 255.335 -5.593 5.924 1079 2HB PHE 137 HB1 PHE 137 256.771 -5.103 6.818 1080 HD1 PHE 137 HD1 PHE 137 255.604 -5.500 3.297 1081 HD2 PHE 137 HD2 PHE 137 257.939 -3.279 6.075 1082 HE1 PHE 137 HE1 PHE 137 256.139 -3.866 1.535 1083 HE2 PHE 137 HE2 PHE 137 258.478 -1.644 4.320 1084 HZ PHE 137 HZ PHE 137 257.577 -1.934 2.047 1085 H LYS 138 HN LYS 138 258.313 -7.766 7.633 1086 HA LYS 138 HA LYS 138 256.315 -9.711 8.461 1087 1HB LYS 138 HB2 LYS 138 259.128 -9.563 8.629 1088 2HB LYS 138 HB1 LYS 138 258.535 -9.475 10.281 1089 1HG LYS 138 HG2 LYS 138 257.042 -11.513 9.289 1090 2HG LYS 138 HG1 LYS 138 258.547 -11.713 8.391 1091 1HD LYS 138 HD2 LYS 138 259.787 -12.115 10.297 1092 2HD LYS 138 HD1 LYS 138 258.643 -11.270 11.343 1093 1HE LYS 138 HE2 LYS 138 257.453 -13.126 11.714 1094 2HE LYS 138 HE1 LYS 138 257.468 -13.576 10.009 1095 1HZ LYS 138 HZ1 LYS 138 259.702 -14.467 10.314 1096 2HZ LYS 138 HZ2 LYS 138 258.598 -15.225 11.346 1097 3HZ LYS 138 HZ3 LYS 138 259.661 -14.057 11.954 1098 H PHE 139 HN PHE 139 254.889 -9.314 10.114 1099 HA PHE 139 HA PHE 139 255.257 -6.749 11.502 1100 1HB PHE 139 HB2 PHE 139 252.911 -8.190 10.458 1101 2HB PHE 139 HB1 PHE 139 252.671 -7.430 12.028 1102 HD1 PHE 139 HD1 PHE 139 251.816 -5.311 12.005 1103 HD2 PHE 139 HD2 PHE 139 254.235 -6.582 8.743 1104 HE1 PHE 139 HE1 PHE 139 251.461 -3.141 10.901 1105 HE2 PHE 139 HE2 PHE 139 253.884 -4.414 7.633 1106 HZ PHE 139 HZ PHE 139 252.495 -2.690 8.713 1107 H GLN 140 HN GLN 140 254.361 -6.572 13.685 1108 HA GLN 140 HA GLN 140 254.541 -9.026 15.280 1109 1HB GLN 140 HB2 GLN 140 256.685 -8.207 15.671 1110 2HB GLN 140 HB1 GLN 140 256.182 -6.531 15.542 1111 1HG GLN 140 HG2 GLN 140 256.874 -7.356 17.826 1112 2HG GLN 140 HG1 GLN 140 255.338 -6.502 17.726 1113 1HE2 GLN 140 HE21 GLN 140 256.794 -9.707 17.857 1114 2HE2 GLN 140 HE22 GLN 140 255.450 -10.490 18.609 1115 H GLY 141 HN GLY 141 252.223 -8.842 15.315 1116 1HA GLY 141 HA2 GLY 141 250.619 -8.391 17.098 1117 2HA GLY 141 HA1 GLY 141 251.304 -6.778 17.217 1118 H GLN 142 HN GLN 142 251.129 -5.459 15.127 1119 HA GLN 142 HA GLN 142 249.190 -6.062 13.193 1120 1HB GLN 142 HB2 GLN 142 248.127 -5.171 15.716 1121 2HB GLN 142 HB1 GLN 142 247.760 -3.993 14.464 1122 1HG GLN 142 HG2 GLN 142 247.160 -6.934 14.266 1123 2HG GLN 142 HG1 GLN 142 246.006 -5.705 14.775 1124 1HE2 GLN 142 HE21 GLN 142 244.978 -6.888 12.841 1125 2HE2 GLN 142 HE22 GLN 142 245.207 -6.134 11.304 1126 H ASP 143 HN ASP 143 250.743 -3.496 15.075 1127 HA ASP 143 HA ASP 143 250.999 -1.959 12.571 1128 1HB ASP 143 HB2 ASP 143 250.502 -0.974 15.376 1129 2HB ASP 143 HB1 ASP 143 251.091 0.081 14.095 1130 H THR 144 HN THR 144 252.816 -3.935 14.034 1131 HA THR 144 HA THR 144 255.155 -2.148 14.223 1132 HB THR 144 HB THR 144 254.563 -4.699 15.717 1133 HG1 THR 144 HG1 THR 144 253.784 -3.054 16.876 1134 1HG2 THR 144 HG21 THR 144 256.747 -4.508 16.758 1135 2HG2 THR 144 HG22 THR 144 257.144 -3.154 15.699 1136 3HG2 THR 144 HG23 THR 144 256.894 -4.762 15.019 1137 H ILE 145 HN ILE 145 256.835 -2.552 12.894 1138 HA ILE 145 HA ILE 145 256.699 -5.038 11.336 1139 HB ILE 145 HB ILE 145 258.125 -2.514 10.503 1140 1HG1 ILE 145 HG12 ILE 145 255.431 -3.604 9.647 1141 2HG1 ILE 145 HG11 ILE 145 255.716 -2.113 10.539 1142 1HG2 ILE 145 HG21 ILE 145 259.156 -3.961 9.141 1143 2HG2 ILE 145 HG22 ILE 145 257.625 -4.043 8.271 1144 3HG2 ILE 145 HG23 ILE 145 258.008 -5.250 9.497 1145 1HD1 ILE 145 HD11 ILE 145 255.239 -1.662 8.203 1146 2HD1 ILE 145 HD12 ILE 145 256.597 -2.676 7.715 1147 3HD1 ILE 145 HD13 ILE 145 256.888 -1.183 8.608 1148 H LEU 146 HN LEU 146 258.344 -6.422 11.371 1149 HA LEU 146 HA LEU 146 260.747 -5.640 12.884 1150 1HB LEU 146 HB2 LEU 146 260.022 -8.500 12.465 1151 2HB LEU 146 HB1 LEU 146 260.888 -7.754 13.794 1152 HG LEU 146 HG LEU 146 258.074 -6.930 13.596 1153 1HD1 LEU 146 HD11 LEU 146 258.417 -9.538 12.999 1154 2HD1 LEU 146 HD12 LEU 146 257.017 -8.893 13.854 1155 3HD1 LEU 146 HD13 LEU 146 258.347 -9.613 14.760 1156 1HD2 LEU 146 HD21 LEU 146 260.007 -6.767 15.467 1157 2HD2 LEU 146 HD22 LEU 146 259.171 -8.225 16.003 1158 3HD2 LEU 146 HD23 LEU 146 258.282 -6.713 15.829 1159 H ASP 147 HN ASP 147 259.557 -6.562 9.847 1160 HA ASP 147 HA ASP 147 262.233 -6.642 8.758 1161 1HB ASP 147 HB2 ASP 147 260.915 -9.055 9.350 1162 2HB ASP 147 HB1 ASP 147 260.751 -8.850 7.609 1163 H TYR 148 HN TYR 148 262.302 -5.845 6.686 1164 HA TYR 148 HA TYR 148 259.776 -5.655 5.228 1165 1HB TYR 148 HB2 TYR 148 260.087 -3.311 4.722 1166 2HB TYR 148 HB1 TYR 148 260.026 -3.548 6.466 1167 HD1 TYR 148 HD1 TYR 148 261.909 -3.027 7.848 1168 HD2 TYR 148 HD2 TYR 148 262.239 -2.793 3.613 1169 HE1 TYR 148 HE1 TYR 148 264.048 -1.839 8.087 1170 HE2 TYR 148 HE2 TYR 148 264.381 -1.604 3.840 1171 HH TYR 148 HH TYR 148 266.256 -1.622 6.181 1172 H THR 149 HN THR 149 259.968 -6.161 3.143 1173 HA THR 149 HA THR 149 262.644 -5.983 1.924 1174 HB THR 149 HB THR 149 261.296 -7.967 0.517 1175 HG1 THR 149 HG1 THR 149 260.697 -9.423 2.196 1176 1HG2 THR 149 HG21 THR 149 262.995 -9.375 1.131 1177 2HG2 THR 149 HG22 THR 149 263.099 -8.717 2.765 1178 3HG2 THR 149 HG23 THR 149 263.730 -7.794 1.400 1179 H LEU 150 HN LEU 150 262.725 -5.356 -0.228 1180 HA LEU 150 HA LEU 150 260.193 -4.528 -1.455 1181 1HB LEU 150 HB2 LEU 150 262.667 -2.834 -1.139 1182 2HB LEU 150 HB1 LEU 150 261.364 -2.445 -2.247 1183 HG LEU 150 HG LEU 150 260.034 -2.805 0.142 1184 1HD1 LEU 150 HD11 LEU 150 261.210 -2.038 1.917 1185 2HD1 LEU 150 HD12 LEU 150 262.240 -1.001 0.931 1186 3HD1 LEU 150 HD13 LEU 150 262.552 -2.735 1.009 1187 1HD2 LEU 150 HD21 LEU 150 259.336 -0.697 -0.237 1188 2HD2 LEU 150 HD22 LEU 150 260.206 -0.897 -1.758 1189 3HD2 LEU 150 HD23 LEU 150 260.975 -0.069 -0.405 1190 H ARG 151 HN ARG 151 259.989 -5.303 -3.436 1191 HA ARG 151 HA ARG 151 262.425 -5.825 -5.008 1192 1HB ARG 151 HB2 ARG 151 259.922 -7.521 -4.991 1193 2HB ARG 151 HB1 ARG 151 261.377 -7.821 -5.931 1194 1HG ARG 151 HG2 ARG 151 261.323 -7.762 -2.925 1195 2HG ARG 151 HG1 ARG 151 261.124 -9.230 -3.885 1196 1HD ARG 151 HD2 ARG 151 263.521 -7.401 -3.839 1197 2HD ARG 151 HD1 ARG 151 263.423 -9.036 -3.183 1198 HE ARG 151 HE ARG 151 262.802 -9.354 -5.808 1199 1HH1 ARG 151 HH11 ARG 151 265.477 -7.880 -4.118 1200 2HH1 ARG 151 HH12 ARG 151 266.622 -8.228 -5.371 1201 1HH2 ARG 151 HH21 ARG 151 264.305 -9.812 -7.455 1202 2HH2 ARG 151 HH22 ARG 151 265.957 -9.325 -7.265 1203 H GLU 152 HN GLU 152 262.072 -5.836 -7.357 1204 HA GLU 152 HA GLU 152 260.085 -3.807 -8.084 1205 1HB GLU 152 HB2 GLU 152 261.411 -3.448 -10.085 1206 2HB GLU 152 HB1 GLU 152 262.453 -3.389 -8.670 1207 1HG GLU 152 HG2 GLU 152 263.674 -5.121 -9.352 1208 2HG GLU 152 HG1 GLU 152 262.256 -6.049 -9.840 1209 H VAL 153 HN VAL 153 258.691 -4.080 -9.861 1210 HA VAL 153 HA VAL 153 258.518 -6.756 -11.035 1211 HB VAL 153 HB VAL 153 256.054 -6.792 -10.692 1212 1HG1 VAL 153 HG11 VAL 153 257.283 -6.641 -7.979 1213 2HG1 VAL 153 HG12 VAL 153 257.894 -7.822 -9.137 1214 3HG1 VAL 153 HG13 VAL 153 256.197 -7.853 -8.658 1215 1HG2 VAL 153 HG21 VAL 153 256.220 -4.881 -8.453 1216 2HG2 VAL 153 HG22 VAL 153 254.905 -5.194 -9.587 1217 3HG2 VAL 153 HG23 VAL 153 256.264 -4.179 -10.070 1218 H ASP 154 HN ASP 154 257.630 -6.822 -13.079 1219 HA ASP 154 HA ASP 154 256.702 -4.282 -14.225 1220 1HB ASP 154 HB2 ASP 154 258.859 -6.090 -15.304 1221 2HB ASP 154 HB1 ASP 154 257.992 -4.954 -16.332 1222 H THR 155 HN THR 155 257.096 -7.764 -14.857 1223 HA THR 155 HA THR 155 254.880 -7.798 -16.697 1224 HB THR 155 HB THR 155 255.926 -10.337 -15.571 1225 HG1 THR 155 HG1 THR 155 257.498 -8.738 -17.301 1226 1HG2 THR 155 HG21 THR 155 254.782 -10.950 -17.390 1227 2HG2 THR 155 HG22 THR 155 256.248 -10.475 -18.248 1228 3HG2 THR 155 HG23 THR 155 254.892 -9.353 -18.128 1229 H VAL 156 HN VAL 156 252.810 -8.265 -16.277 1230 HA VAL 156 HA VAL 156 251.800 -8.256 -13.666 1231 HB VAL 156 HB VAL 156 250.457 -7.607 -15.617 1232 1HG1 VAL 156 HG11 VAL 156 249.895 -8.973 -17.334 1233 2HG1 VAL 156 HG12 VAL 156 249.827 -10.410 -16.314 1234 3HG1 VAL 156 HG13 VAL 156 251.385 -9.787 -16.856 1235 1HG2 VAL 156 HG21 VAL 156 248.369 -8.915 -14.991 1236 2HG2 VAL 156 HG22 VAL 156 249.190 -8.062 -13.685 1237 3HG2 VAL 156 HG23 VAL 156 249.392 -9.804 -13.863 Start of MODEL 10 1 1H MET 1 HT1 MET 1 238.425 -20.224 0.195 2 2H MET 1 HT2 MET 1 239.517 -21.081 -0.815 3 3H MET 1 HT3 MET 1 238.705 -19.691 -1.409 4 HA MET 1 HA MET 1 240.877 -19.061 -0.933 5 1HB MET 1 HB2 MET 1 239.001 -18.236 1.294 6 2HB MET 1 HB1 MET 1 240.458 -17.373 0.822 7 1HG MET 1 HG2 MET 1 239.260 -17.382 -1.535 8 2HG MET 1 HG1 MET 1 237.824 -17.537 -0.526 9 1HE MET 1 HE1 MET 1 240.416 -13.881 -1.198 10 2HE MET 1 HE2 MET 1 239.690 -14.928 -2.417 11 3HE MET 1 HE3 MET 1 240.970 -15.546 -1.373 12 H GLY 2 HN GLY 2 242.248 -20.804 -0.420 13 1HA GLY 2 HA2 GLY 2 242.318 -21.776 2.320 14 2HA GLY 2 HA1 GLY 2 243.312 -22.343 0.985 15 H ALA 3 HN ALA 3 243.073 -20.191 3.657 16 HA ALA 3 HA ALA 3 244.587 -18.865 4.717 17 1HB ALA 3 HB1 ALA 3 246.679 -20.263 3.059 18 2HB ALA 3 HB2 ALA 3 245.947 -20.957 4.507 19 3HB ALA 3 HB3 ALA 3 246.892 -19.472 4.620 20 H SER 4 HN SER 4 246.876 -17.591 3.976 21 HA SER 4 HA SER 4 247.589 -15.691 2.951 22 1HB SER 4 HB2 SER 4 247.762 -15.737 0.591 23 2HB SER 4 HB1 SER 4 247.818 -17.425 1.095 24 HG SER 4 HG SER 4 245.955 -17.778 0.154 25 H ARG 5 HN ARG 5 246.316 -14.257 4.047 26 HA ARG 5 HA ARG 5 243.668 -13.600 3.198 27 1HB ARG 5 HB2 ARG 5 245.522 -12.766 5.311 28 2HB ARG 5 HB1 ARG 5 244.522 -11.456 4.700 29 1HG ARG 5 HG2 ARG 5 243.092 -12.189 6.269 30 2HG ARG 5 HG1 ARG 5 242.646 -13.348 5.017 31 1HD ARG 5 HD2 ARG 5 243.514 -15.082 6.145 32 2HD ARG 5 HD1 ARG 5 244.940 -14.169 6.637 33 HE ARG 5 HE ARG 5 243.937 -13.864 8.652 34 1HH1 ARG 5 HH11 ARG 5 241.434 -14.379 6.275 35 2HH1 ARG 5 HH12 ARG 5 240.148 -14.320 7.433 36 1HH2 ARG 5 HH21 ARG 5 242.247 -13.787 10.177 37 2HH2 ARG 5 HH22 ARG 5 240.609 -13.983 9.650 38 H LEU 6 HN LEU 6 243.649 -12.959 1.095 39 HA LEU 6 HA LEU 6 245.496 -10.924 0.169 40 1HB LEU 6 HB2 LEU 6 244.551 -12.948 -1.172 41 2HB LEU 6 HB1 LEU 6 243.154 -11.916 -1.416 42 HG LEU 6 HG LEU 6 245.883 -10.892 -2.105 43 1HD1 LEU 6 HD11 LEU 6 244.207 -12.391 -4.087 44 2HD1 LEU 6 HD12 LEU 6 245.442 -13.203 -3.126 45 3HD1 LEU 6 HD13 LEU 6 245.893 -11.889 -4.212 46 1HD2 LEU 6 HD21 LEU 6 243.874 -9.409 -2.094 47 2HD2 LEU 6 HD22 LEU 6 243.190 -10.415 -3.369 48 3HD2 LEU 6 HD23 LEU 6 244.681 -9.520 -3.656 49 H TYR 7 HN TYR 7 245.150 -8.876 0.505 50 HA TYR 7 HA TYR 7 242.391 -7.851 0.532 51 1HB TYR 7 HB2 TYR 7 244.744 -7.131 2.273 52 2HB TYR 7 HB1 TYR 7 243.377 -6.040 2.068 53 HD1 TYR 7 HD1 TYR 7 243.829 -9.702 2.723 54 HD2 TYR 7 HD2 TYR 7 241.889 -6.077 3.817 55 HE1 TYR 7 HE1 TYR 7 242.622 -10.893 4.503 56 HE2 TYR 7 HE2 TYR 7 240.677 -7.257 5.601 57 HH TYR 7 HH TYR 7 240.861 -9.257 6.942 58 H THR 8 HN THR 8 242.620 -5.271 0.363 59 HA THR 8 HA THR 8 244.406 -4.710 -1.919 60 HB THR 8 HB THR 8 242.624 -3.338 -2.880 61 HG1 THR 8 HG1 THR 8 241.318 -2.706 -1.305 62 1HG2 THR 8 HG21 THR 8 242.428 -5.355 -3.897 63 2HG2 THR 8 HG22 THR 8 240.849 -5.264 -3.116 64 3HG2 THR 8 HG23 THR 8 242.142 -6.218 -2.388 65 H LEU 9 HN LEU 9 244.529 -2.301 -2.336 66 HA LEU 9 HA LEU 9 244.225 -0.576 -0.040 67 1HB LEU 9 HB2 LEU 9 246.460 -1.910 0.120 68 2HB LEU 9 HB1 LEU 9 246.992 -0.844 -1.164 69 HG LEU 9 HG LEU 9 246.205 -0.106 1.634 70 1HD1 LEU 9 HD11 LEU 9 248.708 0.650 0.190 71 2HD1 LEU 9 HD12 LEU 9 248.549 -0.925 0.967 72 3HD1 LEU 9 HD13 LEU 9 248.408 0.549 1.925 73 1HD2 LEU 9 HD21 LEU 9 246.498 1.639 -0.783 74 2HD2 LEU 9 HD22 LEU 9 246.771 2.255 0.847 75 3HD2 LEU 9 HD23 LEU 9 245.193 1.604 0.403 76 H VAL 10 HN VAL 10 243.221 1.065 -1.100 77 HA VAL 10 HA VAL 10 244.355 1.916 -3.664 78 HB VAL 10 HB VAL 10 242.152 1.318 -4.072 79 1HG1 VAL 10 HG11 VAL 10 241.011 0.873 -2.225 80 2HG1 VAL 10 HG12 VAL 10 240.346 2.479 -2.509 81 3HG1 VAL 10 HG13 VAL 10 241.664 2.263 -1.361 82 1HG2 VAL 10 HG21 VAL 10 241.971 4.264 -3.498 83 2HG2 VAL 10 HG22 VAL 10 240.980 3.351 -4.632 84 3HG2 VAL 10 HG23 VAL 10 242.702 3.561 -4.941 85 H LEU 11 HN LEU 11 245.340 3.728 -3.801 86 HA LEU 11 HA LEU 11 244.762 5.866 -1.867 87 1HB LEU 11 HB2 LEU 11 247.203 4.427 -2.338 88 2HB LEU 11 HB1 LEU 11 247.430 6.108 -2.778 89 HG LEU 11 HG LEU 11 246.757 4.951 -0.085 90 1HD1 LEU 11 HD11 LEU 11 248.703 7.113 -0.274 91 2HD1 LEU 11 HD12 LEU 11 249.140 5.701 -1.235 92 3HD1 LEU 11 HD13 LEU 11 248.836 5.530 0.494 93 1HD2 LEU 11 HD21 LEU 11 245.271 6.659 0.074 94 2HD2 LEU 11 HD22 LEU 11 246.089 7.636 -1.144 95 3HD2 LEU 11 HD23 LEU 11 246.740 7.538 0.492 96 H VAL 12 HN VAL 12 243.828 7.465 -2.998 97 HA VAL 12 HA VAL 12 244.276 7.723 -5.829 98 HB VAL 12 HB VAL 12 242.761 9.680 -4.115 99 1HG1 VAL 12 HG11 VAL 12 242.858 8.993 -7.021 100 2HG1 VAL 12 HG12 VAL 12 242.915 10.573 -6.240 101 3HG1 VAL 12 HG13 VAL 12 241.393 9.686 -6.326 102 1HG2 VAL 12 HG21 VAL 12 240.800 8.119 -5.038 103 2HG2 VAL 12 HG22 VAL 12 241.576 7.850 -3.476 104 3HG2 VAL 12 HG23 VAL 12 242.070 6.905 -4.881 105 H LEU 13 HN LEU 13 246.638 8.056 -5.405 106 HA LEU 13 HA LEU 13 247.343 10.775 -4.606 107 1HB LEU 13 HB2 LEU 13 248.575 8.682 -3.847 108 2HB LEU 13 HB1 LEU 13 249.232 8.621 -5.470 109 HG LEU 13 HG LEU 13 250.875 9.925 -4.777 110 1HD1 LEU 13 HD11 LEU 13 248.702 11.957 -4.408 111 2HD1 LEU 13 HD12 LEU 13 249.771 11.745 -5.792 112 3HD1 LEU 13 HD13 LEU 13 250.416 12.328 -4.260 113 1HD2 LEU 13 HD21 LEU 13 250.303 11.159 -2.384 114 2HD2 LEU 13 HD22 LEU 13 251.118 9.610 -2.591 115 3HD2 LEU 13 HD23 LEU 13 249.379 9.659 -2.314 116 H GLN 14 HN GLN 14 247.416 12.308 -6.068 117 HA GLN 14 HA GLN 14 247.929 11.607 -8.877 118 1HB GLN 14 HB2 GLN 14 246.315 13.730 -7.541 119 2HB GLN 14 HB1 GLN 14 247.056 14.113 -9.090 120 1HG GLN 14 HG2 GLN 14 245.888 11.636 -9.494 121 2HG GLN 14 HG1 GLN 14 244.728 12.505 -8.492 122 1HE2 GLN 14 HE21 GLN 14 245.225 15.096 -9.408 123 2HE2 GLN 14 HE22 GLN 14 244.677 15.216 -11.042 124 HA PRO 15 HA PRO 15 251.808 13.699 -8.879 125 1HB PRO 15 HB2 PRO 15 251.755 15.060 -11.246 126 2HB PRO 15 HB1 PRO 15 252.032 13.320 -11.119 127 1HG PRO 15 HG2 PRO 15 249.510 14.795 -11.766 128 2HG PRO 15 HG1 PRO 15 250.175 13.331 -12.515 129 1HD PRO 15 HD2 PRO 15 248.181 13.223 -10.711 130 2HD PRO 15 HD1 PRO 15 249.430 11.964 -10.804 131 H GLN 16 HN GLN 16 249.525 15.131 -7.601 132 HA GLN 16 HA GLN 16 250.781 17.687 -7.365 133 1HB GLN 16 HB2 GLN 16 248.160 17.387 -8.791 134 2HB GLN 16 HB1 GLN 16 248.470 18.827 -7.829 135 1HG GLN 16 HG2 GLN 16 250.728 18.750 -9.278 136 2HG GLN 16 HG1 GLN 16 249.615 17.982 -10.407 137 1HE2 GLN 16 HE21 GLN 16 250.872 20.860 -9.436 138 2HE2 GLN 16 HE22 GLN 16 249.654 21.927 -10.038 139 H ARG 17 HN ARG 17 247.955 15.673 -6.660 140 HA ARG 17 HA ARG 17 248.178 16.448 -3.852 141 1HB ARG 17 HB2 ARG 17 245.637 16.588 -3.762 142 2HB ARG 17 HB1 ARG 17 246.472 17.933 -4.525 143 1HG ARG 17 HG2 ARG 17 244.961 17.654 -6.148 144 2HG ARG 17 HG1 ARG 17 246.012 16.335 -6.664 145 1HD ARG 17 HD2 ARG 17 244.588 14.957 -4.940 146 2HD ARG 17 HD1 ARG 17 243.411 16.240 -5.210 147 HE ARG 17 HE ARG 17 244.203 15.403 -7.713 148 1HH1 ARG 17 HH11 ARG 17 242.688 13.956 -4.921 149 2HH1 ARG 17 HH12 ARG 17 241.801 12.795 -5.850 150 1HH2 ARG 17 HH21 ARG 17 243.035 13.877 -8.935 151 2HH2 ARG 17 HH22 ARG 17 241.998 12.749 -8.128 152 H VAL 18 HN VAL 18 246.969 15.001 -2.401 153 HA VAL 18 HA VAL 18 246.482 12.329 -3.551 154 HB VAL 18 HB VAL 18 248.661 12.210 -2.540 155 1HG1 VAL 18 HG11 VAL 18 249.297 13.316 -0.708 156 2HG1 VAL 18 HG12 VAL 18 247.907 12.751 0.217 157 3HG1 VAL 18 HG13 VAL 18 247.756 14.165 -0.825 158 1HG2 VAL 18 HG21 VAL 18 246.625 10.975 -0.689 159 2HG2 VAL 18 HG22 VAL 18 248.304 10.472 -0.873 160 3HG2 VAL 18 HG23 VAL 18 247.177 10.287 -2.216 161 H LEU 19 HN LEU 19 245.045 10.994 -2.305 162 HA LEU 19 HA LEU 19 243.344 12.510 -0.435 163 1HB LEU 19 HB2 LEU 19 242.255 12.104 -2.625 164 2HB LEU 19 HB1 LEU 19 242.457 10.380 -2.379 165 HG LEU 19 HG LEU 19 240.941 10.402 -0.507 166 1HD1 LEU 19 HD11 LEU 19 241.101 12.311 0.701 167 2HD1 LEU 19 HD12 LEU 19 239.699 12.753 -0.274 168 3HD1 LEU 19 HD13 LEU 19 241.304 13.328 -0.725 169 1HD2 LEU 19 HD21 LEU 19 239.616 12.072 -2.618 170 2HD2 LEU 19 HD22 LEU 19 238.937 10.759 -1.656 171 3HD2 LEU 19 HD23 LEU 19 240.108 10.406 -2.926 172 H LEU 20 HN LEU 20 243.640 11.742 1.549 173 HA LEU 20 HA LEU 20 244.055 8.845 1.879 174 1HB LEU 20 HB2 LEU 20 245.221 11.215 3.199 175 2HB LEU 20 HB1 LEU 20 244.823 9.877 4.260 176 HG LEU 20 HG LEU 20 246.538 9.566 1.804 177 1HD1 LEU 20 HD11 LEU 20 248.474 9.664 3.223 178 2HD1 LEU 20 HD12 LEU 20 247.464 9.884 4.653 179 3HD1 LEU 20 HD13 LEU 20 247.545 11.150 3.428 180 1HD2 LEU 20 HD21 LEU 20 246.371 7.812 4.235 181 2HD2 LEU 20 HD22 LEU 20 247.091 7.447 2.667 182 3HD2 LEU 20 HD23 LEU 20 245.339 7.580 2.823 183 H GLY 21 HN GLY 21 242.754 7.688 3.208 184 1HA GLY 21 HA2 GLY 21 240.314 9.004 4.096 185 2HA GLY 21 HA1 GLY 21 240.602 7.272 4.034 186 H MET 22 HN MET 22 239.863 9.556 6.115 187 HA MET 22 HA MET 22 241.598 8.521 8.252 188 1HB MET 22 HB2 MET 22 241.872 10.904 8.017 189 2HB MET 22 HB1 MET 22 240.132 11.152 8.048 190 1HG MET 22 HG2 MET 22 239.995 10.598 10.339 191 2HG MET 22 HG1 MET 22 241.640 9.965 10.356 192 1HE MET 22 HE1 MET 22 243.452 11.517 9.181 193 2HE MET 22 HE2 MET 22 243.883 11.789 10.869 194 3HE MET 22 HE3 MET 22 243.737 13.155 9.768 195 H LYS 23 HN LYS 23 240.684 7.729 10.139 196 HA LYS 23 HA LYS 23 237.918 6.910 9.914 197 1HB LYS 23 HB2 LYS 23 240.247 6.179 11.607 198 2HB LYS 23 HB1 LYS 23 238.652 5.955 12.312 199 1HG LYS 23 HG2 LYS 23 238.900 4.920 9.591 200 2HG LYS 23 HG1 LYS 23 239.968 4.140 10.761 201 1HD LYS 23 HD2 LYS 23 237.013 4.529 11.204 202 2HD LYS 23 HD1 LYS 23 237.709 3.071 10.492 203 1HE LYS 23 HE2 LYS 23 239.016 3.883 12.969 204 2HE LYS 23 HE1 LYS 23 237.302 3.526 13.174 205 1HZ LYS 23 HZ1 LYS 23 237.772 1.378 13.100 206 2HZ LYS 23 HZ2 LYS 23 239.418 1.721 12.925 207 3HZ LYS 23 HZ3 LYS 23 238.442 1.538 11.556 208 H LYS 24 HN LYS 24 236.281 7.459 11.383 209 HA LYS 24 HA LYS 24 236.709 10.041 12.650 210 1HB LYS 24 HB2 LYS 24 234.505 8.769 11.369 211 2HB LYS 24 HB1 LYS 24 234.037 9.099 13.031 212 1HG LYS 24 HG2 LYS 24 233.546 11.158 12.376 213 2HG LYS 24 HG1 LYS 24 235.281 11.434 12.201 214 1HD LYS 24 HD2 LYS 24 235.075 10.510 9.865 215 2HD LYS 24 HD1 LYS 24 233.325 10.562 10.083 216 1HE LYS 24 HE2 LYS 24 235.171 12.933 10.337 217 2HE LYS 24 HE1 LYS 24 234.214 12.548 8.908 218 1HZ LYS 24 HZ1 LYS 24 232.341 13.295 9.858 219 2HZ LYS 24 HZ2 LYS 24 233.387 14.154 10.872 220 3HZ LYS 24 HZ3 LYS 24 232.727 12.686 11.390 221 H ARG 25 HN ARG 25 236.080 6.714 13.481 222 HA ARG 25 HA ARG 25 236.953 7.134 16.137 223 1HB ARG 25 HB2 ARG 25 234.662 6.171 17.054 224 2HB ARG 25 HB1 ARG 25 234.926 7.898 16.871 225 1HG ARG 25 HG2 ARG 25 232.722 7.093 16.046 226 2HG ARG 25 HG1 ARG 25 233.682 7.953 14.840 227 1HD ARG 25 HD2 ARG 25 234.222 5.983 13.699 228 2HD ARG 25 HD1 ARG 25 233.766 4.964 15.063 229 HE ARG 25 HE ARG 25 232.068 5.859 12.981 230 1HH1 ARG 25 HH11 ARG 25 232.100 5.228 16.413 231 2HH1 ARG 25 HH12 ARG 25 230.404 4.890 16.493 232 1HH2 ARG 25 HH21 ARG 25 229.837 5.416 13.084 233 2HH2 ARG 25 HH22 ARG 25 229.119 4.996 14.604 234 H GLY 26 HN GLY 26 237.489 5.246 17.178 235 1HA GLY 26 HA2 GLY 26 237.055 2.817 17.413 236 2HA GLY 26 HA1 GLY 26 236.961 2.765 15.658 237 H PHE 27 HN PHE 27 238.681 1.789 14.841 238 HA PHE 27 HA PHE 27 241.262 2.062 16.203 239 1HB PHE 27 HB2 PHE 27 240.105 0.038 14.320 240 2HB PHE 27 HB1 PHE 27 241.853 0.203 14.448 241 HD1 PHE 27 HD1 PHE 27 242.887 -1.255 15.872 242 HD2 PHE 27 HD2 PHE 27 238.922 0.013 16.758 243 HE1 PHE 27 HE1 PHE 27 242.877 -2.695 17.867 244 HE2 PHE 27 HE2 PHE 27 238.905 -1.423 18.756 245 HZ PHE 27 HZ PHE 27 240.884 -2.779 19.313 246 H GLY 28 HN GLY 28 241.447 4.281 15.364 247 1HA GLY 28 HA2 GLY 28 243.301 4.844 13.611 248 2HA GLY 28 HA1 GLY 28 242.009 4.446 12.489 249 H ALA 29 HN ALA 29 240.228 5.691 14.790 250 HA ALA 29 HA ALA 29 239.445 7.996 13.625 251 1HB ALA 29 HB1 ALA 29 238.243 8.393 15.458 252 2HB ALA 29 HB2 ALA 29 239.614 8.178 16.546 253 3HB ALA 29 HB3 ALA 29 238.783 6.770 15.886 254 H GLY 30 HN GLY 30 240.783 9.552 12.831 255 1HA GLY 30 HA2 GLY 30 241.848 11.651 13.379 256 2HA GLY 30 HA1 GLY 30 242.580 10.862 14.767 257 H ARG 31 HN ARG 31 242.747 8.758 12.199 258 HA ARG 31 HA ARG 31 245.391 9.770 11.386 259 1HB ARG 31 HB2 ARG 31 244.566 7.076 12.347 260 2HB ARG 31 HB1 ARG 31 245.754 7.144 11.052 261 1HG ARG 31 HG2 ARG 31 247.373 7.982 12.391 262 2HG ARG 31 HG1 ARG 31 246.234 8.890 13.388 263 1HD ARG 31 HD2 ARG 31 245.462 6.541 14.182 264 2HD ARG 31 HD1 ARG 31 247.019 6.007 13.552 265 HE ARG 31 HE ARG 31 247.228 8.262 15.311 266 1HH1 ARG 31 HH11 ARG 31 247.011 4.782 15.166 267 2HH1 ARG 31 HH12 ARG 31 247.787 4.545 16.695 268 1HH2 ARG 31 HH21 ARG 31 248.251 7.953 17.322 269 2HH2 ARG 31 HH22 ARG 31 248.491 6.344 17.920 270 H TRP 32 HN TRP 32 246.052 9.234 9.235 271 HA TRP 32 HA TRP 32 243.771 8.675 7.459 272 1HB TRP 32 HB2 TRP 32 246.091 9.770 6.094 273 2HB TRP 32 HB1 TRP 32 244.428 10.336 6.106 274 HD1 TRP 32 HD1 TRP 32 247.426 10.504 8.592 275 HE1 TRP 32 HE1 TRP 32 247.457 12.865 9.609 276 HE3 TRP 32 HE3 TRP 32 243.329 12.463 6.242 277 HZ2 TRP 32 HZ2 TRP 32 245.962 15.249 9.431 278 HZ3 TRP 32 HZ3 TRP 32 242.700 14.792 6.721 279 HH2 TRP 32 HH2 TRP 32 243.991 16.156 8.281 280 H ASN 33 HN ASN 33 244.104 7.355 5.597 281 HA ASN 33 HA ASN 33 246.496 6.006 5.019 282 1HB ASN 33 HB2 ASN 33 245.977 3.762 5.884 283 2HB ASN 33 HB1 ASN 33 246.159 4.928 7.190 284 1HD2 ASN 33 HD21 ASN 33 244.670 4.871 8.701 285 2HD2 ASN 33 HD22 ASN 33 243.066 4.252 8.530 286 H GLY 34 HN GLY 34 246.204 4.268 3.430 287 1HA GLY 34 HA2 GLY 34 244.360 4.933 1.445 288 2HA GLY 34 HA1 GLY 34 245.250 3.420 1.523 289 H PHE 35 HN PHE 35 242.774 3.344 0.468 290 HA PHE 35 HA PHE 35 240.989 2.427 2.607 291 1HB PHE 35 HB2 PHE 35 240.105 2.530 -0.241 292 2HB PHE 35 HB1 PHE 35 239.196 2.851 1.225 293 HD1 PHE 35 HD1 PHE 35 239.699 5.009 2.488 294 HD2 PHE 35 HD2 PHE 35 240.973 4.281 -1.506 295 HE1 PHE 35 HE1 PHE 35 239.988 7.427 2.143 296 HE2 PHE 35 HE2 PHE 35 241.266 6.698 -1.859 297 HZ PHE 35 HZ PHE 35 240.773 8.275 -0.032 298 H GLY 36 HN GLY 36 241.577 0.385 3.117 299 1HA GLY 36 HA2 GLY 36 242.414 -1.499 1.122 300 2HA GLY 36 HA1 GLY 36 242.168 -1.832 2.828 301 H GLY 37 HN GLY 37 241.437 -3.650 0.898 302 1HA GLY 37 HA2 GLY 37 238.648 -3.983 1.512 303 2HA GLY 37 HA1 GLY 37 238.934 -3.630 -0.186 304 H LYS 38 HN LYS 38 238.697 -6.049 2.108 305 HA LYS 38 HA LYS 38 240.523 -7.957 1.083 306 1HB LYS 38 HB2 LYS 38 239.332 -9.572 2.431 307 2HB LYS 38 HB1 LYS 38 239.517 -8.080 3.343 308 1HG LYS 38 HG2 LYS 38 237.148 -7.532 2.443 309 2HG LYS 38 HG1 LYS 38 237.056 -9.268 2.143 310 1HD LYS 38 HD2 LYS 38 238.024 -9.226 4.678 311 2HD LYS 38 HD1 LYS 38 237.014 -7.779 4.677 312 1HE LYS 38 HE2 LYS 38 235.107 -9.078 3.932 313 2HE LYS 38 HE1 LYS 38 236.107 -10.527 3.825 314 1HZ LYS 38 HZ1 LYS 38 236.545 -10.116 6.293 315 2HZ LYS 38 HZ2 LYS 38 235.030 -10.727 5.856 316 3HZ LYS 38 HZ3 LYS 38 235.202 -9.088 6.239 317 H VAL 39 HN VAL 39 240.286 -9.577 -0.404 318 HA VAL 39 HA VAL 39 238.234 -9.196 -2.396 319 HB VAL 39 HB VAL 39 240.327 -11.375 -2.293 320 1HG1 VAL 39 HG11 VAL 39 238.955 -10.179 -4.687 321 2HG1 VAL 39 HG12 VAL 39 238.372 -11.627 -3.866 322 3HG1 VAL 39 HG13 VAL 39 239.964 -11.622 -4.623 323 1HG2 VAL 39 HG21 VAL 39 240.471 -8.525 -3.116 324 2HG2 VAL 39 HG22 VAL 39 241.373 -9.724 -4.043 325 3HG2 VAL 39 HG23 VAL 39 241.676 -9.534 -2.315 326 H GLN 40 HN GLN 40 236.257 -9.930 -1.954 327 HA GLN 40 HA GLN 40 235.445 -11.801 -0.146 328 1HB GLN 40 HB2 GLN 40 234.167 -10.257 -1.952 329 2HB GLN 40 HB1 GLN 40 233.953 -11.833 -2.703 330 1HG GLN 40 HG2 GLN 40 233.292 -12.356 -0.112 331 2HG GLN 40 HG1 GLN 40 232.717 -10.701 -0.311 332 1HE2 GLN 40 HE21 GLN 40 231.503 -10.359 -2.435 333 2HE2 GLN 40 HE22 GLN 40 230.341 -11.570 -2.843 334 H GLU 41 HN GLU 41 234.348 -13.954 -0.675 335 HA GLU 41 HA GLU 41 236.347 -15.749 -1.589 336 1HB GLU 41 HB2 GLU 41 233.434 -16.242 -0.951 337 2HB GLU 41 HB1 GLU 41 234.641 -17.497 -1.195 338 1HG GLU 41 HG2 GLU 41 235.918 -16.426 0.720 339 2HG GLU 41 HG1 GLU 41 234.445 -15.512 1.044 340 H GLY 42 HN GLY 42 236.402 -14.481 -3.757 341 1HA GLY 42 HA2 GLY 42 236.227 -15.734 -5.947 342 2HA GLY 42 HA1 GLY 42 234.500 -15.735 -5.634 343 H GLU 43 HN GLU 43 236.742 -13.031 -5.077 344 HA GLU 43 HA GLU 43 235.469 -11.631 -7.305 345 1HB GLU 43 HB2 GLU 43 234.958 -9.766 -6.083 346 2HB GLU 43 HB1 GLU 43 234.774 -10.972 -4.822 347 1HG GLU 43 HG2 GLU 43 236.869 -10.413 -3.865 348 2HG GLU 43 HG1 GLU 43 237.309 -9.419 -5.253 349 H THR 44 HN THR 44 236.865 -9.578 -7.776 350 HA THR 44 HA THR 44 239.605 -10.579 -7.932 351 HB THR 44 HB THR 44 239.841 -8.913 -9.754 352 HG1 THR 44 HG1 THR 44 237.042 -8.593 -9.515 353 1HG2 THR 44 HG21 THR 44 239.358 -10.920 -10.701 354 2HG2 THR 44 HG22 THR 44 237.906 -10.037 -11.176 355 3HG2 THR 44 HG23 THR 44 237.868 -11.115 -9.780 356 H ILE 45 HN ILE 45 241.337 -9.436 -7.273 357 HA ILE 45 HA ILE 45 241.165 -7.918 -5.005 358 HB ILE 45 HB ILE 45 243.406 -7.471 -6.957 359 1HG1 ILE 45 HG12 ILE 45 243.028 -9.867 -5.152 360 2HG1 ILE 45 HG11 ILE 45 242.987 -9.889 -6.910 361 1HG2 ILE 45 HG21 ILE 45 243.019 -7.292 -4.018 362 2HG2 ILE 45 HG22 ILE 45 243.782 -6.154 -5.127 363 3HG2 ILE 45 HG23 ILE 45 244.624 -7.632 -4.662 364 1HD1 ILE 45 HD11 ILE 45 245.154 -10.488 -5.450 365 2HD1 ILE 45 HD12 ILE 45 245.424 -8.767 -5.723 366 3HD1 ILE 45 HD13 ILE 45 245.216 -9.855 -7.095 367 H GLU 46 HN GLU 46 241.038 -6.852 -8.343 368 HA GLU 46 HA GLU 46 241.212 -4.043 -7.733 369 1HB GLU 46 HB2 GLU 46 241.770 -5.246 -9.964 370 2HB GLU 46 HB1 GLU 46 240.039 -5.180 -10.259 371 1HG GLU 46 HG2 GLU 46 240.042 -2.802 -10.215 372 2HG GLU 46 HG1 GLU 46 241.709 -2.758 -9.640 373 H ASP 47 HN ASP 47 238.736 -6.452 -7.912 374 HA ASP 47 HA ASP 47 236.555 -4.580 -8.081 375 1HB ASP 47 HB2 ASP 47 236.829 -7.532 -7.847 376 2HB ASP 47 HB1 ASP 47 235.341 -6.820 -7.234 377 H GLY 48 HN GLY 48 238.252 -6.412 -5.626 378 1HA GLY 48 HA2 GLY 48 236.499 -5.663 -3.478 379 2HA GLY 48 HA1 GLY 48 238.084 -6.409 -3.318 380 H ALA 49 HN ALA 49 239.455 -4.368 -4.858 381 HA ALA 49 HA ALA 49 239.936 -2.497 -2.742 382 1HB ALA 49 HB1 ALA 49 241.046 -2.088 -5.475 383 2HB ALA 49 HB2 ALA 49 241.566 -3.500 -4.557 384 3HB ALA 49 HB3 ALA 49 241.814 -1.882 -3.901 385 H ARG 50 HN ARG 50 238.233 -2.495 -5.810 386 HA ARG 50 HA ARG 50 237.783 0.351 -5.708 387 1HB ARG 50 HB2 ARG 50 236.625 0.109 -7.782 388 2HB ARG 50 HB1 ARG 50 238.052 -0.914 -7.856 389 1HG ARG 50 HG2 ARG 50 236.615 -2.853 -7.260 390 2HG ARG 50 HG1 ARG 50 235.212 -1.788 -7.386 391 1HD ARG 50 HD2 ARG 50 236.138 -1.246 -9.739 392 2HD ARG 50 HD1 ARG 50 237.075 -2.726 -9.536 393 HE ARG 50 HE ARG 50 234.557 -3.511 -8.948 394 1HH1 ARG 50 HH11 ARG 50 235.947 -1.800 -11.654 395 2HH1 ARG 50 HH12 ARG 50 234.793 -2.407 -12.792 396 1HH2 ARG 50 HH21 ARG 50 233.037 -4.311 -10.444 397 2HH2 ARG 50 HH22 ARG 50 233.140 -3.832 -12.106 398 H ARG 51 HN ARG 51 235.799 -2.583 -5.375 399 HA ARG 51 HA ARG 51 233.360 -1.305 -4.857 400 1HB ARG 51 HB2 ARG 51 234.406 -4.003 -3.992 401 2HB ARG 51 HB1 ARG 51 232.752 -3.476 -3.714 402 1HG ARG 51 HG2 ARG 51 233.862 -3.388 -6.478 403 2HG ARG 51 HG1 ARG 51 233.354 -4.932 -5.791 404 1HD ARG 51 HD2 ARG 51 231.300 -3.131 -5.190 405 2HD ARG 51 HD1 ARG 51 231.759 -2.782 -6.857 406 HE ARG 51 HE ARG 51 230.877 -4.799 -7.488 407 1HH1 ARG 51 HH11 ARG 51 231.249 -4.762 -4.018 408 2HH1 ARG 51 HH12 ARG 51 230.393 -6.249 -3.785 409 1HH2 ARG 51 HH21 ARG 51 229.750 -6.756 -7.183 410 2HH2 ARG 51 HH22 ARG 51 229.542 -7.381 -5.581 411 H GLU 52 HN GLU 52 236.037 -2.147 -2.757 412 HA GLU 52 HA GLU 52 234.633 -1.324 -0.361 413 1HB GLU 52 HB2 GLU 52 237.521 -2.119 -0.797 414 2HB GLU 52 HB1 GLU 52 236.789 -1.798 0.769 415 1HG GLU 52 HG2 GLU 52 235.551 -3.847 -0.993 416 2HG GLU 52 HG1 GLU 52 237.045 -4.242 -0.144 417 H LEU 53 HN LEU 53 236.649 0.035 -2.775 418 HA LEU 53 HA LEU 53 237.758 2.187 -1.319 419 1HB LEU 53 HB2 LEU 53 238.814 1.685 -3.340 420 2HB LEU 53 HB1 LEU 53 237.303 1.594 -4.222 421 HG LEU 53 HG LEU 53 237.074 4.053 -3.998 422 1HD1 LEU 53 HD11 LEU 53 239.883 4.445 -3.327 423 2HD1 LEU 53 HD12 LEU 53 238.925 3.775 -2.008 424 3HD1 LEU 53 HD13 LEU 53 238.450 5.298 -2.760 425 1HD2 LEU 53 HD21 LEU 53 239.296 2.718 -5.443 426 2HD2 LEU 53 HD22 LEU 53 239.265 4.482 -5.430 427 3HD2 LEU 53 HD23 LEU 53 237.892 3.580 -6.070 428 H GLN 54 HN GLN 54 234.949 1.935 -3.466 429 HA GLN 54 HA GLN 54 234.086 4.589 -3.294 430 1HB GLN 54 HB2 GLN 54 233.034 3.395 -4.965 431 2HB GLN 54 HB1 GLN 54 232.769 1.990 -3.944 432 1HG GLN 54 HG2 GLN 54 230.970 3.097 -2.797 433 2HG GLN 54 HG1 GLN 54 231.289 4.597 -3.668 434 1HE2 GLN 54 HE21 GLN 54 231.008 1.205 -4.672 435 2HE2 GLN 54 HE22 GLN 54 229.786 1.479 -5.862 436 H GLU 55 HN GLU 55 233.783 1.950 -1.075 437 HA GLU 55 HA GLU 55 231.690 3.166 0.485 438 1HB GLU 55 HB2 GLU 55 233.365 0.692 0.835 439 2HB GLU 55 HB1 GLU 55 232.234 1.237 2.067 440 1HG GLU 55 HG2 GLU 55 230.590 1.267 -0.022 441 2HG GLU 55 HG1 GLU 55 231.723 0.043 -0.590 442 H GLU 56 HN GLU 56 235.148 3.257 0.491 443 HA GLU 56 HA GLU 56 235.347 3.966 3.267 444 1HB GLU 56 HB2 GLU 56 237.211 3.460 1.056 445 2HB GLU 56 HB1 GLU 56 237.765 4.641 2.233 446 1HG GLU 56 HG2 GLU 56 236.641 2.326 3.533 447 2HG GLU 56 HG1 GLU 56 237.930 1.876 2.419 448 H SER 57 HN SER 57 235.630 5.767 0.204 449 HA SER 57 HA SER 57 235.360 8.230 1.803 450 1HB SER 57 HB2 SER 57 237.022 9.329 0.598 451 2HB SER 57 HB1 SER 57 237.683 7.701 0.735 452 HG SER 57 HG SER 57 237.345 9.010 -1.457 453 H GLY 58 HN GLY 58 233.441 6.502 0.167 454 1HA GLY 58 HA2 GLY 58 231.673 6.839 -1.257 455 2HA GLY 58 HA1 GLY 58 231.789 8.526 -0.783 456 H LEU 59 HN LEU 59 234.634 7.308 -2.199 457 HA LEU 59 HA LEU 59 233.962 8.636 -4.734 458 1HB LEU 59 HB2 LEU 59 236.614 8.243 -3.362 459 2HB LEU 59 HB1 LEU 59 236.431 8.889 -4.981 460 HG LEU 59 HG LEU 59 235.722 10.148 -2.360 461 1HD1 LEU 59 HD11 LEU 59 237.455 11.450 -2.843 462 2HD1 LEU 59 HD12 LEU 59 236.794 11.834 -4.431 463 3HD1 LEU 59 HD13 LEU 59 237.798 10.400 -4.218 464 1HD2 LEU 59 HD21 LEU 59 234.658 11.006 -5.053 465 2HD2 LEU 59 HD22 LEU 59 234.476 11.882 -3.534 466 3HD2 LEU 59 HD23 LEU 59 233.701 10.312 -3.744 467 H THR 60 HN THR 60 233.484 7.231 -6.226 468 HA THR 60 HA THR 60 234.636 4.574 -6.220 469 HB THR 60 HB THR 60 233.017 5.316 -8.540 470 HG1 THR 60 HG1 THR 60 231.250 5.959 -7.548 471 1HG2 THR 60 HG21 THR 60 233.447 3.058 -6.878 472 2HG2 THR 60 HG22 THR 60 232.560 3.158 -8.399 473 3HG2 THR 60 HG23 THR 60 231.726 3.437 -6.872 474 H VAL 61 HN VAL 61 235.321 3.775 -8.536 475 HA VAL 61 HA VAL 61 236.830 5.882 -9.907 476 HB VAL 61 HB VAL 61 238.850 4.536 -9.995 477 1HG1 VAL 61 HG11 VAL 61 238.874 6.070 -8.227 478 2HG1 VAL 61 HG12 VAL 61 239.379 4.546 -7.498 479 3HG1 VAL 61 HG13 VAL 61 237.729 5.127 -7.275 480 1HG2 VAL 61 HG21 VAL 61 238.654 2.594 -8.080 481 2HG2 VAL 61 HG22 VAL 61 238.562 2.321 -9.818 482 3HG2 VAL 61 HG23 VAL 61 237.083 2.492 -8.874 483 H ASP 62 HN ASP 62 237.039 5.636 -12.063 484 HA ASP 62 HA ASP 62 235.416 3.618 -13.326 485 1HB ASP 62 HB2 ASP 62 236.850 6.078 -14.198 486 2HB ASP 62 HB1 ASP 62 236.548 4.844 -15.419 487 H ALA 63 HN ALA 63 238.697 3.986 -12.437 488 HA ALA 63 HA ALA 63 239.457 1.410 -13.104 489 1HB ALA 63 HB1 ALA 63 239.916 3.402 -15.280 490 2HB ALA 63 HB2 ALA 63 239.398 1.719 -15.387 491 3HB ALA 63 HB3 ALA 63 241.082 2.103 -15.027 492 H LEU 64 HN LEU 64 240.494 1.570 -11.109 493 HA LEU 64 HA LEU 64 242.251 3.581 -10.279 494 1HB LEU 64 HB2 LEU 64 242.267 0.626 -9.636 495 2HB LEU 64 HB1 LEU 64 243.244 1.818 -8.803 496 HG LEU 64 HG LEU 64 240.540 2.701 -8.718 497 1HD1 LEU 64 HD11 LEU 64 240.953 -0.172 -7.920 498 2HD1 LEU 64 HD12 LEU 64 239.824 0.451 -9.122 499 3HD1 LEU 64 HD13 LEU 64 239.585 0.817 -7.413 500 1HD2 LEU 64 HD21 LEU 64 241.714 1.507 -6.306 501 2HD2 LEU 64 HD22 LEU 64 241.089 3.133 -6.583 502 3HD2 LEU 64 HD23 LEU 64 242.721 2.715 -7.103 503 H HIS 65 HN HIS 65 244.693 2.742 -9.745 504 HA HIS 65 HA HIS 65 245.856 1.670 -12.214 505 1HB HIS 65 HB2 HIS 65 245.916 4.258 -12.023 506 2HB HIS 65 HB1 HIS 65 247.153 3.985 -10.802 507 HD1 HIS 65 HD1 HIS 65 247.569 1.404 -13.218 508 HD2 HIS 65 HD2 HIS 65 248.575 5.432 -13.043 509 HE1 HIS 65 HE1 HIS 65 249.372 1.722 -14.942 510 HE2 HIS 65 HE2 HIS 65 250.025 4.148 -14.757 511 H LYS 66 HN LYS 66 246.570 -0.237 -11.405 512 HA LYS 66 HA LYS 66 247.590 -0.620 -8.805 513 1HB LYS 66 HB2 LYS 66 248.388 -2.786 -9.634 514 2HB LYS 66 HB1 LYS 66 246.740 -2.473 -10.159 515 1HG LYS 66 HG2 LYS 66 248.790 -1.589 -12.050 516 2HG LYS 66 HG1 LYS 66 248.759 -3.329 -11.764 517 1HD LYS 66 HD2 LYS 66 246.120 -2.095 -12.144 518 2HD LYS 66 HD1 LYS 66 247.180 -2.022 -13.553 519 1HE LYS 66 HE2 LYS 66 247.586 -4.517 -13.139 520 2HE LYS 66 HE1 LYS 66 246.178 -4.437 -12.079 521 1HZ LYS 66 HZ1 LYS 66 245.707 -5.128 -14.414 522 2HZ LYS 66 HZ2 LYS 66 246.132 -3.568 -14.914 523 3HZ LYS 66 HZ3 LYS 66 244.810 -3.795 -13.885 524 H VAL 67 HN VAL 67 249.658 -0.562 -7.978 525 HA VAL 67 HA VAL 67 251.772 0.238 -9.874 526 HB VAL 67 HB VAL 67 252.711 1.782 -8.230 527 1HG1 VAL 67 HG11 VAL 67 251.265 2.726 -9.883 528 2HG1 VAL 67 HG12 VAL 67 250.910 3.508 -8.343 529 3HG1 VAL 67 HG13 VAL 67 249.830 2.263 -8.969 530 1HG2 VAL 67 HG21 VAL 67 250.452 0.784 -6.567 531 2HG2 VAL 67 HG22 VAL 67 250.991 2.448 -6.368 532 3HG2 VAL 67 HG23 VAL 67 252.123 1.121 -6.115 533 H GLY 68 HN GLY 68 251.150 -1.034 -6.600 534 1HA GLY 68 HA2 GLY 68 253.398 -2.861 -7.020 535 2HA GLY 68 HA1 GLY 68 253.452 -1.817 -5.610 536 H GLN 69 HN GLN 69 253.601 -4.433 -5.156 537 HA GLN 69 HA GLN 69 250.968 -5.055 -4.007 538 1HB GLN 69 HB2 GLN 69 251.627 -6.428 -6.097 539 2HB GLN 69 HB1 GLN 69 252.790 -7.214 -5.039 540 1HG GLN 69 HG2 GLN 69 250.541 -7.408 -3.551 541 2HG GLN 69 HG1 GLN 69 249.874 -7.486 -5.181 542 1HE2 GLN 69 HE21 GLN 69 250.261 -9.259 -6.440 543 2HE2 GLN 69 HE22 GLN 69 251.033 -10.690 -5.856 544 H ILE 70 HN ILE 70 251.172 -5.001 -1.871 545 HA ILE 70 HA ILE 70 253.749 -5.718 -0.664 546 HB ILE 70 HB ILE 70 251.383 -4.328 0.598 547 1HG1 ILE 70 HG12 ILE 70 254.016 -3.079 -0.170 548 2HG1 ILE 70 HG11 ILE 70 252.640 -3.107 -1.269 549 1HG2 ILE 70 HG21 ILE 70 253.990 -5.276 1.619 550 2HG2 ILE 70 HG22 ILE 70 252.444 -5.093 2.447 551 3HG2 ILE 70 HG23 ILE 70 253.460 -3.682 2.158 552 1HD1 ILE 70 HD11 ILE 70 251.371 -2.030 0.724 553 2HD1 ILE 70 HD12 ILE 70 252.434 -1.046 -0.283 554 3HD1 ILE 70 HD13 ILE 70 252.992 -1.621 1.288 555 H VAL 71 HN VAL 71 253.932 -7.302 0.876 556 HA VAL 71 HA VAL 71 251.537 -8.918 1.436 557 HB VAL 71 HB VAL 71 254.293 -9.943 0.733 558 1HG1 VAL 71 HG11 VAL 71 253.331 -12.184 0.965 559 2HG1 VAL 71 HG12 VAL 71 251.827 -11.472 1.552 560 3HG1 VAL 71 HG13 VAL 71 253.311 -11.301 2.492 561 1HG2 VAL 71 HG21 VAL 71 252.662 -11.160 -0.995 562 2HG2 VAL 71 HG22 VAL 71 253.411 -9.597 -1.326 563 3HG2 VAL 71 HG23 VAL 71 251.746 -9.672 -0.749 564 H PHE 72 HN PHE 72 251.443 -9.895 3.473 565 HA PHE 72 HA PHE 72 253.562 -9.085 5.351 566 1HB PHE 72 HB2 PHE 72 250.621 -9.304 6.004 567 2HB PHE 72 HB1 PHE 72 251.899 -8.778 7.088 568 HD1 PHE 72 HD1 PHE 72 253.189 -6.671 6.449 569 HD2 PHE 72 HD2 PHE 72 249.458 -7.762 4.720 570 HE1 PHE 72 HE1 PHE 72 252.839 -4.338 5.741 571 HE2 PHE 72 HE2 PHE 72 249.101 -5.433 4.008 572 HZ PHE 72 HZ PHE 72 250.793 -3.718 4.520 573 H GLU 73 HN GLU 73 254.602 -10.763 6.150 574 HA GLU 73 HA GLU 73 253.263 -13.370 6.241 575 1HB GLU 73 HB2 GLU 73 256.192 -12.857 6.734 576 2HB GLU 73 HB1 GLU 73 255.414 -14.369 6.289 577 1HG GLU 73 HG2 GLU 73 254.854 -13.363 4.089 578 2HG GLU 73 HG1 GLU 73 255.797 -11.947 4.547 579 H PHE 74 HN PHE 74 252.572 -14.162 8.129 580 HA PHE 74 HA PHE 74 253.122 -12.682 10.551 581 1HB PHE 74 HB2 PHE 74 251.439 -15.149 10.075 582 2HB PHE 74 HB1 PHE 74 251.527 -14.268 11.597 583 HD1 PHE 74 HD1 PHE 74 251.415 -11.494 10.778 584 HD2 PHE 74 HD2 PHE 74 249.312 -14.860 9.243 585 HE1 PHE 74 HE1 PHE 74 249.601 -10.012 10.026 586 HE2 PHE 74 HE2 PHE 74 247.493 -13.384 8.487 587 HZ PHE 74 HZ PHE 74 247.637 -10.956 8.878 588 H VAL 75 HN VAL 75 254.434 -13.168 12.123 589 HA VAL 75 HA VAL 75 256.333 -15.285 11.744 590 HB VAL 75 HB VAL 75 256.375 -13.975 14.359 591 1HG1 VAL 75 HG11 VAL 75 258.625 -14.055 14.049 592 2HG1 VAL 75 HG12 VAL 75 258.510 -13.686 12.327 593 3HG1 VAL 75 HG13 VAL 75 258.140 -15.311 12.908 594 1HG2 VAL 75 HG21 VAL 75 255.620 -11.988 13.510 595 2HG2 VAL 75 HG22 VAL 75 256.208 -12.331 11.884 596 3HG2 VAL 75 HG23 VAL 75 257.339 -11.850 13.148 597 H GLY 76 HN GLY 76 255.750 -17.308 12.181 598 1HA GLY 76 HA2 GLY 76 255.475 -18.998 13.856 599 2HA GLY 76 HA1 GLY 76 254.551 -17.848 14.811 600 H GLU 77 HN GLU 77 253.168 -17.091 12.161 601 HA GLU 77 HA GLU 77 251.204 -19.277 12.281 602 1HB GLU 77 HB2 GLU 77 250.940 -16.357 11.587 603 2HB GLU 77 HB1 GLU 77 249.679 -17.523 11.212 604 1HG GLU 77 HG2 GLU 77 249.010 -17.692 13.351 605 2HG GLU 77 HG1 GLU 77 250.649 -17.553 13.988 606 HA PRO 78 HA PRO 78 252.225 -20.383 8.120 607 1HB PRO 78 HB2 PRO 78 249.942 -21.656 7.402 608 2HB PRO 78 HB1 PRO 78 251.118 -22.358 8.519 609 1HG PRO 78 HG2 PRO 78 248.545 -20.954 9.116 610 2HG PRO 78 HG1 PRO 78 249.214 -22.423 9.849 611 1HD PRO 78 HD2 PRO 78 249.370 -19.987 11.034 612 2HD PRO 78 HD1 PRO 78 250.606 -21.242 11.250 613 H GLU 79 HN GLU 79 248.928 -19.090 8.553 614 HA GLU 79 HA GLU 79 248.480 -18.286 5.934 615 1HB GLU 79 HB2 GLU 79 247.086 -18.170 8.304 616 2HB GLU 79 HB1 GLU 79 247.360 -16.472 7.941 617 1HG GLU 79 HG2 GLU 79 246.375 -16.807 5.721 618 2HG GLU 79 HG1 GLU 79 246.060 -18.492 6.132 619 H LEU 80 HN LEU 80 248.325 -16.049 5.123 620 HA LEU 80 HA LEU 80 250.278 -14.183 6.240 621 1HB LEU 80 HB2 LEU 80 250.380 -14.507 3.297 622 2HB LEU 80 HB1 LEU 80 251.655 -14.090 4.424 623 HG LEU 80 HG LEU 80 250.589 -16.882 4.381 624 1HD1 LEU 80 HD11 LEU 80 252.690 -15.816 2.502 625 2HD1 LEU 80 HD12 LEU 80 251.059 -16.304 2.041 626 3HD1 LEU 80 HD13 LEU 80 252.191 -17.499 2.674 627 1HD2 LEU 80 HD21 LEU 80 252.107 -16.855 6.048 628 2HD2 LEU 80 HD22 LEU 80 252.933 -15.430 5.417 629 3HD2 LEU 80 HD23 LEU 80 253.264 -17.019 4.726 630 H MET 81 HN MET 81 250.240 -12.358 4.106 631 HA MET 81 HA MET 81 247.442 -11.810 3.561 632 1HB MET 81 HB2 MET 81 247.767 -10.725 5.707 633 2HB MET 81 HB1 MET 81 249.191 -9.896 5.099 634 1HG MET 81 HG2 MET 81 247.927 -8.506 3.700 635 2HG MET 81 HG1 MET 81 246.492 -9.518 3.855 636 1HE MET 81 HE1 MET 81 245.427 -10.001 6.197 637 2HE MET 81 HE2 MET 81 245.434 -8.866 7.547 638 3HE MET 81 HE3 MET 81 246.822 -9.919 7.272 639 H ASP 82 HN ASP 82 247.376 -11.436 1.462 640 HA ASP 82 HA ASP 82 249.659 -10.098 0.180 641 1HB ASP 82 HB2 ASP 82 249.006 -12.273 -0.777 642 2HB ASP 82 HB1 ASP 82 247.379 -11.664 -1.060 643 H VAL 83 HN VAL 83 249.331 -7.953 0.346 644 HA VAL 83 HA VAL 83 246.667 -6.884 -0.291 645 HB VAL 83 HB VAL 83 248.959 -5.448 1.046 646 1HG1 VAL 83 HG11 VAL 83 246.192 -4.571 1.476 647 2HG1 VAL 83 HG12 VAL 83 246.785 -4.373 -0.174 648 3HG1 VAL 83 HG13 VAL 83 247.650 -3.627 1.170 649 1HG2 VAL 83 HG21 VAL 83 247.136 -5.767 3.003 650 2HG2 VAL 83 HG22 VAL 83 248.500 -6.857 2.744 651 3HG2 VAL 83 HG23 VAL 83 246.905 -7.271 2.112 652 H HIS 84 HN HIS 84 246.396 -6.117 -2.260 653 HA HIS 84 HA HIS 84 248.643 -5.392 -3.922 654 1HB HIS 84 HB2 HIS 84 246.190 -6.413 -4.496 655 2HB HIS 84 HB1 HIS 84 245.905 -4.706 -4.816 656 HD1 HIS 84 HD1 HIS 84 248.044 -3.669 -6.388 657 HD2 HIS 84 HD2 HIS 84 247.012 -7.681 -6.722 658 HE1 HIS 84 HE1 HIS 84 248.956 -4.416 -8.610 659 HE2 HIS 84 HE2 HIS 84 248.396 -6.868 -8.751 660 H VAL 85 HN VAL 85 249.068 -3.276 -4.718 661 HA VAL 85 HA VAL 85 247.826 -1.163 -3.074 662 HB VAL 85 HB VAL 85 250.589 -1.159 -4.317 663 1HG1 VAL 85 HG11 VAL 85 249.033 0.996 -3.628 664 2HG1 VAL 85 HG12 VAL 85 250.792 0.991 -3.737 665 3HG1 VAL 85 HG13 VAL 85 250.004 0.737 -2.180 666 1HG2 VAL 85 HG21 VAL 85 250.981 -1.047 -1.641 667 2HG2 VAL 85 HG22 VAL 85 251.032 -2.533 -2.589 668 3HG2 VAL 85 HG23 VAL 85 249.560 -2.090 -1.724 669 H PHE 86 HN PHE 86 246.317 -0.294 -4.299 670 HA PHE 86 HA PHE 86 246.883 0.341 -7.107 671 1HB PHE 86 HB2 PHE 86 244.410 -0.295 -5.551 672 2HB PHE 86 HB1 PHE 86 244.256 0.787 -6.931 673 HD1 PHE 86 HD1 PHE 86 244.093 -0.072 -9.090 674 HD2 PHE 86 HD2 PHE 86 245.499 -2.568 -5.942 675 HE1 PHE 86 HE1 PHE 86 244.001 -2.016 -10.595 676 HE2 PHE 86 HE2 PHE 86 245.410 -4.516 -7.442 677 HZ PHE 86 HZ PHE 86 244.660 -4.241 -9.772 678 H CYS 87 HN CYS 87 246.385 2.384 -7.920 679 HA CYS 87 HA CYS 87 245.707 4.496 -6.003 680 1HB CYS 87 HB2 CYS 87 247.445 5.972 -6.908 681 2HB CYS 87 HB1 CYS 87 248.170 4.526 -6.216 682 HG CYS 87 HG CYS 87 249.206 5.192 -8.590 683 H THR 88 HN THR 88 243.933 5.439 -6.813 684 HA THR 88 HA THR 88 243.430 5.214 -9.678 685 HB THR 88 HB THR 88 241.779 4.562 -7.788 686 HG1 THR 88 HG1 THR 88 240.476 6.153 -9.649 687 1HG2 THR 88 HG21 THR 88 241.983 7.032 -6.891 688 2HG2 THR 88 HG22 THR 88 240.486 6.104 -6.776 689 3HG2 THR 88 HG23 THR 88 240.692 7.292 -8.064 690 H ASP 89 HN ASP 89 241.926 7.151 -10.421 691 HA ASP 89 HA ASP 89 242.851 9.748 -9.552 692 1HB ASP 89 HB2 ASP 89 243.634 10.411 -11.807 693 2HB ASP 89 HB1 ASP 89 244.629 9.135 -11.112 694 H SER 90 HN SER 90 241.104 7.874 -11.986 695 HA SER 90 HA SER 90 239.184 10.013 -12.401 696 1HB SER 90 HB2 SER 90 240.143 7.972 -14.015 697 2HB SER 90 HB1 SER 90 238.533 7.405 -13.570 698 HG SER 90 HG SER 90 238.312 8.667 -15.379 699 H ILE 91 HN ILE 91 237.969 10.238 -10.562 700 HA ILE 91 HA ILE 91 236.716 7.827 -9.465 701 HB ILE 91 HB ILE 91 236.127 9.200 -7.501 702 1HG1 ILE 91 HG12 ILE 91 237.850 11.368 -8.710 703 2HG1 ILE 91 HG11 ILE 91 236.094 11.366 -8.851 704 1HG2 ILE 91 HG21 ILE 91 239.020 9.726 -7.789 705 2HG2 ILE 91 HG22 ILE 91 238.493 8.064 -8.057 706 3HG2 ILE 91 HG23 ILE 91 238.139 8.866 -6.526 707 1HD1 ILE 91 HD11 ILE 91 237.489 11.241 -6.200 708 2HD1 ILE 91 HD12 ILE 91 235.807 11.647 -6.539 709 3HD1 ILE 91 HD13 ILE 91 237.094 12.762 -6.998 710 H GLN 92 HN GLN 92 234.473 8.475 -8.382 711 HA GLN 92 HA GLN 92 232.894 10.028 -10.304 712 1HB GLN 92 HB2 GLN 92 232.182 7.246 -9.369 713 2HB GLN 92 HB1 GLN 92 231.181 8.273 -10.386 714 1HG GLN 92 HG2 GLN 92 232.956 8.240 -12.103 715 2HG GLN 92 HG1 GLN 92 233.869 7.120 -11.092 716 1HE2 GLN 92 HE21 GLN 92 233.176 5.005 -10.882 717 2HE2 GLN 92 HE22 GLN 92 231.988 4.309 -11.926 718 H GLY 93 HN GLY 93 232.313 7.977 -7.453 719 1HA GLY 93 HA2 GLY 93 230.195 9.392 -6.387 720 2HA GLY 93 HA1 GLY 93 231.314 8.429 -5.437 721 H THR 94 HN THR 94 230.512 10.294 -3.959 722 HA THR 94 HA THR 94 232.376 12.551 -4.203 723 HB THR 94 HB THR 94 230.081 12.865 -2.402 724 HG1 THR 94 HG1 THR 94 228.992 11.801 -4.015 725 1HG2 THR 94 HG21 THR 94 231.734 14.529 -4.090 726 2HG2 THR 94 HG22 THR 94 230.747 14.958 -2.693 727 3HG2 THR 94 HG23 THR 94 230.017 14.871 -4.295 728 HA PRO 95 HA PRO 95 234.256 11.522 -0.384 729 1HB PRO 95 HB2 PRO 95 234.127 14.306 0.541 730 2HB PRO 95 HB1 PRO 95 235.541 13.337 0.115 731 1HG PRO 95 HG2 PRO 95 234.700 15.373 -1.416 732 2HG PRO 95 HG1 PRO 95 235.435 13.914 -2.104 733 1HD PRO 95 HD2 PRO 95 232.542 14.671 -1.917 734 2HD PRO 95 HD1 PRO 95 233.431 13.952 -3.278 735 H VAL 96 HN VAL 96 231.865 10.742 -0.204 736 HA VAL 96 HA VAL 96 230.219 12.123 1.694 737 HB VAL 96 HB VAL 96 229.977 9.214 0.942 738 1HG1 VAL 96 HG11 VAL 96 227.518 9.813 1.238 739 2HG1 VAL 96 HG12 VAL 96 228.093 11.292 2.009 740 3HG1 VAL 96 HG13 VAL 96 228.509 9.721 2.694 741 1HG2 VAL 96 HG21 VAL 96 228.256 10.327 -0.746 742 2HG2 VAL 96 HG22 VAL 96 229.941 10.035 -1.180 743 3HG2 VAL 96 HG23 VAL 96 229.429 11.644 -0.669 744 H GLU 97 HN GLU 97 232.365 12.163 3.051 745 HA GLU 97 HA GLU 97 233.355 10.086 4.521 746 1HB GLU 97 HB2 GLU 97 233.906 11.684 6.258 747 2HB GLU 97 HB1 GLU 97 234.130 12.430 4.682 748 1HG GLU 97 HG2 GLU 97 231.565 13.121 5.238 749 2HG GLU 97 HG1 GLU 97 232.285 13.112 6.848 750 H SER 98 HN SER 98 232.438 8.567 5.729 751 HA SER 98 HA SER 98 229.754 8.947 6.763 752 1HB SER 98 HB2 SER 98 231.586 6.606 6.415 753 2HB SER 98 HB1 SER 98 230.262 6.487 7.574 754 HG SER 98 HG SER 98 229.867 7.334 4.904 755 H ASP 99 HN ASP 99 229.514 7.683 9.031 756 HA ASP 99 HA ASP 99 230.653 9.417 10.947 757 1HB ASP 99 HB2 ASP 99 229.307 6.755 11.437 758 2HB ASP 99 HB1 ASP 99 229.515 8.058 12.603 759 H GLU 100 HN GLU 100 231.924 6.651 9.445 760 HA GLU 100 HA GLU 100 233.893 6.345 11.616 761 1HB GLU 100 HB2 GLU 100 232.237 4.394 10.534 762 2HB GLU 100 HB1 GLU 100 233.787 4.110 9.755 763 1HG GLU 100 HG2 GLU 100 234.572 4.429 12.318 764 2HG GLU 100 HG1 GLU 100 232.972 3.725 12.548 765 H MET 101 HN MET 101 233.442 7.323 8.408 766 HA MET 101 HA MET 101 236.340 7.132 7.931 767 1HB MET 101 HB2 MET 101 234.239 6.047 6.370 768 2HB MET 101 HB1 MET 101 234.905 7.394 5.460 769 1HG MET 101 HG2 MET 101 235.935 5.193 4.956 770 2HG MET 101 HG1 MET 101 237.078 6.431 5.468 771 1HE MET 101 HE1 MET 101 238.731 5.939 7.891 772 2HE MET 101 HE2 MET 101 238.899 5.543 6.182 773 3HE MET 101 HE3 MET 101 239.193 4.307 7.405 774 H ARG 102 HN ARG 102 237.188 8.801 6.452 775 HA ARG 102 HA ARG 102 235.757 11.150 5.840 776 1HB ARG 102 HB2 ARG 102 235.746 11.450 8.275 777 2HB ARG 102 HB1 ARG 102 237.496 11.290 8.315 778 1HG ARG 102 HG2 ARG 102 237.272 13.314 6.568 779 2HG ARG 102 HG1 ARG 102 235.816 13.580 7.529 780 1HD ARG 102 HD2 ARG 102 236.991 14.053 9.431 781 2HD ARG 102 HD1 ARG 102 238.357 13.039 8.968 782 HE ARG 102 HE ARG 102 239.309 14.849 7.939 783 1HH1 ARG 102 HH11 ARG 102 235.948 15.546 8.569 784 2HH1 ARG 102 HH12 ARG 102 236.079 17.211 8.114 785 1HH2 ARG 102 HH21 ARG 102 239.483 17.039 7.339 786 2HH2 ARG 102 HH22 ARG 102 238.085 18.059 7.414 787 HA PRO 103 HA PRO 103 239.728 10.817 3.618 788 1HB PRO 103 HB2 PRO 103 238.874 11.798 1.275 789 2HB PRO 103 HB1 PRO 103 238.486 10.147 1.781 790 1HG PRO 103 HG2 PRO 103 236.801 12.623 1.950 791 2HG PRO 103 HG1 PRO 103 236.349 11.005 1.381 792 1HD PRO 103 HD2 PRO 103 235.786 11.900 3.888 793 2HD PRO 103 HD1 PRO 103 236.085 10.189 3.524 794 H CYS 104 HN CYS 104 241.166 12.387 2.694 795 HA CYS 104 HA CYS 104 240.436 15.192 2.984 796 1HB CYS 104 HB2 CYS 104 241.463 14.303 5.165 797 2HB CYS 104 HB1 CYS 104 242.973 14.198 4.265 798 HG CYS 104 HG CYS 104 241.964 16.657 5.539 799 H TRP 105 HN TRP 105 241.124 16.276 1.280 800 HA TRP 105 HA TRP 105 243.044 15.046 -0.518 801 1HB TRP 105 HB2 TRP 105 241.440 17.596 -0.816 802 2HB TRP 105 HB1 TRP 105 242.389 16.824 -2.081 803 HD1 TRP 105 HD1 TRP 105 239.709 15.337 0.327 804 HE1 TRP 105 HE1 TRP 105 237.974 14.083 -1.104 805 HE3 TRP 105 HE3 TRP 105 241.609 16.346 -4.313 806 HZ2 TRP 105 HZ2 TRP 105 237.479 13.594 -3.839 807 HZ3 TRP 105 HZ3 TRP 105 240.443 15.447 -6.284 808 HH2 TRP 105 HH2 TRP 105 238.421 14.099 -6.050 809 H PHE 106 HN PHE 106 245.141 15.426 -0.282 810 HA PHE 106 HA PHE 106 246.000 18.105 0.596 811 1HB PHE 106 HB2 PHE 106 246.891 15.399 1.545 812 2HB PHE 106 HB1 PHE 106 247.997 16.764 1.618 813 HD1 PHE 106 HD1 PHE 106 246.252 18.968 2.379 814 HD2 PHE 106 HD2 PHE 106 246.298 14.929 3.719 815 HE1 PHE 106 HE1 PHE 106 245.247 19.669 4.514 816 HE2 PHE 106 HE2 PHE 106 245.293 15.622 5.855 817 HZ PHE 106 HZ PHE 106 244.767 17.994 6.255 818 H GLN 107 HN GLN 107 248.717 17.805 0.333 819 HA GLN 107 HA GLN 107 248.980 17.698 -2.560 820 1HB GLN 107 HB2 GLN 107 250.677 18.768 -0.329 821 2HB GLN 107 HB1 GLN 107 251.369 18.513 -1.925 822 1HG GLN 107 HG2 GLN 107 250.744 20.703 -2.066 823 2HG GLN 107 HG1 GLN 107 249.315 19.906 -2.723 824 1HE2 GLN 107 HE21 GLN 107 248.479 22.106 -2.082 825 2HE2 GLN 107 HE22 GLN 107 247.823 22.254 -0.492 826 H LEU 108 HN LEU 108 250.739 16.572 -3.586 827 HA LEU 108 HA LEU 108 251.051 13.908 -2.574 828 1HB LEU 108 HB2 LEU 108 251.980 13.372 -4.652 829 2HB LEU 108 HB1 LEU 108 250.804 14.619 -5.016 830 HG LEU 108 HG LEU 108 253.788 15.032 -4.796 831 1HD1 LEU 108 HD11 LEU 108 253.214 15.658 -7.319 832 2HD1 LEU 108 HD12 LEU 108 251.959 14.448 -7.048 833 3HD1 LEU 108 HD13 LEU 108 253.656 14.025 -6.822 834 1HD2 LEU 108 HD21 LEU 108 252.601 17.018 -4.111 835 2HD2 LEU 108 HD22 LEU 108 251.564 16.927 -5.534 836 3HD2 LEU 108 HD23 LEU 108 253.283 17.267 -5.718 837 H ASP 109 HN ASP 109 252.632 16.670 -1.775 838 HA ASP 109 HA ASP 109 255.128 15.219 -1.206 839 1HB ASP 109 HB2 ASP 109 255.395 17.109 -2.820 840 2HB ASP 109 HB1 ASP 109 254.814 18.207 -1.572 841 H GLN 110 HN GLN 110 252.530 15.566 0.306 842 HA GLN 110 HA GLN 110 253.777 16.280 2.832 843 1HB GLN 110 HB2 GLN 110 251.445 17.703 1.616 844 2HB GLN 110 HB1 GLN 110 251.531 17.527 3.364 845 1HG GLN 110 HG2 GLN 110 254.025 18.432 2.799 846 2HG GLN 110 HG1 GLN 110 253.068 19.244 1.562 847 1HE2 GLN 110 HE21 GLN 110 252.535 18.390 4.966 848 2HE2 GLN 110 HE22 GLN 110 252.084 19.979 5.472 849 H ILE 111 HN ILE 111 252.613 13.860 1.394 850 HA ILE 111 HA ILE 111 250.300 13.130 2.932 851 HB ILE 111 HB ILE 111 251.753 10.808 1.996 852 1HG1 ILE 111 HG12 ILE 111 251.154 11.476 -0.491 853 2HG1 ILE 111 HG11 ILE 111 251.474 13.101 0.108 854 1HG2 ILE 111 HG21 ILE 111 249.700 10.084 1.717 855 2HG2 ILE 111 HG22 ILE 111 249.313 11.389 0.598 856 3HG2 ILE 111 HG23 ILE 111 249.137 11.636 2.336 857 1HD1 ILE 111 HD11 ILE 111 253.668 12.145 0.990 858 2HD1 ILE 111 HD12 ILE 111 253.514 12.370 -0.752 859 3HD1 ILE 111 HD13 ILE 111 253.334 10.763 -0.051 860 HA PRO 112 HA PRO 112 252.743 11.811 6.410 861 1HB PRO 112 HB2 PRO 112 250.784 11.650 8.199 862 2HB PRO 112 HB1 PRO 112 251.246 13.216 7.520 863 1HG PRO 112 HG2 PRO 112 248.903 11.486 6.868 864 2HG PRO 112 HG1 PRO 112 249.004 13.253 6.953 865 1HD PRO 112 HD2 PRO 112 249.147 11.685 4.624 866 2HD PRO 112 HD1 PRO 112 249.573 13.401 4.763 867 H PHE 113 HN PHE 113 253.471 9.800 5.813 868 HA PHE 113 HA PHE 113 251.740 7.523 5.756 869 1HB PHE 113 HB2 PHE 113 254.654 7.100 6.046 870 2HB PHE 113 HB1 PHE 113 253.507 6.319 4.974 871 HD1 PHE 113 HD1 PHE 113 252.493 9.153 3.881 872 HD2 PHE 113 HD2 PHE 113 256.280 7.247 4.326 873 HE1 PHE 113 HE1 PHE 113 253.396 10.465 2.008 874 HE2 PHE 113 HE2 PHE 113 257.172 8.555 2.456 875 HZ PHE 113 HZ PHE 113 255.728 10.176 1.292 876 H LYS 114 HN LYS 114 253.413 9.180 8.229 877 HA LYS 114 HA LYS 114 253.796 6.970 9.989 878 1HB LYS 114 HB2 LYS 114 253.731 9.948 10.511 879 2HB LYS 114 HB1 LYS 114 254.181 8.739 11.706 880 1HG LYS 114 HG2 LYS 114 256.215 8.382 10.785 881 2HG LYS 114 HG1 LYS 114 255.644 8.670 9.140 882 1HD LYS 114 HD2 LYS 114 255.661 11.041 9.481 883 2HD LYS 114 HD1 LYS 114 255.994 10.841 11.203 884 1HE LYS 114 HE2 LYS 114 258.195 10.465 10.867 885 2HE LYS 114 HE1 LYS 114 257.920 9.564 9.376 886 1HZ LYS 114 HZ1 LYS 114 257.527 12.486 9.457 887 2HZ LYS 114 HZ2 LYS 114 257.853 11.493 8.127 888 3HZ LYS 114 HZ3 LYS 114 259.074 11.834 9.247 889 H ASP 115 HN ASP 115 251.156 9.008 9.156 890 HA ASP 115 HA ASP 115 249.667 8.184 11.525 891 1HB ASP 115 HB2 ASP 115 249.318 10.374 9.515 892 2HB ASP 115 HB1 ASP 115 247.924 9.811 10.432 893 H MET 116 HN MET 116 250.344 6.449 9.169 894 HA MET 116 HA MET 116 247.588 5.604 8.589 895 1HB MET 116 HB2 MET 116 249.583 5.062 6.477 896 2HB MET 116 HB1 MET 116 247.887 5.491 6.339 897 1HG MET 116 HG2 MET 116 248.596 7.835 7.031 898 2HG MET 116 HG1 MET 116 250.242 7.298 6.722 899 1HE MET 116 HE1 MET 116 251.076 7.414 3.569 900 2HE MET 116 HE2 MET 116 250.090 5.991 3.227 901 3HE MET 116 HE3 MET 116 250.936 6.129 4.768 902 H TRP 117 HN TRP 117 250.807 4.324 7.733 903 HA TRP 117 HA TRP 117 250.434 2.083 9.530 904 1HB TRP 117 HB2 TRP 117 249.884 1.908 6.671 905 2HB TRP 117 HB1 TRP 117 251.099 0.746 7.190 906 HD1 TRP 117 HD1 TRP 117 249.620 0.388 10.159 907 HE1 TRP 117 HE1 TRP 117 247.557 -1.146 10.237 908 HE3 TRP 117 HE3 TRP 117 248.397 0.418 5.195 909 HZ2 TRP 117 HZ2 TRP 117 245.660 -2.205 8.435 910 HZ3 TRP 117 HZ3 TRP 117 246.444 -0.883 4.455 911 HH2 TRP 117 HH2 TRP 117 245.105 -2.167 6.042 912 HA PRO 118 HA PRO 118 254.849 2.091 9.489 913 1HB PRO 118 HB2 PRO 118 255.451 -0.398 10.231 914 2HB PRO 118 HB1 PRO 118 254.562 0.689 11.305 915 1HG PRO 118 HG2 PRO 118 253.539 -1.539 9.596 916 2HG PRO 118 HG1 PRO 118 253.069 -1.084 11.241 917 1HD PRO 118 HD2 PRO 118 251.677 -0.403 8.948 918 2HD PRO 118 HD1 PRO 118 251.559 0.449 10.499 919 H ASP 119 HN ASP 119 253.377 1.013 6.876 920 HA ASP 119 HA ASP 119 255.876 0.043 5.674 921 1HB ASP 119 HB2 ASP 119 253.164 -1.049 4.926 922 2HB ASP 119 HB1 ASP 119 254.742 -1.639 4.413 923 H ASP 120 HN ASP 120 253.415 2.311 5.600 924 HA ASP 120 HA ASP 120 252.936 2.683 2.876 925 1HB ASP 120 HB2 ASP 120 252.740 4.431 5.281 926 2HB ASP 120 HB1 ASP 120 252.559 5.150 3.682 927 H SER 121 HN SER 121 255.454 4.079 4.931 928 HA SER 121 HA SER 121 256.560 5.830 3.042 929 1HB SER 121 HB2 SER 121 258.505 5.901 4.475 930 2HB SER 121 HB1 SER 121 257.065 5.824 5.490 931 HG SER 121 HG SER 121 258.340 4.303 6.343 932 H TYR 122 HN TYR 122 256.633 2.411 3.132 933 HA TYR 122 HA TYR 122 259.118 2.153 1.705 934 1HB TYR 122 HB2 TYR 122 257.055 0.252 2.742 935 2HB TYR 122 HB1 TYR 122 258.230 -0.302 1.554 936 HD1 TYR 122 HD1 TYR 122 260.674 -0.175 2.106 937 HD2 TYR 122 HD2 TYR 122 257.657 0.548 5.014 938 HE1 TYR 122 HE1 TYR 122 262.325 -0.520 3.894 939 HE2 TYR 122 HE2 TYR 122 259.298 0.205 6.812 940 HH TYR 122 HH TYR 122 261.411 -0.803 7.212 941 H TRP 123 HN TRP 123 255.661 2.034 0.901 942 HA TRP 123 HA TRP 123 256.448 1.505 -1.864 943 1HB TRP 123 HB2 TRP 123 254.122 0.886 -2.301 944 2HB TRP 123 HB1 TRP 123 254.814 -0.063 -0.994 945 HD1 TRP 123 HD1 TRP 123 253.904 0.465 1.506 946 HE1 TRP 123 HE1 TRP 123 251.639 1.406 2.295 947 HE3 TRP 123 HE3 TRP 123 252.290 2.510 -2.894 948 HZ2 TRP 123 HZ2 TRP 123 249.458 2.842 1.198 949 HZ3 TRP 123 HZ3 TRP 123 250.100 3.636 -2.934 950 HH2 TRP 123 HH2 TRP 123 248.721 3.787 -0.937 951 H PHE 124 HN PHE 124 255.679 4.113 0.033 952 HA PHE 124 HA PHE 124 254.066 5.592 -1.793 953 1HB PHE 124 HB2 PHE 124 255.350 6.057 0.803 954 2HB PHE 124 HB1 PHE 124 255.281 7.488 -0.218 955 HD1 PHE 124 HD1 PHE 124 253.001 4.657 0.640 956 HD2 PHE 124 HD2 PHE 124 253.494 8.860 0.190 957 HE1 PHE 124 HE1 PHE 124 250.657 5.004 1.297 958 HE2 PHE 124 HE2 PHE 124 251.159 9.211 0.845 959 HZ PHE 124 HZ PHE 124 249.734 7.285 1.403 960 HA PRO 125 HA PRO 125 258.334 7.889 -2.678 961 1HB PRO 125 HB2 PRO 125 260.452 6.084 -2.611 962 2HB PRO 125 HB1 PRO 125 260.094 7.304 -1.385 963 1HG PRO 125 HG2 PRO 125 259.439 4.396 -1.415 964 2HG PRO 125 HG1 PRO 125 259.932 5.424 -0.058 965 1HD PRO 125 HD2 PRO 125 257.389 4.674 -0.393 966 2HD PRO 125 HD1 PRO 125 257.797 6.285 0.225 967 H LEU 126 HN LEU 126 257.802 4.490 -3.539 968 HA LEU 126 HA LEU 126 258.974 4.862 -6.150 969 1HB LEU 126 HB2 LEU 126 258.015 2.560 -6.590 970 2HB LEU 126 HB1 LEU 126 259.242 2.683 -5.347 971 HG LEU 126 HG LEU 126 256.783 2.960 -4.010 972 1HD1 LEU 126 HD11 LEU 126 255.791 2.027 -6.118 973 2HD1 LEU 126 HD12 LEU 126 255.490 1.079 -4.662 974 3HD1 LEU 126 HD13 LEU 126 256.714 0.557 -5.817 975 1HD2 LEU 126 HD21 LEU 126 257.453 0.589 -3.243 976 2HD2 LEU 126 HD22 LEU 126 258.546 1.928 -2.902 977 3HD2 LEU 126 HD23 LEU 126 258.881 0.836 -4.245 978 H LEU 127 HN LEU 127 255.803 4.935 -4.711 979 HA LEU 127 HA LEU 127 254.210 4.780 -7.019 980 1HB LEU 127 HB2 LEU 127 253.843 6.265 -4.420 981 2HB LEU 127 HB1 LEU 127 252.613 6.220 -5.664 982 HG LEU 127 HG LEU 127 253.079 4.385 -3.567 983 1HD1 LEU 127 HD11 LEU 127 250.893 5.004 -4.152 984 2HD1 LEU 127 HD12 LEU 127 251.035 3.307 -4.613 985 3HD1 LEU 127 HD13 LEU 127 251.136 4.567 -5.844 986 1HD2 LEU 127 HD21 LEU 127 253.358 3.121 -6.291 987 2HD2 LEU 127 HD22 LEU 127 253.151 2.262 -4.765 988 3HD2 LEU 127 HD23 LEU 127 254.613 3.202 -5.056 989 H LEU 128 HN LEU 128 255.421 7.572 -5.233 990 HA LEU 128 HA LEU 128 254.590 9.572 -7.005 991 1HB LEU 128 HB2 LEU 128 256.583 9.354 -4.822 992 2HB LEU 128 HB1 LEU 128 256.785 10.697 -5.931 993 HG LEU 128 HG LEU 128 254.116 10.217 -4.668 994 1HD1 LEU 128 HD11 LEU 128 255.164 10.325 -2.664 995 2HD1 LEU 128 HD12 LEU 128 255.118 12.053 -3.011 996 3HD1 LEU 128 HD13 LEU 128 256.588 11.128 -3.325 997 1HD2 LEU 128 HD21 LEU 128 254.905 11.976 -6.529 998 2HD2 LEU 128 HD22 LEU 128 255.283 12.900 -5.074 999 3HD2 LEU 128 HD23 LEU 128 253.640 12.319 -5.350 1000 H GLN 129 HN GLN 129 257.371 7.468 -7.060 1001 HA GLN 129 HA GLN 129 258.777 8.947 -9.082 1002 1HB GLN 129 HB2 GLN 129 259.660 7.240 -7.271 1003 2HB GLN 129 HB1 GLN 129 259.335 6.064 -8.538 1004 1HG GLN 129 HG2 GLN 129 261.604 6.662 -8.739 1005 2HG GLN 129 HG1 GLN 129 260.758 7.465 -10.060 1006 1HE2 GLN 129 HE21 GLN 129 260.423 9.710 -9.952 1007 2HE2 GLN 129 HE22 GLN 129 261.389 10.716 -8.932 1008 H LYS 130 HN LYS 130 256.103 6.903 -9.140 1009 HA LYS 130 HA LYS 130 254.873 6.031 -10.842 1010 1HB LYS 130 HB2 LYS 130 256.879 7.237 -12.748 1011 2HB LYS 130 HB1 LYS 130 255.211 6.792 -13.086 1012 1HG LYS 130 HG2 LYS 130 254.385 8.698 -12.220 1013 2HG LYS 130 HG1 LYS 130 255.591 8.764 -10.934 1014 1HD LYS 130 HD2 LYS 130 256.449 9.235 -13.752 1015 2HD LYS 130 HD1 LYS 130 255.605 10.521 -12.888 1016 1HE LYS 130 HE2 LYS 130 257.416 9.775 -11.026 1017 2HE LYS 130 HE1 LYS 130 258.316 9.436 -12.504 1018 1HZ LYS 130 HZ1 LYS 130 258.384 11.623 -13.077 1019 2HZ LYS 130 HZ2 LYS 130 258.358 11.796 -11.394 1020 3HZ LYS 130 HZ3 LYS 130 256.938 12.010 -12.288 1021 H LYS 131 HN LYS 131 256.450 4.280 -9.626 1022 HA LYS 131 HA LYS 131 257.369 2.562 -11.824 1023 1HB LYS 131 HB2 LYS 131 258.832 3.170 -9.258 1024 2HB LYS 131 HB1 LYS 131 259.178 1.741 -10.222 1025 1HG LYS 131 HG2 LYS 131 260.037 2.982 -11.986 1026 2HG LYS 131 HG1 LYS 131 259.247 4.467 -11.451 1027 1HD LYS 131 HD2 LYS 131 261.371 4.911 -10.750 1028 2HD LYS 131 HD1 LYS 131 260.772 4.067 -9.320 1029 1HE LYS 131 HE2 LYS 131 262.085 2.264 -9.671 1030 2HE LYS 131 HE1 LYS 131 261.920 2.355 -11.424 1031 1HZ LYS 131 HZ1 LYS 131 263.454 4.480 -10.161 1032 2HZ LYS 131 HZ2 LYS 131 263.729 3.664 -11.616 1033 3HZ LYS 131 HZ3 LYS 131 264.163 2.943 -10.149 1034 H LYS 132 HN LYS 132 257.393 0.261 -11.273 1035 HA LYS 132 HA LYS 132 255.269 -0.359 -9.342 1036 1HB LYS 132 HB2 LYS 132 256.262 -1.783 -11.804 1037 2HB LYS 132 HB1 LYS 132 255.233 -2.582 -10.623 1038 1HG LYS 132 HG2 LYS 132 253.542 -0.797 -10.969 1039 2HG LYS 132 HG1 LYS 132 254.559 -0.147 -12.257 1040 1HD LYS 132 HD2 LYS 132 254.007 -1.795 -13.702 1041 2HD LYS 132 HD1 LYS 132 253.960 -3.026 -12.439 1042 1HE LYS 132 HE2 LYS 132 251.741 -2.815 -13.199 1043 2HE LYS 132 HE1 LYS 132 251.801 -1.949 -11.664 1044 1HZ LYS 132 HZ1 LYS 132 250.754 -0.927 -13.876 1045 2HZ LYS 132 HZ2 LYS 132 252.342 -0.372 -14.045 1046 3HZ LYS 132 HZ3 LYS 132 251.452 0.024 -12.663 1047 H PHE 133 HN PHE 133 255.608 -1.705 -7.648 1048 HA PHE 133 HA PHE 133 258.028 -3.309 -7.525 1049 1HB PHE 133 HB2 PHE 133 259.167 -2.065 -6.045 1050 2HB PHE 133 HB1 PHE 133 258.048 -0.763 -6.421 1051 HD1 PHE 133 HD1 PHE 133 255.702 -1.062 -5.066 1052 HD2 PHE 133 HD2 PHE 133 259.528 -2.450 -3.823 1053 HE1 PHE 133 HE1 PHE 133 254.940 -1.051 -2.728 1054 HE2 PHE 133 HE2 PHE 133 258.772 -2.441 -1.481 1055 HZ PHE 133 HZ PHE 133 256.477 -1.741 -0.931 1056 H HIS 134 HN HIS 134 258.096 -4.530 -5.382 1057 HA HIS 134 HA HIS 134 255.440 -5.078 -4.288 1058 1HB HIS 134 HB2 HIS 134 257.275 -7.322 -5.143 1059 2HB HIS 134 HB1 HIS 134 255.604 -7.440 -4.602 1060 HD1 HIS 134 HD1 HIS 134 253.895 -6.015 -6.328 1061 HD2 HIS 134 HD2 HIS 134 257.480 -7.489 -7.825 1062 HE1 HIS 134 HE1 HIS 134 253.598 -6.096 -8.824 1063 HE2 HIS 134 HE2 HIS 134 255.748 -7.076 -9.700 1064 H GLY 135 HN GLY 135 255.560 -5.102 -2.109 1065 1HA GLY 135 HA2 GLY 135 258.222 -5.632 -0.937 1066 2HA GLY 135 HA1 GLY 135 257.095 -4.455 -0.286 1067 H TYR 136 HN TYR 136 258.432 -6.974 0.748 1068 HA TYR 136 HA TYR 136 255.987 -8.246 1.784 1069 1HB TYR 136 HB2 TYR 136 258.652 -9.474 1.081 1070 2HB TYR 136 HB1 TYR 136 257.504 -10.277 2.147 1071 HD1 TYR 136 HD1 TYR 136 256.284 -11.935 1.125 1072 HD2 TYR 136 HD2 TYR 136 257.337 -8.491 -1.140 1073 HE1 TYR 136 HE1 TYR 136 255.122 -12.872 -0.830 1074 HE2 TYR 136 HE2 TYR 136 256.177 -9.417 -3.100 1075 HH TYR 136 HH TYR 136 254.215 -11.135 -3.437 1076 H PHE 137 HN PHE 137 255.690 -7.535 3.794 1077 HA PHE 137 HA PHE 137 258.058 -7.086 5.487 1078 1HB PHE 137 HB2 PHE 137 255.278 -5.980 5.898 1079 2HB PHE 137 HB1 PHE 137 256.752 -5.506 6.736 1080 HD1 PHE 137 HD1 PHE 137 258.149 -3.841 5.872 1081 HD2 PHE 137 HD2 PHE 137 255.070 -5.485 3.439 1082 HE1 PHE 137 HE1 PHE 137 258.549 -2.092 4.191 1083 HE2 PHE 137 HE2 PHE 137 255.463 -3.737 1.753 1084 HZ PHE 137 HZ PHE 137 257.206 -2.037 2.127 1085 H LYS 138 HN LYS 138 258.309 -8.191 7.340 1086 HA LYS 138 HA LYS 138 256.398 -10.282 7.987 1087 1HB LYS 138 HB2 LYS 138 259.222 -9.922 8.276 1088 2HB LYS 138 HB1 LYS 138 258.528 -10.233 9.859 1089 1HG LYS 138 HG2 LYS 138 257.722 -11.982 7.599 1090 2HG LYS 138 HG1 LYS 138 259.335 -12.182 8.283 1091 1HD LYS 138 HD2 LYS 138 258.515 -12.807 10.360 1092 2HD LYS 138 HD1 LYS 138 256.944 -12.055 10.076 1093 1HE LYS 138 HE2 LYS 138 257.018 -14.591 10.018 1094 2HE LYS 138 HE1 LYS 138 256.255 -13.791 8.645 1095 1HZ LYS 138 HZ1 LYS 138 259.045 -14.808 8.699 1096 2HZ LYS 138 HZ2 LYS 138 258.277 -14.086 7.376 1097 3HZ LYS 138 HZ3 LYS 138 257.738 -15.582 7.955 1098 H PHE 139 HN PHE 139 254.822 -9.906 9.433 1099 HA PHE 139 HA PHE 139 255.152 -7.616 11.242 1100 1HB PHE 139 HB2 PHE 139 252.886 -8.824 9.808 1101 2HB PHE 139 HB1 PHE 139 252.524 -8.358 11.468 1102 HD1 PHE 139 HD1 PHE 139 253.846 -7.100 8.250 1103 HD2 PHE 139 HD2 PHE 139 252.147 -6.119 12.025 1104 HE1 PHE 139 HE1 PHE 139 253.564 -4.770 7.514 1105 HE2 PHE 139 HE2 PHE 139 251.861 -3.787 11.294 1106 HZ PHE 139 HZ PHE 139 252.567 -3.112 9.036 1107 H GLN 140 HN GLN 140 254.833 -7.761 13.421 1108 HA GLN 140 HA GLN 140 255.259 -10.364 14.600 1109 1HB GLN 140 HB2 GLN 140 256.571 -8.724 15.607 1110 2HB GLN 140 HB1 GLN 140 255.284 -7.534 15.578 1111 1HG GLN 140 HG2 GLN 140 255.777 -8.243 17.841 1112 2HG GLN 140 HG1 GLN 140 254.141 -8.704 17.377 1113 1HE2 GLN 140 HE21 GLN 140 255.807 -9.811 19.465 1114 2HE2 GLN 140 HE22 GLN 140 255.998 -11.490 19.106 1115 H GLY 141 HN GLY 141 252.560 -8.751 13.605 1116 1HA GLY 141 HA2 GLY 141 250.747 -10.499 14.807 1117 2HA GLY 141 HA1 GLY 141 250.783 -9.036 15.779 1118 H GLN 142 HN GLN 142 251.054 -7.075 13.875 1119 HA GLN 142 HA GLN 142 249.502 -7.227 11.594 1120 1HB GLN 142 HB2 GLN 142 247.877 -7.474 13.874 1121 2HB GLN 142 HB1 GLN 142 247.627 -5.835 13.291 1122 1HG GLN 142 HG2 GLN 142 247.590 -7.876 11.196 1123 2HG GLN 142 HG1 GLN 142 246.311 -8.037 12.398 1124 1HE2 GLN 142 HE21 GLN 142 244.896 -6.242 12.730 1125 2HE2 GLN 142 HE22 GLN 142 244.612 -5.108 11.458 1126 H ASP 143 HN ASP 143 250.551 -5.314 14.328 1127 HA ASP 143 HA ASP 143 250.613 -2.939 12.582 1128 1HB ASP 143 HB2 ASP 143 250.605 -2.914 15.601 1129 2HB ASP 143 HB1 ASP 143 250.374 -1.548 14.514 1130 H THR 144 HN THR 144 252.471 -5.058 14.613 1131 HA THR 144 HA THR 144 254.781 -3.283 14.554 1132 HB THR 144 HB THR 144 254.260 -5.933 15.888 1133 HG1 THR 144 HG1 THR 144 254.010 -4.745 17.605 1134 1HG2 THR 144 HG21 THR 144 256.568 -6.004 15.194 1135 2HG2 THR 144 HG22 THR 144 256.468 -5.737 16.934 1136 3HG2 THR 144 HG23 THR 144 256.844 -4.393 15.855 1137 H ILE 145 HN ILE 145 256.533 -3.547 13.288 1138 HA ILE 145 HA ILE 145 256.489 -5.838 11.450 1139 HB ILE 145 HB ILE 145 257.892 -3.203 11.014 1140 1HG1 ILE 145 HG12 ILE 145 255.332 -4.258 9.788 1141 2HG1 ILE 145 HG11 ILE 145 255.441 -2.949 10.962 1142 1HG2 ILE 145 HG21 ILE 145 257.910 -4.163 8.615 1143 2HG2 ILE 145 HG22 ILE 145 257.618 -5.715 9.400 1144 3HG2 ILE 145 HG23 ILE 145 259.070 -4.793 9.785 1145 1HD1 ILE 145 HD11 ILE 145 255.148 -2.082 8.722 1146 2HD1 ILE 145 HD12 ILE 145 256.591 -2.937 8.183 1147 3HD1 ILE 145 HD13 ILE 145 256.728 -1.630 9.357 1148 H LEU 146 HN LEU 146 258.311 -7.033 11.116 1149 HA LEU 146 HA LEU 146 260.603 -6.450 12.866 1150 1HB LEU 146 HB2 LEU 146 259.731 -9.244 12.200 1151 2HB LEU 146 HB1 LEU 146 260.796 -8.706 13.486 1152 HG LEU 146 HG LEU 146 257.870 -7.995 13.432 1153 1HD1 LEU 146 HD11 LEU 146 257.250 -9.982 14.218 1154 2HD1 LEU 146 HD12 LEU 146 258.636 -10.081 15.304 1155 3HD1 LEU 146 HD13 LEU 146 258.798 -10.578 13.619 1156 1HD2 LEU 146 HD21 LEU 146 259.730 -6.843 14.880 1157 2HD2 LEU 146 HD22 LEU 146 259.550 -8.288 15.875 1158 3HD2 LEU 146 HD23 LEU 146 258.160 -7.244 15.579 1159 H ASP 147 HN ASP 147 259.477 -7.152 9.726 1160 HA ASP 147 HA ASP 147 262.171 -7.059 8.699 1161 1HB ASP 147 HB2 ASP 147 260.967 -9.565 9.090 1162 2HB ASP 147 HB1 ASP 147 260.821 -9.245 7.364 1163 H TYR 148 HN TYR 148 262.271 -6.237 6.615 1164 HA TYR 148 HA TYR 148 259.745 -5.959 5.173 1165 1HB TYR 148 HB2 TYR 148 260.065 -3.603 4.765 1166 2HB TYR 148 HB1 TYR 148 260.042 -3.904 6.499 1167 HD1 TYR 148 HD1 TYR 148 261.906 -3.353 7.861 1168 HD2 TYR 148 HD2 TYR 148 262.253 -3.163 3.625 1169 HE1 TYR 148 HE1 TYR 148 264.063 -2.194 8.095 1170 HE2 TYR 148 HE2 TYR 148 264.411 -2.004 3.847 1171 HH TYR 148 HH TYR 148 265.448 -0.439 5.977 1172 H THR 149 HN THR 149 259.914 -6.279 3.038 1173 HA THR 149 HA THR 149 262.593 -6.114 1.828 1174 HB THR 149 HB THR 149 261.197 -8.028 0.350 1175 HG1 THR 149 HG1 THR 149 260.976 -8.568 3.124 1176 1HG2 THR 149 HG21 THR 149 263.650 -7.831 1.695 1177 2HG2 THR 149 HG22 THR 149 263.148 -9.038 0.513 1178 3HG2 THR 149 HG23 THR 149 262.891 -9.329 2.234 1179 H LEU 150 HN LEU 150 262.682 -5.404 -0.292 1180 HA LEU 150 HA LEU 150 260.167 -4.504 -1.496 1181 1HB LEU 150 HB2 LEU 150 262.649 -2.845 -1.087 1182 2HB LEU 150 HB1 LEU 150 261.362 -2.398 -2.191 1183 HG LEU 150 HG LEU 150 259.951 -2.800 0.100 1184 1HD1 LEU 150 HD11 LEU 150 262.246 -1.257 1.152 1185 2HD1 LEU 150 HD12 LEU 150 262.404 -3.013 1.101 1186 3HD1 LEU 150 HD13 LEU 150 261.075 -2.273 1.994 1187 1HD2 LEU 150 HD21 LEU 150 261.201 -0.129 -0.306 1188 2HD2 LEU 150 HD22 LEU 150 259.519 -0.554 0.007 1189 3HD2 LEU 150 HD23 LEU 150 260.207 -0.805 -1.596 1190 H ARG 151 HN ARG 151 259.970 -5.102 -3.530 1191 HA ARG 151 HA ARG 151 262.406 -5.696 -5.080 1192 1HB ARG 151 HB2 ARG 151 259.749 -7.117 -5.327 1193 2HB ARG 151 HB1 ARG 151 261.235 -7.509 -6.179 1194 1HG ARG 151 HG2 ARG 151 261.262 -7.538 -3.207 1195 2HG ARG 151 HG1 ARG 151 260.466 -8.862 -4.062 1196 1HD ARG 151 HD2 ARG 151 262.705 -8.825 -5.464 1197 2HD ARG 151 HD1 ARG 151 263.339 -8.089 -3.992 1198 HE ARG 151 HE ARG 151 263.243 -10.135 -2.989 1199 1HH1 ARG 151 HH11 ARG 151 261.151 -10.180 -5.782 1200 2HH1 ARG 151 HH12 ARG 151 260.803 -11.871 -5.649 1201 1HH2 ARG 151 HH21 ARG 151 262.786 -12.359 -2.812 1202 2HH2 ARG 151 HH22 ARG 151 261.730 -13.108 -3.963 1203 H GLU 152 HN GLU 152 262.389 -5.151 -7.278 1204 HA GLU 152 HA GLU 152 260.300 -3.215 -8.009 1205 1HB GLU 152 HB2 GLU 152 261.995 -2.402 -9.682 1206 2HB GLU 152 HB1 GLU 152 262.446 -2.179 -7.997 1207 1HG GLU 152 HG2 GLU 152 263.898 -4.116 -8.101 1208 2HG GLU 152 HG1 GLU 152 263.408 -4.415 -9.768 1209 H VAL 153 HN VAL 153 259.333 -3.271 -10.044 1210 HA VAL 153 HA VAL 153 259.950 -5.494 -11.824 1211 HB VAL 153 HB VAL 153 257.584 -6.206 -11.949 1212 1HG1 VAL 153 HG11 VAL 153 257.639 -7.609 -10.050 1213 2HG1 VAL 153 HG12 VAL 153 258.576 -6.441 -9.120 1214 3HG1 VAL 153 HG13 VAL 153 259.323 -7.298 -10.467 1215 1HG2 VAL 153 HG21 VAL 153 256.955 -4.935 -9.352 1216 2HG2 VAL 153 HG22 VAL 153 255.902 -5.316 -10.713 1217 3HG2 VAL 153 HG23 VAL 153 256.942 -3.892 -10.774 1218 H ASP 154 HN ASP 154 259.192 -5.216 -13.942 1219 HA ASP 154 HA ASP 154 257.839 -2.681 -14.535 1220 1HB ASP 154 HB2 ASP 154 259.427 -2.434 -16.510 1221 2HB ASP 154 HB1 ASP 154 260.109 -2.107 -14.919 1222 H THR 155 HN THR 155 256.896 -5.425 -14.488 1223 HA THR 155 HA THR 155 256.472 -5.978 -17.339 1224 HB THR 155 HB THR 155 255.468 -7.827 -15.233 1225 HG1 THR 155 HG1 THR 155 258.196 -7.380 -15.808 1226 1HG2 THR 155 HG21 THR 155 255.816 -9.493 -16.758 1227 2HG2 THR 155 HG22 THR 155 257.116 -8.626 -17.576 1228 3HG2 THR 155 HG23 THR 155 255.438 -8.138 -17.821 1229 H VAL 156 HN VAL 156 254.738 -5.012 -18.157 1230 HA VAL 156 HA VAL 156 252.195 -5.248 -16.728 1231 HB VAL 156 HB VAL 156 253.063 -2.639 -17.973 1232 1HG1 VAL 156 HG11 VAL 156 250.753 -3.198 -16.125 1233 2HG1 VAL 156 HG12 VAL 156 250.615 -3.205 -17.883 1234 3HG1 VAL 156 HG13 VAL 156 251.077 -1.726 -17.040 1235 1HG2 VAL 156 HG21 VAL 156 254.416 -3.131 -15.985 1236 2HG2 VAL 156 HG22 VAL 156 252.941 -3.364 -15.046 1237 3HG2 VAL 156 HG23 VAL 156 253.321 -1.777 -15.713 Start of MODEL 11 1 1H MET 1 HT1 MET 1 240.295 -24.951 0.218 2 2H MET 1 HT2 MET 1 239.853 -23.879 1.484 3 3H MET 1 HT3 MET 1 239.860 -25.574 1.755 4 HA MET 1 HA MET 1 241.767 -24.849 2.747 5 1HB MET 1 HB2 MET 1 242.262 -25.835 -0.060 6 2HB MET 1 HB1 MET 1 243.561 -25.648 1.110 7 1HG MET 1 HG2 MET 1 242.812 -27.378 2.425 8 2HG MET 1 HG1 MET 1 241.156 -27.250 1.836 9 1HE MET 1 HE1 MET 1 241.191 -30.334 1.172 10 2HE MET 1 HE2 MET 1 242.287 -29.723 2.413 11 3HE MET 1 HE3 MET 1 242.904 -30.756 1.122 12 H GLY 2 HN GLY 2 243.916 -23.732 2.498 13 1HA GLY 2 HA2 GLY 2 244.992 -21.993 0.946 14 2HA GLY 2 HA1 GLY 2 243.474 -21.137 1.172 15 H ALA 3 HN ALA 3 245.965 -20.036 1.815 16 HA ALA 3 HA ALA 3 245.493 -19.330 4.558 17 1HB ALA 3 HB1 ALA 3 247.793 -19.931 5.321 18 2HB ALA 3 HB2 ALA 3 247.987 -20.858 3.833 19 3HB ALA 3 HB3 ALA 3 246.747 -21.316 5.001 20 H SER 4 HN SER 4 245.189 -17.368 3.242 21 HA SER 4 HA SER 4 247.368 -15.618 3.470 22 1HB SER 4 HB2 SER 4 248.481 -16.325 1.599 23 2HB SER 4 HB1 SER 4 247.017 -16.929 0.827 24 HG SER 4 HG SER 4 247.401 -15.154 -0.317 25 H ARG 5 HN ARG 5 245.943 -14.302 4.437 26 HA ARG 5 HA ARG 5 243.412 -13.602 3.446 27 1HB ARG 5 HB2 ARG 5 245.294 -12.238 5.368 28 2HB ARG 5 HB1 ARG 5 243.713 -11.577 4.975 29 1HG ARG 5 HG2 ARG 5 244.119 -14.348 6.068 30 2HG ARG 5 HG1 ARG 5 243.829 -12.931 7.080 31 1HD ARG 5 HD2 ARG 5 241.660 -12.675 6.330 32 2HD ARG 5 HD1 ARG 5 241.968 -13.542 4.826 33 HE ARG 5 HE ARG 5 241.184 -14.670 7.350 34 1HH1 ARG 5 HH11 ARG 5 242.753 -15.301 4.297 35 2HH1 ARG 5 HH12 ARG 5 242.452 -17.006 4.353 36 1HH2 ARG 5 HH21 ARG 5 240.789 -16.911 7.427 37 2HH2 ARG 5 HH22 ARG 5 241.338 -17.920 6.129 38 H LEU 6 HN LEU 6 243.447 -13.015 1.327 39 HA LEU 6 HA LEU 6 245.261 -10.948 0.412 40 1HB LEU 6 HB2 LEU 6 244.311 -13.045 -0.887 41 2HB LEU 6 HB1 LEU 6 242.997 -11.946 -1.256 42 HG LEU 6 HG LEU 6 245.835 -11.145 -1.809 43 1HD1 LEU 6 HD11 LEU 6 245.734 -12.096 -3.992 44 2HD1 LEU 6 HD12 LEU 6 244.078 -12.646 -3.738 45 3HD1 LEU 6 HD13 LEU 6 245.400 -13.380 -2.830 46 1HD2 LEU 6 HD21 LEU 6 243.629 -9.676 -1.940 47 2HD2 LEU 6 HD22 LEU 6 243.505 -10.451 -3.517 48 3HD2 LEU 6 HD23 LEU 6 244.934 -9.502 -3.111 49 H TYR 7 HN TYR 7 244.855 -8.894 0.640 50 HA TYR 7 HA TYR 7 242.066 -7.956 0.653 51 1HB TYR 7 HB2 TYR 7 244.393 -6.856 2.244 52 2HB TYR 7 HB1 TYR 7 242.769 -6.180 2.215 53 HD1 TYR 7 HD1 TYR 7 244.382 -7.162 4.642 54 HD2 TYR 7 HD2 TYR 7 241.432 -9.026 2.206 55 HE1 TYR 7 HE1 TYR 7 243.750 -8.612 6.524 56 HE2 TYR 7 HE2 TYR 7 240.792 -10.480 4.082 57 HH TYR 7 HH TYR 7 240.922 -10.541 6.491 58 H THR 8 HN THR 8 242.215 -5.372 0.433 59 HA THR 8 HA THR 8 243.923 -4.818 -1.913 60 HB THR 8 HB THR 8 242.126 -3.659 -2.956 61 HG1 THR 8 HG1 THR 8 241.124 -2.614 -1.324 62 1HG2 THR 8 HG21 THR 8 240.178 -5.354 -2.791 63 2HG2 THR 8 HG22 THR 8 241.314 -6.296 -1.827 64 3HG2 THR 8 HG23 THR 8 241.715 -5.859 -3.487 65 H LEU 9 HN LEU 9 244.163 -2.460 -2.339 66 HA LEU 9 HA LEU 9 243.831 -0.685 -0.073 67 1HB LEU 9 HB2 LEU 9 246.021 -2.014 0.190 68 2HB LEU 9 HB1 LEU 9 246.600 -1.085 -1.179 69 HG LEU 9 HG LEU 9 245.729 0.021 1.479 70 1HD1 LEU 9 HD11 LEU 9 247.891 -1.093 1.550 71 2HD1 LEU 9 HD12 LEU 9 248.071 0.654 1.721 72 3HD1 LEU 9 HD13 LEU 9 248.440 -0.125 0.182 73 1HD2 LEU 9 HD21 LEU 9 245.122 1.664 -0.069 74 2HD2 LEU 9 HD22 LEU 9 246.540 1.362 -1.074 75 3HD2 LEU 9 HD23 LEU 9 246.721 2.152 0.493 76 H VAL 10 HN VAL 10 242.852 0.959 -1.147 77 HA VAL 10 HA VAL 10 243.981 1.773 -3.724 78 HB VAL 10 HB VAL 10 241.749 1.286 -4.100 79 1HG1 VAL 10 HG11 VAL 10 240.681 0.826 -2.202 80 2HG1 VAL 10 HG12 VAL 10 240.000 2.422 -2.496 81 3HG1 VAL 10 HG13 VAL 10 241.336 2.232 -1.365 82 1HG2 VAL 10 HG21 VAL 10 241.405 4.177 -3.432 83 2HG2 VAL 10 HG22 VAL 10 240.773 3.275 -4.808 84 3HG2 VAL 10 HG23 VAL 10 242.488 3.672 -4.728 85 H LEU 11 HN LEU 11 245.038 3.551 -3.890 86 HA LEU 11 HA LEU 11 244.588 5.713 -1.950 87 1HB LEU 11 HB2 LEU 11 246.957 4.180 -2.445 88 2HB LEU 11 HB1 LEU 11 247.244 5.837 -2.940 89 HG LEU 11 HG LEU 11 246.633 4.770 -0.200 90 1HD1 LEU 11 HD11 LEU 11 248.726 5.377 0.308 91 2HD1 LEU 11 HD12 LEU 11 248.572 6.933 -0.505 92 3HD1 LEU 11 HD13 LEU 11 248.979 5.489 -1.434 93 1HD2 LEU 11 HD21 LEU 11 246.579 7.302 0.406 94 2HD2 LEU 11 HD22 LEU 11 245.111 6.481 -0.122 95 3HD2 LEU 11 HD23 LEU 11 246.015 7.485 -1.255 96 H VAL 12 HN VAL 12 243.703 7.347 -3.055 97 HA VAL 12 HA VAL 12 244.093 7.570 -5.900 98 HB VAL 12 HB VAL 12 242.620 9.492 -4.105 99 1HG1 VAL 12 HG11 VAL 12 241.332 9.927 -6.189 100 2HG1 VAL 12 HG12 VAL 12 242.478 8.907 -7.059 101 3HG1 VAL 12 HG13 VAL 12 243.029 10.396 -6.293 102 1HG2 VAL 12 HG21 VAL 12 241.337 7.704 -3.627 103 2HG2 VAL 12 HG22 VAL 12 241.965 6.765 -4.980 104 3HG2 VAL 12 HG23 VAL 12 240.695 7.958 -5.250 105 H LEU 13 HN LEU 13 246.408 7.898 -5.753 106 HA LEU 13 HA LEU 13 247.220 10.607 -4.965 107 1HB LEU 13 HB2 LEU 13 248.416 8.548 -4.110 108 2HB LEU 13 HB1 LEU 13 249.013 8.337 -5.743 109 HG LEU 13 HG LEU 13 250.725 9.628 -5.223 110 1HD1 LEU 13 HD11 LEU 13 249.695 11.436 -6.292 111 2HD1 LEU 13 HD12 LEU 13 250.352 12.081 -4.791 112 3HD1 LEU 13 HD13 LEU 13 248.631 11.744 -4.922 113 1HD2 LEU 13 HD21 LEU 13 250.342 11.018 -2.890 114 2HD2 LEU 13 HD22 LEU 13 251.047 9.409 -3.034 115 3HD2 LEU 13 HD23 LEU 13 249.330 9.588 -2.681 116 H GLN 14 HN GLN 14 247.305 12.073 -6.507 117 HA GLN 14 HA GLN 14 247.725 11.216 -9.286 118 1HB GLN 14 HB2 GLN 14 246.228 13.455 -8.015 119 2HB GLN 14 HB1 GLN 14 246.962 13.761 -9.583 120 1HG GLN 14 HG2 GLN 14 245.710 12.002 -10.594 121 2HG GLN 14 HG1 GLN 14 245.116 11.454 -9.027 122 1HE2 GLN 14 HE21 GLN 14 243.024 11.677 -10.099 123 2HE2 GLN 14 HE22 GLN 14 242.250 13.222 -10.100 124 HA PRO 15 HA PRO 15 251.689 13.127 -9.508 125 1HB PRO 15 HB2 PRO 15 251.631 14.343 -11.951 126 2HB PRO 15 HB1 PRO 15 251.825 12.601 -11.727 127 1HG PRO 15 HG2 PRO 15 249.361 14.163 -12.390 128 2HG PRO 15 HG1 PRO 15 249.932 12.629 -13.072 129 1HD PRO 15 HD2 PRO 15 247.989 12.724 -11.210 130 2HD PRO 15 HD1 PRO 15 249.170 11.400 -11.266 131 H GLN 16 HN GLN 16 249.521 14.737 -8.253 132 HA GLN 16 HA GLN 16 250.896 17.241 -8.215 133 1HB GLN 16 HB2 GLN 16 248.718 18.519 -8.712 134 2HB GLN 16 HB1 GLN 16 249.614 17.864 -10.075 135 1HG GLN 16 HG2 GLN 16 248.089 16.040 -10.290 136 2HG GLN 16 HG1 GLN 16 247.270 16.484 -8.795 137 1HE2 GLN 16 HE21 GLN 16 245.752 18.072 -8.813 138 2HE2 GLN 16 HE22 GLN 16 245.195 18.852 -10.251 139 H ARG 17 HN ARG 17 248.016 15.405 -7.301 140 HA ARG 17 HA ARG 17 248.368 16.330 -4.553 141 1HB ARG 17 HB2 ARG 17 245.857 16.606 -4.371 142 2HB ARG 17 HB1 ARG 17 246.698 17.844 -5.294 143 1HG ARG 17 HG2 ARG 17 245.094 17.487 -6.810 144 2HG ARG 17 HG1 ARG 17 246.061 16.079 -7.251 145 1HD ARG 17 HD2 ARG 17 244.725 14.647 -5.874 146 2HD ARG 17 HD1 ARG 17 243.861 16.026 -5.194 147 HE ARG 17 HE ARG 17 243.326 16.248 -7.819 148 1HH1 ARG 17 HH11 ARG 17 243.098 13.559 -5.603 149 2HH1 ARG 17 HH12 ARG 17 241.787 12.811 -6.451 150 1HH2 ARG 17 HH21 ARG 17 241.601 15.267 -8.931 151 2HH2 ARG 17 HH22 ARG 17 240.936 13.780 -8.339 152 H VAL 18 HN VAL 18 247.157 15.007 -2.983 153 HA VAL 18 HA VAL 18 246.526 12.307 -3.986 154 HB VAL 18 HB VAL 18 248.719 12.100 -3.068 155 1HG1 VAL 18 HG11 VAL 18 247.787 13.269 -0.463 156 2HG1 VAL 18 HG12 VAL 18 248.523 14.252 -1.728 157 3HG1 VAL 18 HG13 VAL 18 249.437 12.936 -0.990 158 1HG2 VAL 18 HG21 VAL 18 248.364 10.533 -1.235 159 2HG2 VAL 18 HG22 VAL 18 247.155 10.306 -2.498 160 3HG2 VAL 18 HG23 VAL 18 246.728 11.151 -1.010 161 H LEU 19 HN LEU 19 245.091 11.091 -2.639 162 HA LEU 19 HA LEU 19 243.535 12.742 -0.761 163 1HB LEU 19 HB2 LEU 19 242.407 12.217 -2.966 164 2HB LEU 19 HB1 LEU 19 242.419 10.533 -2.482 165 HG LEU 19 HG LEU 19 240.835 10.871 -0.797 166 1HD1 LEU 19 HD11 LEU 19 241.574 13.776 -0.961 167 2HD1 LEU 19 HD12 LEU 19 241.682 12.690 0.424 168 3HD1 LEU 19 HD13 LEU 19 240.104 13.222 -0.159 169 1HD2 LEU 19 HD21 LEU 19 239.824 11.014 -2.984 170 2HD2 LEU 19 HD22 LEU 19 240.144 12.747 -3.049 171 3HD2 LEU 19 HD23 LEU 19 238.996 12.107 -1.874 172 H LEU 20 HN LEU 20 243.791 12.031 1.239 173 HA LEU 20 HA LEU 20 244.213 9.148 1.667 174 1HB LEU 20 HB2 LEU 20 245.524 11.519 2.711 175 2HB LEU 20 HB1 LEU 20 244.960 10.471 3.997 176 HG LEU 20 HG LEU 20 246.654 9.464 1.721 177 1HD1 LEU 20 HD11 LEU 20 247.694 11.344 3.120 178 2HD1 LEU 20 HD12 LEU 20 248.602 9.842 2.947 179 3HD1 LEU 20 HD13 LEU 20 247.713 10.169 4.435 180 1HD2 LEU 20 HD21 LEU 20 246.743 7.495 2.831 181 2HD2 LEU 20 HD22 LEU 20 245.199 8.053 3.474 182 3HD2 LEU 20 HD23 LEU 20 246.674 8.260 4.418 183 H GLY 21 HN GLY 21 242.969 8.054 3.114 184 1HA GLY 21 HA2 GLY 21 240.581 9.458 4.063 185 2HA GLY 21 HA1 GLY 21 240.781 7.716 3.947 186 H MET 22 HN MET 22 240.368 10.084 6.100 187 HA MET 22 HA MET 22 242.070 8.803 8.131 188 1HB MET 22 HB2 MET 22 242.690 11.099 7.942 189 2HB MET 22 HB1 MET 22 241.011 11.620 7.944 190 1HG MET 22 HG2 MET 22 240.760 11.114 10.243 191 2HG MET 22 HG1 MET 22 242.296 10.250 10.289 192 1HE MET 22 HE1 MET 22 244.787 11.727 10.708 193 2HE MET 22 HE2 MET 22 244.817 13.130 9.643 194 3HE MET 22 HE3 MET 22 244.291 11.566 9.024 195 H LYS 23 HN LYS 23 241.139 8.107 10.058 196 HA LYS 23 HA LYS 23 238.246 7.817 9.979 197 1HB LYS 23 HB2 LYS 23 240.477 6.394 11.232 198 2HB LYS 23 HB1 LYS 23 239.104 6.606 12.308 199 1HG LYS 23 HG2 LYS 23 237.803 5.755 10.141 200 2HG LYS 23 HG1 LYS 23 239.364 4.982 9.854 201 1HD LYS 23 HD2 LYS 23 238.038 3.433 11.076 202 2HD LYS 23 HD1 LYS 23 239.232 4.085 12.201 203 1HE LYS 23 HE2 LYS 23 237.661 5.012 13.499 204 2HE LYS 23 HE1 LYS 23 236.757 5.628 12.116 205 1HZ LYS 23 HZ1 LYS 23 235.520 3.981 13.443 206 2HZ LYS 23 HZ2 LYS 23 236.675 2.811 13.049 207 3HZ LYS 23 HZ3 LYS 23 235.723 3.501 11.834 208 H LYS 24 HN LYS 24 236.864 8.567 11.621 209 HA LYS 24 HA LYS 24 237.907 10.908 12.985 210 1HB LYS 24 HB2 LYS 24 235.199 9.920 12.251 211 2HB LYS 24 HB1 LYS 24 235.323 10.971 13.654 212 1HG LYS 24 HG2 LYS 24 235.604 12.782 12.399 213 2HG LYS 24 HG1 LYS 24 236.815 11.992 11.388 214 1HD LYS 24 HD2 LYS 24 235.245 11.214 9.884 215 2HD LYS 24 HD1 LYS 24 233.934 11.278 11.063 216 1HE LYS 24 HE2 LYS 24 233.527 13.484 10.696 217 2HE LYS 24 HE1 LYS 24 235.214 13.847 10.338 218 1HZ LYS 24 HZ1 LYS 24 233.078 13.027 8.554 219 2HZ LYS 24 HZ2 LYS 24 234.580 12.309 8.259 220 3HZ LYS 24 HZ3 LYS 24 234.434 13.993 8.250 221 H ARG 25 HN ARG 25 236.684 7.720 13.699 222 HA ARG 25 HA ARG 25 237.888 7.679 16.240 223 1HB ARG 25 HB2 ARG 25 235.778 7.385 17.593 224 2HB ARG 25 HB1 ARG 25 236.121 9.025 17.063 225 1HG ARG 25 HG2 ARG 25 234.312 7.248 15.476 226 2HG ARG 25 HG1 ARG 25 233.719 8.145 16.878 227 1HD ARG 25 HD2 ARG 25 234.947 10.138 15.680 228 2HD ARG 25 HD1 ARG 25 234.696 9.137 14.253 229 HE ARG 25 HE ARG 25 232.249 9.146 15.139 230 1HH1 ARG 25 HH11 ARG 25 234.484 11.836 15.199 231 2HH1 ARG 25 HH12 ARG 25 233.235 13.029 15.106 232 1HH2 ARG 25 HH21 ARG 25 230.616 10.721 15.017 233 2HH2 ARG 25 HH22 ARG 25 231.044 12.399 15.004 234 H GLY 26 HN GLY 26 238.578 5.657 16.304 235 1HA GLY 26 HA2 GLY 26 237.081 3.391 16.558 236 2HA GLY 26 HA1 GLY 26 237.275 3.569 14.821 237 H PHE 27 HN PHE 27 238.882 2.408 14.021 238 HA PHE 27 HA PHE 27 241.114 1.688 15.778 239 1HB PHE 27 HB2 PHE 27 239.842 0.434 13.394 240 2HB PHE 27 HB1 PHE 27 241.563 0.152 13.644 241 HD1 PHE 27 HD1 PHE 27 242.337 -1.295 15.353 242 HD2 PHE 27 HD2 PHE 27 238.211 -0.283 15.109 243 HE1 PHE 27 HE1 PHE 27 241.811 -3.065 16.978 244 HE2 PHE 27 HE2 PHE 27 237.676 -2.052 16.734 245 HZ PHE 27 HZ PHE 27 239.478 -3.446 17.671 246 H GLY 28 HN GLY 28 240.762 4.307 14.342 247 1HA GLY 28 HA2 GLY 28 243.449 4.733 13.652 248 2HA GLY 28 HA1 GLY 28 242.543 4.469 12.171 249 H ALA 29 HN ALA 29 241.178 6.045 14.998 250 HA ALA 29 HA ALA 29 240.192 8.244 13.600 251 1HB ALA 29 HB1 ALA 29 239.348 8.921 15.566 252 2HB ALA 29 HB2 ALA 29 240.869 8.688 16.427 253 3HB ALA 29 HB3 ALA 29 239.831 7.305 16.076 254 H GLY 30 HN GLY 30 240.894 10.372 13.354 255 1HA GLY 30 HA2 GLY 30 242.437 12.023 12.953 256 2HA GLY 30 HA1 GLY 30 243.139 11.547 14.492 257 H ARG 31 HN ARG 31 242.977 9.198 11.960 258 HA ARG 31 HA ARG 31 245.793 9.678 11.270 259 1HB ARG 31 HB2 ARG 31 244.542 7.135 12.264 260 2HB ARG 31 HB1 ARG 31 245.952 7.085 11.215 261 1HG ARG 31 HG2 ARG 31 246.197 8.905 13.499 262 2HG ARG 31 HG1 ARG 31 246.035 7.199 13.922 263 1HD ARG 31 HD2 ARG 31 247.834 7.035 11.919 264 2HD ARG 31 HD1 ARG 31 248.236 8.622 12.572 265 HE ARG 31 HE ARG 31 248.117 7.066 14.777 266 1HH1 ARG 31 HH11 ARG 31 249.805 6.757 11.739 267 2HH1 ARG 31 HH12 ARG 31 251.135 5.884 12.423 268 1HH2 ARG 31 HH21 ARG 31 249.864 5.918 15.680 269 2HH2 ARG 31 HH22 ARG 31 251.168 5.407 14.661 270 H TRP 32 HN TRP 32 246.291 9.400 9.155 271 HA TRP 32 HA TRP 32 244.075 8.925 7.336 272 1HB TRP 32 HB2 TRP 32 246.684 9.381 6.091 273 2HB TRP 32 HB1 TRP 32 245.156 10.209 5.842 274 HD1 TRP 32 HD1 TRP 32 248.138 10.266 8.314 275 HE1 TRP 32 HE1 TRP 32 248.382 12.670 9.198 276 HE3 TRP 32 HE3 TRP 32 244.065 12.378 6.064 277 HZ2 TRP 32 HZ2 TRP 32 247.039 15.138 8.962 278 HZ3 TRP 32 HZ3 TRP 32 243.617 14.767 6.442 279 HH2 TRP 32 HH2 TRP 32 245.073 16.119 7.861 280 H ASN 33 HN ASN 33 244.190 7.441 5.564 281 HA ASN 33 HA ASN 33 246.232 5.559 5.190 282 1HB ASN 33 HB2 ASN 33 245.679 4.683 7.373 283 2HB ASN 33 HB1 ASN 33 243.964 4.642 6.977 284 1HD2 ASN 33 HD21 ASN 33 246.736 3.622 5.041 285 2HD2 ASN 33 HD22 ASN 33 246.264 1.965 4.917 286 H GLY 34 HN GLY 34 245.852 4.292 3.402 287 1HA GLY 34 HA2 GLY 34 243.952 5.097 1.546 288 2HA GLY 34 HA1 GLY 34 244.816 3.569 1.486 289 H PHE 35 HN PHE 35 242.510 3.239 0.455 290 HA PHE 35 HA PHE 35 240.669 2.380 2.585 291 1HB PHE 35 HB2 PHE 35 239.777 2.487 -0.258 292 2HB PHE 35 HB1 PHE 35 238.876 2.818 1.212 293 HD1 PHE 35 HD1 PHE 35 239.172 4.997 2.372 294 HD2 PHE 35 HD2 PHE 35 240.850 4.217 -1.460 295 HE1 PHE 35 HE1 PHE 35 239.454 7.413 2.009 296 HE2 PHE 35 HE2 PHE 35 241.136 6.633 -1.829 297 HZ PHE 35 HZ PHE 35 240.438 8.233 -0.094 298 H GLY 36 HN GLY 36 241.498 0.372 3.054 299 1HA GLY 36 HA2 GLY 36 241.769 -1.519 0.818 300 2HA GLY 36 HA1 GLY 36 242.483 -1.719 2.411 301 H GLY 37 HN GLY 37 240.787 -3.538 0.828 302 1HA GLY 37 HA2 GLY 37 238.693 -3.942 2.865 303 2HA GLY 37 HA1 GLY 37 238.318 -4.087 1.154 304 H LYS 38 HN LYS 38 238.020 -6.164 0.688 305 HA LYS 38 HA LYS 38 240.152 -8.043 1.090 306 1HB LYS 38 HB2 LYS 38 238.939 -9.650 2.424 307 2HB LYS 38 HB1 LYS 38 238.993 -8.115 3.282 308 1HG LYS 38 HG2 LYS 38 236.676 -7.696 2.242 309 2HG LYS 38 HG1 LYS 38 236.674 -9.432 1.926 310 1HD LYS 38 HD2 LYS 38 237.452 -9.395 4.517 311 2HD LYS 38 HD1 LYS 38 236.417 -7.966 4.467 312 1HE LYS 38 HE2 LYS 38 234.550 -9.223 3.759 313 2HE LYS 38 HE1 LYS 38 235.545 -10.625 3.369 314 1HZ LYS 38 HZ1 LYS 38 234.512 -9.737 5.939 315 2HZ LYS 38 HZ2 LYS 38 236.081 -10.370 5.950 316 3HZ LYS 38 HZ3 LYS 38 234.797 -11.304 5.368 317 H VAL 39 HN VAL 39 240.080 -9.716 -0.353 318 HA VAL 39 HA VAL 39 238.187 -9.477 -2.506 319 HB VAL 39 HB VAL 39 240.153 -11.738 -2.224 320 1HG1 VAL 39 HG11 VAL 39 240.202 -11.633 -4.642 321 2HG1 VAL 39 HG12 VAL 39 239.151 -10.218 -4.626 322 3HG1 VAL 39 HG13 VAL 39 238.536 -11.780 -4.083 323 1HG2 VAL 39 HG21 VAL 39 240.701 -8.863 -2.659 324 2HG2 VAL 39 HG22 VAL 39 241.574 -10.019 -3.665 325 3HG2 VAL 39 HG23 VAL 39 241.698 -10.109 -1.907 326 H GLN 40 HN GLN 40 236.189 -10.228 -2.221 327 HA GLN 40 HA GLN 40 235.274 -12.055 -0.392 328 1HB GLN 40 HB2 GLN 40 234.266 -11.082 -3.017 329 2HB GLN 40 HB1 GLN 40 233.479 -12.488 -2.316 330 1HG GLN 40 HG2 GLN 40 233.057 -11.196 -0.264 331 2HG GLN 40 HG1 GLN 40 233.782 -9.783 -1.031 332 1HE2 GLN 40 HE21 GLN 40 231.132 -12.083 -1.222 333 2HE2 GLN 40 HE22 GLN 40 230.050 -11.049 -2.085 334 H GLU 41 HN GLU 41 234.106 -14.191 -1.124 335 HA GLU 41 HA GLU 41 236.170 -16.037 -1.748 336 1HB GLU 41 HB2 GLU 41 233.188 -16.364 -1.431 337 2HB GLU 41 HB1 GLU 41 234.276 -17.713 -1.726 338 1HG GLU 41 HG2 GLU 41 235.183 -17.625 0.361 339 2HG GLU 41 HG1 GLU 41 234.886 -15.896 0.540 340 H GLY 42 HN GLY 42 236.578 -14.764 -3.876 341 1HA GLY 42 HA2 GLY 42 236.747 -15.907 -6.087 342 2HA GLY 42 HA1 GLY 42 234.999 -16.055 -6.016 343 H GLU 43 HN GLU 43 237.053 -13.244 -5.235 344 HA GLU 43 HA GLU 43 235.849 -11.860 -7.514 345 1HB GLU 43 HB2 GLU 43 235.183 -10.049 -6.299 346 2HB GLU 43 HB1 GLU 43 235.020 -11.267 -5.047 347 1HG GLU 43 HG2 GLU 43 237.014 -10.588 -3.991 348 2HG GLU 43 HG1 GLU 43 237.502 -9.609 -5.374 349 H THR 44 HN THR 44 237.168 -9.747 -7.884 350 HA THR 44 HA THR 44 239.963 -10.601 -7.934 351 HB THR 44 HB THR 44 240.210 -8.983 -9.745 352 HG1 THR 44 HG1 THR 44 238.592 -7.685 -10.355 353 1HG2 THR 44 HG21 THR 44 239.638 -10.897 -10.796 354 2HG2 THR 44 HG22 THR 44 238.176 -9.983 -11.170 355 3HG2 THR 44 HG23 THR 44 238.186 -11.119 -9.821 356 H ILE 45 HN ILE 45 241.601 -9.372 -7.119 357 HA ILE 45 HA ILE 45 241.163 -7.858 -4.874 358 HB ILE 45 HB ILE 45 243.526 -7.352 -6.664 359 1HG1 ILE 45 HG12 ILE 45 244.362 -9.295 -4.951 360 2HG1 ILE 45 HG11 ILE 45 242.715 -9.819 -5.284 361 1HG2 ILE 45 HG21 ILE 45 243.420 -5.910 -4.772 362 2HG2 ILE 45 HG22 ILE 45 244.667 -7.119 -4.468 363 3HG2 ILE 45 HG23 ILE 45 243.089 -7.268 -3.695 364 1HD1 ILE 45 HD11 ILE 45 245.085 -9.835 -6.992 365 2HD1 ILE 45 HD12 ILE 45 243.621 -9.248 -7.780 366 3HD1 ILE 45 HD13 ILE 45 243.642 -10.847 -7.036 367 H GLU 46 HN GLU 46 241.220 -6.818 -8.221 368 HA GLU 46 HA GLU 46 241.221 -4.002 -7.634 369 1HB GLU 46 HB2 GLU 46 242.033 -4.921 -9.794 370 2HB GLU 46 HB1 GLU 46 240.397 -5.448 -10.166 371 1HG GLU 46 HG2 GLU 46 239.832 -2.919 -9.774 372 2HG GLU 46 HG1 GLU 46 241.547 -2.707 -10.125 373 H ASP 47 HN ASP 47 238.874 -6.534 -7.943 374 HA ASP 47 HA ASP 47 236.619 -4.757 -8.159 375 1HB ASP 47 HB2 ASP 47 236.985 -7.718 -7.909 376 2HB ASP 47 HB1 ASP 47 235.416 -7.024 -7.514 377 H GLY 48 HN GLY 48 238.333 -6.549 -5.687 378 1HA GLY 48 HA2 GLY 48 236.449 -5.998 -3.589 379 2HA GLY 48 HA1 GLY 48 238.090 -6.601 -3.385 380 H ALA 49 HN ALA 49 239.294 -4.416 -4.870 381 HA ALA 49 HA ALA 49 239.542 -2.528 -2.720 382 1HB ALA 49 HB1 ALA 49 240.714 -1.794 -5.308 383 2HB ALA 49 HB2 ALA 49 241.229 -3.362 -4.689 384 3HB ALA 49 HB3 ALA 49 241.460 -1.912 -3.714 385 H ARG 50 HN ARG 50 237.957 -2.687 -5.837 386 HA ARG 50 HA ARG 50 237.266 0.080 -5.931 387 1HB ARG 50 HB2 ARG 50 236.505 -2.357 -7.488 388 2HB ARG 50 HB1 ARG 50 235.535 -0.900 -7.653 389 1HG ARG 50 HG2 ARG 50 237.696 0.310 -8.183 390 2HG ARG 50 HG1 ARG 50 238.432 -1.288 -8.324 391 1HD ARG 50 HD2 ARG 50 237.776 -0.543 -10.509 392 2HD ARG 50 HD1 ARG 50 236.726 -1.872 -10.023 393 HE ARG 50 HE ARG 50 235.981 0.922 -10.356 394 1HH1 ARG 50 HH11 ARG 50 235.048 -2.275 -9.294 395 2HH1 ARG 50 HH12 ARG 50 233.353 -1.933 -9.360 396 1HH2 ARG 50 HH21 ARG 50 233.752 1.366 -10.438 397 2HH2 ARG 50 HH22 ARG 50 232.617 0.130 -10.007 398 H ARG 51 HN ARG 51 235.377 -2.876 -5.322 399 HA ARG 51 HA ARG 51 232.975 -1.584 -4.663 400 1HB ARG 51 HB2 ARG 51 233.781 -4.190 -4.977 401 2HB ARG 51 HB1 ARG 51 233.445 -4.111 -3.253 402 1HG ARG 51 HG2 ARG 51 231.346 -4.578 -3.862 403 2HG ARG 51 HG1 ARG 51 231.260 -2.865 -4.271 404 1HD ARG 51 HD2 ARG 51 232.433 -4.326 -6.444 405 2HD ARG 51 HD1 ARG 51 230.905 -5.073 -5.979 406 HE ARG 51 HE ARG 51 231.272 -2.524 -7.246 407 1HH1 ARG 51 HH11 ARG 51 229.156 -4.419 -5.220 408 2HH1 ARG 51 HH12 ARG 51 227.739 -3.520 -5.644 409 1HH2 ARG 51 HH21 ARG 51 229.410 -1.340 -7.806 410 2HH2 ARG 51 HH22 ARG 51 227.881 -1.772 -7.114 411 H GLU 52 HN GLU 52 235.768 -2.408 -2.719 412 HA GLU 52 HA GLU 52 234.465 -1.680 -0.239 413 1HB GLU 52 HB2 GLU 52 237.331 -2.420 -0.847 414 2HB GLU 52 HB1 GLU 52 236.704 -2.104 0.764 415 1HG GLU 52 HG2 GLU 52 235.241 -4.120 -0.802 416 2HG GLU 52 HG1 GLU 52 236.884 -4.551 -0.330 417 H LEU 53 HN LEU 53 236.247 -0.158 -2.717 418 HA LEU 53 HA LEU 53 237.358 1.972 -1.179 419 1HB LEU 53 HB2 LEU 53 238.454 1.530 -3.193 420 2HB LEU 53 HB1 LEU 53 236.958 1.433 -4.100 421 HG LEU 53 HG LEU 53 236.678 3.882 -3.826 422 1HD1 LEU 53 HD11 LEU 53 238.032 5.140 -2.569 423 2HD1 LEU 53 HD12 LEU 53 239.478 4.259 -3.063 424 3HD1 LEU 53 HD13 LEU 53 238.443 3.614 -1.788 425 1HD2 LEU 53 HD21 LEU 53 237.556 3.393 -5.892 426 2HD2 LEU 53 HD22 LEU 53 239.014 2.664 -5.224 427 3HD2 LEU 53 HD23 LEU 53 238.830 4.418 -5.231 428 H GLN 54 HN GLN 54 234.587 1.687 -3.368 429 HA GLN 54 HA GLN 54 233.686 4.323 -3.203 430 1HB GLN 54 HB2 GLN 54 232.695 3.067 -4.887 431 2HB GLN 54 HB1 GLN 54 232.361 1.710 -3.820 432 1HG GLN 54 HG2 GLN 54 230.498 2.771 -2.870 433 2HG GLN 54 HG1 GLN 54 230.963 4.345 -3.513 434 1HE2 GLN 54 HE21 GLN 54 230.843 1.218 -5.145 435 2HE2 GLN 54 HE22 GLN 54 229.656 1.672 -6.316 436 H GLU 55 HN GLU 55 233.341 1.682 -0.979 437 HA GLU 55 HA GLU 55 231.241 2.946 0.542 438 1HB GLU 55 HB2 GLU 55 231.390 1.031 2.016 439 2HB GLU 55 HB1 GLU 55 231.367 0.501 0.339 440 1HG GLU 55 HG2 GLU 55 233.629 -0.070 0.370 441 2HG GLU 55 HG1 GLU 55 233.935 0.850 1.841 442 H GLU 56 HN GLU 56 234.716 2.889 0.655 443 HA GLU 56 HA GLU 56 234.982 3.504 3.398 444 1HB GLU 56 HB2 GLU 56 236.732 3.234 1.110 445 2HB GLU 56 HB1 GLU 56 237.234 4.560 2.153 446 1HG GLU 56 HG2 GLU 56 236.531 2.213 3.685 447 2HG GLU 56 HG1 GLU 56 237.784 1.864 2.496 448 H SER 57 HN SER 57 234.883 5.627 0.529 449 HA SER 57 HA SER 57 234.181 7.821 2.334 450 1HB SER 57 HB2 SER 57 236.767 7.597 1.482 451 2HB SER 57 HB1 SER 57 236.078 8.636 0.235 452 HG SER 57 HG SER 57 235.717 9.128 2.999 453 H GLY 58 HN GLY 58 232.773 6.213 0.274 454 1HA GLY 58 HA2 GLY 58 231.228 6.565 -1.386 455 2HA GLY 58 HA1 GLY 58 231.246 8.250 -0.889 456 H LEU 59 HN LEU 59 234.332 7.218 -1.768 457 HA LEU 59 HA LEU 59 234.144 8.680 -4.288 458 1HB LEU 59 HB2 LEU 59 236.500 7.691 -2.683 459 2HB LEU 59 HB1 LEU 59 236.642 8.503 -4.230 460 HG LEU 59 HG LEU 59 235.972 9.623 -1.557 461 1HD1 LEU 59 HD11 LEU 59 237.660 10.349 -3.921 462 2HD1 LEU 59 HD12 LEU 59 238.147 10.073 -2.248 463 3HD1 LEU 59 HD13 LEU 59 237.269 11.541 -2.682 464 1HD2 LEU 59 HD21 LEU 59 233.975 10.192 -2.782 465 2HD2 LEU 59 HD22 LEU 59 234.934 10.753 -4.151 466 3HD2 LEU 59 HD23 LEU 59 234.990 11.625 -2.620 467 H THR 60 HN THR 60 233.558 7.496 -5.962 468 HA THR 60 HA THR 60 234.397 4.705 -6.112 469 HB THR 60 HB THR 60 232.902 5.784 -8.387 470 HG1 THR 60 HG1 THR 60 231.658 5.765 -5.842 471 1HG2 THR 60 HG21 THR 60 231.772 3.816 -8.318 472 2HG2 THR 60 HG22 THR 60 231.817 3.724 -6.557 473 3HG2 THR 60 HG23 THR 60 233.256 3.331 -7.497 474 H VAL 61 HN VAL 61 234.958 4.069 -8.558 475 HA VAL 61 HA VAL 61 236.737 6.090 -9.691 476 HB VAL 61 HB VAL 61 238.631 4.616 -9.824 477 1HG1 VAL 61 HG11 VAL 61 238.612 5.924 -7.854 478 2HG1 VAL 61 HG12 VAL 61 239.088 4.300 -7.362 479 3HG1 VAL 61 HG13 VAL 61 237.443 4.862 -7.074 480 1HG2 VAL 61 HG21 VAL 61 236.677 2.590 -8.943 481 2HG2 VAL 61 HG22 VAL 61 238.298 2.450 -8.262 482 3HG2 VAL 61 HG23 VAL 61 238.071 2.436 -10.011 483 H ASP 62 HN ASP 62 236.911 6.045 -11.841 484 HA ASP 62 HA ASP 62 235.164 4.281 -13.301 485 1HB ASP 62 HB2 ASP 62 235.829 6.838 -13.718 486 2HB ASP 62 HB1 ASP 62 237.064 6.083 -14.722 487 H ALA 63 HN ALA 63 238.460 4.337 -12.383 488 HA ALA 63 HA ALA 63 239.028 1.793 -13.339 489 1HB ALA 63 HB1 ALA 63 239.680 3.999 -15.236 490 2HB ALA 63 HB2 ALA 63 239.060 2.381 -15.562 491 3HB ALA 63 HB3 ALA 63 240.754 2.605 -15.129 492 H LEU 64 HN LEU 64 239.980 1.675 -11.282 493 HA LEU 64 HA LEU 64 241.891 3.392 -10.192 494 1HB LEU 64 HB2 LEU 64 241.276 0.480 -9.870 495 2HB LEU 64 HB1 LEU 64 242.745 1.111 -9.154 496 HG LEU 64 HG LEU 64 240.262 2.598 -8.538 497 1HD1 LEU 64 HD11 LEU 64 239.266 1.031 -7.215 498 2HD1 LEU 64 HD12 LEU 64 240.766 0.140 -6.951 499 3HD1 LEU 64 HD13 LEU 64 239.904 -0.016 -8.482 500 1HD2 LEU 64 HD21 LEU 64 242.818 2.698 -7.653 501 2HD2 LEU 64 HD22 LEU 64 242.095 1.633 -6.447 502 3HD2 LEU 64 HD23 LEU 64 241.426 3.242 -6.718 503 H HIS 65 HN HIS 65 244.261 2.620 -9.807 504 HA HIS 65 HA HIS 65 245.394 1.466 -12.254 505 1HB HIS 65 HB2 HIS 65 245.450 4.139 -11.907 506 2HB HIS 65 HB1 HIS 65 246.920 3.699 -11.044 507 HD1 HIS 65 HD1 HIS 65 248.886 2.792 -12.436 508 HD2 HIS 65 HD2 HIS 65 245.526 3.741 -14.688 509 HE1 HIS 65 HE1 HIS 65 249.652 2.765 -14.830 510 HE2 HIS 65 HE2 HIS 65 247.620 3.415 -16.170 511 H LYS 66 HN LYS 66 246.140 -0.411 -11.401 512 HA LYS 66 HA LYS 66 247.204 -0.733 -8.814 513 1HB LYS 66 HB2 LYS 66 248.216 -2.844 -9.779 514 2HB LYS 66 HB1 LYS 66 246.475 -2.688 -9.958 515 1HG LYS 66 HG2 LYS 66 247.531 -1.538 -12.262 516 2HG LYS 66 HG1 LYS 66 248.517 -2.972 -11.972 517 1HD LYS 66 HD2 LYS 66 245.578 -3.261 -11.698 518 2HD LYS 66 HD1 LYS 66 246.224 -3.060 -13.327 519 1HE LYS 66 HE2 LYS 66 247.570 -5.015 -11.549 520 2HE LYS 66 HE1 LYS 66 245.975 -5.444 -12.166 521 1HZ LYS 66 HZ1 LYS 66 246.763 -5.147 -14.403 522 2HZ LYS 66 HZ2 LYS 66 247.794 -6.218 -13.597 523 3HZ LYS 66 HZ3 LYS 66 248.273 -4.616 -13.855 524 H VAL 67 HN VAL 67 249.280 -0.617 -8.005 525 HA VAL 67 HA VAL 67 251.343 0.270 -9.921 526 HB VAL 67 HB VAL 67 252.262 1.791 -8.223 527 1HG1 VAL 67 HG11 VAL 67 249.409 2.217 -9.080 528 2HG1 VAL 67 HG12 VAL 67 250.880 2.794 -9.863 529 3HG1 VAL 67 HG13 VAL 67 250.380 3.473 -8.313 530 1HG2 VAL 67 HG21 VAL 67 251.611 1.009 -6.146 531 2HG2 VAL 67 HG22 VAL 67 249.933 0.785 -6.641 532 3HG2 VAL 67 HG23 VAL 67 250.562 2.409 -6.364 533 H GLY 68 HN GLY 68 250.815 -1.072 -6.658 534 1HA GLY 68 HA2 GLY 68 253.126 -2.809 -7.133 535 2HA GLY 68 HA1 GLY 68 253.162 -1.775 -5.715 536 H GLN 69 HN GLN 69 253.329 -4.570 -5.647 537 HA GLN 69 HA GLN 69 250.772 -5.275 -4.359 538 1HB GLN 69 HB2 GLN 69 251.825 -6.582 -6.468 539 2HB GLN 69 HB1 GLN 69 252.633 -7.440 -5.163 540 1HG GLN 69 HG2 GLN 69 250.259 -7.660 -4.163 541 2HG GLN 69 HG1 GLN 69 249.720 -7.279 -5.798 542 1HE2 GLN 69 HE21 GLN 69 249.844 -8.804 -7.359 543 2HE2 GLN 69 HE22 GLN 69 250.397 -10.418 -7.097 544 H ILE 70 HN ILE 70 250.903 -5.384 -2.213 545 HA ILE 70 HA ILE 70 253.538 -5.926 -1.013 546 HB ILE 70 HB ILE 70 251.197 -4.607 0.354 547 1HG1 ILE 70 HG12 ILE 70 253.575 -3.319 -1.005 548 2HG1 ILE 70 HG11 ILE 70 251.906 -3.241 -1.559 549 1HG2 ILE 70 HG21 ILE 70 254.123 -4.545 1.055 550 2HG2 ILE 70 HG22 ILE 70 252.984 -5.712 1.728 551 3HG2 ILE 70 HG23 ILE 70 252.764 -3.989 2.033 552 1HD1 ILE 70 HD11 ILE 70 251.894 -1.292 -0.465 553 2HD1 ILE 70 HD12 ILE 70 253.271 -1.732 0.544 554 3HD1 ILE 70 HD13 ILE 70 251.654 -2.299 0.963 555 H VAL 71 HN VAL 71 253.816 -7.572 0.330 556 HA VAL 71 HA VAL 71 251.471 -9.217 1.019 557 HB VAL 71 HB VAL 71 254.318 -10.170 0.676 558 1HG1 VAL 71 HG11 VAL 71 253.275 -12.403 0.689 559 2HG1 VAL 71 HG12 VAL 71 251.721 -11.649 1.048 560 3HG1 VAL 71 HG13 VAL 71 253.044 -11.533 2.206 561 1HG2 VAL 71 HG21 VAL 71 253.279 -9.376 -1.445 562 2HG2 VAL 71 HG22 VAL 71 252.002 -10.571 -1.212 563 3HG2 VAL 71 HG23 VAL 71 253.671 -11.095 -1.438 564 H PHE 72 HN PHE 72 251.418 -10.152 3.114 565 HA PHE 72 HA PHE 72 253.429 -9.140 4.995 566 1HB PHE 72 HB2 PHE 72 250.439 -9.026 5.414 567 2HB PHE 72 HB1 PHE 72 251.647 -8.621 6.626 568 HD1 PHE 72 HD1 PHE 72 252.176 -6.413 6.912 569 HD2 PHE 72 HD2 PHE 72 250.732 -7.710 3.124 570 HE1 PHE 72 HE1 PHE 72 252.204 -4.087 6.109 571 HE2 PHE 72 HE2 PHE 72 250.760 -5.387 2.315 572 HZ PHE 72 HZ PHE 72 251.495 -3.572 3.807 573 H GLU 73 HN GLU 73 253.990 -10.498 6.622 574 HA GLU 73 HA GLU 73 252.574 -13.084 6.737 575 1HB GLU 73 HB2 GLU 73 254.722 -13.418 5.676 576 2HB GLU 73 HB1 GLU 73 255.540 -12.546 6.965 577 1HG GLU 73 HG2 GLU 73 255.598 -14.334 8.304 578 2HG GLU 73 HG1 GLU 73 253.960 -14.831 7.879 579 H PHE 74 HN PHE 74 251.894 -13.734 8.688 580 HA PHE 74 HA PHE 74 252.313 -11.963 10.947 581 1HB PHE 74 HB2 PHE 74 250.091 -13.026 10.408 582 2HB PHE 74 HB1 PHE 74 250.783 -14.578 10.854 583 HD1 PHE 74 HD1 PHE 74 249.056 -14.887 12.534 584 HD2 PHE 74 HD2 PHE 74 251.747 -11.592 12.724 585 HE1 PHE 74 HE1 PHE 74 248.422 -14.507 14.880 586 HE2 PHE 74 HE2 PHE 74 251.120 -11.214 15.068 587 HZ PHE 74 HZ PHE 74 249.455 -12.670 16.152 588 H VAL 75 HN VAL 75 253.515 -12.377 12.748 589 HA VAL 75 HA VAL 75 255.579 -14.327 12.541 590 HB VAL 75 HB VAL 75 255.169 -11.978 14.019 591 1HG1 VAL 75 HG11 VAL 75 255.787 -12.584 16.298 592 2HG1 VAL 75 HG12 VAL 75 255.668 -14.294 15.881 593 3HG1 VAL 75 HG13 VAL 75 254.227 -13.277 15.852 594 1HG2 VAL 75 HG21 VAL 75 257.561 -12.431 14.729 595 2HG2 VAL 75 HG22 VAL 75 257.235 -12.415 12.996 596 3HG2 VAL 75 HG23 VAL 75 257.423 -13.951 13.844 597 H GLY 76 HN GLY 76 255.631 -16.358 13.229 598 1HA GLY 76 HA2 GLY 76 255.161 -18.254 14.448 599 2HA GLY 76 HA1 GLY 76 254.259 -17.250 15.571 600 H GLU 77 HN GLU 77 253.253 -16.902 12.328 601 HA GLU 77 HA GLU 77 251.193 -18.964 12.641 602 1HB GLU 77 HB2 GLU 77 250.743 -16.027 12.201 603 2HB GLU 77 HB1 GLU 77 249.559 -17.215 11.676 604 1HG GLU 77 HG2 GLU 77 250.509 -16.705 14.482 605 2HG GLU 77 HG1 GLU 77 248.909 -16.387 13.815 606 HA PRO 78 HA PRO 78 252.532 -19.890 8.485 607 1HB PRO 78 HB2 PRO 78 249.843 -21.151 8.332 608 2HB PRO 78 HB1 PRO 78 251.432 -21.838 7.973 609 1HG PRO 78 HG2 PRO 78 250.141 -22.496 10.207 610 2HG PRO 78 HG1 PRO 78 251.900 -22.264 10.203 611 1HD PRO 78 HD2 PRO 78 249.748 -20.448 11.205 612 2HD PRO 78 HD1 PRO 78 251.362 -20.766 11.875 613 H GLU 79 HN GLU 79 249.145 -18.907 9.024 614 HA GLU 79 HA GLU 79 248.492 -18.108 6.475 615 1HB GLU 79 HB2 GLU 79 247.264 -18.013 8.919 616 2HB GLU 79 HB1 GLU 79 247.481 -16.306 8.556 617 1HG GLU 79 HG2 GLU 79 246.354 -16.633 6.407 618 2HG GLU 79 HG1 GLU 79 246.107 -18.332 6.810 619 H LEU 80 HN LEU 80 248.181 -15.899 5.642 620 HA LEU 80 HA LEU 80 250.093 -13.902 6.561 621 1HB LEU 80 HB2 LEU 80 250.167 -14.337 3.645 622 2HB LEU 80 HB1 LEU 80 251.455 -13.895 4.747 623 HG LEU 80 HG LEU 80 250.438 -16.687 4.849 624 1HD1 LEU 80 HD11 LEU 80 251.368 -17.398 2.907 625 2HD1 LEU 80 HD12 LEU 80 252.578 -16.116 2.887 626 3HD1 LEU 80 HD13 LEU 80 250.918 -15.771 2.399 627 1HD2 LEU 80 HD21 LEU 80 253.255 -15.646 4.947 628 2HD2 LEU 80 HD22 LEU 80 252.634 -17.186 5.542 629 3HD2 LEU 80 HD23 LEU 80 252.208 -15.687 6.366 630 H MET 81 HN MET 81 249.937 -12.136 4.468 631 HA MET 81 HA MET 81 247.134 -11.800 3.796 632 1HB MET 81 HB2 MET 81 247.308 -10.700 5.970 633 2HB MET 81 HB1 MET 81 248.657 -9.735 5.390 634 1HG MET 81 HG2 MET 81 246.986 -8.922 3.591 635 2HG MET 81 HG1 MET 81 245.760 -9.540 4.697 636 1HE MET 81 HE1 MET 81 248.220 -7.211 3.673 637 2HE MET 81 HE2 MET 81 248.766 -6.287 5.073 638 3HE MET 81 HE3 MET 81 247.335 -5.771 4.180 639 H ASP 82 HN ASP 82 247.218 -11.520 1.665 640 HA ASP 82 HA ASP 82 249.442 -9.978 0.521 641 1HB ASP 82 HB2 ASP 82 249.091 -12.246 -0.383 642 2HB ASP 82 HB1 ASP 82 247.448 -11.809 -0.840 643 H VAL 83 HN VAL 83 248.885 -7.859 0.542 644 HA VAL 83 HA VAL 83 246.213 -7.145 -0.475 645 HB VAL 83 HB VAL 83 246.647 -6.403 1.831 646 1HG1 VAL 83 HG11 VAL 83 249.143 -6.107 1.413 647 2HG1 VAL 83 HG12 VAL 83 248.348 -4.895 2.418 648 3HG1 VAL 83 HG13 VAL 83 248.726 -4.533 0.734 649 1HG2 VAL 83 HG21 VAL 83 245.087 -5.076 0.703 650 2HG2 VAL 83 HG22 VAL 83 246.318 -4.342 -0.324 651 3HG2 VAL 83 HG23 VAL 83 246.228 -3.915 1.384 652 H HIS 84 HN HIS 84 246.183 -6.436 -2.478 653 HA HIS 84 HA HIS 84 248.547 -5.530 -3.823 654 1HB HIS 84 HB2 HIS 84 246.546 -6.766 -4.865 655 2HB HIS 84 HB1 HIS 84 245.717 -5.213 -4.826 656 HD1 HIS 84 HD1 HIS 84 245.617 -5.156 -7.415 657 HD2 HIS 84 HD2 HIS 84 249.467 -5.244 -5.857 658 HE1 HIS 84 HE1 HIS 84 247.134 -4.581 -9.336 659 HE2 HIS 84 HE2 HIS 84 249.464 -4.720 -8.389 660 H VAL 85 HN VAL 85 248.784 -3.376 -4.776 661 HA VAL 85 HA VAL 85 247.409 -1.344 -3.136 662 HB VAL 85 HB VAL 85 250.174 -1.141 -4.351 663 1HG1 VAL 85 HG11 VAL 85 249.393 0.639 -2.164 664 2HG1 VAL 85 HG12 VAL 85 248.486 0.881 -3.656 665 3HG1 VAL 85 HG13 VAL 85 250.245 0.992 -3.668 666 1HG2 VAL 85 HG21 VAL 85 251.089 -1.585 -2.238 667 2HG2 VAL 85 HG22 VAL 85 249.845 -2.815 -2.454 668 3HG2 VAL 85 HG23 VAL 85 249.531 -1.413 -1.430 669 H PHE 86 HN PHE 86 245.901 -0.476 -4.354 670 HA PHE 86 HA PHE 86 246.440 0.105 -7.177 671 1HB PHE 86 HB2 PHE 86 244.071 -0.688 -5.630 672 2HB PHE 86 HB1 PHE 86 243.764 0.655 -6.723 673 HD1 PHE 86 HD1 PHE 86 244.584 0.327 -9.176 674 HD2 PHE 86 HD2 PHE 86 243.939 -2.847 -6.417 675 HE1 PHE 86 HE1 PHE 86 244.350 -1.248 -11.051 676 HE2 PHE 86 HE2 PHE 86 243.706 -4.430 -8.287 677 HZ PHE 86 HZ PHE 86 243.911 -3.631 -10.607 678 H CYS 87 HN CYS 87 246.048 2.146 -8.019 679 HA CYS 87 HA CYS 87 245.417 4.310 -6.140 680 1HB CYS 87 HB2 CYS 87 247.873 4.064 -7.863 681 2HB CYS 87 HB1 CYS 87 247.219 5.652 -7.475 682 HG CYS 87 HG CYS 87 247.737 3.967 -5.000 683 H THR 88 HN THR 88 243.679 5.311 -6.997 684 HA THR 88 HA THR 88 243.167 5.024 -9.842 685 HB THR 88 HB THR 88 241.394 4.594 -8.136 686 HG1 THR 88 HG1 THR 88 239.844 6.058 -9.322 687 1HG2 THR 88 HG21 THR 88 240.732 7.429 -7.921 688 2HG2 THR 88 HG22 THR 88 242.118 6.905 -6.964 689 3HG2 THR 88 HG23 THR 88 240.553 6.120 -6.754 690 H ASP 89 HN ASP 89 241.729 7.153 -10.516 691 HA ASP 89 HA ASP 89 243.119 9.616 -9.906 692 1HB ASP 89 HB2 ASP 89 244.199 8.186 -11.932 693 2HB ASP 89 HB1 ASP 89 242.964 9.076 -12.818 694 H SER 90 HN SER 90 240.778 7.933 -11.946 695 HA SER 90 HA SER 90 239.104 10.336 -12.044 696 1HB SER 90 HB2 SER 90 239.739 8.509 -14.004 697 2HB SER 90 HB1 SER 90 238.156 7.943 -13.469 698 HG SER 90 HG SER 90 238.705 10.638 -14.160 699 H ILE 91 HN ILE 91 238.170 10.356 -10.001 700 HA ILE 91 HA ILE 91 236.693 7.953 -9.197 701 HB ILE 91 HB ILE 91 236.428 9.203 -6.982 702 1HG1 ILE 91 HG12 ILE 91 238.875 10.742 -7.637 703 2HG1 ILE 91 HG11 ILE 91 237.385 11.337 -8.363 704 1HG2 ILE 91 HG21 ILE 91 237.900 7.540 -6.642 705 2HG2 ILE 91 HG22 ILE 91 239.100 8.832 -6.649 706 3HG2 ILE 91 HG23 ILE 91 238.804 7.895 -8.114 707 1HD1 ILE 91 HD11 ILE 91 236.704 10.849 -5.726 708 2HD1 ILE 91 HD12 ILE 91 237.036 12.417 -6.462 709 3HD1 ILE 91 HD13 ILE 91 238.326 11.537 -5.643 710 H GLN 92 HN GLN 92 234.691 8.615 -7.777 711 HA GLN 92 HA GLN 92 233.030 10.323 -9.496 712 1HB GLN 92 HB2 GLN 92 232.285 8.129 -7.556 713 2HB GLN 92 HB1 GLN 92 231.113 9.141 -8.390 714 1HG GLN 92 HG2 GLN 92 233.149 7.490 -9.851 715 2HG GLN 92 HG1 GLN 92 231.567 6.863 -9.386 716 1HE2 GLN 92 HE21 GLN 92 231.999 6.752 -11.944 717 2HE2 GLN 92 HE22 GLN 92 231.189 8.005 -12.816 718 H GLY 93 HN GLY 93 234.057 12.146 -8.416 719 1HA GLY 93 HA2 GLY 93 234.347 13.082 -6.042 720 2HA GLY 93 HA1 GLY 93 233.364 14.020 -7.150 721 H THR 94 HN THR 94 233.389 11.909 -4.411 722 HA THR 94 HA THR 94 230.946 13.016 -3.412 723 HB THR 94 HB THR 94 231.031 10.083 -4.133 724 HG1 THR 94 HG1 THR 94 229.272 12.106 -5.038 725 1HG2 THR 94 HG21 THR 94 229.343 11.562 -2.265 726 2HG2 THR 94 HG22 THR 94 229.635 9.828 -2.413 727 3HG2 THR 94 HG23 THR 94 228.457 10.617 -3.462 728 HA PRO 95 HA PRO 95 234.050 11.300 -0.356 729 1HB PRO 95 HB2 PRO 95 235.121 13.617 0.523 730 2HB PRO 95 HB1 PRO 95 235.769 12.756 -0.878 731 1HG PRO 95 HG2 PRO 95 234.002 15.156 -0.778 732 2HG PRO 95 HG1 PRO 95 235.343 14.793 -1.877 733 1HD PRO 95 HD2 PRO 95 232.685 14.481 -2.508 734 2HD PRO 95 HD1 PRO 95 234.011 13.600 -3.289 735 H VAL 96 HN VAL 96 231.717 11.015 0.309 736 HA VAL 96 HA VAL 96 230.526 13.051 1.937 737 HB VAL 96 HB VAL 96 229.713 10.169 2.082 738 1HG1 VAL 96 HG11 VAL 96 227.817 12.430 1.792 739 2HG1 VAL 96 HG12 VAL 96 228.703 12.289 3.310 740 3HG1 VAL 96 HG13 VAL 96 227.689 10.958 2.753 741 1HG2 VAL 96 HG21 VAL 96 229.916 10.334 -0.241 742 2HG2 VAL 96 HG22 VAL 96 229.367 12.010 -0.262 743 3HG2 VAL 96 HG23 VAL 96 228.222 10.710 0.067 744 H GLU 97 HN GLU 97 232.734 13.109 3.101 745 HA GLU 97 HA GLU 97 233.721 11.316 4.876 746 1HB GLU 97 HB2 GLU 97 234.513 13.160 6.221 747 2HB GLU 97 HB1 GLU 97 234.600 13.607 4.523 748 1HG GLU 97 HG2 GLU 97 232.278 14.680 4.952 749 2HG GLU 97 HG1 GLU 97 232.760 14.604 6.647 750 H SER 98 HN SER 98 232.570 9.969 6.104 751 HA SER 98 HA SER 98 230.179 10.875 7.475 752 1HB SER 98 HB2 SER 98 231.397 8.259 6.813 753 2HB SER 98 HB1 SER 98 230.475 8.320 8.313 754 HG SER 98 HG SER 98 229.583 8.259 5.777 755 H ASP 99 HN ASP 99 230.049 9.597 9.781 756 HA ASP 99 HA ASP 99 231.788 11.097 11.473 757 1HB ASP 99 HB2 ASP 99 229.595 9.102 11.929 758 2HB ASP 99 HB1 ASP 99 230.624 9.598 13.270 759 H GLU 100 HN GLU 100 232.189 8.163 9.879 760 HA GLU 100 HA GLU 100 234.083 7.177 11.898 761 1HB GLU 100 HB2 GLU 100 232.271 5.873 10.017 762 2HB GLU 100 HB1 GLU 100 233.903 5.225 9.940 763 1HG GLU 100 HG2 GLU 100 233.868 4.687 12.270 764 2HG GLU 100 HG1 GLU 100 232.323 5.509 12.484 765 H MET 101 HN MET 101 233.762 8.091 8.510 766 HA MET 101 HA MET 101 236.694 7.938 8.260 767 1HB MET 101 HB2 MET 101 234.752 6.775 6.642 768 2HB MET 101 HB1 MET 101 235.267 8.192 5.737 769 1HG MET 101 HG2 MET 101 236.554 6.222 5.125 770 2HG MET 101 HG1 MET 101 237.575 7.459 5.854 771 1HE MET 101 HE1 MET 101 239.392 6.643 6.636 772 2HE MET 101 HE2 MET 101 239.695 5.280 7.711 773 3HE MET 101 HE3 MET 101 239.069 6.794 8.363 774 H ARG 102 HN ARG 102 237.692 9.577 6.869 775 HA ARG 102 HA ARG 102 236.275 11.983 6.249 776 1HB ARG 102 HB2 ARG 102 236.523 12.199 8.715 777 2HB ARG 102 HB1 ARG 102 238.267 12.074 8.531 778 1HG ARG 102 HG2 ARG 102 237.740 14.109 6.836 779 2HG ARG 102 HG1 ARG 102 236.467 14.343 8.033 780 1HD ARG 102 HD2 ARG 102 239.387 14.024 8.703 781 2HD ARG 102 HD1 ARG 102 238.576 15.579 8.522 782 HE ARG 102 HE ARG 102 237.193 13.965 10.384 783 1HH1 ARG 102 HH11 ARG 102 240.111 15.850 10.047 784 2HH1 ARG 102 HH12 ARG 102 240.227 16.203 11.738 785 1HH2 ARG 102 HH21 ARG 102 237.343 14.429 12.608 786 2HH2 ARG 102 HH22 ARG 102 238.655 15.396 13.193 787 HA PRO 103 HA PRO 103 240.030 11.329 3.702 788 1HB PRO 103 HB2 PRO 103 239.013 12.370 1.429 789 2HB PRO 103 HB1 PRO 103 238.659 10.718 1.951 790 1HG PRO 103 HG2 PRO 103 237.007 13.198 2.275 791 2HG PRO 103 HG1 PRO 103 236.501 11.582 1.746 792 1HD PRO 103 HD2 PRO 103 236.130 12.454 4.282 793 2HD PRO 103 HD1 PRO 103 236.459 10.752 3.905 794 H CYS 104 HN CYS 104 241.482 12.804 2.663 795 HA CYS 104 HA CYS 104 240.926 15.648 2.958 796 1HB CYS 104 HB2 CYS 104 242.435 14.245 4.874 797 2HB CYS 104 HB1 CYS 104 243.601 15.140 3.905 798 HG CYS 104 HG CYS 104 241.653 16.337 5.901 799 H TRP 105 HN TRP 105 241.548 16.666 1.182 800 HA TRP 105 HA TRP 105 243.302 15.305 -0.696 801 1HB TRP 105 HB2 TRP 105 241.767 17.895 -1.010 802 2HB TRP 105 HB1 TRP 105 242.583 17.009 -2.295 803 HD1 TRP 105 HD1 TRP 105 240.004 15.838 0.385 804 HE1 TRP 105 HE1 TRP 105 238.120 14.574 -0.834 805 HE3 TRP 105 HE3 TRP 105 241.657 16.372 -4.424 806 HZ2 TRP 105 HZ2 TRP 105 237.432 13.896 -3.487 807 HZ3 TRP 105 HZ3 TRP 105 240.328 15.386 -6.243 808 HH2 TRP 105 HH2 TRP 105 238.259 14.173 -5.782 809 H PHE 106 HN PHE 106 245.403 15.751 -0.890 810 HA PHE 106 HA PHE 106 246.374 18.422 -0.183 811 1HB PHE 106 HB2 PHE 106 247.487 15.838 0.931 812 2HB PHE 106 HB1 PHE 106 248.278 17.403 1.074 813 HD1 PHE 106 HD1 PHE 106 246.146 19.217 1.741 814 HD2 PHE 106 HD2 PHE 106 246.774 15.209 3.023 815 HE1 PHE 106 HE1 PHE 106 244.876 19.680 3.796 816 HE2 PHE 106 HE2 PHE 106 245.503 15.663 5.080 817 HZ PHE 106 HZ PHE 106 244.552 17.901 5.469 818 H GLN 107 HN GLN 107 249.082 17.979 -0.474 819 HA GLN 107 HA GLN 107 249.259 17.631 -3.343 820 1HB GLN 107 HB2 GLN 107 251.351 18.444 -1.318 821 2HB GLN 107 HB1 GLN 107 251.571 18.455 -3.063 822 1HG GLN 107 HG2 GLN 107 251.071 20.646 -2.690 823 2HG GLN 107 HG1 GLN 107 249.461 20.002 -3.013 824 1HE2 GLN 107 HE21 GLN 107 248.093 21.061 -1.765 825 2HE2 GLN 107 HE22 GLN 107 248.282 21.353 -0.073 826 H LEU 108 HN LEU 108 250.968 16.356 -4.324 827 HA LEU 108 HA LEU 108 251.065 13.709 -3.209 828 1HB LEU 108 HB2 LEU 108 251.909 13.016 -5.280 829 2HB LEU 108 HB1 LEU 108 250.823 14.333 -5.676 830 HG LEU 108 HG LEU 108 253.832 14.550 -5.512 831 1HD1 LEU 108 HD11 LEU 108 251.946 13.982 -7.732 832 2HD1 LEU 108 HD12 LEU 108 253.587 13.396 -7.460 833 3HD1 LEU 108 HD13 LEU 108 253.323 15.034 -8.060 834 1HD2 LEU 108 HD21 LEU 108 253.424 16.744 -6.621 835 2HD2 LEU 108 HD22 LEU 108 252.832 16.654 -4.962 836 3HD2 LEU 108 HD23 LEU 108 251.702 16.526 -6.310 837 H ASP 109 HN ASP 109 252.875 16.378 -2.586 838 HA ASP 109 HA ASP 109 255.269 14.771 -1.999 839 1HB ASP 109 HB2 ASP 109 255.585 16.609 -3.694 840 2HB ASP 109 HB1 ASP 109 255.185 17.765 -2.426 841 H GLN 110 HN GLN 110 252.719 15.400 -0.459 842 HA GLN 110 HA GLN 110 254.087 16.167 1.997 843 1HB GLN 110 HB2 GLN 110 251.620 17.484 0.891 844 2HB GLN 110 HB1 GLN 110 252.009 17.534 2.605 845 1HG GLN 110 HG2 GLN 110 254.044 18.396 0.603 846 2HG GLN 110 HG1 GLN 110 252.722 19.478 1.035 847 1HE2 GLN 110 HE21 GLN 110 255.436 20.013 1.506 848 2HE2 GLN 110 HE22 GLN 110 255.685 20.081 3.214 849 H ILE 111 HN ILE 111 252.784 13.703 0.702 850 HA ILE 111 HA ILE 111 250.568 13.112 2.435 851 HB ILE 111 HB ILE 111 251.849 10.695 1.512 852 1HG1 ILE 111 HG12 ILE 111 251.048 11.326 -0.961 853 2HG1 ILE 111 HG11 ILE 111 251.622 12.910 -0.451 854 1HG2 ILE 111 HG21 ILE 111 249.329 11.602 2.042 855 2HG2 ILE 111 HG22 ILE 111 249.754 10.046 1.327 856 3HG2 ILE 111 HG23 ILE 111 249.325 11.406 0.289 857 1HD1 ILE 111 HD11 ILE 111 253.149 10.347 -0.676 858 2HD1 ILE 111 HD12 ILE 111 253.752 11.712 0.263 859 3HD1 ILE 111 HD13 ILE 111 253.461 11.890 -1.468 860 HA PRO 112 HA PRO 112 253.244 11.886 5.768 861 1HB PRO 112 HB2 PRO 112 251.458 11.995 7.726 862 2HB PRO 112 HB1 PRO 112 251.922 13.472 6.871 863 1HG PRO 112 HG2 PRO 112 249.465 11.794 6.557 864 2HG PRO 112 HG1 PRO 112 249.625 13.558 6.522 865 1HD PRO 112 HD2 PRO 112 249.504 11.867 4.294 866 2HD PRO 112 HD1 PRO 112 250.036 13.560 4.293 867 H PHE 113 HN PHE 113 253.777 9.790 5.232 868 HA PHE 113 HA PHE 113 251.924 7.629 5.533 869 1HB PHE 113 HB2 PHE 113 254.825 7.042 5.602 870 2HB PHE 113 HB1 PHE 113 253.544 6.272 4.688 871 HD1 PHE 113 HD1 PHE 113 252.597 9.056 3.459 872 HD2 PHE 113 HD2 PHE 113 256.316 6.991 3.765 873 HE1 PHE 113 HE1 PHE 113 253.406 10.174 1.427 874 HE2 PHE 113 HE2 PHE 113 257.117 8.110 1.738 875 HZ PHE 113 HZ PHE 113 255.662 9.715 0.563 876 H LYS 114 HN LYS 114 253.922 9.384 7.683 877 HA LYS 114 HA LYS 114 254.426 7.362 9.599 878 1HB LYS 114 HB2 LYS 114 254.459 10.365 9.645 879 2HB LYS 114 HB1 LYS 114 254.627 9.457 11.141 880 1HG LYS 114 HG2 LYS 114 256.401 9.031 8.752 881 2HG LYS 114 HG1 LYS 114 256.769 10.171 10.048 882 1HD LYS 114 HD2 LYS 114 257.017 8.473 11.632 883 2HD LYS 114 HD1 LYS 114 256.150 7.297 10.642 884 1HE LYS 114 HE2 LYS 114 257.973 6.818 9.371 885 2HE LYS 114 HE1 LYS 114 258.627 8.450 9.501 886 1HZ LYS 114 HZ1 LYS 114 258.922 7.690 11.993 887 2HZ LYS 114 HZ2 LYS 114 260.089 7.351 10.816 888 3HZ LYS 114 HZ3 LYS 114 258.981 6.159 11.276 889 H ASP 115 HN ASP 115 251.746 9.411 8.842 890 HA ASP 115 HA ASP 115 250.362 8.588 11.273 891 1HB ASP 115 HB2 ASP 115 249.988 10.836 9.339 892 2HB ASP 115 HB1 ASP 115 248.603 10.273 10.270 893 H MET 116 HN MET 116 250.896 6.794 9.030 894 HA MET 116 HA MET 116 248.118 6.094 8.399 895 1HB MET 116 HB2 MET 116 250.440 6.320 6.521 896 2HB MET 116 HB1 MET 116 249.165 5.153 6.196 897 1HG MET 116 HG2 MET 116 247.692 6.724 5.589 898 2HG MET 116 HG1 MET 116 248.231 7.859 6.823 899 1HE MET 116 HE1 MET 116 249.559 6.330 3.223 900 2HE MET 116 HE2 MET 116 250.683 6.110 4.564 901 3HE MET 116 HE3 MET 116 251.060 7.255 3.282 902 H TRP 117 HN TRP 117 251.139 4.482 7.475 903 HA TRP 117 HA TRP 117 250.734 2.414 9.472 904 1HB TRP 117 HB2 TRP 117 250.362 1.940 6.522 905 2HB TRP 117 HB1 TRP 117 250.843 0.641 7.602 906 HD1 TRP 117 HD1 TRP 117 247.904 1.540 5.974 907 HE1 TRP 117 HE1 TRP 117 245.768 1.064 7.327 908 HE3 TRP 117 HE3 TRP 117 249.975 1.046 10.625 909 HZ2 TRP 117 HZ2 TRP 117 245.053 0.549 10.006 910 HZ3 TRP 117 HZ3 TRP 117 248.495 0.562 12.527 911 HH2 TRP 117 HH2 TRP 117 246.084 0.319 12.223 912 HA PRO 118 HA PRO 118 255.118 2.013 9.104 913 1HB PRO 118 HB2 PRO 118 255.573 -0.523 9.821 914 2HB PRO 118 HB1 PRO 118 254.928 0.661 10.961 915 1HG PRO 118 HG2 PRO 118 253.483 -1.453 9.411 916 2HG PRO 118 HG1 PRO 118 253.287 -0.980 11.109 917 1HD PRO 118 HD2 PRO 118 251.637 -0.138 9.094 918 2HD PRO 118 HD1 PRO 118 251.921 0.781 10.584 919 H ASP 119 HN ASP 119 253.263 0.914 6.705 920 HA ASP 119 HA ASP 119 255.523 -0.343 5.297 921 1HB ASP 119 HB2 ASP 119 253.741 -1.483 3.895 922 2HB ASP 119 HB1 ASP 119 253.876 -2.040 5.560 923 H ASP 120 HN ASP 120 253.000 2.039 5.247 924 HA ASP 120 HA ASP 120 252.659 2.720 2.646 925 1HB ASP 120 HB2 ASP 120 252.928 4.475 5.062 926 2HB ASP 120 HB1 ASP 120 252.465 5.104 3.481 927 H SER 121 HN SER 121 255.321 3.961 4.667 928 HA SER 121 HA SER 121 256.561 5.467 2.655 929 1HB SER 121 HB2 SER 121 258.192 4.132 4.785 930 2HB SER 121 HB1 SER 121 258.311 5.773 4.148 931 HG SER 121 HG SER 121 257.196 6.280 5.854 932 H TYR 122 HN TYR 122 256.397 2.068 3.041 933 HA TYR 122 HA TYR 122 258.843 1.518 1.620 934 1HB TYR 122 HB2 TYR 122 256.612 -0.289 2.561 935 2HB TYR 122 HB1 TYR 122 258.082 -0.854 1.776 936 HD1 TYR 122 HD1 TYR 122 259.949 -1.375 3.066 937 HD2 TYR 122 HD2 TYR 122 256.926 1.121 4.719 938 HE1 TYR 122 HE1 TYR 122 261.090 -1.444 5.243 939 HE2 TYR 122 HE2 TYR 122 258.059 1.060 6.899 940 HH TYR 122 HH TYR 122 260.475 0.662 7.708 941 H TRP 123 HN TRP 123 255.420 1.773 0.866 942 HA TRP 123 HA TRP 123 256.071 0.950 -1.873 943 1HB TRP 123 HB2 TRP 123 253.710 0.394 -2.186 944 2HB TRP 123 HB1 TRP 123 254.423 -0.509 -0.857 945 HD1 TRP 123 HD1 TRP 123 253.612 0.145 1.639 946 HE1 TRP 123 HE1 TRP 123 251.418 1.223 2.460 947 HE3 TRP 123 HE3 TRP 123 251.963 2.111 -2.782 948 HZ2 TRP 123 HZ2 TRP 123 249.273 2.733 1.370 949 HZ3 TRP 123 HZ3 TRP 123 249.834 3.346 -2.802 950 HH2 TRP 123 HH2 TRP 123 248.525 3.635 -0.774 951 H PHE 124 HN PHE 124 255.495 3.689 -0.104 952 HA PHE 124 HA PHE 124 253.877 5.127 -1.983 953 1HB PHE 124 HB2 PHE 124 255.186 5.676 0.590 954 2HB PHE 124 HB1 PHE 124 255.147 7.057 -0.501 955 HD1 PHE 124 HD1 PHE 124 253.369 8.483 -0.256 956 HD2 PHE 124 HD2 PHE 124 252.826 4.357 0.636 957 HE1 PHE 124 HE1 PHE 124 251.062 8.941 0.419 958 HE2 PHE 124 HE2 PHE 124 250.505 4.813 1.314 959 HZ PHE 124 HZ PHE 124 249.621 7.108 1.207 960 HA PRO 125 HA PRO 125 258.374 7.187 -2.767 961 1HB PRO 125 HB2 PRO 125 259.737 4.532 -2.542 962 2HB PRO 125 HB1 PRO 125 260.366 6.151 -2.211 963 1HG PRO 125 HG2 PRO 125 259.636 4.558 -0.213 964 2HG PRO 125 HG1 PRO 125 259.285 6.297 -0.162 965 1HD PRO 125 HD2 PRO 125 257.451 4.007 -0.659 966 2HD PRO 125 HD1 PRO 125 257.125 5.571 0.116 967 H LEU 126 HN LEU 126 257.523 3.868 -3.768 968 HA LEU 126 HA LEU 126 258.601 4.266 -6.405 969 1HB LEU 126 HB2 LEU 126 257.492 2.077 -6.907 970 2HB LEU 126 HB1 LEU 126 258.668 2.038 -5.607 971 HG LEU 126 HG LEU 126 256.104 2.531 -4.462 972 1HD1 LEU 126 HD11 LEU 126 255.034 1.584 -6.362 973 2HD1 LEU 126 HD12 LEU 126 255.046 0.347 -5.105 974 3HD1 LEU 126 HD13 LEU 126 256.198 0.262 -6.438 975 1HD2 LEU 126 HD21 LEU 126 258.236 0.463 -4.340 976 2HD2 LEU 126 HD22 LEU 126 256.671 0.101 -3.615 977 3HD2 LEU 126 HD23 LEU 126 257.593 1.501 -3.068 978 H LEU 127 HN LEU 127 255.492 4.525 -4.844 979 HA LEU 127 HA LEU 127 253.834 4.615 -7.103 980 1HB LEU 127 HB2 LEU 127 253.600 6.049 -4.456 981 2HB LEU 127 HB1 LEU 127 252.326 5.987 -5.652 982 HG LEU 127 HG LEU 127 252.941 4.133 -3.575 983 1HD1 LEU 127 HD11 LEU 127 250.792 4.482 -5.622 984 2HD1 LEU 127 HD12 LEU 127 250.728 4.758 -3.881 985 3HD1 LEU 127 HD13 LEU 127 250.781 3.112 -4.512 986 1HD2 LEU 127 HD21 LEU 127 252.750 2.035 -4.893 987 2HD2 LEU 127 HD22 LEU 127 254.278 2.878 -5.129 988 3HD2 LEU 127 HD23 LEU 127 253.020 2.977 -6.359 989 H LEU 128 HN LEU 128 255.379 7.198 -5.254 990 HA LEU 128 HA LEU 128 254.609 9.350 -6.876 991 1HB LEU 128 HB2 LEU 128 256.668 8.859 -4.807 992 2HB LEU 128 HB1 LEU 128 256.958 10.221 -5.872 993 HG LEU 128 HG LEU 128 254.359 9.893 -4.394 994 1HD1 LEU 128 HD11 LEU 128 255.599 11.782 -2.967 995 2HD1 LEU 128 HD12 LEU 128 256.992 10.787 -3.395 996 3HD1 LEU 128 HD13 LEU 128 255.631 10.072 -2.533 997 1HD2 LEU 128 HD21 LEU 128 254.910 11.521 -6.422 998 2HD2 LEU 128 HD22 LEU 128 255.562 12.505 -5.112 999 3HD2 LEU 128 HD23 LEU 128 253.872 12.003 -5.081 1000 H GLN 129 HN GLN 129 257.149 6.996 -7.210 1001 HA GLN 129 HA GLN 129 258.523 8.472 -9.287 1002 1HB GLN 129 HB2 GLN 129 259.609 6.907 -7.573 1003 2HB GLN 129 HB1 GLN 129 258.982 5.588 -8.553 1004 1HG GLN 129 HG2 GLN 129 261.228 5.944 -9.202 1005 2HG GLN 129 HG1 GLN 129 260.207 6.562 -10.499 1006 1HE2 GLN 129 HE21 GLN 129 262.829 7.320 -10.281 1007 2HE2 GLN 129 HE22 GLN 129 262.918 8.987 -9.833 1008 H LYS 130 HN LYS 130 255.683 6.894 -9.283 1009 HA LYS 130 HA LYS 130 254.345 5.977 -10.858 1010 1HB LYS 130 HB2 LYS 130 254.406 6.975 -12.892 1011 2HB LYS 130 HB1 LYS 130 255.595 7.997 -12.105 1012 1HG LYS 130 HG2 LYS 130 257.187 6.023 -13.059 1013 2HG LYS 130 HG1 LYS 130 255.911 6.045 -14.276 1014 1HD LYS 130 HD2 LYS 130 257.582 7.559 -15.014 1015 2HD LYS 130 HD1 LYS 130 256.242 8.539 -14.415 1016 1HE LYS 130 HE2 LYS 130 257.485 8.649 -12.212 1017 2HE LYS 130 HE1 LYS 130 258.865 7.953 -13.062 1018 1HZ LYS 130 HZ1 LYS 130 257.589 10.315 -14.225 1019 2HZ LYS 130 HZ2 LYS 130 259.215 9.850 -14.240 1020 3HZ LYS 130 HZ3 LYS 130 258.546 10.536 -12.847 1021 H LYS 131 HN LYS 131 256.726 4.484 -9.752 1022 HA LYS 131 HA LYS 131 257.017 2.468 -11.874 1023 1HB LYS 131 HB2 LYS 131 258.675 2.916 -9.385 1024 2HB LYS 131 HB1 LYS 131 258.947 1.640 -10.565 1025 1HG LYS 131 HG2 LYS 131 259.019 4.570 -11.240 1026 2HG LYS 131 HG1 LYS 131 260.441 3.630 -10.782 1027 1HD LYS 131 HD2 LYS 131 258.718 2.571 -12.957 1028 2HD LYS 131 HD1 LYS 131 259.734 3.969 -13.317 1029 1HE LYS 131 HE2 LYS 131 261.604 2.541 -12.191 1030 2HE LYS 131 HE1 LYS 131 260.527 1.192 -12.548 1031 1HZ LYS 131 HZ1 LYS 131 260.548 1.861 -14.882 1032 2HZ LYS 131 HZ2 LYS 131 262.108 1.513 -14.328 1033 3HZ LYS 131 HZ3 LYS 131 261.620 3.120 -14.525 1034 H LYS 132 HN LYS 132 256.965 0.199 -11.221 1035 HA LYS 132 HA LYS 132 255.009 -0.230 -9.067 1036 1HB LYS 132 HB2 LYS 132 255.615 -1.853 -11.543 1037 2HB LYS 132 HB1 LYS 132 254.533 -2.389 -10.266 1038 1HG LYS 132 HG2 LYS 132 252.968 -1.472 -11.591 1039 2HG LYS 132 HG1 LYS 132 253.464 0.020 -10.789 1040 1HD LYS 132 HD2 LYS 132 254.924 0.582 -12.612 1041 2HD LYS 132 HD1 LYS 132 254.641 -0.983 -13.377 1042 1HE LYS 132 HE2 LYS 132 252.285 -0.404 -13.689 1043 2HE LYS 132 HE1 LYS 132 252.565 1.156 -12.919 1044 1HZ LYS 132 HZ1 LYS 132 254.240 1.567 -14.725 1045 2HZ LYS 132 HZ2 LYS 132 252.625 1.524 -15.230 1046 3HZ LYS 132 HZ3 LYS 132 253.635 0.195 -15.509 1047 H PHE 133 HN PHE 133 255.551 -1.417 -7.340 1048 HA PHE 133 HA PHE 133 257.875 -3.201 -7.507 1049 1HB PHE 133 HB2 PHE 133 257.494 -0.914 -5.597 1050 2HB PHE 133 HB1 PHE 133 258.437 -2.319 -5.123 1051 HD1 PHE 133 HD1 PHE 133 258.170 0.071 -7.980 1052 HD2 PHE 133 HD2 PHE 133 260.699 -2.235 -5.451 1053 HE1 PHE 133 HE1 PHE 133 260.146 1.024 -9.092 1054 HE2 PHE 133 HE2 PHE 133 262.679 -1.286 -6.560 1055 HZ PHE 133 HZ PHE 133 262.404 0.347 -8.383 1056 H HIS 134 HN HIS 134 258.037 -4.619 -5.560 1057 HA HIS 134 HA HIS 134 255.401 -5.192 -4.387 1058 1HB HIS 134 HB2 HIS 134 255.826 -6.840 -6.137 1059 2HB HIS 134 HB1 HIS 134 257.406 -7.199 -5.448 1060 HD1 HIS 134 HD1 HIS 134 254.193 -8.601 -5.610 1061 HD2 HIS 134 HD2 HIS 134 256.939 -8.088 -2.534 1062 HE1 HIS 134 HE1 HIS 134 253.546 -10.272 -3.847 1063 HE2 HIS 134 HE2 HIS 134 255.286 -10.014 -2.042 1064 H GLY 135 HN GLY 135 255.445 -5.223 -2.212 1065 1HA GLY 135 HA2 GLY 135 258.061 -5.712 -0.929 1066 2HA GLY 135 HA1 GLY 135 256.975 -4.449 -0.379 1067 H TYR 136 HN TYR 136 258.161 -7.117 0.666 1068 HA TYR 136 HA TYR 136 255.645 -8.215 1.729 1069 1HB TYR 136 HB2 TYR 136 257.306 -9.682 0.353 1070 2HB TYR 136 HB1 TYR 136 258.271 -9.673 1.823 1071 HD1 TYR 136 HD1 TYR 136 256.606 -11.892 0.178 1072 HD2 TYR 136 HD2 TYR 136 256.116 -9.850 3.877 1073 HE1 TYR 136 HE1 TYR 136 255.297 -13.784 1.044 1074 HE2 TYR 136 HE2 TYR 136 254.805 -11.730 4.747 1075 HH TYR 136 HH TYR 136 254.824 -14.554 3.868 1076 H PHE 137 HN PHE 137 255.246 -7.644 3.775 1077 HA PHE 137 HA PHE 137 257.544 -7.060 5.528 1078 1HB PHE 137 HB2 PHE 137 254.795 -5.862 5.839 1079 2HB PHE 137 HB1 PHE 137 256.298 -5.344 6.593 1080 HD1 PHE 137 HD1 PHE 137 253.994 -4.469 4.218 1081 HD2 PHE 137 HD2 PHE 137 258.204 -4.846 4.698 1082 HE1 PHE 137 HE1 PHE 137 254.344 -2.854 2.395 1083 HE2 PHE 137 HE2 PHE 137 258.562 -3.232 2.877 1084 HZ PHE 137 HZ PHE 137 256.629 -2.234 1.722 1085 H LYS 138 HN LYS 138 257.764 -8.360 7.221 1086 HA LYS 138 HA LYS 138 255.612 -10.160 7.988 1087 1HB LYS 138 HB2 LYS 138 258.336 -10.472 7.838 1088 2HB LYS 138 HB1 LYS 138 258.093 -10.217 9.561 1089 1HG LYS 138 HG2 LYS 138 256.157 -12.019 9.083 1090 2HG LYS 138 HG1 LYS 138 257.330 -12.490 7.852 1091 1HD LYS 138 HD2 LYS 138 258.809 -13.254 9.374 1092 2HD LYS 138 HD1 LYS 138 258.458 -11.955 10.516 1093 1HE LYS 138 HE2 LYS 138 256.479 -13.071 11.273 1094 2HE LYS 138 HE1 LYS 138 256.624 -14.290 10.009 1095 1HZ LYS 138 HZ1 LYS 138 258.590 -13.886 12.198 1096 2HZ LYS 138 HZ2 LYS 138 258.623 -15.110 11.031 1097 3HZ LYS 138 HZ3 LYS 138 257.390 -15.077 12.188 1098 H PHE 139 HN PHE 139 254.326 -9.812 9.734 1099 HA PHE 139 HA PHE 139 255.032 -7.533 11.440 1100 1HB PHE 139 HB2 PHE 139 252.557 -7.758 12.156 1101 2HB PHE 139 HB1 PHE 139 252.926 -7.077 10.579 1102 HD1 PHE 139 HD1 PHE 139 251.093 -9.509 12.376 1103 HD2 PHE 139 HD2 PHE 139 252.788 -8.671 8.564 1104 HE1 PHE 139 HE1 PHE 139 249.564 -11.136 11.344 1105 HE2 PHE 139 HE2 PHE 139 251.263 -10.302 7.528 1106 HZ PHE 139 HZ PHE 139 249.649 -11.533 8.916 1107 H GLN 140 HN GLN 140 254.519 -7.610 13.705 1108 HA GLN 140 HA GLN 140 255.170 -10.216 14.861 1109 1HB GLN 140 HB2 GLN 140 256.672 -8.758 15.787 1110 2HB GLN 140 HB1 GLN 140 255.593 -7.383 15.635 1111 1HG GLN 140 HG2 GLN 140 256.038 -7.892 17.959 1112 2HG GLN 140 HG1 GLN 140 254.335 -8.142 17.578 1113 1HE2 GLN 140 HE21 GLN 140 253.784 -9.654 19.031 1114 2HE2 GLN 140 HE22 GLN 140 254.515 -11.213 19.157 1115 H GLY 141 HN GLY 141 252.654 -7.833 14.700 1116 1HA GLY 141 HA2 GLY 141 250.857 -9.639 16.119 1117 2HA GLY 141 HA1 GLY 141 251.070 -8.041 16.816 1118 H GLN 142 HN GLN 142 251.201 -6.473 14.554 1119 HA GLN 142 HA GLN 142 249.335 -6.895 12.557 1120 1HB GLN 142 HB2 GLN 142 248.140 -6.158 15.134 1121 2HB GLN 142 HB1 GLN 142 247.653 -5.115 13.805 1122 1HG GLN 142 HG2 GLN 142 247.562 -7.949 13.138 1123 2HG GLN 142 HG1 GLN 142 246.506 -7.507 14.480 1124 1HE2 GLN 142 HE21 GLN 142 245.676 -5.025 13.813 1125 2HE2 GLN 142 HE22 GLN 142 244.765 -5.065 12.346 1126 H ASP 143 HN ASP 143 250.728 -4.581 14.805 1127 HA ASP 143 HA ASP 143 250.862 -2.606 12.625 1128 1HB ASP 143 HB2 ASP 143 250.760 -2.246 15.618 1129 2HB ASP 143 HB1 ASP 143 251.222 -0.946 14.522 1130 H THR 144 HN THR 144 252.705 -4.586 14.754 1131 HA THR 144 HA THR 144 255.140 -3.038 14.381 1132 HB THR 144 HB THR 144 254.502 -5.543 15.928 1133 HG1 THR 144 HG1 THR 144 255.162 -4.180 17.660 1134 1HG2 THR 144 HG21 THR 144 257.204 -4.254 15.622 1135 2HG2 THR 144 HG22 THR 144 256.738 -5.859 15.057 1136 3HG2 THR 144 HG23 THR 144 256.789 -5.512 16.785 1137 H ILE 145 HN ILE 145 256.761 -3.526 13.013 1138 HA ILE 145 HA ILE 145 256.397 -5.911 11.336 1139 HB ILE 145 HB ILE 145 257.903 -3.388 10.641 1140 1HG1 ILE 145 HG12 ILE 145 255.281 -4.436 9.548 1141 2HG1 ILE 145 HG11 ILE 145 255.425 -3.125 10.714 1142 1HG2 ILE 145 HG21 ILE 145 258.977 -4.813 9.267 1143 2HG2 ILE 145 HG22 ILE 145 257.501 -4.717 8.306 1144 3HG2 ILE 145 HG23 ILE 145 257.739 -6.058 9.424 1145 1HD1 ILE 145 HD11 ILE 145 256.781 -1.887 9.020 1146 2HD1 ILE 145 HD12 ILE 145 255.098 -2.161 8.572 1147 3HD1 ILE 145 HD13 ILE 145 256.371 -3.153 7.863 1148 H LEU 146 HN LEU 146 257.986 -7.383 11.168 1149 HA LEU 146 HA LEU 146 260.467 -6.856 12.666 1150 1HB LEU 146 HB2 LEU 146 259.383 -9.604 12.150 1151 2HB LEU 146 HB1 LEU 146 260.535 -9.091 13.366 1152 HG LEU 146 HG LEU 146 257.799 -7.956 13.556 1153 1HD1 LEU 146 HD11 LEU 146 258.300 -10.803 13.462 1154 2HD1 LEU 146 HD12 LEU 146 256.772 -9.925 13.535 1155 3HD1 LEU 146 HD13 LEU 146 257.644 -10.305 15.021 1156 1HD2 LEU 146 HD21 LEU 146 259.991 -7.778 15.095 1157 2HD2 LEU 146 HD22 LEU 146 259.219 -9.179 15.837 1158 3HD2 LEU 146 HD23 LEU 146 258.350 -7.648 15.726 1159 H ASP 147 HN ASP 147 259.170 -7.434 9.611 1160 HA ASP 147 HA ASP 147 261.812 -7.744 8.483 1161 1HB ASP 147 HB2 ASP 147 260.197 -10.022 8.892 1162 2HB ASP 147 HB1 ASP 147 260.112 -9.670 7.169 1163 H TYR 148 HN TYR 148 261.974 -6.705 6.549 1164 HA TYR 148 HA TYR 148 259.509 -6.185 5.067 1165 1HB TYR 148 HB2 TYR 148 259.985 -3.831 4.816 1166 2HB TYR 148 HB1 TYR 148 259.899 -4.235 6.526 1167 HD1 TYR 148 HD1 TYR 148 262.234 -3.485 3.751 1168 HD2 TYR 148 HD2 TYR 148 261.749 -3.867 7.961 1169 HE1 TYR 148 HE1 TYR 148 264.453 -2.481 4.093 1170 HE2 TYR 148 HE2 TYR 148 263.965 -2.864 8.315 1171 HH TYR 148 HH TYR 148 266.246 -2.562 5.946 1172 H THR 149 HN THR 149 259.713 -6.392 2.923 1173 HA THR 149 HA THR 149 262.422 -6.309 1.776 1174 HB THR 149 HB THR 149 261.134 -8.103 0.165 1175 HG1 THR 149 HG1 THR 149 260.397 -8.740 2.825 1176 1HG2 THR 149 HG21 THR 149 263.125 -8.974 0.644 1177 2HG2 THR 149 HG22 THR 149 262.282 -9.790 1.961 1178 3HG2 THR 149 HG23 THR 149 263.146 -8.283 2.266 1179 H LEU 150 HN LEU 150 262.588 -5.478 -0.298 1180 HA LEU 150 HA LEU 150 260.121 -4.452 -1.513 1181 1HB LEU 150 HB2 LEU 150 262.609 -2.915 -0.838 1182 2HB LEU 150 HB1 LEU 150 261.553 -2.396 -2.138 1183 HG LEU 150 HG LEU 150 259.802 -2.771 -0.033 1184 1HD1 LEU 150 HD11 LEU 150 261.041 -2.815 1.829 1185 2HD1 LEU 150 HD12 LEU 150 261.223 -1.081 1.560 1186 3HD1 LEU 150 HD13 LEU 150 262.475 -2.196 1.010 1187 1HD2 LEU 150 HD21 LEU 150 259.788 -0.276 0.051 1188 2HD2 LEU 150 HD22 LEU 150 259.645 -0.949 -1.573 1189 3HD2 LEU 150 HD23 LEU 150 261.185 -0.284 -1.026 1190 H ARG 151 HN ARG 151 259.941 -5.061 -3.550 1191 HA ARG 151 HA ARG 151 262.392 -5.515 -5.120 1192 1HB ARG 151 HB2 ARG 151 259.867 -7.154 -5.360 1193 2HB ARG 151 HB1 ARG 151 261.403 -7.441 -6.167 1194 1HG ARG 151 HG2 ARG 151 262.322 -7.637 -3.735 1195 2HG ARG 151 HG1 ARG 151 260.630 -7.934 -3.330 1196 1HD ARG 151 HD2 ARG 151 261.160 -10.074 -3.781 1197 2HD ARG 151 HD1 ARG 151 260.921 -9.574 -5.455 1198 HE ARG 151 HE ARG 151 263.598 -9.127 -4.600 1199 1HH1 ARG 151 HH11 ARG 151 261.401 -11.617 -5.672 1200 2HH1 ARG 151 HH12 ARG 151 262.658 -12.630 -6.302 1201 1HH2 ARG 151 HH21 ARG 151 265.252 -10.457 -5.427 1202 2HH2 ARG 151 HH22 ARG 151 264.844 -11.971 -6.162 1203 H GLU 152 HN GLU 152 262.105 -5.301 -7.452 1204 HA GLU 152 HA GLU 152 260.116 -3.233 -8.062 1205 1HB GLU 152 HB2 GLU 152 261.517 -2.662 -9.963 1206 2HB GLU 152 HB1 GLU 152 262.487 -2.700 -8.496 1207 1HG GLU 152 HG2 GLU 152 263.570 -4.657 -9.110 1208 2HG GLU 152 HG1 GLU 152 262.328 -5.091 -10.284 1209 H VAL 153 HN VAL 153 258.793 -3.352 -9.896 1210 HA VAL 153 HA VAL 153 258.751 -5.854 -11.400 1211 HB VAL 153 HB VAL 153 256.263 -6.028 -11.088 1212 1HG1 VAL 153 HG11 VAL 153 256.446 -7.055 -8.799 1213 2HG1 VAL 153 HG12 VAL 153 258.097 -6.438 -8.736 1214 3HG1 VAL 153 HG13 VAL 153 257.641 -7.609 -9.973 1215 1HG2 VAL 153 HG21 VAL 153 255.162 -4.900 -9.336 1216 2HG2 VAL 153 HG22 VAL 153 256.087 -3.661 -10.185 1217 3HG2 VAL 153 HG23 VAL 153 256.678 -4.312 -8.656 1218 H ASP 154 HN ASP 154 257.696 -5.719 -13.404 1219 HA ASP 154 HA ASP 154 256.223 -3.466 -14.267 1220 1HB ASP 154 HB2 ASP 154 258.422 -2.364 -14.119 1221 2HB ASP 154 HB1 ASP 154 259.099 -3.573 -15.204 1222 H THR 155 HN THR 155 258.624 -5.782 -15.535 1223 HA THR 155 HA THR 155 256.946 -6.323 -17.838 1224 HB THR 155 HB THR 155 259.437 -7.856 -17.183 1225 HG1 THR 155 HG1 THR 155 259.423 -5.286 -18.372 1226 1HG2 THR 155 HG21 THR 155 257.775 -7.682 -19.434 1227 2HG2 THR 155 HG22 THR 155 259.321 -8.518 -19.284 1228 3HG2 THR 155 HG23 THR 155 259.273 -6.848 -19.847 1229 H VAL 156 HN VAL 156 256.245 -8.459 -18.416 1230 HA VAL 156 HA VAL 156 255.547 -10.059 -16.054 1231 HB VAL 156 HB VAL 156 254.308 -10.220 -18.802 1232 1HG1 VAL 156 HG11 VAL 156 252.823 -11.713 -17.952 1233 2HG1 VAL 156 HG12 VAL 156 252.885 -11.023 -16.331 1234 3HG1 VAL 156 HG13 VAL 156 254.185 -12.073 -16.893 1235 1HG2 VAL 156 HG21 VAL 156 252.475 -8.880 -17.927 1236 2HG2 VAL 156 HG22 VAL 156 253.991 -7.982 -17.845 1237 3HG2 VAL 156 HG23 VAL 156 253.317 -8.708 -16.387 Start of MODEL 12 1 1H MET 1 HT1 MET 1 250.426 -21.113 3.203 2 2H MET 1 HT2 MET 1 249.939 -21.216 1.560 3 3H MET 1 HT3 MET 1 251.603 -21.305 1.971 4 HA MET 1 HA MET 1 250.926 -23.455 1.503 5 1HB MET 1 HB2 MET 1 251.334 -22.665 4.345 6 2HB MET 1 HB1 MET 1 250.886 -24.336 4.028 7 1HG MET 1 HG2 MET 1 252.877 -24.840 3.105 8 2HG MET 1 HG1 MET 1 253.064 -23.249 2.370 9 1HE MET 1 HE1 MET 1 255.148 -21.260 4.590 10 2HE MET 1 HE2 MET 1 253.408 -20.983 4.656 11 3HE MET 1 HE3 MET 1 254.171 -21.436 3.132 12 H GLY 2 HN GLY 2 248.796 -22.092 4.016 13 1HA GLY 2 HA2 GLY 2 246.745 -24.057 3.224 14 2HA GLY 2 HA1 GLY 2 246.819 -23.252 4.785 15 H ALA 3 HN ALA 3 247.420 -20.648 3.483 16 HA ALA 3 HA ALA 3 245.305 -19.952 1.739 17 1HB ALA 3 HB1 ALA 3 243.822 -18.776 3.199 18 2HB ALA 3 HB2 ALA 3 244.864 -19.079 4.590 19 3HB ALA 3 HB3 ALA 3 244.007 -20.416 3.822 20 H SER 4 HN SER 4 244.874 -17.337 2.296 21 HA SER 4 HA SER 4 247.152 -15.886 3.115 22 1HB SER 4 HB2 SER 4 248.414 -16.296 1.266 23 2HB SER 4 HB1 SER 4 247.014 -16.702 0.275 24 HG SER 4 HG SER 4 248.337 -14.547 0.070 25 H ARG 5 HN ARG 5 246.044 -14.358 4.076 26 HA ARG 5 HA ARG 5 243.550 -13.376 3.331 27 1HB ARG 5 HB2 ARG 5 245.709 -11.907 4.854 28 2HB ARG 5 HB1 ARG 5 243.993 -11.528 4.863 29 1HG ARG 5 HG2 ARG 5 244.524 -14.286 5.602 30 2HG ARG 5 HG1 ARG 5 245.324 -13.128 6.666 31 1HD ARG 5 HD2 ARG 5 243.388 -12.875 7.727 32 2HD ARG 5 HD1 ARG 5 242.750 -12.113 6.272 33 HE ARG 5 HE ARG 5 242.214 -14.787 7.224 34 1HH1 ARG 5 HH11 ARG 5 242.117 -12.611 4.496 35 2HH1 ARG 5 HH12 ARG 5 240.900 -13.516 3.661 36 1HH2 ARG 5 HH21 ARG 5 240.617 -15.977 6.124 37 2HH2 ARG 5 HH22 ARG 5 240.048 -15.425 4.584 38 H LEU 6 HN LEU 6 243.454 -12.893 1.167 39 HA LEU 6 HA LEU 6 245.297 -10.961 0.028 40 1HB LEU 6 HB2 LEU 6 244.006 -13.064 -1.056 41 2HB LEU 6 HB1 LEU 6 242.874 -11.789 -1.466 42 HG LEU 6 HG LEU 6 245.771 -11.442 -2.125 43 1HD1 LEU 6 HD11 LEU 6 244.857 -13.718 -2.910 44 2HD1 LEU 6 HD12 LEU 6 245.650 -12.674 -4.089 45 3HD1 LEU 6 HD13 LEU 6 243.890 -12.767 -4.037 46 1HD2 LEU 6 HD21 LEU 6 243.509 -10.640 -3.873 47 2HD2 LEU 6 HD22 LEU 6 245.049 -9.835 -3.574 48 3HD2 LEU 6 HD23 LEU 6 243.758 -9.740 -2.377 49 H TYR 7 HN TYR 7 245.011 -8.884 0.340 50 HA TYR 7 HA TYR 7 242.272 -7.810 0.470 51 1HB TYR 7 HB2 TYR 7 244.700 -7.168 2.114 52 2HB TYR 7 HB1 TYR 7 243.442 -5.960 1.883 53 HD1 TYR 7 HD1 TYR 7 241.988 -5.784 3.653 54 HD2 TYR 7 HD2 TYR 7 243.546 -9.620 2.673 55 HE1 TYR 7 HE1 TYR 7 240.696 -6.774 5.496 56 HE2 TYR 7 HE2 TYR 7 242.257 -10.620 4.512 57 HH TYR 7 HH TYR 7 239.905 -9.761 5.792 58 H THR 8 HN THR 8 242.516 -5.245 0.248 59 HA THR 8 HA THR 8 244.183 -4.718 -2.130 60 HB THR 8 HB THR 8 242.387 -3.490 -3.121 61 HG1 THR 8 HG1 THR 8 241.278 -2.519 -1.571 62 1HG2 THR 8 HG21 THR 8 240.881 -5.145 -3.679 63 2HG2 THR 8 HG22 THR 8 240.920 -5.863 -2.070 64 3HG2 THR 8 HG23 THR 8 242.290 -6.067 -3.160 65 H LEU 9 HN LEU 9 244.474 -2.377 -2.553 66 HA LEU 9 HA LEU 9 244.208 -0.611 -0.262 67 1HB LEU 9 HB2 LEU 9 246.424 -1.967 -0.170 68 2HB LEU 9 HB1 LEU 9 246.927 -0.931 -1.491 69 HG LEU 9 HG LEU 9 246.234 -0.111 1.315 70 1HD1 LEU 9 HD11 LEU 9 248.511 -1.044 0.767 71 2HD1 LEU 9 HD12 LEU 9 248.485 0.564 1.490 72 3HD1 LEU 9 HD13 LEU 9 248.750 0.381 -0.244 73 1HD2 LEU 9 HD21 LEU 9 246.597 1.566 -1.145 74 2HD2 LEU 9 HD22 LEU 9 246.868 2.201 0.477 75 3HD2 LEU 9 HD23 LEU 9 245.275 1.597 0.022 76 H VAL 10 HN VAL 10 243.189 1.051 -1.270 77 HA VAL 10 HA VAL 10 244.262 1.939 -3.849 78 HB VAL 10 HB VAL 10 242.060 1.304 -4.233 79 1HG1 VAL 10 HG11 VAL 10 241.562 2.288 -1.523 80 2HG1 VAL 10 HG12 VAL 10 240.987 0.833 -2.336 81 3HG1 VAL 10 HG13 VAL 10 240.234 2.389 -2.675 82 1HG2 VAL 10 HG21 VAL 10 241.850 4.244 -3.640 83 2HG2 VAL 10 HG22 VAL 10 240.865 3.326 -4.777 84 3HG2 VAL 10 HG23 VAL 10 242.583 3.560 -5.091 85 H LEU 11 HN LEU 11 245.202 3.779 -3.963 86 HA LEU 11 HA LEU 11 244.620 5.859 -1.970 87 1HB LEU 11 HB2 LEU 11 247.085 4.482 -2.556 88 2HB LEU 11 HB1 LEU 11 247.260 6.192 -2.891 89 HG LEU 11 HG LEU 11 246.646 4.857 -0.266 90 1HD1 LEU 11 HD11 LEU 11 248.588 7.064 -0.510 91 2HD1 LEU 11 HD12 LEU 11 249.014 5.561 -1.326 92 3HD1 LEU 11 HD13 LEU 11 248.685 5.561 0.407 93 1HD2 LEU 11 HD21 LEU 11 246.622 7.425 0.443 94 2HD2 LEU 11 HD22 LEU 11 245.156 6.529 0.045 95 3HD2 LEU 11 HD23 LEU 11 245.906 7.575 -1.162 96 H VAL 12 HN VAL 12 243.650 7.472 -3.033 97 HA VAL 12 HA VAL 12 244.039 7.814 -5.865 98 HB VAL 12 HB VAL 12 242.493 9.629 -4.020 99 1HG1 VAL 12 HG11 VAL 12 242.405 10.773 -5.963 100 2HG1 VAL 12 HG12 VAL 12 241.163 9.588 -6.367 101 3HG1 VAL 12 HG13 VAL 12 242.817 9.360 -6.935 102 1HG2 VAL 12 HG21 VAL 12 240.622 8.041 -5.182 103 2HG2 VAL 12 HG22 VAL 12 241.279 7.788 -3.565 104 3HG2 VAL 12 HG23 VAL 12 241.938 6.893 -4.934 105 H LEU 13 HN LEU 13 246.377 8.202 -5.574 106 HA LEU 13 HA LEU 13 247.051 10.924 -4.723 107 1HB LEU 13 HB2 LEU 13 248.326 8.883 -3.942 108 2HB LEU 13 HB1 LEU 13 248.946 8.766 -5.576 109 HG LEU 13 HG LEU 13 250.599 10.104 -4.984 110 1HD1 LEU 13 HD11 LEU 13 250.136 12.517 -4.474 111 2HD1 LEU 13 HD12 LEU 13 248.424 12.127 -4.599 112 3HD1 LEU 13 HD13 LEU 13 249.481 11.904 -5.990 113 1HD2 LEU 13 HD21 LEU 13 249.184 9.896 -2.462 114 2HD2 LEU 13 HD22 LEU 13 250.130 11.379 -2.600 115 3HD2 LEU 13 HD23 LEU 13 250.912 9.812 -2.802 116 H GLN 14 HN GLN 14 247.085 12.453 -6.199 117 HA GLN 14 HA GLN 14 247.551 11.740 -9.010 118 1HB GLN 14 HB2 GLN 14 245.977 13.857 -7.640 119 2HB GLN 14 HB1 GLN 14 246.727 14.287 -9.170 120 1HG GLN 14 HG2 GLN 14 245.615 12.301 -10.188 121 2HG GLN 14 HG1 GLN 14 244.750 12.079 -8.667 122 1HE2 GLN 14 HE21 GLN 14 244.184 14.673 -7.989 123 2HE2 GLN 14 HE22 GLN 14 243.097 15.351 -9.146 124 HA PRO 15 HA PRO 15 251.465 13.764 -9.116 125 1HB PRO 15 HB2 PRO 15 251.385 15.098 -11.496 126 2HB PRO 15 HB1 PRO 15 251.630 13.354 -11.357 127 1HG PRO 15 HG2 PRO 15 249.124 14.872 -11.963 128 2HG PRO 15 HG1 PRO 15 249.743 13.388 -12.712 129 1HD PRO 15 HD2 PRO 15 247.788 13.341 -10.862 130 2HD PRO 15 HD1 PRO 15 249.007 12.054 -10.971 131 H GLN 16 HN GLN 16 249.240 15.247 -7.802 132 HA GLN 16 HA GLN 16 250.539 17.786 -7.628 133 1HB GLN 16 HB2 GLN 16 248.105 17.469 -9.239 134 2HB GLN 16 HB1 GLN 16 247.987 18.728 -8.017 135 1HG GLN 16 HG2 GLN 16 250.172 18.525 -10.076 136 2HG GLN 16 HG1 GLN 16 248.752 19.562 -10.201 137 1HE2 GLN 16 HE21 GLN 16 248.903 21.548 -9.424 138 2HE2 GLN 16 HE22 GLN 16 250.136 22.127 -8.363 139 H ARG 17 HN ARG 17 247.703 15.822 -6.830 140 HA ARG 17 HA ARG 17 248.003 16.625 -4.037 141 1HB ARG 17 HB2 ARG 17 245.201 16.435 -4.978 142 2HB ARG 17 HB1 ARG 17 245.908 17.485 -3.761 143 1HG ARG 17 HG2 ARG 17 246.989 18.707 -5.754 144 2HG ARG 17 HG1 ARG 17 245.782 17.860 -6.725 145 1HD ARG 17 HD2 ARG 17 244.067 18.776 -5.068 146 2HD ARG 17 HD1 ARG 17 245.350 19.852 -4.517 147 HE ARG 17 HE ARG 17 245.105 21.079 -6.438 148 1HH1 ARG 17 HH11 ARG 17 243.441 18.034 -6.813 149 2HH1 ARG 17 HH12 ARG 17 242.681 18.490 -8.301 150 1HH2 ARG 17 HH21 ARG 17 244.106 21.680 -8.394 151 2HH2 ARG 17 HH22 ARG 17 243.059 20.560 -9.198 152 H VAL 18 HN VAL 18 246.803 15.202 -2.541 153 HA VAL 18 HA VAL 18 246.254 12.531 -3.662 154 HB VAL 18 HB VAL 18 248.455 12.366 -2.724 155 1HG1 VAL 18 HG11 VAL 18 247.550 13.176 -0.005 156 2HG1 VAL 18 HG12 VAL 18 247.963 14.425 -1.179 157 3HG1 VAL 18 HG13 VAL 18 249.163 13.221 -0.716 158 1HG2 VAL 18 HG21 VAL 18 246.449 11.209 -0.791 159 2HG2 VAL 18 HG22 VAL 18 248.115 10.670 -1.000 160 3HG2 VAL 18 HG23 VAL 18 246.955 10.479 -2.315 161 H LEU 19 HN LEU 19 244.809 11.240 -2.414 162 HA LEU 19 HA LEU 19 243.215 12.758 -0.454 163 1HB LEU 19 HB2 LEU 19 242.017 12.474 -2.580 164 2HB LEU 19 HB1 LEU 19 242.227 10.737 -2.464 165 HG LEU 19 HG LEU 19 240.777 10.620 -0.547 166 1HD1 LEU 19 HD11 LEU 19 241.215 13.530 -0.502 167 2HD1 LEU 19 HD12 LEU 19 240.944 12.398 0.823 168 3HD1 LEU 19 HD13 LEU 19 239.579 12.995 -0.121 169 1HD2 LEU 19 HD21 LEU 19 239.246 12.476 -2.287 170 2HD2 LEU 19 HD22 LEU 19 238.805 10.888 -1.657 171 3HD2 LEU 19 HD23 LEU 19 239.920 11.019 -3.018 172 H LEU 20 HN LEU 20 243.530 11.930 1.504 173 HA LEU 20 HA LEU 20 243.871 9.013 1.747 174 1HB LEU 20 HB2 LEU 20 245.123 11.312 3.141 175 2HB LEU 20 HB1 LEU 20 244.783 9.890 4.108 176 HG LEU 20 HG LEU 20 246.371 9.780 1.552 177 1HD1 LEU 20 HD11 LEU 20 247.424 9.963 4.370 178 2HD1 LEU 20 HD12 LEU 20 247.479 11.261 3.179 179 3HD1 LEU 20 HD13 LEU 20 248.381 9.769 2.901 180 1HD2 LEU 20 HD21 LEU 20 246.189 7.871 3.873 181 2HD2 LEU 20 HD22 LEU 20 247.087 7.631 2.375 182 3HD2 LEU 20 HD23 LEU 20 245.325 7.690 2.347 183 H GLY 21 HN GLY 21 242.637 7.872 3.181 184 1HA GLY 21 HA2 GLY 21 240.266 9.258 4.177 185 2HA GLY 21 HA1 GLY 21 240.471 7.519 4.040 186 H MET 22 HN MET 22 239.936 9.760 6.233 187 HA MET 22 HA MET 22 241.725 8.588 8.252 188 1HB MET 22 HB2 MET 22 242.041 10.976 8.069 189 2HB MET 22 HB1 MET 22 240.312 11.257 8.218 190 1HG MET 22 HG2 MET 22 240.304 10.627 10.491 191 2HG MET 22 HG1 MET 22 241.928 9.950 10.383 192 1HE MET 22 HE1 MET 22 244.231 11.655 10.885 193 2HE MET 22 HE2 MET 22 244.112 13.074 9.850 194 3HE MET 22 HE3 MET 22 243.739 11.477 9.202 195 H LYS 23 HN LYS 23 240.878 7.749 10.147 196 HA LYS 23 HA LYS 23 238.088 6.999 10.028 197 1HB LYS 23 HB2 LYS 23 240.491 6.072 11.403 198 2HB LYS 23 HB1 LYS 23 239.080 6.095 12.451 199 1HG LYS 23 HG2 LYS 23 238.749 4.895 9.766 200 2HG LYS 23 HG1 LYS 23 239.721 4.005 10.940 201 1HD LYS 23 HD2 LYS 23 236.988 5.071 11.598 202 2HD LYS 23 HD1 LYS 23 237.228 3.483 10.863 203 1HE LYS 23 HE2 LYS 23 238.918 3.149 12.819 204 2HE LYS 23 HE1 LYS 23 238.015 4.461 13.574 205 1HZ LYS 23 HZ1 LYS 23 236.264 2.497 12.494 206 2HZ LYS 23 HZ2 LYS 23 236.376 3.073 14.081 207 3HZ LYS 23 HZ3 LYS 23 237.358 1.792 13.575 208 H LYS 24 HN LYS 24 236.523 7.548 11.583 209 HA LYS 24 HA LYS 24 237.037 10.112 12.842 210 1HB LYS 24 HB2 LYS 24 234.751 8.828 11.716 211 2HB LYS 24 HB1 LYS 24 234.395 9.188 13.400 212 1HG LYS 24 HG2 LYS 24 233.761 11.171 12.571 213 2HG LYS 24 HG1 LYS 24 235.489 11.528 12.631 214 1HD LYS 24 HD2 LYS 24 235.755 10.988 10.325 215 2HD LYS 24 HD1 LYS 24 234.117 10.340 10.228 216 1HE LYS 24 HE2 LYS 24 234.912 13.216 10.661 217 2HE LYS 24 HE1 LYS 24 234.164 12.528 9.220 218 1HZ LYS 24 HZ1 LYS 24 232.385 11.837 11.064 219 2HZ LYS 24 HZ2 LYS 24 232.305 13.291 10.202 220 3HZ LYS 24 HZ3 LYS 24 232.963 13.268 11.760 221 H ARG 25 HN ARG 25 236.328 6.797 13.737 222 HA ARG 25 HA ARG 25 237.433 7.191 16.317 223 1HB ARG 25 HB2 ARG 25 235.153 6.324 17.388 224 2HB ARG 25 HB1 ARG 25 235.519 8.035 17.222 225 1HG ARG 25 HG2 ARG 25 233.216 7.399 16.535 226 2HG ARG 25 HG1 ARG 25 234.148 8.219 15.281 227 1HD ARG 25 HD2 ARG 25 234.405 6.291 14.030 228 2HD ARG 25 HD1 ARG 25 234.129 5.235 15.415 229 HE ARG 25 HE ARG 25 232.148 6.341 13.658 230 1HH1 ARG 25 HH11 ARG 25 232.732 5.121 16.876 231 2HH1 ARG 25 HH12 ARG 25 231.079 4.682 17.145 232 1HH2 ARG 25 HH21 ARG 25 229.973 5.765 14.011 233 2HH2 ARG 25 HH22 ARG 25 229.512 5.048 15.519 234 H GLY 26 HN GLY 26 237.872 5.277 17.395 235 1HA GLY 26 HA2 GLY 26 237.377 2.881 17.668 236 2HA GLY 26 HA1 GLY 26 237.147 2.817 15.927 237 H PHE 27 HN PHE 27 238.754 1.753 14.992 238 HA PHE 27 HA PHE 27 241.440 1.921 16.154 239 1HB PHE 27 HB2 PHE 27 240.004 -0.091 14.490 240 2HB PHE 27 HB1 PHE 27 241.750 0.031 14.299 241 HD1 PHE 27 HD1 PHE 27 243.083 -1.257 15.652 242 HD2 PHE 27 HD2 PHE 27 239.185 -0.205 16.998 243 HE1 PHE 27 HE1 PHE 27 243.400 -2.655 17.652 244 HE2 PHE 27 HE2 PHE 27 239.495 -1.600 19.000 245 HZ PHE 27 HZ PHE 27 241.605 -2.828 19.330 246 H GLY 28 HN GLY 28 241.590 4.146 15.249 247 1HA GLY 28 HA2 GLY 28 243.355 4.561 13.337 248 2HA GLY 28 HA1 GLY 28 241.940 4.248 12.347 249 H ALA 29 HN ALA 29 240.478 5.643 14.799 250 HA ALA 29 HA ALA 29 239.764 7.988 13.662 251 1HB ALA 29 HB1 ALA 29 239.284 6.843 16.047 252 2HB ALA 29 HB2 ALA 29 238.726 8.446 15.566 253 3HB ALA 29 HB3 ALA 29 240.190 8.275 16.532 254 H GLY 30 HN GLY 30 240.859 9.711 12.945 255 1HA GLY 30 HA2 GLY 30 242.254 11.574 13.106 256 2HA GLY 30 HA1 GLY 30 242.913 10.921 14.597 257 H ARG 31 HN ARG 31 242.775 8.876 11.811 258 HA ARG 31 HA ARG 31 245.586 9.417 11.178 259 1HB ARG 31 HB2 ARG 31 244.442 6.677 11.755 260 2HB ARG 31 HB1 ARG 31 246.054 6.985 11.124 261 1HG ARG 31 HG2 ARG 31 245.488 8.460 13.569 262 2HG ARG 31 HG1 ARG 31 245.379 6.711 13.768 263 1HD ARG 31 HD2 ARG 31 247.653 6.902 12.323 264 2HD ARG 31 HD1 ARG 31 247.716 8.420 13.218 265 HE ARG 31 HE ARG 31 248.302 7.209 15.049 266 1HH1 ARG 31 HH11 ARG 31 246.507 5.116 12.908 267 2HH1 ARG 31 HH12 ARG 31 246.696 3.719 13.913 268 1HH2 ARG 31 HH21 ARG 31 248.550 5.372 16.371 269 2HH2 ARG 31 HH22 ARG 31 247.856 3.864 15.879 270 H TRP 32 HN TRP 32 245.992 9.419 9.043 271 HA TRP 32 HA TRP 32 243.795 8.706 7.252 272 1HB TRP 32 HB2 TRP 32 246.085 9.793 5.862 273 2HB TRP 32 HB1 TRP 32 244.444 10.413 5.959 274 HD1 TRP 32 HD1 TRP 32 247.616 10.463 8.215 275 HE1 TRP 32 HE1 TRP 32 247.753 12.785 9.313 276 HE3 TRP 32 HE3 TRP 32 243.339 12.521 6.317 277 HZ2 TRP 32 HZ2 TRP 32 246.265 15.178 9.356 278 HZ3 TRP 32 HZ3 TRP 32 242.771 14.833 6.935 279 HH2 TRP 32 HH2 TRP 32 244.204 16.133 8.422 280 H ASN 33 HN ASN 33 244.136 7.405 5.369 281 HA ASN 33 HA ASN 33 246.524 6.062 4.782 282 1HB ASN 33 HB2 ASN 33 245.943 5.054 7.063 283 2HB ASN 33 HB1 ASN 33 244.595 4.266 6.248 284 1HD2 ASN 33 HD21 ASN 33 245.821 2.375 7.105 285 2HD2 ASN 33 HD22 ASN 33 247.038 1.691 6.087 286 H GLY 34 HN GLY 34 246.197 4.240 3.249 287 1HA GLY 34 HA2 GLY 34 244.353 4.923 1.250 288 2HA GLY 34 HA1 GLY 34 245.248 3.413 1.331 289 H PHE 35 HN PHE 35 242.756 3.336 0.297 290 HA PHE 35 HA PHE 35 241.004 2.407 2.460 291 1HB PHE 35 HB2 PHE 35 240.059 2.515 -0.366 292 2HB PHE 35 HB1 PHE 35 239.189 2.852 1.119 293 HD1 PHE 35 HD1 PHE 35 241.157 4.233 -1.573 294 HD2 PHE 35 HD2 PHE 35 239.486 5.032 2.258 295 HE1 PHE 35 HE1 PHE 35 241.456 6.644 -1.950 296 HE2 PHE 35 HE2 PHE 35 239.781 7.447 1.887 297 HZ PHE 35 HZ PHE 35 240.767 8.255 -0.220 298 H GLY 36 HN GLY 36 241.634 0.362 2.943 299 1HA GLY 36 HA2 GLY 36 242.034 -1.514 0.720 300 2HA GLY 36 HA1 GLY 36 242.568 -1.764 2.375 301 H GLY 37 HN GLY 37 241.077 -3.575 0.705 302 1HA GLY 37 HA2 GLY 37 238.971 -4.206 2.578 303 2HA GLY 37 HA1 GLY 37 238.392 -3.768 0.978 304 H LYS 38 HN LYS 38 239.021 -6.331 2.849 305 HA LYS 38 HA LYS 38 240.583 -8.103 1.454 306 1HB LYS 38 HB2 LYS 38 239.544 -9.835 2.650 307 2HB LYS 38 HB1 LYS 38 239.383 -8.428 3.689 308 1HG LYS 38 HG2 LYS 38 237.200 -9.361 1.843 309 2HG LYS 38 HG1 LYS 38 237.361 -9.906 3.511 310 1HD LYS 38 HD2 LYS 38 236.081 -8.143 4.024 311 2HD LYS 38 HD1 LYS 38 237.537 -7.183 3.765 312 1HE LYS 38 HE2 LYS 38 236.877 -6.529 1.635 313 2HE LYS 38 HE1 LYS 38 235.742 -7.868 1.471 314 1HZ LYS 38 HZ1 LYS 38 234.375 -6.066 1.847 315 2HZ LYS 38 HZ2 LYS 38 235.424 -5.347 2.962 316 3HZ LYS 38 HZ3 LYS 38 234.527 -6.712 3.404 317 H VAL 39 HN VAL 39 240.257 -9.634 -0.162 318 HA VAL 39 HA VAL 39 238.443 -8.840 -2.234 319 HB VAL 39 HB VAL 39 240.041 -11.397 -2.198 320 1HG1 VAL 39 HG11 VAL 39 240.134 -10.940 -4.650 321 2HG1 VAL 39 HG12 VAL 39 239.015 -9.603 -4.386 322 3HG1 VAL 39 HG13 VAL 39 238.514 -11.256 -4.031 323 1HG2 VAL 39 HG21 VAL 39 240.993 -8.642 -2.247 324 2HG2 VAL 39 HG22 VAL 39 241.561 -9.616 -3.604 325 3HG2 VAL 39 HG23 VAL 39 241.869 -10.144 -1.950 326 H GLN 40 HN GLN 40 236.357 -9.322 -2.176 327 HA GLN 40 HA GLN 40 234.985 -10.970 -0.527 328 1HB GLN 40 HB2 GLN 40 234.440 -10.119 -3.350 329 2HB GLN 40 HB1 GLN 40 233.327 -11.202 -2.525 330 1HG GLN 40 HG2 GLN 40 233.567 -9.302 -0.653 331 2HG GLN 40 HG1 GLN 40 233.854 -8.335 -2.099 332 1HE2 GLN 40 HE21 GLN 40 232.225 -9.231 -3.941 333 2HE2 GLN 40 HE22 GLN 40 230.572 -9.161 -3.446 334 H GLU 41 HN GLU 41 233.823 -13.017 -0.947 335 HA GLU 41 HA GLU 41 235.587 -15.129 -1.381 336 1HB GLU 41 HB2 GLU 41 233.325 -15.098 -0.150 337 2HB GLU 41 HB1 GLU 41 232.612 -15.396 -1.730 338 1HG GLU 41 HG2 GLU 41 233.243 -17.541 -1.751 339 2HG GLU 41 HG1 GLU 41 234.820 -17.189 -1.044 340 H GLY 42 HN GLY 42 236.632 -14.786 -3.379 341 1HA GLY 42 HA2 GLY 42 236.896 -15.674 -5.535 342 2HA GLY 42 HA1 GLY 42 235.158 -15.911 -5.626 343 H GLU 43 HN GLU 43 237.084 -12.981 -4.958 344 HA GLU 43 HA GLU 43 235.980 -11.819 -7.407 345 1HB GLU 43 HB2 GLU 43 235.148 -9.982 -6.373 346 2HB GLU 43 HB1 GLU 43 235.055 -11.058 -4.992 347 1HG GLU 43 HG2 GLU 43 236.969 -10.124 -4.005 348 2HG GLU 43 HG1 GLU 43 237.437 -9.301 -5.492 349 H THR 44 HN THR 44 237.299 -9.718 -7.899 350 HA THR 44 HA THR 44 240.105 -10.536 -7.694 351 HB THR 44 HB THR 44 240.422 -9.073 -9.668 352 HG1 THR 44 HG1 THR 44 237.598 -8.913 -9.727 353 1HG2 THR 44 HG21 THR 44 238.470 -11.328 -9.710 354 2HG2 THR 44 HG22 THR 44 240.130 -11.274 -10.303 355 3HG2 THR 44 HG23 THR 44 238.847 -10.454 -11.194 356 H ILE 45 HN ILE 45 241.710 -9.146 -7.060 357 HA ILE 45 HA ILE 45 241.251 -7.407 -5.005 358 HB ILE 45 HB ILE 45 243.519 -7.384 -6.989 359 1HG1 ILE 45 HG12 ILE 45 244.074 -8.251 -4.279 360 2HG1 ILE 45 HG11 ILE 45 242.822 -9.225 -5.046 361 1HG2 ILE 45 HG21 ILE 45 244.415 -6.318 -4.565 362 2HG2 ILE 45 HG22 ILE 45 242.906 -5.483 -4.924 363 3HG2 ILE 45 HG23 ILE 45 244.219 -5.472 -6.100 364 1HD1 ILE 45 HD11 ILE 45 245.676 -8.859 -5.838 365 2HD1 ILE 45 HD12 ILE 45 244.472 -9.364 -7.024 366 3HD1 ILE 45 HD13 ILE 45 244.762 -10.347 -5.588 367 H GLU 46 HN GLU 46 241.118 -6.739 -8.443 368 HA GLU 46 HA GLU 46 241.076 -3.888 -8.183 369 1HB GLU 46 HB2 GLU 46 241.421 -5.595 -10.287 370 2HB GLU 46 HB1 GLU 46 239.760 -5.078 -10.542 371 1HG GLU 46 HG2 GLU 46 240.609 -2.705 -10.328 372 2HG GLU 46 HG1 GLU 46 242.232 -3.383 -10.433 373 H ASP 47 HN ASP 47 238.721 -6.465 -8.228 374 HA ASP 47 HA ASP 47 236.475 -4.680 -8.343 375 1HB ASP 47 HB2 ASP 47 236.765 -7.327 -8.916 376 2HB ASP 47 HB1 ASP 47 236.039 -7.418 -7.315 377 H GLY 48 HN GLY 48 238.214 -6.499 -5.885 378 1HA GLY 48 HA2 GLY 48 236.454 -5.805 -3.734 379 2HA GLY 48 HA1 GLY 48 238.070 -6.482 -3.579 380 H ALA 49 HN ALA 49 239.366 -4.422 -5.108 381 HA ALA 49 HA ALA 49 239.743 -2.477 -3.028 382 1HB ALA 49 HB1 ALA 49 241.572 -1.721 -4.247 383 2HB ALA 49 HB2 ALA 49 240.881 -2.223 -5.789 384 3HB ALA 49 HB3 ALA 49 241.502 -3.430 -4.668 385 H ARG 50 HN ARG 50 238.023 -2.708 -6.046 386 HA ARG 50 HA ARG 50 237.488 0.107 -6.256 387 1HB ARG 50 HB2 ARG 50 236.612 -2.346 -7.735 388 2HB ARG 50 HB1 ARG 50 235.736 -0.839 -7.962 389 1HG ARG 50 HG2 ARG 50 237.779 0.255 -8.694 390 2HG ARG 50 HG1 ARG 50 238.682 -1.237 -8.435 391 1HD ARG 50 HD2 ARG 50 236.998 -2.297 -10.057 392 2HD ARG 50 HD1 ARG 50 236.582 -0.640 -10.492 393 HE ARG 50 HE ARG 50 239.396 -1.140 -10.612 394 1HH1 ARG 50 HH11 ARG 50 236.391 -1.468 -12.356 395 2HH1 ARG 50 HH12 ARG 50 237.151 -1.481 -13.912 396 1HH2 ARG 50 HH21 ARG 50 240.398 -1.157 -12.658 397 2HH2 ARG 50 HH22 ARG 50 239.426 -1.305 -14.084 398 H ARG 51 HN ARG 51 235.491 -2.765 -5.591 399 HA ARG 51 HA ARG 51 233.134 -1.381 -4.966 400 1HB ARG 51 HB2 ARG 51 233.593 -3.924 -5.394 401 2HB ARG 51 HB1 ARG 51 233.792 -3.986 -3.648 402 1HG ARG 51 HG2 ARG 51 231.586 -4.414 -3.702 403 2HG ARG 51 HG1 ARG 51 231.468 -2.655 -3.785 404 1HD ARG 51 HD2 ARG 51 231.544 -2.932 -6.315 405 2HD ARG 51 HD1 ARG 51 231.267 -4.649 -6.026 406 HE ARG 51 HE ARG 51 229.082 -4.180 -5.540 407 1HH1 ARG 51 HH11 ARG 51 230.917 -1.212 -5.448 408 2HH1 ARG 51 HH12 ARG 51 229.518 -0.206 -5.284 409 1HH2 ARG 51 HH21 ARG 51 227.240 -2.857 -5.324 410 2HH2 ARG 51 HH22 ARG 51 227.430 -1.138 -5.213 411 H GLU 52 HN GLU 52 235.892 -2.245 -2.990 412 HA GLU 52 HA GLU 52 234.601 -1.419 -0.535 413 1HB GLU 52 HB2 GLU 52 237.457 -2.235 -1.100 414 2HB GLU 52 HB1 GLU 52 236.809 -1.892 0.497 415 1HG GLU 52 HG2 GLU 52 235.522 -3.966 -1.218 416 2HG GLU 52 HG1 GLU 52 236.997 -4.341 -0.327 417 H LEU 53 HN LEU 53 236.478 -0.012 -3.032 418 HA LEU 53 HA LEU 53 237.643 2.107 -1.551 419 1HB LEU 53 HB2 LEU 53 238.655 1.619 -3.609 420 2HB LEU 53 HB1 LEU 53 237.123 1.604 -4.464 421 HG LEU 53 HG LEU 53 236.956 4.042 -4.165 422 1HD1 LEU 53 HD11 LEU 53 238.780 3.652 -2.162 423 2HD1 LEU 53 HD12 LEU 53 238.318 5.212 -2.844 424 3HD1 LEU 53 HD13 LEU 53 239.755 4.380 -3.437 425 1HD2 LEU 53 HD21 LEU 53 239.180 2.735 -5.631 426 2HD2 LEU 53 HD22 LEU 53 239.183 4.497 -5.540 427 3HD2 LEU 53 HD23 LEU 53 237.802 3.652 -6.242 428 H GLN 54 HN GLN 54 234.766 1.850 -3.600 429 HA GLN 54 HA GLN 54 233.912 4.520 -3.332 430 1HB GLN 54 HB2 GLN 54 232.842 3.426 -5.053 431 2HB GLN 54 HB1 GLN 54 232.624 1.950 -4.125 432 1HG GLN 54 HG2 GLN 54 230.831 2.971 -2.862 433 2HG GLN 54 HG1 GLN 54 231.085 4.503 -3.696 434 1HE2 GLN 54 HE21 GLN 54 229.640 4.883 -5.199 435 2HE2 GLN 54 HE22 GLN 54 228.859 3.706 -6.193 436 H GLU 55 HN GLU 55 233.676 1.779 -1.244 437 HA GLU 55 HA GLU 55 231.569 2.866 0.390 438 1HB GLU 55 HB2 GLU 55 233.239 0.391 0.451 439 2HB GLU 55 HB1 GLU 55 232.353 0.867 1.893 440 1HG GLU 55 HG2 GLU 55 230.880 0.784 -0.680 441 2HG GLU 55 HG1 GLU 55 231.322 -0.746 0.078 442 H GLU 56 HN GLU 56 235.027 3.056 0.372 443 HA GLU 56 HA GLU 56 235.260 3.591 3.173 444 1HB GLU 56 HB2 GLU 56 237.055 3.220 0.938 445 2HB GLU 56 HB1 GLU 56 237.569 4.561 1.954 446 1HG GLU 56 HG2 GLU 56 236.776 2.282 3.540 447 2HG GLU 56 HG1 GLU 56 238.039 1.862 2.383 448 H SER 57 HN SER 57 235.301 5.659 0.269 449 HA SER 57 HA SER 57 234.768 7.927 2.061 450 1HB SER 57 HB2 SER 57 237.140 8.032 1.516 451 2HB SER 57 HB1 SER 57 236.773 7.922 -0.205 452 HG SER 57 HG SER 57 235.652 9.922 0.010 453 H GLY 58 HN GLY 58 233.079 6.288 0.231 454 1HA GLY 58 HA2 GLY 58 231.418 6.608 -1.319 455 2HA GLY 58 HA1 GLY 58 231.423 8.274 -0.763 456 H LEU 59 HN LEU 59 234.399 7.187 -2.064 457 HA LEU 59 HA LEU 59 233.863 8.710 -4.517 458 1HB LEU 59 HB2 LEU 59 236.443 8.091 -3.093 459 2HB LEU 59 HB1 LEU 59 236.354 8.868 -4.662 460 HG LEU 59 HG LEU 59 235.690 9.952 -1.970 461 1HD1 LEU 59 HD11 LEU 59 237.151 11.606 -2.544 462 2HD1 LEU 59 HD12 LEU 59 236.746 11.520 -4.259 463 3HD1 LEU 59 HD13 LEU 59 237.793 10.298 -3.537 464 1HD2 LEU 59 HD21 LEU 59 234.476 10.977 -4.537 465 2HD2 LEU 59 HD22 LEU 59 234.399 11.772 -2.964 466 3HD2 LEU 59 HD23 LEU 59 233.598 10.220 -3.208 467 H THR 60 HN THR 60 233.244 7.382 -6.032 468 HA THR 60 HA THR 60 234.384 4.729 -6.292 469 HB THR 60 HB THR 60 232.631 5.671 -8.446 470 HG1 THR 60 HG1 THR 60 230.789 5.786 -7.118 471 1HG2 THR 60 HG21 THR 60 231.431 3.636 -6.916 472 2HG2 THR 60 HG22 THR 60 233.153 3.270 -7.004 473 3HG2 THR 60 HG23 THR 60 232.223 3.497 -8.485 474 H VAL 61 HN VAL 61 235.463 4.015 -8.227 475 HA VAL 61 HA VAL 61 236.679 6.238 -9.735 476 HB VAL 61 HB VAL 61 238.728 4.952 -9.935 477 1HG1 VAL 61 HG11 VAL 61 238.746 6.430 -8.111 478 2HG1 VAL 61 HG12 VAL 61 239.349 4.903 -7.469 479 3HG1 VAL 61 HG13 VAL 61 237.685 5.397 -7.155 480 1HG2 VAL 61 HG21 VAL 61 237.050 2.816 -8.882 481 2HG2 VAL 61 HG22 VAL 61 238.605 2.941 -8.059 482 3HG2 VAL 61 HG23 VAL 61 238.548 2.728 -9.809 483 H ASP 62 HN ASP 62 236.920 6.043 -11.909 484 HA ASP 62 HA ASP 62 235.263 4.084 -13.217 485 1HB ASP 62 HB2 ASP 62 235.436 6.502 -13.926 486 2HB ASP 62 HB1 ASP 62 237.060 6.146 -14.505 487 H ALA 63 HN ALA 63 238.590 4.439 -12.416 488 HA ALA 63 HA ALA 63 239.295 1.852 -13.154 489 1HB ALA 63 HB1 ALA 63 239.274 2.163 -15.411 490 2HB ALA 63 HB2 ALA 63 240.922 2.691 -15.073 491 3HB ALA 63 HB3 ALA 63 239.640 3.883 -15.289 492 H LEU 64 HN LEU 64 240.433 1.841 -11.239 493 HA LEU 64 HA LEU 64 242.230 3.838 -10.378 494 1HB LEU 64 HB2 LEU 64 242.257 0.880 -9.753 495 2HB LEU 64 HB1 LEU 64 243.125 2.116 -8.867 496 HG LEU 64 HG LEU 64 240.404 2.886 -8.913 497 1HD1 LEU 64 HD11 LEU 64 239.670 0.702 -9.389 498 2HD1 LEU 64 HD12 LEU 64 239.498 0.891 -7.644 499 3HD1 LEU 64 HD13 LEU 64 240.859 -0.018 -8.304 500 1HD2 LEU 64 HD21 LEU 64 242.481 2.897 -7.164 501 2HD2 LEU 64 HD22 LEU 64 241.444 1.652 -6.466 502 3HD2 LEU 64 HD23 LEU 64 240.812 3.275 -6.743 503 H HIS 65 HN HIS 65 244.640 2.913 -9.880 504 HA HIS 65 HA HIS 65 245.744 1.802 -12.359 505 1HB HIS 65 HB2 HIS 65 247.000 4.155 -10.942 506 2HB HIS 65 HB1 HIS 65 247.469 3.457 -12.488 507 HD1 HIS 65 HD1 HIS 65 244.927 5.707 -10.916 508 HD2 HIS 65 HD2 HIS 65 245.936 4.267 -14.681 509 HE1 HIS 65 HE1 HIS 65 243.608 7.098 -12.544 510 HE2 HIS 65 HE2 HIS 65 244.302 6.267 -14.819 511 H LYS 66 HN LYS 66 246.408 -0.128 -11.558 512 HA LYS 66 HA LYS 66 247.422 -0.571 -8.972 513 1HB LYS 66 HB2 LYS 66 248.155 -2.735 -9.807 514 2HB LYS 66 HB1 LYS 66 246.556 -2.365 -10.438 515 1HG LYS 66 HG2 LYS 66 247.733 -1.535 -12.527 516 2HG LYS 66 HG1 LYS 66 249.185 -2.304 -11.883 517 1HD LYS 66 HD2 LYS 66 247.609 -4.379 -11.630 518 2HD LYS 66 HD1 LYS 66 246.643 -3.543 -12.847 519 1HE LYS 66 HE2 LYS 66 248.282 -3.723 -14.463 520 2HE LYS 66 HE1 LYS 66 249.577 -3.890 -13.278 521 1HZ LYS 66 HZ1 LYS 66 249.185 -6.106 -13.023 522 2HZ LYS 66 HZ2 LYS 66 248.711 -5.936 -14.638 523 3HZ LYS 66 HZ3 LYS 66 247.543 -5.993 -13.416 524 H VAL 67 HN VAL 67 249.492 -0.583 -8.130 525 HA VAL 67 HA VAL 67 251.611 0.314 -9.981 526 HB VAL 67 HB VAL 67 252.586 1.685 -8.201 527 1HG1 VAL 67 HG11 VAL 67 250.483 3.292 -8.036 528 2HG1 VAL 67 HG12 VAL 67 249.863 2.188 -9.263 529 3HG1 VAL 67 HG13 VAL 67 251.370 3.061 -9.542 530 1HG2 VAL 67 HG21 VAL 67 251.980 0.869 -6.151 531 2HG2 VAL 67 HG22 VAL 67 250.311 0.573 -6.640 532 3HG2 VAL 67 HG23 VAL 67 250.852 2.215 -6.298 533 H GLY 68 HN GLY 68 250.989 -1.257 -6.839 534 1HA GLY 68 HA2 GLY 68 253.173 -3.100 -7.443 535 2HA GLY 68 HA1 GLY 68 253.343 -2.131 -5.988 536 H GLN 69 HN GLN 69 253.459 -4.653 -5.487 537 HA GLN 69 HA GLN 69 250.827 -5.325 -4.366 538 1HB GLN 69 HB2 GLN 69 251.718 -6.707 -6.447 539 2HB GLN 69 HB1 GLN 69 252.655 -7.529 -5.206 540 1HG GLN 69 HG2 GLN 69 250.004 -7.346 -4.261 541 2HG GLN 69 HG1 GLN 69 249.928 -7.892 -5.935 542 1HE2 GLN 69 HE21 GLN 69 250.079 -9.990 -6.234 543 2HE2 GLN 69 HE22 GLN 69 250.812 -11.126 -5.158 544 H ILE 70 HN ILE 70 250.980 -5.299 -2.227 545 HA ILE 70 HA ILE 70 253.578 -5.826 -0.979 546 HB ILE 70 HB ILE 70 251.074 -4.633 0.215 547 1HG1 ILE 70 HG12 ILE 70 253.668 -3.276 -0.540 548 2HG1 ILE 70 HG11 ILE 70 252.212 -3.245 -1.531 549 1HG2 ILE 70 HG21 ILE 70 252.070 -5.314 2.120 550 2HG2 ILE 70 HG22 ILE 70 253.071 -3.885 1.863 551 3HG2 ILE 70 HG23 ILE 70 253.654 -5.471 1.362 552 1HD1 ILE 70 HD11 ILE 70 252.443 -2.159 1.265 553 2HD1 ILE 70 HD12 ILE 70 251.016 -2.085 0.230 554 3HD1 ILE 70 HD13 ILE 70 252.478 -1.207 -0.219 555 H VAL 71 HN VAL 71 253.848 -7.315 0.648 556 HA VAL 71 HA VAL 71 251.640 -9.200 1.123 557 HB VAL 71 HB VAL 71 254.512 -10.082 0.902 558 1HG1 VAL 71 HG11 VAL 71 252.703 -11.433 2.097 559 2HG1 VAL 71 HG12 VAL 71 253.663 -12.259 0.870 560 3HG1 VAL 71 HG13 VAL 71 252.029 -11.712 0.491 561 1HG2 VAL 71 HG21 VAL 71 254.120 -10.792 -1.361 562 2HG2 VAL 71 HG22 VAL 71 253.768 -9.068 -1.244 563 3HG2 VAL 71 HG23 VAL 71 252.448 -10.236 -1.292 564 H PHE 72 HN PHE 72 251.595 -10.161 3.178 565 HA PHE 72 HA PHE 72 253.545 -9.156 5.122 566 1HB PHE 72 HB2 PHE 72 250.545 -8.983 5.311 567 2HB PHE 72 HB1 PHE 72 251.579 -8.891 6.732 568 HD1 PHE 72 HD1 PHE 72 253.442 -7.098 6.680 569 HD2 PHE 72 HD2 PHE 72 250.036 -7.065 4.129 570 HE1 PHE 72 HE1 PHE 72 253.759 -4.688 6.293 571 HE2 PHE 72 HE2 PHE 72 250.347 -4.657 3.737 572 HZ PHE 72 HZ PHE 72 252.211 -3.465 4.819 573 H GLU 73 HN GLU 73 254.455 -10.796 6.133 574 HA GLU 73 HA GLU 73 253.026 -13.349 6.304 575 1HB GLU 73 HB2 GLU 73 255.237 -13.507 5.353 576 2HB GLU 73 HB1 GLU 73 255.933 -12.628 6.707 577 1HG GLU 73 HG2 GLU 73 256.340 -14.552 7.706 578 2HG GLU 73 HG1 GLU 73 254.606 -14.847 7.802 579 H PHE 74 HN PHE 74 252.196 -14.066 8.170 580 HA PHE 74 HA PHE 74 252.727 -12.491 10.583 581 1HB PHE 74 HB2 PHE 74 250.490 -14.252 9.679 582 2HB PHE 74 HB1 PHE 74 250.765 -14.070 11.408 583 HD1 PHE 74 HD1 PHE 74 251.340 -11.401 11.937 584 HD2 PHE 74 HD2 PHE 74 248.782 -12.949 8.908 585 HE1 PHE 74 HE1 PHE 74 250.092 -9.279 11.912 586 HE2 PHE 74 HE2 PHE 74 247.530 -10.830 8.877 587 HZ PHE 74 HZ PHE 74 248.185 -8.993 10.381 588 H VAL 75 HN VAL 75 253.797 -13.196 12.250 589 HA VAL 75 HA VAL 75 255.164 -15.712 12.067 590 HB VAL 75 HB VAL 75 255.330 -14.327 14.643 591 1HG1 VAL 75 HG11 VAL 75 256.964 -15.916 14.253 592 2HG1 VAL 75 HG12 VAL 75 257.798 -14.410 13.872 593 3HG1 VAL 75 HG13 VAL 75 257.177 -15.429 12.572 594 1HG2 VAL 75 HG21 VAL 75 255.123 -12.272 13.634 595 2HG2 VAL 75 HG22 VAL 75 255.789 -12.837 12.102 596 3HG2 VAL 75 HG23 VAL 75 256.858 -12.553 13.477 597 H GLY 76 HN GLY 76 254.344 -17.579 12.702 598 1HA GLY 76 HA2 GLY 76 253.513 -19.041 14.376 599 2HA GLY 76 HA1 GLY 76 252.737 -17.669 15.153 600 H GLU 77 HN GLU 77 251.818 -16.879 12.311 601 HA GLU 77 HA GLU 77 249.465 -18.642 12.316 602 1HB GLU 77 HB2 GLU 77 249.706 -15.879 11.124 603 2HB GLU 77 HB1 GLU 77 248.234 -16.822 11.312 604 1HG GLU 77 HG2 GLU 77 249.925 -15.750 13.559 605 2HG GLU 77 HG1 GLU 77 248.413 -15.050 12.981 606 HA PRO 78 HA PRO 78 251.345 -20.406 8.590 607 1HB PRO 78 HB2 PRO 78 248.530 -21.394 8.418 608 2HB PRO 78 HB1 PRO 78 250.046 -22.273 8.186 609 1HG PRO 78 HG2 PRO 78 248.663 -22.534 10.445 610 2HG PRO 78 HG1 PRO 78 250.436 -22.467 10.465 611 1HD PRO 78 HD2 PRO 78 248.450 -20.392 11.251 612 2HD PRO 78 HD1 PRO 78 250.068 -20.716 11.905 613 H GLU 79 HN GLU 79 248.373 -18.567 8.849 614 HA GLU 79 HA GLU 79 248.002 -18.201 6.042 615 1HB GLU 79 HB2 GLU 79 246.548 -17.642 8.389 616 2HB GLU 79 HB1 GLU 79 246.817 -16.090 7.607 617 1HG GLU 79 HG2 GLU 79 245.913 -17.085 5.505 618 2HG GLU 79 HG1 GLU 79 245.487 -18.519 6.437 619 H LEU 80 HN LEU 80 247.881 -15.876 5.169 620 HA LEU 80 HA LEU 80 250.043 -14.183 6.170 621 1HB LEU 80 HB2 LEU 80 249.935 -14.675 3.229 622 2HB LEU 80 HB1 LEU 80 251.282 -14.150 4.222 623 HG LEU 80 HG LEU 80 250.213 -16.928 4.518 624 1HD1 LEU 80 HD11 LEU 80 250.535 -16.896 2.196 625 2HD1 LEU 80 HD12 LEU 80 252.027 -17.573 2.851 626 3HD1 LEU 80 HD13 LEU 80 251.979 -15.891 2.324 627 1HD2 LEU 80 HD21 LEU 80 252.063 -15.618 5.923 628 2HD2 LEU 80 HD22 LEU 80 253.086 -16.226 4.622 629 3HD2 LEU 80 HD23 LEU 80 252.155 -17.351 5.610 630 H MET 81 HN MET 81 250.100 -12.363 4.066 631 HA MET 81 HA MET 81 247.342 -11.534 3.635 632 1HB MET 81 HB2 MET 81 249.107 -10.337 5.589 633 2HB MET 81 HB1 MET 81 248.631 -9.161 4.373 634 1HG MET 81 HG2 MET 81 246.265 -9.758 4.795 635 2HG MET 81 HG1 MET 81 246.805 -10.811 6.102 636 1HE MET 81 HE1 MET 81 248.751 -7.115 5.826 637 2HE MET 81 HE2 MET 81 247.191 -6.294 5.829 638 3HE MET 81 HE3 MET 81 247.554 -7.496 4.589 639 H ASP 82 HN ASP 82 247.249 -11.265 1.500 640 HA ASP 82 HA ASP 82 249.551 -10.039 0.134 641 1HB ASP 82 HB2 ASP 82 248.973 -12.255 -0.718 642 2HB ASP 82 HB1 ASP 82 247.308 -11.747 -0.976 643 H VAL 83 HN VAL 83 249.196 -7.886 0.160 644 HA VAL 83 HA VAL 83 246.521 -6.904 -0.595 645 HB VAL 83 HB VAL 83 248.707 -5.348 0.782 646 1HG1 VAL 83 HG11 VAL 83 245.768 -4.799 0.397 647 2HG1 VAL 83 HG12 VAL 83 247.106 -3.965 -0.396 648 3HG1 VAL 83 HG13 VAL 83 246.878 -3.809 1.346 649 1HG2 VAL 83 HG21 VAL 83 246.682 -7.209 1.848 650 2HG2 VAL 83 HG22 VAL 83 246.857 -5.675 2.698 651 3HG2 VAL 83 HG23 VAL 83 248.249 -6.738 2.501 652 H HIS 84 HN HIS 84 246.339 -6.218 -2.607 653 HA HIS 84 HA HIS 84 248.671 -5.444 -4.143 654 1HB HIS 84 HB2 HIS 84 246.352 -6.678 -4.850 655 2HB HIS 84 HB1 HIS 84 245.976 -5.016 -5.289 656 HD1 HIS 84 HD1 HIS 84 245.984 -6.401 -7.716 657 HD2 HIS 84 HD2 HIS 84 249.633 -5.487 -5.951 658 HE1 HIS 84 HE1 HIS 84 247.682 -6.555 -9.564 659 HE2 HIS 84 HE2 HIS 84 249.869 -5.913 -8.491 660 H VAL 85 HN VAL 85 249.102 -3.352 -4.889 661 HA VAL 85 HA VAL 85 247.651 -1.263 -3.424 662 HB VAL 85 HB VAL 85 250.328 -1.080 -4.831 663 1HG1 VAL 85 HG11 VAL 85 248.850 1.020 -4.457 664 2HG1 VAL 85 HG12 VAL 85 250.549 1.069 -3.988 665 3HG1 VAL 85 HG13 VAL 85 249.304 0.826 -2.764 666 1HG2 VAL 85 HG21 VAL 85 251.392 -1.541 -2.857 667 2HG2 VAL 85 HG22 VAL 85 249.971 -2.571 -2.687 668 3HG2 VAL 85 HG23 VAL 85 250.030 -1.009 -1.871 669 H PHE 86 HN PHE 86 246.622 0.351 -4.437 670 HA PHE 86 HA PHE 86 246.787 0.561 -7.354 671 1HB PHE 86 HB2 PHE 86 244.387 -0.100 -5.693 672 2HB PHE 86 HB1 PHE 86 244.164 0.915 -7.113 673 HD1 PHE 86 HD1 PHE 86 245.596 -2.342 -6.037 674 HD2 PHE 86 HD2 PHE 86 243.911 -0.054 -9.204 675 HE1 PHE 86 HE1 PHE 86 245.531 -4.354 -7.452 676 HE2 PHE 86 HE2 PHE 86 243.841 -2.062 -10.624 677 HZ PHE 86 HZ PHE 86 244.652 -4.216 -9.748 678 H CYS 87 HN CYS 87 246.348 2.598 -8.166 679 HA CYS 87 HA CYS 87 245.655 4.703 -6.236 680 1HB CYS 87 HB2 CYS 87 248.068 4.545 -8.005 681 2HB CYS 87 HB1 CYS 87 247.337 6.119 -7.711 682 HG CYS 87 HG CYS 87 248.621 6.161 -5.639 683 H THR 88 HN THR 88 243.843 5.642 -6.983 684 HA THR 88 HA THR 88 243.262 5.463 -9.838 685 HB THR 88 HB THR 88 241.610 4.718 -8.080 686 HG1 THR 88 HG1 THR 88 240.699 5.001 -10.006 687 1HG2 THR 88 HG21 THR 88 240.711 6.068 -6.590 688 2HG2 THR 88 HG22 THR 88 240.474 7.352 -7.776 689 3HG2 THR 88 HG23 THR 88 242.028 7.182 -6.960 690 H ASP 89 HN ASP 89 241.601 7.483 -10.316 691 HA ASP 89 HA ASP 89 242.613 10.027 -9.457 692 1HB ASP 89 HB2 ASP 89 243.195 9.030 -12.251 693 2HB ASP 89 HB1 ASP 89 243.229 10.735 -11.812 694 H SER 90 HN SER 90 240.806 8.259 -11.923 695 HA SER 90 HA SER 90 238.899 10.419 -12.230 696 1HB SER 90 HB2 SER 90 239.785 8.434 -13.922 697 2HB SER 90 HB1 SER 90 238.214 7.815 -13.415 698 HG SER 90 HG SER 90 238.046 9.157 -15.258 699 H ILE 91 HN ILE 91 237.705 10.644 -10.385 700 HA ILE 91 HA ILE 91 236.464 8.233 -9.272 701 HB ILE 91 HB ILE 91 235.923 9.567 -7.288 702 1HG1 ILE 91 HG12 ILE 91 237.530 11.808 -8.525 703 2HG1 ILE 91 HG11 ILE 91 235.772 11.748 -8.602 704 1HG2 ILE 91 HG21 ILE 91 238.806 9.682 -8.162 705 2HG2 ILE 91 HG22 ILE 91 238.008 8.382 -7.277 706 3HG2 ILE 91 HG23 ILE 91 238.253 9.951 -6.510 707 1HD1 ILE 91 HD11 ILE 91 235.779 11.637 -6.091 708 2HD1 ILE 91 HD12 ILE 91 236.339 13.155 -6.793 709 3HD1 ILE 91 HD13 ILE 91 237.504 11.992 -6.162 710 H GLN 92 HN GLN 92 234.224 8.881 -8.168 711 HA GLN 92 HA GLN 92 232.626 10.484 -10.018 712 1HB GLN 92 HB2 GLN 92 232.079 7.593 -9.351 713 2HB GLN 92 HB1 GLN 92 230.920 8.660 -10.133 714 1HG GLN 92 HG2 GLN 92 233.107 8.964 -11.723 715 2HG GLN 92 HG1 GLN 92 233.250 7.278 -11.229 716 1HE2 GLN 92 HE21 GLN 92 232.897 6.856 -13.509 717 2HE2 GLN 92 HE22 GLN 92 231.279 6.794 -14.115 718 H GLY 93 HN GLY 93 232.169 8.251 -7.284 719 1HA GLY 93 HA2 GLY 93 229.968 9.485 -6.149 720 2HA GLY 93 HA1 GLY 93 231.138 8.529 -5.256 721 H THR 94 HN THR 94 230.326 10.204 -3.620 722 HA THR 94 HA THR 94 231.987 12.620 -3.771 723 HB THR 94 HB THR 94 229.784 12.648 -1.859 724 HG1 THR 94 HG1 THR 94 228.518 11.669 -3.276 725 1HG2 THR 94 HG21 THR 94 231.104 14.500 -3.675 726 2HG2 THR 94 HG22 THR 94 230.309 14.795 -2.128 727 3HG2 THR 94 HG23 THR 94 229.353 14.697 -3.606 728 HA PRO 95 HA PRO 95 234.053 11.308 -0.143 729 1HB PRO 95 HB2 PRO 95 234.774 13.701 0.941 730 2HB PRO 95 HB1 PRO 95 235.592 12.988 -0.451 731 1HG PRO 95 HG2 PRO 95 233.643 15.213 -0.337 732 2HG PRO 95 HG1 PRO 95 234.973 14.934 -1.471 733 1HD PRO 95 HD2 PRO 95 232.285 14.464 -1.974 734 2HD PRO 95 HD1 PRO 95 233.636 13.795 -2.902 735 H VAL 96 HN VAL 96 231.662 10.793 0.278 736 HA VAL 96 HA VAL 96 230.271 12.451 2.151 737 HB VAL 96 HB VAL 96 229.721 9.522 1.754 738 1HG1 VAL 96 HG11 VAL 96 228.538 11.215 3.407 739 2HG1 VAL 96 HG12 VAL 96 227.639 9.953 2.564 740 3HG1 VAL 96 HG13 VAL 96 227.620 11.608 1.954 741 1HG2 VAL 96 HG21 VAL 96 228.088 10.938 -0.024 742 2HG2 VAL 96 HG22 VAL 96 229.393 9.820 -0.421 743 3HG2 VAL 96 HG23 VAL 96 229.721 11.547 -0.286 744 H GLU 97 HN GLU 97 232.377 12.507 3.445 745 HA GLU 97 HA GLU 97 233.409 10.523 5.004 746 1HB GLU 97 HB2 GLU 97 234.041 12.203 6.608 747 2HB GLU 97 HB1 GLU 97 234.133 12.909 5.001 748 1HG GLU 97 HG2 GLU 97 231.610 13.576 5.687 749 2HG GLU 97 HG1 GLU 97 232.394 13.583 7.266 750 H SER 98 HN SER 98 232.433 9.011 6.171 751 HA SER 98 HA SER 98 229.826 9.499 7.347 752 1HB SER 98 HB2 SER 98 231.488 7.109 6.756 753 2HB SER 98 HB1 SER 98 230.378 6.985 8.121 754 HG SER 98 HG SER 98 229.679 6.498 5.782 755 H ASP 99 HN ASP 99 229.674 8.135 9.595 756 HA ASP 99 HA ASP 99 231.000 9.793 11.486 757 1HB ASP 99 HB2 ASP 99 229.512 7.229 12.059 758 2HB ASP 99 HB1 ASP 99 229.794 8.572 13.163 759 H GLU 100 HN GLU 100 232.015 7.017 9.857 760 HA GLU 100 HA GLU 100 234.075 6.542 11.908 761 1HB GLU 100 HB2 GLU 100 232.171 4.710 10.984 762 2HB GLU 100 HB1 GLU 100 233.664 4.258 10.173 763 1HG GLU 100 HG2 GLU 100 234.703 4.442 12.543 764 2HG GLU 100 HG1 GLU 100 233.032 4.299 13.088 765 H MET 101 HN MET 101 233.817 8.127 9.245 766 HA MET 101 HA MET 101 236.504 7.533 8.378 767 1HB MET 101 HB2 MET 101 234.429 6.292 7.018 768 2HB MET 101 HB1 MET 101 234.783 7.703 6.030 769 1HG MET 101 HG2 MET 101 236.029 5.709 5.333 770 2HG MET 101 HG1 MET 101 237.082 7.037 5.813 771 1HE MET 101 HE1 MET 101 239.066 6.250 8.394 772 2HE MET 101 HE2 MET 101 238.855 6.818 6.738 773 3HE MET 101 HE3 MET 101 239.564 5.233 7.043 774 H ARG 102 HN ARG 102 237.315 9.147 6.838 775 HA ARG 102 HA ARG 102 235.856 11.480 6.198 776 1HB ARG 102 HB2 ARG 102 235.955 11.888 8.603 777 2HB ARG 102 HB1 ARG 102 237.699 11.669 8.593 778 1HG ARG 102 HG2 ARG 102 237.905 13.647 7.126 779 2HG ARG 102 HG1 ARG 102 236.161 13.886 7.255 780 1HD ARG 102 HD2 ARG 102 236.606 13.852 9.812 781 2HD ARG 102 HD1 ARG 102 238.276 14.184 9.351 782 HE ARG 102 HE ARG 102 237.654 16.337 8.977 783 1HH1 ARG 102 HH11 ARG 102 234.818 14.329 8.655 784 2HH1 ARG 102 HH12 ARG 102 233.749 15.665 8.389 785 1HH2 ARG 102 HH21 ARG 102 236.250 18.096 8.627 786 2HH2 ARG 102 HH22 ARG 102 234.561 17.804 8.372 787 HA PRO 103 HA PRO 103 239.666 11.103 3.742 788 1HB PRO 103 HB2 PRO 103 238.725 12.228 1.502 789 2HB PRO 103 HB1 PRO 103 238.263 10.585 1.970 790 1HG PRO 103 HG2 PRO 103 236.759 13.154 2.351 791 2HG PRO 103 HG1 PRO 103 236.165 11.597 1.745 792 1HD PRO 103 HD2 PRO 103 235.822 12.404 4.318 793 2HD PRO 103 HD1 PRO 103 235.990 10.697 3.863 794 H CYS 104 HN CYS 104 241.154 12.621 2.831 795 HA CYS 104 HA CYS 104 240.596 15.451 3.244 796 1HB CYS 104 HB2 CYS 104 241.659 14.422 5.347 797 2HB CYS 104 HB1 CYS 104 243.125 14.276 4.382 798 HG CYS 104 HG CYS 104 241.850 16.973 5.244 799 H TRP 105 HN TRP 105 241.177 16.471 1.465 800 HA TRP 105 HA TRP 105 243.028 15.234 -0.392 801 1HB TRP 105 HB2 TRP 105 241.449 17.809 -0.612 802 2HB TRP 105 HB1 TRP 105 242.364 17.054 -1.914 803 HD1 TRP 105 HD1 TRP 105 239.698 15.595 0.527 804 HE1 TRP 105 HE1 TRP 105 237.932 14.360 -0.885 805 HE3 TRP 105 HE3 TRP 105 241.578 16.548 -4.133 806 HZ2 TRP 105 HZ2 TRP 105 237.410 13.861 -3.613 807 HZ3 TRP 105 HZ3 TRP 105 240.384 15.655 -6.090 808 HH2 TRP 105 HH2 TRP 105 238.344 14.340 -5.835 809 H PHE 106 HN PHE 106 245.138 15.593 -0.273 810 HA PHE 106 HA PHE 106 246.073 18.243 0.612 811 1HB PHE 106 HB2 PHE 106 246.939 15.515 1.511 812 2HB PHE 106 HB1 PHE 106 248.098 16.837 1.517 813 HD1 PHE 106 HD1 PHE 106 246.450 19.104 2.358 814 HD2 PHE 106 HD2 PHE 106 246.481 15.075 3.727 815 HE1 PHE 106 HE1 PHE 106 245.592 19.844 4.542 816 HE2 PHE 106 HE2 PHE 106 245.623 15.807 5.914 817 HZ PHE 106 HZ PHE 106 245.177 18.194 6.324 818 H GLN 107 HN GLN 107 248.762 17.946 0.210 819 HA GLN 107 HA GLN 107 248.876 17.822 -2.692 820 1HB GLN 107 HB2 GLN 107 250.899 18.725 -0.635 821 2HB GLN 107 HB1 GLN 107 251.169 18.767 -2.371 822 1HG GLN 107 HG2 GLN 107 249.725 20.511 -2.698 823 2HG GLN 107 HG1 GLN 107 248.768 20.129 -1.267 824 1HE2 GLN 107 HE21 GLN 107 250.690 22.387 -2.496 825 2HE2 GLN 107 HE22 GLN 107 251.413 23.018 -1.060 826 H LEU 108 HN LEU 108 250.581 16.682 -3.801 827 HA LEU 108 HA LEU 108 250.903 14.014 -2.817 828 1HB LEU 108 HB2 LEU 108 251.769 13.483 -4.923 829 2HB LEU 108 HB1 LEU 108 250.594 14.744 -5.242 830 HG LEU 108 HG LEU 108 253.587 15.131 -5.109 831 1HD1 LEU 108 HD11 LEU 108 253.405 14.152 -7.140 832 2HD1 LEU 108 HD12 LEU 108 252.920 15.782 -7.612 833 3HD1 LEU 108 HD13 LEU 108 251.695 14.551 -7.303 834 1HD2 LEU 108 HD21 LEU 108 253.072 17.376 -6.004 835 2HD2 LEU 108 HD22 LEU 108 252.434 17.122 -4.380 836 3HD2 LEU 108 HD23 LEU 108 251.356 17.047 -5.772 837 H ASP 109 HN ASP 109 252.549 16.754 -2.053 838 HA ASP 109 HA ASP 109 255.037 15.262 -1.559 839 1HB ASP 109 HB2 ASP 109 254.940 17.418 -3.127 840 2HB ASP 109 HB1 ASP 109 255.046 18.244 -1.575 841 H GLN 110 HN GLN 110 252.468 15.669 0.015 842 HA GLN 110 HA GLN 110 253.791 16.330 2.518 843 1HB GLN 110 HB2 GLN 110 251.209 17.633 1.646 844 2HB GLN 110 HB1 GLN 110 251.939 17.785 3.238 845 1HG GLN 110 HG2 GLN 110 253.290 18.647 0.696 846 2HG GLN 110 HG1 GLN 110 252.318 19.717 1.705 847 1HE2 GLN 110 HE21 GLN 110 253.647 21.033 2.727 848 2HE2 GLN 110 HE22 GLN 110 255.089 20.576 3.561 849 H ILE 111 HN ILE 111 252.571 13.933 1.106 850 HA ILE 111 HA ILE 111 250.261 13.238 2.665 851 HB ILE 111 HB ILE 111 251.680 10.898 1.719 852 1HG1 ILE 111 HG12 ILE 111 251.065 11.566 -0.762 853 2HG1 ILE 111 HG11 ILE 111 251.398 13.191 -0.169 854 1HG2 ILE 111 HG21 ILE 111 249.623 10.187 1.396 855 2HG2 ILE 111 HG22 ILE 111 249.212 11.564 0.375 856 3HG2 ILE 111 HG23 ILE 111 249.094 11.702 2.129 857 1HD1 ILE 111 HD11 ILE 111 253.243 10.848 -0.376 858 2HD1 ILE 111 HD12 ILE 111 253.594 12.198 0.702 859 3HD1 ILE 111 HD13 ILE 111 253.431 12.473 -1.032 860 HA PRO 112 HA PRO 112 252.715 11.918 6.133 861 1HB PRO 112 HB2 PRO 112 250.764 11.767 7.934 862 2HB PRO 112 HB1 PRO 112 251.235 13.329 7.254 863 1HG PRO 112 HG2 PRO 112 248.879 11.614 6.607 864 2HG PRO 112 HG1 PRO 112 248.987 13.379 6.703 865 1HD PRO 112 HD2 PRO 112 249.102 11.835 4.363 866 2HD PRO 112 HD1 PRO 112 249.562 13.543 4.514 867 H PHE 113 HN PHE 113 253.432 9.913 5.527 868 HA PHE 113 HA PHE 113 251.720 7.624 5.482 869 1HB PHE 113 HB2 PHE 113 254.656 7.292 5.780 870 2HB PHE 113 HB1 PHE 113 253.528 6.417 4.763 871 HD1 PHE 113 HD1 PHE 113 256.213 7.334 3.964 872 HD2 PHE 113 HD2 PHE 113 252.415 9.241 3.625 873 HE1 PHE 113 HE1 PHE 113 257.026 8.575 2.018 874 HE2 PHE 113 HE2 PHE 113 253.243 10.495 1.678 875 HZ PHE 113 HZ PHE 113 255.540 10.170 0.868 876 H LYS 114 HN LYS 114 253.380 9.300 7.957 877 HA LYS 114 HA LYS 114 253.782 7.096 9.722 878 1HB LYS 114 HB2 LYS 114 254.040 10.054 9.879 879 2HB LYS 114 HB1 LYS 114 253.827 9.189 11.396 880 1HG LYS 114 HG2 LYS 114 255.847 8.060 9.586 881 2HG LYS 114 HG1 LYS 114 256.213 9.662 10.227 882 1HD LYS 114 HD2 LYS 114 257.093 8.384 11.901 883 2HD LYS 114 HD1 LYS 114 255.436 8.528 12.492 884 1HE LYS 114 HE2 LYS 114 255.213 6.352 10.905 885 2HE LYS 114 HE1 LYS 114 256.883 6.187 11.441 886 1HZ LYS 114 HZ1 LYS 114 254.692 6.680 13.361 887 2HZ LYS 114 HZ2 LYS 114 256.233 6.050 13.659 888 3HZ LYS 114 HZ3 LYS 114 255.079 5.114 12.851 889 H ASP 115 HN ASP 115 251.167 9.226 8.971 890 HA ASP 115 HA ASP 115 249.688 8.380 11.330 891 1HB ASP 115 HB2 ASP 115 249.346 10.565 9.319 892 2HB ASP 115 HB1 ASP 115 247.934 9.995 10.205 893 H MET 116 HN MET 116 250.347 6.562 9.098 894 HA MET 116 HA MET 116 247.599 5.728 8.485 895 1HB MET 116 HB2 MET 116 249.636 5.189 6.399 896 2HB MET 116 HB1 MET 116 247.923 5.540 6.236 897 1HG MET 116 HG2 MET 116 248.615 7.926 6.996 898 2HG MET 116 HG1 MET 116 250.222 7.416 6.492 899 1HE MET 116 HE1 MET 116 250.727 7.692 3.324 900 2HE MET 116 HE2 MET 116 249.777 6.240 3.007 901 3HE MET 116 HE3 MET 116 250.747 6.356 4.473 902 H TRP 117 HN TRP 117 250.814 4.418 7.646 903 HA TRP 117 HA TRP 117 250.474 2.232 9.505 904 1HB TRP 117 HB2 TRP 117 249.615 1.971 6.782 905 2HB TRP 117 HB1 TRP 117 250.999 0.918 7.047 906 HD1 TRP 117 HD1 TRP 117 248.776 1.418 10.056 907 HE1 TRP 117 HE1 TRP 117 247.416 -0.724 10.478 908 HE3 TRP 117 HE3 TRP 117 249.845 -1.093 5.731 909 HZ2 TRP 117 HZ2 TRP 117 246.866 -3.155 9.155 910 HZ3 TRP 117 HZ3 TRP 117 248.861 -3.321 5.387 911 HH2 TRP 117 HH2 TRP 117 247.402 -4.330 7.065 912 HA PRO 118 HA PRO 118 254.876 2.035 9.164 913 1HB PRO 118 HB2 PRO 118 255.434 -0.478 9.828 914 2HB PRO 118 HB1 PRO 118 254.612 0.601 10.960 915 1HG PRO 118 HG2 PRO 118 253.480 -1.577 9.261 916 2HG PRO 118 HG1 PRO 118 253.062 -1.114 10.918 917 1HD PRO 118 HD2 PRO 118 251.665 -0.377 8.620 918 2HD PRO 118 HD1 PRO 118 251.533 0.405 10.206 919 H ASP 119 HN ASP 119 253.240 1.088 6.610 920 HA ASP 119 HA ASP 119 255.610 -0.032 5.267 921 1HB ASP 119 HB2 ASP 119 253.867 -1.187 3.737 922 2HB ASP 119 HB1 ASP 119 254.199 -1.890 5.316 923 H ASP 120 HN ASP 120 253.014 2.230 5.240 924 HA ASP 120 HA ASP 120 252.636 2.929 2.642 925 1HB ASP 120 HB2 ASP 120 252.841 4.663 5.086 926 2HB ASP 120 HB1 ASP 120 252.342 5.292 3.517 927 H SER 121 HN SER 121 255.239 4.237 4.689 928 HA SER 121 HA SER 121 256.429 5.867 2.759 929 1HB SER 121 HB2 SER 121 258.143 4.507 4.792 930 2HB SER 121 HB1 SER 121 258.121 6.198 4.289 931 HG SER 121 HG SER 121 256.939 5.119 6.386 932 H TYR 122 HN TYR 122 256.425 2.439 2.937 933 HA TYR 122 HA TYR 122 258.922 2.118 1.538 934 1HB TYR 122 HB2 TYR 122 256.790 0.140 2.344 935 2HB TYR 122 HB1 TYR 122 258.282 -0.303 1.522 936 HD1 TYR 122 HD1 TYR 122 256.953 1.257 4.617 937 HD2 TYR 122 HD2 TYR 122 260.272 -0.628 2.737 938 HE1 TYR 122 HE1 TYR 122 258.100 1.122 6.788 939 HE2 TYR 122 HE2 TYR 122 261.426 -0.769 4.903 940 HH TYR 122 HH TYR 122 261.331 0.527 7.129 941 H TRP 123 HN TRP 123 255.475 2.050 0.711 942 HA TRP 123 HA TRP 123 256.272 1.470 -2.044 943 1HB TRP 123 HB2 TRP 123 253.907 0.928 -2.487 944 2HB TRP 123 HB1 TRP 123 254.608 -0.073 -1.225 945 HD1 TRP 123 HD1 TRP 123 253.827 0.536 1.348 946 HE1 TRP 123 HE1 TRP 123 251.566 1.431 2.195 947 HE3 TRP 123 HE3 TRP 123 251.984 2.390 -3.048 948 HZ2 TRP 123 HZ2 TRP 123 249.302 2.767 1.138 949 HZ3 TRP 123 HZ3 TRP 123 249.761 3.450 -3.037 950 HH2 TRP 123 HH2 TRP 123 248.455 3.627 -0.992 951 H PHE 124 HN PHE 124 255.329 4.059 -0.105 952 HA PHE 124 HA PHE 124 253.841 5.581 -1.961 953 1HB PHE 124 HB2 PHE 124 255.111 6.019 0.642 954 2HB PHE 124 HB1 PHE 124 255.127 7.449 -0.384 955 HD1 PHE 124 HD1 PHE 124 253.337 8.882 -0.221 956 HD2 PHE 124 HD2 PHE 124 252.764 4.757 0.655 957 HE1 PHE 124 HE1 PHE 124 251.014 9.344 0.402 958 HE2 PHE 124 HE2 PHE 124 250.432 5.216 1.282 959 HZ PHE 124 HZ PHE 124 249.554 7.512 1.157 960 HA PRO 125 HA PRO 125 258.118 7.782 -2.909 961 1HB PRO 125 HB2 PRO 125 260.265 6.053 -2.649 962 2HB PRO 125 HB1 PRO 125 259.821 7.303 -1.484 963 1HG PRO 125 HG2 PRO 125 259.240 4.376 -1.440 964 2HG PRO 125 HG1 PRO 125 259.669 5.457 -0.102 965 1HD PRO 125 HD2 PRO 125 257.148 4.642 -0.504 966 2HD PRO 125 HD1 PRO 125 257.510 6.272 0.097 967 H LEU 126 HN LEU 126 257.509 4.377 -3.493 968 HA LEU 126 HA LEU 126 258.790 4.407 -6.079 969 1HB LEU 126 HB2 LEU 126 257.226 2.383 -4.517 970 2HB LEU 126 HB1 LEU 126 257.534 2.128 -6.226 971 HG LEU 126 HG LEU 126 259.862 2.783 -4.499 972 1HD1 LEU 126 HD11 LEU 126 258.106 0.551 -3.987 973 2HD1 LEU 126 HD12 LEU 126 259.516 1.106 -3.086 974 3HD1 LEU 126 HD13 LEU 126 259.718 0.008 -4.451 975 1HD2 LEU 126 HD21 LEU 126 259.848 0.582 -6.469 976 2HD2 LEU 126 HD22 LEU 126 261.060 1.823 -6.161 977 3HD2 LEU 126 HD23 LEU 126 259.622 2.211 -7.104 978 H LEU 127 HN LEU 127 255.591 4.806 -4.760 979 HA LEU 127 HA LEU 127 254.085 4.504 -7.129 980 1HB LEU 127 HB2 LEU 127 253.599 6.168 -4.657 981 2HB LEU 127 HB1 LEU 127 252.419 5.961 -5.935 982 HG LEU 127 HG LEU 127 252.965 4.291 -3.672 983 1HD1 LEU 127 HD11 LEU 127 250.862 3.171 -4.597 984 2HD1 LEU 127 HD12 LEU 127 250.900 4.426 -5.836 985 3HD1 LEU 127 HD13 LEU 127 250.755 4.869 -4.135 986 1HD2 LEU 127 HD21 LEU 127 254.403 3.005 -5.176 987 2HD2 LEU 127 HD22 LEU 127 253.083 2.885 -6.337 988 3HD2 LEU 127 HD23 LEU 127 252.944 2.108 -4.761 989 H LEU 128 HN LEU 128 255.279 7.390 -5.458 990 HA LEU 128 HA LEU 128 254.541 9.279 -7.389 991 1HB LEU 128 HB2 LEU 128 256.474 9.192 -5.136 992 2HB LEU 128 HB1 LEU 128 256.686 10.470 -6.318 993 HG LEU 128 HG LEU 128 253.968 10.075 -5.167 994 1HD1 LEU 128 HD11 LEU 128 255.783 11.853 -3.661 995 2HD1 LEU 128 HD12 LEU 128 255.968 10.120 -3.391 996 3HD1 LEU 128 HD13 LEU 128 254.410 10.895 -3.108 997 1HD2 LEU 128 HD21 LEU 128 254.017 12.570 -5.330 998 2HD2 LEU 128 HD22 LEU 128 254.206 11.731 -6.869 999 3HD2 LEU 128 HD23 LEU 128 255.612 12.432 -6.070 1000 H GLN 129 HN GLN 129 257.149 7.019 -7.305 1001 HA GLN 129 HA GLN 129 258.729 8.362 -9.313 1002 1HB GLN 129 HB2 GLN 129 258.986 5.949 -7.633 1003 2HB GLN 129 HB1 GLN 129 259.746 5.844 -9.215 1004 1HG GLN 129 HG2 GLN 129 261.395 7.234 -8.649 1005 2HG GLN 129 HG1 GLN 129 260.309 8.335 -7.803 1006 1HE2 GLN 129 HE21 GLN 129 262.125 8.451 -6.293 1007 2HE2 GLN 129 HE22 GLN 129 262.244 7.259 -5.047 1008 H LYS 130 HN LYS 130 255.862 6.864 -9.532 1009 HA LYS 130 HA LYS 130 254.675 5.802 -11.134 1010 1HB LYS 130 HB2 LYS 130 254.927 6.579 -13.328 1011 2HB LYS 130 HB1 LYS 130 255.535 7.891 -12.333 1012 1HG LYS 130 HG2 LYS 130 257.617 6.018 -13.153 1013 2HG LYS 130 HG1 LYS 130 256.794 6.793 -14.504 1014 1HD LYS 130 HD2 LYS 130 257.537 8.879 -13.942 1015 2HD LYS 130 HD1 LYS 130 257.624 8.503 -12.220 1016 1HE LYS 130 HE2 LYS 130 259.847 8.500 -12.633 1017 2HE LYS 130 HE1 LYS 130 259.519 6.841 -13.134 1018 1HZ LYS 130 HZ1 LYS 130 259.052 8.104 -15.407 1019 2HZ LYS 130 HZ2 LYS 130 260.588 7.543 -14.976 1020 3HZ LYS 130 HZ3 LYS 130 260.188 9.171 -14.747 1021 H LYS 131 HN LYS 131 256.685 4.264 -9.827 1022 HA LYS 131 HA LYS 131 257.367 2.344 -11.959 1023 1HB LYS 131 HB2 LYS 131 258.792 2.980 -9.376 1024 2HB LYS 131 HB1 LYS 131 259.128 1.532 -10.314 1025 1HG LYS 131 HG2 LYS 131 259.401 3.352 -12.247 1026 2HG LYS 131 HG1 LYS 131 259.826 4.350 -10.855 1027 1HD LYS 131 HD2 LYS 131 261.275 2.174 -10.282 1028 2HD LYS 131 HD1 LYS 131 261.239 2.034 -12.041 1029 1HE LYS 131 HE2 LYS 131 261.897 4.670 -10.819 1030 2HE LYS 131 HE1 LYS 131 263.126 3.405 -10.821 1031 1HZ LYS 131 HZ1 LYS 131 262.034 4.935 -13.036 1032 2HZ LYS 131 HZ2 LYS 131 262.310 3.296 -13.346 1033 3HZ LYS 131 HZ3 LYS 131 263.582 4.284 -12.828 1034 H LYS 132 HN LYS 132 257.201 0.084 -11.413 1035 HA LYS 132 HA LYS 132 255.158 -0.397 -9.355 1036 1HB LYS 132 HB2 LYS 132 255.808 -1.982 -11.845 1037 2HB LYS 132 HB1 LYS 132 254.598 -2.438 -10.654 1038 1HG LYS 132 HG2 LYS 132 253.128 -0.830 -11.324 1039 2HG LYS 132 HG1 LYS 132 254.400 0.255 -11.888 1040 1HD LYS 132 HD2 LYS 132 253.972 -2.342 -13.293 1041 2HD LYS 132 HD1 LYS 132 252.858 -1.007 -13.597 1042 1HE LYS 132 HE2 LYS 132 255.731 -0.341 -13.676 1043 2HE LYS 132 HE1 LYS 132 255.149 -1.394 -14.965 1044 1HZ LYS 132 HZ1 LYS 132 254.798 0.679 -15.846 1045 2HZ LYS 132 HZ2 LYS 132 254.402 1.384 -14.360 1046 3HZ LYS 132 HZ3 LYS 132 253.287 0.381 -15.143 1047 H PHE 133 HN PHE 133 255.556 -1.764 -7.710 1048 HA PHE 133 HA PHE 133 257.747 -3.665 -7.890 1049 1HB PHE 133 HB2 PHE 133 259.118 -2.768 -6.285 1050 2HB PHE 133 HB1 PHE 133 258.466 -1.282 -6.964 1051 HD1 PHE 133 HD1 PHE 133 259.410 -2.584 -4.022 1052 HD2 PHE 133 HD2 PHE 133 255.930 -0.889 -5.792 1053 HE1 PHE 133 HE1 PHE 133 258.593 -1.942 -1.792 1054 HE2 PHE 133 HE2 PHE 133 255.108 -0.241 -3.565 1055 HZ PHE 133 HZ PHE 133 256.441 -0.767 -1.561 1056 H HIS 134 HN HIS 134 257.912 -4.954 -5.816 1057 HA HIS 134 HA HIS 134 255.269 -5.297 -4.562 1058 1HB HIS 134 HB2 HIS 134 257.123 -7.359 -5.732 1059 2HB HIS 134 HB1 HIS 134 256.028 -7.791 -4.424 1060 HD1 HIS 134 HD1 HIS 134 254.628 -9.354 -5.891 1061 HD2 HIS 134 HD2 HIS 134 254.783 -5.448 -7.299 1062 HE1 HIS 134 HE1 HIS 134 252.873 -9.215 -7.687 1063 HE2 HIS 134 HE2 HIS 134 253.040 -6.866 -8.577 1064 H GLY 135 HN GLY 135 255.358 -5.127 -2.382 1065 1HA GLY 135 HA2 GLY 135 258.019 -5.440 -1.140 1066 2HA GLY 135 HA1 GLY 135 256.798 -4.320 -0.566 1067 H TYR 136 HN TYR 136 258.310 -6.974 0.308 1068 HA TYR 136 HA TYR 136 255.932 -8.245 1.494 1069 1HB TYR 136 HB2 TYR 136 257.046 -9.873 0.177 1070 2HB TYR 136 HB1 TYR 136 258.631 -9.358 0.736 1071 HD1 TYR 136 HD1 TYR 136 255.711 -9.956 2.925 1072 HD2 TYR 136 HD2 TYR 136 259.427 -11.461 1.502 1073 HE1 TYR 136 HE1 TYR 136 255.660 -11.699 4.654 1074 HE2 TYR 136 HE2 TYR 136 259.387 -13.211 3.227 1075 HH TYR 136 HH TYR 136 257.401 -14.400 4.597 1076 H PHE 137 HN PHE 137 255.630 -7.765 3.572 1077 HA PHE 137 HA PHE 137 258.010 -7.179 5.210 1078 1HB PHE 137 HB2 PHE 137 255.277 -6.025 5.719 1079 2HB PHE 137 HB1 PHE 137 256.824 -5.497 6.371 1080 HD1 PHE 137 HD1 PHE 137 254.969 -5.821 3.164 1081 HD2 PHE 137 HD2 PHE 137 257.960 -3.751 5.370 1082 HE1 PHE 137 HE1 PHE 137 255.176 -4.182 1.339 1083 HE2 PHE 137 HE2 PHE 137 258.171 -2.111 3.552 1084 HZ PHE 137 HZ PHE 137 256.779 -2.322 1.533 1085 H LYS 138 HN LYS 138 258.234 -8.211 7.115 1086 HA LYS 138 HA LYS 138 256.298 -10.264 7.821 1087 1HB LYS 138 HB2 LYS 138 259.074 -10.122 7.936 1088 2HB LYS 138 HB1 LYS 138 258.576 -9.967 9.615 1089 1HG LYS 138 HG2 LYS 138 257.023 -12.041 8.728 1090 2HG LYS 138 HG1 LYS 138 258.534 -12.285 7.851 1091 1HD LYS 138 HD2 LYS 138 259.768 -12.556 9.797 1092 2HD LYS 138 HD1 LYS 138 258.573 -11.718 10.788 1093 1HE LYS 138 HE2 LYS 138 257.143 -13.558 10.835 1094 2HE LYS 138 HE1 LYS 138 257.909 -14.306 9.434 1095 1HZ LYS 138 HZ1 LYS 138 258.664 -15.537 11.240 1096 2HZ LYS 138 HZ2 LYS 138 258.894 -14.175 12.216 1097 3HZ LYS 138 HZ3 LYS 138 259.948 -14.479 10.930 1098 H PHE 139 HN PHE 139 254.944 -10.106 9.574 1099 HA PHE 139 HA PHE 139 255.071 -7.564 11.043 1100 1HB PHE 139 HB2 PHE 139 252.918 -9.190 9.969 1101 2HB PHE 139 HB1 PHE 139 252.658 -8.847 11.675 1102 HD1 PHE 139 HD1 PHE 139 252.303 -7.640 8.376 1103 HD2 PHE 139 HD2 PHE 139 252.897 -6.371 12.393 1104 HE1 PHE 139 HE1 PHE 139 251.460 -5.403 7.791 1105 HE2 PHE 139 HE2 PHE 139 252.059 -4.133 11.813 1106 HZ PHE 139 HZ PHE 139 251.338 -3.647 9.511 1107 H GLN 140 HN GLN 140 254.347 -7.611 13.317 1108 HA GLN 140 HA GLN 140 255.352 -10.007 14.708 1109 1HB GLN 140 HB2 GLN 140 256.895 -8.214 15.048 1110 2HB GLN 140 HB1 GLN 140 255.603 -7.083 15.392 1111 1HG GLN 140 HG2 GLN 140 256.944 -7.854 17.363 1112 2HG GLN 140 HG1 GLN 140 255.196 -8.029 17.507 1113 1HE2 GLN 140 HE21 GLN 140 254.885 -9.754 18.737 1114 2HE2 GLN 140 HE22 GLN 140 255.595 -11.310 18.493 1115 H GLY 141 HN GLY 141 252.571 -8.618 13.918 1116 1HA GLY 141 HA2 GLY 141 250.936 -9.908 15.680 1117 2HA GLY 141 HA1 GLY 141 251.280 -8.377 16.472 1118 H GLN 142 HN GLN 142 251.246 -6.553 14.485 1119 HA GLN 142 HA GLN 142 249.263 -6.787 12.542 1120 1HB GLN 142 HB2 GLN 142 248.257 -6.311 15.250 1121 2HB GLN 142 HB1 GLN 142 247.694 -5.130 14.077 1122 1HG GLN 142 HG2 GLN 142 247.524 -7.872 13.114 1123 2HG GLN 142 HG1 GLN 142 246.569 -7.578 14.567 1124 1HE2 GLN 142 HE21 GLN 142 247.297 -6.017 11.463 1125 2HE2 GLN 142 HE22 GLN 142 245.678 -5.508 11.144 1126 H ASP 143 HN ASP 143 250.895 -4.669 14.844 1127 HA ASP 143 HA ASP 143 250.874 -2.570 12.773 1128 1HB ASP 143 HB2 ASP 143 251.102 -2.057 15.735 1129 2HB ASP 143 HB1 ASP 143 250.817 -0.883 14.454 1130 H THR 144 HN THR 144 252.855 -4.693 14.492 1131 HA THR 144 HA THR 144 255.180 -2.916 14.231 1132 HB THR 144 HB THR 144 254.815 -5.486 15.768 1133 HG1 THR 144 HG1 THR 144 255.235 -4.090 17.531 1134 1HG2 THR 144 HG21 THR 144 257.000 -5.815 15.667 1135 2HG2 THR 144 HG22 THR 144 257.203 -4.306 16.556 1136 3HG2 THR 144 HG23 THR 144 257.249 -4.305 14.793 1137 H ILE 145 HN ILE 145 256.817 -3.324 12.858 1138 HA ILE 145 HA ILE 145 256.565 -5.739 11.212 1139 HB ILE 145 HB ILE 145 257.967 -3.179 10.452 1140 1HG1 ILE 145 HG12 ILE 145 255.327 -4.289 9.472 1141 2HG1 ILE 145 HG11 ILE 145 255.497 -2.940 10.591 1142 1HG2 ILE 145 HG21 ILE 145 257.328 -5.648 8.837 1143 2HG2 ILE 145 HG22 ILE 145 258.923 -5.188 9.431 1144 3HG2 ILE 145 HG23 ILE 145 258.108 -4.188 8.229 1145 1HD1 ILE 145 HD11 ILE 145 256.478 -3.015 7.750 1146 2HD1 ILE 145 HD12 ILE 145 256.666 -1.666 8.870 1147 3HD1 ILE 145 HD13 ILE 145 255.057 -2.159 8.344 1148 H LEU 146 HN LEU 146 258.336 -7.000 10.804 1149 HA LEU 146 HA LEU 146 260.734 -6.394 12.400 1150 1HB LEU 146 HB2 LEU 146 259.810 -9.188 11.819 1151 2HB LEU 146 HB1 LEU 146 260.905 -8.629 13.074 1152 HG LEU 146 HG LEU 146 257.971 -7.931 13.041 1153 1HD1 LEU 146 HD11 LEU 146 258.890 -10.480 13.325 1154 2HD1 LEU 146 HD12 LEU 146 257.402 -9.851 14.030 1155 3HD1 LEU 146 HD13 LEU 146 258.877 -9.910 14.994 1156 1HD2 LEU 146 HD21 LEU 146 260.270 -7.399 14.806 1157 2HD2 LEU 146 HD22 LEU 146 258.778 -7.876 15.616 1158 3HD2 LEU 146 HD23 LEU 146 258.791 -6.472 14.549 1159 H ASP 147 HN ASP 147 259.475 -7.118 9.322 1160 HA ASP 147 HA ASP 147 262.130 -7.098 8.193 1161 1HB ASP 147 HB2 ASP 147 260.857 -9.568 8.648 1162 2HB ASP 147 HB1 ASP 147 260.695 -9.259 6.922 1163 H TYR 148 HN TYR 148 262.168 -6.188 6.168 1164 HA TYR 148 HA TYR 148 259.628 -5.958 4.741 1165 1HB TYR 148 HB2 TYR 148 259.833 -3.595 4.396 1166 2HB TYR 148 HB1 TYR 148 259.895 -3.919 6.124 1167 HD1 TYR 148 HD1 TYR 148 262.048 -3.209 3.176 1168 HD2 TYR 148 HD2 TYR 148 261.694 -3.146 7.415 1169 HE1 TYR 148 HE1 TYR 148 264.161 -1.959 3.328 1170 HE2 TYR 148 HE2 TYR 148 263.806 -1.897 7.580 1171 HH TYR 148 HH TYR 148 265.952 -1.694 5.995 1172 H THR 149 HN THR 149 259.788 -6.106 2.565 1173 HA THR 149 HA THR 149 262.479 -5.937 1.389 1174 HB THR 149 HB THR 149 261.140 -7.780 -0.185 1175 HG1 THR 149 HG1 THR 149 260.731 -8.449 2.538 1176 1HG2 THR 149 HG21 THR 149 262.579 -9.456 1.246 1177 2HG2 THR 149 HG22 THR 149 263.290 -7.955 1.840 1178 3HG2 THR 149 HG23 THR 149 263.317 -8.322 0.115 1179 H LEU 150 HN LEU 150 262.608 -5.121 -0.669 1180 HA LEU 150 HA LEU 150 260.118 -4.210 -1.924 1181 1HB LEU 150 HB2 LEU 150 262.564 -2.531 -1.383 1182 2HB LEU 150 HB1 LEU 150 261.300 -2.063 -2.504 1183 HG LEU 150 HG LEU 150 259.801 -2.523 -0.311 1184 1HD1 LEU 150 HD11 LEU 150 260.841 -2.232 1.667 1185 2HD1 LEU 150 HD12 LEU 150 262.042 -1.127 0.999 1186 3HD1 LEU 150 HD13 LEU 150 262.227 -2.867 0.782 1187 1HD2 LEU 150 HD21 LEU 150 261.184 0.112 -0.478 1188 2HD2 LEU 150 HD22 LEU 150 259.474 -0.253 -0.245 1189 3HD2 LEU 150 HD23 LEU 150 260.206 -0.433 -1.840 1190 H ARG 151 HN ARG 151 260.011 -4.888 -3.962 1191 HA ARG 151 HA ARG 151 262.488 -5.073 -5.526 1192 1HB ARG 151 HB2 ARG 151 260.365 -7.221 -5.518 1193 2HB ARG 151 HB1 ARG 151 261.880 -7.239 -6.411 1194 1HG ARG 151 HG2 ARG 151 261.653 -7.244 -3.409 1195 2HG ARG 151 HG1 ARG 151 261.912 -8.674 -4.410 1196 1HD ARG 151 HD2 ARG 151 263.761 -6.349 -4.683 1197 2HD ARG 151 HD1 ARG 151 263.933 -7.424 -3.298 1198 HE ARG 151 HE ARG 151 264.638 -9.118 -4.712 1199 1HH1 ARG 151 HH11 ARG 151 263.622 -6.337 -6.571 1200 2HH1 ARG 151 HH12 ARG 151 264.320 -6.917 -8.045 1201 1HH2 ARG 151 HH21 ARG 151 265.553 -9.874 -6.652 1202 2HH2 ARG 151 HH22 ARG 151 265.414 -8.922 -8.092 1203 H GLU 152 HN GLU 152 262.284 -3.919 -7.318 1204 HA GLU 152 HA GLU 152 259.687 -3.071 -8.242 1205 1HB GLU 152 HB2 GLU 152 262.311 -2.577 -9.636 1206 2HB GLU 152 HB1 GLU 152 260.842 -1.615 -9.712 1207 1HG GLU 152 HG2 GLU 152 261.147 -0.920 -7.408 1208 2HG GLU 152 HG1 GLU 152 262.586 -1.930 -7.280 1209 H VAL 153 HN VAL 153 258.658 -3.650 -10.114 1210 HA VAL 153 HA VAL 153 259.938 -5.614 -11.866 1211 HB VAL 153 HB VAL 153 257.907 -7.028 -11.872 1212 1HG1 VAL 153 HG11 VAL 153 258.406 -8.220 -9.877 1213 2HG1 VAL 153 HG12 VAL 153 259.024 -6.769 -9.088 1214 3HG1 VAL 153 HG13 VAL 153 259.912 -7.490 -10.430 1215 1HG2 VAL 153 HG21 VAL 153 256.049 -6.610 -10.657 1216 2HG2 VAL 153 HG22 VAL 153 256.626 -4.946 -10.748 1217 3HG2 VAL 153 HG23 VAL 153 256.954 -5.914 -9.312 1218 H ASP 154 HN ASP 154 258.853 -5.878 -13.921 1219 HA ASP 154 HA ASP 154 257.183 -3.552 -14.625 1220 1HB ASP 154 HB2 ASP 154 259.479 -4.842 -16.055 1221 2HB ASP 154 HB1 ASP 154 258.222 -4.034 -16.988 1222 H THR 155 HN THR 155 257.863 -6.960 -15.263 1223 HA THR 155 HA THR 155 255.851 -7.426 -17.152 1224 HB THR 155 HB THR 155 256.627 -9.508 -15.138 1225 HG1 THR 155 HG1 THR 155 258.616 -9.610 -15.873 1226 1HG2 THR 155 HG21 THR 155 255.420 -10.648 -16.655 1227 2HG2 THR 155 HG22 THR 155 256.954 -10.658 -17.526 1228 3HG2 THR 155 HG23 THR 155 255.714 -9.473 -17.937 1229 H VAL 156 HN VAL 156 255.759 -8.400 -13.719 1230 HA VAL 156 HA VAL 156 253.147 -7.328 -13.311 1231 HB VAL 156 HB VAL 156 252.532 -9.301 -14.647 1232 1HG1 VAL 156 HG11 VAL 156 253.255 -11.217 -12.535 1233 2HG1 VAL 156 HG12 VAL 156 254.606 -10.564 -13.461 1234 3HG1 VAL 156 HG13 VAL 156 253.287 -11.391 -14.290 1235 1HG2 VAL 156 HG21 VAL 156 251.687 -8.867 -11.867 1236 2HG2 VAL 156 HG22 VAL 156 251.250 -10.438 -12.541 1237 3HG2 VAL 156 HG23 VAL 156 250.731 -8.957 -13.346 Start of MODEL 13 1 1H MET 1 HT1 MET 1 240.044 -23.124 4.986 2 2H MET 1 HT2 MET 1 241.187 -24.391 4.800 3 3H MET 1 HT3 MET 1 239.538 -24.756 5.108 4 HA MET 1 HA MET 1 239.799 -25.148 2.884 5 1HB MET 1 HB2 MET 1 237.928 -23.570 3.691 6 2HB MET 1 HB1 MET 1 238.866 -22.285 2.943 7 1HG MET 1 HG2 MET 1 238.794 -23.952 0.884 8 2HG MET 1 HG1 MET 1 237.327 -24.487 1.701 9 1HE MET 1 HE1 MET 1 236.520 -24.075 -0.551 10 2HE MET 1 HE2 MET 1 237.019 -22.656 -1.472 11 3HE MET 1 HE3 MET 1 235.419 -22.709 -0.733 12 H GLY 2 HN GLY 2 240.865 -21.770 3.362 13 1HA GLY 2 HA2 GLY 2 243.067 -22.308 1.475 14 2HA GLY 2 HA1 GLY 2 242.057 -20.883 1.280 15 H ALA 3 HN ALA 3 244.342 -19.969 1.414 16 HA ALA 3 HA ALA 3 244.716 -18.982 4.123 17 1HB ALA 3 HB1 ALA 3 246.999 -19.567 4.325 18 2HB ALA 3 HB2 ALA 3 247.076 -20.133 2.657 19 3HB ALA 3 HB3 ALA 3 246.152 -21.039 3.854 20 H SER 4 HN SER 4 247.050 -17.608 3.822 21 HA SER 4 HA SER 4 247.828 -15.596 3.094 22 1HB SER 4 HB2 SER 4 248.316 -15.406 0.777 23 2HB SER 4 HB1 SER 4 248.394 -17.129 1.142 24 HG SER 4 HG SER 4 246.664 -17.473 -0.043 25 H ARG 5 HN ARG 5 246.251 -14.440 4.188 26 HA ARG 5 HA ARG 5 243.742 -13.749 3.156 27 1HB ARG 5 HB2 ARG 5 245.482 -12.122 5.018 28 2HB ARG 5 HB1 ARG 5 243.743 -11.962 4.812 29 1HG ARG 5 HG2 ARG 5 245.007 -14.518 5.745 30 2HG ARG 5 HG1 ARG 5 244.563 -13.222 6.857 31 1HD ARG 5 HD2 ARG 5 242.682 -14.599 4.944 32 2HD ARG 5 HD1 ARG 5 242.816 -14.952 6.667 33 HE ARG 5 HE ARG 5 242.319 -12.261 6.528 34 1HH1 ARG 5 HH11 ARG 5 240.709 -15.147 5.407 35 2HH1 ARG 5 HH12 ARG 5 239.124 -14.457 5.519 36 1HH2 ARG 5 HH21 ARG 5 240.236 -11.352 6.677 37 2HH2 ARG 5 HH22 ARG 5 238.856 -12.302 6.240 38 H LEU 6 HN LEU 6 243.764 -13.079 1.079 39 HA LEU 6 HA LEU 6 245.584 -10.998 0.208 40 1HB LEU 6 HB2 LEU 6 244.547 -13.055 -1.131 41 2HB LEU 6 HB1 LEU 6 243.300 -11.876 -1.485 42 HG LEU 6 HG LEU 6 246.172 -11.181 -1.975 43 1HD1 LEU 6 HD11 LEU 6 245.446 -13.453 -3.014 44 2HD1 LEU 6 HD12 LEU 6 246.275 -12.257 -4.010 45 3HD1 LEU 6 HD13 LEU 6 244.524 -12.438 -4.123 46 1HD2 LEU 6 HD21 LEU 6 243.881 -10.429 -3.719 47 2HD2 LEU 6 HD22 LEU 6 245.341 -9.524 -3.319 48 3HD2 LEU 6 HD23 LEU 6 244.030 -9.647 -2.145 49 H TYR 7 HN TYR 7 245.200 -8.949 0.481 50 HA TYR 7 HA TYR 7 242.422 -7.977 0.561 51 1HB TYR 7 HB2 TYR 7 244.782 -7.316 2.288 52 2HB TYR 7 HB1 TYR 7 243.538 -6.100 2.016 53 HD1 TYR 7 HD1 TYR 7 243.551 -9.774 2.753 54 HD2 TYR 7 HD2 TYR 7 242.066 -5.919 3.770 55 HE1 TYR 7 HE1 TYR 7 242.191 -10.775 4.541 56 HE2 TYR 7 HE2 TYR 7 240.705 -6.910 5.562 57 HH TYR 7 HH TYR 7 241.112 -9.478 6.977 58 H THR 8 HN THR 8 242.602 -5.392 0.379 59 HA THR 8 HA THR 8 244.297 -4.816 -1.969 60 HB THR 8 HB THR 8 242.496 -3.556 -2.938 61 HG1 THR 8 HG1 THR 8 240.889 -4.283 -0.730 62 1HG2 THR 8 HG21 THR 8 241.842 -6.323 -2.083 63 2HG2 THR 8 HG22 THR 8 242.153 -5.680 -3.693 64 3HG2 THR 8 HG23 THR 8 240.613 -5.361 -2.900 65 H LEU 9 HN LEU 9 244.499 -2.442 -2.374 66 HA LEU 9 HA LEU 9 244.253 -0.712 -0.063 67 1HB LEU 9 HB2 LEU 9 246.478 -2.065 0.017 68 2HB LEU 9 HB1 LEU 9 246.978 -1.004 -1.285 69 HG LEU 9 HG LEU 9 246.263 -0.233 1.529 70 1HD1 LEU 9 HD11 LEU 9 248.588 -1.142 0.755 71 2HD1 LEU 9 HD12 LEU 9 248.481 0.243 1.842 72 3HD1 LEU 9 HD13 LEU 9 248.780 0.493 0.123 73 1HD2 LEU 9 HD21 LEU 9 245.310 1.498 0.277 74 2HD2 LEU 9 HD22 LEU 9 246.614 1.472 -0.910 75 3HD2 LEU 9 HD23 LEU 9 246.912 2.094 0.713 76 H VAL 10 HN VAL 10 243.234 0.956 -1.064 77 HA VAL 10 HA VAL 10 244.295 1.829 -3.653 78 HB VAL 10 HB VAL 10 242.085 1.200 -4.008 79 1HG1 VAL 10 HG11 VAL 10 241.005 0.763 -2.109 80 2HG1 VAL 10 HG12 VAL 10 240.290 2.341 -2.433 81 3HG1 VAL 10 HG13 VAL 10 241.631 2.198 -1.298 82 1HG2 VAL 10 HG21 VAL 10 242.695 3.523 -4.795 83 2HG2 VAL 10 HG22 VAL 10 241.750 4.124 -3.432 84 3HG2 VAL 10 HG23 VAL 10 240.972 3.167 -4.691 85 H LEU 11 HN LEU 11 245.177 3.695 -3.846 86 HA LEU 11 HA LEU 11 244.650 5.796 -1.859 87 1HB LEU 11 HB2 LEU 11 247.112 4.448 -2.467 88 2HB LEU 11 HB1 LEU 11 247.251 6.126 -2.950 89 HG LEU 11 HG LEU 11 246.782 5.009 -0.195 90 1HD1 LEU 11 HD11 LEU 11 248.647 7.172 -0.335 91 2HD1 LEU 11 HD12 LEU 11 249.049 5.977 -1.570 92 3HD1 LEU 11 HD13 LEU 11 248.924 5.491 0.119 93 1HD2 LEU 11 HD21 LEU 11 245.264 6.681 0.015 94 2HD2 LEU 11 HD22 LEU 11 245.986 7.652 -1.269 95 3HD2 LEU 11 HD23 LEU 11 246.733 7.606 0.328 96 H VAL 12 HN VAL 12 243.591 7.347 -2.917 97 HA VAL 12 HA VAL 12 243.837 7.598 -5.774 98 HB VAL 12 HB VAL 12 242.263 9.350 -3.894 99 1HG1 VAL 12 HG11 VAL 12 242.094 10.504 -5.835 100 2HG1 VAL 12 HG12 VAL 12 240.865 9.289 -6.184 101 3HG1 VAL 12 HG13 VAL 12 242.496 9.103 -6.828 102 1HG2 VAL 12 HG21 VAL 12 241.853 6.594 -4.798 103 2HG2 VAL 12 HG22 VAL 12 240.466 7.653 -5.047 104 3HG2 VAL 12 HG23 VAL 12 241.147 7.457 -3.432 105 H LEU 13 HN LEU 13 245.784 8.373 -6.330 106 HA LEU 13 HA LEU 13 246.716 10.886 -5.148 107 1HB LEU 13 HB2 LEU 13 248.050 8.734 -6.732 108 2HB LEU 13 HB1 LEU 13 248.782 10.316 -6.550 109 HG LEU 13 HG LEU 13 249.253 8.246 -4.914 110 1HD1 LEU 13 HD11 LEU 13 249.646 10.307 -3.198 111 2HD1 LEU 13 HD12 LEU 13 249.542 11.143 -4.747 112 3HD1 LEU 13 HD13 LEU 13 250.734 9.866 -4.513 113 1HD2 LEU 13 HD21 LEU 13 247.056 8.064 -3.995 114 2HD2 LEU 13 HD22 LEU 13 247.024 9.785 -3.616 115 3HD2 LEU 13 HD23 LEU 13 248.125 8.714 -2.752 116 H GLN 14 HN GLN 14 247.539 12.549 -6.574 117 HA GLN 14 HA GLN 14 246.481 12.496 -9.309 118 1HB GLN 14 HB2 GLN 14 245.400 14.045 -7.197 119 2HB GLN 14 HB1 GLN 14 246.274 15.159 -8.239 120 1HG GLN 14 HG2 GLN 14 244.838 13.513 -9.971 121 2HG GLN 14 HG1 GLN 14 243.735 13.868 -8.642 122 1HE2 GLN 14 HE21 GLN 14 242.497 15.036 -10.220 123 2HE2 GLN 14 HE22 GLN 14 242.943 16.650 -10.644 124 HA PRO 15 HA PRO 15 250.423 14.086 -10.420 125 1HB PRO 15 HB2 PRO 15 249.841 15.888 -12.389 126 2HB PRO 15 HB1 PRO 15 249.821 14.135 -12.621 127 1HG PRO 15 HG2 PRO 15 247.544 16.006 -12.105 128 2HG PRO 15 HG1 PRO 15 247.639 14.641 -13.233 129 1HD PRO 15 HD2 PRO 15 246.381 14.453 -10.857 130 2HD PRO 15 HD1 PRO 15 247.249 13.081 -11.574 131 H GLN 16 HN GLN 16 248.703 15.657 -8.389 132 HA GLN 16 HA GLN 16 250.603 17.754 -8.012 133 1HB GLN 16 HB2 GLN 16 247.872 18.351 -9.054 134 2HB GLN 16 HB1 GLN 16 248.550 19.437 -7.848 135 1HG GLN 16 HG2 GLN 16 250.633 19.295 -9.517 136 2HG GLN 16 HG1 GLN 16 249.325 18.999 -10.661 137 1HE2 GLN 16 HE21 GLN 16 249.338 20.889 -11.742 138 2HE2 GLN 16 HE22 GLN 16 249.021 22.428 -11.023 139 H ARG 17 HN ARG 17 247.469 16.394 -7.108 140 HA ARG 17 HA ARG 17 248.196 16.788 -4.283 141 1HB ARG 17 HB2 ARG 17 245.692 16.987 -3.869 142 2HB ARG 17 HB1 ARG 17 246.473 18.362 -4.637 143 1HG ARG 17 HG2 ARG 17 245.559 16.574 -6.661 144 2HG ARG 17 HG1 ARG 17 244.242 16.889 -5.530 145 1HD ARG 17 HD2 ARG 17 244.124 19.095 -6.068 146 2HD ARG 17 HD1 ARG 17 245.850 19.216 -6.410 147 HE ARG 17 HE ARG 17 244.802 17.632 -8.402 148 1HH1 ARG 17 HH11 ARG 17 244.292 20.880 -7.231 149 2HH1 ARG 17 HH12 ARG 17 243.819 21.497 -8.778 150 1HH2 ARG 17 HH21 ARG 17 244.181 18.443 -10.438 151 2HH2 ARG 17 HH22 ARG 17 243.756 20.114 -10.599 152 H VAL 18 HN VAL 18 247.128 15.266 -2.800 153 HA VAL 18 HA VAL 18 246.418 12.710 -4.083 154 HB VAL 18 HB VAL 18 248.546 12.160 -3.388 155 1HG1 VAL 18 HG11 VAL 18 248.996 14.344 -2.314 156 2HG1 VAL 18 HG12 VAL 18 249.673 12.981 -1.423 157 3HG1 VAL 18 HG13 VAL 18 248.195 13.758 -0.856 158 1HG2 VAL 18 HG21 VAL 18 247.413 11.587 -0.707 159 2HG2 VAL 18 HG22 VAL 18 248.269 10.526 -1.826 160 3HG2 VAL 18 HG23 VAL 18 246.573 10.916 -2.104 161 H LEU 19 HN LEU 19 244.783 11.574 -3.125 162 HA LEU 19 HA LEU 19 243.403 12.927 -0.911 163 1HB LEU 19 HB2 LEU 19 242.087 12.732 -2.936 164 2HB LEU 19 HB1 LEU 19 242.375 11.004 -2.992 165 HG LEU 19 HG LEU 19 241.034 10.651 -1.021 166 1HD1 LEU 19 HD11 LEU 19 241.052 12.269 0.511 167 2HD1 LEU 19 HD12 LEU 19 239.775 13.024 -0.440 168 3HD1 LEU 19 HD13 LEU 19 241.453 13.510 -0.676 169 1HD2 LEU 19 HD21 LEU 19 239.091 10.765 -2.130 170 2HD2 LEU 19 HD22 LEU 19 240.064 11.409 -3.453 171 3HD2 LEU 19 HD23 LEU 19 239.214 12.508 -2.366 172 H LEU 20 HN LEU 20 243.765 12.057 1.014 173 HA LEU 20 HA LEU 20 244.201 9.151 1.196 174 1HB LEU 20 HB2 LEU 20 245.506 11.419 2.398 175 2HB LEU 20 HB1 LEU 20 244.866 10.367 3.647 176 HG LEU 20 HG LEU 20 246.597 9.340 1.410 177 1HD1 LEU 20 HD11 LEU 20 247.559 10.040 4.167 178 2HD1 LEU 20 HD12 LEU 20 247.698 11.148 2.802 179 3HD1 LEU 20 HD13 LEU 20 248.514 9.585 2.755 180 1HD2 LEU 20 HD21 LEU 20 246.043 8.221 4.149 181 2HD2 LEU 20 HD22 LEU 20 246.905 7.439 2.825 182 3HD2 LEU 20 HD23 LEU 20 245.175 7.745 2.690 183 H GLY 21 HN GLY 21 243.262 8.012 3.004 184 1HA GLY 21 HA2 GLY 21 240.691 9.209 3.809 185 2HA GLY 21 HA1 GLY 21 240.999 7.485 3.666 186 H MET 22 HN MET 22 240.376 9.746 5.857 187 HA MET 22 HA MET 22 242.145 8.567 7.891 188 1HB MET 22 HB2 MET 22 242.566 10.923 7.731 189 2HB MET 22 HB1 MET 22 240.846 11.290 7.776 190 1HG MET 22 HG2 MET 22 240.684 10.711 10.058 191 2HG MET 22 HG1 MET 22 242.276 9.959 10.056 192 1HE MET 22 HE1 MET 22 244.180 11.429 8.856 193 2HE MET 22 HE2 MET 22 244.651 11.585 10.547 194 3HE MET 22 HE3 MET 22 244.598 13.010 9.513 195 H LYS 23 HN LYS 23 241.262 7.773 9.788 196 HA LYS 23 HA LYS 23 238.436 7.147 9.667 197 1HB LYS 23 HB2 LYS 23 240.795 6.147 11.135 198 2HB LYS 23 HB1 LYS 23 239.281 6.096 12.027 199 1HG LYS 23 HG2 LYS 23 239.117 5.078 9.282 200 2HG LYS 23 HG1 LYS 23 240.168 4.153 10.358 201 1HD LYS 23 HD2 LYS 23 237.330 4.921 11.021 202 2HD LYS 23 HD1 LYS 23 237.792 3.376 10.307 203 1HE LYS 23 HE2 LYS 23 239.365 3.108 12.281 204 2HE LYS 23 HE1 LYS 23 238.522 4.474 13.008 205 1HZ LYS 23 HZ1 LYS 23 236.770 3.209 13.515 206 2HZ LYS 23 HZ2 LYS 23 237.794 1.888 13.258 207 3HZ LYS 23 HZ3 LYS 23 236.769 2.413 12.021 208 H LYS 24 HN LYS 24 236.914 7.760 11.241 209 HA LYS 24 HA LYS 24 237.575 10.278 12.524 210 1HB LYS 24 HB2 LYS 24 235.165 9.028 11.507 211 2HB LYS 24 HB1 LYS 24 234.915 9.647 13.133 212 1HG LYS 24 HG2 LYS 24 234.691 11.694 12.334 213 2HG LYS 24 HG1 LYS 24 236.317 11.620 11.651 214 1HD LYS 24 HD2 LYS 24 235.435 10.582 9.630 215 2HD LYS 24 HD1 LYS 24 233.809 10.604 10.315 216 1HE LYS 24 HE2 LYS 24 235.443 13.099 9.936 217 2HE LYS 24 HE1 LYS 24 234.387 12.458 8.677 218 1HZ LYS 24 HZ1 LYS 24 232.642 12.498 10.586 219 2HZ LYS 24 HZ2 LYS 24 233.004 13.919 9.742 220 3HZ LYS 24 HZ3 LYS 24 233.680 13.647 11.268 221 H ARG 25 HN ARG 25 236.809 6.980 13.384 222 HA ARG 25 HA ARG 25 237.875 7.352 15.987 223 1HB ARG 25 HB2 ARG 25 235.684 6.542 17.115 224 2HB ARG 25 HB1 ARG 25 235.865 8.246 16.724 225 1HG ARG 25 HG2 ARG 25 233.639 7.344 16.167 226 2HG ARG 25 HG1 ARG 25 234.493 7.999 14.766 227 1HD ARG 25 HD2 ARG 25 234.856 5.920 13.849 228 2HD ARG 25 HD1 ARG 25 234.748 5.099 15.404 229 HE ARG 25 HE ARG 25 232.596 5.673 13.604 230 1HH1 ARG 25 HH11 ARG 25 233.425 5.142 16.952 231 2HH1 ARG 25 HH12 ARG 25 231.836 4.613 17.392 232 1HH2 ARG 25 HH21 ARG 25 230.504 4.977 14.181 233 2HH2 ARG 25 HH22 ARG 25 230.178 4.519 15.819 234 H GLY 26 HN GLY 26 238.106 5.396 17.175 235 1HA GLY 26 HA2 GLY 26 237.711 3.011 17.371 236 2HA GLY 26 HA1 GLY 26 237.500 2.959 15.626 237 H PHE 27 HN PHE 27 239.111 1.853 14.743 238 HA PHE 27 HA PHE 27 241.791 2.063 15.910 239 1HB PHE 27 HB2 PHE 27 240.440 -0.159 15.228 240 2HB PHE 27 HB1 PHE 27 241.254 0.155 13.700 241 HD1 PHE 27 HD1 PHE 27 241.491 -1.741 16.496 242 HD2 PHE 27 HD2 PHE 27 243.855 0.973 14.225 243 HE1 PHE 27 HE1 PHE 27 243.534 -2.790 17.376 244 HE2 PHE 27 HE2 PHE 27 245.903 -0.072 15.100 245 HZ PHE 27 HZ PHE 27 245.744 -1.957 16.678 246 H GLY 28 HN GLY 28 242.080 4.218 14.989 247 1HA GLY 28 HA2 GLY 28 243.802 4.638 13.091 248 2HA GLY 28 HA1 GLY 28 242.430 4.244 12.071 249 H ALA 29 HN ALA 29 241.030 5.751 14.598 250 HA ALA 29 HA ALA 29 240.189 7.999 13.307 251 1HB ALA 29 HB1 ALA 29 239.769 6.987 15.753 252 2HB ALA 29 HB2 ALA 29 239.212 8.575 15.223 253 3HB ALA 29 HB3 ALA 29 240.701 8.429 16.156 254 H GLY 30 HN GLY 30 240.853 10.132 13.097 255 1HA GLY 30 HA2 GLY 30 242.335 11.868 12.870 256 2HA GLY 30 HA1 GLY 30 243.004 11.340 14.405 257 H ARG 31 HN ARG 31 243.009 9.153 11.710 258 HA ARG 31 HA ARG 31 245.795 9.811 11.087 259 1HB ARG 31 HB2 ARG 31 244.870 7.000 11.704 260 2HB ARG 31 HB1 ARG 31 246.498 7.494 11.262 261 1HG ARG 31 HG2 ARG 31 246.862 8.545 13.319 262 2HG ARG 31 HG1 ARG 31 245.142 8.567 13.711 263 1HD ARG 31 HD2 ARG 31 245.629 6.758 14.949 264 2HD ARG 31 HD1 ARG 31 245.577 5.906 13.407 265 HE ARG 31 HE ARG 31 247.821 5.555 13.585 266 1HH1 ARG 31 HH11 ARG 31 246.954 8.206 15.684 267 2HH1 ARG 31 HH12 ARG 31 248.534 8.337 16.379 268 1HH2 ARG 31 HH21 ARG 31 249.901 5.726 14.499 269 2HH2 ARG 31 HH22 ARG 31 250.209 6.929 15.706 270 H TRP 32 HN TRP 32 246.386 9.422 8.986 271 HA TRP 32 HA TRP 32 244.196 8.766 7.171 272 1HB TRP 32 HB2 TRP 32 246.744 9.456 5.908 273 2HB TRP 32 HB1 TRP 32 245.145 10.144 5.665 274 HD1 TRP 32 HD1 TRP 32 248.141 10.469 8.087 275 HE1 TRP 32 HE1 TRP 32 248.173 12.875 8.995 276 HE3 TRP 32 HE3 TRP 32 243.841 12.212 5.943 277 HZ2 TRP 32 HZ2 TRP 32 246.603 15.207 8.817 278 HZ3 TRP 32 HZ3 TRP 32 243.180 14.544 6.363 279 HH2 TRP 32 HH2 TRP 32 244.532 16.010 7.768 280 H ASN 33 HN ASN 33 244.442 7.269 5.440 281 HA ASN 33 HA ASN 33 246.644 5.586 5.071 282 1HB ASN 33 HB2 ASN 33 245.798 3.498 6.104 283 2HB ASN 33 HB1 ASN 33 246.178 4.733 7.301 284 1HD2 ASN 33 HD21 ASN 33 244.556 5.629 8.509 285 2HD2 ASN 33 HD22 ASN 33 242.939 5.020 8.519 286 H GLY 34 HN GLY 34 246.352 4.213 3.331 287 1HA GLY 34 HA2 GLY 34 244.434 4.808 1.446 288 2HA GLY 34 HA1 GLY 34 245.322 3.293 1.491 289 H PHE 35 HN PHE 35 242.808 3.251 0.499 290 HA PHE 35 HA PHE 35 241.082 2.315 2.674 291 1HB PHE 35 HB2 PHE 35 240.108 2.426 -0.142 292 2HB PHE 35 HB1 PHE 35 239.253 2.766 1.353 293 HD1 PHE 35 HD1 PHE 35 239.509 4.947 2.462 294 HD2 PHE 35 HD2 PHE 35 241.255 4.143 -1.333 295 HE1 PHE 35 HE1 PHE 35 239.800 7.361 2.089 296 HE2 PHE 35 HE2 PHE 35 241.553 6.554 -1.711 297 HZ PHE 35 HZ PHE 35 240.825 8.168 0.001 298 H GLY 36 HN GLY 36 241.714 0.275 3.156 299 1HA GLY 36 HA2 GLY 36 242.342 -1.596 1.033 300 2HA GLY 36 HA1 GLY 36 242.441 -1.908 2.759 301 H GLY 37 HN GLY 37 241.432 -3.828 1.137 302 1HA GLY 37 HA2 GLY 37 238.866 -4.283 2.271 303 2HA GLY 37 HA1 GLY 37 238.719 -3.841 0.576 304 H LYS 38 HN LYS 38 238.868 -6.394 2.607 305 HA LYS 38 HA LYS 38 240.624 -8.206 1.412 306 1HB LYS 38 HB2 LYS 38 239.357 -9.942 2.518 307 2HB LYS 38 HB1 LYS 38 239.492 -8.554 3.589 308 1HG LYS 38 HG2 LYS 38 237.182 -7.892 2.641 309 2HG LYS 38 HG1 LYS 38 237.100 -9.576 2.120 310 1HD LYS 38 HD2 LYS 38 237.745 -10.121 4.562 311 2HD LYS 38 HD1 LYS 38 237.243 -8.463 4.900 312 1HE LYS 38 HE2 LYS 38 235.137 -9.287 3.455 313 2HE LYS 38 HE1 LYS 38 235.631 -10.827 4.155 314 1HZ LYS 38 HZ1 LYS 38 235.100 -10.158 6.242 315 2HZ LYS 38 HZ2 LYS 38 233.992 -9.202 5.392 316 3HZ LYS 38 HZ3 LYS 38 235.440 -8.527 5.947 317 H VAL 39 HN VAL 39 240.315 -9.875 -0.098 318 HA VAL 39 HA VAL 39 238.553 -9.177 -2.272 319 HB VAL 39 HB VAL 39 240.266 -11.658 -2.091 320 1HG1 VAL 39 HG11 VAL 39 238.656 -11.618 -3.921 321 2HG1 VAL 39 HG12 VAL 39 240.302 -11.462 -4.535 322 3HG1 VAL 39 HG13 VAL 39 239.262 -10.043 -4.431 323 1HG2 VAL 39 HG21 VAL 39 242.102 -10.483 -2.966 324 2HG2 VAL 39 HG22 VAL 39 241.519 -9.511 -1.617 325 3HG2 VAL 39 HG23 VAL 39 241.137 -9.040 -3.273 326 H GLN 40 HN GLN 40 236.472 -9.694 -2.152 327 HA GLN 40 HA GLN 40 235.183 -11.404 -0.484 328 1HB GLN 40 HB2 GLN 40 234.389 -9.803 -2.507 329 2HB GLN 40 HB1 GLN 40 234.110 -11.376 -3.242 330 1HG GLN 40 HG2 GLN 40 232.115 -11.233 -2.250 331 2HG GLN 40 HG1 GLN 40 232.989 -11.745 -0.807 332 1HE2 GLN 40 HE21 GLN 40 232.481 -8.718 -2.598 333 2HE2 GLN 40 HE22 GLN 40 232.086 -7.766 -1.212 334 H GLU 41 HN GLU 41 233.998 -13.456 -1.026 335 HA GLU 41 HA GLU 41 235.837 -15.513 -1.538 336 1HB GLU 41 HB2 GLU 41 232.889 -15.356 -1.149 337 2HB GLU 41 HB1 GLU 41 233.550 -16.840 -1.822 338 1HG GLU 41 HG2 GLU 41 233.624 -17.373 0.377 339 2HG GLU 41 HG1 GLU 41 235.204 -16.605 0.225 340 H GLY 42 HN GLY 42 236.745 -14.849 -3.594 341 1HA GLY 42 HA2 GLY 42 236.950 -15.784 -5.774 342 2HA GLY 42 HA1 GLY 42 235.207 -15.991 -5.818 343 H GLU 43 HN GLU 43 237.216 -13.122 -5.107 344 HA GLU 43 HA GLU 43 236.037 -11.845 -7.456 345 1HB GLU 43 HB2 GLU 43 235.342 -9.993 -6.327 346 2HB GLU 43 HB1 GLU 43 235.197 -11.145 -5.012 347 1HG GLU 43 HG2 GLU 43 237.161 -10.377 -3.984 348 2HG GLU 43 HG1 GLU 43 237.674 -9.503 -5.426 349 H THR 44 HN THR 44 237.367 -9.758 -7.916 350 HA THR 44 HA THR 44 240.149 -10.637 -7.942 351 HB THR 44 HB THR 44 240.400 -9.066 -9.787 352 HG1 THR 44 HG1 THR 44 239.030 -7.509 -10.005 353 1HG2 THR 44 HG21 THR 44 238.329 -11.156 -9.783 354 2HG2 THR 44 HG22 THR 44 239.763 -10.981 -10.794 355 3HG2 THR 44 HG23 THR 44 238.312 -10.046 -11.153 356 H ILE 45 HN ILE 45 241.824 -9.392 -7.216 357 HA ILE 45 HA ILE 45 241.462 -7.848 -4.974 358 HB ILE 45 HB ILE 45 243.776 -7.337 -6.820 359 1HG1 ILE 45 HG12 ILE 45 244.644 -9.341 -5.187 360 2HG1 ILE 45 HG11 ILE 45 242.989 -9.849 -5.509 361 1HG2 ILE 45 HG21 ILE 45 243.861 -5.959 -4.938 362 2HG2 ILE 45 HG22 ILE 45 244.940 -7.302 -4.559 363 3HG2 ILE 45 HG23 ILE 45 243.321 -7.248 -3.864 364 1HD1 ILE 45 HD11 ILE 45 244.105 -9.059 -7.972 365 2HD1 ILE 45 HD12 ILE 45 243.665 -10.683 -7.439 366 3HD1 ILE 45 HD13 ILE 45 245.297 -10.075 -7.159 367 H GLU 46 HN GLU 46 241.435 -6.844 -8.336 368 HA GLU 46 HA GLU 46 241.468 -4.024 -7.772 369 1HB GLU 46 HB2 GLU 46 242.134 -5.210 -9.969 370 2HB GLU 46 HB1 GLU 46 240.408 -5.284 -10.297 371 1HG GLU 46 HG2 GLU 46 240.248 -2.883 -10.236 372 2HG GLU 46 HG1 GLU 46 241.939 -2.749 -9.758 373 H ASP 47 HN ASP 47 239.108 -6.542 -7.968 374 HA ASP 47 HA ASP 47 236.856 -4.747 -8.153 375 1HB ASP 47 HB2 ASP 47 237.204 -7.715 -7.911 376 2HB ASP 47 HB1 ASP 47 235.645 -7.003 -7.512 377 H GLY 48 HN GLY 48 238.588 -6.589 -5.719 378 1HA GLY 48 HA2 GLY 48 236.752 -6.045 -3.585 379 2HA GLY 48 HA1 GLY 48 238.401 -6.636 -3.414 380 H ALA 49 HN ALA 49 239.607 -4.468 -4.869 381 HA ALA 49 HA ALA 49 239.849 -2.569 -2.731 382 1HB ALA 49 HB1 ALA 49 241.749 -1.909 -3.758 383 2HB ALA 49 HB2 ALA 49 241.009 -1.901 -5.358 384 3HB ALA 49 HB3 ALA 49 241.554 -3.419 -4.646 385 H ARG 50 HN ARG 50 238.331 -2.719 -5.889 386 HA ARG 50 HA ARG 50 237.617 0.034 -5.999 387 1HB ARG 50 HB2 ARG 50 236.955 -2.416 -7.557 388 2HB ARG 50 HB1 ARG 50 235.882 -1.032 -7.713 389 1HG ARG 50 HG2 ARG 50 238.076 0.287 -8.154 390 2HG ARG 50 HG1 ARG 50 238.741 -1.307 -8.514 391 1HD ARG 50 HD2 ARG 50 237.879 -0.103 -10.510 392 2HD ARG 50 HD1 ARG 50 237.113 -1.666 -10.235 393 HE ARG 50 HE ARG 50 235.678 0.528 -9.068 394 1HH1 ARG 50 HH11 ARG 50 236.180 -1.319 -11.986 395 2HH1 ARG 50 HH12 ARG 50 234.630 -0.927 -12.650 396 1HH2 ARG 50 HH21 ARG 50 233.638 1.044 -9.939 397 2HH2 ARG 50 HH22 ARG 50 233.186 0.415 -11.489 398 H ARG 51 HN ARG 51 235.713 -2.917 -5.398 399 HA ARG 51 HA ARG 51 233.305 -1.625 -4.779 400 1HB ARG 51 HB2 ARG 51 233.885 -4.157 -5.210 401 2HB ARG 51 HB1 ARG 51 234.023 -4.209 -3.458 402 1HG ARG 51 HG2 ARG 51 231.705 -3.201 -3.378 403 2HG ARG 51 HG1 ARG 51 231.607 -3.535 -5.108 404 1HD ARG 51 HD2 ARG 51 231.550 -5.805 -4.806 405 2HD ARG 51 HD1 ARG 51 232.441 -5.734 -3.287 406 HE ARG 51 HE ARG 51 229.594 -5.574 -3.638 407 1HH1 ARG 51 HH11 ARG 51 232.267 -4.751 -1.551 408 2HH1 ARG 51 HH12 ARG 51 231.287 -4.654 -0.127 409 1HH2 ARG 51 HH21 ARG 51 228.304 -5.448 -1.766 410 2HH2 ARG 51 HH22 ARG 51 229.037 -5.052 -0.248 411 H GLU 52 HN GLU 52 236.073 -2.429 -2.782 412 HA GLU 52 HA GLU 52 234.736 -1.649 -0.337 413 1HB GLU 52 HB2 GLU 52 237.607 -2.414 -0.892 414 2HB GLU 52 HB1 GLU 52 236.966 -2.057 0.704 415 1HG GLU 52 HG2 GLU 52 235.463 -4.083 -0.783 416 2HG GLU 52 HG1 GLU 52 237.123 -4.531 -0.393 417 H LEU 53 HN LEU 53 236.587 -0.175 -2.808 418 HA LEU 53 HA LEU 53 237.690 1.967 -1.308 419 1HB LEU 53 HB2 LEU 53 238.729 1.514 -3.361 420 2HB LEU 53 HB1 LEU 53 237.203 1.460 -4.227 421 HG LEU 53 HG LEU 53 236.974 3.899 -3.909 422 1HD1 LEU 53 HD11 LEU 53 238.796 3.559 -1.913 423 2HD1 LEU 53 HD12 LEU 53 238.347 5.109 -2.626 424 3HD1 LEU 53 HD13 LEU 53 239.783 4.258 -3.195 425 1HD2 LEU 53 HD21 LEU 53 239.185 4.397 -5.301 426 2HD2 LEU 53 HD22 LEU 53 237.808 3.541 -5.994 427 3HD2 LEU 53 HD23 LEU 53 239.202 2.636 -5.403 428 H GLN 54 HN GLN 54 234.823 1.627 -3.355 429 HA GLN 54 HA GLN 54 233.893 4.269 -3.125 430 1HB GLN 54 HB2 GLN 54 232.837 3.115 -4.810 431 2HB GLN 54 HB1 GLN 54 232.678 1.648 -3.858 432 1HG GLN 54 HG2 GLN 54 230.871 2.651 -2.579 433 2HG GLN 54 HG1 GLN 54 231.051 4.154 -3.481 434 1HE2 GLN 54 HE21 GLN 54 230.533 0.687 -4.018 435 2HE2 GLN 54 HE22 GLN 54 229.412 0.879 -5.317 436 H GLU 55 HN GLU 55 233.759 1.579 -0.962 437 HA GLU 55 HA GLU 55 231.620 2.635 0.649 438 1HB GLU 55 HB2 GLU 55 233.471 0.285 1.003 439 2HB GLU 55 HB1 GLU 55 232.224 0.715 2.166 440 1HG GLU 55 HG2 GLU 55 230.497 0.330 0.562 441 2HG GLU 55 HG1 GLU 55 231.678 0.113 -0.729 442 H GLU 56 HN GLU 56 235.069 2.954 0.623 443 HA GLU 56 HA GLU 56 235.259 3.577 3.412 444 1HB GLU 56 HB2 GLU 56 237.108 3.260 1.179 445 2HB GLU 56 HB1 GLU 56 237.580 4.533 2.299 446 1HG GLU 56 HG2 GLU 56 236.721 2.071 3.611 447 2HG GLU 56 HG1 GLU 56 238.140 1.876 2.586 448 H SER 57 HN SER 57 235.290 5.555 0.441 449 HA SER 57 HA SER 57 234.717 7.868 2.164 450 1HB SER 57 HB2 SER 57 236.917 7.560 0.181 451 2HB SER 57 HB1 SER 57 236.127 9.132 0.294 452 HG SER 57 HG SER 57 237.790 7.850 2.084 453 H GLY 58 HN GLY 58 233.067 6.114 0.376 454 1HA GLY 58 HA2 GLY 58 231.354 6.356 -1.129 455 2HA GLY 58 HA1 GLY 58 231.345 8.045 -0.646 456 H LEU 59 HN LEU 59 234.322 6.996 -1.938 457 HA LEU 59 HA LEU 59 233.716 8.397 -4.445 458 1HB LEU 59 HB2 LEU 59 236.322 7.843 -3.034 459 2HB LEU 59 HB1 LEU 59 236.225 8.517 -4.649 460 HG LEU 59 HG LEU 59 235.468 9.782 -2.037 461 1HD1 LEU 59 HD11 LEU 59 237.121 11.253 -2.496 462 2HD1 LEU 59 HD12 LEU 59 236.824 11.214 -4.235 463 3HD1 LEU 59 HD13 LEU 59 237.728 9.909 -3.464 464 1HD2 LEU 59 HD21 LEU 59 234.519 11.662 -3.426 465 2HD2 LEU 59 HD22 LEU 59 233.523 10.208 -3.327 466 3HD2 LEU 59 HD23 LEU 59 234.472 10.531 -4.779 467 H THR 60 HN THR 60 233.233 7.117 -6.054 468 HA THR 60 HA THR 60 234.350 4.416 -6.166 469 HB THR 60 HB THR 60 232.428 5.214 -8.242 470 HG1 THR 60 HG1 THR 60 231.098 6.152 -6.938 471 1HG2 THR 60 HG21 THR 60 232.176 3.016 -8.217 472 2HG2 THR 60 HG22 THR 60 231.404 3.164 -6.639 473 3HG2 THR 60 HG23 THR 60 233.141 2.875 -6.748 474 H VAL 61 HN VAL 61 235.721 3.751 -7.759 475 HA VAL 61 HA VAL 61 236.618 5.845 -9.613 476 HB VAL 61 HB VAL 61 238.716 4.679 -9.796 477 1HG1 VAL 61 HG11 VAL 61 239.347 4.678 -7.293 478 2HG1 VAL 61 HG12 VAL 61 237.687 5.219 -7.039 479 3HG1 VAL 61 HG13 VAL 61 238.785 6.179 -8.030 480 1HG2 VAL 61 HG21 VAL 61 237.192 2.467 -8.717 481 2HG2 VAL 61 HG22 VAL 61 238.696 2.713 -7.830 482 3HG2 VAL 61 HG23 VAL 61 238.732 2.461 -9.576 483 H ASP 62 HN ASP 62 236.703 5.542 -11.768 484 HA ASP 62 HA ASP 62 235.120 3.397 -12.859 485 1HB ASP 62 HB2 ASP 62 234.988 5.712 -13.749 486 2HB ASP 62 HB1 ASP 62 236.658 5.578 -14.290 487 H ALA 63 HN ALA 63 238.427 3.956 -12.198 488 HA ALA 63 HA ALA 63 239.236 1.397 -12.966 489 1HB ALA 63 HB1 ALA 63 240.773 2.159 -14.887 490 2HB ALA 63 HB2 ALA 63 239.680 3.537 -15.015 491 3HB ALA 63 HB3 ALA 63 239.063 1.898 -15.232 492 H LEU 64 HN LEU 64 240.371 1.381 -11.061 493 HA LEU 64 HA LEU 64 242.092 3.410 -10.120 494 1HB LEU 64 HB2 LEU 64 241.849 0.460 -9.607 495 2HB LEU 64 HB1 LEU 64 243.188 1.359 -8.926 496 HG LEU 64 HG LEU 64 240.600 2.610 -8.412 497 1HD1 LEU 64 HD11 LEU 64 240.221 0.035 -8.431 498 2HD1 LEU 64 HD12 LEU 64 239.606 1.006 -7.092 499 3HD1 LEU 64 HD13 LEU 64 241.098 0.086 -6.901 500 1HD2 LEU 64 HD21 LEU 64 241.654 3.291 -6.555 501 2HD2 LEU 64 HD22 LEU 64 243.111 2.714 -7.361 502 3HD2 LEU 64 HD23 LEU 64 242.279 1.682 -6.197 503 H HIS 65 HN HIS 65 244.549 2.561 -9.681 504 HA HIS 65 HA HIS 65 245.668 1.595 -12.215 505 1HB HIS 65 HB2 HIS 65 245.727 4.241 -11.651 506 2HB HIS 65 HB1 HIS 65 247.213 3.726 -10.861 507 HD1 HIS 65 HD1 HIS 65 248.393 1.768 -12.783 508 HD2 HIS 65 HD2 HIS 65 246.494 5.245 -14.037 509 HE1 HIS 65 HE1 HIS 65 249.297 2.236 -15.083 510 HE2 HIS 65 HE2 HIS 65 248.197 4.391 -15.786 511 H LYS 66 HN LYS 66 246.415 -0.339 -11.500 512 HA LYS 66 HA LYS 66 247.473 -0.851 -8.946 513 1HB LYS 66 HB2 LYS 66 248.560 -2.856 -10.146 514 2HB LYS 66 HB1 LYS 66 246.807 -2.757 -10.142 515 1HG LYS 66 HG2 LYS 66 246.679 -2.436 -12.373 516 2HG LYS 66 HG1 LYS 66 248.175 -1.502 -12.433 517 1HD LYS 66 HD2 LYS 66 248.752 -3.455 -13.545 518 2HD LYS 66 HD1 LYS 66 249.322 -3.764 -11.903 519 1HE LYS 66 HE2 LYS 66 248.183 -5.691 -12.130 520 2HE LYS 66 HE1 LYS 66 246.785 -4.691 -11.739 521 1HZ LYS 66 HZ1 LYS 66 246.339 -6.005 -13.686 522 2HZ LYS 66 HZ2 LYS 66 247.719 -5.414 -14.463 523 3HZ LYS 66 HZ3 LYS 66 246.427 -4.375 -14.130 524 H VAL 67 HN VAL 67 249.465 -0.573 -8.067 525 HA VAL 67 HA VAL 67 251.594 0.313 -9.916 526 HB VAL 67 HB VAL 67 252.462 1.803 -8.173 527 1HG1 VAL 67 HG11 VAL 67 251.152 3.529 -8.820 528 2HG1 VAL 67 HG12 VAL 67 249.656 2.697 -8.397 529 3HG1 VAL 67 HG13 VAL 67 250.483 2.311 -9.907 530 1HG2 VAL 67 HG21 VAL 67 250.126 0.735 -6.646 531 2HG2 VAL 67 HG22 VAL 67 250.719 2.363 -6.329 532 3HG2 VAL 67 HG23 VAL 67 251.792 0.979 -6.122 533 H GLY 68 HN GLY 68 251.009 -1.068 -6.674 534 1HA GLY 68 HA2 GLY 68 253.318 -2.814 -7.136 535 2HA GLY 68 HA1 GLY 68 253.336 -1.796 -5.707 536 H GLN 69 HN GLN 69 253.584 -4.403 -5.306 537 HA GLN 69 HA GLN 69 250.986 -5.154 -4.153 538 1HB GLN 69 HB2 GLN 69 252.781 -6.761 -5.908 539 2HB GLN 69 HB1 GLN 69 251.951 -7.592 -4.600 540 1HG GLN 69 HG2 GLN 69 249.971 -7.498 -5.632 541 2HG GLN 69 HG1 GLN 69 250.226 -5.844 -6.187 542 1HE2 GLN 69 HE21 GLN 69 250.903 -9.218 -6.855 543 2HE2 GLN 69 HE22 GLN 69 251.217 -9.019 -8.543 544 H ILE 70 HN ILE 70 251.189 -5.175 -2.015 545 HA ILE 70 HA ILE 70 253.811 -5.828 -0.849 546 HB ILE 70 HB ILE 70 251.479 -4.508 0.533 547 1HG1 ILE 70 HG12 ILE 70 253.939 -3.169 -0.603 548 2HG1 ILE 70 HG11 ILE 70 252.370 -3.177 -1.403 549 1HG2 ILE 70 HG21 ILE 70 254.252 -5.228 1.293 550 2HG2 ILE 70 HG22 ILE 70 252.774 -5.246 2.252 551 3HG2 ILE 70 HG23 ILE 70 253.591 -3.718 1.922 552 1HD1 ILE 70 HD11 ILE 70 251.832 -2.269 1.161 553 2HD1 ILE 70 HD12 ILE 70 251.930 -1.302 -0.310 554 3HD1 ILE 70 HD13 ILE 70 253.351 -1.490 0.717 555 H VAL 71 HN VAL 71 253.965 -7.244 0.888 556 HA VAL 71 HA VAL 71 251.652 -9.004 1.343 557 HB VAL 71 HB VAL 71 254.531 -9.883 1.069 558 1HG1 VAL 71 HG11 VAL 71 253.384 -12.172 1.034 559 2HG1 VAL 71 HG12 VAL 71 251.999 -11.339 1.741 560 3HG1 VAL 71 HG13 VAL 71 253.547 -11.355 2.588 561 1HG2 VAL 71 HG21 VAL 71 253.834 -10.976 -0.986 562 2HG2 VAL 71 HG22 VAL 71 253.524 -9.241 -1.078 563 3HG2 VAL 71 HG23 VAL 71 252.194 -10.360 -0.778 564 H PHE 72 HN PHE 72 251.508 -9.926 3.428 565 HA PHE 72 HA PHE 72 253.332 -8.759 5.419 566 1HB PHE 72 HB2 PHE 72 250.331 -9.031 5.583 567 2HB PHE 72 HB1 PHE 72 251.352 -8.634 6.959 568 HD1 PHE 72 HD1 PHE 72 251.432 -6.422 7.523 569 HD2 PHE 72 HD2 PHE 72 250.910 -7.478 3.435 570 HE1 PHE 72 HE1 PHE 72 251.294 -4.039 6.928 571 HE2 PHE 72 HE2 PHE 72 250.780 -5.097 2.833 572 HZ PHE 72 HZ PHE 72 250.970 -3.374 4.580 573 H GLU 73 HN GLU 73 254.259 -10.175 6.738 574 HA GLU 73 HA GLU 73 253.199 -12.917 6.795 575 1HB GLU 73 HB2 GLU 73 255.485 -12.774 6.001 576 2HB GLU 73 HB1 GLU 73 255.960 -11.854 7.419 577 1HG GLU 73 HG2 GLU 73 255.871 -13.700 8.808 578 2HG GLU 73 HG1 GLU 73 254.805 -14.590 7.722 579 H PHE 74 HN PHE 74 252.195 -13.575 8.579 580 HA PHE 74 HA PHE 74 252.219 -11.906 10.936 581 1HB PHE 74 HB2 PHE 74 250.496 -13.910 9.791 582 2HB PHE 74 HB1 PHE 74 250.815 -14.280 11.481 583 HD1 PHE 74 HD1 PHE 74 248.701 -13.836 12.400 584 HD2 PHE 74 HD2 PHE 74 250.629 -10.898 10.001 585 HE1 PHE 74 HE1 PHE 74 247.013 -12.180 13.078 586 HE2 PHE 74 HE2 PHE 74 248.945 -9.237 10.675 587 HZ PHE 74 HZ PHE 74 247.134 -9.877 12.217 588 H VAL 75 HN VAL 75 253.362 -12.221 12.740 589 HA VAL 75 HA VAL 75 255.360 -14.257 12.807 590 HB VAL 75 HB VAL 75 254.996 -11.783 14.059 591 1HG1 VAL 75 HG11 VAL 75 255.398 -12.234 16.435 592 2HG1 VAL 75 HG12 VAL 75 255.136 -13.954 16.148 593 3HG1 VAL 75 HG13 VAL 75 253.814 -12.808 15.914 594 1HG2 VAL 75 HG21 VAL 75 257.148 -12.131 13.513 595 2HG2 VAL 75 HG22 VAL 75 257.075 -13.855 13.877 596 3HG2 VAL 75 HG23 VAL 75 257.269 -12.684 15.182 597 H GLY 76 HN GLY 76 255.115 -16.281 13.454 598 1HA GLY 76 HA2 GLY 76 254.539 -17.983 14.959 599 2HA GLY 76 HA1 GLY 76 253.411 -16.884 15.735 600 H GLU 77 HN GLU 77 252.469 -16.325 12.787 601 HA GLU 77 HA GLU 77 250.652 -18.641 12.724 602 1HB GLU 77 HB2 GLU 77 250.204 -15.781 12.540 603 2HB GLU 77 HB1 GLU 77 249.513 -16.629 11.164 604 1HG GLU 77 HG2 GLU 77 248.962 -17.900 13.733 605 2HG GLU 77 HG1 GLU 77 248.304 -16.271 13.580 606 HA PRO 78 HA PRO 78 252.732 -19.813 8.939 607 1HB PRO 78 HB2 PRO 78 250.159 -21.241 8.494 608 2HB PRO 78 HB1 PRO 78 251.815 -21.856 8.427 609 1HG PRO 78 HG2 PRO 78 250.241 -22.422 10.497 610 2HG PRO 78 HG1 PRO 78 251.966 -22.083 10.730 611 1HD PRO 78 HD2 PRO 78 249.600 -20.337 11.259 612 2HD PRO 78 HD1 PRO 78 251.114 -20.497 12.174 613 H GLU 79 HN GLU 79 249.334 -18.796 8.994 614 HA GLU 79 HA GLU 79 249.080 -18.252 6.258 615 1HB GLU 79 HB2 GLU 79 247.415 -18.188 8.453 616 2HB GLU 79 HB1 GLU 79 247.526 -16.492 8.001 617 1HG GLU 79 HG2 GLU 79 246.848 -17.060 5.725 618 2HG GLU 79 HG1 GLU 79 246.720 -18.755 6.194 619 H LEU 80 HN LEU 80 248.470 -15.916 5.553 620 HA LEU 80 HA LEU 80 250.218 -13.869 6.649 621 1HB LEU 80 HB2 LEU 80 250.464 -14.147 3.722 622 2HB LEU 80 HB1 LEU 80 251.662 -13.669 4.908 623 HG LEU 80 HG LEU 80 250.820 -16.531 4.738 624 1HD1 LEU 80 HD11 LEU 80 252.888 -15.241 2.967 625 2HD1 LEU 80 HD12 LEU 80 251.318 -15.842 2.436 626 3HD1 LEU 80 HD13 LEU 80 252.523 -16.963 3.070 627 1HD2 LEU 80 HD21 LEU 80 253.583 -16.211 5.110 628 2HD2 LEU 80 HD22 LEU 80 252.383 -16.681 6.312 629 3HD2 LEU 80 HD23 LEU 80 252.812 -14.984 6.113 630 H MET 81 HN MET 81 250.050 -11.963 4.746 631 HA MET 81 HA MET 81 247.292 -11.801 3.839 632 1HB MET 81 HB2 MET 81 248.508 -9.632 5.560 633 2HB MET 81 HB1 MET 81 246.923 -9.592 4.809 634 1HG MET 81 HG2 MET 81 246.079 -10.460 6.652 635 2HG MET 81 HG1 MET 81 246.975 -11.939 6.325 636 1HE MET 81 HE1 MET 81 250.427 -10.691 8.039 637 2HE MET 81 HE2 MET 81 249.817 -10.735 6.387 638 3HE MET 81 HE3 MET 81 249.735 -12.178 7.394 639 H ASP 82 HN ASP 82 247.553 -11.428 1.748 640 HA ASP 82 HA ASP 82 249.767 -9.722 0.858 641 1HB ASP 82 HB2 ASP 82 249.488 -12.019 -0.124 642 2HB ASP 82 HB1 ASP 82 247.971 -11.472 -0.833 643 H VAL 83 HN VAL 83 249.182 -7.626 0.782 644 HA VAL 83 HA VAL 83 246.518 -6.982 -0.291 645 HB VAL 83 HB VAL 83 246.938 -6.170 2.001 646 1HG1 VAL 83 HG11 VAL 83 249.423 -5.817 1.566 647 2HG1 VAL 83 HG12 VAL 83 248.598 -4.598 2.536 648 3HG1 VAL 83 HG13 VAL 83 248.961 -4.279 0.840 649 1HG2 VAL 83 HG21 VAL 83 245.341 -4.924 0.824 650 2HG2 VAL 83 HG22 VAL 83 246.557 -4.177 -0.211 651 3HG2 VAL 83 HG23 VAL 83 246.440 -3.716 1.487 652 H HIS 84 HN HIS 84 246.495 -6.324 -2.315 653 HA HIS 84 HA HIS 84 248.867 -5.443 -3.664 654 1HB HIS 84 HB2 HIS 84 245.970 -5.639 -4.495 655 2HB HIS 84 HB1 HIS 84 247.222 -5.018 -5.565 656 HD1 HIS 84 HD1 HIS 84 246.923 -6.972 -7.220 657 HD2 HIS 84 HD2 HIS 84 248.010 -8.155 -3.388 658 HE1 HIS 84 HE1 HIS 84 247.591 -9.387 -7.426 659 HE2 HIS 84 HE2 HIS 84 248.332 -10.055 -5.113 660 H VAL 85 HN VAL 85 248.953 -3.345 -4.854 661 HA VAL 85 HA VAL 85 247.641 -1.237 -3.262 662 HB VAL 85 HB VAL 85 250.312 -1.052 -4.678 663 1HG1 VAL 85 HG11 VAL 85 250.509 1.107 -3.872 664 2HG1 VAL 85 HG12 VAL 85 249.294 0.859 -2.618 665 3HG1 VAL 85 HG13 VAL 85 248.800 1.028 -4.302 666 1HG2 VAL 85 HG21 VAL 85 251.386 -1.339 -2.626 667 2HG2 VAL 85 HG22 VAL 85 250.120 -2.567 -2.610 668 3HG2 VAL 85 HG23 VAL 85 249.905 -1.068 -1.707 669 H PHE 86 HN PHE 86 246.508 0.256 -4.317 670 HA PHE 86 HA PHE 86 246.708 0.425 -7.242 671 1HB PHE 86 HB2 PHE 86 244.412 -0.420 -5.594 672 2HB PHE 86 HB1 PHE 86 244.027 0.820 -6.779 673 HD1 PHE 86 HD1 PHE 86 244.840 0.351 -9.210 674 HD2 PHE 86 HD2 PHE 86 244.387 -2.635 -6.214 675 HE1 PHE 86 HE1 PHE 86 244.665 -1.371 -10.959 676 HE2 PHE 86 HE2 PHE 86 244.215 -4.364 -7.956 677 HZ PHE 86 HZ PHE 86 244.354 -3.733 -10.332 678 H CYS 87 HN CYS 87 246.346 2.450 -8.090 679 HA CYS 87 HA CYS 87 245.618 4.591 -6.204 680 1HB CYS 87 HB2 CYS 87 248.019 4.370 -7.957 681 2HB CYS 87 HB1 CYS 87 247.254 5.950 -7.833 682 HG CYS 87 HG CYS 87 247.617 5.458 -5.107 683 H THR 88 HN THR 88 243.783 5.503 -6.935 684 HA THR 88 HA THR 88 243.144 5.247 -9.774 685 HB THR 88 HB THR 88 241.504 4.503 -8.059 686 HG1 THR 88 HG1 THR 88 240.843 5.199 -10.161 687 1HG2 THR 88 HG21 THR 88 240.736 5.765 -6.433 688 2HG2 THR 88 HG22 THR 88 240.439 7.118 -7.524 689 3HG2 THR 88 HG23 THR 88 242.037 6.893 -6.814 690 H ASP 89 HN ASP 89 241.453 7.242 -10.263 691 HA ASP 89 HA ASP 89 242.444 9.812 -9.472 692 1HB ASP 89 HB2 ASP 89 243.252 8.598 -12.073 693 2HB ASP 89 HB1 ASP 89 242.815 10.304 -12.071 694 H SER 90 HN SER 90 240.609 7.948 -11.837 695 HA SER 90 HA SER 90 238.672 10.079 -12.173 696 1HB SER 90 HB2 SER 90 239.553 8.068 -13.832 697 2HB SER 90 HB1 SER 90 238.006 7.433 -13.275 698 HG SER 90 HG SER 90 238.521 9.862 -14.630 699 H ILE 91 HN ILE 91 237.502 10.336 -10.319 700 HA ILE 91 HA ILE 91 236.321 7.937 -9.107 701 HB ILE 91 HB ILE 91 235.791 9.321 -7.163 702 1HG1 ILE 91 HG12 ILE 91 237.278 11.562 -8.550 703 2HG1 ILE 91 HG11 ILE 91 235.520 11.457 -8.482 704 1HG2 ILE 91 HG21 ILE 91 237.800 8.405 -6.697 705 2HG2 ILE 91 HG22 ILE 91 238.345 10.080 -6.806 706 3HG2 ILE 91 HG23 ILE 91 238.539 8.998 -8.185 707 1HD1 ILE 91 HD11 ILE 91 236.399 12.965 -6.786 708 2HD1 ILE 91 HD12 ILE 91 237.360 11.653 -6.108 709 3HD1 ILE 91 HD13 ILE 91 235.599 11.575 -6.053 710 H GLN 92 HN GLN 92 234.078 8.577 -8.011 711 HA GLN 92 HA GLN 92 232.433 9.953 -10.017 712 1HB GLN 92 HB2 GLN 92 232.067 7.208 -8.861 713 2HB GLN 92 HB1 GLN 92 230.693 8.120 -9.470 714 1HG GLN 92 HG2 GLN 92 232.958 8.021 -11.311 715 2HG GLN 92 HG1 GLN 92 232.261 6.445 -10.939 716 1HE2 GLN 92 HE21 GLN 92 230.758 9.635 -11.238 717 2HE2 GLN 92 HE22 GLN 92 229.667 9.197 -12.504 718 H GLY 93 HN GLY 93 231.859 8.242 -6.949 719 1HA GLY 93 HA2 GLY 93 229.852 9.956 -6.042 720 2HA GLY 93 HA1 GLY 93 230.817 8.906 -5.019 721 H THR 94 HN THR 94 230.464 10.738 -3.504 722 HA THR 94 HA THR 94 232.470 12.841 -3.914 723 HB THR 94 HB THR 94 230.364 13.378 -1.957 724 HG1 THR 94 HG1 THR 94 229.084 12.329 -3.465 725 1HG2 THR 94 HG21 THR 94 231.994 14.864 -3.806 726 2HG2 THR 94 HG22 THR 94 231.113 15.418 -2.383 727 3HG2 THR 94 HG23 THR 94 230.296 15.317 -3.942 728 HA PRO 95 HA PRO 95 234.498 11.692 -0.207 729 1HB PRO 95 HB2 PRO 95 234.494 14.454 0.802 730 2HB PRO 95 HB1 PRO 95 235.859 13.451 0.299 731 1HG PRO 95 HG2 PRO 95 235.036 15.550 -1.149 732 2HG PRO 95 HG1 PRO 95 235.683 14.080 -1.902 733 1HD PRO 95 HD2 PRO 95 232.833 14.945 -1.575 734 2HD PRO 95 HD1 PRO 95 233.635 14.225 -2.989 735 H VAL 96 HN VAL 96 232.127 10.953 0.083 736 HA VAL 96 HA VAL 96 230.581 12.328 2.065 737 HB VAL 96 HB VAL 96 230.267 9.426 1.321 738 1HG1 VAL 96 HG11 VAL 96 228.089 11.387 1.934 739 2HG1 VAL 96 HG12 VAL 96 228.978 10.581 3.227 740 3HG1 VAL 96 HG13 VAL 96 228.071 9.628 2.053 741 1HG2 VAL 96 HG21 VAL 96 229.750 11.844 -0.305 742 2HG2 VAL 96 HG22 VAL 96 228.510 10.589 -0.315 743 3HG2 VAL 96 HG23 VAL 96 230.160 10.204 -0.806 744 H GLU 97 HN GLU 97 232.751 12.356 3.352 745 HA GLU 97 HA GLU 97 233.832 10.287 4.752 746 1HB GLU 97 HB2 GLU 97 234.368 11.854 6.522 747 2HB GLU 97 HB1 GLU 97 234.523 12.655 4.965 748 1HG GLU 97 HG2 GLU 97 231.943 13.222 5.617 749 2HG GLU 97 HG1 GLU 97 232.723 13.211 7.198 750 H SER 98 HN SER 98 232.951 8.680 5.862 751 HA SER 98 HA SER 98 230.303 8.966 7.013 752 1HB SER 98 HB2 SER 98 232.129 6.552 6.948 753 2HB SER 98 HB1 SER 98 230.425 6.555 7.399 754 HG SER 98 HG SER 98 229.876 7.026 5.311 755 H ASP 99 HN ASP 99 230.130 7.584 9.198 756 HA ASP 99 HA ASP 99 231.283 9.188 11.196 757 1HB ASP 99 HB2 ASP 99 230.004 6.457 11.438 758 2HB ASP 99 HB1 ASP 99 230.335 7.547 12.781 759 H GLU 100 HN GLU 100 232.568 6.539 9.474 760 HA GLU 100 HA GLU 100 234.753 6.334 11.435 761 1HB GLU 100 HB2 GLU 100 233.014 4.270 10.550 762 2HB GLU 100 HB1 GLU 100 234.602 3.945 9.870 763 1HG GLU 100 HG2 GLU 100 235.584 4.071 12.103 764 2HG GLU 100 HG1 GLU 100 233.990 4.393 12.783 765 H MET 101 HN MET 101 234.306 7.903 8.865 766 HA MET 101 HA MET 101 236.940 7.405 7.796 767 1HB MET 101 HB2 MET 101 234.553 6.473 6.428 768 2HB MET 101 HB1 MET 101 235.470 7.602 5.441 769 1HG MET 101 HG2 MET 101 236.904 5.384 6.810 770 2HG MET 101 HG1 MET 101 235.962 5.039 5.360 771 1HE MET 101 HE1 MET 101 240.149 6.475 5.531 772 2HE MET 101 HE2 MET 101 239.228 5.339 6.518 773 3HE MET 101 HE3 MET 101 239.083 7.073 6.802 774 H ARG 102 HN ARG 102 237.707 9.089 6.428 775 HA ARG 102 HA ARG 102 236.174 11.404 5.833 776 1HB ARG 102 HB2 ARG 102 236.395 11.697 8.284 777 2HB ARG 102 HB1 ARG 102 238.144 11.635 8.123 778 1HG ARG 102 HG2 ARG 102 237.595 13.615 6.390 779 2HG ARG 102 HG1 ARG 102 236.260 13.819 7.527 780 1HD ARG 102 HD2 ARG 102 238.186 13.580 9.307 781 2HD ARG 102 HD1 ARG 102 239.194 14.108 7.960 782 HE ARG 102 HE ARG 102 237.355 15.702 9.470 783 1HH1 ARG 102 HH11 ARG 102 238.905 15.342 6.365 784 2HH1 ARG 102 HH12 ARG 102 238.755 17.017 5.955 785 1HH2 ARG 102 HH21 ARG 102 237.154 17.906 8.932 786 2HH2 ARG 102 HH22 ARG 102 237.759 18.473 7.412 787 HA PRO 103 HA PRO 103 239.916 11.129 3.291 788 1HB PRO 103 HB2 PRO 103 238.915 12.199 1.064 789 2HB PRO 103 HB1 PRO 103 238.459 10.569 1.575 790 1HG PRO 103 HG2 PRO 103 236.972 13.149 1.923 791 2HG PRO 103 HG1 PRO 103 236.360 11.572 1.385 792 1HD PRO 103 HD2 PRO 103 236.120 12.490 3.953 793 2HD PRO 103 HD1 PRO 103 236.194 10.767 3.535 794 H CYS 104 HN CYS 104 241.400 12.630 2.422 795 HA CYS 104 HA CYS 104 240.823 15.469 2.730 796 1HB CYS 104 HB2 CYS 104 242.132 14.124 4.756 797 2HB CYS 104 HB1 CYS 104 243.455 14.804 3.814 798 HG CYS 104 HG CYS 104 242.819 16.585 5.543 799 H TRP 105 HN TRP 105 241.662 16.610 1.108 800 HA TRP 105 HA TRP 105 243.471 15.246 -0.736 801 1HB TRP 105 HB2 TRP 105 241.939 17.829 -1.106 802 2HB TRP 105 HB1 TRP 105 242.816 16.949 -2.354 803 HD1 TRP 105 HD1 TRP 105 240.131 15.731 0.197 804 HE1 TRP 105 HE1 TRP 105 238.305 14.479 -1.120 805 HE3 TRP 105 HE3 TRP 105 241.966 16.372 -4.534 806 HZ2 TRP 105 HZ2 TRP 105 237.723 13.854 -3.811 807 HZ3 TRP 105 HZ3 TRP 105 240.713 15.416 -6.423 808 HH2 TRP 105 HH2 TRP 105 238.636 14.183 -6.067 809 H PHE 106 HN PHE 106 245.573 15.578 -0.480 810 HA PHE 106 HA PHE 106 246.490 18.260 0.333 811 1HB PHE 106 HB2 PHE 106 247.678 15.570 1.051 812 2HB PHE 106 HB1 PHE 106 248.431 17.119 1.413 813 HD1 PHE 106 HD1 PHE 106 246.117 18.709 2.283 814 HD2 PHE 106 HD2 PHE 106 247.162 14.669 3.118 815 HE1 PHE 106 HE1 PHE 106 244.868 18.828 4.399 816 HE2 PHE 106 HE2 PHE 106 245.913 14.779 5.235 817 HZ PHE 106 HZ PHE 106 244.764 16.860 5.878 818 H GLN 107 HN GLN 107 249.231 17.834 -0.052 819 HA GLN 107 HA GLN 107 249.332 17.854 -2.964 820 1HB GLN 107 HB2 GLN 107 251.606 18.485 -1.093 821 2HB GLN 107 HB1 GLN 107 251.404 18.989 -2.766 822 1HG GLN 107 HG2 GLN 107 249.511 19.863 -0.613 823 2HG GLN 107 HG1 GLN 107 251.014 20.725 -0.945 824 1HE2 GLN 107 HE21 GLN 107 249.071 22.312 -1.248 825 2HE2 GLN 107 HE22 GLN 107 248.563 22.517 -2.887 826 H LEU 108 HN LEU 108 251.250 16.866 -4.031 827 HA LEU 108 HA LEU 108 251.406 14.097 -3.366 828 1HB LEU 108 HB2 LEU 108 252.770 15.808 -5.432 829 2HB LEU 108 HB1 LEU 108 253.109 14.095 -5.267 830 HG LEU 108 HG LEU 108 250.534 15.401 -6.097 831 1HD1 LEU 108 HD11 LEU 108 251.081 14.762 -8.155 832 2HD1 LEU 108 HD12 LEU 108 251.528 13.144 -7.619 833 3HD1 LEU 108 HD13 LEU 108 252.701 14.458 -7.529 834 1HD2 LEU 108 HD21 LEU 108 249.964 12.782 -6.243 835 2HD2 LEU 108 HD22 LEU 108 249.549 13.791 -4.857 836 3HD2 LEU 108 HD23 LEU 108 250.997 12.785 -4.814 837 H ASP 109 HN ASP 109 253.310 16.850 -2.635 838 HA ASP 109 HA ASP 109 255.470 15.147 -1.613 839 1HB ASP 109 HB2 ASP 109 255.792 17.244 -3.236 840 2HB ASP 109 HB1 ASP 109 255.740 18.117 -1.708 841 H GLN 110 HN GLN 110 252.713 15.897 -0.523 842 HA GLN 110 HA GLN 110 253.695 16.718 2.114 843 1HB GLN 110 HB2 GLN 110 251.224 17.734 0.716 844 2HB GLN 110 HB1 GLN 110 251.534 17.966 2.431 845 1HG GLN 110 HG2 GLN 110 253.676 19.109 1.776 846 2HG GLN 110 HG1 GLN 110 253.097 19.060 0.111 847 1HE2 GLN 110 HE21 GLN 110 253.305 21.404 0.298 848 2HE2 GLN 110 HE22 GLN 110 251.991 22.306 0.966 849 H ILE 111 HN ILE 111 252.728 14.155 0.662 850 HA ILE 111 HA ILE 111 250.406 13.403 2.190 851 HB ILE 111 HB ILE 111 251.904 11.071 1.394 852 1HG1 ILE 111 HG12 ILE 111 251.205 11.737 -1.151 853 2HG1 ILE 111 HG11 ILE 111 251.841 13.269 -0.562 854 1HG2 ILE 111 HG21 ILE 111 249.851 10.453 0.352 855 2HG2 ILE 111 HG22 ILE 111 249.263 12.116 0.430 856 3HG2 ILE 111 HG23 ILE 111 249.516 11.198 1.915 857 1HD1 ILE 111 HD11 ILE 111 253.535 11.840 -1.653 858 2HD1 ILE 111 HD12 ILE 111 253.284 10.639 -0.390 859 3HD1 ILE 111 HD13 ILE 111 253.926 12.229 0.021 860 HA PRO 112 HA PRO 112 252.856 12.320 5.739 861 1HB PRO 112 HB2 PRO 112 250.904 12.321 7.531 862 2HB PRO 112 HB1 PRO 112 251.357 13.826 6.718 863 1HG PRO 112 HG2 PRO 112 249.030 12.021 6.203 864 2HG PRO 112 HG1 PRO 112 249.101 13.790 6.172 865 1HD PRO 112 HD2 PRO 112 249.264 12.082 3.954 866 2HD PRO 112 HD1 PRO 112 249.685 13.806 3.981 867 H PHE 113 HN PHE 113 253.546 10.227 5.264 868 HA PHE 113 HA PHE 113 251.693 8.032 5.514 869 1HB PHE 113 HB2 PHE 113 254.514 7.285 5.559 870 2HB PHE 113 HB1 PHE 113 253.222 6.746 4.506 871 HD1 PHE 113 HD1 PHE 113 252.561 9.554 3.368 872 HD2 PHE 113 HD2 PHE 113 256.183 7.402 3.970 873 HE1 PHE 113 HE1 PHE 113 253.607 10.768 1.508 874 HE2 PHE 113 HE2 PHE 113 257.226 8.605 2.112 875 HZ PHE 113 HZ PHE 113 255.939 10.304 0.871 876 H LYS 114 HN LYS 114 253.694 9.812 7.624 877 HA LYS 114 HA LYS 114 254.318 7.822 9.522 878 1HB LYS 114 HB2 LYS 114 254.320 10.794 9.448 879 2HB LYS 114 HB1 LYS 114 254.280 10.039 11.036 880 1HG LYS 114 HG2 LYS 114 256.259 8.625 9.839 881 2HG LYS 114 HG1 LYS 114 256.453 10.204 9.078 882 1HD LYS 114 HD2 LYS 114 257.819 10.217 11.017 883 2HD LYS 114 HD1 LYS 114 256.403 11.197 11.395 884 1HE LYS 114 HE2 LYS 114 255.398 9.297 12.561 885 2HE LYS 114 HE1 LYS 114 256.807 8.312 12.176 886 1HZ LYS 114 HZ1 LYS 114 257.987 10.358 13.365 887 2HZ LYS 114 HZ2 LYS 114 257.433 9.005 14.215 888 3HZ LYS 114 HZ3 LYS 114 256.498 10.413 14.166 889 H ASP 115 HN ASP 115 251.490 9.675 8.812 890 HA ASP 115 HA ASP 115 250.239 8.851 11.303 891 1HB ASP 115 HB2 ASP 115 249.716 10.975 9.311 892 2HB ASP 115 HB1 ASP 115 248.297 10.261 10.072 893 H MET 116 HN MET 116 250.915 7.005 9.115 894 HA MET 116 HA MET 116 248.250 5.840 8.757 895 1HB MET 116 HB2 MET 116 250.196 5.586 6.507 896 2HB MET 116 HB1 MET 116 248.440 5.537 6.476 897 1HG MET 116 HG2 MET 116 248.566 8.034 7.058 898 2HG MET 116 HG1 MET 116 250.251 7.914 6.566 899 1HE MET 116 HE1 MET 116 249.931 6.388 3.075 900 2HE MET 116 HE2 MET 116 250.870 6.550 4.557 901 3HE MET 116 HE3 MET 116 250.764 7.901 3.429 902 H TRP 117 HN TRP 117 249.146 3.624 7.222 903 HA TRP 117 HA TRP 117 249.970 1.868 9.230 904 1HB TRP 117 HB2 TRP 117 249.604 1.729 6.300 905 2HB TRP 117 HB1 TRP 117 250.689 0.523 6.985 906 HD1 TRP 117 HD1 TRP 117 249.462 -0.723 9.320 907 HE1 TRP 117 HE1 TRP 117 247.096 -1.736 9.393 908 HE3 TRP 117 HE3 TRP 117 247.401 1.739 5.342 909 HZ2 TRP 117 HZ2 TRP 117 244.678 -1.519 7.954 910 HZ3 TRP 117 HZ3 TRP 117 245.056 1.279 4.757 911 HH2 TRP 117 HH2 TRP 117 243.725 -0.317 6.036 912 HA PRO 118 HA PRO 118 254.387 2.133 9.177 913 1HB PRO 118 HB2 PRO 118 255.139 -0.313 9.890 914 2HB PRO 118 HB1 PRO 118 254.157 0.683 10.969 915 1HG PRO 118 HG2 PRO 118 253.323 -1.572 9.192 916 2HG PRO 118 HG1 PRO 118 252.800 -1.195 10.842 917 1HD PRO 118 HD2 PRO 118 251.399 -0.549 8.538 918 2HD PRO 118 HD1 PRO 118 251.186 0.237 10.113 919 H ASP 119 HN ASP 119 252.956 0.982 6.565 920 HA ASP 119 HA ASP 119 255.474 0.040 5.362 921 1HB ASP 119 HB2 ASP 119 252.768 -0.741 4.305 922 2HB ASP 119 HB1 ASP 119 254.327 -1.504 4.009 923 H ASP 120 HN ASP 120 252.932 2.318 5.277 924 HA ASP 120 HA ASP 120 252.584 3.052 2.688 925 1HB ASP 120 HB2 ASP 120 252.935 4.884 5.057 926 2HB ASP 120 HB1 ASP 120 252.238 5.361 3.510 927 H SER 121 HN SER 121 255.182 4.367 4.751 928 HA SER 121 HA SER 121 256.424 5.924 2.799 929 1HB SER 121 HB2 SER 121 256.830 5.735 5.378 930 2HB SER 121 HB1 SER 121 258.049 4.550 4.911 931 HG SER 121 HG SER 121 258.431 7.067 5.015 932 H TYR 122 HN TYR 122 256.372 2.495 3.059 933 HA TYR 122 HA TYR 122 258.853 2.120 1.642 934 1HB TYR 122 HB2 TYR 122 256.785 0.299 2.799 935 2HB TYR 122 HB1 TYR 122 257.919 -0.325 1.607 936 HD1 TYR 122 HD1 TYR 122 260.439 0.108 2.084 937 HD2 TYR 122 HD2 TYR 122 257.392 0.346 5.043 938 HE1 TYR 122 HE1 TYR 122 262.131 -0.197 3.842 939 HE2 TYR 122 HE2 TYR 122 259.075 0.042 6.809 940 HH TYR 122 HH TYR 122 261.292 -0.825 7.114 941 H TRP 123 HN TRP 123 255.377 1.746 0.919 942 HA TRP 123 HA TRP 123 256.100 1.177 -1.839 943 1HB TRP 123 HB2 TRP 123 253.748 0.611 -2.199 944 2HB TRP 123 HB1 TRP 123 254.433 -0.288 -0.853 945 HD1 TRP 123 HD1 TRP 123 253.598 0.416 1.630 946 HE1 TRP 123 HE1 TRP 123 251.386 1.483 2.405 947 HE3 TRP 123 HE3 TRP 123 251.959 2.249 -2.853 948 HZ2 TRP 123 HZ2 TRP 123 249.230 2.928 1.264 949 HZ3 TRP 123 HZ3 TRP 123 249.810 3.450 -2.920 950 HH2 TRP 123 HH2 TRP 123 248.480 3.773 -0.908 951 H PHE 124 HN PHE 124 255.602 3.916 -0.113 952 HA PHE 124 HA PHE 124 253.967 5.372 -1.966 953 1HB PHE 124 HB2 PHE 124 255.346 5.922 0.569 954 2HB PHE 124 HB1 PHE 124 255.311 7.290 -0.537 955 HD1 PHE 124 HD1 PHE 124 253.644 8.779 -0.028 956 HD2 PHE 124 HD2 PHE 124 252.887 4.616 0.422 957 HE1 PHE 124 HE1 PHE 124 251.351 9.280 0.676 958 HE2 PHE 124 HE2 PHE 124 250.582 5.111 1.123 959 HZ PHE 124 HZ PHE 124 249.810 7.446 1.250 960 HA PRO 125 HA PRO 125 258.476 7.291 -2.931 961 1HB PRO 125 HB2 PRO 125 259.838 4.648 -2.646 962 2HB PRO 125 HB1 PRO 125 260.464 6.275 -2.353 963 1HG PRO 125 HG2 PRO 125 259.767 4.720 -0.317 964 2HG PRO 125 HG1 PRO 125 259.404 6.456 -0.295 965 1HD PRO 125 HD2 PRO 125 257.583 4.142 -0.763 966 2HD PRO 125 HD1 PRO 125 257.258 5.693 0.035 967 H LEU 126 HN LEU 126 257.506 3.981 -3.776 968 HA LEU 126 HA LEU 126 258.571 4.194 -6.442 969 1HB LEU 126 HB2 LEU 126 257.063 2.068 -6.734 970 2HB LEU 126 HB1 LEU 126 258.569 1.986 -5.845 971 HG LEU 126 HG LEU 126 256.247 2.611 -4.168 972 1HD1 LEU 126 HD11 LEU 126 256.155 0.355 -6.031 973 2HD1 LEU 126 HD12 LEU 126 254.864 1.119 -5.104 974 3HD1 LEU 126 HD13 LEU 126 255.904 -0.084 -4.342 975 1HD2 LEU 126 HD21 LEU 126 258.007 2.069 -2.862 976 2HD2 LEU 126 HD22 LEU 126 258.744 1.043 -4.091 977 3HD2 LEU 126 HD23 LEU 126 257.409 0.429 -3.116 978 H LEU 127 HN LEU 127 255.485 4.614 -4.867 979 HA LEU 127 HA LEU 127 253.828 4.712 -7.127 980 1HB LEU 127 HB2 LEU 127 253.636 6.143 -4.479 981 2HB LEU 127 HB1 LEU 127 252.360 6.141 -5.676 982 HG LEU 127 HG LEU 127 252.851 4.278 -3.604 983 1HD1 LEU 127 HD11 LEU 127 250.732 3.268 -4.600 984 2HD1 LEU 127 HD12 LEU 127 250.820 4.569 -5.786 985 3HD1 LEU 127 HD13 LEU 127 250.662 4.948 -4.071 986 1HD2 LEU 127 HD21 LEU 127 254.270 3.006 -5.092 987 2HD2 LEU 127 HD22 LEU 127 253.043 3.062 -6.358 988 3HD2 LEU 127 HD23 LEU 127 252.739 2.161 -4.873 989 H LEU 128 HN LEU 128 255.355 7.311 -5.277 990 HA LEU 128 HA LEU 128 254.634 9.427 -6.975 991 1HB LEU 128 HB2 LEU 128 256.620 9.003 -4.820 992 2HB LEU 128 HB1 LEU 128 256.931 10.343 -5.906 993 HG LEU 128 HG LEU 128 254.298 10.008 -4.488 994 1HD1 LEU 128 HD11 LEU 128 256.028 10.122 -2.791 995 2HD1 LEU 128 HD12 LEU 128 255.119 11.633 -2.844 996 3HD1 LEU 128 HD13 LEU 128 256.725 11.543 -3.569 997 1HD2 LEU 128 HD21 LEU 128 253.885 11.578 -6.075 998 2HD2 LEU 128 HD22 LEU 128 255.578 12.057 -6.201 999 3HD2 LEU 128 HD23 LEU 128 254.598 12.630 -4.851 1000 H GLN 129 HN GLN 129 257.182 7.070 -7.175 1001 HA GLN 129 HA GLN 129 258.636 8.515 -9.217 1002 1HB GLN 129 HB2 GLN 129 259.646 6.955 -7.443 1003 2HB GLN 129 HB1 GLN 129 259.063 5.637 -8.450 1004 1HG GLN 129 HG2 GLN 129 261.299 5.945 -9.059 1005 2HG GLN 129 HG1 GLN 129 260.360 6.697 -10.347 1006 1HE2 GLN 129 HE21 GLN 129 263.068 7.066 -8.712 1007 2HE2 GLN 129 HE22 GLN 129 263.190 8.788 -8.640 1008 H LYS 130 HN LYS 130 255.791 6.954 -9.302 1009 HA LYS 130 HA LYS 130 254.513 6.001 -10.905 1010 1HB LYS 130 HB2 LYS 130 254.618 6.985 -12.948 1011 2HB LYS 130 HB1 LYS 130 255.738 8.047 -12.112 1012 1HG LYS 130 HG2 LYS 130 257.416 6.099 -13.015 1013 2HG LYS 130 HG1 LYS 130 256.203 6.148 -14.291 1014 1HD LYS 130 HD2 LYS 130 257.904 7.694 -14.893 1015 2HD LYS 130 HD1 LYS 130 256.516 8.641 -14.354 1016 1HE LYS 130 HE2 LYS 130 257.587 8.811 -12.114 1017 2HE LYS 130 HE1 LYS 130 259.007 8.007 -12.778 1018 1HZ LYS 130 HZ1 LYS 130 258.971 10.552 -12.692 1019 2HZ LYS 130 HZ2 LYS 130 257.941 10.456 -14.030 1020 3HZ LYS 130 HZ3 LYS 130 259.503 9.812 -14.118 1021 H LYS 131 HN LYS 131 256.842 4.518 -9.727 1022 HA LYS 131 HA LYS 131 257.222 2.515 -11.851 1023 1HB LYS 131 HB2 LYS 131 258.833 3.035 -9.346 1024 2HB LYS 131 HB1 LYS 131 259.125 1.705 -10.458 1025 1HG LYS 131 HG2 LYS 131 259.165 4.568 -11.352 1026 2HG LYS 131 HG1 LYS 131 260.591 3.760 -10.698 1027 1HD LYS 131 HD2 LYS 131 260.894 2.516 -12.555 1028 2HD LYS 131 HD1 LYS 131 259.163 2.279 -12.802 1029 1HE LYS 131 HE2 LYS 131 259.001 4.587 -13.658 1030 2HE LYS 131 HE1 LYS 131 260.746 4.759 -13.471 1031 1HZ LYS 131 HZ1 LYS 131 259.244 3.107 -15.392 1032 2HZ LYS 131 HZ2 LYS 131 260.824 2.678 -14.966 1033 3HZ LYS 131 HZ3 LYS 131 260.519 4.183 -15.676 1034 H LYS 132 HN LYS 132 257.182 0.246 -11.196 1035 HA LYS 132 HA LYS 132 255.197 -0.197 -9.070 1036 1HB LYS 132 HB2 LYS 132 255.835 -1.807 -11.545 1037 2HB LYS 132 HB1 LYS 132 254.743 -2.355 -10.281 1038 1HG LYS 132 HG2 LYS 132 253.231 -1.459 -11.714 1039 2HG LYS 132 HG1 LYS 132 253.596 -0.023 -10.754 1040 1HD LYS 132 HD2 LYS 132 253.949 0.924 -12.769 1041 2HD LYS 132 HD1 LYS 132 255.524 0.138 -12.644 1042 1HE LYS 132 HE2 LYS 132 254.147 -1.884 -13.697 1043 2HE LYS 132 HE1 LYS 132 253.177 -0.550 -14.322 1044 1HZ LYS 132 HZ1 LYS 132 254.705 -0.644 -15.960 1045 2HZ LYS 132 HZ2 LYS 132 255.900 -1.334 -14.983 1046 3HZ LYS 132 HZ3 LYS 132 255.603 0.330 -14.906 1047 H PHE 133 HN PHE 133 255.715 -1.381 -7.341 1048 HA PHE 133 HA PHE 133 258.016 -3.190 -7.469 1049 1HB PHE 133 HB2 PHE 133 257.680 -0.862 -5.600 1050 2HB PHE 133 HB1 PHE 133 258.592 -2.278 -5.099 1051 HD1 PHE 133 HD1 PHE 133 258.385 0.083 -7.985 1052 HD2 PHE 133 HD2 PHE 133 260.855 -2.258 -5.431 1053 HE1 PHE 133 HE1 PHE 133 260.384 0.979 -9.103 1054 HE2 PHE 133 HE2 PHE 133 262.859 -1.367 -6.545 1055 HZ PHE 133 HZ PHE 133 262.624 0.256 -8.383 1056 H HIS 134 HN HIS 134 258.097 -4.692 -5.643 1057 HA HIS 134 HA HIS 134 255.488 -5.093 -4.341 1058 1HB HIS 134 HB2 HIS 134 255.657 -6.699 -6.167 1059 2HB HIS 134 HB1 HIS 134 257.246 -7.207 -5.609 1060 HD1 HIS 134 HD1 HIS 134 253.934 -8.358 -5.596 1061 HD2 HIS 134 HD2 HIS 134 256.909 -8.179 -2.701 1062 HE1 HIS 134 HE1 HIS 134 253.279 -10.049 -3.854 1063 HE2 HIS 134 HE2 HIS 134 255.156 -10.005 -2.173 1064 H GLY 135 HN GLY 135 255.656 -5.212 -2.173 1065 1HA GLY 135 HA2 GLY 135 258.314 -5.904 -1.080 1066 2HA GLY 135 HA1 GLY 135 257.288 -4.663 -0.383 1067 H TYR 136 HN TYR 136 258.461 -7.079 0.769 1068 HA TYR 136 HA TYR 136 255.999 -8.383 1.727 1069 1HB TYR 136 HB2 TYR 136 257.535 -9.854 0.360 1070 2HB TYR 136 HB1 TYR 136 258.749 -9.641 1.614 1071 HD1 TYR 136 HD1 TYR 136 255.829 -11.457 0.576 1072 HD2 TYR 136 HD2 TYR 136 258.250 -10.494 3.938 1073 HE1 TYR 136 HE1 TYR 136 254.889 -13.375 1.793 1074 HE2 TYR 136 HE2 TYR 136 257.316 -12.410 5.166 1075 HH TYR 136 HH TYR 136 256.211 -14.735 4.383 1076 H PHE 137 HN PHE 137 255.582 -7.579 3.699 1077 HA PHE 137 HA PHE 137 257.859 -6.981 5.471 1078 1HB PHE 137 HB2 PHE 137 255.062 -5.848 5.600 1079 2HB PHE 137 HB1 PHE 137 256.458 -5.334 6.545 1080 HD1 PHE 137 HD1 PHE 137 255.084 -5.495 3.114 1081 HD2 PHE 137 HD2 PHE 137 257.968 -3.750 5.711 1082 HE1 PHE 137 HE1 PHE 137 255.669 -3.865 1.364 1083 HE2 PHE 137 HE2 PHE 137 258.556 -2.121 3.967 1084 HZ PHE 137 HZ PHE 137 257.406 -2.177 1.791 1085 H LYS 138 HN LYS 138 258.092 -8.107 7.288 1086 HA LYS 138 HA LYS 138 256.053 -10.018 8.096 1087 1HB LYS 138 HB2 LYS 138 258.774 -10.178 8.033 1088 2HB LYS 138 HB1 LYS 138 258.503 -9.753 9.717 1089 1HG LYS 138 HG2 LYS 138 256.654 -11.741 9.271 1090 2HG LYS 138 HG1 LYS 138 258.051 -12.263 8.327 1091 1HD LYS 138 HD2 LYS 138 259.392 -12.481 10.180 1092 2HD LYS 138 HD1 LYS 138 258.486 -11.282 11.107 1093 1HE LYS 138 HE2 LYS 138 256.815 -12.793 11.665 1094 2HE LYS 138 HE1 LYS 138 257.210 -13.874 10.330 1095 1HZ LYS 138 HZ1 LYS 138 259.307 -14.396 11.493 1096 2HZ LYS 138 HZ2 LYS 138 257.936 -14.853 12.371 1097 3HZ LYS 138 HZ3 LYS 138 258.793 -13.462 12.807 1098 H PHE 139 HN PHE 139 254.680 -9.659 9.779 1099 HA PHE 139 HA PHE 139 255.226 -7.276 11.431 1100 1HB PHE 139 HB2 PHE 139 252.698 -8.476 10.370 1101 2HB PHE 139 HB1 PHE 139 252.644 -7.550 11.865 1102 HD1 PHE 139 HD1 PHE 139 252.127 -5.331 11.683 1103 HD2 PHE 139 HD2 PHE 139 254.114 -7.251 8.446 1104 HE1 PHE 139 HE1 PHE 139 252.023 -3.243 10.386 1105 HE2 PHE 139 HE2 PHE 139 254.014 -5.166 7.144 1106 HZ PHE 139 HZ PHE 139 252.967 -3.160 8.113 1107 H GLN 140 HN GLN 140 254.398 -7.315 13.637 1108 HA GLN 140 HA GLN 140 255.079 -9.806 14.959 1109 1HB GLN 140 HB2 GLN 140 255.079 -7.008 15.621 1110 2HB GLN 140 HB1 GLN 140 254.163 -7.887 16.833 1111 1HG GLN 140 HG2 GLN 140 257.020 -8.305 16.023 1112 2HG GLN 140 HG1 GLN 140 256.406 -7.742 17.574 1113 1HE2 GLN 140 HE21 GLN 140 258.138 -10.008 16.958 1114 2HE2 GLN 140 HE22 GLN 140 257.340 -11.406 17.583 1115 H GLY 141 HN GLY 141 252.308 -7.672 14.557 1116 1HA GLY 141 HA2 GLY 141 250.522 -9.889 15.198 1117 2HA GLY 141 HA1 GLY 141 250.391 -8.448 16.196 1118 H GLN 142 HN GLN 142 250.864 -6.523 14.146 1119 HA GLN 142 HA GLN 142 249.323 -6.809 11.859 1120 1HB GLN 142 HB2 GLN 142 247.755 -6.381 14.293 1121 2HB GLN 142 HB1 GLN 142 247.418 -5.200 13.034 1122 1HG GLN 142 HG2 GLN 142 246.320 -6.680 11.783 1123 2HG GLN 142 HG1 GLN 142 247.531 -7.935 12.041 1124 1HE2 GLN 142 HE21 GLN 142 244.410 -7.421 12.341 1125 2HE2 GLN 142 HE22 GLN 142 244.046 -8.339 13.758 1126 H ASP 143 HN ASP 143 250.444 -4.684 14.421 1127 HA ASP 143 HA ASP 143 250.615 -2.495 12.456 1128 1HB ASP 143 HB2 ASP 143 250.529 -2.318 15.473 1129 2HB ASP 143 HB1 ASP 143 250.629 -0.951 14.365 1130 H THR 144 HN THR 144 252.449 -4.534 14.578 1131 HA THR 144 HA THR 144 254.809 -2.837 14.372 1132 HB THR 144 HB THR 144 254.207 -5.364 15.883 1133 HG1 THR 144 HG1 THR 144 253.594 -3.329 16.771 1134 1HG2 THR 144 HG21 THR 144 256.884 -4.007 15.670 1135 2HG2 THR 144 HG22 THR 144 256.483 -5.631 15.114 1136 3HG2 THR 144 HG23 THR 144 256.459 -5.258 16.837 1137 H ILE 145 HN ILE 145 256.536 -3.221 13.110 1138 HA ILE 145 HA ILE 145 256.395 -5.576 11.358 1139 HB ILE 145 HB ILE 145 257.814 -2.964 10.826 1140 1HG1 ILE 145 HG12 ILE 145 255.301 -4.107 9.588 1141 2HG1 ILE 145 HG11 ILE 145 255.350 -2.777 10.740 1142 1HG2 ILE 145 HG21 ILE 145 259.039 -4.565 9.667 1143 2HG2 ILE 145 HG22 ILE 145 257.871 -4.017 8.463 1144 3HG2 ILE 145 HG23 ILE 145 257.614 -5.541 9.312 1145 1HD1 ILE 145 HD11 ILE 145 256.585 -2.764 7.996 1146 2HD1 ILE 145 HD12 ILE 145 256.591 -1.427 9.146 1147 3HD1 ILE 145 HD13 ILE 145 255.070 -1.988 8.452 1148 H LEU 146 HN LEU 146 258.147 -6.878 11.089 1149 HA LEU 146 HA LEU 146 260.500 -6.302 12.765 1150 1HB LEU 146 HB2 LEU 146 259.453 -9.063 12.187 1151 2HB LEU 146 HB1 LEU 146 260.670 -8.596 13.360 1152 HG LEU 146 HG LEU 146 257.923 -7.488 13.675 1153 1HD1 LEU 146 HD11 LEU 146 256.929 -9.394 14.348 1154 2HD1 LEU 146 HD12 LEU 146 258.425 -10.081 14.983 1155 3HD1 LEU 146 HD13 LEU 146 258.092 -10.137 13.251 1156 1HD2 LEU 146 HD21 LEU 146 260.198 -7.208 15.090 1157 2HD2 LEU 146 HD22 LEU 146 259.489 -8.597 15.914 1158 3HD2 LEU 146 HD23 LEU 146 258.585 -7.088 15.795 1159 H ASP 147 HN ASP 147 259.316 -7.009 9.663 1160 HA ASP 147 HA ASP 147 262.004 -7.102 8.608 1161 1HB ASP 147 HB2 ASP 147 260.609 -9.510 9.039 1162 2HB ASP 147 HB1 ASP 147 260.504 -9.204 7.308 1163 H TYR 148 HN TYR 148 262.121 -6.144 6.614 1164 HA TYR 148 HA TYR 148 259.635 -5.851 5.107 1165 1HB TYR 148 HB2 TYR 148 259.949 -3.482 4.773 1166 2HB TYR 148 HB1 TYR 148 259.852 -3.837 6.493 1167 HD1 TYR 148 HD1 TYR 148 262.050 -2.751 3.764 1168 HD2 TYR 148 HD2 TYR 148 261.779 -3.541 7.936 1169 HE1 TYR 148 HE1 TYR 148 264.180 -1.576 4.118 1170 HE2 TYR 148 HE2 TYR 148 263.908 -2.367 8.302 1171 HH TYR 148 HH TYR 148 266.076 -1.732 6.011 1172 H THR 149 HN THR 149 259.865 -6.142 2.993 1173 HA THR 149 HA THR 149 262.552 -5.878 1.826 1174 HB THR 149 HB THR 149 261.385 -7.849 0.307 1175 HG1 THR 149 HG1 THR 149 260.683 -9.383 1.900 1176 1HG2 THR 149 HG21 THR 149 263.589 -7.637 2.087 1177 2HG2 THR 149 HG22 THR 149 263.355 -8.741 0.732 1178 3HG2 THR 149 HG23 THR 149 262.792 -9.190 2.342 1179 H LEU 150 HN LEU 150 262.643 -5.145 -0.290 1180 HA LEU 150 HA LEU 150 260.101 -4.371 -1.531 1181 1HB LEU 150 HB2 LEU 150 262.496 -2.610 -1.058 1182 2HB LEU 150 HB1 LEU 150 261.255 -2.225 -2.235 1183 HG LEU 150 HG LEU 150 259.744 -2.652 -0.008 1184 1HD1 LEU 150 HD11 LEU 150 261.883 -0.973 1.137 1185 2HD1 LEU 150 HD12 LEU 150 262.181 -2.710 1.096 1186 3HD1 LEU 150 HD13 LEU 150 260.759 -2.079 1.926 1187 1HD2 LEU 150 HD21 LEU 150 260.152 -0.635 -1.742 1188 2HD2 LEU 150 HD22 LEU 150 260.820 0.078 -0.274 1189 3HD2 LEU 150 HD23 LEU 150 259.153 -0.494 -0.295 1190 H ARG 151 HN ARG 151 259.960 -5.024 -3.558 1191 HA ARG 151 HA ARG 151 262.442 -5.455 -5.086 1192 1HB ARG 151 HB2 ARG 151 259.944 -7.102 -5.445 1193 2HB ARG 151 HB1 ARG 151 261.559 -7.430 -6.057 1194 1HG ARG 151 HG2 ARG 151 262.179 -7.513 -3.517 1195 2HG ARG 151 HG1 ARG 151 260.451 -7.818 -3.322 1196 1HD ARG 151 HD2 ARG 151 260.556 -9.773 -4.657 1197 2HD ARG 151 HD1 ARG 151 262.182 -9.386 -5.218 1198 HE ARG 151 HE ARG 151 262.203 -9.652 -2.418 1199 1HH1 ARG 151 HH11 ARG 151 261.860 -11.591 -5.300 1200 2HH1 ARG 151 HH12 ARG 151 262.499 -13.022 -4.563 1201 1HH2 ARG 151 HH21 ARG 151 263.044 -11.533 -1.449 1202 2HH2 ARG 151 HH22 ARG 151 263.170 -12.990 -2.377 1203 H GLU 152 HN GLU 152 262.185 -5.292 -7.432 1204 HA GLU 152 HA GLU 152 260.217 -3.226 -8.101 1205 1HB GLU 152 HB2 GLU 152 261.633 -2.712 -10.006 1206 2HB GLU 152 HB1 GLU 152 262.598 -2.734 -8.537 1207 1HG GLU 152 HG2 GLU 152 262.931 -5.272 -9.323 1208 2HG GLU 152 HG1 GLU 152 262.684 -4.504 -10.890 1209 H VAL 153 HN VAL 153 258.897 -3.375 -9.930 1210 HA VAL 153 HA VAL 153 258.834 -5.908 -11.381 1211 HB VAL 153 HB VAL 153 256.324 -6.009 -11.081 1212 1HG1 VAL 153 HG11 VAL 153 256.495 -7.076 -8.818 1213 2HG1 VAL 153 HG12 VAL 153 258.157 -6.489 -8.739 1214 3HG1 VAL 153 HG13 VAL 153 257.684 -7.635 -9.993 1215 1HG2 VAL 153 HG21 VAL 153 256.263 -3.635 -10.138 1216 2HG2 VAL 153 HG22 VAL 153 256.795 -4.355 -8.618 1217 3HG2 VAL 153 HG23 VAL 153 255.263 -4.849 -9.340 1218 H ASP 154 HN ASP 154 257.787 -5.804 -13.392 1219 HA ASP 154 HA ASP 154 256.512 -3.371 -14.259 1220 1HB ASP 154 HB2 ASP 154 259.137 -3.141 -14.410 1221 2HB ASP 154 HB1 ASP 154 258.924 -4.106 -15.867 1222 H THR 155 HN THR 155 258.197 -6.254 -15.509 1223 HA THR 155 HA THR 155 256.151 -6.600 -17.543 1224 HB THR 155 HB THR 155 258.462 -6.952 -18.202 1225 HG1 THR 155 HG1 THR 155 257.769 -8.474 -19.439 1226 1HG2 THR 155 HG21 THR 155 259.921 -7.830 -16.794 1227 2HG2 THR 155 HG22 THR 155 259.176 -9.400 -17.101 1228 3HG2 THR 155 HG23 THR 155 258.638 -8.420 -15.736 1229 H VAL 156 HN VAL 156 255.073 -8.671 -17.841 1230 HA VAL 156 HA VAL 156 254.891 -10.397 -15.505 1231 HB VAL 156 HB VAL 156 253.215 -8.656 -15.063 1232 1HG1 VAL 156 HG11 VAL 156 252.580 -9.111 -17.868 1233 2HG1 VAL 156 HG12 VAL 156 252.244 -7.718 -16.840 1234 3HG1 VAL 156 HG13 VAL 156 251.155 -9.106 -16.827 1235 1HG2 VAL 156 HG21 VAL 156 252.303 -10.418 -14.032 1236 2HG2 VAL 156 HG22 VAL 156 252.614 -11.491 -15.396 1237 3HG2 VAL 156 HG23 VAL 156 251.178 -10.468 -15.389 Start of MODEL 14 1 1H MET 1 HT1 MET 1 243.618 -25.161 -1.409 2 2H MET 1 HT2 MET 1 245.241 -24.605 -1.476 3 3H MET 1 HT3 MET 1 244.736 -25.910 -2.470 4 HA MET 1 HA MET 1 244.982 -23.703 -3.556 5 1HB MET 1 HB2 MET 1 243.601 -25.798 -4.233 6 2HB MET 1 HB1 MET 1 242.206 -24.835 -3.765 7 1HG MET 1 HG2 MET 1 242.589 -24.697 -6.149 8 2HG MET 1 HG1 MET 1 242.836 -23.126 -5.387 9 1HE MET 1 HE1 MET 1 245.132 -21.882 -7.191 10 2HE MET 1 HE2 MET 1 243.562 -22.589 -7.575 11 3HE MET 1 HE3 MET 1 245.010 -23.144 -8.416 12 H GLY 2 HN GLY 2 244.482 -22.849 -0.893 13 1HA GLY 2 HA2 GLY 2 242.670 -20.639 -1.473 14 2HA GLY 2 HA1 GLY 2 242.243 -21.656 -0.106 15 H ALA 3 HN ALA 3 242.571 -20.286 1.566 16 HA ALA 3 HA ALA 3 243.675 -19.061 3.132 17 1HB ALA 3 HB1 ALA 3 246.398 -19.692 2.371 18 2HB ALA 3 HB2 ALA 3 245.381 -21.131 2.425 19 3HB ALA 3 HB3 ALA 3 245.515 -20.093 3.845 20 H SER 4 HN SER 4 246.030 -17.672 3.167 21 HA SER 4 HA SER 4 246.980 -15.709 2.522 22 1HB SER 4 HB2 SER 4 247.950 -16.441 0.594 23 2HB SER 4 HB1 SER 4 246.443 -17.097 -0.039 24 HG SER 4 HG SER 4 247.302 -14.397 -0.035 25 H ARG 5 HN ARG 5 245.571 -14.429 3.614 26 HA ARG 5 HA ARG 5 243.046 -13.622 2.699 27 1HB ARG 5 HB2 ARG 5 245.007 -12.325 4.595 28 2HB ARG 5 HB1 ARG 5 243.400 -11.678 4.289 29 1HG ARG 5 HG2 ARG 5 243.672 -14.523 5.125 30 2HG ARG 5 HG1 ARG 5 243.855 -13.248 6.331 31 1HD ARG 5 HD2 ARG 5 241.539 -12.971 4.536 32 2HD ARG 5 HD1 ARG 5 241.487 -14.357 5.625 33 HE ARG 5 HE ARG 5 242.176 -11.898 6.937 34 1HH1 ARG 5 HH11 ARG 5 239.538 -13.898 5.834 35 2HH1 ARG 5 HH12 ARG 5 238.404 -13.247 6.969 36 1HH2 ARG 5 HH21 ARG 5 240.686 -11.040 8.431 37 2HH2 ARG 5 HH22 ARG 5 239.055 -11.624 8.443 38 H LEU 6 HN LEU 6 243.010 -12.945 0.628 39 HA LEU 6 HA LEU 6 244.896 -10.964 -0.323 40 1HB LEU 6 HB2 LEU 6 243.745 -12.944 -1.634 41 2HB LEU 6 HB1 LEU 6 242.477 -11.759 -1.881 42 HG LEU 6 HG LEU 6 245.302 -11.047 -2.566 43 1HD1 LEU 6 HD11 LEU 6 243.625 -12.176 -4.716 44 2HD1 LEU 6 HD12 LEU 6 244.331 -13.327 -3.581 45 3HD1 LEU 6 HD13 LEU 6 245.373 -12.230 -4.488 46 1HD2 LEU 6 HD21 LEU 6 244.373 -9.383 -3.829 47 2HD2 LEU 6 HD22 LEU 6 243.134 -9.532 -2.584 48 3HD2 LEU 6 HD23 LEU 6 242.902 -10.298 -4.155 49 H TYR 7 HN TYR 7 244.646 -8.914 0.061 50 HA TYR 7 HA TYR 7 241.939 -7.768 0.193 51 1HB TYR 7 HB2 TYR 7 244.352 -7.293 1.911 52 2HB TYR 7 HB1 TYR 7 243.159 -6.016 1.700 53 HD1 TYR 7 HD1 TYR 7 241.703 -5.835 3.468 54 HD2 TYR 7 HD2 TYR 7 243.040 -9.708 2.326 55 HE1 TYR 7 HE1 TYR 7 240.325 -6.828 5.246 56 HE2 TYR 7 HE2 TYR 7 241.665 -10.712 4.098 57 HH TYR 7 HH TYR 7 239.442 -9.918 5.377 58 H THR 8 HN THR 8 242.283 -5.198 0.087 59 HA THR 8 HA THR 8 244.022 -4.645 -2.232 60 HB THR 8 HB THR 8 242.255 -3.159 -3.083 61 HG1 THR 8 HG1 THR 8 240.993 -2.607 -1.437 62 1HG2 THR 8 HG21 THR 8 241.744 -6.055 -2.750 63 2HG2 THR 8 HG22 THR 8 242.018 -5.108 -4.211 64 3HG2 THR 8 HG23 THR 8 240.453 -5.045 -3.401 65 H LEU 9 HN LEU 9 244.289 -2.237 -2.570 66 HA LEU 9 HA LEU 9 244.084 -0.613 -0.176 67 1HB LEU 9 HB2 LEU 9 246.289 -2.015 -0.211 68 2HB LEU 9 HB1 LEU 9 246.793 -0.863 -1.431 69 HG LEU 9 HG LEU 9 246.123 -0.320 1.443 70 1HD1 LEU 9 HD11 LEU 9 248.607 0.183 -0.179 71 2HD1 LEU 9 HD12 LEU 9 248.378 -1.140 0.965 72 3HD1 LEU 9 HD13 LEU 9 248.392 0.528 1.537 73 1HD2 LEU 9 HD21 LEU 9 246.375 1.583 -0.854 74 2HD2 LEU 9 HD22 LEU 9 246.742 2.075 0.800 75 3HD2 LEU 9 HD23 LEU 9 245.125 1.503 0.389 76 H VAL 10 HN VAL 10 243.088 1.122 -1.072 77 HA VAL 10 HA VAL 10 244.137 2.131 -3.616 78 HB VAL 10 HB VAL 10 241.907 1.630 -3.990 79 1HG1 VAL 10 HG11 VAL 10 240.877 1.019 -2.109 80 2HG1 VAL 10 HG12 VAL 10 240.164 2.621 -2.280 81 3HG1 VAL 10 HG13 VAL 10 241.525 2.374 -1.187 82 1HG2 VAL 10 HG21 VAL 10 240.754 3.726 -4.304 83 2HG2 VAL 10 HG22 VAL 10 242.466 3.938 -4.661 84 3HG2 VAL 10 HG23 VAL 10 241.806 4.509 -3.127 85 H LEU 11 HN LEU 11 245.258 3.867 -3.575 86 HA LEU 11 HA LEU 11 244.763 5.893 -1.503 87 1HB LEU 11 HB2 LEU 11 247.118 4.344 -2.039 88 2HB LEU 11 HB1 LEU 11 247.457 6.034 -2.359 89 HG LEU 11 HG LEU 11 246.596 4.779 0.246 90 1HD1 LEU 11 HD11 LEU 11 248.799 6.675 0.280 91 2HD1 LEU 11 HD12 LEU 11 249.097 5.308 -0.793 92 3HD1 LEU 11 HD13 LEU 11 248.710 5.027 0.902 93 1HD2 LEU 11 HD21 LEU 11 245.414 6.627 0.650 94 2HD2 LEU 11 HD22 LEU 11 246.112 7.487 -0.723 95 3HD2 LEU 11 HD23 LEU 11 246.977 7.427 0.812 96 H VAL 12 HN VAL 12 243.950 7.619 -2.508 97 HA VAL 12 HA VAL 12 244.457 8.081 -5.306 98 HB VAL 12 HB VAL 12 242.965 9.900 -3.426 99 1HG1 VAL 12 HG11 VAL 12 243.688 10.464 -5.901 100 2HG1 VAL 12 HG12 VAL 12 242.103 10.925 -5.278 101 3HG1 VAL 12 HG13 VAL 12 242.270 9.488 -6.287 102 1HG2 VAL 12 HG21 VAL 12 241.644 8.106 -3.073 103 2HG2 VAL 12 HG22 VAL 12 242.253 7.250 -4.489 104 3HG2 VAL 12 HG23 VAL 12 241.021 8.498 -4.676 105 H LEU 13 HN LEU 13 246.483 8.739 -5.704 106 HA LEU 13 HA LEU 13 247.381 11.229 -4.412 107 1HB LEU 13 HB2 LEU 13 248.613 9.145 -3.725 108 2HB LEU 13 HB1 LEU 13 249.196 9.047 -5.372 109 HG LEU 13 HG LEU 13 250.901 10.324 -4.797 110 1HD1 LEU 13 HD11 LEU 13 248.798 12.387 -4.276 111 2HD1 LEU 13 HD12 LEU 13 249.836 12.205 -5.687 112 3HD1 LEU 13 HD13 LEU 13 250.521 12.728 -4.151 113 1HD2 LEU 13 HD21 LEU 13 250.609 11.505 -2.364 114 2HD2 LEU 13 HD22 LEU 13 251.239 9.880 -2.637 115 3HD2 LEU 13 HD23 LEU 13 249.538 10.110 -2.234 116 H GLN 14 HN GLN 14 247.449 12.830 -5.804 117 HA GLN 14 HA GLN 14 247.888 12.254 -8.651 118 1HB GLN 14 HB2 GLN 14 246.067 13.964 -7.271 119 2HB GLN 14 HB1 GLN 14 247.146 14.977 -8.221 120 1HG GLN 14 HG2 GLN 14 246.237 14.340 -10.158 121 2HG GLN 14 HG1 GLN 14 246.127 12.651 -9.664 122 1HE2 GLN 14 HE21 GLN 14 244.260 11.895 -8.741 123 2HE2 GLN 14 HE22 GLN 14 242.797 12.810 -8.684 124 HA PRO 15 HA PRO 15 251.855 14.172 -8.650 125 1HB PRO 15 HB2 PRO 15 251.807 15.655 -10.946 126 2HB PRO 15 HB1 PRO 15 252.015 13.901 -10.910 127 1HG PRO 15 HG2 PRO 15 249.544 15.506 -11.424 128 2HG PRO 15 HG1 PRO 15 250.130 14.055 -12.258 129 1HD PRO 15 HD2 PRO 15 248.173 13.941 -10.415 130 2HD PRO 15 HD1 PRO 15 249.366 12.639 -10.595 131 H GLN 16 HN GLN 16 249.668 15.653 -7.249 132 HA GLN 16 HA GLN 16 251.069 18.119 -6.917 133 1HB GLN 16 HB2 GLN 16 248.494 18.019 -8.409 134 2HB GLN 16 HB1 GLN 16 248.720 19.336 -7.266 135 1HG GLN 16 HG2 GLN 16 250.951 19.726 -8.472 136 2HG GLN 16 HG1 GLN 16 250.275 18.709 -9.744 137 1HE2 GLN 16 HE21 GLN 16 247.656 19.472 -9.735 138 2HE2 GLN 16 HE22 GLN 16 247.523 21.127 -10.211 139 H ARG 17 HN ARG 17 248.199 16.183 -6.221 140 HA ARG 17 HA ARG 17 248.494 16.883 -3.400 141 1HB ARG 17 HB2 ARG 17 246.053 17.211 -3.163 142 2HB ARG 17 HB1 ARG 17 246.796 18.421 -4.201 143 1HG ARG 17 HG2 ARG 17 245.034 17.943 -5.515 144 2HG ARG 17 HG1 ARG 17 246.081 16.630 -6.058 145 1HD ARG 17 HD2 ARG 17 245.030 15.179 -4.319 146 2HD ARG 17 HD1 ARG 17 243.894 16.486 -3.989 147 HE ARG 17 HE ARG 17 243.629 16.109 -6.650 148 1HH1 ARG 17 HH11 ARG 17 243.521 13.935 -3.923 149 2HH1 ARG 17 HH12 ARG 17 242.414 12.840 -4.679 150 1HH2 ARG 17 HH21 ARG 17 242.171 14.673 -7.646 151 2HH2 ARG 17 HH22 ARG 17 241.646 13.258 -6.794 152 H VAL 18 HN VAL 18 247.288 15.410 -1.962 153 HA VAL 18 HA VAL 18 246.673 12.808 -3.190 154 HB VAL 18 HB VAL 18 248.885 12.494 -2.370 155 1HG1 VAL 18 HG11 VAL 18 248.649 14.553 -0.804 156 2HG1 VAL 18 HG12 VAL 18 249.749 13.247 -0.365 157 3HG1 VAL 18 HG13 VAL 18 248.162 13.357 0.397 158 1HG2 VAL 18 HG21 VAL 18 248.581 10.801 -0.635 159 2HG2 VAL 18 HG22 VAL 18 247.337 10.671 -1.878 160 3HG2 VAL 18 HG23 VAL 18 246.956 11.408 -0.320 161 H LEU 19 HN LEU 19 245.192 11.524 -2.034 162 HA LEU 19 HA LEU 19 243.749 12.928 0.119 163 1HB LEU 19 HB2 LEU 19 242.421 12.944 -1.909 164 2HB LEU 19 HB1 LEU 19 242.628 11.215 -2.095 165 HG LEU 19 HG LEU 19 241.246 10.761 -0.192 166 1HD1 LEU 19 HD11 LEU 19 241.436 12.213 1.500 167 2HD1 LEU 19 HD12 LEU 19 240.130 13.081 0.695 168 3HD1 LEU 19 HD13 LEU 19 241.806 13.565 0.431 169 1HD2 LEU 19 HD21 LEU 19 240.271 12.551 -2.321 170 2HD2 LEU 19 HD22 LEU 19 239.208 12.351 -0.927 171 3HD2 LEU 19 HD23 LEU 19 239.728 10.941 -1.851 172 H LEU 20 HN LEU 20 243.925 11.896 1.989 173 HA LEU 20 HA LEU 20 244.235 8.966 1.947 174 1HB LEU 20 HB2 LEU 20 245.602 11.091 3.445 175 2HB LEU 20 HB1 LEU 20 245.105 9.725 4.425 176 HG LEU 20 HG LEU 20 246.717 9.399 1.905 177 1HD1 LEU 20 HD11 LEU 20 247.892 10.850 3.556 178 2HD1 LEU 20 HD12 LEU 20 248.709 9.323 3.225 179 3HD1 LEU 20 HD13 LEU 20 247.789 9.526 4.716 180 1HD2 LEU 20 HD21 LEU 20 247.206 7.224 2.774 181 2HD2 LEU 20 HD22 LEU 20 245.457 7.451 2.806 182 3HD2 LEU 20 HD23 LEU 20 246.393 7.595 4.293 183 H GLY 21 HN GLY 21 243.051 7.716 3.370 184 1HA GLY 21 HA2 GLY 21 240.639 9.008 4.392 185 2HA GLY 21 HA1 GLY 21 240.889 7.280 4.199 186 H MET 22 HN MET 22 240.356 9.511 6.456 187 HA MET 22 HA MET 22 242.081 8.199 8.444 188 1HB MET 22 HB2 MET 22 242.645 10.495 8.437 189 2HB MET 22 HB1 MET 22 240.965 10.991 8.326 190 1HG MET 22 HG2 MET 22 240.548 10.414 10.583 191 2HG MET 22 HG1 MET 22 242.091 9.575 10.723 192 1HE MET 22 HE1 MET 22 244.519 11.032 11.265 193 2HE MET 22 HE2 MET 22 244.598 12.547 10.372 194 3HE MET 22 HE3 MET 22 244.135 11.060 9.547 195 H LYS 23 HN LYS 23 241.166 7.377 10.317 196 HA LYS 23 HA LYS 23 238.289 6.966 10.188 197 1HB LYS 23 HB2 LYS 23 240.563 5.671 11.604 198 2HB LYS 23 HB1 LYS 23 238.979 5.578 12.360 199 1HG LYS 23 HG2 LYS 23 238.760 4.933 9.580 200 2HG LYS 23 HG1 LYS 23 240.025 3.955 10.325 201 1HD LYS 23 HD2 LYS 23 237.185 4.231 11.308 202 2HD LYS 23 HD1 LYS 23 237.856 2.839 10.456 203 1HE LYS 23 HE2 LYS 23 239.623 3.146 12.510 204 2HE LYS 23 HE1 LYS 23 238.108 3.640 13.264 205 1HZ LYS 23 HZ1 LYS 23 237.743 1.479 13.553 206 2HZ LYS 23 HZ2 LYS 23 238.992 1.027 12.506 207 3HZ LYS 23 HZ3 LYS 23 237.457 1.378 11.888 208 H LYS 24 HN LYS 24 236.869 7.574 11.851 209 HA LYS 24 HA LYS 24 237.798 9.884 13.337 210 1HB LYS 24 HB2 LYS 24 235.144 8.786 12.565 211 2HB LYS 24 HB1 LYS 24 235.214 9.744 14.037 212 1HG LYS 24 HG2 LYS 24 235.261 11.629 12.879 213 2HG LYS 24 HG1 LYS 24 236.645 11.073 11.936 214 1HD LYS 24 HD2 LYS 24 235.262 10.065 10.312 215 2HD LYS 24 HD1 LYS 24 233.836 10.184 11.344 216 1HE LYS 24 HE2 LYS 24 235.166 12.735 10.720 217 2HE LYS 24 HE1 LYS 24 234.420 11.914 9.348 218 1HZ LYS 24 HZ1 LYS 24 233.066 13.551 10.862 219 2HZ LYS 24 HZ2 LYS 24 232.862 12.168 11.813 220 3HZ LYS 24 HZ3 LYS 24 232.343 12.169 10.204 221 H ARG 25 HN ARG 25 236.906 6.583 13.874 222 HA ARG 25 HA ARG 25 238.020 6.586 16.466 223 1HB ARG 25 HB2 ARG 25 235.737 5.752 17.498 224 2HB ARG 25 HB1 ARG 25 236.149 7.460 17.463 225 1HG ARG 25 HG2 ARG 25 233.817 6.968 16.788 226 2HG ARG 25 HG1 ARG 25 234.747 7.827 15.560 227 1HD ARG 25 HD2 ARG 25 234.940 5.939 14.212 228 2HD ARG 25 HD1 ARG 25 234.558 4.840 15.536 229 HE ARG 25 HE ARG 25 232.711 6.082 13.770 230 1HH1 ARG 25 HH11 ARG 25 233.100 5.021 17.072 231 2HH1 ARG 25 HH12 ARG 25 231.405 4.781 17.326 232 1HH2 ARG 25 HH21 ARG 25 230.480 5.768 14.104 233 2HH2 ARG 25 HH22 ARG 25 229.916 5.204 15.642 234 H GLY 26 HN GLY 26 238.450 4.538 17.201 235 1HA GLY 26 HA2 GLY 26 237.560 2.143 17.058 236 2HA GLY 26 HA1 GLY 26 237.725 2.384 15.326 237 H PHE 27 HN PHE 27 239.411 1.251 14.627 238 HA PHE 27 HA PHE 27 241.789 1.055 16.325 239 1HB PHE 27 HB2 PHE 27 240.671 -0.611 14.109 240 2HB PHE 27 HB1 PHE 27 242.402 -0.665 14.424 241 HD1 PHE 27 HD1 PHE 27 239.106 -1.623 15.590 242 HD2 PHE 27 HD2 PHE 27 243.244 -1.493 16.579 243 HE1 PHE 27 HE1 PHE 27 238.721 -3.244 17.402 244 HE2 PHE 27 HE2 PHE 27 242.866 -3.115 18.391 245 HZ PHE 27 HZ PHE 27 240.602 -3.992 18.804 246 H GLY 28 HN GLY 28 241.016 3.415 14.613 247 1HA GLY 28 HA2 GLY 28 243.647 3.923 13.598 248 2HA GLY 28 HA1 GLY 28 242.487 3.668 12.307 249 H ALA 29 HN ALA 29 241.264 5.133 15.184 250 HA ALA 29 HA ALA 29 240.351 7.433 13.891 251 1HB ALA 29 HB1 ALA 29 240.874 7.773 16.741 252 2HB ALA 29 HB2 ALA 29 239.966 6.316 16.333 253 3HB ALA 29 HB3 ALA 29 239.370 7.899 15.830 254 H GLY 30 HN GLY 30 241.073 9.597 13.915 255 1HA GLY 30 HA2 GLY 30 242.644 11.263 13.741 256 2HA GLY 30 HA1 GLY 30 243.331 10.586 15.209 257 H ARG 31 HN ARG 31 243.101 8.774 12.225 258 HA ARG 31 HA ARG 31 245.919 9.253 11.623 259 1HB ARG 31 HB2 ARG 31 244.733 6.621 12.434 260 2HB ARG 31 HB1 ARG 31 246.082 6.663 11.307 261 1HG ARG 31 HG2 ARG 31 247.553 7.473 12.886 262 2HG ARG 31 HG1 ARG 31 246.266 8.141 13.893 263 1HD ARG 31 HD2 ARG 31 245.915 6.189 14.966 264 2HD ARG 31 HD1 ARG 31 246.194 5.223 13.518 265 HE ARG 31 HE ARG 31 248.109 5.903 15.535 266 1HH1 ARG 31 HH11 ARG 31 247.714 5.094 12.163 267 2HH1 ARG 31 HH12 ARG 31 249.326 4.485 11.992 268 1HH2 ARG 31 HH21 ARG 31 250.230 5.103 15.312 269 2HH2 ARG 31 HH22 ARG 31 250.754 4.489 13.778 270 H TRP 32 HN TRP 32 246.473 8.874 9.462 271 HA TRP 32 HA TRP 32 244.164 8.479 7.681 272 1HB TRP 32 HB2 TRP 32 246.566 9.454 6.353 273 2HB TRP 32 HB1 TRP 32 244.939 10.119 6.357 274 HD1 TRP 32 HD1 TRP 32 248.003 10.095 8.752 275 HE1 TRP 32 HE1 TRP 32 248.127 12.402 9.884 276 HE3 TRP 32 HE3 TRP 32 243.830 12.232 6.714 277 HZ2 TRP 32 HZ2 TRP 32 246.666 14.811 9.903 278 HZ3 TRP 32 HZ3 TRP 32 243.266 14.543 7.342 279 HH2 TRP 32 HH2 TRP 32 244.654 15.805 8.902 280 H ASN 33 HN ASN 33 244.411 7.183 5.774 281 HA ASN 33 HA ASN 33 246.711 5.709 5.154 282 1HB ASN 33 HB2 ASN 33 246.054 3.473 5.979 283 2HB ASN 33 HB1 ASN 33 246.365 4.599 7.296 284 1HD2 ASN 33 HD21 ASN 33 243.966 2.776 5.586 285 2HD2 ASN 33 HD22 ASN 33 242.689 2.995 6.728 286 H GLY 34 HN GLY 34 246.310 4.004 3.554 287 1HA GLY 34 HA2 GLY 34 244.473 4.797 1.600 288 2HA GLY 34 HA1 GLY 34 245.302 3.247 1.638 289 H PHE 35 HN PHE 35 242.788 3.334 0.631 290 HA PHE 35 HA PHE 35 241.025 2.412 2.786 291 1HB PHE 35 HB2 PHE 35 240.056 2.645 -0.026 292 2HB PHE 35 HB1 PHE 35 239.212 2.962 1.478 293 HD1 PHE 35 HD1 PHE 35 239.649 5.082 2.710 294 HD2 PHE 35 HD2 PHE 35 241.154 4.372 -1.206 295 HE1 PHE 35 HE1 PHE 35 240.025 7.496 2.421 296 HE2 PHE 35 HE2 PHE 35 241.534 6.783 -1.503 297 HZ PHE 35 HZ PHE 35 240.970 8.350 0.312 298 H GLY 36 HN GLY 36 241.551 0.338 3.210 299 1HA GLY 36 HA2 GLY 36 242.306 -1.503 1.157 300 2HA GLY 36 HA1 GLY 36 242.029 -1.889 2.846 301 H GLY 37 HN GLY 37 241.262 -3.571 0.772 302 1HA GLY 37 HA2 GLY 37 238.443 -3.821 1.349 303 2HA GLY 37 HA1 GLY 37 238.795 -3.459 -0.336 304 H LYS 38 HN LYS 38 238.227 -5.905 1.794 305 HA LYS 38 HA LYS 38 240.060 -7.872 0.815 306 1HB LYS 38 HB2 LYS 38 238.778 -9.454 2.129 307 2HB LYS 38 HB1 LYS 38 239.050 -7.992 3.067 308 1HG LYS 38 HG2 LYS 38 236.722 -7.281 2.221 309 2HG LYS 38 HG1 LYS 38 236.519 -8.988 1.823 310 1HD LYS 38 HD2 LYS 38 237.473 -9.174 4.348 311 2HD LYS 38 HD1 LYS 38 236.596 -7.646 4.445 312 1HE LYS 38 HE2 LYS 38 234.648 -8.879 3.369 313 2HE LYS 38 HE1 LYS 38 235.538 -10.363 3.710 314 1HZ LYS 38 HZ1 LYS 38 234.106 -10.061 5.516 315 2HZ LYS 38 HZ2 LYS 38 234.438 -8.407 5.638 316 3HZ LYS 38 HZ3 LYS 38 235.611 -9.539 6.087 317 H VAL 39 HN VAL 39 239.727 -9.515 -0.645 318 HA VAL 39 HA VAL 39 237.767 -9.007 -2.694 319 HB VAL 39 HB VAL 39 239.488 -11.473 -2.597 320 1HG1 VAL 39 HG11 VAL 39 238.515 -9.729 -4.858 321 2HG1 VAL 39 HG12 VAL 39 237.836 -11.288 -4.386 322 3HG1 VAL 39 HG13 VAL 39 239.477 -11.196 -5.026 323 1HG2 VAL 39 HG21 VAL 39 240.362 -8.676 -2.830 324 2HG2 VAL 39 HG22 VAL 39 240.996 -9.780 -4.050 325 3HG2 VAL 39 HG23 VAL 39 241.258 -10.112 -2.338 326 H GLN 40 HN GLN 40 235.721 -9.574 -2.335 327 HA GLN 40 HA GLN 40 234.704 -11.331 -0.501 328 1HB GLN 40 HB2 GLN 40 233.592 -9.695 -2.306 329 2HB GLN 40 HB1 GLN 40 233.302 -11.228 -3.117 330 1HG GLN 40 HG2 GLN 40 232.605 -11.328 -0.306 331 2HG GLN 40 HG1 GLN 40 231.727 -10.068 -1.172 332 1HE2 GLN 40 HE21 GLN 40 231.233 -12.951 -0.077 333 2HE2 GLN 40 HE22 GLN 40 230.306 -13.674 -1.344 334 H GLU 41 HN GLU 41 233.343 -13.351 -1.154 335 HA GLU 41 HA GLU 41 235.190 -15.378 -1.871 336 1HB GLU 41 HB2 GLU 41 233.324 -15.722 -0.284 337 2HB GLU 41 HB1 GLU 41 232.183 -15.557 -1.612 338 1HG GLU 41 HG2 GLU 41 232.294 -17.778 -1.727 339 2HG GLU 41 HG1 GLU 41 233.831 -17.510 -2.547 340 H GLY 42 HN GLY 42 235.654 -14.172 -4.006 341 1HA GLY 42 HA2 GLY 42 235.646 -15.264 -6.229 342 2HA GLY 42 HA1 GLY 42 233.896 -15.313 -6.091 343 H GLU 43 HN GLU 43 236.178 -12.652 -5.405 344 HA GLU 43 HA GLU 43 234.935 -11.161 -7.593 345 1HB GLU 43 HB2 GLU 43 234.460 -9.331 -6.321 346 2HB GLU 43 HB1 GLU 43 234.319 -10.544 -5.061 347 1HG GLU 43 HG2 GLU 43 236.415 -9.984 -4.151 348 2HG GLU 43 HG1 GLU 43 236.869 -9.043 -5.571 349 H THR 44 HN THR 44 236.382 -9.143 -8.033 350 HA THR 44 HA THR 44 239.095 -10.208 -8.258 351 HB THR 44 HB THR 44 239.343 -8.554 -10.067 352 HG1 THR 44 HG1 THR 44 236.581 -8.051 -9.746 353 1HG2 THR 44 HG21 THR 44 236.940 -10.352 -10.232 354 2HG2 THR 44 HG22 THR 44 238.597 -10.738 -10.696 355 3HG2 THR 44 HG23 THR 44 237.676 -9.550 -11.620 356 H ILE 45 HN ILE 45 240.879 -9.087 -7.612 357 HA ILE 45 HA ILE 45 240.764 -7.593 -5.320 358 HB ILE 45 HB ILE 45 242.958 -7.249 -7.352 359 1HG1 ILE 45 HG12 ILE 45 243.823 -9.221 -5.677 360 2HG1 ILE 45 HG11 ILE 45 242.119 -9.628 -5.853 361 1HG2 ILE 45 HG21 ILE 45 243.296 -5.779 -5.574 362 2HG2 ILE 45 HG22 ILE 45 244.311 -7.173 -5.201 363 3HG2 ILE 45 HG23 ILE 45 242.762 -6.965 -4.383 364 1HD1 ILE 45 HD11 ILE 45 244.202 -10.263 -7.582 365 2HD1 ILE 45 HD12 ILE 45 243.287 -8.999 -8.403 366 3HD1 ILE 45 HD13 ILE 45 242.474 -10.470 -7.868 367 H GLU 46 HN GLU 46 240.579 -6.479 -8.641 368 HA GLU 46 HA GLU 46 240.824 -3.687 -8.009 369 1HB GLU 46 HB2 GLU 46 240.992 -5.130 -10.324 370 2HB GLU 46 HB1 GLU 46 239.386 -4.434 -10.475 371 1HG GLU 46 HG2 GLU 46 240.230 -2.226 -10.355 372 2HG GLU 46 HG1 GLU 46 241.824 -2.794 -9.857 373 H ASP 47 HN ASP 47 238.282 -6.044 -8.146 374 HA ASP 47 HA ASP 47 236.157 -4.102 -8.102 375 1HB ASP 47 HB2 ASP 47 236.336 -7.078 -8.046 376 2HB ASP 47 HB1 ASP 47 234.881 -6.336 -7.391 377 H GLY 48 HN GLY 48 237.919 -6.123 -5.837 378 1HA GLY 48 HA2 GLY 48 236.262 -5.535 -3.575 379 2HA GLY 48 HA1 GLY 48 237.884 -6.219 -3.527 380 H ALA 49 HN ALA 49 239.131 -4.099 -4.986 381 HA ALA 49 HA ALA 49 239.589 -2.256 -2.833 382 1HB ALA 49 HB1 ALA 49 241.196 -3.185 -4.745 383 2HB ALA 49 HB2 ALA 49 241.456 -1.622 -3.971 384 3HB ALA 49 HB3 ALA 49 240.663 -1.706 -5.544 385 H ARG 50 HN ARG 50 237.815 -2.302 -5.840 386 HA ARG 50 HA ARG 50 237.308 0.521 -5.871 387 1HB ARG 50 HB2 ARG 50 236.467 -1.828 -7.497 388 2HB ARG 50 HB1 ARG 50 235.464 -0.385 -7.563 389 1HG ARG 50 HG2 ARG 50 237.729 0.823 -8.018 390 2HG ARG 50 HG1 ARG 50 238.265 -0.790 -8.491 391 1HD ARG 50 HD2 ARG 50 236.082 -0.809 -9.905 392 2HD ARG 50 HD1 ARG 50 236.157 0.943 -9.714 393 HE ARG 50 HE ARG 50 237.956 1.002 -11.143 394 1HH1 ARG 50 HH11 ARG 50 237.312 -2.307 -10.231 395 2HH1 ARG 50 HH12 ARG 50 238.397 -2.971 -11.405 396 1HH2 ARG 50 HH21 ARG 50 239.382 0.127 -12.687 397 2HH2 ARG 50 HH22 ARG 50 239.572 -1.591 -12.799 398 H ARG 51 HN ARG 51 235.289 -2.354 -5.293 399 HA ARG 51 HA ARG 51 232.964 -0.967 -4.557 400 1HB ARG 51 HB2 ARG 51 233.481 -3.539 -5.056 401 2HB ARG 51 HB1 ARG 51 233.512 -3.605 -3.300 402 1HG ARG 51 HG2 ARG 51 231.274 -2.946 -3.121 403 2HG ARG 51 HG1 ARG 51 231.224 -2.364 -4.787 404 1HD ARG 51 HD2 ARG 51 231.892 -4.975 -5.148 405 2HD ARG 51 HD1 ARG 51 230.866 -5.074 -3.718 406 HE ARG 51 HE ARG 51 229.455 -3.508 -5.439 407 1HH1 ARG 51 HH11 ARG 51 230.878 -6.687 -5.648 408 2HH1 ARG 51 HH12 ARG 51 229.700 -7.278 -6.771 409 1HH2 ARG 51 HH21 ARG 51 227.904 -4.283 -6.916 410 2HH2 ARG 51 HH22 ARG 51 228.013 -5.913 -7.492 411 H GLU 52 HN GLU 52 235.753 -1.966 -2.682 412 HA GLU 52 HA GLU 52 234.525 -1.232 -0.166 413 1HB GLU 52 HB2 GLU 52 237.357 -2.059 -0.826 414 2HB GLU 52 HB1 GLU 52 236.744 -1.784 0.798 415 1HG GLU 52 HG2 GLU 52 235.273 -3.714 -0.893 416 2HG GLU 52 HG1 GLU 52 236.863 -4.195 -0.306 417 H LEU 53 HN LEU 53 236.331 0.269 -2.644 418 HA LEU 53 HA LEU 53 237.563 2.312 -1.093 419 1HB LEU 53 HB2 LEU 53 238.561 1.895 -3.165 420 2HB LEU 53 HB1 LEU 53 237.025 1.892 -4.013 421 HG LEU 53 HG LEU 53 236.855 4.330 -3.659 422 1HD1 LEU 53 HD11 LEU 53 239.651 4.696 -2.978 423 2HD1 LEU 53 HD12 LEU 53 238.741 3.885 -1.704 424 3HD1 LEU 53 HD13 LEU 53 238.210 5.455 -2.304 425 1HD2 LEU 53 HD21 LEU 53 237.675 3.928 -5.757 426 2HD2 LEU 53 HD22 LEU 53 239.095 3.073 -5.158 427 3HD2 LEU 53 HD23 LEU 53 239.025 4.832 -5.071 428 H GLN 54 HN GLN 54 234.662 2.160 -3.118 429 HA GLN 54 HA GLN 54 233.853 4.832 -2.795 430 1HB GLN 54 HB2 GLN 54 232.736 3.769 -4.506 431 2HB GLN 54 HB1 GLN 54 232.504 2.291 -3.583 432 1HG GLN 54 HG2 GLN 54 230.757 3.352 -2.276 433 2HG GLN 54 HG1 GLN 54 231.019 4.873 -3.128 434 1HE2 GLN 54 HE21 GLN 54 229.568 5.263 -4.624 435 2HE2 GLN 54 HE22 GLN 54 228.740 4.090 -5.583 436 H GLU 55 HN GLU 55 233.583 2.075 -0.724 437 HA GLU 55 HA GLU 55 231.535 3.211 0.953 438 1HB GLU 55 HB2 GLU 55 233.234 0.736 1.217 439 2HB GLU 55 HB1 GLU 55 232.010 1.203 2.389 440 1HG GLU 55 HG2 GLU 55 231.061 1.137 -0.377 441 2HG GLU 55 HG1 GLU 55 231.598 -0.422 0.250 442 H GLU 56 HN GLU 56 234.992 3.296 0.884 443 HA GLU 56 HA GLU 56 235.306 3.780 3.681 444 1HB GLU 56 HB2 GLU 56 237.099 3.769 1.314 445 2HB GLU 56 HB1 GLU 56 237.644 4.621 2.754 446 1HG GLU 56 HG2 GLU 56 236.624 2.127 3.596 447 2HG GLU 56 HG1 GLU 56 237.664 1.827 2.205 448 H SER 57 HN SER 57 235.304 5.920 0.824 449 HA SER 57 HA SER 57 234.851 8.150 2.683 450 1HB SER 57 HB2 SER 57 237.053 7.860 0.706 451 2HB SER 57 HB1 SER 57 236.313 9.454 0.864 452 HG SER 57 HG SER 57 237.716 7.943 2.775 453 H GLY 58 HN GLY 58 233.139 6.569 0.793 454 1HA GLY 58 HA2 GLY 58 231.430 6.970 -0.679 455 2HA GLY 58 HA1 GLY 58 231.502 8.632 -0.116 456 H LEU 59 HN LEU 59 234.427 7.511 -1.459 457 HA LEU 59 HA LEU 59 233.889 9.051 -3.899 458 1HB LEU 59 HB2 LEU 59 236.461 8.324 -2.510 459 2HB LEU 59 HB1 LEU 59 236.395 9.079 -4.091 460 HG LEU 59 HG LEU 59 235.744 10.241 -1.413 461 1HD1 LEU 59 HD11 LEU 59 237.940 10.396 -2.884 462 2HD1 LEU 59 HD12 LEU 59 237.359 11.762 -1.932 463 3HD1 LEU 59 HD13 LEU 59 237.029 11.690 -3.663 464 1HD2 LEU 59 HD21 LEU 59 233.738 10.677 -2.703 465 2HD2 LEU 59 HD22 LEU 59 234.704 11.261 -4.059 466 3HD2 LEU 59 HD23 LEU 59 234.680 12.159 -2.540 467 H THR 60 HN THR 60 233.256 7.812 -5.480 468 HA THR 60 HA THR 60 234.270 5.096 -5.760 469 HB THR 60 HB THR 60 232.458 6.114 -7.836 470 HG1 THR 60 HG1 THR 60 231.643 6.082 -5.121 471 1HG2 THR 60 HG21 THR 60 232.018 3.948 -7.914 472 2HG2 THR 60 HG22 THR 60 231.278 4.064 -6.317 473 3HG2 THR 60 HG23 THR 60 232.989 3.668 -6.469 474 H VAL 61 HN VAL 61 235.466 4.385 -7.539 475 HA VAL 61 HA VAL 61 236.574 6.558 -9.191 476 HB VAL 61 HB VAL 61 238.619 5.284 -9.412 477 1HG1 VAL 61 HG11 VAL 61 237.654 5.711 -6.597 478 2HG1 VAL 61 HG12 VAL 61 238.634 6.787 -7.593 479 3HG1 VAL 61 HG13 VAL 61 239.321 5.282 -6.983 480 1HG2 VAL 61 HG21 VAL 61 238.447 3.061 -9.270 481 2HG2 VAL 61 HG22 VAL 61 236.980 3.149 -8.295 482 3HG2 VAL 61 HG23 VAL 61 238.561 3.287 -7.525 483 H ASP 62 HN ASP 62 236.693 6.343 -11.360 484 HA ASP 62 HA ASP 62 235.033 4.321 -12.567 485 1HB ASP 62 HB2 ASP 62 235.127 6.742 -13.308 486 2HB ASP 62 HB1 ASP 62 236.719 6.395 -13.977 487 H ALA 63 HN ALA 63 238.366 4.734 -11.871 488 HA ALA 63 HA ALA 63 239.104 2.169 -12.632 489 1HB ALA 63 HB1 ALA 63 240.573 2.806 -14.629 490 2HB ALA 63 HB2 ALA 63 239.560 4.245 -14.750 491 3HB ALA 63 HB3 ALA 63 238.839 2.643 -14.908 492 H LEU 64 HN LEU 64 240.300 2.206 -10.746 493 HA LEU 64 HA LEU 64 242.095 4.232 -9.962 494 1HB LEU 64 HB2 LEU 64 242.267 1.277 -9.354 495 2HB LEU 64 HB1 LEU 64 243.068 2.560 -8.471 496 HG LEU 64 HG LEU 64 240.332 3.193 -8.431 497 1HD1 LEU 64 HD11 LEU 64 239.573 1.057 -7.214 498 2HD1 LEU 64 HD12 LEU 64 240.882 0.272 -8.097 499 3HD1 LEU 64 HD13 LEU 64 239.576 1.066 -8.977 500 1HD2 LEU 64 HD21 LEU 64 240.739 3.444 -6.235 501 2HD2 LEU 64 HD22 LEU 64 242.419 3.189 -6.710 502 3HD2 LEU 64 HD23 LEU 64 241.466 1.844 -6.079 503 H HIS 65 HN HIS 65 244.546 3.193 -9.538 504 HA HIS 65 HA HIS 65 245.530 2.237 -12.129 505 1HB HIS 65 HB2 HIS 65 246.889 4.453 -10.591 506 2HB HIS 65 HB1 HIS 65 247.313 3.843 -12.185 507 HD1 HIS 65 HD1 HIS 65 246.217 6.804 -11.089 508 HD2 HIS 65 HD2 HIS 65 244.399 4.068 -13.633 509 HE1 HIS 65 HE1 HIS 65 244.562 8.135 -12.435 510 HE2 HIS 65 HE2 HIS 65 243.411 6.443 -13.903 511 H LYS 66 HN LYS 66 246.153 0.239 -11.499 512 HA LYS 66 HA LYS 66 247.228 -0.441 -8.994 513 1HB LYS 66 HB2 LYS 66 247.862 -2.554 -10.017 514 2HB LYS 66 HB1 LYS 66 246.260 -2.084 -10.568 515 1HG LYS 66 HG2 LYS 66 247.640 -1.028 -12.557 516 2HG LYS 66 HG1 LYS 66 248.812 -2.256 -12.071 517 1HD LYS 66 HD2 LYS 66 246.747 -3.848 -12.122 518 2HD LYS 66 HD1 LYS 66 246.042 -2.594 -13.145 519 1HE LYS 66 HE2 LYS 66 247.037 -3.764 -14.797 520 2HE LYS 66 HE1 LYS 66 248.458 -2.844 -14.305 521 1HZ LYS 66 HZ1 LYS 66 249.344 -4.645 -13.197 522 2HZ LYS 66 HZ2 LYS 66 248.626 -5.389 -14.535 523 3HZ LYS 66 HZ3 LYS 66 247.855 -5.431 -13.030 524 H VAL 67 HN VAL 67 249.280 -0.455 -8.180 525 HA VAL 67 HA VAL 67 251.399 0.445 -10.034 526 HB VAL 67 HB VAL 67 252.467 1.645 -8.176 527 1HG1 VAL 67 HG11 VAL 67 251.130 2.963 -9.619 528 2HG1 VAL 67 HG12 VAL 67 250.731 3.462 -7.975 529 3HG1 VAL 67 HG13 VAL 67 249.638 2.402 -8.865 530 1HG2 VAL 67 HG21 VAL 67 250.782 2.122 -6.223 531 2HG2 VAL 67 HG22 VAL 67 251.842 0.715 -6.182 532 3HG2 VAL 67 HG23 VAL 67 250.156 0.538 -6.668 533 H GLY 68 HN GLY 68 250.819 -1.283 -6.963 534 1HA GLY 68 HA2 GLY 68 252.839 -3.221 -7.764 535 2HA GLY 68 HA1 GLY 68 253.200 -2.302 -6.312 536 H GLN 69 HN GLN 69 253.084 -4.984 -6.142 537 HA GLN 69 HA GLN 69 250.506 -5.499 -4.809 538 1HB GLN 69 HB2 GLN 69 251.203 -6.918 -6.861 539 2HB GLN 69 HB1 GLN 69 252.363 -7.661 -5.769 540 1HG GLN 69 HG2 GLN 69 249.524 -7.509 -4.916 541 2HG GLN 69 HG1 GLN 69 249.970 -8.681 -6.155 542 1HE2 GLN 69 HE21 GLN 69 251.608 -10.242 -5.632 543 2HE2 GLN 69 HE22 GLN 69 251.828 -10.744 -3.993 544 H ILE 70 HN ILE 70 250.635 -5.571 -2.667 545 HA ILE 70 HA ILE 70 253.246 -6.157 -1.442 546 HB ILE 70 HB ILE 70 250.867 -4.765 -0.204 547 1HG1 ILE 70 HG12 ILE 70 253.447 -3.668 -1.341 548 2HG1 ILE 70 HG11 ILE 70 251.823 -3.388 -1.960 549 1HG2 ILE 70 HG21 ILE 70 252.300 -5.955 1.401 550 2HG2 ILE 70 HG22 ILE 70 252.382 -4.206 1.607 551 3HG2 ILE 70 HG23 ILE 70 253.696 -5.061 0.800 552 1HD1 ILE 70 HD11 ILE 70 251.881 -1.512 -0.774 553 2HD1 ILE 70 HD12 ILE 70 253.267 -2.053 0.175 554 3HD1 ILE 70 HD13 ILE 70 251.637 -2.540 0.639 555 H VAL 71 HN VAL 71 253.513 -7.917 -0.287 556 HA VAL 71 HA VAL 71 251.152 -9.526 0.414 557 HB VAL 71 HB VAL 71 254.003 -10.476 0.111 558 1HG1 VAL 71 HG11 VAL 71 251.443 -11.756 0.871 559 2HG1 VAL 71 HG12 VAL 71 253.084 -12.090 1.420 560 3HG1 VAL 71 HG13 VAL 71 252.542 -12.679 -0.153 561 1HG2 VAL 71 HG21 VAL 71 251.731 -10.339 -1.829 562 2HG2 VAL 71 HG22 VAL 71 252.929 -11.627 -1.953 563 3HG2 VAL 71 HG23 VAL 71 253.432 -9.940 -2.069 564 H PHE 72 HN PHE 72 251.054 -10.495 2.477 565 HA PHE 72 HA PHE 72 252.974 -9.458 4.443 566 1HB PHE 72 HB2 PHE 72 250.019 -9.159 4.375 567 2HB PHE 72 HB1 PHE 72 250.755 -9.473 5.942 568 HD1 PHE 72 HD1 PHE 72 250.522 -7.113 3.148 569 HD2 PHE 72 HD2 PHE 72 252.108 -7.826 7.032 570 HE1 PHE 72 HE1 PHE 72 251.085 -4.726 3.352 571 HE2 PHE 72 HE2 PHE 72 252.675 -5.441 7.243 572 HZ PHE 72 HZ PHE 72 252.163 -3.887 5.402 573 H GLU 73 HN GLU 73 253.792 -10.961 5.740 574 HA GLU 73 HA GLU 73 252.461 -13.585 5.841 575 1HB GLU 73 HB2 GLU 73 255.366 -12.834 6.209 576 2HB GLU 73 HB1 GLU 73 254.726 -14.444 6.505 577 1HG GLU 73 HG2 GLU 73 253.822 -13.965 3.989 578 2HG GLU 73 HG1 GLU 73 255.357 -13.097 3.985 579 H PHE 74 HN PHE 74 251.612 -14.218 7.722 580 HA PHE 74 HA PHE 74 251.986 -12.549 10.072 581 1HB PHE 74 HB2 PHE 74 249.746 -13.490 9.350 582 2HB PHE 74 HB1 PHE 74 250.335 -15.079 9.810 583 HD1 PHE 74 HD1 PHE 74 251.319 -12.171 11.787 584 HD2 PHE 74 HD2 PHE 74 248.497 -15.334 11.375 585 HE1 PHE 74 HE1 PHE 74 250.571 -11.805 14.093 586 HE2 PHE 74 HE2 PHE 74 247.742 -14.964 13.686 587 HZ PHE 74 HZ PHE 74 248.779 -13.196 15.050 588 H VAL 75 HN VAL 75 253.042 -13.109 11.923 589 HA VAL 75 HA VAL 75 255.039 -15.122 11.755 590 HB VAL 75 HB VAL 75 254.660 -12.852 13.296 591 1HG1 VAL 75 HG11 VAL 75 254.851 -13.516 15.608 592 2HG1 VAL 75 HG12 VAL 75 254.751 -15.219 15.157 593 3HG1 VAL 75 HG13 VAL 75 253.358 -14.162 14.926 594 1HG2 VAL 75 HG21 VAL 75 256.791 -13.476 12.531 595 2HG2 VAL 75 HG22 VAL 75 256.722 -15.027 13.370 596 3HG2 VAL 75 HG23 VAL 75 256.881 -13.532 14.292 597 H GLY 76 HN GLY 76 255.073 -17.164 12.439 598 1HA GLY 76 HA2 GLY 76 254.444 -19.132 13.435 599 2HA GLY 76 HA1 GLY 76 253.528 -18.173 14.583 600 H GLU 77 HN GLU 77 252.585 -17.516 11.389 601 HA GLU 77 HA GLU 77 250.453 -19.535 11.543 602 1HB GLU 77 HB2 GLU 77 250.224 -16.583 11.336 603 2HB GLU 77 HB1 GLU 77 249.101 -17.541 10.382 604 1HG GLU 77 HG2 GLU 77 249.500 -17.976 13.323 605 2HG GLU 77 HG1 GLU 77 248.327 -16.830 12.679 606 HA PRO 78 HA PRO 78 252.035 -20.532 7.472 607 1HB PRO 78 HB2 PRO 78 249.325 -21.756 7.260 608 2HB PRO 78 HB1 PRO 78 250.909 -22.460 6.911 609 1HG PRO 78 HG2 PRO 78 249.597 -23.114 9.132 610 2HG PRO 78 HG1 PRO 78 251.356 -22.892 9.147 611 1HD PRO 78 HD2 PRO 78 249.206 -21.080 10.150 612 2HD PRO 78 HD1 PRO 78 250.826 -21.385 10.809 613 H GLU 79 HN GLU 79 248.674 -19.445 7.928 614 HA GLU 79 HA GLU 79 248.181 -18.619 5.316 615 1HB GLU 79 HB2 GLU 79 246.764 -18.656 7.668 616 2HB GLU 79 HB1 GLU 79 246.949 -16.932 7.372 617 1HG GLU 79 HG2 GLU 79 246.017 -17.245 5.121 618 2HG GLU 79 HG1 GLU 79 245.772 -18.954 5.483 619 H LEU 80 HN LEU 80 247.790 -16.300 4.682 620 HA LEU 80 HA LEU 80 249.670 -14.385 5.813 621 1HB LEU 80 HB2 LEU 80 249.820 -14.513 2.879 622 2HB LEU 80 HB1 LEU 80 251.087 -14.236 4.056 623 HG LEU 80 HG LEU 80 250.013 -16.996 3.812 624 1HD1 LEU 80 HD11 LEU 80 251.771 -17.347 1.991 625 2HD1 LEU 80 HD12 LEU 80 251.671 -15.605 1.738 626 3HD1 LEU 80 HD13 LEU 80 250.240 -16.611 1.520 627 1HD2 LEU 80 HD21 LEU 80 252.465 -15.623 4.711 628 2HD2 LEU 80 HD22 LEU 80 252.695 -17.181 3.915 629 3HD2 LEU 80 HD23 LEU 80 251.671 -17.064 5.346 630 H MET 81 HN MET 81 249.543 -12.487 3.791 631 HA MET 81 HA MET 81 246.740 -12.090 3.154 632 1HB MET 81 HB2 MET 81 247.253 -11.104 5.472 633 2HB MET 81 HB1 MET 81 248.210 -9.904 4.613 634 1HG MET 81 HG2 MET 81 246.048 -9.537 3.234 635 2HG MET 81 HG1 MET 81 245.257 -10.335 4.593 636 1HE MET 81 HE1 MET 81 246.458 -6.426 3.653 637 2HE MET 81 HE2 MET 81 247.543 -7.782 3.341 638 3HE MET 81 HE3 MET 81 247.872 -6.679 4.677 639 H ASP 82 HN ASP 82 246.848 -11.722 1.028 640 HA ASP 82 HA ASP 82 249.125 -10.223 -0.041 641 1HB ASP 82 HB2 ASP 82 247.828 -12.496 -0.940 642 2HB ASP 82 HB1 ASP 82 247.181 -11.233 -1.983 643 H VAL 83 HN VAL 83 248.736 -8.076 0.147 644 HA VAL 83 HA VAL 83 246.108 -7.080 -0.728 645 HB VAL 83 HB VAL 83 246.731 -6.496 1.589 646 1HG1 VAL 83 HG11 VAL 83 248.574 -5.144 2.133 647 2HG1 VAL 83 HG12 VAL 83 248.882 -4.741 0.445 648 3HG1 VAL 83 HG13 VAL 83 249.215 -6.368 1.036 649 1HG2 VAL 83 HG21 VAL 83 246.356 -4.039 1.366 650 2HG2 VAL 83 HG22 VAL 83 245.225 -5.030 0.445 651 3HG2 VAL 83 HG23 VAL 83 246.558 -4.219 -0.377 652 H HIS 84 HN HIS 84 246.055 -6.275 -2.695 653 HA HIS 84 HA HIS 84 248.452 -5.512 -4.086 654 1HB HIS 84 HB2 HIS 84 245.533 -5.619 -4.782 655 2HB HIS 84 HB1 HIS 84 246.650 -4.745 -5.826 656 HD1 HIS 84 HD1 HIS 84 246.854 -8.165 -4.148 657 HD2 HIS 84 HD2 HIS 84 247.278 -6.378 -7.874 658 HE1 HIS 84 HE1 HIS 84 247.512 -10.020 -5.712 659 HE2 HIS 84 HE2 HIS 84 247.852 -8.899 -7.942 660 H VAL 85 HN VAL 85 248.714 -3.368 -5.097 661 HA VAL 85 HA VAL 85 247.618 -1.270 -3.337 662 HB VAL 85 HB VAL 85 250.280 -1.373 -4.780 663 1HG1 VAL 85 HG11 VAL 85 249.262 0.900 -4.797 664 2HG1 VAL 85 HG12 VAL 85 250.758 0.800 -3.871 665 3HG1 VAL 85 HG13 VAL 85 249.207 0.841 -3.036 666 1HG2 VAL 85 HG21 VAL 85 251.270 -1.580 -2.669 667 2HG2 VAL 85 HG22 VAL 85 249.887 -2.674 -2.615 668 3HG2 VAL 85 HG23 VAL 85 249.794 -1.096 -1.832 669 H PHE 86 HN PHE 86 246.562 0.359 -4.240 670 HA PHE 86 HA PHE 86 246.673 0.736 -7.146 671 1HB PHE 86 HB2 PHE 86 244.317 0.019 -5.454 672 2HB PHE 86 HB1 PHE 86 244.059 1.164 -6.765 673 HD1 PHE 86 HD1 PHE 86 245.146 -2.267 -5.957 674 HD2 PHE 86 HD2 PHE 86 243.982 0.451 -9.017 675 HE1 PHE 86 HE1 PHE 86 244.950 -4.140 -7.541 676 HE2 PHE 86 HE2 PHE 86 243.782 -1.416 -10.606 677 HZ PHE 86 HZ PHE 86 244.266 -3.715 -9.869 678 H CYS 87 HN CYS 87 246.383 2.816 -7.821 679 HA CYS 87 HA CYS 87 245.750 4.845 -5.782 680 1HB CYS 87 HB2 CYS 87 247.429 6.345 -6.882 681 2HB CYS 87 HB1 CYS 87 248.154 4.953 -6.085 682 HG CYS 87 HG CYS 87 248.331 3.893 -8.561 683 H THR 88 HN THR 88 243.928 5.850 -6.450 684 HA THR 88 HA THR 88 243.278 5.768 -9.297 685 HB THR 88 HB THR 88 241.675 4.964 -7.499 686 HG1 THR 88 HG1 THR 88 240.550 5.188 -9.255 687 1HG2 THR 88 HG21 THR 88 242.040 7.514 -6.460 688 2HG2 THR 88 HG22 THR 88 240.872 6.295 -5.950 689 3HG2 THR 88 HG23 THR 88 240.419 7.504 -7.153 690 H ASP 89 HN ASP 89 241.633 7.795 -9.712 691 HA ASP 89 HA ASP 89 242.627 10.311 -8.759 692 1HB ASP 89 HB2 ASP 89 243.275 9.379 -11.559 693 2HB ASP 89 HB1 ASP 89 243.233 11.083 -11.118 694 H SER 90 HN SER 90 240.835 8.590 -11.265 695 HA SER 90 HA SER 90 238.943 10.754 -11.587 696 1HB SER 90 HB2 SER 90 239.810 8.700 -13.231 697 2HB SER 90 HB1 SER 90 238.200 8.167 -12.749 698 HG SER 90 HG SER 90 238.866 10.040 -14.525 699 H ILE 91 HN ILE 91 237.755 11.012 -9.743 700 HA ILE 91 HA ILE 91 236.458 8.636 -8.616 701 HB ILE 91 HB ILE 91 235.947 9.980 -6.641 702 1HG1 ILE 91 HG12 ILE 91 237.525 12.204 -7.957 703 2HG1 ILE 91 HG11 ILE 91 235.766 12.162 -7.883 704 1HG2 ILE 91 HG21 ILE 91 238.329 8.920 -7.282 705 2HG2 ILE 91 HG22 ILE 91 237.995 9.690 -5.731 706 3HG2 ILE 91 HG23 ILE 91 238.813 10.593 -7.006 707 1HD1 ILE 91 HD11 ILE 91 237.712 12.423 -5.616 708 2HD1 ILE 91 HD12 ILE 91 236.009 12.033 -5.373 709 3HD1 ILE 91 HD13 ILE 91 236.465 13.559 -6.130 710 H GLN 92 HN GLN 92 234.225 9.344 -7.535 711 HA GLN 92 HA GLN 92 232.672 10.894 -9.479 712 1HB GLN 92 HB2 GLN 92 232.010 8.115 -8.507 713 2HB GLN 92 HB1 GLN 92 230.901 9.141 -9.407 714 1HG GLN 92 HG2 GLN 92 232.360 9.121 -11.320 715 2HG GLN 92 HG1 GLN 92 233.582 8.223 -10.420 716 1HE2 GLN 92 HE21 GLN 92 233.142 6.049 -9.844 717 2HE2 GLN 92 HE22 GLN 92 232.004 5.108 -10.740 718 H GLY 93 HN GLY 93 232.103 8.935 -6.558 719 1HA GLY 93 HA2 GLY 93 230.021 10.484 -5.542 720 2HA GLY 93 HA1 GLY 93 231.048 9.429 -4.586 721 H THR 94 HN THR 94 230.665 11.101 -2.933 722 HA THR 94 HA THR 94 232.561 13.323 -3.223 723 HB THR 94 HB THR 94 230.349 13.658 -1.314 724 HG1 THR 94 HG1 THR 94 229.168 12.773 -2.977 725 1HG2 THR 94 HG21 THR 94 232.050 15.338 -2.952 726 2HG2 THR 94 HG22 THR 94 231.166 15.715 -1.472 727 3HG2 THR 94 HG23 THR 94 230.351 15.802 -3.033 728 HA PRO 95 HA PRO 95 234.561 12.009 0.444 729 1HB PRO 95 HB2 PRO 95 234.688 14.768 1.452 730 2HB PRO 95 HB1 PRO 95 236.001 13.709 0.932 731 1HG PRO 95 HG2 PRO 95 235.252 15.845 -0.504 732 2HG PRO 95 HG1 PRO 95 235.829 14.351 -1.267 733 1HD PRO 95 HD2 PRO 95 233.020 15.330 -0.901 734 2HD PRO 95 HD1 PRO 95 233.775 14.591 -2.330 735 H VAL 96 HN VAL 96 232.137 11.396 0.739 736 HA VAL 96 HA VAL 96 230.692 12.840 2.751 737 HB VAL 96 HB VAL 96 230.162 9.963 2.062 738 1HG1 VAL 96 HG11 VAL 96 227.767 11.012 2.221 739 2HG1 VAL 96 HG12 VAL 96 228.607 12.268 3.131 740 3HG1 VAL 96 HG13 VAL 96 228.666 10.593 3.679 741 1HG2 VAL 96 HG21 VAL 96 228.576 11.189 0.299 742 2HG2 VAL 96 HG22 VAL 96 230.198 10.629 -0.106 743 3HG2 VAL 96 HG23 VAL 96 229.924 12.325 0.292 744 H GLU 97 HN GLU 97 232.888 12.712 3.999 745 HA GLU 97 HA GLU 97 233.819 10.541 5.370 746 1HB GLU 97 HB2 GLU 97 234.530 12.075 7.130 747 2HB GLU 97 HB1 GLU 97 234.783 12.796 5.546 748 1HG GLU 97 HG2 GLU 97 232.304 13.708 6.136 749 2HG GLU 97 HG1 GLU 97 233.028 13.622 7.741 750 H SER 98 HN SER 98 232.743 9.020 6.442 751 HA SER 98 HA SER 98 230.229 9.634 7.756 752 1HB SER 98 HB2 SER 98 230.380 7.581 6.435 753 2HB SER 98 HB1 SER 98 231.713 7.013 7.441 754 HG SER 98 HG SER 98 228.987 7.269 8.072 755 H ASP 99 HN ASP 99 230.040 8.141 9.912 756 HA ASP 99 HA ASP 99 231.553 9.541 11.855 757 1HB ASP 99 HB2 ASP 99 229.859 7.058 12.194 758 2HB ASP 99 HB1 ASP 99 230.408 8.118 13.489 759 H GLU 100 HN GLU 100 232.313 6.815 9.993 760 HA GLU 100 HA GLU 100 234.310 5.935 11.969 761 1HB GLU 100 HB2 GLU 100 232.478 4.471 10.356 762 2HB GLU 100 HB1 GLU 100 234.103 4.086 9.807 763 1HG GLU 100 HG2 GLU 100 234.743 3.414 12.031 764 2HG GLU 100 HG1 GLU 100 233.174 3.911 12.664 765 H MET 101 HN MET 101 233.843 7.174 8.748 766 HA MET 101 HA MET 101 236.762 7.083 8.348 767 1HB MET 101 HB2 MET 101 234.576 6.307 6.600 768 2HB MET 101 HB1 MET 101 235.627 7.494 5.839 769 1HG MET 101 HG2 MET 101 236.785 5.097 7.192 770 2HG MET 101 HG1 MET 101 236.135 4.979 5.559 771 1HE MET 101 HE1 MET 101 238.976 6.419 7.842 772 2HE MET 101 HE2 MET 101 240.255 6.151 6.659 773 3HE MET 101 HE3 MET 101 239.205 4.818 7.140 774 H ARG 102 HN ARG 102 237.666 8.850 7.064 775 HA ARG 102 HA ARG 102 236.216 11.246 6.596 776 1HB ARG 102 HB2 ARG 102 236.391 11.209 9.126 777 2HB ARG 102 HB1 ARG 102 238.132 11.351 8.934 778 1HG ARG 102 HG2 ARG 102 236.583 13.354 7.459 779 2HG ARG 102 HG1 ARG 102 236.420 13.438 9.214 780 1HD ARG 102 HD2 ARG 102 239.150 13.118 8.093 781 2HD ARG 102 HD1 ARG 102 238.369 14.686 7.902 782 HE ARG 102 HE ARG 102 239.499 13.643 10.275 783 1HH1 ARG 102 HH11 ARG 102 236.789 15.523 9.134 784 2HH1 ARG 102 HH12 ARG 102 236.606 16.393 10.620 785 1HH2 ARG 102 HH21 ARG 102 239.260 14.787 12.230 786 2HH2 ARG 102 HH22 ARG 102 238.009 15.975 12.378 787 HA PRO 103 HA PRO 103 240.150 10.914 4.280 788 1HB PRO 103 HB2 PRO 103 239.234 11.882 1.952 789 2HB PRO 103 HB1 PRO 103 238.912 10.218 2.456 790 1HG PRO 103 HG2 PRO 103 237.145 12.633 2.660 791 2HG PRO 103 HG1 PRO 103 236.741 11.001 2.093 792 1HD PRO 103 HD2 PRO 103 236.176 11.859 4.607 793 2HD PRO 103 HD1 PRO 103 236.554 10.165 4.238 794 H CYS 104 HN CYS 104 241.590 12.487 3.450 795 HA CYS 104 HA CYS 104 240.801 15.288 3.686 796 1HB CYS 104 HB2 CYS 104 242.262 13.986 5.703 797 2HB CYS 104 HB1 CYS 104 243.440 14.945 4.813 798 HG CYS 104 HG CYS 104 241.448 16.027 6.761 799 H TRP 105 HN TRP 105 241.624 16.496 2.105 800 HA TRP 105 HA TRP 105 243.502 15.237 0.260 801 1HB TRP 105 HB2 TRP 105 241.907 17.788 -0.066 802 2HB TRP 105 HB1 TRP 105 242.811 16.954 -1.325 803 HD1 TRP 105 HD1 TRP 105 240.156 15.596 1.187 804 HE1 TRP 105 HE1 TRP 105 238.362 14.339 -0.163 805 HE3 TRP 105 HE3 TRP 105 241.956 16.440 -3.525 806 HZ2 TRP 105 HZ2 TRP 105 237.785 13.788 -2.871 807 HZ3 TRP 105 HZ3 TRP 105 240.719 15.515 -5.440 808 HH2 TRP 105 HH2 TRP 105 238.679 14.215 -5.118 809 H PHE 106 HN PHE 106 245.593 15.731 0.281 810 HA PHE 106 HA PHE 106 246.419 18.393 1.219 811 1HB PHE 106 HB2 PHE 106 247.746 15.782 1.984 812 2HB PHE 106 HB1 PHE 106 248.302 17.389 2.437 813 HD1 PHE 106 HD1 PHE 106 247.179 14.750 3.970 814 HD2 PHE 106 HD2 PHE 106 245.800 18.703 3.205 815 HE1 PHE 106 HE1 PHE 106 245.797 14.658 6.003 816 HE2 PHE 106 HE2 PHE 106 244.415 18.618 5.237 817 HZ PHE 106 HZ PHE 106 244.414 16.593 6.639 818 H GLN 107 HN GLN 107 249.167 18.045 0.932 819 HA GLN 107 HA GLN 107 249.386 18.066 -1.962 820 1HB GLN 107 HB2 GLN 107 251.587 18.597 0.029 821 2HB GLN 107 HB1 GLN 107 251.506 19.108 -1.651 822 1HG GLN 107 HG2 GLN 107 249.372 20.385 -0.854 823 2HG GLN 107 HG1 GLN 107 250.114 20.214 0.736 824 1HE2 GLN 107 HE21 GLN 107 249.749 22.308 -1.663 825 2HE2 GLN 107 HE22 GLN 107 251.228 23.193 -1.556 826 H LEU 108 HN LEU 108 251.296 17.027 -2.987 827 HA LEU 108 HA LEU 108 251.477 14.266 -2.093 828 1HB LEU 108 HB2 LEU 108 252.160 13.730 -4.254 829 2HB LEU 108 HB1 LEU 108 251.042 15.056 -4.505 830 HG LEU 108 HG LEU 108 254.046 15.349 -4.468 831 1HD1 LEU 108 HD11 LEU 108 253.818 14.231 -6.430 832 2HD1 LEU 108 HD12 LEU 108 253.410 15.850 -6.996 833 3HD1 LEU 108 HD13 LEU 108 252.128 14.696 -6.629 834 1HD2 LEU 108 HD21 LEU 108 253.300 17.508 -5.707 835 2HD2 LEU 108 HD22 LEU 108 253.223 17.443 -3.947 836 3HD2 LEU 108 HD23 LEU 108 251.760 17.218 -4.902 837 H ASP 109 HN ASP 109 253.054 16.825 -1.094 838 HA ASP 109 HA ASP 109 255.627 15.410 -0.932 839 1HB ASP 109 HB2 ASP 109 256.672 17.717 -0.759 840 2HB ASP 109 HB1 ASP 109 256.045 17.281 -2.346 841 H GLN 110 HN GLN 110 253.215 15.495 0.825 842 HA GLN 110 HA GLN 110 254.638 15.944 3.290 843 1HB GLN 110 HB2 GLN 110 252.136 17.523 2.679 844 2HB GLN 110 HB1 GLN 110 252.943 17.460 4.240 845 1HG GLN 110 HG2 GLN 110 254.987 18.377 3.079 846 2HG GLN 110 HG1 GLN 110 253.949 18.673 1.685 847 1HE2 GLN 110 HE21 GLN 110 253.963 19.221 5.193 848 2HE2 GLN 110 HE22 GLN 110 253.336 20.829 5.116 849 H ILE 111 HN ILE 111 253.217 13.748 1.779 850 HA ILE 111 HA ILE 111 250.891 13.119 3.337 851 HB ILE 111 HB ILE 111 252.116 10.739 2.248 852 1HG1 ILE 111 HG12 ILE 111 251.570 11.551 -0.189 853 2HG1 ILE 111 HG11 ILE 111 251.988 13.134 0.464 854 1HG2 ILE 111 HG21 ILE 111 249.649 11.527 2.814 855 2HG2 ILE 111 HG22 ILE 111 250.014 10.236 1.667 856 3HG2 ILE 111 HG23 ILE 111 249.658 11.862 1.082 857 1HD1 ILE 111 HD11 ILE 111 253.961 12.283 -0.475 858 2HD1 ILE 111 HD12 ILE 111 253.707 10.690 0.240 859 3HD1 ILE 111 HD13 ILE 111 254.138 12.058 1.265 860 HA PRO 112 HA PRO 112 253.273 11.348 6.661 861 1HB PRO 112 HB2 PRO 112 251.341 11.251 8.481 862 2HB PRO 112 HB1 PRO 112 251.929 12.811 7.892 863 1HG PRO 112 HG2 PRO 112 249.420 11.352 7.206 864 2HG PRO 112 HG1 PRO 112 249.698 13.095 7.371 865 1HD PRO 112 HD2 PRO 112 249.649 11.612 4.969 866 2HD PRO 112 HD1 PRO 112 250.195 13.289 5.169 867 H PHE 113 HN PHE 113 253.790 9.302 5.919 868 HA PHE 113 HA PHE 113 251.793 7.245 5.785 869 1HB PHE 113 HB2 PHE 113 254.598 6.373 5.846 870 2HB PHE 113 HB1 PHE 113 253.313 5.963 4.730 871 HD1 PHE 113 HD1 PHE 113 252.753 8.961 3.947 872 HD2 PHE 113 HD2 PHE 113 256.246 6.538 4.207 873 HE1 PHE 113 HE1 PHE 113 253.851 10.333 2.227 874 HE2 PHE 113 HE2 PHE 113 257.337 7.896 2.490 875 HZ PHE 113 HZ PHE 113 256.143 9.813 1.496 876 H LYS 114 HN LYS 114 253.783 8.518 8.243 877 HA LYS 114 HA LYS 114 254.063 6.177 9.827 878 1HB LYS 114 HB2 LYS 114 254.391 9.119 10.318 879 2HB LYS 114 HB1 LYS 114 254.402 7.999 11.673 880 1HG LYS 114 HG2 LYS 114 256.147 7.182 9.484 881 2HG LYS 114 HG1 LYS 114 256.578 8.741 10.191 882 1HD LYS 114 HD2 LYS 114 255.927 6.620 12.124 883 2HD LYS 114 HD1 LYS 114 257.382 6.343 11.165 884 1HE LYS 114 HE2 LYS 114 256.790 8.825 12.773 885 2HE LYS 114 HE1 LYS 114 257.862 7.518 13.273 886 1HZ LYS 114 HZ1 LYS 114 259.256 9.140 12.375 887 2HZ LYS 114 HZ2 LYS 114 258.233 9.447 11.063 888 3HZ LYS 114 HZ3 LYS 114 259.108 8.000 11.132 889 H ASP 115 HN ASP 115 251.535 8.432 9.254 890 HA ASP 115 HA ASP 115 250.089 7.573 11.628 891 1HB ASP 115 HB2 ASP 115 249.831 9.860 9.735 892 2HB ASP 115 HB1 ASP 115 248.381 9.306 10.567 893 H MET 116 HN MET 116 250.610 5.890 9.195 894 HA MET 116 HA MET 116 247.801 5.192 8.660 895 1HB MET 116 HB2 MET 116 249.803 4.588 6.548 896 2HB MET 116 HB1 MET 116 248.103 5.000 6.399 897 1HG MET 116 HG2 MET 116 248.874 7.355 7.165 898 2HG MET 116 HG1 MET 116 250.464 6.793 6.672 899 1HE MET 116 HE1 MET 116 251.051 5.857 4.599 900 2HE MET 116 HE2 MET 116 251.088 7.362 3.683 901 3HE MET 116 HE3 MET 116 250.203 5.971 3.058 902 H TRP 117 HN TRP 117 250.956 3.746 7.824 903 HA TRP 117 HA TRP 117 250.533 1.551 9.635 904 1HB TRP 117 HB2 TRP 117 249.710 1.350 6.850 905 2HB TRP 117 HB1 TRP 117 250.906 0.130 7.268 906 HD1 TRP 117 HD1 TRP 117 249.626 0.005 10.399 907 HE1 TRP 117 HE1 TRP 117 247.530 -1.457 10.688 908 HE3 TRP 117 HE3 TRP 117 248.120 -0.233 5.518 909 HZ2 TRP 117 HZ2 TRP 117 245.505 -2.565 9.065 910 HZ3 TRP 117 HZ3 TRP 117 246.093 -1.515 4.972 911 HH2 TRP 117 HH2 TRP 117 244.814 -2.657 6.709 912 HA PRO 118 HA PRO 118 254.910 1.145 9.157 913 1HB PRO 118 HB2 PRO 118 255.378 -1.405 9.736 914 2HB PRO 118 HB1 PRO 118 254.631 -0.330 10.921 915 1HG PRO 118 HG2 PRO 118 253.361 -2.393 9.172 916 2HG PRO 118 HG1 PRO 118 253.019 -1.994 10.862 917 1HD PRO 118 HD2 PRO 118 251.561 -1.098 8.675 918 2HD PRO 118 HD1 PRO 118 251.553 -0.358 10.286 919 H ASP 119 HN ASP 119 253.157 0.347 6.633 920 HA ASP 119 HA ASP 119 255.424 -0.855 5.192 921 1HB ASP 119 HB2 ASP 119 253.706 -1.950 3.704 922 2HB ASP 119 HB1 ASP 119 253.781 -2.579 5.348 923 H ASP 120 HN ASP 120 252.947 1.549 5.297 924 HA ASP 120 HA ASP 120 252.571 2.372 2.738 925 1HB ASP 120 HB2 ASP 120 253.010 4.103 5.164 926 2HB ASP 120 HB1 ASP 120 252.332 4.672 3.641 927 H SER 121 HN SER 121 255.225 3.591 4.789 928 HA SER 121 HA SER 121 256.486 5.164 2.872 929 1HB SER 121 HB2 SER 121 258.342 5.236 4.332 930 2HB SER 121 HB1 SER 121 256.947 5.000 5.385 931 HG SER 121 HG SER 121 258.857 3.608 5.739 932 H TYR 122 HN TYR 122 256.366 1.720 3.037 933 HA TYR 122 HA TYR 122 258.810 1.337 1.558 934 1HB TYR 122 HB2 TYR 122 256.739 -0.481 2.714 935 2HB TYR 122 HB1 TYR 122 257.839 -1.094 1.486 936 HD1 TYR 122 HD1 TYR 122 257.383 -1.334 4.763 937 HD2 TYR 122 HD2 TYR 122 260.375 0.118 2.111 938 HE1 TYR 122 HE1 TYR 122 259.091 -1.716 6.490 939 HE2 TYR 122 HE2 TYR 122 262.091 -0.259 3.830 940 HH TYR 122 HH TYR 122 261.478 -2.055 6.677 941 H TRP 123 HN TRP 123 255.383 1.570 0.819 942 HA TRP 123 HA TRP 123 256.055 0.860 -1.949 943 1HB TRP 123 HB2 TRP 123 253.715 0.230 -2.285 944 2HB TRP 123 HB1 TRP 123 254.456 -0.690 -0.983 945 HD1 TRP 123 HD1 TRP 123 253.577 -0.218 1.508 946 HE1 TRP 123 HE1 TRP 123 251.385 0.810 2.378 947 HE3 TRP 123 HE3 TRP 123 251.955 2.012 -2.799 948 HZ2 TRP 123 HZ2 TRP 123 249.248 2.372 1.373 949 HZ3 TRP 123 HZ3 TRP 123 249.823 3.241 -2.753 950 HH2 TRP 123 HH2 TRP 123 248.503 3.408 -0.717 951 H PHE 124 HN PHE 124 255.184 3.499 -0.039 952 HA PHE 124 HA PHE 124 253.618 4.871 -2.003 953 1HB PHE 124 HB2 PHE 124 253.975 5.206 0.678 954 2HB PHE 124 HB1 PHE 124 254.966 6.510 0.038 955 HD1 PHE 124 HD1 PHE 124 251.920 5.324 -1.669 956 HD2 PHE 124 HD2 PHE 124 253.592 8.260 0.914 957 HE1 PHE 124 HE1 PHE 124 249.915 6.715 -1.947 958 HE2 PHE 124 HE2 PHE 124 251.598 9.643 0.650 959 HZ PHE 124 HZ PHE 124 249.748 8.878 -0.784 960 HA PRO 125 HA PRO 125 257.908 7.360 -2.402 961 1HB PRO 125 HB2 PRO 125 259.561 4.881 -2.231 962 2HB PRO 125 HB1 PRO 125 259.956 6.534 -1.743 963 1HG PRO 125 HG2 PRO 125 259.319 4.707 0.077 964 2HG PRO 125 HG1 PRO 125 258.755 6.379 0.234 965 1HD PRO 125 HD2 PRO 125 257.248 3.940 -0.579 966 2HD PRO 125 HD1 PRO 125 256.693 5.361 0.327 967 H LEU 126 HN LEU 126 257.431 4.027 -3.559 968 HA LEU 126 HA LEU 126 258.598 4.615 -6.120 969 1HB LEU 126 HB2 LEU 126 257.630 2.355 -6.740 970 2HB LEU 126 HB1 LEU 126 258.846 2.379 -5.478 971 HG LEU 126 HG LEU 126 256.334 2.593 -4.193 972 1HD1 LEU 126 HD11 LEU 126 256.398 0.264 -6.098 973 2HD1 LEU 126 HD12 LEU 126 255.424 1.714 -6.347 974 3HD1 LEU 126 HD13 LEU 126 255.128 0.681 -4.948 975 1HD2 LEU 126 HD21 LEU 126 257.039 0.196 -3.498 976 2HD2 LEU 126 HD22 LEU 126 258.050 1.563 -3.030 977 3HD2 LEU 126 HD23 LEU 126 258.510 0.554 -4.400 978 H LEU 127 HN LEU 127 255.397 4.546 -4.720 979 HA LEU 127 HA LEU 127 253.837 4.566 -7.041 980 1HB LEU 127 HB2 LEU 127 253.402 5.951 -4.393 981 2HB LEU 127 HB1 LEU 127 252.189 5.850 -5.649 982 HG LEU 127 HG LEU 127 252.834 3.975 -3.586 983 1HD1 LEU 127 HD11 LEU 127 250.711 2.936 -4.458 984 2HD1 LEU 127 HD12 LEU 127 250.700 4.200 -5.687 985 3HD1 LEU 127 HD13 LEU 127 250.601 4.630 -3.980 986 1HD2 LEU 127 HD21 LEU 127 252.765 1.912 -4.933 987 2HD2 LEU 127 HD22 LEU 127 254.236 2.842 -5.201 988 3HD2 LEU 127 HD23 LEU 127 252.940 2.882 -6.395 989 H LEU 128 HN LEU 128 255.143 7.216 -5.115 990 HA LEU 128 HA LEU 128 254.291 9.364 -6.671 991 1HB LEU 128 HB2 LEU 128 256.423 8.902 -4.662 992 2HB LEU 128 HB1 LEU 128 256.587 10.331 -5.665 993 HG LEU 128 HG LEU 128 253.959 9.874 -4.354 994 1HD1 LEU 128 HD11 LEU 128 255.505 9.368 -2.555 995 2HD1 LEU 128 HD12 LEU 128 254.747 10.938 -2.289 996 3HD1 LEU 128 HD13 LEU 128 256.404 10.849 -2.885 997 1HD2 LEU 128 HD21 LEU 128 253.846 12.228 -4.362 998 2HD2 LEU 128 HD22 LEU 128 254.549 11.783 -5.916 999 3HD2 LEU 128 HD23 LEU 128 255.582 12.390 -4.622 1000 H GLN 129 HN GLN 129 256.998 7.194 -7.080 1001 HA GLN 129 HA GLN 129 258.239 8.805 -9.131 1002 1HB GLN 129 HB2 GLN 129 258.868 6.298 -7.700 1003 2HB GLN 129 HB1 GLN 129 259.470 6.404 -9.349 1004 1HG GLN 129 HG2 GLN 129 260.273 8.783 -8.497 1005 2HG GLN 129 HG1 GLN 129 260.233 7.951 -6.943 1006 1HE2 GLN 129 HE21 GLN 129 261.782 8.209 -10.018 1007 2HE2 GLN 129 HE22 GLN 129 263.110 7.157 -9.677 1008 H LYS 130 HN LYS 130 255.592 6.774 -9.073 1009 HA LYS 130 HA LYS 130 254.280 5.894 -10.707 1010 1HB LYS 130 HB2 LYS 130 256.160 7.110 -12.727 1011 2HB LYS 130 HB1 LYS 130 254.463 6.700 -12.942 1012 1HG LYS 130 HG2 LYS 130 253.785 8.667 -12.158 1013 2HG LYS 130 HG1 LYS 130 254.876 8.585 -10.773 1014 1HD LYS 130 HD2 LYS 130 256.052 9.136 -13.448 1015 2HD LYS 130 HD1 LYS 130 255.142 10.428 -12.661 1016 1HE LYS 130 HE2 LYS 130 256.681 9.573 -10.607 1017 2HE LYS 130 HE1 LYS 130 257.752 9.250 -11.972 1018 1HZ LYS 130 HZ1 LYS 130 257.617 11.599 -10.755 1019 2HZ LYS 130 HZ2 LYS 130 256.442 11.848 -11.946 1020 3HZ LYS 130 HZ3 LYS 130 258.022 11.435 -12.390 1021 H LYS 131 HN LYS 131 256.207 4.264 -9.586 1022 HA LYS 131 HA LYS 131 256.977 2.567 -11.872 1023 1HB LYS 131 HB2 LYS 131 258.421 2.842 -9.229 1024 2HB LYS 131 HB1 LYS 131 258.879 1.766 -10.542 1025 1HG LYS 131 HG2 LYS 131 259.106 3.844 -11.974 1026 2HG LYS 131 HG1 LYS 131 258.984 4.764 -10.474 1027 1HD LYS 131 HD2 LYS 131 261.237 4.543 -10.499 1028 2HD LYS 131 HD1 LYS 131 260.864 2.984 -9.761 1029 1HE LYS 131 HE2 LYS 131 261.000 1.887 -11.905 1030 2HE LYS 131 HE1 LYS 131 261.222 3.435 -12.721 1031 1HZ LYS 131 HZ1 LYS 131 263.110 2.510 -10.645 1032 2HZ LYS 131 HZ2 LYS 131 263.352 3.670 -11.852 1033 3HZ LYS 131 HZ3 LYS 131 263.277 2.031 -12.260 1034 H LYS 132 HN LYS 132 257.026 0.248 -11.414 1035 HA LYS 132 HA LYS 132 254.926 -0.473 -9.492 1036 1HB LYS 132 HB2 LYS 132 255.887 -1.772 -12.033 1037 2HB LYS 132 HB1 LYS 132 254.882 -2.634 -10.876 1038 1HG LYS 132 HG2 LYS 132 253.022 -1.481 -11.421 1039 2HG LYS 132 HG1 LYS 132 253.905 0.017 -11.719 1040 1HD LYS 132 HD2 LYS 132 254.215 -0.449 -13.907 1041 2HD LYS 132 HD1 LYS 132 254.451 -2.173 -13.611 1042 1HE LYS 132 HE2 LYS 132 252.265 -2.654 -13.897 1043 2HE LYS 132 HE1 LYS 132 251.729 -1.162 -13.127 1044 1HZ LYS 132 HZ1 LYS 132 253.029 -0.899 -15.720 1045 2HZ LYS 132 HZ2 LYS 132 251.712 -0.054 -15.078 1046 3HZ LYS 132 HZ3 LYS 132 251.490 -1.604 -15.718 1047 H PHE 133 HN PHE 133 255.279 -1.931 -7.888 1048 HA PHE 133 HA PHE 133 257.725 -3.498 -7.871 1049 1HB PHE 133 HB2 PHE 133 258.836 -2.388 -6.255 1050 2HB PHE 133 HB1 PHE 133 257.790 -1.036 -6.669 1051 HD1 PHE 133 HD1 PHE 133 259.144 -2.589 -4.001 1052 HD2 PHE 133 HD2 PHE 133 255.301 -1.473 -5.450 1053 HE1 PHE 133 HE1 PHE 133 258.284 -2.570 -1.697 1054 HE2 PHE 133 HE2 PHE 133 254.435 -1.452 -3.147 1055 HZ PHE 133 HZ PHE 133 255.928 -2.001 -1.267 1056 H HIS 134 HN HIS 134 257.843 -4.833 -5.814 1057 HA HIS 134 HA HIS 134 255.177 -5.607 -4.845 1058 1HB HIS 134 HB2 HIS 134 257.231 -7.288 -6.204 1059 2HB HIS 134 HB1 HIS 134 256.380 -8.005 -4.842 1060 HD1 HIS 134 HD1 HIS 134 254.979 -5.794 -7.601 1061 HD2 HIS 134 HD2 HIS 134 254.576 -9.628 -6.051 1062 HE1 HIS 134 HE1 HIS 134 253.070 -6.833 -8.865 1063 HE2 HIS 134 HE2 HIS 134 252.903 -9.182 -7.972 1064 H GLY 135 HN GLY 135 255.131 -5.607 -2.655 1065 1HA GLY 135 HA2 GLY 135 257.721 -5.915 -1.270 1066 2HA GLY 135 HA1 GLY 135 256.526 -4.734 -0.767 1067 H TYR 136 HN TYR 136 257.854 -7.484 0.145 1068 HA TYR 136 HA TYR 136 255.376 -8.667 1.200 1069 1HB TYR 136 HB2 TYR 136 258.118 -9.821 0.703 1070 2HB TYR 136 HB1 TYR 136 256.935 -10.637 1.718 1071 HD1 TYR 136 HD1 TYR 136 256.056 -12.457 0.614 1072 HD2 TYR 136 HD2 TYR 136 256.711 -8.866 -1.573 1073 HE1 TYR 136 HE1 TYR 136 255.066 -13.497 -1.383 1074 HE2 TYR 136 HE2 TYR 136 255.721 -9.896 -3.573 1075 HH TYR 136 HH TYR 136 255.346 -12.177 -4.475 1076 H PHE 137 HN PHE 137 254.923 -8.058 3.222 1077 HA PHE 137 HA PHE 137 257.168 -7.479 5.045 1078 1HB PHE 137 HB2 PHE 137 254.367 -6.372 5.252 1079 2HB PHE 137 HB1 PHE 137 255.789 -5.867 6.158 1080 HD1 PHE 137 HD1 PHE 137 257.826 -5.162 4.542 1081 HD2 PHE 137 HD2 PHE 137 253.691 -4.996 3.558 1082 HE1 PHE 137 HE1 PHE 137 258.305 -3.453 2.838 1083 HE2 PHE 137 HE2 PHE 137 254.161 -3.286 1.853 1084 HZ PHE 137 HZ PHE 137 256.470 -2.513 1.491 1085 H LYS 138 HN LYS 138 257.408 -8.841 6.693 1086 HA LYS 138 HA LYS 138 255.296 -10.707 7.403 1087 1HB LYS 138 HB2 LYS 138 258.013 -10.973 7.240 1088 2HB LYS 138 HB1 LYS 138 257.792 -10.730 8.967 1089 1HG LYS 138 HG2 LYS 138 255.857 -12.573 8.386 1090 2HG LYS 138 HG1 LYS 138 257.165 -13.037 7.297 1091 1HD LYS 138 HD2 LYS 138 258.574 -13.591 9.008 1092 2HD LYS 138 HD1 LYS 138 257.864 -12.416 10.117 1093 1HE LYS 138 HE2 LYS 138 256.109 -13.821 10.685 1094 2HE LYS 138 HE1 LYS 138 256.281 -14.790 9.221 1095 1HZ LYS 138 HZ1 LYS 138 257.106 -16.099 10.966 1096 2HZ LYS 138 HZ2 LYS 138 257.991 -14.824 11.637 1097 3HZ LYS 138 HZ3 LYS 138 258.482 -15.516 10.174 1098 H PHE 139 HN PHE 139 254.105 -10.579 9.278 1099 HA PHE 139 HA PHE 139 254.801 -8.361 11.093 1100 1HB PHE 139 HB2 PHE 139 252.309 -8.308 11.601 1101 2HB PHE 139 HB1 PHE 139 252.807 -7.710 10.025 1102 HD1 PHE 139 HD1 PHE 139 252.725 -9.527 8.104 1103 HD2 PHE 139 HD2 PHE 139 250.529 -9.704 11.744 1104 HE1 PHE 139 HE1 PHE 139 251.081 -11.018 7.042 1105 HE2 PHE 139 HE2 PHE 139 248.886 -11.197 10.686 1106 HZ PHE 139 HZ PHE 139 249.162 -11.853 8.330 1107 H GLN 140 HN GLN 140 253.923 -8.556 13.299 1108 HA GLN 140 HA GLN 140 254.307 -11.277 14.325 1109 1HB GLN 140 HB2 GLN 140 254.441 -8.555 15.616 1110 2HB GLN 140 HB1 GLN 140 254.449 -10.041 16.553 1111 1HG GLN 140 HG2 GLN 140 256.450 -10.718 15.132 1112 2HG GLN 140 HG1 GLN 140 256.512 -9.028 14.634 1113 1HE2 GLN 140 HE21 GLN 140 257.640 -11.234 16.810 1114 2HE2 GLN 140 HE22 GLN 140 258.168 -10.161 18.057 1115 H GLY 141 HN GLY 141 251.998 -8.696 14.080 1116 1HA GLY 141 HA2 GLY 141 249.877 -10.454 15.028 1117 2HA GLY 141 HA1 GLY 141 250.132 -8.982 15.950 1118 H GLN 142 HN GLN 142 250.269 -6.958 14.534 1119 HA GLN 142 HA GLN 142 248.960 -6.903 12.030 1120 1HB GLN 142 HB2 GLN 142 247.289 -6.639 14.464 1121 2HB GLN 142 HB1 GLN 142 246.983 -5.480 13.177 1122 1HG GLN 142 HG2 GLN 142 247.082 -7.821 11.794 1123 2HG GLN 142 HG1 GLN 142 246.377 -8.335 13.326 1124 1HE2 GLN 142 HE21 GLN 142 245.390 -7.829 10.458 1125 2HE2 GLN 142 HE22 GLN 142 243.934 -6.929 10.695 1126 H ASP 143 HN ASP 143 251.222 -5.735 13.623 1127 HA ASP 143 HA ASP 143 251.036 -3.081 12.550 1128 1HB ASP 143 HB2 ASP 143 250.995 -3.525 15.526 1129 2HB ASP 143 HB1 ASP 143 251.618 -2.036 14.820 1130 H THR 144 HN THR 144 252.822 -5.351 14.603 1131 HA THR 144 HA THR 144 255.330 -4.006 14.119 1132 HB THR 144 HB THR 144 254.651 -6.593 15.515 1133 HG1 THR 144 HG1 THR 144 254.191 -4.475 16.501 1134 1HG2 THR 144 HG21 THR 144 257.281 -5.458 14.783 1135 2HG2 THR 144 HG22 THR 144 256.783 -7.136 14.994 1136 3HG2 THR 144 HG23 THR 144 257.099 -6.125 16.405 1137 H ILE 145 HN ILE 145 256.830 -4.491 12.638 1138 HA ILE 145 HA ILE 145 256.270 -6.790 10.907 1139 HB ILE 145 HB ILE 145 257.870 -4.335 10.190 1140 1HG1 ILE 145 HG12 ILE 145 255.078 -5.145 9.344 1141 2HG1 ILE 145 HG11 ILE 145 255.462 -3.852 10.477 1142 1HG2 ILE 145 HG21 ILE 145 258.512 -6.453 9.052 1143 2HG2 ILE 145 HG22 ILE 145 257.900 -5.218 7.954 1144 3HG2 ILE 145 HG23 ILE 145 256.868 -6.567 8.426 1145 1HD1 ILE 145 HD11 ILE 145 256.304 -3.930 7.591 1146 2HD1 ILE 145 HD12 ILE 145 256.574 -2.611 8.731 1147 3HD1 ILE 145 HD13 ILE 145 254.933 -3.025 8.233 1148 H LEU 146 HN LEU 146 257.789 -8.296 10.543 1149 HA LEU 146 HA LEU 146 260.324 -8.001 12.011 1150 1HB LEU 146 HB2 LEU 146 259.095 -10.613 11.183 1151 2HB LEU 146 HB1 LEU 146 260.330 -10.327 12.395 1152 HG LEU 146 HG LEU 146 257.745 -9.012 12.924 1153 1HD1 LEU 146 HD11 LEU 146 257.487 -11.513 11.941 1154 2HD1 LEU 146 HD12 LEU 146 256.410 -10.801 13.140 1155 3HD1 LEU 146 HD13 LEU 146 257.726 -11.856 13.654 1156 1HD2 LEU 146 HD21 LEU 146 258.862 -8.854 14.845 1157 2HD2 LEU 146 HD22 LEU 146 260.047 -10.060 14.344 1158 3HD2 LEU 146 HD23 LEU 146 258.527 -10.570 15.077 1159 H ASP 147 HN ASP 147 258.910 -8.357 8.933 1160 HA ASP 147 HA ASP 147 261.539 -8.515 7.717 1161 1HB ASP 147 HB2 ASP 147 259.952 -10.815 7.951 1162 2HB ASP 147 HB1 ASP 147 259.738 -10.282 6.287 1163 H TYR 148 HN TYR 148 261.673 -7.291 5.898 1164 HA TYR 148 HA TYR 148 259.186 -6.595 4.529 1165 1HB TYR 148 HB2 TYR 148 259.658 -4.241 4.518 1166 2HB TYR 148 HB1 TYR 148 259.668 -4.808 6.184 1167 HD1 TYR 148 HD1 TYR 148 261.807 -5.019 7.408 1168 HD2 TYR 148 HD2 TYR 148 261.635 -3.350 3.498 1169 HE1 TYR 148 HE1 TYR 148 264.046 -4.053 7.728 1170 HE2 TYR 148 HE2 TYR 148 263.873 -2.381 3.807 1171 HH TYR 148 HH TYR 148 265.954 -3.299 6.258 1172 H THR 149 HN THR 149 259.428 -7.105 2.466 1173 HA THR 149 HA THR 149 262.101 -6.792 1.267 1174 HB THR 149 HB THR 149 260.575 -8.489 -0.368 1175 HG1 THR 149 HG1 THR 149 260.042 -10.142 1.140 1176 1HG2 THR 149 HG21 THR 149 262.598 -9.373 -0.403 1177 2HG2 THR 149 HG22 THR 149 262.206 -10.148 1.132 1178 3HG2 THR 149 HG23 THR 149 263.038 -8.593 1.116 1179 H LEU 150 HN LEU 150 262.274 -5.919 -0.761 1180 HA LEU 150 HA LEU 150 259.853 -4.797 -1.971 1181 1HB LEU 150 HB2 LEU 150 262.375 -3.302 -1.284 1182 2HB LEU 150 HB1 LEU 150 261.224 -2.714 -2.470 1183 HG LEU 150 HG LEU 150 259.592 -3.185 -0.333 1184 1HD1 LEU 150 HD11 LEU 150 262.178 -2.115 0.782 1185 2HD1 LEU 150 HD12 LEU 150 261.523 -3.724 1.089 1186 3HD1 LEU 150 HD13 LEU 150 260.652 -2.297 1.647 1187 1HD2 LEU 150 HD21 LEU 150 259.716 -1.177 -1.796 1188 2HD2 LEU 150 HD22 LEU 150 261.080 -0.613 -0.832 1189 3HD2 LEU 150 HD23 LEU 150 259.493 -0.802 -0.087 1190 H ARG 151 HN ARG 151 259.718 -5.320 -4.054 1191 HA ARG 151 HA ARG 151 262.216 -5.753 -5.554 1192 1HB ARG 151 HB2 ARG 151 259.696 -7.415 -5.735 1193 2HB ARG 151 HB1 ARG 151 261.109 -7.597 -6.766 1194 1HG ARG 151 HG2 ARG 151 262.170 -7.768 -4.236 1195 2HG ARG 151 HG1 ARG 151 260.616 -8.589 -4.078 1196 1HD ARG 151 HD2 ARG 151 261.768 -10.369 -4.836 1197 2HD ARG 151 HD1 ARG 151 261.483 -9.631 -6.412 1198 HE ARG 151 HE ARG 151 263.884 -8.716 -5.128 1199 1HH1 ARG 151 HH11 ARG 151 262.495 -11.185 -7.165 1200 2HH1 ARG 151 HH12 ARG 151 264.006 -11.606 -7.898 1201 1HH2 ARG 151 HH21 ARG 151 265.873 -9.269 -6.090 1202 2HH2 ARG 151 HH22 ARG 151 265.925 -10.519 -7.288 1203 H GLU 152 HN GLU 152 262.369 -4.400 -7.212 1204 HA GLU 152 HA GLU 152 259.999 -3.030 -8.182 1205 1HB GLU 152 HB2 GLU 152 261.594 -1.660 -9.472 1206 2HB GLU 152 HB1 GLU 152 261.976 -1.691 -7.757 1207 1HG GLU 152 HG2 GLU 152 263.746 -3.289 -8.142 1208 2HG GLU 152 HG1 GLU 152 263.326 -3.378 -9.852 1209 H VAL 153 HN VAL 153 259.153 -3.178 -10.218 1210 HA VAL 153 HA VAL 153 260.393 -5.080 -12.082 1211 HB VAL 153 HB VAL 153 258.166 -6.012 -12.625 1212 1HG1 VAL 153 HG11 VAL 153 259.268 -6.298 -9.852 1213 2HG1 VAL 153 HG12 VAL 153 259.429 -7.388 -11.228 1214 3HG1 VAL 153 HG13 VAL 153 257.883 -7.248 -10.391 1215 1HG2 VAL 153 HG21 VAL 153 256.828 -4.100 -11.831 1216 2HG2 VAL 153 HG22 VAL 153 257.236 -4.527 -10.169 1217 3HG2 VAL 153 HG23 VAL 153 256.277 -5.632 -11.153 1218 H ASP 154 HN ASP 154 259.094 -5.004 -14.248 1219 HA ASP 154 HA ASP 154 258.558 -3.810 -16.107 1220 1HB ASP 154 HB2 ASP 154 256.700 -3.115 -14.279 1221 2HB ASP 154 HB1 ASP 154 257.419 -1.536 -14.583 1222 H THR 155 HN THR 155 261.118 -3.383 -14.853 1223 HA THR 155 HA THR 155 261.699 -0.560 -15.103 1224 HB THR 155 HB THR 155 263.589 -2.888 -14.706 1225 HG1 THR 155 HG1 THR 155 262.207 -1.238 -12.875 1226 1HG2 THR 155 HG21 THR 155 265.279 -1.456 -14.296 1227 2HG2 THR 155 HG22 THR 155 264.212 -0.191 -13.687 1228 3HG2 THR 155 HG23 THR 155 264.372 -0.449 -15.424 1229 H VAL 156 HN VAL 156 262.520 0.452 -16.835 1230 HA VAL 156 HA VAL 156 262.692 -0.985 -19.326 1231 HB VAL 156 HB VAL 156 263.364 1.915 -18.830 1232 1HG1 VAL 156 HG11 VAL 156 262.529 0.434 -21.322 1233 2HG1 VAL 156 HG12 VAL 156 264.143 1.048 -20.965 1234 3HG1 VAL 156 HG13 VAL 156 262.805 2.171 -21.205 1235 1HG2 VAL 156 HG21 VAL 156 261.057 1.173 -18.052 1236 2HG2 VAL 156 HG22 VAL 156 260.701 0.874 -19.752 1237 3HG2 VAL 156 HG23 VAL 156 261.119 2.500 -19.212 Start of MODEL 15 1 1H MET 1 HT1 MET 1 244.151 -25.854 2.566 2 2H MET 1 HT2 MET 1 242.830 -25.617 3.637 3 3H MET 1 HT3 MET 1 244.045 -24.414 3.490 4 HA MET 1 HA MET 1 243.421 -24.246 1.112 5 1HB MET 1 HB2 MET 1 241.406 -26.163 2.180 6 2HB MET 1 HB1 MET 1 240.857 -24.980 1.001 7 1HG MET 1 HG2 MET 1 242.096 -25.881 -0.692 8 2HG MET 1 HG1 MET 1 243.309 -26.544 0.400 9 1HE MET 1 HE1 MET 1 241.752 -29.478 -1.669 10 2HE MET 1 HE2 MET 1 242.554 -27.929 -1.933 11 3HE MET 1 HE3 MET 1 240.805 -28.060 -2.124 12 H GLY 2 HN GLY 2 242.796 -22.192 0.885 13 1HA GLY 2 HA2 GLY 2 241.395 -20.328 1.166 14 2HA GLY 2 HA1 GLY 2 240.661 -21.115 2.553 15 H ALA 3 HN ALA 3 244.082 -20.465 1.878 16 HA ALA 3 HA ALA 3 244.193 -18.966 4.408 17 1HB ALA 3 HB1 ALA 3 245.574 -21.070 4.144 18 2HB ALA 3 HB2 ALA 3 246.449 -19.624 4.646 19 3HB ALA 3 HB3 ALA 3 246.543 -20.176 2.974 20 H SER 4 HN SER 4 246.581 -17.669 4.115 21 HA SER 4 HA SER 4 247.434 -15.691 3.380 22 1HB SER 4 HB2 SER 4 247.927 -15.521 1.071 23 2HB SER 4 HB1 SER 4 247.915 -17.250 1.419 24 HG SER 4 HG SER 4 245.984 -15.699 0.069 25 H ARG 5 HN ARG 5 245.988 -14.398 4.451 26 HA ARG 5 HA ARG 5 243.467 -13.646 3.464 27 1HB ARG 5 HB2 ARG 5 245.037 -13.081 5.734 28 2HB ARG 5 HB1 ARG 5 244.690 -11.527 4.991 29 1HG ARG 5 HG2 ARG 5 242.834 -11.653 6.246 30 2HG ARG 5 HG1 ARG 5 242.244 -12.631 4.900 31 1HD ARG 5 HD2 ARG 5 242.585 -14.629 6.043 32 2HD ARG 5 HD1 ARG 5 243.716 -13.896 7.181 33 HE ARG 5 HE ARG 5 241.945 -13.321 8.502 34 1HH1 ARG 5 HH11 ARG 5 240.752 -14.056 5.306 35 2HH1 ARG 5 HH12 ARG 5 239.087 -13.954 5.769 36 1HH2 ARG 5 HH21 ARG 5 239.755 -13.186 9.113 37 2HH2 ARG 5 HH22 ARG 5 238.520 -13.460 7.930 38 H LEU 6 HN LEU 6 243.475 -13.025 1.370 39 HA LEU 6 HA LEU 6 245.360 -11.039 0.420 40 1HB LEU 6 HB2 LEU 6 244.325 -13.064 -0.884 41 2HB LEU 6 HB1 LEU 6 242.992 -11.961 -1.163 42 HG LEU 6 HG LEU 6 245.761 -11.054 -1.828 43 1HD1 LEU 6 HD11 LEU 6 245.150 -13.443 -2.754 44 2HD1 LEU 6 HD12 LEU 6 245.942 -12.239 -3.770 45 3HD1 LEU 6 HD13 LEU 6 244.203 -12.501 -3.905 46 1HD2 LEU 6 HD21 LEU 6 244.706 -9.584 -3.259 47 2HD2 LEU 6 HD22 LEU 6 243.527 -9.707 -1.954 48 3HD2 LEU 6 HD23 LEU 6 243.289 -10.615 -3.446 49 H TYR 7 HN TYR 7 245.058 -8.962 0.599 50 HA TYR 7 HA TYR 7 242.321 -7.896 0.766 51 1HB TYR 7 HB2 TYR 7 244.751 -7.323 2.401 52 2HB TYR 7 HB1 TYR 7 243.626 -6.006 2.090 53 HD1 TYR 7 HD1 TYR 7 242.195 -5.613 3.846 54 HD2 TYR 7 HD2 TYR 7 243.304 -9.629 2.983 55 HE1 TYR 7 HE1 TYR 7 240.765 -6.396 5.687 56 HE2 TYR 7 HE2 TYR 7 241.876 -10.424 4.821 57 HH TYR 7 HH TYR 7 239.847 -9.587 6.071 58 H THR 8 HN THR 8 242.561 -5.328 0.503 59 HA THR 8 HA THR 8 244.263 -4.779 -1.840 60 HB THR 8 HB THR 8 242.324 -3.564 -2.830 61 HG1 THR 8 HG1 THR 8 240.247 -4.549 -1.911 62 1HG2 THR 8 HG21 THR 8 240.951 -5.799 -3.216 63 2HG2 THR 8 HG22 THR 8 242.419 -6.498 -2.533 64 3HG2 THR 8 HG23 THR 8 242.509 -5.495 -3.980 65 H LEU 9 HN LEU 9 245.260 -2.881 -1.772 66 HA LEU 9 HA LEU 9 244.361 -0.899 0.223 67 1HB LEU 9 HB2 LEU 9 246.650 -2.110 0.465 68 2HB LEU 9 HB1 LEU 9 247.158 -1.073 -0.854 69 HG LEU 9 HG LEU 9 246.298 -0.260 1.902 70 1HD1 LEU 9 HD11 LEU 9 248.589 -0.887 1.789 71 2HD1 LEU 9 HD12 LEU 9 248.518 0.874 1.848 72 3HD1 LEU 9 HD13 LEU 9 248.829 0.055 0.318 73 1HD2 LEU 9 HD21 LEU 9 246.536 1.398 -0.577 74 2HD2 LEU 9 HD22 LEU 9 246.787 2.089 1.026 75 3HD2 LEU 9 HD23 LEU 9 245.234 1.362 0.612 76 H VAL 10 HN VAL 10 243.299 0.679 -0.884 77 HA VAL 10 HA VAL 10 244.411 1.497 -3.470 78 HB VAL 10 HB VAL 10 242.219 0.834 -3.840 79 1HG1 VAL 10 HG11 VAL 10 241.735 1.849 -1.159 80 2HG1 VAL 10 HG12 VAL 10 241.094 0.425 -1.977 81 3HG1 VAL 10 HG13 VAL 10 240.401 2.013 -2.296 82 1HG2 VAL 10 HG21 VAL 10 241.999 3.796 -3.372 83 2HG2 VAL 10 HG22 VAL 10 240.978 2.828 -4.434 84 3HG2 VAL 10 HG23 VAL 10 242.688 3.041 -4.809 85 H LEU 11 HN LEU 11 245.254 3.378 -3.744 86 HA LEU 11 HA LEU 11 244.704 5.534 -1.823 87 1HB LEU 11 HB2 LEU 11 247.170 4.196 -2.371 88 2HB LEU 11 HB1 LEU 11 247.298 5.841 -2.963 89 HG LEU 11 HG LEU 11 246.835 4.904 -0.140 90 1HD1 LEU 11 HD11 LEU 11 248.699 6.912 -0.110 91 2HD1 LEU 11 HD12 LEU 11 249.033 6.107 -1.644 92 3HD1 LEU 11 HD13 LEU 11 249.055 5.185 -0.142 93 1HD2 LEU 11 HD21 LEU 11 245.275 6.600 -0.169 94 2HD2 LEU 11 HD22 LEU 11 246.162 7.541 -1.368 95 3HD2 LEU 11 HD23 LEU 11 246.740 7.467 0.297 96 H VAL 12 HN VAL 12 243.622 7.044 -2.914 97 HA VAL 12 HA VAL 12 243.832 7.235 -5.776 98 HB VAL 12 HB VAL 12 242.332 9.107 -3.950 99 1HG1 VAL 12 HG11 VAL 12 240.856 8.869 -6.194 100 2HG1 VAL 12 HG12 VAL 12 242.476 8.652 -6.857 101 3HG1 VAL 12 HG13 VAL 12 242.083 10.114 -5.953 102 1HG2 VAL 12 HG21 VAL 12 240.624 7.154 -5.121 103 2HG2 VAL 12 HG22 VAL 12 240.921 7.480 -3.414 104 3HG2 VAL 12 HG23 VAL 12 241.930 6.321 -4.279 105 H LEU 13 HN LEU 13 245.377 8.302 -6.759 106 HA LEU 13 HA LEU 13 246.363 10.821 -5.578 107 1HB LEU 13 HB2 LEU 13 247.909 8.727 -5.529 108 2HB LEU 13 HB1 LEU 13 248.151 9.108 -7.228 109 HG LEU 13 HG LEU 13 248.383 11.445 -5.524 110 1HD1 LEU 13 HD11 LEU 13 249.281 9.336 -4.200 111 2HD1 LEU 13 HD12 LEU 13 250.078 10.908 -4.141 112 3HD1 LEU 13 HD13 LEU 13 250.696 9.645 -5.205 113 1HD2 LEU 13 HD21 LEU 13 249.199 10.699 -7.999 114 2HD2 LEU 13 HD22 LEU 13 250.688 10.544 -7.064 115 3HD2 LEU 13 HD23 LEU 13 249.821 12.079 -7.094 116 H GLN 14 HN GLN 14 247.241 12.325 -7.120 117 HA GLN 14 HA GLN 14 246.291 11.961 -9.879 118 1HB GLN 14 HB2 GLN 14 246.207 14.649 -8.539 119 2HB GLN 14 HB1 GLN 14 245.346 14.105 -9.970 120 1HG GLN 14 HG2 GLN 14 244.355 12.431 -8.071 121 2HG GLN 14 HG1 GLN 14 244.622 13.907 -7.145 122 1HE2 GLN 14 HE21 GLN 14 242.367 12.281 -8.787 123 2HE2 GLN 14 HE22 GLN 14 241.376 13.583 -9.341 124 HA PRO 15 HA PRO 15 250.324 13.195 -11.125 125 1HB PRO 15 HB2 PRO 15 249.843 14.816 -13.274 126 2HB PRO 15 HB1 PRO 15 249.735 13.053 -13.324 127 1HG PRO 15 HG2 PRO 15 247.554 15.077 -13.018 128 2HG PRO 15 HG1 PRO 15 247.583 13.603 -14.004 129 1HD PRO 15 HD2 PRO 15 246.305 13.708 -11.637 130 2HD PRO 15 HD1 PRO 15 247.125 12.235 -12.194 131 H GLN 16 HN GLN 16 248.725 15.054 -9.261 132 HA GLN 16 HA GLN 16 250.730 17.080 -9.114 133 1HB GLN 16 HB2 GLN 16 249.239 19.009 -9.342 134 2HB GLN 16 HB1 GLN 16 249.279 18.070 -10.829 135 1HG GLN 16 HG2 GLN 16 247.162 16.932 -9.900 136 2HG GLN 16 HG1 GLN 16 247.085 18.319 -8.815 137 1HE2 GLN 16 HE21 GLN 16 245.832 19.882 -9.508 138 2HE2 GLN 16 HE22 GLN 16 245.523 20.294 -11.158 139 H ARG 17 HN ARG 17 247.576 15.935 -8.053 140 HA ARG 17 HA ARG 17 248.364 16.529 -5.285 141 1HB ARG 17 HB2 ARG 17 245.822 16.876 -4.909 142 2HB ARG 17 HB1 ARG 17 246.757 18.185 -5.616 143 1HG ARG 17 HG2 ARG 17 245.969 16.961 -7.861 144 2HG ARG 17 HG1 ARG 17 244.636 16.506 -6.798 145 1HD ARG 17 HD2 ARG 17 244.358 18.899 -6.211 146 2HD ARG 17 HD1 ARG 17 245.605 19.298 -7.392 147 HE ARG 17 HE ARG 17 244.079 18.977 -9.072 148 1HH1 ARG 17 HH11 ARG 17 242.801 17.661 -6.103 149 2HH1 ARG 17 HH12 ARG 17 241.222 17.384 -6.760 150 1HH2 ARG 17 HH21 ARG 17 242.004 18.614 -9.937 151 2HH2 ARG 17 HH22 ARG 17 240.769 17.925 -8.936 152 H VAL 18 HN VAL 18 247.216 15.168 -3.677 153 HA VAL 18 HA VAL 18 246.365 12.590 -4.830 154 HB VAL 18 HB VAL 18 248.499 12.098 -4.035 155 1HG1 VAL 18 HG11 VAL 18 248.778 14.253 -2.796 156 2HG1 VAL 18 HG12 VAL 18 249.471 12.848 -1.987 157 3HG1 VAL 18 HG13 VAL 18 247.932 13.512 -1.437 158 1HG2 VAL 18 HG21 VAL 18 248.180 10.607 -2.153 159 2HG2 VAL 18 HG22 VAL 18 246.796 10.517 -3.241 160 3HG2 VAL 18 HG23 VAL 18 246.676 11.424 -1.733 161 H LEU 19 HN LEU 19 244.979 11.316 -3.421 162 HA LEU 19 HA LEU 19 243.497 12.946 -1.464 163 1HB LEU 19 HB2 LEU 19 242.129 12.669 -3.419 164 2HB LEU 19 HB1 LEU 19 242.452 10.948 -3.464 165 HG LEU 19 HG LEU 19 241.108 10.555 -1.529 166 1HD1 LEU 19 HD11 LEU 19 239.870 12.839 -0.758 167 2HD1 LEU 19 HD12 LEU 19 241.490 13.434 -1.117 168 3HD1 LEU 19 HD13 LEU 19 241.267 12.136 0.055 169 1HD2 LEU 19 HD21 LEU 19 239.541 10.537 -3.143 170 2HD2 LEU 19 HD22 LEU 19 240.023 12.112 -3.773 171 3HD2 LEU 19 HD23 LEU 19 238.986 12.012 -2.351 172 H LEU 20 HN LEU 20 243.967 12.195 0.501 173 HA LEU 20 HA LEU 20 244.398 9.312 0.854 174 1HB LEU 20 HB2 LEU 20 245.653 11.658 1.919 175 2HB LEU 20 HB1 LEU 20 244.981 10.724 3.240 176 HG LEU 20 HG LEU 20 246.732 9.445 1.160 177 1HD1 LEU 20 HD11 LEU 20 247.770 11.484 2.372 178 2HD1 LEU 20 HD12 LEU 20 248.670 9.968 2.315 179 3HD1 LEU 20 HD13 LEU 20 247.797 10.420 3.778 180 1HD2 LEU 20 HD21 LEU 20 245.921 8.757 3.976 181 2HD2 LEU 20 HD22 LEU 20 247.188 7.911 3.087 182 3HD2 LEU 20 HD23 LEU 20 245.527 7.885 2.495 183 H GLY 21 HN GLY 21 243.776 8.634 3.231 184 1HA GLY 21 HA2 GLY 21 241.067 9.660 3.806 185 2HA GLY 21 HA1 GLY 21 241.394 7.934 3.731 186 H MET 22 HN MET 22 240.908 10.388 5.821 187 HA MET 22 HA MET 22 242.699 9.239 7.854 188 1HB MET 22 HB2 MET 22 243.186 11.576 7.480 189 2HB MET 22 HB1 MET 22 241.489 12.000 7.664 190 1HG MET 22 HG2 MET 22 241.527 11.561 9.978 191 2HG MET 22 HG1 MET 22 243.080 10.736 9.871 192 1HE MET 22 HE1 MET 22 245.536 12.263 10.170 193 2HE MET 22 HE2 MET 22 245.508 13.596 9.019 194 3HE MET 22 HE3 MET 22 244.973 11.991 8.522 195 H LYS 23 HN LYS 23 241.863 8.597 9.831 196 HA LYS 23 HA LYS 23 238.998 8.142 9.853 197 1HB LYS 23 HB2 LYS 23 241.306 6.842 10.962 198 2HB LYS 23 HB1 LYS 23 240.174 7.212 12.256 199 1HG LYS 23 HG2 LYS 23 238.394 6.121 10.832 200 2HG LYS 23 HG1 LYS 23 239.706 5.545 9.803 201 1HD LYS 23 HD2 LYS 23 239.613 3.762 11.195 202 2HD LYS 23 HD1 LYS 23 240.652 4.782 12.193 203 1HE LYS 23 HE2 LYS 23 239.091 5.001 13.777 204 2HE LYS 23 HE1 LYS 23 237.820 5.317 12.597 205 1HZ LYS 23 HZ1 LYS 23 238.868 2.614 13.235 206 2HZ LYS 23 HZ2 LYS 23 237.544 2.982 12.248 207 3HZ LYS 23 HZ3 LYS 23 237.465 3.277 13.912 208 H LYS 24 HN LYS 24 237.600 8.896 11.475 209 HA LYS 24 HA LYS 24 238.491 11.382 12.678 210 1HB LYS 24 HB2 LYS 24 235.900 10.197 11.938 211 2HB LYS 24 HB1 LYS 24 235.876 11.119 13.435 212 1HG LYS 24 HG2 LYS 24 235.982 13.062 12.358 213 2HG LYS 24 HG1 LYS 24 237.283 12.502 11.306 214 1HD LYS 24 HD2 LYS 24 235.818 11.684 9.713 215 2HD LYS 24 HD1 LYS 24 234.491 11.531 10.866 216 1HE LYS 24 HE2 LYS 24 234.323 13.407 9.157 217 2HE LYS 24 HE1 LYS 24 234.062 13.838 10.847 218 1HZ LYS 24 HZ1 LYS 24 236.800 14.051 9.920 219 2HZ LYS 24 HZ2 LYS 24 235.901 15.102 10.893 220 3HZ LYS 24 HZ3 LYS 24 235.718 15.143 9.213 221 H ARG 25 HN ARG 25 237.568 8.154 13.597 222 HA ARG 25 HA ARG 25 238.768 8.420 16.144 223 1HB ARG 25 HB2 ARG 25 236.477 7.735 17.296 224 2HB ARG 25 HB1 ARG 25 236.953 9.416 17.112 225 1HG ARG 25 HG2 ARG 25 234.592 8.968 16.519 226 2HG ARG 25 HG1 ARG 25 235.531 9.679 15.204 227 1HD ARG 25 HD2 ARG 25 235.636 7.661 14.033 228 2HD ARG 25 HD1 ARG 25 235.200 6.711 15.453 229 HE ARG 25 HE ARG 25 233.418 7.849 13.571 230 1HH1 ARG 25 HH11 ARG 25 233.758 7.214 16.985 231 2HH1 ARG 25 HH12 ARG 25 232.052 7.126 17.266 232 1HH2 ARG 25 HH21 ARG 25 231.173 7.734 13.938 233 2HH2 ARG 25 HH22 ARG 25 230.584 7.421 15.537 234 H GLY 26 HN GLY 26 239.281 6.468 17.005 235 1HA GLY 26 HA2 GLY 26 238.321 4.083 17.188 236 2HA GLY 26 HA1 GLY 26 238.426 4.130 15.435 237 H PHE 27 HN PHE 27 240.076 2.914 14.794 238 HA PHE 27 HA PHE 27 242.505 2.843 16.428 239 1HB PHE 27 HB2 PHE 27 241.284 0.987 14.431 240 2HB PHE 27 HB1 PHE 27 243.026 0.937 14.678 241 HD1 PHE 27 HD1 PHE 27 243.960 0.228 16.809 242 HD2 PHE 27 HD2 PHE 27 239.760 0.233 16.125 243 HE1 PHE 27 HE1 PHE 27 243.641 -1.203 18.786 244 HE2 PHE 27 HE2 PHE 27 239.432 -1.197 18.101 245 HZ PHE 27 HZ PHE 27 241.375 -1.917 19.433 246 H GLY 28 HN GLY 28 241.709 5.037 14.519 247 1HA GLY 28 HA2 GLY 28 244.306 5.444 13.409 248 2HA GLY 28 HA1 GLY 28 243.147 5.015 12.162 249 H ALA 29 HN ALA 29 242.016 6.816 14.904 250 HA ALA 29 HA ALA 29 240.955 8.900 13.388 251 1HB ALA 29 HB1 ALA 29 240.718 8.129 15.951 252 2HB ALA 29 HB2 ALA 29 240.142 9.672 15.322 253 3HB ALA 29 HB3 ALA 29 241.701 9.579 16.142 254 H GLY 30 HN GLY 30 241.609 11.036 13.019 255 1HA GLY 30 HA2 GLY 30 243.117 12.671 12.449 256 2HA GLY 30 HA1 GLY 30 243.871 12.305 13.992 257 H ARG 31 HN ARG 31 243.666 9.838 11.557 258 HA ARG 31 HA ARG 31 246.450 10.319 10.764 259 1HB ARG 31 HB2 ARG 31 245.385 8.010 12.261 260 2HB ARG 31 HB1 ARG 31 246.413 7.601 10.895 261 1HG ARG 31 HG2 ARG 31 248.080 7.820 12.366 262 2HG ARG 31 HG1 ARG 31 247.877 9.550 12.088 263 1HD ARG 31 HD2 ARG 31 246.935 9.900 14.115 264 2HD ARG 31 HD1 ARG 31 246.104 8.346 14.115 265 HE ARG 31 HE ARG 31 248.831 7.850 14.394 266 1HH1 ARG 31 HH11 ARG 31 246.251 9.373 16.183 267 2HH1 ARG 31 HH12 ARG 31 246.954 9.032 17.729 268 1HH2 ARG 31 HH21 ARG 31 249.756 7.400 16.426 269 2HH2 ARG 31 HH22 ARG 31 248.943 7.912 17.867 270 H TRP 32 HN TRP 32 246.867 9.935 8.660 271 HA TRP 32 HA TRP 32 244.630 9.247 6.950 272 1HB TRP 32 HB2 TRP 32 247.216 9.577 5.610 273 2HB TRP 32 HB1 TRP 32 245.684 10.384 5.312 274 HD1 TRP 32 HD1 TRP 32 248.789 10.671 7.584 275 HE1 TRP 32 HE1 TRP 32 249.034 13.130 8.301 276 HE3 TRP 32 HE3 TRP 32 244.501 12.554 5.534 277 HZ2 TRP 32 HZ2 TRP 32 247.615 15.549 8.022 278 HZ3 TRP 32 HZ3 TRP 32 244.023 14.953 5.804 279 HH2 TRP 32 HH2 TRP 32 245.548 16.417 7.021 280 H ASN 33 HN ASN 33 244.702 7.584 5.338 281 HA ASN 33 HA ASN 33 246.755 5.669 5.158 282 1HB ASN 33 HB2 ASN 33 245.492 3.762 6.265 283 2HB ASN 33 HB1 ASN 33 246.225 4.937 7.354 284 1HD2 ASN 33 HD21 ASN 33 244.881 4.683 9.057 285 2HD2 ASN 33 HD22 ASN 33 243.196 5.060 9.025 286 H GLY 34 HN GLY 34 246.401 4.216 3.510 287 1HA GLY 34 HA2 GLY 34 244.576 4.843 1.521 288 2HA GLY 34 HA1 GLY 34 245.390 3.292 1.667 289 H PHE 35 HN PHE 35 243.020 3.066 0.594 290 HA PHE 35 HA PHE 35 241.132 2.460 2.761 291 1HB PHE 35 HB2 PHE 35 240.340 2.285 -0.113 292 2HB PHE 35 HB1 PHE 35 239.384 2.751 1.278 293 HD1 PHE 35 HD1 PHE 35 241.319 3.899 -1.489 294 HD2 PHE 35 HD2 PHE 35 239.835 5.012 2.339 295 HE1 PHE 35 HE1 PHE 35 241.667 6.268 -2.049 296 HE2 PHE 35 HE2 PHE 35 240.177 7.385 1.787 297 HZ PHE 35 HZ PHE 35 241.095 8.016 -0.410 298 H GLY 36 HN GLY 36 241.811 0.524 3.503 299 1HA GLY 36 HA2 GLY 36 242.862 -1.580 2.039 300 2HA GLY 36 HA1 GLY 36 242.057 -1.747 3.587 301 H GLY 37 HN GLY 37 241.514 -3.849 2.545 302 1HA GLY 37 HA2 GLY 37 238.840 -4.091 1.989 303 2HA GLY 37 HA1 GLY 37 239.601 -3.902 0.415 304 H LYS 38 HN LYS 38 238.196 -6.230 1.264 305 HA LYS 38 HA LYS 38 240.413 -8.155 1.175 306 1HB LYS 38 HB2 LYS 38 239.454 -9.572 2.778 307 2HB LYS 38 HB1 LYS 38 239.286 -7.964 3.463 308 1HG LYS 38 HG2 LYS 38 237.089 -9.391 1.980 309 2HG LYS 38 HG1 LYS 38 237.293 -9.432 3.732 310 1HD LYS 38 HD2 LYS 38 236.130 -7.544 3.876 311 2HD LYS 38 HD1 LYS 38 237.403 -6.721 2.976 312 1HE LYS 38 HE2 LYS 38 236.260 -6.819 1.001 313 2HE LYS 38 HE1 LYS 38 235.421 -8.307 1.437 314 1HZ LYS 38 HZ1 LYS 38 234.764 -5.948 3.006 315 2HZ LYS 38 HZ2 LYS 38 233.760 -7.184 2.437 316 3HZ LYS 38 HZ3 LYS 38 234.241 -5.940 1.397 317 H VAL 39 HN VAL 39 240.189 -9.847 -0.199 318 HA VAL 39 HA VAL 39 238.148 -9.651 -2.206 319 HB VAL 39 HB VAL 39 239.992 -12.011 -1.946 320 1HG1 VAL 39 HG11 VAL 39 239.931 -11.948 -4.377 321 2HG1 VAL 39 HG12 VAL 39 238.945 -10.488 -4.328 322 3HG1 VAL 39 HG13 VAL 39 238.296 -12.011 -3.720 323 1HG2 VAL 39 HG21 VAL 39 240.747 -9.212 -2.326 324 2HG2 VAL 39 HG22 VAL 39 241.363 -10.306 -3.564 325 3HG2 VAL 39 HG23 VAL 39 241.727 -10.603 -1.864 326 H GLN 40 HN GLN 40 236.140 -10.252 -1.686 327 HA GLN 40 HA GLN 40 235.285 -11.941 0.290 328 1HB GLN 40 HB2 GLN 40 234.042 -10.458 -1.599 329 2HB GLN 40 HB1 GLN 40 233.718 -12.072 -2.215 330 1HG GLN 40 HG2 GLN 40 233.119 -12.340 0.435 331 2HG GLN 40 HG1 GLN 40 232.613 -10.685 0.100 332 1HE2 GLN 40 HE21 GLN 40 232.555 -13.675 -1.808 333 2HE2 GLN 40 HE22 GLN 40 230.863 -13.626 -2.152 334 H GLU 41 HN GLU 41 233.941 -14.034 -0.232 335 HA GLU 41 HA GLU 41 235.830 -16.038 -0.908 336 1HB GLU 41 HB2 GLU 41 233.663 -16.060 0.634 337 2HB GLU 41 HB1 GLU 41 232.920 -16.673 -0.836 338 1HG GLU 41 HG2 GLU 41 233.532 -18.646 0.065 339 2HG GLU 41 HG1 GLU 41 235.042 -18.273 -0.765 340 H GLY 42 HN GLY 42 236.197 -14.924 -3.109 341 1HA GLY 42 HA2 GLY 42 236.155 -16.127 -5.276 342 2HA GLY 42 HA1 GLY 42 234.412 -16.204 -5.086 343 H GLU 43 HN GLU 43 236.651 -13.470 -4.591 344 HA GLU 43 HA GLU 43 235.316 -12.107 -6.805 345 1HB GLU 43 HB2 GLU 43 234.822 -10.241 -5.605 346 2HB GLU 43 HB1 GLU 43 234.773 -11.388 -4.279 347 1HG GLU 43 HG2 GLU 43 236.874 -10.709 -3.478 348 2HG GLU 43 HG1 GLU 43 237.253 -9.847 -4.968 349 H THR 44 HN THR 44 236.696 -10.077 -7.374 350 HA THR 44 HA THR 44 239.426 -11.082 -7.661 351 HB THR 44 HB THR 44 239.570 -9.540 -9.548 352 HG1 THR 44 HG1 THR 44 238.249 -7.930 -9.621 353 1HG2 THR 44 HG21 THR 44 238.696 -11.734 -10.017 354 2HG2 THR 44 HG22 THR 44 237.822 -10.539 -10.977 355 3HG2 THR 44 HG23 THR 44 237.079 -11.225 -9.531 356 H ILE 45 HN ILE 45 241.207 -9.901 -7.095 357 HA ILE 45 HA ILE 45 241.119 -8.306 -4.870 358 HB ILE 45 HB ILE 45 243.233 -8.065 -7.005 359 1HG1 ILE 45 HG12 ILE 45 244.196 -9.835 -5.151 360 2HG1 ILE 45 HG11 ILE 45 242.500 -10.296 -5.249 361 1HG2 ILE 45 HG21 ILE 45 243.530 -6.402 -5.359 362 2HG2 ILE 45 HG22 ILE 45 244.683 -7.684 -4.987 363 3HG2 ILE 45 HG23 ILE 45 243.194 -7.538 -4.053 364 1HD1 ILE 45 HD11 ILE 45 244.492 -11.166 -6.901 365 2HD1 ILE 45 HD12 ILE 45 243.739 -9.885 -7.852 366 3HD1 ILE 45 HD13 ILE 45 242.765 -11.227 -7.253 367 H GLU 46 HN GLU 46 240.802 -7.357 -8.232 368 HA GLU 46 HA GLU 46 240.988 -4.529 -7.735 369 1HB GLU 46 HB2 GLU 46 241.461 -5.682 -9.950 370 2HB GLU 46 HB1 GLU 46 239.723 -5.888 -10.120 371 1HG GLU 46 HG2 GLU 46 239.477 -3.420 -9.946 372 2HG GLU 46 HG1 GLU 46 241.235 -3.293 -9.962 373 H ASP 47 HN ASP 47 238.512 -6.963 -7.726 374 HA ASP 47 HA ASP 47 236.324 -5.095 -7.736 375 1HB ASP 47 HB2 ASP 47 236.592 -8.062 -7.437 376 2HB ASP 47 HB1 ASP 47 235.101 -7.285 -6.919 377 H GLY 48 HN GLY 48 238.199 -6.924 -5.402 378 1HA GLY 48 HA2 GLY 48 236.573 -6.265 -3.139 379 2HA GLY 48 HA1 GLY 48 238.215 -6.895 -3.091 380 H ALA 49 HN ALA 49 239.321 -4.780 -4.723 381 HA ALA 49 HA ALA 49 239.797 -2.843 -2.658 382 1HB ALA 49 HB1 ALA 49 240.732 -2.408 -5.450 383 2HB ALA 49 HB2 ALA 49 241.390 -3.774 -4.550 384 3HB ALA 49 HB3 ALA 49 241.568 -2.135 -3.922 385 H ARG 50 HN ARG 50 237.948 -3.039 -5.622 386 HA ARG 50 HA ARG 50 237.330 -0.257 -5.741 387 1HB ARG 50 HB2 ARG 50 236.314 -2.712 -7.125 388 2HB ARG 50 HB1 ARG 50 235.435 -1.199 -7.280 389 1HG ARG 50 HG2 ARG 50 237.440 -0.124 -8.176 390 2HG ARG 50 HG1 ARG 50 238.317 -1.648 -8.026 391 1HD ARG 50 HD2 ARG 50 236.598 -2.679 -9.531 392 2HD ARG 50 HD1 ARG 50 235.948 -1.061 -9.793 393 HE ARG 50 HE ARG 50 238.557 -0.773 -10.422 394 1HH1 ARG 50 HH11 ARG 50 236.114 -3.052 -11.428 395 2HH1 ARG 50 HH12 ARG 50 236.807 -3.293 -12.997 396 1HH2 ARG 50 HH21 ARG 50 239.471 -1.089 -12.484 397 2HH2 ARG 50 HH22 ARG 50 238.713 -2.179 -13.596 398 H ARG 51 HN ARG 51 235.440 -3.135 -4.830 399 HA ARG 51 HA ARG 51 233.146 -1.752 -3.986 400 1HB ARG 51 HB2 ARG 51 233.701 -4.342 -4.378 401 2HB ARG 51 HB1 ARG 51 233.847 -4.296 -2.626 402 1HG ARG 51 HG2 ARG 51 231.593 -3.511 -2.399 403 2HG ARG 51 HG1 ARG 51 231.434 -3.335 -4.148 404 1HD ARG 51 HD2 ARG 51 231.631 -5.720 -4.449 405 2HD ARG 51 HD1 ARG 51 231.949 -5.945 -2.729 406 HE ARG 51 HE ARG 51 229.701 -5.879 -2.361 407 1HH1 ARG 51 HH11 ARG 51 230.348 -4.398 -5.454 408 2HH1 ARG 51 HH12 ARG 51 228.674 -4.209 -5.855 409 1HH2 ARG 51 HH21 ARG 51 227.499 -5.633 -2.886 410 2HH2 ARG 51 HH22 ARG 51 227.056 -4.910 -4.398 411 H GLU 52 HN GLU 52 236.114 -2.575 -2.316 412 HA GLU 52 HA GLU 52 235.094 -1.739 0.261 413 1HB GLU 52 HB2 GLU 52 237.856 -2.569 -0.643 414 2HB GLU 52 HB1 GLU 52 237.455 -2.134 1.012 415 1HG GLU 52 HG2 GLU 52 235.912 -4.279 -0.373 416 2HG GLU 52 HG1 GLU 52 237.506 -4.627 0.293 417 H LEU 53 HN LEU 53 236.616 -0.318 -2.446 418 HA LEU 53 HA LEU 53 237.874 1.854 -1.080 419 1HB LEU 53 HB2 LEU 53 238.795 1.271 -3.164 420 2HB LEU 53 HB1 LEU 53 237.227 1.244 -3.948 421 HG LEU 53 HG LEU 53 237.098 3.700 -3.699 422 1HD1 LEU 53 HD11 LEU 53 239.042 3.351 -1.811 423 2HD1 LEU 53 HD12 LEU 53 238.577 4.893 -2.528 424 3HD1 LEU 53 HD13 LEU 53 239.951 3.999 -3.175 425 1HD2 LEU 53 HD21 LEU 53 239.257 2.348 -5.243 426 2HD2 LEU 53 HD22 LEU 53 239.164 4.110 -5.265 427 3HD2 LEU 53 HD23 LEU 53 237.792 3.147 -5.813 428 H GLN 54 HN GLN 54 234.916 1.471 -2.993 429 HA GLN 54 HA GLN 54 234.019 4.121 -2.845 430 1HB GLN 54 HB2 GLN 54 232.867 2.869 -4.403 431 2HB GLN 54 HB1 GLN 54 232.721 1.479 -3.338 432 1HG GLN 54 HG2 GLN 54 230.977 2.547 -2.086 433 2HG GLN 54 HG1 GLN 54 231.198 4.051 -2.980 434 1HE2 GLN 54 HE21 GLN 54 229.537 4.362 -4.268 435 2HE2 GLN 54 HE22 GLN 54 228.765 3.165 -5.247 436 H GLU 55 HN GLU 55 234.005 1.585 -0.502 437 HA GLU 55 HA GLU 55 231.956 2.756 1.148 438 1HB GLU 55 HB2 GLU 55 233.781 0.393 1.440 439 2HB GLU 55 HB1 GLU 55 232.794 0.950 2.783 440 1HG GLU 55 HG2 GLU 55 231.430 0.518 0.195 441 2HG GLU 55 HG1 GLU 55 231.982 -0.909 1.071 442 H GLU 56 HN GLU 56 235.410 3.012 0.929 443 HA GLU 56 HA GLU 56 235.806 3.824 3.629 444 1HB GLU 56 HB2 GLU 56 237.440 3.170 1.427 445 2HB GLU 56 HB1 GLU 56 237.896 4.791 1.933 446 1HG GLU 56 HG2 GLU 56 237.870 2.296 3.609 447 2HG GLU 56 HG1 GLU 56 239.272 3.228 3.090 448 H SER 57 HN SER 57 235.534 5.656 0.581 449 HA SER 57 HA SER 57 235.025 8.042 2.224 450 1HB SER 57 HB2 SER 57 237.318 8.266 1.526 451 2HB SER 57 HB1 SER 57 236.902 7.863 -0.139 452 HG SER 57 HG SER 57 237.070 10.076 0.005 453 H GLY 58 HN GLY 58 233.337 6.153 0.597 454 1HA GLY 58 HA2 GLY 58 231.525 6.284 -0.802 455 2HA GLY 58 HA1 GLY 58 231.514 8.001 -0.426 456 H LEU 59 HN LEU 59 234.455 6.988 -1.771 457 HA LEU 59 HA LEU 59 233.703 8.184 -4.338 458 1HB LEU 59 HB2 LEU 59 236.368 7.803 -2.991 459 2HB LEU 59 HB1 LEU 59 236.201 8.341 -4.651 460 HG LEU 59 HG LEU 59 235.492 9.791 -2.127 461 1HD1 LEU 59 HD11 LEU 59 237.586 10.447 -2.738 462 2HD1 LEU 59 HD12 LEU 59 236.638 11.590 -3.690 463 3HD1 LEU 59 HD13 LEU 59 237.302 10.145 -4.452 464 1HD2 LEU 59 HD21 LEU 59 234.390 10.288 -4.885 465 2HD2 LEU 59 HD22 LEU 59 234.450 11.529 -3.634 466 3HD2 LEU 59 HD23 LEU 59 233.497 10.067 -3.380 467 H THR 60 HN THR 60 233.160 6.771 -5.807 468 HA THR 60 HA THR 60 234.339 4.109 -5.822 469 HB THR 60 HB THR 60 232.478 4.782 -7.983 470 HG1 THR 60 HG1 THR 60 231.701 5.114 -5.284 471 1HG2 THR 60 HG21 THR 60 232.145 2.604 -7.801 472 2HG2 THR 60 HG22 THR 60 231.404 2.867 -6.222 473 3HG2 THR 60 HG23 THR 60 233.134 2.548 -6.342 474 H VAL 61 HN VAL 61 235.265 3.237 -7.816 475 HA VAL 61 HA VAL 61 236.413 5.358 -9.512 476 HB VAL 61 HB VAL 61 238.464 4.066 -9.715 477 1HG1 VAL 61 HG11 VAL 61 237.545 4.741 -6.938 478 2HG1 VAL 61 HG12 VAL 61 238.569 5.683 -8.021 479 3HG1 VAL 61 HG13 VAL 61 239.192 4.211 -7.278 480 1HG2 VAL 61 HG21 VAL 61 236.851 2.017 -8.416 481 2HG2 VAL 61 HG22 VAL 61 238.442 2.211 -7.680 482 3HG2 VAL 61 HG23 VAL 61 238.303 1.860 -9.402 483 H ASP 62 HN ASP 62 236.539 5.025 -11.669 484 HA ASP 62 HA ASP 62 234.888 2.927 -12.761 485 1HB ASP 62 HB2 ASP 62 236.526 5.013 -14.220 486 2HB ASP 62 HB1 ASP 62 235.232 4.030 -14.900 487 H ALA 63 HN ALA 63 238.210 3.427 -12.096 488 HA ALA 63 HA ALA 63 238.992 0.838 -12.718 489 1HB ALA 63 HB1 ALA 63 240.482 1.441 -14.733 490 2HB ALA 63 HB2 ALA 63 239.387 2.807 -14.941 491 3HB ALA 63 HB3 ALA 63 238.764 1.159 -15.013 492 H LEU 64 HN LEU 64 240.191 0.963 -10.849 493 HA LEU 64 HA LEU 64 241.928 3.071 -10.143 494 1HB LEU 64 HB2 LEU 64 242.037 0.150 -9.372 495 2HB LEU 64 HB1 LEU 64 242.963 1.422 -8.603 496 HG LEU 64 HG LEU 64 240.257 2.221 -8.504 497 1HD1 LEU 64 HD11 LEU 64 239.731 -0.153 -8.949 498 2HD1 LEU 64 HD12 LEU 64 239.191 0.391 -7.361 499 3HD1 LEU 64 HD13 LEU 64 240.647 -0.594 -7.508 500 1HD2 LEU 64 HD21 LEU 64 242.455 2.196 -6.870 501 2HD2 LEU 64 HD22 LEU 64 241.372 1.058 -6.068 502 3HD2 LEU 64 HD23 LEU 64 240.835 2.705 -6.399 503 H HIS 65 HN HIS 65 244.383 2.184 -9.640 504 HA HIS 65 HA HIS 65 245.462 1.084 -12.136 505 1HB HIS 65 HB2 HIS 65 245.565 3.686 -11.907 506 2HB HIS 65 HB1 HIS 65 246.870 3.357 -10.773 507 HD1 HIS 65 HD1 HIS 65 249.128 2.869 -11.746 508 HD2 HIS 65 HD2 HIS 65 246.105 2.744 -14.594 509 HE1 HIS 65 HE1 HIS 65 250.299 2.651 -13.961 510 HE2 HIS 65 HE2 HIS 65 248.453 2.664 -15.675 511 H LYS 66 HN LYS 66 246.165 -0.834 -11.340 512 HA LYS 66 HA LYS 66 247.297 -1.182 -8.764 513 1HB LYS 66 HB2 LYS 66 246.258 -3.025 -10.025 514 2HB LYS 66 HB1 LYS 66 247.541 -2.930 -11.222 515 1HG LYS 66 HG2 LYS 66 249.018 -3.264 -9.008 516 2HG LYS 66 HG1 LYS 66 247.548 -4.112 -8.524 517 1HD LYS 66 HD2 LYS 66 248.918 -4.624 -11.153 518 2HD LYS 66 HD1 LYS 66 249.341 -5.498 -9.679 519 1HE LYS 66 HE2 LYS 66 247.779 -6.922 -10.548 520 2HE LYS 66 HE1 LYS 66 246.738 -5.889 -9.569 521 1HZ LYS 66 HZ1 LYS 66 247.209 -5.028 -12.309 522 2HZ LYS 66 HZ2 LYS 66 245.794 -4.969 -11.383 523 3HZ LYS 66 HZ3 LYS 66 246.263 -6.418 -12.116 524 H VAL 67 HN VAL 67 249.394 -1.069 -8.062 525 HA VAL 67 HA VAL 67 251.433 -0.559 -10.134 526 HB VAL 67 HB VAL 67 252.491 1.132 -8.750 527 1HG1 VAL 67 HG11 VAL 67 250.388 2.744 -8.675 528 2HG1 VAL 67 HG12 VAL 67 249.665 1.432 -9.607 529 3HG1 VAL 67 HG13 VAL 67 251.121 2.235 -10.196 530 1HG2 VAL 67 HG21 VAL 67 252.049 0.573 -6.538 531 2HG2 VAL 67 HG22 VAL 67 250.316 0.424 -6.821 532 3HG2 VAL 67 HG23 VAL 67 251.068 2.013 -6.793 533 H GLY 68 HN GLY 68 250.947 -1.444 -6.712 534 1HA GLY 68 HA2 GLY 68 253.216 -3.295 -7.019 535 2HA GLY 68 HA1 GLY 68 253.168 -2.199 -5.648 536 H GLN 69 HN GLN 69 253.387 -4.823 -5.154 537 HA GLN 69 HA GLN 69 250.749 -5.477 -4.030 538 1HB GLN 69 HB2 GLN 69 252.595 -7.244 -5.598 539 2HB GLN 69 HB1 GLN 69 251.564 -7.943 -4.358 540 1HG GLN 69 HG2 GLN 69 250.088 -8.153 -6.019 541 2HG GLN 69 HG1 GLN 69 249.773 -6.443 -5.726 542 1HE2 GLN 69 HE21 GLN 69 250.208 -8.572 -8.093 543 2HE2 GLN 69 HE22 GLN 69 250.936 -7.572 -9.299 544 H ILE 70 HN ILE 70 250.926 -5.371 -1.895 545 HA ILE 70 HA ILE 70 253.514 -5.939 -0.650 546 HB ILE 70 HB ILE 70 251.059 -4.711 0.600 547 1HG1 ILE 70 HG12 ILE 70 253.569 -3.300 -0.309 548 2HG1 ILE 70 HG11 ILE 70 252.108 -3.392 -1.287 549 1HG2 ILE 70 HG21 ILE 70 253.911 -4.788 1.568 550 2HG2 ILE 70 HG22 ILE 70 252.601 -5.797 2.180 551 3HG2 ILE 70 HG23 ILE 70 252.542 -4.047 2.396 552 1HD1 ILE 70 HD11 ILE 70 250.903 -2.319 0.656 553 2HD1 ILE 70 HD12 ILE 70 252.053 -1.304 -0.216 554 3HD1 ILE 70 HD13 ILE 70 252.497 -2.003 1.341 555 H VAL 71 HN VAL 71 253.738 -7.344 1.072 556 HA VAL 71 HA VAL 71 251.523 -9.221 1.545 557 HB VAL 71 HB VAL 71 254.422 -10.033 1.356 558 1HG1 VAL 71 HG11 VAL 71 253.543 -12.287 1.303 559 2HG1 VAL 71 HG12 VAL 71 251.894 -11.668 1.358 560 3HG1 VAL 71 HG13 VAL 71 252.965 -11.444 2.740 561 1HG2 VAL 71 HG21 VAL 71 253.357 -11.205 -0.791 562 2HG2 VAL 71 HG22 VAL 71 254.109 -9.611 -0.853 563 3HG2 VAL 71 HG23 VAL 71 252.354 -9.756 -0.746 564 H PHE 72 HN PHE 72 251.449 -10.155 3.631 565 HA PHE 72 HA PHE 72 253.294 -8.993 5.599 566 1HB PHE 72 HB2 PHE 72 250.288 -9.176 5.851 567 2HB PHE 72 HB1 PHE 72 251.376 -8.720 7.158 568 HD1 PHE 72 HD1 PHE 72 250.707 -7.760 3.613 569 HD2 PHE 72 HD2 PHE 72 251.615 -6.480 7.568 570 HE1 PHE 72 HE1 PHE 72 250.607 -5.416 2.873 571 HE2 PHE 72 HE2 PHE 72 251.513 -4.133 6.834 572 HZ PHE 72 HZ PHE 72 251.007 -3.600 4.485 573 H GLU 73 HN GLU 73 254.314 -10.538 6.646 574 HA GLU 73 HA GLU 73 253.084 -13.189 6.854 575 1HB GLU 73 HB2 GLU 73 255.289 -13.196 5.871 576 2HB GLU 73 HB1 GLU 73 255.937 -12.254 7.206 577 1HG GLU 73 HG2 GLU 73 256.496 -14.132 8.218 578 2HG GLU 73 HG1 GLU 73 254.787 -14.547 8.345 579 H PHE 74 HN PHE 74 252.224 -13.832 8.719 580 HA PHE 74 HA PHE 74 252.616 -12.192 11.087 581 1HB PHE 74 HB2 PHE 74 250.690 -14.327 10.278 582 2HB PHE 74 HB1 PHE 74 250.938 -14.026 11.994 583 HD1 PHE 74 HD1 PHE 74 249.244 -12.780 12.893 584 HD2 PHE 74 HD2 PHE 74 250.623 -11.849 8.976 585 HE1 PHE 74 HE1 PHE 74 247.666 -10.895 12.789 586 HE2 PHE 74 HE2 PHE 74 249.049 -9.962 8.866 587 HZ PHE 74 HZ PHE 74 247.568 -9.482 10.774 588 H VAL 75 HN VAL 75 253.682 -12.711 12.850 589 HA VAL 75 HA VAL 75 255.475 -14.964 12.724 590 HB VAL 75 HB VAL 75 255.422 -13.465 15.241 591 1HG1 VAL 75 HG11 VAL 75 257.328 -14.687 14.992 592 2HG1 VAL 75 HG12 VAL 75 257.875 -13.150 14.318 593 3HG1 VAL 75 HG13 VAL 75 257.376 -14.458 13.244 594 1HG2 VAL 75 HG21 VAL 75 256.626 -11.507 14.008 595 2HG2 VAL 75 HG22 VAL 75 254.868 -11.517 14.136 596 3HG2 VAL 75 HG23 VAL 75 255.644 -12.022 12.635 597 H GLY 76 HN GLY 76 254.675 -16.897 13.223 598 1HA GLY 76 HA2 GLY 76 254.145 -18.442 14.982 599 2HA GLY 76 HA1 GLY 76 253.245 -17.161 15.781 600 H GLU 77 HN GLU 77 252.153 -16.488 12.977 601 HA GLU 77 HA GLU 77 250.016 -18.507 13.050 602 1HB GLU 77 HB2 GLU 77 249.909 -15.735 11.853 603 2HB GLU 77 HB1 GLU 77 248.559 -16.838 12.080 604 1HG GLU 77 HG2 GLU 77 249.253 -16.697 14.596 605 2HG GLU 77 HG1 GLU 77 250.024 -15.195 14.084 606 HA PRO 78 HA PRO 78 251.795 -20.118 9.247 607 1HB PRO 78 HB2 PRO 78 248.996 -21.134 9.024 608 2HB PRO 78 HB1 PRO 78 250.525 -21.994 8.807 609 1HG PRO 78 HG2 PRO 78 249.104 -22.308 11.033 610 2HG PRO 78 HG1 PRO 78 250.875 -22.221 11.090 611 1HD PRO 78 HD2 PRO 78 248.849 -20.172 11.852 612 2HD PRO 78 HD1 PRO 78 250.443 -20.503 12.558 613 H GLU 79 HN GLU 79 248.447 -18.880 9.245 614 HA GLU 79 HA GLU 79 248.312 -18.257 6.529 615 1HB GLU 79 HB2 GLU 79 246.617 -18.066 8.714 616 2HB GLU 79 HB1 GLU 79 246.826 -16.395 8.209 617 1HG GLU 79 HG2 GLU 79 246.141 -16.997 5.943 618 2HG GLU 79 HG1 GLU 79 245.921 -18.669 6.458 619 H LEU 80 HN LEU 80 248.040 -15.981 5.680 620 HA LEU 80 HA LEU 80 249.865 -14.047 6.900 621 1HB LEU 80 HB2 LEU 80 250.121 -14.374 3.966 622 2HB LEU 80 HB1 LEU 80 251.324 -13.902 5.151 623 HG LEU 80 HG LEU 80 250.361 -16.734 5.040 624 1HD1 LEU 80 HD11 LEU 80 251.646 -17.312 3.261 625 2HD1 LEU 80 HD12 LEU 80 252.792 -15.996 3.520 626 3HD1 LEU 80 HD13 LEU 80 251.230 -15.670 2.768 627 1HD2 LEU 80 HD21 LEU 80 253.017 -16.754 5.584 628 2HD2 LEU 80 HD22 LEU 80 251.748 -16.702 6.807 629 3HD2 LEU 80 HD23 LEU 80 252.536 -15.211 6.292 630 H MET 81 HN MET 81 249.890 -12.183 4.850 631 HA MET 81 HA MET 81 247.115 -11.726 4.102 632 1HB MET 81 HB2 MET 81 248.011 -10.605 6.417 633 2HB MET 81 HB1 MET 81 248.409 -9.344 5.258 634 1HG MET 81 HG2 MET 81 245.915 -9.808 4.483 635 2HG MET 81 HG1 MET 81 245.771 -10.338 6.156 636 1HE MET 81 HE1 MET 81 246.934 -7.811 3.755 637 2HE MET 81 HE2 MET 81 247.914 -6.841 4.856 638 3HE MET 81 HE3 MET 81 246.316 -6.277 4.367 639 H ASP 82 HN ASP 82 247.278 -11.431 1.966 640 HA ASP 82 HA ASP 82 249.567 -9.894 0.937 641 1HB ASP 82 HB2 ASP 82 248.883 -12.314 0.124 642 2HB ASP 82 HB1 ASP 82 247.717 -11.426 -0.851 643 H VAL 83 HN VAL 83 248.966 -7.785 0.946 644 HA VAL 83 HA VAL 83 246.346 -7.117 -0.221 645 HB VAL 83 HB VAL 83 246.637 -6.373 2.111 646 1HG1 VAL 83 HG11 VAL 83 249.212 -5.867 1.469 647 2HG1 VAL 83 HG12 VAL 83 248.392 -5.190 2.876 648 3HG1 VAL 83 HG13 VAL 83 248.533 -4.241 1.396 649 1HG2 VAL 83 HG21 VAL 83 245.102 -5.056 0.993 650 2HG2 VAL 83 HG22 VAL 83 246.315 -4.382 -0.095 651 3HG2 VAL 83 HG23 VAL 83 246.251 -3.857 1.587 652 H HIS 84 HN HIS 84 246.421 -6.390 -2.223 653 HA HIS 84 HA HIS 84 248.850 -5.505 -3.439 654 1HB HIS 84 HB2 HIS 84 245.979 -5.557 -4.378 655 2HB HIS 84 HB1 HIS 84 247.292 -4.937 -5.373 656 HD1 HIS 84 HD1 HIS 84 247.092 -6.777 -7.137 657 HD2 HIS 84 HD2 HIS 84 247.776 -8.220 -3.301 658 HE1 HIS 84 HE1 HIS 84 247.654 -9.211 -7.424 659 HE2 HIS 84 HE2 HIS 84 248.151 -10.041 -5.098 660 H VAL 85 HN VAL 85 249.093 -3.374 -4.490 661 HA VAL 85 HA VAL 85 247.785 -1.273 -2.878 662 HB VAL 85 HB VAL 85 250.522 -1.109 -4.170 663 1HG1 VAL 85 HG11 VAL 85 250.421 0.750 -2.174 664 2HG1 VAL 85 HG12 VAL 85 248.770 0.788 -2.791 665 3HG1 VAL 85 HG13 VAL 85 250.126 1.078 -3.881 666 1HG2 VAL 85 HG21 VAL 85 251.527 -1.625 -2.140 667 2HG2 VAL 85 HG22 VAL 85 250.193 -2.776 -2.222 668 3HG2 VAL 85 HG23 VAL 85 250.051 -1.331 -1.220 669 H PHE 86 HN PHE 86 246.210 -0.562 -4.166 670 HA PHE 86 HA PHE 86 246.762 -0.029 -6.994 671 1HB PHE 86 HB2 PHE 86 244.270 -0.532 -5.393 672 2HB PHE 86 HB1 PHE 86 244.160 0.324 -6.926 673 HD1 PHE 86 HD1 PHE 86 245.972 -2.688 -5.656 674 HD2 PHE 86 HD2 PHE 86 243.490 -0.995 -8.670 675 HE1 PHE 86 HE1 PHE 86 245.950 -4.843 -6.844 676 HE2 PHE 86 HE2 PHE 86 243.464 -3.146 -9.863 677 HZ PHE 86 HZ PHE 86 244.694 -5.075 -8.949 678 H CYS 87 HN CYS 87 246.196 1.962 -7.919 679 HA CYS 87 HA CYS 87 245.570 4.165 -6.078 680 1HB CYS 87 HB2 CYS 87 247.994 4.248 -6.419 681 2HB CYS 87 HB1 CYS 87 247.775 4.175 -8.164 682 HG CYS 87 HG CYS 87 247.480 6.668 -6.422 683 H THR 88 HN THR 88 243.733 5.051 -6.827 684 HA THR 88 HA THR 88 243.090 4.725 -9.659 685 HB THR 88 HB THR 88 241.536 4.070 -7.704 686 HG1 THR 88 HG1 THR 88 240.012 5.588 -9.393 687 1HG2 THR 88 HG21 THR 88 240.315 6.727 -7.891 688 2HG2 THR 88 HG22 THR 88 241.766 6.616 -6.895 689 3HG2 THR 88 HG23 THR 88 240.378 5.587 -6.547 690 H ASP 89 HN ASP 89 241.385 6.686 -10.198 691 HA ASP 89 HA ASP 89 242.352 9.284 -9.456 692 1HB ASP 89 HB2 ASP 89 243.044 9.953 -11.734 693 2HB ASP 89 HB1 ASP 89 244.078 8.685 -11.083 694 H SER 90 HN SER 90 240.544 7.368 -11.811 695 HA SER 90 HA SER 90 238.596 9.473 -12.209 696 1HB SER 90 HB2 SER 90 239.480 7.360 -13.768 697 2HB SER 90 HB1 SER 90 237.894 6.814 -13.225 698 HG SER 90 HG SER 90 238.455 9.296 -14.489 699 H ILE 91 HN ILE 91 237.440 9.792 -10.347 700 HA ILE 91 HA ILE 91 236.249 7.434 -9.079 701 HB ILE 91 HB ILE 91 235.736 8.868 -7.159 702 1HG1 ILE 91 HG12 ILE 91 237.229 11.033 -8.663 703 2HG1 ILE 91 HG11 ILE 91 235.481 10.987 -8.450 704 1HG2 ILE 91 HG21 ILE 91 237.743 7.825 -6.801 705 2HG2 ILE 91 HG22 ILE 91 238.242 9.513 -6.694 706 3HG2 ILE 91 HG23 ILE 91 238.523 8.603 -8.178 707 1HD1 ILE 91 HD11 ILE 91 236.536 12.508 -6.873 708 2HD1 ILE 91 HD12 ILE 91 237.516 11.185 -6.241 709 3HD1 ILE 91 HD13 ILE 91 235.766 11.161 -6.037 710 H GLN 92 HN GLN 92 234.022 8.039 -7.998 711 HA GLN 92 HA GLN 92 232.365 9.407 -10.009 712 1HB GLN 92 HB2 GLN 92 231.861 6.746 -8.686 713 2HB GLN 92 HB1 GLN 92 230.611 7.650 -9.529 714 1HG GLN 92 HG2 GLN 92 232.317 7.628 -11.498 715 2HG GLN 92 HG1 GLN 92 233.010 6.263 -10.622 716 1HE2 GLN 92 HE21 GLN 92 232.140 4.324 -10.909 717 2HE2 GLN 92 HE22 GLN 92 230.638 4.005 -11.703 718 H GLY 93 HN GLY 93 231.946 7.853 -6.829 719 1HA GLY 93 HA2 GLY 93 229.892 9.513 -5.939 720 2HA GLY 93 HA1 GLY 93 230.969 8.600 -4.896 721 H THR 94 HN THR 94 230.663 10.455 -3.450 722 HA THR 94 HA THR 94 232.521 12.626 -4.109 723 HB THR 94 HB THR 94 230.347 13.211 -2.209 724 HG1 THR 94 HG1 THR 94 229.891 12.744 -4.955 725 1HG2 THR 94 HG21 THR 94 230.327 15.154 -4.130 726 2HG2 THR 94 HG22 THR 94 232.023 14.671 -4.085 727 3HG2 THR 94 HG23 THR 94 231.221 15.216 -2.612 728 HA PRO 95 HA PRO 95 234.675 11.819 -0.399 729 1HB PRO 95 HB2 PRO 95 234.830 14.709 0.165 730 2HB PRO 95 HB1 PRO 95 236.132 13.567 -0.186 731 1HG PRO 95 HG2 PRO 95 235.397 15.428 -1.955 732 2HG PRO 95 HG1 PRO 95 235.907 13.807 -2.466 733 1HD PRO 95 HD2 PRO 95 233.138 14.922 -2.192 734 2HD PRO 95 HD1 PRO 95 233.827 13.937 -3.502 735 H VAL 96 HN VAL 96 232.334 11.222 0.120 736 HA VAL 96 HA VAL 96 230.900 12.941 1.911 737 HB VAL 96 HB VAL 96 230.464 9.975 1.806 738 1HG1 VAL 96 HG11 VAL 96 228.087 10.712 1.987 739 2HG1 VAL 96 HG12 VAL 96 228.670 12.369 2.143 740 3HG1 VAL 96 HG13 VAL 96 229.098 11.164 3.359 741 1HG2 VAL 96 HG21 VAL 96 230.409 10.142 -0.446 742 2HG2 VAL 96 HG22 VAL 96 230.163 11.888 -0.420 743 3HG2 VAL 96 HG23 VAL 96 228.803 10.802 -0.139 744 H GLU 97 HN GLU 97 233.133 13.131 3.073 745 HA GLU 97 HA GLU 97 234.201 11.261 4.764 746 1HB GLU 97 HB2 GLU 97 235.011 13.082 6.119 747 2HB GLU 97 HB1 GLU 97 235.042 13.581 4.434 748 1HG GLU 97 HG2 GLU 97 232.777 14.663 4.898 749 2HG GLU 97 HG1 GLU 97 233.164 14.438 6.602 750 H SER 98 HN SER 98 233.199 9.932 6.121 751 HA SER 98 HA SER 98 230.736 10.733 7.433 752 1HB SER 98 HB2 SER 98 231.335 8.394 6.386 753 2HB SER 98 HB1 SER 98 232.092 8.112 7.954 754 HG SER 98 HG SER 98 230.079 7.487 8.341 755 H ASP 99 HN ASP 99 230.666 9.649 9.818 756 HA ASP 99 HA ASP 99 232.275 11.359 11.410 757 1HB ASP 99 HB2 ASP 99 230.653 8.988 12.347 758 2HB ASP 99 HB1 ASP 99 231.154 10.380 13.304 759 H GLU 100 HN GLU 100 232.927 8.352 10.013 760 HA GLU 100 HA GLU 100 234.954 7.729 12.049 761 1HB GLU 100 HB2 GLU 100 233.089 6.097 10.720 762 2HB GLU 100 HB1 GLU 100 234.657 5.677 10.045 763 1HG GLU 100 HG2 GLU 100 235.313 5.674 12.625 764 2HG GLU 100 HG1 GLU 100 233.599 5.292 12.777 765 H MET 101 HN MET 101 234.461 8.306 8.611 766 HA MET 101 HA MET 101 237.381 8.280 8.243 767 1HB MET 101 HB2 MET 101 235.371 6.998 6.777 768 2HB MET 101 HB1 MET 101 235.878 8.345 5.769 769 1HG MET 101 HG2 MET 101 237.109 6.271 5.304 770 2HG MET 101 HG1 MET 101 238.157 7.592 5.815 771 1HE MET 101 HE1 MET 101 239.895 7.098 8.315 772 2HE MET 101 HE2 MET 101 239.987 6.941 6.561 773 3HE MET 101 HE3 MET 101 240.419 5.577 7.593 774 H ARG 102 HN ARG 102 238.260 9.853 6.707 775 HA ARG 102 HA ARG 102 236.763 12.166 5.976 776 1HB ARG 102 HB2 ARG 102 237.008 12.593 8.396 777 2HB ARG 102 HB1 ARG 102 238.753 12.450 8.241 778 1HG ARG 102 HG2 ARG 102 237.524 14.409 6.438 779 2HG ARG 102 HG1 ARG 102 237.375 14.782 8.157 780 1HD ARG 102 HD2 ARG 102 239.859 14.352 8.333 781 2HD ARG 102 HD1 ARG 102 239.891 14.321 6.571 782 HE ARG 102 HE ARG 102 239.676 16.603 6.556 783 1HH1 ARG 102 HH11 ARG 102 238.925 15.410 9.749 784 2HH1 ARG 102 HH12 ARG 102 238.862 16.988 10.460 785 1HH2 ARG 102 HH21 ARG 102 239.593 18.678 7.489 786 2HH2 ARG 102 HH22 ARG 102 239.242 18.843 9.177 787 HA PRO 103 HA PRO 103 240.501 11.507 3.431 788 1HB PRO 103 HB2 PRO 103 239.440 12.340 1.106 789 2HB PRO 103 HB1 PRO 103 239.101 10.733 1.761 790 1HG PRO 103 HG2 PRO 103 237.444 13.227 1.918 791 2HG PRO 103 HG1 PRO 103 236.937 11.578 1.505 792 1HD PRO 103 HD2 PRO 103 236.597 12.624 3.982 793 2HD PRO 103 HD1 PRO 103 236.909 10.898 3.715 794 H CYS 104 HN CYS 104 241.874 12.959 2.232 795 HA CYS 104 HA CYS 104 241.233 15.798 2.386 796 1HB CYS 104 HB2 CYS 104 243.024 14.466 4.210 797 2HB CYS 104 HB1 CYS 104 243.908 15.643 3.247 798 HG CYS 104 HG CYS 104 242.945 16.773 5.415 799 H TRP 105 HN TRP 105 241.853 16.812 0.598 800 HA TRP 105 HA TRP 105 243.578 15.390 -1.279 801 1HB TRP 105 HB2 TRP 105 241.906 17.882 -1.675 802 2HB TRP 105 HB1 TRP 105 242.760 17.003 -2.938 803 HD1 TRP 105 HD1 TRP 105 240.301 15.749 -0.187 804 HE1 TRP 105 HE1 TRP 105 238.475 14.343 -1.346 805 HE3 TRP 105 HE3 TRP 105 241.829 16.280 -5.038 806 HZ2 TRP 105 HZ2 TRP 105 237.782 13.571 -3.969 807 HZ3 TRP 105 HZ3 TRP 105 240.528 15.177 -6.811 808 HH2 TRP 105 HH2 TRP 105 238.547 13.850 -6.286 809 H PHE 106 HN PHE 106 245.668 15.857 -1.402 810 HA PHE 106 HA PHE 106 246.555 18.616 -0.911 811 1HB PHE 106 HB2 PHE 106 247.928 16.147 0.179 812 2HB PHE 106 HB1 PHE 106 248.486 17.805 0.361 813 HD1 PHE 106 HD1 PHE 106 245.952 19.175 1.026 814 HD2 PHE 106 HD2 PHE 106 247.532 15.452 2.347 815 HE1 PHE 106 HE1 PHE 106 244.678 19.383 3.122 816 HE2 PHE 106 HE2 PHE 106 246.261 15.651 4.444 817 HZ PHE 106 HZ PHE 106 244.831 17.619 4.834 818 H GLN 107 HN GLN 107 249.309 18.112 -1.277 819 HA GLN 107 HA GLN 107 249.342 17.733 -4.147 820 1HB GLN 107 HB2 GLN 107 251.024 19.048 -2.171 821 2HB GLN 107 HB1 GLN 107 251.968 18.110 -3.321 822 1HG GLN 107 HG2 GLN 107 251.731 20.401 -4.062 823 2HG GLN 107 HG1 GLN 107 250.913 19.299 -5.169 824 1HE2 GLN 107 HE21 GLN 107 249.046 20.028 -5.856 825 2HE2 GLN 107 HE22 GLN 107 247.948 21.030 -4.976 826 H LEU 108 HN LEU 108 250.773 16.268 -5.224 827 HA LEU 108 HA LEU 108 250.866 13.693 -3.952 828 1HB LEU 108 HB2 LEU 108 251.282 12.824 -6.052 829 2HB LEU 108 HB1 LEU 108 250.389 14.281 -6.439 830 HG LEU 108 HG LEU 108 253.393 14.003 -6.570 831 1HD1 LEU 108 HD11 LEU 108 252.477 12.699 -8.320 832 2HD1 LEU 108 HD12 LEU 108 252.960 14.236 -9.039 833 3HD1 LEU 108 HD13 LEU 108 251.261 13.922 -8.689 834 1HD2 LEU 108 HD21 LEU 108 253.387 16.176 -7.581 835 2HD2 LEU 108 HD22 LEU 108 252.541 16.278 -6.037 836 3HD2 LEU 108 HD23 LEU 108 251.626 16.239 -7.544 837 H ASP 109 HN ASP 109 252.872 16.260 -3.692 838 HA ASP 109 HA ASP 109 255.220 14.537 -3.281 839 1HB ASP 109 HB2 ASP 109 254.975 17.281 -4.442 840 2HB ASP 109 HB1 ASP 109 256.423 16.885 -3.524 841 H GLN 110 HN GLN 110 252.905 15.462 -1.533 842 HA GLN 110 HA GLN 110 254.583 16.257 0.706 843 1HB GLN 110 HB2 GLN 110 253.220 18.079 1.379 844 2HB GLN 110 HB1 GLN 110 253.567 18.321 -0.326 845 1HG GLN 110 HG2 GLN 110 251.376 17.546 -0.936 846 2HG GLN 110 HG1 GLN 110 251.022 17.117 0.737 847 1HE2 GLN 110 HE21 GLN 110 249.762 18.508 1.720 848 2HE2 GLN 110 HE22 GLN 110 249.691 20.210 1.433 849 H ILE 111 HN ILE 111 252.979 13.836 -0.213 850 HA ILE 111 HA ILE 111 250.833 13.617 1.680 851 HB ILE 111 HB ILE 111 251.886 11.013 1.019 852 1HG1 ILE 111 HG12 ILE 111 251.167 11.235 -1.463 853 2HG1 ILE 111 HG11 ILE 111 251.556 12.942 -1.259 854 1HG2 ILE 111 HG21 ILE 111 249.352 11.977 -0.125 855 2HG2 ILE 111 HG22 ILE 111 249.517 12.027 1.631 856 3HG2 ILE 111 HG23 ILE 111 249.718 10.502 0.770 857 1HD1 ILE 111 HD11 ILE 111 253.818 12.065 -0.376 858 2HD1 ILE 111 HD12 ILE 111 253.505 12.041 -2.112 859 3HD1 ILE 111 HD13 ILE 111 253.352 10.560 -1.167 860 HA PRO 112 HA PRO 112 253.537 12.531 5.035 861 1HB PRO 112 HB2 PRO 112 251.799 12.827 7.028 862 2HB PRO 112 HB1 PRO 112 252.328 14.224 6.083 863 1HG PRO 112 HG2 PRO 112 249.758 12.723 5.965 864 2HG PRO 112 HG1 PRO 112 250.061 14.452 5.729 865 1HD PRO 112 HD2 PRO 112 249.757 12.499 3.711 866 2HD PRO 112 HD1 PRO 112 250.321 14.167 3.496 867 H PHE 113 HN PHE 113 254.012 10.404 4.683 868 HA PHE 113 HA PHE 113 252.103 8.321 5.176 869 1HB PHE 113 HB2 PHE 113 254.983 7.638 5.162 870 2HB PHE 113 HB1 PHE 113 253.637 6.857 4.348 871 HD1 PHE 113 HD1 PHE 113 252.735 9.589 2.984 872 HD2 PHE 113 HD2 PHE 113 256.401 7.436 3.274 873 HE1 PHE 113 HE1 PHE 113 253.490 10.552 0.856 874 HE2 PHE 113 HE2 PHE 113 257.150 8.400 1.150 875 HZ PHE 113 HZ PHE 113 255.692 9.970 -0.066 876 H LYS 114 HN LYS 114 254.219 10.167 7.123 877 HA LYS 114 HA LYS 114 254.876 8.338 9.138 878 1HB LYS 114 HB2 LYS 114 254.649 11.317 8.981 879 2HB LYS 114 HB1 LYS 114 254.800 10.566 10.563 880 1HG LYS 114 HG2 LYS 114 256.957 9.979 10.233 881 2HG LYS 114 HG1 LYS 114 256.731 9.700 8.505 882 1HD LYS 114 HD2 LYS 114 256.760 12.067 8.068 883 2HD LYS 114 HD1 LYS 114 256.797 12.425 9.794 884 1HE LYS 114 HE2 LYS 114 259.018 12.605 9.407 885 2HE LYS 114 HE1 LYS 114 258.961 10.856 9.626 886 1HZ LYS 114 HZ1 LYS 114 260.181 11.694 7.605 887 2HZ LYS 114 HZ2 LYS 114 258.676 12.131 6.968 888 3HZ LYS 114 HZ3 LYS 114 259.007 10.509 7.318 889 H ASP 115 HN ASP 115 252.004 10.105 8.361 890 HA ASP 115 HA ASP 115 250.732 9.195 10.813 891 1HB ASP 115 HB2 ASP 115 250.162 11.390 8.883 892 2HB ASP 115 HB1 ASP 115 248.801 10.679 9.745 893 H MET 116 HN MET 116 251.448 7.458 8.595 894 HA MET 116 HA MET 116 248.789 6.368 8.015 895 1HB MET 116 HB2 MET 116 251.006 6.945 6.075 896 2HB MET 116 HB1 MET 116 249.879 5.636 5.761 897 1HG MET 116 HG2 MET 116 248.140 7.037 5.353 898 2HG MET 116 HG1 MET 116 248.747 8.287 6.436 899 1HE MET 116 HE1 MET 116 249.719 6.412 3.062 900 2HE MET 116 HE2 MET 116 251.224 6.679 3.941 901 3HE MET 116 HE3 MET 116 250.916 7.547 2.437 902 H TRP 117 HN TRP 117 249.367 4.075 6.781 903 HA TRP 117 HA TRP 117 250.150 2.338 8.770 904 1HB TRP 117 HB2 TRP 117 249.831 2.131 5.829 905 2HB TRP 117 HB1 TRP 117 250.757 0.852 6.608 906 HD1 TRP 117 HD1 TRP 117 247.354 2.606 7.329 907 HE1 TRP 117 HE1 TRP 117 245.658 0.782 7.978 908 HE3 TRP 117 HE3 TRP 117 250.403 -1.486 7.022 909 HZ2 TRP 117 HZ2 TRP 117 245.618 -2.020 8.316 910 HZ3 TRP 117 HZ3 TRP 117 249.458 -3.703 7.525 911 HH2 TRP 117 HH2 TRP 117 247.115 -3.961 8.158 912 HA PRO 118 HA PRO 118 254.568 2.311 8.729 913 1HB PRO 118 HB2 PRO 118 255.154 -0.152 9.544 914 2HB PRO 118 HB1 PRO 118 254.241 0.952 10.577 915 1HG PRO 118 HG2 PRO 118 253.258 -1.320 8.902 916 2HG PRO 118 HG1 PRO 118 252.753 -0.825 10.526 917 1HD PRO 118 HD2 PRO 118 251.420 -0.197 8.172 918 2HD PRO 118 HD1 PRO 118 251.238 0.666 9.712 919 H ASP 119 HN ASP 119 253.091 1.199 6.146 920 HA ASP 119 HA ASP 119 255.551 0.087 4.978 921 1HB ASP 119 HB2 ASP 119 254.118 -1.310 3.499 922 2HB ASP 119 HB1 ASP 119 253.972 -1.729 5.204 923 H ASP 120 HN ASP 120 253.037 2.396 4.790 924 HA ASP 120 HA ASP 120 252.707 2.970 2.140 925 1HB ASP 120 HB2 ASP 120 252.760 4.669 4.591 926 2HB ASP 120 HB1 ASP 120 252.632 5.443 3.013 927 H SER 121 HN SER 121 255.254 4.358 4.204 928 HA SER 121 HA SER 121 256.537 5.832 2.198 929 1HB SER 121 HB2 SER 121 256.865 6.067 4.684 930 2HB SER 121 HB1 SER 121 257.870 4.619 4.625 931 HG SER 121 HG SER 121 258.834 6.886 4.385 932 H TYR 122 HN TYR 122 256.517 2.443 2.702 933 HA TYR 122 HA TYR 122 259.088 1.994 1.483 934 1HB TYR 122 HB2 TYR 122 256.915 0.126 2.414 935 2HB TYR 122 HB1 TYR 122 258.401 -0.429 1.648 936 HD1 TYR 122 HD1 TYR 122 260.434 -0.557 2.867 937 HD2 TYR 122 HD2 TYR 122 257.043 1.338 4.602 938 HE1 TYR 122 HE1 TYR 122 261.580 -0.510 5.042 939 HE2 TYR 122 HE2 TYR 122 258.180 1.390 6.782 940 HH TYR 122 HH TYR 122 260.760 1.381 7.513 941 H TRP 123 HN TRP 123 255.818 2.280 0.355 942 HA TRP 123 HA TRP 123 256.753 1.246 -2.227 943 1HB TRP 123 HB2 TRP 123 254.440 0.561 -2.735 944 2HB TRP 123 HB1 TRP 123 255.115 -0.277 -1.344 945 HD1 TRP 123 HD1 TRP 123 253.986 0.158 1.017 946 HE1 TRP 123 HE1 TRP 123 251.738 1.217 1.696 947 HE3 TRP 123 HE3 TRP 123 252.802 2.445 -3.396 948 HZ2 TRP 123 HZ2 TRP 123 249.727 2.822 0.510 949 HZ3 TRP 123 HZ3 TRP 123 250.702 3.717 -3.539 950 HH2 TRP 123 HH2 TRP 123 249.200 3.894 -1.632 951 H PHE 124 HN PHE 124 254.931 3.805 -0.641 952 HA PHE 124 HA PHE 124 253.766 5.039 -2.805 953 1HB PHE 124 HB2 PHE 124 253.921 5.690 -0.209 954 2HB PHE 124 HB1 PHE 124 255.088 6.842 -0.844 955 HD1 PHE 124 HD1 PHE 124 252.894 7.993 0.479 956 HD2 PHE 124 HD2 PHE 124 253.035 6.554 -3.522 957 HE1 PHE 124 HE1 PHE 124 251.061 9.496 -0.121 958 HE2 PHE 124 HE2 PHE 124 251.194 8.060 -4.128 959 HZ PHE 124 HZ PHE 124 250.202 9.535 -2.425 960 HA PRO 125 HA PRO 125 258.049 7.480 -3.402 961 1HB PRO 125 HB2 PRO 125 259.752 5.120 -2.756 962 2HB PRO 125 HB1 PRO 125 260.062 6.839 -2.485 963 1HG PRO 125 HG2 PRO 125 259.375 5.252 -0.463 964 2HG PRO 125 HG1 PRO 125 258.755 6.910 -0.571 965 1HD PRO 125 HD2 PRO 125 257.375 4.327 -1.144 966 2HD PRO 125 HD1 PRO 125 256.729 5.821 -0.437 967 H LEU 126 HN LEU 126 257.286 4.132 -4.026 968 HA LEU 126 HA LEU 126 258.707 4.043 -6.540 969 1HB LEU 126 HB2 LEU 126 256.698 2.120 -5.359 970 2HB LEU 126 HB1 LEU 126 257.681 1.821 -6.780 971 HG LEU 126 HG LEU 126 259.031 2.452 -4.190 972 1HD1 LEU 126 HD11 LEU 126 258.388 0.600 -3.159 973 2HD1 LEU 126 HD12 LEU 126 258.812 -0.379 -4.562 974 3HD1 LEU 126 HD13 LEU 126 257.205 0.336 -4.440 975 1HD2 LEU 126 HD21 LEU 126 259.709 1.321 -6.812 976 2HD2 LEU 126 HD22 LEU 126 260.423 0.482 -5.435 977 3HD2 LEU 126 HD23 LEU 126 260.710 2.208 -5.661 978 H LEU 127 HN LEU 127 255.445 4.515 -5.369 979 HA LEU 127 HA LEU 127 254.008 4.346 -7.763 980 1HB LEU 127 HB2 LEU 127 253.619 6.023 -5.290 981 2HB LEU 127 HB1 LEU 127 252.471 6.022 -6.608 982 HG LEU 127 HG LEU 127 252.525 4.345 -4.386 983 1HD1 LEU 127 HD11 LEU 127 250.539 5.106 -5.532 984 2HD1 LEU 127 HD12 LEU 127 250.544 3.344 -5.453 985 3HD1 LEU 127 HD13 LEU 127 250.967 4.160 -6.958 986 1HD2 LEU 127 HD21 LEU 127 252.630 2.097 -5.361 987 2HD2 LEU 127 HD22 LEU 127 254.185 2.923 -5.447 988 3HD2 LEU 127 HD23 LEU 127 253.177 2.791 -6.887 989 H LEU 128 HN LEU 128 255.232 7.207 -6.087 990 HA LEU 128 HA LEU 128 254.688 9.130 -7.998 991 1HB LEU 128 HB2 LEU 128 256.667 8.863 -5.801 992 2HB LEU 128 HB1 LEU 128 256.947 10.138 -6.973 993 HG LEU 128 HG LEU 128 254.204 10.021 -5.901 994 1HD1 LEU 128 HD11 LEU 128 255.636 9.429 -3.930 995 2HD1 LEU 128 HD12 LEU 128 254.706 10.917 -3.758 996 3HD1 LEU 128 HD13 LEU 128 256.430 10.991 -4.123 997 1HD2 LEU 128 HD21 LEU 128 255.109 12.542 -5.558 998 2HD2 LEU 128 HD22 LEU 128 254.426 11.936 -7.066 999 3HD2 LEU 128 HD23 LEU 128 256.175 11.990 -6.851 1000 H GLN 129 HN GLN 129 257.235 6.755 -7.943 1001 HA GLN 129 HA GLN 129 258.761 8.012 -10.045 1002 1HB GLN 129 HB2 GLN 129 259.041 5.639 -8.313 1003 2HB GLN 129 HB1 GLN 129 259.745 5.486 -9.917 1004 1HG GLN 129 HG2 GLN 129 260.823 7.786 -9.372 1005 2HG GLN 129 HG1 GLN 129 260.470 7.345 -7.702 1006 1HE2 GLN 129 HE21 GLN 129 262.154 6.340 -10.617 1007 2HE2 GLN 129 HE22 GLN 129 263.344 5.373 -9.821 1008 H LYS 130 HN LYS 130 255.960 6.158 -9.954 1009 HA LYS 130 HA LYS 130 254.669 5.247 -11.589 1010 1HB LYS 130 HB2 LYS 130 256.764 6.107 -13.582 1011 2HB LYS 130 HB1 LYS 130 255.060 5.796 -13.879 1012 1HG LYS 130 HG2 LYS 130 254.470 7.868 -13.317 1013 2HG LYS 130 HG1 LYS 130 255.496 7.866 -11.883 1014 1HD LYS 130 HD2 LYS 130 256.816 8.047 -14.539 1015 2HD LYS 130 HD1 LYS 130 255.963 9.472 -13.941 1016 1HE LYS 130 HE2 LYS 130 257.357 8.746 -11.735 1017 2HE LYS 130 HE1 LYS 130 258.459 8.224 -13.008 1018 1HZ LYS 130 HZ1 LYS 130 258.512 10.657 -12.066 1019 2HZ LYS 130 HZ2 LYS 130 257.292 10.901 -13.212 1020 3HZ LYS 130 HZ3 LYS 130 258.813 10.346 -13.703 1021 H LYS 131 HN LYS 131 256.383 3.595 -10.187 1022 HA LYS 131 HA LYS 131 257.011 1.568 -12.225 1023 1HB LYS 131 HB2 LYS 131 258.635 1.968 -9.713 1024 2HB LYS 131 HB1 LYS 131 258.998 0.909 -11.069 1025 1HG LYS 131 HG2 LYS 131 258.722 3.744 -11.767 1026 2HG LYS 131 HG1 LYS 131 260.073 3.365 -10.697 1027 1HD LYS 131 HD2 LYS 131 261.011 3.118 -12.803 1028 2HD LYS 131 HD1 LYS 131 260.560 1.464 -12.387 1029 1HE LYS 131 HE2 LYS 131 258.289 2.295 -13.578 1030 2HE LYS 131 HE1 LYS 131 259.472 3.270 -14.450 1031 1HZ LYS 131 HZ1 LYS 131 259.668 0.325 -14.133 1032 2HZ LYS 131 HZ2 LYS 131 260.625 1.312 -15.119 1033 3HZ LYS 131 HZ3 LYS 131 258.990 1.086 -15.484 1034 H LYS 132 HN LYS 132 256.967 -0.651 -11.416 1035 HA LYS 132 HA LYS 132 254.992 -0.941 -9.257 1036 1HB LYS 132 HB2 LYS 132 255.632 -2.709 -11.620 1037 2HB LYS 132 HB1 LYS 132 254.565 -3.196 -10.310 1038 1HG LYS 132 HG2 LYS 132 253.023 -2.417 -11.782 1039 2HG LYS 132 HG1 LYS 132 253.368 -0.921 -10.912 1040 1HD LYS 132 HD2 LYS 132 253.724 -0.061 -12.955 1041 2HD LYS 132 HD1 LYS 132 255.283 -0.881 -12.849 1042 1HE LYS 132 HE2 LYS 132 252.907 -2.370 -13.872 1043 2HE LYS 132 HE1 LYS 132 253.733 -1.228 -14.931 1044 1HZ LYS 132 HZ1 LYS 132 254.629 -3.431 -15.220 1045 2HZ LYS 132 HZ2 LYS 132 254.966 -3.561 -13.568 1046 3HZ LYS 132 HZ3 LYS 132 255.805 -2.439 -14.516 1047 H PHE 133 HN PHE 133 255.506 -2.002 -7.445 1048 HA PHE 133 HA PHE 133 257.777 -3.844 -7.435 1049 1HB PHE 133 HB2 PHE 133 257.541 -1.355 -5.759 1050 2HB PHE 133 HB1 PHE 133 258.493 -2.732 -5.219 1051 HD1 PHE 133 HD1 PHE 133 260.721 -2.825 -5.769 1052 HD2 PHE 133 HD2 PHE 133 258.099 -0.487 -8.171 1053 HE1 PHE 133 HE1 PHE 133 262.644 -2.006 -7.064 1054 HE2 PHE 133 HE2 PHE 133 260.017 0.332 -9.473 1055 HZ PHE 133 HZ PHE 133 262.293 -0.426 -8.920 1056 H HIS 134 HN HIS 134 257.837 -5.235 -5.573 1057 HA HIS 134 HA HIS 134 255.236 -5.477 -4.203 1058 1HB HIS 134 HB2 HIS 134 257.119 -7.610 -5.218 1059 2HB HIS 134 HB1 HIS 134 255.856 -7.951 -4.043 1060 HD1 HIS 134 HD1 HIS 134 254.799 -9.572 -5.818 1061 HD2 HIS 134 HD2 HIS 134 254.845 -5.564 -6.915 1062 HE1 HIS 134 HE1 HIS 134 253.222 -9.389 -7.767 1063 HE2 HIS 134 HE2 HIS 134 253.255 -6.952 -8.406 1064 H GLY 135 HN GLY 135 255.304 -5.389 -2.010 1065 1HA GLY 135 HA2 GLY 135 257.968 -5.697 -0.769 1066 2HA GLY 135 HA1 GLY 135 256.805 -4.496 -0.237 1067 H TYR 136 HN TYR 136 258.193 -7.162 0.761 1068 HA TYR 136 HA TYR 136 255.765 -8.311 1.975 1069 1HB TYR 136 HB2 TYR 136 257.468 -9.718 0.539 1070 2HB TYR 136 HB1 TYR 136 258.417 -9.708 2.019 1071 HD1 TYR 136 HD1 TYR 136 255.936 -9.804 3.888 1072 HD2 TYR 136 HD2 TYR 136 257.113 -12.073 0.488 1073 HE1 TYR 136 HE1 TYR 136 254.641 -11.719 4.721 1074 HE2 TYR 136 HE2 TYR 136 255.819 -13.992 1.313 1075 HH TYR 136 HH TYR 136 253.885 -14.397 2.824 1076 H PHE 137 HN PHE 137 255.438 -7.618 3.990 1077 HA PHE 137 HA PHE 137 257.799 -7.017 5.652 1078 1HB PHE 137 HB2 PHE 137 255.073 -5.746 5.896 1079 2HB PHE 137 HB1 PHE 137 256.552 -5.272 6.725 1080 HD1 PHE 137 HD1 PHE 137 255.225 -5.704 3.265 1081 HD2 PHE 137 HD2 PHE 137 257.758 -3.513 5.888 1082 HE1 PHE 137 HE1 PHE 137 255.738 -4.128 1.446 1083 HE2 PHE 137 HE2 PHE 137 258.275 -1.937 4.076 1084 HZ PHE 137 HZ PHE 137 257.265 -2.239 1.851 1085 H LYS 138 HN LYS 138 257.917 -7.864 7.673 1086 HA LYS 138 HA LYS 138 255.935 -9.842 8.461 1087 1HB LYS 138 HB2 LYS 138 258.688 -9.120 9.450 1088 2HB LYS 138 HB1 LYS 138 257.633 -10.179 10.375 1089 1HG LYS 138 HG2 LYS 138 257.543 -11.298 7.879 1090 2HG LYS 138 HG1 LYS 138 259.207 -10.721 7.983 1091 1HD LYS 138 HD2 LYS 138 259.055 -13.003 8.801 1092 2HD LYS 138 HD1 LYS 138 259.467 -11.908 10.122 1093 1HE LYS 138 HE2 LYS 138 257.334 -12.046 11.060 1094 2HE LYS 138 HE1 LYS 138 256.620 -12.665 9.572 1095 1HZ LYS 138 HZ1 LYS 138 258.347 -14.101 11.499 1096 2HZ LYS 138 HZ2 LYS 138 258.056 -14.689 9.941 1097 3HZ LYS 138 HZ3 LYS 138 256.770 -14.484 11.020 1098 H PHE 139 HN PHE 139 254.525 -9.539 10.183 1099 HA PHE 139 HA PHE 139 254.639 -6.861 11.394 1100 1HB PHE 139 HB2 PHE 139 252.464 -8.554 10.413 1101 2HB PHE 139 HB1 PHE 139 252.142 -7.883 12.007 1102 HD1 PHE 139 HD1 PHE 139 250.346 -6.482 11.287 1103 HD2 PHE 139 HD2 PHE 139 254.197 -6.142 9.507 1104 HE1 PHE 139 HE1 PHE 139 249.676 -4.353 10.253 1105 HE2 PHE 139 HE2 PHE 139 253.533 -4.011 8.472 1106 HZ PHE 139 HZ PHE 139 251.271 -3.114 8.846 1107 H GLN 140 HN GLN 140 253.765 -6.653 13.595 1108 HA GLN 140 HA GLN 140 254.177 -8.981 15.318 1109 1HB GLN 140 HB2 GLN 140 256.320 -7.920 15.374 1110 2HB GLN 140 HB1 GLN 140 255.602 -6.331 15.546 1111 1HG GLN 140 HG2 GLN 140 256.630 -7.237 17.616 1112 2HG GLN 140 HG1 GLN 140 254.937 -6.784 17.782 1113 1HE2 GLN 140 HE21 GLN 140 253.480 -8.285 18.379 1114 2HE2 GLN 140 HE22 GLN 140 253.855 -9.943 18.690 1115 H GLY 141 HN GLY 141 251.830 -8.820 15.390 1116 1HA GLY 141 HA2 GLY 141 250.268 -8.371 17.193 1117 2HA GLY 141 HA1 GLY 141 250.974 -6.769 17.333 1118 H GLN 142 HN GLN 142 250.792 -5.435 15.220 1119 HA GLN 142 HA GLN 142 248.757 -5.970 13.369 1120 1HB GLN 142 HB2 GLN 142 247.847 -4.966 15.937 1121 2HB GLN 142 HB1 GLN 142 247.390 -3.891 14.623 1122 1HG GLN 142 HG2 GLN 142 246.914 -6.792 14.252 1123 2HG GLN 142 HG1 GLN 142 245.880 -5.924 15.387 1124 1HE2 GLN 142 HE21 GLN 142 244.153 -4.972 14.582 1125 2HE2 GLN 142 HE22 GLN 142 243.896 -4.565 12.923 1126 H ASP 143 HN ASP 143 250.550 -3.500 15.151 1127 HA ASP 143 HA ASP 143 250.713 -1.964 12.640 1128 1HB ASP 143 HB2 ASP 143 250.676 -0.738 15.399 1129 2HB ASP 143 HB1 ASP 143 250.624 0.105 13.855 1130 H THR 144 HN THR 144 252.536 -3.964 14.088 1131 HA THR 144 HA THR 144 254.914 -2.221 14.146 1132 HB THR 144 HB THR 144 254.405 -4.766 15.692 1133 HG1 THR 144 HG1 THR 144 253.527 -2.820 16.573 1134 1HG2 THR 144 HG21 THR 144 256.903 -3.096 15.586 1135 2HG2 THR 144 HG22 THR 144 256.713 -4.735 14.964 1136 3HG2 THR 144 HG23 THR 144 256.598 -4.430 16.698 1137 H ILE 145 HN ILE 145 256.607 -2.743 12.855 1138 HA ILE 145 HA ILE 145 256.313 -5.218 11.310 1139 HB ILE 145 HB ILE 145 257.892 -2.804 10.442 1140 1HG1 ILE 145 HG12 ILE 145 255.113 -3.694 9.631 1141 2HG1 ILE 145 HG11 ILE 145 255.508 -2.243 10.544 1142 1HG2 ILE 145 HG21 ILE 145 258.643 -4.935 9.518 1143 2HG2 ILE 145 HG22 ILE 145 257.897 -3.938 8.268 1144 3HG2 ILE 145 HG23 ILE 145 257.004 -5.287 8.972 1145 1HD1 ILE 145 HD11 ILE 145 256.482 -2.760 7.749 1146 2HD1 ILE 145 HD12 ILE 145 256.566 -1.254 8.662 1147 3HD1 ILE 145 HD13 ILE 145 255.005 -1.876 8.130 1148 H LEU 146 HN LEU 146 257.934 -6.652 11.205 1149 HA LEU 146 HA LEU 146 260.330 -6.055 12.807 1150 1HB LEU 146 HB2 LEU 146 259.351 -8.829 12.236 1151 2HB LEU 146 HB1 LEU 146 260.390 -8.274 13.537 1152 HG LEU 146 HG LEU 146 257.508 -7.427 13.368 1153 1HD1 LEU 146 HD11 LEU 146 256.891 -9.534 13.711 1154 2HD1 LEU 146 HD12 LEU 146 257.633 -9.387 15.305 1155 3HD1 LEU 146 HD13 LEU 146 258.552 -10.069 13.963 1156 1HD2 LEU 146 HD21 LEU 146 259.521 -6.531 14.932 1157 2HD2 LEU 146 HD22 LEU 146 258.893 -7.840 15.933 1158 3HD2 LEU 146 HD23 LEU 146 257.825 -6.537 15.412 1159 H ASP 147 HN ASP 147 259.160 -6.844 9.707 1160 HA ASP 147 HA ASP 147 261.850 -6.923 8.665 1161 1HB ASP 147 HB2 ASP 147 260.638 -9.343 9.217 1162 2HB ASP 147 HB1 ASP 147 260.272 -9.106 7.512 1163 H TYR 148 HN TYR 148 261.968 -6.082 6.605 1164 HA TYR 148 HA TYR 148 259.466 -5.837 5.117 1165 1HB TYR 148 HB2 TYR 148 259.807 -3.481 4.667 1166 2HB TYR 148 HB1 TYR 148 259.680 -3.769 6.399 1167 HD1 TYR 148 HD1 TYR 148 261.424 -3.139 7.864 1168 HD2 TYR 148 HD2 TYR 148 262.088 -3.093 3.661 1169 HE1 TYR 148 HE1 TYR 148 263.556 -1.965 8.219 1170 HE2 TYR 148 HE2 TYR 148 264.221 -1.920 4.005 1171 HH TYR 148 HH TYR 148 265.038 -0.310 6.600 1172 H THR 149 HN THR 149 259.664 -6.158 2.984 1173 HA THR 149 HA THR 149 262.358 -5.992 1.813 1174 HB THR 149 HB THR 149 261.181 -7.962 0.329 1175 HG1 THR 149 HG1 THR 149 259.492 -7.965 2.028 1176 1HG2 THR 149 HG21 THR 149 262.961 -8.175 2.727 1177 2HG2 THR 149 HG22 THR 149 263.390 -8.267 1.019 1178 3HG2 THR 149 HG23 THR 149 262.486 -9.581 1.774 1179 H LEU 150 HN LEU 150 262.461 -5.312 -0.327 1180 HA LEU 150 HA LEU 150 259.931 -4.490 -1.572 1181 1HB LEU 150 HB2 LEU 150 261.802 -2.737 -0.438 1182 2HB LEU 150 HB1 LEU 150 262.080 -2.637 -2.162 1183 HG LEU 150 HG LEU 150 260.548 -0.954 -1.879 1184 1HD1 LEU 150 HD11 LEU 150 258.526 -1.576 -2.864 1185 2HD1 LEU 150 HD12 LEU 150 258.556 -3.179 -2.131 1186 3HD1 LEU 150 HD13 LEU 150 259.680 -2.782 -3.430 1187 1HD2 LEU 150 HD21 LEU 150 260.037 -0.940 0.362 1188 2HD2 LEU 150 HD22 LEU 150 259.494 -2.618 0.359 1189 3HD2 LEU 150 HD23 LEU 150 258.480 -1.362 -0.352 1190 H ARG 151 HN ARG 151 259.764 -5.383 -3.522 1191 HA ARG 151 HA ARG 151 262.232 -5.831 -5.072 1192 1HB ARG 151 HB2 ARG 151 259.787 -7.608 -4.976 1193 2HB ARG 151 HB1 ARG 151 261.193 -7.862 -5.999 1194 1HG ARG 151 HG2 ARG 151 261.325 -7.781 -2.996 1195 2HG ARG 151 HG1 ARG 151 261.102 -9.264 -3.928 1196 1HD ARG 151 HD2 ARG 151 263.358 -7.479 -4.668 1197 2HD ARG 151 HD1 ARG 151 263.502 -8.413 -3.180 1198 HE ARG 151 HE ARG 151 262.670 -10.084 -5.298 1199 1HH1 ARG 151 HH11 ARG 151 265.479 -8.387 -4.110 1200 2HH1 ARG 151 HH12 ARG 151 266.604 -9.494 -4.822 1201 1HH2 ARG 151 HH21 ARG 151 264.149 -11.543 -6.235 1202 2HH2 ARG 151 HH22 ARG 151 265.849 -11.285 -6.029 1203 H GLU 152 HN GLU 152 261.914 -5.909 -7.420 1204 HA GLU 152 HA GLU 152 259.904 -3.941 -8.229 1205 1HB GLU 152 HB2 GLU 152 261.239 -3.638 -10.232 1206 2HB GLU 152 HB1 GLU 152 262.271 -3.522 -8.814 1207 1HG GLU 152 HG2 GLU 152 263.510 -5.268 -9.427 1208 2HG GLU 152 HG1 GLU 152 262.102 -6.220 -9.899 1209 H VAL 153 HN VAL 153 258.507 -4.286 -9.983 1210 HA VAL 153 HA VAL 153 258.373 -6.990 -11.093 1211 HB VAL 153 HB VAL 153 255.908 -7.056 -10.730 1212 1HG1 VAL 153 HG11 VAL 153 256.048 -7.990 -8.591 1213 2HG1 VAL 153 HG12 VAL 153 257.307 -6.865 -8.082 1214 3HG1 VAL 153 HG13 VAL 153 257.682 -8.144 -9.236 1215 1HG2 VAL 153 HG21 VAL 153 256.112 -4.429 -10.118 1216 2HG2 VAL 153 HG22 VAL 153 256.052 -5.138 -8.504 1217 3HG2 VAL 153 HG23 VAL 153 254.751 -5.450 -9.653 1218 H ASP 154 HN ASP 154 257.340 -7.134 -13.095 1219 HA ASP 154 HA ASP 154 256.513 -4.586 -14.311 1220 1HB ASP 154 HB2 ASP 154 258.864 -5.322 -14.959 1221 2HB ASP 154 HB1 ASP 154 258.109 -6.678 -15.790 1222 H THR 155 HN THR 155 256.506 -8.123 -14.653 1223 HA THR 155 HA THR 155 254.248 -8.092 -16.435 1224 HB THR 155 HB THR 155 255.449 -10.437 -14.951 1225 HG1 THR 155 HG1 THR 155 257.101 -9.878 -16.157 1226 1HG2 THR 155 HG21 THR 155 254.655 -11.675 -17.001 1227 2HG2 THR 155 HG22 THR 155 253.674 -10.253 -17.361 1228 3HG2 THR 155 HG23 THR 155 253.409 -11.152 -15.866 1229 H VAL 156 HN VAL 156 252.172 -8.043 -15.892 1230 HA VAL 156 HA VAL 156 251.379 -7.977 -13.138 1231 HB VAL 156 HB VAL 156 249.591 -8.063 -15.570 1232 1HG1 VAL 156 HG11 VAL 156 249.165 -7.621 -12.677 1233 2HG1 VAL 156 HG12 VAL 156 248.099 -8.334 -13.887 1234 3HG1 VAL 156 HG13 VAL 156 248.265 -6.581 -13.781 1235 1HG2 VAL 156 HG21 VAL 156 249.957 -5.883 -15.980 1236 2HG2 VAL 156 HG22 VAL 156 251.474 -6.155 -15.123 1237 3HG2 VAL 156 HG23 VAL 156 250.087 -5.480 -14.268 Start of MODEL 16 1 1H MET 1 HT1 MET 1 244.793 -24.944 1.238 2 2H MET 1 HT2 MET 1 244.330 -25.937 2.560 3 3H MET 1 HT3 MET 1 244.950 -24.361 2.842 4 HA MET 1 HA MET 1 242.515 -24.843 1.284 5 1HB MET 1 HB2 MET 1 242.475 -25.838 3.629 6 2HB MET 1 HB1 MET 1 242.646 -24.193 4.227 7 1HG MET 1 HG2 MET 1 240.557 -23.552 3.271 8 2HG MET 1 HG1 MET 1 240.414 -25.091 2.425 9 1HE MET 1 HE1 MET 1 238.429 -24.120 6.190 10 2HE MET 1 HE2 MET 1 238.139 -23.719 4.497 11 3HE MET 1 HE3 MET 1 239.526 -23.032 5.341 12 H GLY 2 HN GLY 2 244.630 -23.006 0.766 13 1HA GLY 2 HA2 GLY 2 244.812 -20.789 0.180 14 2HA GLY 2 HA1 GLY 2 243.143 -20.581 0.688 15 H ALA 3 HN ALA 3 246.473 -20.743 1.852 16 HA ALA 3 HA ALA 3 245.653 -19.354 4.307 17 1HB ALA 3 HB1 ALA 3 248.062 -20.998 3.605 18 2HB ALA 3 HB2 ALA 3 246.890 -21.246 4.898 19 3HB ALA 3 HB3 ALA 3 248.053 -19.926 5.005 20 H SER 4 HN SER 4 245.395 -17.326 3.186 21 HA SER 4 HA SER 4 247.614 -15.633 3.402 22 1HB SER 4 HB2 SER 4 248.658 -16.191 1.462 23 2HB SER 4 HB1 SER 4 247.194 -16.860 0.747 24 HG SER 4 HG SER 4 247.136 -15.071 -0.343 25 H ARG 5 HN ARG 5 246.186 -14.382 4.512 26 HA ARG 5 HA ARG 5 243.655 -13.588 3.621 27 1HB ARG 5 HB2 ARG 5 245.502 -12.834 5.755 28 2HB ARG 5 HB1 ARG 5 244.554 -11.474 5.171 29 1HG ARG 5 HG2 ARG 5 243.508 -12.611 7.077 30 2HG ARG 5 HG1 ARG 5 242.501 -12.655 5.628 31 1HD ARG 5 HD2 ARG 5 243.316 -14.937 5.169 32 2HD ARG 5 HD1 ARG 5 244.248 -14.885 6.664 33 HE ARG 5 HE ARG 5 241.738 -14.347 7.499 34 1HH1 ARG 5 HH11 ARG 5 243.085 -16.886 5.520 35 2HH1 ARG 5 HH12 ARG 5 241.910 -18.061 6.008 36 1HH2 ARG 5 HH21 ARG 5 240.192 -15.890 8.142 37 2HH2 ARG 5 HH22 ARG 5 240.268 -17.496 7.496 38 H LEU 6 HN LEU 6 243.668 -12.939 1.510 39 HA LEU 6 HA LEU 6 245.457 -10.825 0.649 40 1HB LEU 6 HB2 LEU 6 244.498 -12.891 -0.706 41 2HB LEU 6 HB1 LEU 6 243.190 -11.772 -1.039 42 HG LEU 6 HG LEU 6 245.996 -10.878 -1.536 43 1HD1 LEU 6 HD11 LEU 6 245.529 -11.777 -3.937 44 2HD1 LEU 6 HD12 LEU 6 244.496 -12.931 -3.095 45 3HD1 LEU 6 HD13 LEU 6 246.214 -12.844 -2.710 46 1HD2 LEU 6 HD21 LEU 6 243.733 -9.548 -1.764 47 2HD2 LEU 6 HD22 LEU 6 243.664 -10.379 -3.318 48 3HD2 LEU 6 HD23 LEU 6 245.036 -9.339 -2.933 49 H TYR 7 HN TYR 7 245.033 -8.776 0.908 50 HA TYR 7 HA TYR 7 242.232 -7.875 0.976 51 1HB TYR 7 HB2 TYR 7 244.565 -7.100 2.702 52 2HB TYR 7 HB1 TYR 7 243.229 -5.981 2.454 53 HD1 TYR 7 HD1 TYR 7 241.695 -5.950 4.166 54 HD2 TYR 7 HD2 TYR 7 243.601 -9.632 3.207 55 HE1 TYR 7 HE1 TYR 7 240.427 -7.066 5.953 56 HE2 TYR 7 HE2 TYR 7 242.337 -10.758 4.990 57 HH TYR 7 HH TYR 7 239.661 -9.594 6.365 58 H THR 8 HN THR 8 242.342 -5.284 0.779 59 HA THR 8 HA THR 8 244.084 -4.673 -1.519 60 HB THR 8 HB THR 8 242.276 -3.544 -2.618 61 HG1 THR 8 HG1 THR 8 241.028 -2.659 -1.113 62 1HG2 THR 8 HG21 THR 8 240.445 -5.438 -2.542 63 2HG2 THR 8 HG22 THR 8 241.739 -6.313 -1.723 64 3HG2 THR 8 HG23 THR 8 241.997 -5.673 -3.345 65 H LEU 9 HN LEU 9 244.205 -2.300 -1.956 66 HA LEU 9 HA LEU 9 243.690 -0.513 0.253 67 1HB LEU 9 HB2 LEU 9 245.906 -1.765 0.688 68 2HB LEU 9 HB1 LEU 9 246.546 -0.815 -0.637 69 HG LEU 9 HG LEU 9 245.444 0.248 1.955 70 1HD1 LEU 9 HD11 LEU 9 248.210 -0.009 0.827 71 2HD1 LEU 9 HD12 LEU 9 247.590 -0.608 2.365 72 3HD1 LEU 9 HD13 LEU 9 247.820 1.123 2.122 73 1HD2 LEU 9 HD21 LEU 9 244.847 1.874 0.398 74 2HD2 LEU 9 HD22 LEU 9 246.309 1.627 -0.557 75 3HD2 LEU 9 HD23 LEU 9 246.404 2.426 1.013 76 H VAL 10 HN VAL 10 242.747 1.089 -0.911 77 HA VAL 10 HA VAL 10 244.011 1.875 -3.431 78 HB VAL 10 HB VAL 10 241.826 1.326 -3.940 79 1HG1 VAL 10 HG11 VAL 10 239.936 2.406 -2.469 80 2HG1 VAL 10 HG12 VAL 10 241.204 2.314 -1.250 81 3HG1 VAL 10 HG13 VAL 10 240.673 0.853 -2.083 82 1HG2 VAL 10 HG21 VAL 10 242.415 3.591 -4.744 83 2HG2 VAL 10 HG22 VAL 10 241.605 4.262 -3.329 84 3HG2 VAL 10 HG23 VAL 10 240.682 3.360 -4.527 85 H LEU 11 HN LEU 11 245.095 3.635 -3.524 86 HA LEU 11 HA LEU 11 244.432 5.874 -1.737 87 1HB LEU 11 HB2 LEU 11 246.833 4.335 -1.889 88 2HB LEU 11 HB1 LEU 11 247.183 5.953 -2.466 89 HG LEU 11 HG LEU 11 246.203 5.122 0.262 90 1HD1 LEU 11 HD11 LEU 11 248.200 6.907 0.654 91 2HD1 LEU 11 HD12 LEU 11 248.701 6.182 -0.872 92 3HD1 LEU 11 HD13 LEU 11 248.440 5.163 0.539 93 1HD2 LEU 11 HD21 LEU 11 246.350 7.745 0.579 94 2HD2 LEU 11 HD22 LEU 11 244.858 6.946 0.081 95 3HD2 LEU 11 HD23 LEU 11 245.886 7.725 -1.123 96 H VAL 12 HN VAL 12 243.649 7.446 -3.002 97 HA VAL 12 HA VAL 12 244.275 7.556 -5.800 98 HB VAL 12 HB VAL 12 242.779 9.647 -4.234 99 1HG1 VAL 12 HG11 VAL 12 243.025 8.904 -7.119 100 2HG1 VAL 12 HG12 VAL 12 243.121 10.493 -6.359 101 3HG1 VAL 12 HG13 VAL 12 241.561 9.690 -6.529 102 1HG2 VAL 12 HG21 VAL 12 240.827 8.129 -5.309 103 2HG2 VAL 12 HG22 VAL 12 241.423 7.932 -3.661 104 3HG2 VAL 12 HG23 VAL 12 242.027 6.888 -4.947 105 H LEU 13 HN LEU 13 246.480 7.934 -5.889 106 HA LEU 13 HA LEU 13 247.381 10.592 -4.996 107 1HB LEU 13 HB2 LEU 13 248.521 8.510 -4.118 108 2HB LEU 13 HB1 LEU 13 249.137 8.283 -5.742 109 HG LEU 13 HG LEU 13 250.870 9.533 -5.187 110 1HD1 LEU 13 HD11 LEU 13 250.557 11.999 -4.817 111 2HD1 LEU 13 HD12 LEU 13 248.827 11.710 -4.958 112 3HD1 LEU 13 HD13 LEU 13 249.893 11.345 -6.312 113 1HD2 LEU 13 HD21 LEU 13 251.172 9.395 -2.994 114 2HD2 LEU 13 HD22 LEU 13 249.441 9.511 -2.682 115 3HD2 LEU 13 HD23 LEU 13 250.402 10.977 -2.876 116 H GLN 14 HN GLN 14 247.521 12.046 -6.539 117 HA GLN 14 HA GLN 14 248.007 11.167 -9.304 118 1HB GLN 14 HB2 GLN 14 246.909 13.839 -8.427 119 2HB GLN 14 HB1 GLN 14 246.903 13.155 -10.047 120 1HG GLN 14 HG2 GLN 14 245.031 11.999 -9.683 121 2HG GLN 14 HG1 GLN 14 245.539 11.498 -8.070 122 1HE2 GLN 14 HE21 GLN 14 243.105 12.892 -9.491 123 2HE2 GLN 14 HE22 GLN 14 242.656 14.096 -8.337 124 HA PRO 15 HA PRO 15 251.945 13.148 -9.409 125 1HB PRO 15 HB2 PRO 15 251.286 14.389 -12.001 126 2HB PRO 15 HB1 PRO 15 252.530 13.198 -11.609 127 1HG PRO 15 HG2 PRO 15 250.344 12.534 -13.015 128 2HG PRO 15 HG1 PRO 15 251.089 11.412 -11.861 129 1HD PRO 15 HD2 PRO 15 248.650 13.120 -11.540 130 2HD PRO 15 HD1 PRO 15 248.928 11.442 -11.022 131 H GLN 16 HN GLN 16 249.676 14.724 -8.256 132 HA GLN 16 HA GLN 16 251.007 17.252 -8.160 133 1HB GLN 16 HB2 GLN 16 248.766 18.447 -8.747 134 2HB GLN 16 HB1 GLN 16 249.829 17.917 -10.043 135 1HG GLN 16 HG2 GLN 16 248.318 16.495 -10.852 136 2HG GLN 16 HG1 GLN 16 247.898 15.889 -9.250 137 1HE2 GLN 16 HE21 GLN 16 247.651 19.062 -10.819 138 2HE2 GLN 16 HE22 GLN 16 245.965 19.273 -10.512 139 H ARG 17 HN ARG 17 248.160 15.326 -7.345 140 HA ARG 17 HA ARG 17 248.323 16.350 -4.612 141 1HB ARG 17 HB2 ARG 17 245.620 16.040 -5.869 142 2HB ARG 17 HB1 ARG 17 246.080 16.972 -4.454 143 1HG ARG 17 HG2 ARG 17 247.470 18.339 -6.227 144 2HG ARG 17 HG1 ARG 17 246.262 17.675 -7.331 145 1HD ARG 17 HD2 ARG 17 245.169 18.770 -4.839 146 2HD ARG 17 HD1 ARG 17 245.961 19.958 -5.872 147 HE ARG 17 HE ARG 17 243.483 18.590 -6.379 148 1HH1 ARG 17 HH11 ARG 17 246.180 20.264 -7.831 149 2HH1 ARG 17 HH12 ARG 17 245.301 20.705 -9.256 150 1HH2 ARG 17 HH21 ARG 17 242.326 19.169 -8.253 151 2HH2 ARG 17 HH22 ARG 17 243.112 20.084 -9.496 152 H VAL 18 HN VAL 18 247.110 15.000 -3.053 153 HA VAL 18 HA VAL 18 246.626 12.252 -3.991 154 HB VAL 18 HB VAL 18 248.844 12.141 -3.124 155 1HG1 VAL 18 HG11 VAL 18 249.614 13.099 -1.150 156 2HG1 VAL 18 HG12 VAL 18 247.989 13.272 -0.487 157 3HG1 VAL 18 HG13 VAL 18 248.524 14.325 -1.797 158 1HG2 VAL 18 HG21 VAL 18 246.944 11.167 -0.993 159 2HG2 VAL 18 HG22 VAL 18 248.595 10.601 -1.252 160 3HG2 VAL 18 HG23 VAL 18 247.360 10.305 -2.475 161 H LEU 19 HN LEU 19 245.260 11.001 -2.608 162 HA LEU 19 HA LEU 19 243.681 12.611 -0.709 163 1HB LEU 19 HB2 LEU 19 242.454 12.126 -2.801 164 2HB LEU 19 HB1 LEU 19 242.677 10.412 -2.515 165 HG LEU 19 HG LEU 19 241.275 10.484 -0.559 166 1HD1 LEU 19 HD11 LEU 19 241.671 13.390 -0.841 167 2HD1 LEU 19 HD12 LEU 19 241.462 12.404 0.606 168 3HD1 LEU 19 HD13 LEU 19 240.058 12.873 -0.351 169 1HD2 LEU 19 HD21 LEU 19 240.070 11.934 -2.911 170 2HD2 LEU 19 HD22 LEU 19 239.143 11.229 -1.588 171 3HD2 LEU 19 HD23 LEU 19 240.108 10.192 -2.638 172 H LEU 20 HN LEU 20 243.561 11.837 1.299 173 HA LEU 20 HA LEU 20 244.196 8.992 1.736 174 1HB LEU 20 HB2 LEU 20 245.323 11.426 2.971 175 2HB LEU 20 HB1 LEU 20 244.933 10.128 4.081 176 HG LEU 20 HG LEU 20 246.619 9.628 1.648 177 1HD1 LEU 20 HD11 LEU 20 248.596 10.111 2.838 178 2HD1 LEU 20 HD12 LEU 20 247.725 10.300 4.360 179 3HD1 LEU 20 HD13 LEU 20 247.541 11.504 3.084 180 1HD2 LEU 20 HD21 LEU 20 247.284 7.676 2.754 181 2HD2 LEU 20 HD22 LEU 20 245.549 7.782 3.054 182 3HD2 LEU 20 HD23 LEU 20 246.693 8.251 4.312 183 H GLY 21 HN GLY 21 242.762 7.865 2.901 184 1HA GLY 21 HA2 GLY 21 240.349 9.183 3.780 185 2HA GLY 21 HA1 GLY 21 240.668 7.457 3.813 186 H MET 22 HN MET 22 239.927 9.914 5.746 187 HA MET 22 HA MET 22 241.572 8.928 7.980 188 1HB MET 22 HB2 MET 22 242.025 11.248 7.677 189 2HB MET 22 HB1 MET 22 240.320 11.630 7.501 190 1HG MET 22 HG2 MET 22 239.905 11.277 9.801 191 2HG MET 22 HG1 MET 22 241.487 10.540 10.044 192 1HE MET 22 HE1 MET 22 243.851 13.564 9.413 193 2HE MET 22 HE2 MET 22 243.488 11.951 8.804 194 3HE MET 22 HE3 MET 22 243.817 12.192 10.518 195 H LYS 23 HN LYS 23 240.561 8.299 9.888 196 HA LYS 23 HA LYS 23 237.740 7.683 9.618 197 1HB LYS 23 HB2 LYS 23 239.943 6.836 11.447 198 2HB LYS 23 HB1 LYS 23 238.283 6.666 11.999 199 1HG LYS 23 HG2 LYS 23 238.629 5.642 9.315 200 2HG LYS 23 HG1 LYS 23 239.722 4.867 10.463 201 1HD LYS 23 HD2 LYS 23 236.730 5.121 10.766 202 2HD LYS 23 HD1 LYS 23 237.599 3.660 10.292 203 1HE LYS 23 HE2 LYS 23 238.883 3.976 12.506 204 2HE LYS 23 HE1 LYS 23 237.560 5.056 12.944 205 1HZ LYS 23 HZ1 LYS 23 237.616 2.188 12.825 206 2HZ LYS 23 HZ2 LYS 23 236.286 2.850 12.015 207 3HZ LYS 23 HZ3 LYS 23 236.549 3.215 13.646 208 H LYS 24 HN LYS 24 236.135 8.396 11.045 209 HA LYS 24 HA LYS 24 236.750 10.962 12.265 210 1HB LYS 24 HB2 LYS 24 234.292 9.597 11.323 211 2HB LYS 24 HB1 LYS 24 234.101 10.678 12.696 212 1HG LYS 24 HG2 LYS 24 234.223 12.476 11.403 213 2HG LYS 24 HG1 LYS 24 235.693 11.896 10.618 214 1HD LYS 24 HD2 LYS 24 234.475 10.695 8.998 215 2HD LYS 24 HD1 LYS 24 232.974 10.828 9.916 216 1HE LYS 24 HE2 LYS 24 234.367 13.288 8.942 217 2HE LYS 24 HE1 LYS 24 233.358 12.349 7.842 218 1HZ LYS 24 HZ1 LYS 24 232.555 13.776 10.301 219 2HZ LYS 24 HZ2 LYS 24 231.592 12.551 9.643 220 3HZ LYS 24 HZ3 LYS 24 231.934 13.937 8.736 221 H ARG 25 HN ARG 25 235.950 7.703 13.157 222 HA ARG 25 HA ARG 25 236.754 8.154 15.826 223 1HB ARG 25 HB2 ARG 25 234.483 7.381 16.793 224 2HB ARG 25 HB1 ARG 25 234.680 9.068 16.342 225 1HG ARG 25 HG2 ARG 25 232.524 8.165 15.624 226 2HG ARG 25 HG1 ARG 25 233.514 8.678 14.255 227 1HD ARG 25 HD2 ARG 25 233.884 6.537 13.542 228 2HD ARG 25 HD1 ARG 25 233.691 5.852 15.155 229 HE ARG 25 HE ARG 25 231.281 6.959 14.012 230 1HH1 ARG 25 HH11 ARG 25 233.264 4.108 14.376 231 2HH1 ARG 25 HH12 ARG 25 231.958 3.011 14.075 232 1HH2 ARG 25 HH21 ARG 25 229.565 5.516 13.615 233 2HH2 ARG 25 HH22 ARG 25 229.860 3.810 13.641 234 H GLY 26 HN GLY 26 236.941 6.238 17.065 235 1HA GLY 26 HA2 GLY 26 236.546 3.858 17.311 236 2HA GLY 26 HA1 GLY 26 236.436 3.752 15.560 237 H PHE 27 HN PHE 27 238.104 2.667 14.769 238 HA PHE 27 HA PHE 27 240.706 2.875 16.105 239 1HB PHE 27 HB2 PHE 27 239.484 0.848 14.253 240 2HB PHE 27 HB1 PHE 27 241.228 0.915 14.485 241 HD1 PHE 27 HD1 PHE 27 238.045 -0.042 15.917 242 HD2 PHE 27 HD2 PHE 27 242.194 0.472 16.711 243 HE1 PHE 27 HE1 PHE 27 237.819 -1.401 17.955 244 HE2 PHE 27 HE2 PHE 27 241.977 -0.889 18.750 245 HZ PHE 27 HZ PHE 27 239.787 -1.828 19.373 246 H GLY 28 HN GLY 28 241.115 5.003 15.218 247 1HA GLY 28 HA2 GLY 28 242.939 5.391 13.404 248 2HA GLY 28 HA1 GLY 28 241.596 5.066 12.321 249 H ALA 29 HN ALA 29 239.940 6.484 14.592 250 HA ALA 29 HA ALA 29 239.363 8.833 13.370 251 1HB ALA 29 HB1 ALA 29 238.119 9.308 15.147 252 2HB ALA 29 HB2 ALA 29 239.443 9.053 16.284 253 3HB ALA 29 HB3 ALA 29 238.559 7.671 15.635 254 H GLY 30 HN GLY 30 240.909 10.208 12.584 255 1HA GLY 30 HA2 GLY 30 242.076 12.262 13.261 256 2HA GLY 30 HA1 GLY 30 242.789 11.333 14.570 257 H ARG 31 HN ARG 31 242.855 9.199 12.153 258 HA ARG 31 HA ARG 31 245.473 10.136 11.178 259 1HB ARG 31 HB2 ARG 31 244.508 7.418 11.993 260 2HB ARG 31 HB1 ARG 31 245.801 7.566 10.811 261 1HG ARG 31 HG2 ARG 31 246.850 9.146 12.622 262 2HG ARG 31 HG1 ARG 31 245.789 8.244 13.706 263 1HD ARG 31 HD2 ARG 31 247.207 6.492 11.887 264 2HD ARG 31 HD1 ARG 31 248.316 7.488 12.828 265 HE ARG 31 HE ARG 31 247.719 6.326 14.712 266 1HH1 ARG 31 HH11 ARG 31 245.442 5.615 12.163 267 2HH1 ARG 31 HH12 ARG 31 244.668 4.340 13.041 268 1HH2 ARG 31 HH21 ARG 31 246.701 4.647 15.867 269 2HH2 ARG 31 HH22 ARG 31 245.381 3.791 15.142 270 H TRP 32 HN TRP 32 246.068 9.440 9.008 271 HA TRP 32 HA TRP 32 243.701 9.137 7.282 272 1HB TRP 32 HB2 TRP 32 246.135 10.027 5.926 273 2HB TRP 32 HB1 TRP 32 244.507 10.688 5.865 274 HD1 TRP 32 HD1 TRP 32 247.387 10.722 8.493 275 HE1 TRP 32 HE1 TRP 32 247.525 13.101 9.458 276 HE3 TRP 32 HE3 TRP 32 243.576 12.897 5.867 277 HZ2 TRP 32 HZ2 TRP 32 246.215 15.575 9.142 278 HZ3 TRP 32 HZ3 TRP 32 243.089 15.276 6.257 279 HH2 TRP 32 HH2 TRP 32 244.380 16.587 7.859 280 H ASN 33 HN ASN 33 243.880 7.776 5.415 281 HA ASN 33 HA ASN 33 246.121 6.226 4.779 282 1HB ASN 33 HB2 ASN 33 245.332 5.366 7.158 283 2HB ASN 33 HB1 ASN 33 244.169 4.465 6.192 284 1HD2 ASN 33 HD21 ASN 33 244.914 2.902 4.737 285 2HD2 ASN 33 HD22 ASN 33 246.495 2.219 4.875 286 H GLY 34 HN GLY 34 245.674 4.549 3.210 287 1HA GLY 34 HA2 GLY 34 243.720 5.292 1.344 288 2HA GLY 34 HA1 GLY 34 244.614 3.779 1.330 289 H PHE 35 HN PHE 35 242.200 3.509 0.404 290 HA PHE 35 HA PHE 35 240.446 2.702 2.611 291 1HB PHE 35 HB2 PHE 35 239.564 2.581 -0.240 292 2HB PHE 35 HB1 PHE 35 238.637 2.959 1.201 293 HD1 PHE 35 HD1 PHE 35 238.826 5.207 2.235 294 HD2 PHE 35 HD2 PHE 35 240.600 4.282 -1.520 295 HE1 PHE 35 HE1 PHE 35 239.025 7.609 1.742 296 HE2 PHE 35 HE2 PHE 35 240.803 6.681 -2.021 297 HZ PHE 35 HZ PHE 35 240.016 8.349 -0.388 298 H GLY 36 HN GLY 36 241.190 0.735 3.259 299 1HA GLY 36 HA2 GLY 36 242.095 -1.258 1.432 300 2HA GLY 36 HA1 GLY 36 241.803 -1.482 3.149 301 H GLY 37 HN GLY 37 241.210 -3.495 1.434 302 1HA GLY 37 HA2 GLY 37 238.449 -3.945 1.973 303 2HA GLY 37 HA1 GLY 37 238.709 -3.617 0.265 304 H LYS 38 HN LYS 38 238.315 -6.048 2.375 305 HA LYS 38 HA LYS 38 240.369 -7.855 1.525 306 1HB LYS 38 HB2 LYS 38 239.197 -9.520 2.822 307 2HB LYS 38 HB1 LYS 38 239.261 -8.018 3.733 308 1HG LYS 38 HG2 LYS 38 236.931 -7.548 2.870 309 2HG LYS 38 HG1 LYS 38 236.909 -9.220 2.306 310 1HD LYS 38 HD2 LYS 38 237.757 -8.833 5.101 311 2HD LYS 38 HD1 LYS 38 236.073 -8.433 4.754 312 1HE LYS 38 HE2 LYS 38 235.795 -10.644 5.167 313 2HE LYS 38 HE1 LYS 38 236.225 -10.765 3.461 314 1HZ LYS 38 HZ1 LYS 38 238.337 -10.845 5.510 315 2HZ LYS 38 HZ2 LYS 38 238.330 -11.509 3.954 316 3HZ LYS 38 HZ3 LYS 38 237.430 -12.238 5.187 317 H VAL 39 HN VAL 39 240.218 -9.603 0.129 318 HA VAL 39 HA VAL 39 238.371 -9.280 -2.055 319 HB VAL 39 HB VAL 39 240.191 -11.655 -1.741 320 1HG1 VAL 39 HG11 VAL 39 238.674 -11.660 -3.635 321 2HG1 VAL 39 HG12 VAL 39 240.335 -11.453 -4.187 322 3HG1 VAL 39 HG13 VAL 39 239.248 -10.066 -4.124 323 1HG2 VAL 39 HG21 VAL 39 241.688 -9.918 -3.189 324 2HG2 VAL 39 HG22 VAL 39 241.901 -10.235 -1.467 325 3HG2 VAL 39 HG23 VAL 39 240.960 -8.840 -1.997 326 H GLN 40 HN GLN 40 236.343 -9.970 -1.876 327 HA GLN 40 HA GLN 40 235.254 -11.654 -0.020 328 1HB GLN 40 HB2 GLN 40 234.454 -10.783 -2.740 329 2HB GLN 40 HB1 GLN 40 233.593 -12.162 -2.070 330 1HG GLN 40 HG2 GLN 40 233.872 -9.895 -0.238 331 2HG GLN 40 HG1 GLN 40 232.919 -9.566 -1.683 332 1HE2 GLN 40 HE21 GLN 40 230.879 -9.603 -1.026 333 2HE2 GLN 40 HE22 GLN 40 230.131 -10.888 -0.144 334 H GLU 41 HN GLU 41 234.090 -13.804 -0.621 335 HA GLU 41 HA GLU 41 236.112 -15.749 -1.018 336 1HB GLU 41 HB2 GLU 41 234.003 -15.978 0.384 337 2HB GLU 41 HB1 GLU 41 233.139 -16.246 -1.124 338 1HG GLU 41 HG2 GLU 41 234.416 -18.224 -1.571 339 2HG GLU 41 HG1 GLU 41 235.455 -17.918 -0.180 340 H GLY 42 HN GLY 42 236.705 -14.689 -3.189 341 1HA GLY 42 HA2 GLY 42 236.976 -15.902 -5.317 342 2HA GLY 42 HA1 GLY 42 235.233 -16.110 -5.321 343 H GLU 43 HN GLU 43 237.219 -13.213 -4.680 344 HA GLU 43 HA GLU 43 236.021 -11.993 -7.050 345 1HB GLU 43 HB2 GLU 43 235.308 -10.127 -5.954 346 2HB GLU 43 HB1 GLU 43 235.174 -11.259 -4.621 347 1HG GLU 43 HG2 GLU 43 237.142 -10.461 -3.613 348 2HG GLU 43 HG1 GLU 43 237.626 -9.585 -5.064 349 H THR 44 HN THR 44 237.316 -9.895 -7.550 350 HA THR 44 HA THR 44 240.117 -10.726 -7.559 351 HB THR 44 HB THR 44 240.338 -9.202 -9.447 352 HG1 THR 44 HG1 THR 44 238.612 -8.025 -10.170 353 1HG2 THR 44 HG21 THR 44 239.404 -10.616 -10.937 354 2HG2 THR 44 HG22 THR 44 237.824 -10.561 -10.152 355 3HG2 THR 44 HG23 THR 44 239.102 -11.581 -9.493 356 H ILE 45 HN ILE 45 241.768 -9.424 -6.874 357 HA ILE 45 HA ILE 45 241.376 -7.822 -4.676 358 HB ILE 45 HB ILE 45 243.676 -7.365 -6.557 359 1HG1 ILE 45 HG12 ILE 45 244.582 -9.231 -4.791 360 2HG1 ILE 45 HG11 ILE 45 242.934 -9.786 -5.066 361 1HG2 ILE 45 HG21 ILE 45 244.879 -7.054 -4.391 362 2HG2 ILE 45 HG22 ILE 45 243.313 -7.150 -3.585 363 3HG2 ILE 45 HG23 ILE 45 243.637 -5.849 -4.732 364 1HD1 ILE 45 HD11 ILE 45 243.847 -9.249 -7.600 365 2HD1 ILE 45 HD12 ILE 45 243.759 -10.837 -6.839 366 3HD1 ILE 45 HD13 ILE 45 245.263 -9.918 -6.789 367 H GLU 46 HN GLU 46 241.323 -6.925 -8.065 368 HA GLU 46 HA GLU 46 241.309 -4.090 -7.589 369 1HB GLU 46 HB2 GLU 46 241.941 -5.424 -9.760 370 2HB GLU 46 HB1 GLU 46 240.214 -5.352 -10.082 371 1HG GLU 46 HG2 GLU 46 240.257 -2.950 -10.055 372 2HG GLU 46 HG1 GLU 46 241.951 -2.950 -9.568 373 H ASP 47 HN ASP 47 238.991 -6.653 -7.712 374 HA ASP 47 HA ASP 47 236.707 -4.907 -7.945 375 1HB ASP 47 HB2 ASP 47 237.110 -7.859 -7.611 376 2HB ASP 47 HB1 ASP 47 235.536 -7.161 -7.240 377 H GLY 48 HN GLY 48 238.444 -6.677 -5.448 378 1HA GLY 48 HA2 GLY 48 236.600 -6.092 -3.339 379 2HA GLY 48 HA1 GLY 48 238.261 -6.641 -3.145 380 H ALA 49 HN ALA 49 239.489 -4.531 -4.592 381 HA ALA 49 HA ALA 49 239.624 -2.538 -2.536 382 1HB ALA 49 HB1 ALA 49 240.881 -1.951 -5.132 383 2HB ALA 49 HB2 ALA 49 241.404 -3.449 -4.363 384 3HB ALA 49 HB3 ALA 49 241.561 -1.916 -3.506 385 H ARG 50 HN ARG 50 238.188 -2.872 -5.704 386 HA ARG 50 HA ARG 50 237.470 -0.130 -5.998 387 1HB ARG 50 HB2 ARG 50 237.744 -1.471 -7.969 388 2HB ARG 50 HB1 ARG 50 236.562 -2.641 -7.402 389 1HG ARG 50 HG2 ARG 50 234.815 -1.420 -8.111 390 2HG ARG 50 HG1 ARG 50 235.572 0.114 -7.674 391 1HD ARG 50 HD2 ARG 50 237.057 -0.127 -9.656 392 2HD ARG 50 HD1 ARG 50 236.143 -1.563 -10.114 393 HE ARG 50 HE ARG 50 234.510 0.773 -9.738 394 1HH1 ARG 50 HH11 ARG 50 236.480 -1.005 -12.005 395 2HH1 ARG 50 HH12 ARG 50 235.690 -0.348 -13.398 396 1HH2 ARG 50 HH21 ARG 50 233.470 1.638 -11.569 397 2HH2 ARG 50 HH22 ARG 50 233.982 1.153 -13.152 398 H ARG 51 HN ARG 51 235.573 -3.066 -5.278 399 HA ARG 51 HA ARG 51 233.137 -1.735 -4.827 400 1HB ARG 51 HB2 ARG 51 234.218 -4.435 -4.282 401 2HB ARG 51 HB1 ARG 51 232.850 -3.941 -3.295 402 1HG ARG 51 HG2 ARG 51 231.662 -4.810 -4.988 403 2HG ARG 51 HG1 ARG 51 231.946 -3.233 -5.725 404 1HD ARG 51 HD2 ARG 51 233.562 -4.042 -7.155 405 2HD ARG 51 HD1 ARG 51 233.948 -5.411 -6.110 406 HE ARG 51 HE ARG 51 231.434 -5.967 -6.878 407 1HH1 ARG 51 HH11 ARG 51 234.280 -5.056 -8.683 408 2HH1 ARG 51 HH12 ARG 51 233.807 -5.924 -10.105 409 1HH2 ARG 51 HH21 ARG 51 230.814 -7.110 -8.747 410 2HH2 ARG 51 HH22 ARG 51 231.841 -7.090 -10.140 411 H GLU 52 HN GLU 52 235.850 -2.407 -2.731 412 HA GLU 52 HA GLU 52 234.452 -1.545 -0.348 413 1HB GLU 52 HB2 GLU 52 237.343 -2.288 -0.826 414 2HB GLU 52 HB1 GLU 52 236.682 -1.851 0.742 415 1HG GLU 52 HG2 GLU 52 235.239 -3.987 -0.658 416 2HG GLU 52 HG1 GLU 52 236.893 -4.379 -0.192 417 H LEU 53 HN LEU 53 236.316 -0.164 -2.856 418 HA LEU 53 HA LEU 53 237.334 2.082 -1.438 419 1HB LEU 53 HB2 LEU 53 238.472 1.520 -3.410 420 2HB LEU 53 HB1 LEU 53 236.989 1.383 -4.337 421 HG LEU 53 HG LEU 53 236.703 3.819 -4.220 422 1HD1 LEU 53 HD11 LEU 53 238.377 3.663 -2.071 423 2HD1 LEU 53 HD12 LEU 53 237.920 5.147 -2.905 424 3HD1 LEU 53 HD13 LEU 53 239.428 4.334 -3.319 425 1HD2 LEU 53 HD21 LEU 53 237.716 3.314 -6.203 426 2HD2 LEU 53 HD22 LEU 53 239.107 2.556 -5.427 427 3HD2 LEU 53 HD23 LEU 53 238.976 4.314 -5.479 428 H GLN 54 HN GLN 54 234.610 1.601 -3.656 429 HA GLN 54 HA GLN 54 233.633 4.235 -3.586 430 1HB GLN 54 HB2 GLN 54 232.725 3.003 -5.307 431 2HB GLN 54 HB1 GLN 54 232.499 1.574 -4.311 432 1HG GLN 54 HG2 GLN 54 230.590 2.600 -3.223 433 2HG GLN 54 HG1 GLN 54 230.837 4.080 -4.150 434 1HE2 GLN 54 HE21 GLN 54 230.825 0.634 -4.999 435 2HE2 GLN 54 HE22 GLN 54 229.637 0.769 -6.246 436 H GLU 55 HN GLU 55 233.328 1.595 -1.372 437 HA GLU 55 HA GLU 55 231.094 2.715 0.061 438 1HB GLU 55 HB2 GLU 55 232.896 0.383 0.712 439 2HB GLU 55 HB1 GLU 55 231.446 0.818 1.608 440 1HG GLU 55 HG2 GLU 55 230.061 0.353 -0.287 441 2HG GLU 55 HG1 GLU 55 231.472 0.104 -1.313 442 H GLU 56 HN GLU 56 234.541 2.985 0.265 443 HA GLU 56 HA GLU 56 234.565 3.656 3.047 444 1HB GLU 56 HB2 GLU 56 236.588 3.552 0.873 445 2HB GLU 56 HB1 GLU 56 236.960 4.500 2.307 446 1HG GLU 56 HG2 GLU 56 235.888 1.917 3.013 447 2HG GLU 56 HG1 GLU 56 237.299 1.764 1.967 448 H SER 57 HN SER 57 234.794 5.592 0.055 449 HA SER 57 HA SER 57 234.106 7.931 1.699 450 1HB SER 57 HB2 SER 57 236.423 7.652 -0.188 451 2HB SER 57 HB1 SER 57 235.686 9.231 0.087 452 HG SER 57 HG SER 57 237.435 8.792 1.522 453 H GLY 58 HN GLY 58 232.620 6.172 -0.221 454 1HA GLY 58 HA2 GLY 58 231.044 6.414 -1.868 455 2HA GLY 58 HA1 GLY 58 231.026 8.115 -1.425 456 H LEU 59 HN LEU 59 234.090 7.002 -2.404 457 HA LEU 59 HA LEU 59 233.764 8.369 -4.979 458 1HB LEU 59 HB2 LEU 59 236.203 7.717 -3.333 459 2HB LEU 59 HB1 LEU 59 236.283 8.368 -4.958 460 HG LEU 59 HG LEU 59 235.411 9.709 -2.430 461 1HD1 LEU 59 HD11 LEU 59 236.936 11.393 -3.127 462 2HD1 LEU 59 HD12 LEU 59 237.069 10.693 -4.740 463 3HD1 LEU 59 HD13 LEU 59 237.739 9.838 -3.351 464 1HD2 LEU 59 HD21 LEU 59 234.529 11.577 -3.829 465 2HD2 LEU 59 HD22 LEU 59 233.533 10.121 -3.864 466 3HD2 LEU 59 HD23 LEU 59 234.592 10.499 -5.224 467 H THR 60 HN THR 60 233.278 7.048 -6.556 468 HA THR 60 HA THR 60 234.327 4.322 -6.575 469 HB THR 60 HB THR 60 232.609 5.158 -8.807 470 HG1 THR 60 HG1 THR 60 230.802 5.520 -7.621 471 1HG2 THR 60 HG21 THR 60 232.233 2.979 -8.764 472 2HG2 THR 60 HG22 THR 60 231.383 3.185 -7.233 473 3HG2 THR 60 HG23 THR 60 233.108 2.821 -7.240 474 H VAL 61 HN VAL 61 235.807 3.604 -8.052 475 HA VAL 61 HA VAL 61 236.911 5.663 -9.831 476 HB VAL 61 HB VAL 61 238.965 4.366 -9.886 477 1HG1 VAL 61 HG11 VAL 61 238.932 5.995 -8.194 478 2HG1 VAL 61 HG12 VAL 61 239.526 4.530 -7.410 479 3HG1 VAL 61 HG13 VAL 61 237.853 5.038 -7.179 480 1HG2 VAL 61 HG21 VAL 61 238.793 2.161 -9.575 481 2HG2 VAL 61 HG22 VAL 61 237.262 2.320 -8.713 482 3HG2 VAL 61 HG23 VAL 61 238.786 2.519 -7.848 483 H ASP 62 HN ASP 62 237.220 5.326 -11.973 484 HA ASP 62 HA ASP 62 235.613 3.272 -13.198 485 1HB ASP 62 HB2 ASP 62 235.980 5.729 -13.993 486 2HB ASP 62 HB1 ASP 62 237.459 5.097 -14.710 487 H ALA 63 HN ALA 63 238.911 3.714 -12.318 488 HA ALA 63 HA ALA 63 239.651 1.085 -12.843 489 1HB ALA 63 HB1 ALA 63 239.478 2.427 -15.219 490 2HB ALA 63 HB2 ALA 63 240.451 0.985 -14.932 491 3HB ALA 63 HB3 ALA 63 241.190 2.582 -14.828 492 H LEU 64 HN LEU 64 240.673 1.279 -10.854 493 HA LEU 64 HA LEU 64 242.464 3.312 -10.092 494 1HB LEU 64 HB2 LEU 64 242.403 0.408 -9.254 495 2HB LEU 64 HB1 LEU 64 243.321 1.665 -8.451 496 HG LEU 64 HG LEU 64 240.658 2.577 -8.552 497 1HD1 LEU 64 HD11 LEU 64 239.579 0.715 -7.247 498 2HD1 LEU 64 HD12 LEU 64 240.903 -0.318 -7.787 499 3HD1 LEU 64 HD13 LEU 64 239.812 0.408 -8.968 500 1HD2 LEU 64 HD21 LEU 64 242.729 2.460 -6.762 501 2HD2 LEU 64 HD22 LEU 64 241.527 1.396 -6.031 502 3HD2 LEU 64 HD23 LEU 64 241.108 3.063 -6.421 503 H HIS 65 HN HIS 65 244.853 2.403 -9.440 504 HA HIS 65 HA HIS 65 246.012 1.127 -11.814 505 1HB HIS 65 HB2 HIS 65 246.249 3.865 -11.240 506 2HB HIS 65 HB1 HIS 65 247.791 3.157 -10.772 507 HD1 HIS 65 HD1 HIS 65 245.465 3.055 -13.787 508 HD2 HIS 65 HD2 HIS 65 249.512 2.953 -12.845 509 HE1 HIS 65 HE1 HIS 65 246.669 3.020 -15.996 510 HE2 HIS 65 HE2 HIS 65 249.113 2.872 -15.399 511 H LYS 66 HN LYS 66 246.624 -0.761 -10.877 512 HA LYS 66 HA LYS 66 247.614 -1.022 -8.243 513 1HB LYS 66 HB2 LYS 66 248.587 -3.228 -9.211 514 2HB LYS 66 HB1 LYS 66 246.844 -3.034 -9.132 515 1HG LYS 66 HG2 LYS 66 246.633 -2.789 -11.418 516 2HG LYS 66 HG1 LYS 66 248.313 -2.285 -11.620 517 1HD LYS 66 HD2 LYS 66 248.470 -4.420 -12.409 518 2HD LYS 66 HD1 LYS 66 248.767 -4.727 -10.696 519 1HE LYS 66 HE2 LYS 66 246.807 -5.807 -10.416 520 2HE LYS 66 HE1 LYS 66 245.939 -4.729 -11.508 521 1HZ LYS 66 HZ1 LYS 66 247.283 -5.944 -13.319 522 2HZ LYS 66 HZ2 LYS 66 245.941 -6.720 -12.642 523 3HZ LYS 66 HZ3 LYS 66 247.502 -7.142 -12.145 524 H VAL 67 HN VAL 67 249.616 -0.685 -7.405 525 HA VAL 67 HA VAL 67 251.852 -0.501 -9.306 526 HB VAL 67 HB VAL 67 252.672 1.572 -8.221 527 1HG1 VAL 67 HG11 VAL 67 251.521 1.690 -10.349 528 2HG1 VAL 67 HG12 VAL 67 251.082 3.079 -9.355 529 3HG1 VAL 67 HG13 VAL 67 249.960 1.730 -9.531 530 1HG2 VAL 67 HG21 VAL 67 251.659 1.686 -6.135 531 2HG2 VAL 67 HG22 VAL 67 250.060 1.325 -6.780 532 3HG2 VAL 67 HG23 VAL 67 250.788 2.906 -7.061 533 H GLY 68 HN GLY 68 251.001 -0.375 -5.837 534 1HA GLY 68 HA2 GLY 68 253.615 -1.635 -5.302 535 2HA GLY 68 HA1 GLY 68 252.729 -0.652 -4.151 536 H GLN 69 HN GLN 69 253.346 -3.798 -5.282 537 HA GLN 69 HA GLN 69 251.029 -4.934 -3.911 538 1HB GLN 69 HB2 GLN 69 252.209 -5.749 -6.167 539 2HB GLN 69 HB1 GLN 69 253.192 -6.655 -5.026 540 1HG GLN 69 HG2 GLN 69 250.671 -7.171 -4.128 541 2HG GLN 69 HG1 GLN 69 250.426 -7.063 -5.870 542 1HE2 GLN 69 HE21 GLN 69 252.572 -8.540 -3.469 543 2HE2 GLN 69 HE22 GLN 69 252.799 -10.022 -4.327 544 H ILE 70 HN ILE 70 251.180 -5.184 -1.771 545 HA ILE 70 HA ILE 70 253.834 -5.787 -0.651 546 HB ILE 70 HB ILE 70 251.507 -4.400 0.671 547 1HG1 ILE 70 HG12 ILE 70 254.184 -3.149 0.322 548 2HG1 ILE 70 HG11 ILE 70 253.158 -3.284 -1.103 549 1HG2 ILE 70 HG21 ILE 70 252.733 -5.776 2.268 550 2HG2 ILE 70 HG22 ILE 70 253.010 -4.061 2.569 551 3HG2 ILE 70 HG23 ILE 70 254.247 -5.026 1.762 552 1HD1 ILE 70 HD11 ILE 70 251.371 -2.242 0.540 553 2HD1 ILE 70 HD12 ILE 70 252.510 -1.245 -0.363 554 3HD1 ILE 70 HD13 ILE 70 252.826 -1.631 1.328 555 H VAL 71 HN VAL 71 254.031 -7.260 1.018 556 HA VAL 71 HA VAL 71 251.740 -9.050 1.463 557 HB VAL 71 HB VAL 71 254.593 -9.986 1.166 558 1HG1 VAL 71 HG11 VAL 71 251.982 -11.485 1.264 559 2HG1 VAL 71 HG12 VAL 71 253.173 -11.390 2.561 560 3HG1 VAL 71 HG13 VAL 71 253.579 -12.202 1.050 561 1HG2 VAL 71 HG21 VAL 71 252.419 -9.669 -0.849 562 2HG2 VAL 71 HG22 VAL 71 253.518 -11.041 -0.983 563 3HG2 VAL 71 HG23 VAL 71 254.154 -9.396 -1.012 564 H PHE 72 HN PHE 72 251.667 -10.057 3.507 565 HA PHE 72 HA PHE 72 253.552 -8.972 5.489 566 1HB PHE 72 HB2 PHE 72 250.555 -9.218 5.654 567 2HB PHE 72 HB1 PHE 72 251.560 -9.054 7.090 568 HD1 PHE 72 HD1 PHE 72 253.350 -7.056 6.860 569 HD2 PHE 72 HD2 PHE 72 249.613 -7.301 4.839 570 HE1 PHE 72 HE1 PHE 72 253.340 -4.610 6.589 571 HE2 PHE 72 HE2 PHE 72 249.595 -4.857 4.565 572 HZ PHE 72 HZ PHE 72 251.461 -3.508 5.440 573 H GLU 73 HN GLU 73 254.683 -10.518 6.419 574 HA GLU 73 HA GLU 73 253.601 -13.240 6.512 575 1HB GLU 73 HB2 GLU 73 256.415 -12.314 7.119 576 2HB GLU 73 HB1 GLU 73 255.874 -13.973 6.904 577 1HG GLU 73 HG2 GLU 73 255.105 -12.841 4.553 578 2HG GLU 73 HG1 GLU 73 256.580 -11.947 4.918 579 H PHE 74 HN PHE 74 252.774 -14.000 8.347 580 HA PHE 74 HA PHE 74 253.116 -12.477 10.797 581 1HB PHE 74 HB2 PHE 74 251.257 -14.612 9.860 582 2HB PHE 74 HB1 PHE 74 251.521 -14.449 11.594 583 HD1 PHE 74 HD1 PHE 74 251.310 -11.847 8.942 584 HD2 PHE 74 HD2 PHE 74 249.582 -13.530 12.448 585 HE1 PHE 74 HE1 PHE 74 249.676 -10.009 9.014 586 HE2 PHE 74 HE2 PHE 74 247.944 -11.695 12.526 587 HZ PHE 74 HZ PHE 74 247.989 -9.933 10.806 588 H VAL 75 HN VAL 75 254.135 -13.097 12.581 589 HA VAL 75 HA VAL 75 256.042 -15.250 12.309 590 HB VAL 75 HB VAL 75 255.924 -13.920 14.914 591 1HG1 VAL 75 HG11 VAL 75 258.186 -14.096 14.790 592 2HG1 VAL 75 HG12 VAL 75 258.230 -13.727 13.066 593 3HG1 VAL 75 HG13 VAL 75 257.751 -15.334 13.612 594 1HG2 VAL 75 HG21 VAL 75 256.965 -11.806 13.931 595 2HG2 VAL 75 HG22 VAL 75 255.213 -11.968 13.827 596 3HG2 VAL 75 HG23 VAL 75 256.214 -12.288 12.411 597 H GLY 76 HN GLY 76 255.318 -17.243 12.686 598 1HA GLY 76 HA2 GLY 76 254.841 -18.923 14.319 599 2HA GLY 76 HA1 GLY 76 253.929 -17.728 15.230 600 H GLU 77 HN GLU 77 252.801 -16.931 12.428 601 HA GLU 77 HA GLU 77 250.625 -18.896 12.533 602 1HB GLU 77 HB2 GLU 77 250.647 -16.202 11.167 603 2HB GLU 77 HB1 GLU 77 249.250 -17.232 11.445 604 1HG GLU 77 HG2 GLU 77 250.187 -16.902 13.974 605 2HG GLU 77 HG1 GLU 77 250.598 -15.354 13.238 606 HA PRO 78 HA PRO 78 252.001 -20.597 8.669 607 1HB PRO 78 HB2 PRO 78 249.742 -21.921 7.965 608 2HB PRO 78 HB1 PRO 78 250.823 -22.488 9.244 609 1HG PRO 78 HG2 PRO 78 248.253 -20.970 9.473 610 2HG PRO 78 HG1 PRO 78 248.827 -22.349 10.429 611 1HD PRO 78 HD2 PRO 78 248.974 -19.793 11.316 612 2HD PRO 78 HD1 PRO 78 250.171 -21.029 11.757 613 H GLU 79 HN GLU 79 249.001 -18.776 8.906 614 HA GLU 79 HA GLU 79 248.774 -18.391 6.063 615 1HB GLU 79 HB2 GLU 79 247.112 -18.005 8.356 616 2HB GLU 79 HB1 GLU 79 247.203 -16.488 7.473 617 1HG GLU 79 HG2 GLU 79 246.392 -17.513 5.481 618 2HG GLU 79 HG1 GLU 79 246.515 -19.120 6.196 619 H LEU 80 HN LEU 80 248.345 -15.971 5.401 620 HA LEU 80 HA LEU 80 250.281 -14.148 6.598 621 1HB LEU 80 HB2 LEU 80 250.384 -14.332 3.638 622 2HB LEU 80 HB1 LEU 80 251.644 -13.901 4.778 623 HG LEU 80 HG LEU 80 250.711 -16.735 4.665 624 1HD1 LEU 80 HD11 LEU 80 252.407 -15.339 2.626 625 2HD1 LEU 80 HD12 LEU 80 251.046 -16.434 2.376 626 3HD1 LEU 80 HD13 LEU 80 252.587 -17.062 2.960 627 1HD2 LEU 80 HD21 LEU 80 253.548 -15.940 4.880 628 2HD2 LEU 80 HD22 LEU 80 252.648 -17.185 5.747 629 3HD2 LEU 80 HD23 LEU 80 252.502 -15.495 6.228 630 H MET 81 HN MET 81 250.217 -12.215 4.566 631 HA MET 81 HA MET 81 247.408 -11.668 4.053 632 1HB MET 81 HB2 MET 81 248.815 -10.486 6.227 633 2HB MET 81 HB1 MET 81 248.544 -9.234 5.023 634 1HG MET 81 HG2 MET 81 246.104 -10.218 5.040 635 2HG MET 81 HG1 MET 81 246.587 -10.773 6.642 636 1HE MET 81 HE1 MET 81 246.076 -6.720 4.893 637 2HE MET 81 HE2 MET 81 247.145 -7.992 4.304 638 3HE MET 81 HE3 MET 81 247.758 -6.769 5.417 639 H ASP 82 HN ASP 82 247.406 -11.306 1.923 640 HA ASP 82 HA ASP 82 249.657 -9.811 0.756 641 1HB ASP 82 HB2 ASP 82 249.254 -12.043 -0.205 642 2HB ASP 82 HB1 ASP 82 247.604 -11.577 -0.603 643 H VAL 83 HN VAL 83 249.128 -7.683 0.852 644 HA VAL 83 HA VAL 83 246.448 -6.902 -0.095 645 HB VAL 83 HB VAL 83 246.946 -6.246 2.234 646 1HG1 VAL 83 HG11 VAL 83 249.425 -5.921 1.762 647 2HG1 VAL 83 HG12 VAL 83 248.651 -4.736 2.813 648 3HG1 VAL 83 HG13 VAL 83 248.984 -4.336 1.128 649 1HG2 VAL 83 HG21 VAL 83 245.549 -4.885 0.520 650 2HG2 VAL 83 HG22 VAL 83 246.876 -3.728 0.621 651 3HG2 VAL 83 HG23 VAL 83 245.967 -4.155 2.071 652 H HIS 84 HN HIS 84 246.388 -6.119 -2.060 653 HA HIS 84 HA HIS 84 248.764 -5.106 -3.361 654 1HB HIS 84 HB2 HIS 84 246.786 -6.517 -4.376 655 2HB HIS 84 HB1 HIS 84 246.020 -4.944 -4.560 656 HD1 HIS 84 HD1 HIS 84 249.524 -4.436 -5.042 657 HD2 HIS 84 HD2 HIS 84 246.425 -5.912 -7.380 658 HE1 HIS 84 HE1 HIS 84 250.343 -4.285 -7.413 659 HE2 HIS 84 HE2 HIS 84 248.489 -5.277 -8.801 660 H VAL 85 HN VAL 85 249.207 -2.969 -3.808 661 HA VAL 85 HA VAL 85 247.400 -1.029 -2.543 662 HB VAL 85 HB VAL 85 250.243 -0.551 -3.446 663 1HG1 VAL 85 HG11 VAL 85 249.460 1.552 -3.178 664 2HG1 VAL 85 HG12 VAL 85 249.790 1.207 -1.482 665 3HG1 VAL 85 HG13 VAL 85 248.150 1.047 -2.110 666 1HG2 VAL 85 HG21 VAL 85 249.408 -2.193 -1.343 667 2HG2 VAL 85 HG22 VAL 85 249.880 -0.670 -0.587 668 3HG2 VAL 85 HG23 VAL 85 251.024 -1.539 -1.610 669 H PHE 86 HN PHE 86 245.977 -0.341 -3.950 670 HA PHE 86 HA PHE 86 246.728 0.177 -6.727 671 1HB PHE 86 HB2 PHE 86 244.284 -0.585 -5.289 672 2HB PHE 86 HB1 PHE 86 244.011 0.716 -6.441 673 HD1 PHE 86 HD1 PHE 86 244.851 0.330 -8.846 674 HD2 PHE 86 HD2 PHE 86 244.319 -2.784 -5.998 675 HE1 PHE 86 HE1 PHE 86 244.713 -1.310 -10.674 676 HE2 PHE 86 HE2 PHE 86 244.183 -4.433 -7.820 677 HZ PHE 86 HZ PHE 86 244.379 -3.697 -10.162 678 H CYS 87 HN CYS 87 246.678 2.197 -7.612 679 HA CYS 87 HA CYS 87 245.856 4.421 -5.854 680 1HB CYS 87 HB2 CYS 87 247.599 5.803 -6.935 681 2HB CYS 87 HB1 CYS 87 248.300 4.420 -6.103 682 HG CYS 87 HG CYS 87 249.429 3.945 -8.213 683 H THR 88 HN THR 88 244.070 5.356 -6.702 684 HA THR 88 HA THR 88 243.566 5.005 -9.561 685 HB THR 88 HB THR 88 241.896 4.356 -7.725 686 HG1 THR 88 HG1 THR 88 240.868 4.265 -9.547 687 1HG2 THR 88 HG21 THR 88 242.121 6.957 -6.948 688 2HG2 THR 88 HG22 THR 88 240.811 5.853 -6.524 689 3HG2 THR 88 HG23 THR 88 240.632 6.950 -7.894 690 H ASP 89 HN ASP 89 241.899 6.955 -10.214 691 HA ASP 89 HA ASP 89 242.804 9.562 -9.438 692 1HB ASP 89 HB2 ASP 89 243.599 8.411 -12.113 693 2HB ASP 89 HB1 ASP 89 243.500 10.146 -11.827 694 H SER 90 HN SER 90 241.149 7.597 -11.855 695 HA SER 90 HA SER 90 239.239 9.695 -12.434 696 1HB SER 90 HB2 SER 90 240.226 7.551 -13.882 697 2HB SER 90 HB1 SER 90 238.606 7.014 -13.439 698 HG SER 90 HG SER 90 237.909 9.139 -14.254 699 H ILE 91 HN ILE 91 237.958 10.058 -10.674 700 HA ILE 91 HA ILE 91 236.636 7.745 -9.441 701 HB ILE 91 HB ILE 91 235.993 9.241 -7.609 702 1HG1 ILE 91 HG12 ILE 91 237.667 11.365 -8.963 703 2HG1 ILE 91 HG11 ILE 91 235.912 11.309 -9.074 704 1HG2 ILE 91 HG21 ILE 91 238.227 9.610 -6.679 705 2HG2 ILE 91 HG22 ILE 91 238.932 9.371 -8.277 706 3HG2 ILE 91 HG23 ILE 91 238.105 8.038 -7.471 707 1HD1 ILE 91 HD11 ILE 91 235.872 11.399 -6.557 708 2HD1 ILE 91 HD12 ILE 91 236.432 12.856 -7.378 709 3HD1 ILE 91 HD13 ILE 91 237.597 11.760 -6.633 710 H GLN 92 HN GLN 92 234.334 8.495 -8.540 711 HA GLN 92 HA GLN 92 232.877 9.836 -10.706 712 1HB GLN 92 HB2 GLN 92 232.359 7.120 -9.538 713 2HB GLN 92 HB1 GLN 92 231.064 8.048 -10.281 714 1HG GLN 92 HG2 GLN 92 233.494 7.837 -11.902 715 2HG GLN 92 HG1 GLN 92 232.680 6.306 -11.585 716 1HE2 GLN 92 HE21 GLN 92 232.990 7.898 -14.057 717 2HE2 GLN 92 HE22 GLN 92 231.384 8.146 -14.645 718 H GLY 93 HN GLY 93 232.060 8.199 -7.651 719 1HA GLY 93 HA2 GLY 93 230.003 9.942 -6.934 720 2HA GLY 93 HA1 GLY 93 230.890 8.920 -5.816 721 H THR 94 HN THR 94 230.498 10.746 -4.341 722 HA THR 94 HA THR 94 232.517 12.847 -4.684 723 HB THR 94 HB THR 94 230.264 13.423 -2.896 724 HG1 THR 94 HG1 THR 94 228.951 12.575 -4.372 725 1HG2 THR 94 HG21 THR 94 231.107 15.444 -3.242 726 2HG2 THR 94 HG22 THR 94 230.390 15.374 -4.851 727 3HG2 THR 94 HG23 THR 94 232.068 14.885 -4.611 728 HA PRO 95 HA PRO 95 234.312 11.759 -0.845 729 1HB PRO 95 HB2 PRO 95 234.345 14.569 0.032 730 2HB PRO 95 HB1 PRO 95 235.701 13.494 -0.328 731 1HG PRO 95 HG2 PRO 95 235.062 15.535 -1.935 732 2HG PRO 95 HG1 PRO 95 235.676 13.998 -2.573 733 1HD PRO 95 HD2 PRO 95 232.855 15.003 -2.447 734 2HD PRO 95 HD1 PRO 95 233.698 14.183 -3.780 735 H VAL 96 HN VAL 96 231.907 11.108 -0.648 736 HA VAL 96 HA VAL 96 230.311 12.617 1.195 737 HB VAL 96 HB VAL 96 229.932 9.694 0.577 738 1HG1 VAL 96 HG11 VAL 96 227.669 11.571 0.790 739 2HG1 VAL 96 HG12 VAL 96 228.578 11.275 2.272 740 3HG1 VAL 96 HG13 VAL 96 227.847 9.927 1.402 741 1HG2 VAL 96 HG21 VAL 96 229.949 10.334 -1.593 742 2HG2 VAL 96 HG22 VAL 96 229.627 12.026 -1.212 743 3HG2 VAL 96 HG23 VAL 96 228.308 10.854 -1.212 744 H GLU 97 HN GLU 97 232.406 12.647 2.577 745 HA GLU 97 HA GLU 97 233.388 10.628 4.110 746 1HB GLU 97 HB2 GLU 97 232.619 13.267 5.346 747 2HB GLU 97 HB1 GLU 97 233.979 12.234 5.758 748 1HG GLU 97 HG2 GLU 97 235.242 13.467 4.433 749 2HG GLU 97 HG1 GLU 97 234.315 12.868 3.059 750 H SER 98 HN SER 98 232.399 9.058 5.189 751 HA SER 98 HA SER 98 229.734 9.457 6.264 752 1HB SER 98 HB2 SER 98 230.502 7.361 5.015 753 2HB SER 98 HB1 SER 98 231.395 6.945 6.478 754 HG SER 98 HG SER 98 229.341 5.993 6.502 755 H ASP 99 HN ASP 99 229.478 8.097 8.471 756 HA ASP 99 HA ASP 99 230.703 9.706 10.452 757 1HB ASP 99 HB2 ASP 99 229.237 7.095 10.863 758 2HB ASP 99 HB1 ASP 99 229.489 8.366 12.055 759 H GLU 100 HN GLU 100 231.850 6.979 8.810 760 HA GLU 100 HA GLU 100 233.830 6.509 10.940 761 1HB GLU 100 HB2 GLU 100 232.082 4.647 9.624 762 2HB GLU 100 HB1 GLU 100 233.753 4.234 9.267 763 1HG GLU 100 HG2 GLU 100 234.241 3.725 11.432 764 2HG GLU 100 HG1 GLU 100 233.036 4.835 12.081 765 H MET 101 HN MET 101 233.606 8.096 8.205 766 HA MET 101 HA MET 101 236.386 7.670 7.543 767 1HB MET 101 HB2 MET 101 234.511 6.268 6.068 768 2HB MET 101 HB1 MET 101 234.826 7.687 5.079 769 1HG MET 101 HG2 MET 101 236.275 5.834 4.469 770 2HG MET 101 HG1 MET 101 237.201 7.198 5.092 771 1HE MET 101 HE1 MET 101 239.629 5.404 6.903 772 2HE MET 101 HE2 MET 101 238.819 6.765 7.678 773 3HE MET 101 HE3 MET 101 239.066 6.764 5.932 774 H ARG 102 HN ARG 102 237.296 9.339 6.283 775 HA ARG 102 HA ARG 102 235.778 11.557 5.342 776 1HB ARG 102 HB2 ARG 102 235.688 11.878 7.842 777 2HB ARG 102 HB1 ARG 102 237.438 12.048 7.825 778 1HG ARG 102 HG2 ARG 102 237.111 13.952 6.196 779 2HG ARG 102 HG1 ARG 102 235.391 13.859 6.579 780 1HD ARG 102 HD2 ARG 102 235.663 14.780 8.616 781 2HD ARG 102 HD1 ARG 102 237.183 13.935 8.907 782 HE ARG 102 HE ARG 102 237.756 15.824 6.999 783 1HH1 ARG 102 HH11 ARG 102 236.478 15.854 10.246 784 2HH1 ARG 102 HH12 ARG 102 237.121 17.418 10.619 785 1HH2 ARG 102 HH21 ARG 102 238.602 17.881 7.487 786 2HH2 ARG 102 HH22 ARG 102 238.326 18.570 9.052 787 HA PRO 103 HA PRO 103 239.942 11.079 3.458 788 1HB PRO 103 HB2 PRO 103 239.185 11.686 0.942 789 2HB PRO 103 HB1 PRO 103 238.948 10.077 1.635 790 1HG PRO 103 HG2 PRO 103 236.989 12.334 1.381 791 2HG PRO 103 HG1 PRO 103 236.766 10.616 0.997 792 1HD PRO 103 HD2 PRO 103 235.890 11.692 3.314 793 2HD PRO 103 HD1 PRO 103 236.492 10.026 3.220 794 H CYS 104 HN CYS 104 241.426 12.600 2.837 795 HA CYS 104 HA CYS 104 240.493 15.374 2.573 796 1HB CYS 104 HB2 CYS 104 241.816 14.409 4.801 797 2HB CYS 104 HB1 CYS 104 243.113 15.121 3.848 798 HG CYS 104 HG CYS 104 241.273 16.667 5.531 799 H TRP 105 HN TRP 105 241.268 16.374 0.834 800 HA TRP 105 HA TRP 105 243.237 14.997 -0.797 801 1HB TRP 105 HB2 TRP 105 241.636 17.501 -1.371 802 2HB TRP 105 HB1 TRP 105 242.619 16.614 -2.534 803 HD1 TRP 105 HD1 TRP 105 239.838 15.436 -0.071 804 HE1 TRP 105 HE1 TRP 105 238.161 14.003 -1.401 805 HE3 TRP 105 HE3 TRP 105 241.963 15.805 -4.707 806 HZ2 TRP 105 HZ2 TRP 105 237.791 13.150 -4.067 807 HZ3 TRP 105 HZ3 TRP 105 240.884 14.652 -6.593 808 HH2 TRP 105 HH2 TRP 105 238.841 13.352 -6.278 809 H PHE 106 HN PHE 106 245.315 15.522 -0.914 810 HA PHE 106 HA PHE 106 246.160 18.227 -0.148 811 1HB PHE 106 HB2 PHE 106 247.468 15.676 0.825 812 2HB PHE 106 HB1 PHE 106 248.043 17.308 1.141 813 HD1 PHE 106 HD1 PHE 106 245.517 18.688 1.778 814 HD2 PHE 106 HD2 PHE 106 246.935 14.842 2.919 815 HE1 PHE 106 HE1 PHE 106 244.135 18.787 3.811 816 HE2 PHE 106 HE2 PHE 106 245.556 14.933 4.954 817 HZ PHE 106 HZ PHE 106 244.153 16.908 5.402 818 H GLN 107 HN GLN 107 248.909 17.841 -0.440 819 HA GLN 107 HA GLN 107 249.057 17.525 -3.332 820 1HB GLN 107 HB2 GLN 107 250.057 19.470 -1.867 821 2HB GLN 107 HB1 GLN 107 251.393 18.346 -1.658 822 1HG GLN 107 HG2 GLN 107 251.649 18.216 -4.092 823 2HG GLN 107 HG1 GLN 107 250.335 19.374 -4.281 824 1HE2 GLN 107 HE21 GLN 107 253.099 19.583 -5.139 825 2HE2 GLN 107 HE22 GLN 107 253.740 20.994 -4.377 826 H LEU 108 HN LEU 108 250.882 16.380 -4.298 827 HA LEU 108 HA LEU 108 251.195 13.777 -3.123 828 1HB LEU 108 HB2 LEU 108 252.073 13.100 -5.174 829 2HB LEU 108 HB1 LEU 108 250.910 14.338 -5.606 830 HG LEU 108 HG LEU 108 253.907 14.688 -5.475 831 1HD1 LEU 108 HD11 LEU 108 253.753 13.683 -7.477 832 2HD1 LEU 108 HD12 LEU 108 253.163 15.255 -8.013 833 3HD1 LEU 108 HD13 LEU 108 252.019 13.976 -7.608 834 1HD2 LEU 108 HD21 LEU 108 253.472 16.905 -6.437 835 2HD2 LEU 108 HD22 LEU 108 252.767 16.732 -4.829 836 3HD2 LEU 108 HD23 LEU 108 251.740 16.632 -6.256 837 H ASP 109 HN ASP 109 252.777 16.588 -2.527 838 HA ASP 109 HA ASP 109 255.298 15.190 -1.932 839 1HB ASP 109 HB2 ASP 109 255.098 17.292 -3.610 840 2HB ASP 109 HB1 ASP 109 255.304 18.152 -2.087 841 H GLN 110 HN GLN 110 252.743 15.591 -0.370 842 HA GLN 110 HA GLN 110 254.046 16.429 2.083 843 1HB GLN 110 HB2 GLN 110 251.453 17.673 1.157 844 2HB GLN 110 HB1 GLN 110 252.213 17.932 2.722 845 1HG GLN 110 HG2 GLN 110 254.245 18.698 1.254 846 2HG GLN 110 HG1 GLN 110 252.992 18.953 0.040 847 1HE2 GLN 110 HE21 GLN 110 254.636 20.939 1.287 848 2HE2 GLN 110 HE22 GLN 110 253.579 22.020 2.125 849 H ILE 111 HN ILE 111 252.826 13.961 0.797 850 HA ILE 111 HA ILE 111 250.518 13.351 2.393 851 HB ILE 111 HB ILE 111 251.919 10.960 1.560 852 1HG1 ILE 111 HG12 ILE 111 251.296 11.517 -0.952 853 2HG1 ILE 111 HG11 ILE 111 251.669 13.161 -0.438 854 1HG2 ILE 111 HG21 ILE 111 249.358 11.743 1.975 855 2HG2 ILE 111 HG22 ILE 111 249.858 10.246 1.187 856 3HG2 ILE 111 HG23 ILE 111 249.433 11.654 0.215 857 1HD1 ILE 111 HD11 ILE 111 253.864 12.289 0.399 858 2HD1 ILE 111 HD12 ILE 111 253.648 12.234 -1.351 859 3HD1 ILE 111 HD13 ILE 111 253.475 10.763 -0.393 860 HA PRO 112 HA PRO 112 252.975 12.165 5.911 861 1HB PRO 112 HB2 PRO 112 251.036 12.150 7.726 862 2HB PRO 112 HB1 PRO 112 251.520 13.666 6.954 863 1HG PRO 112 HG2 PRO 112 249.137 11.946 6.421 864 2HG PRO 112 HG1 PRO 112 249.269 13.712 6.412 865 1HD PRO 112 HD2 PRO 112 249.357 12.025 4.168 866 2HD PRO 112 HD1 PRO 112 249.821 13.737 4.213 867 H PHE 113 HN PHE 113 253.638 10.093 5.390 868 HA PHE 113 HA PHE 113 251.826 7.871 5.522 869 1HB PHE 113 HB2 PHE 113 254.720 7.324 5.722 870 2HB PHE 113 HB1 PHE 113 253.501 6.581 4.707 871 HD1 PHE 113 HD1 PHE 113 252.612 9.415 3.522 872 HD2 PHE 113 HD2 PHE 113 256.313 7.330 3.971 873 HE1 PHE 113 HE1 PHE 113 253.553 10.623 1.599 874 HE2 PHE 113 HE2 PHE 113 257.236 8.534 2.046 875 HZ PHE 113 HZ PHE 113 255.856 10.194 0.858 876 H LYS 114 HN LYS 114 253.642 9.630 7.815 877 HA LYS 114 HA LYS 114 254.113 7.583 9.709 878 1HB LYS 114 HB2 LYS 114 255.050 10.035 9.556 879 2HB LYS 114 HB1 LYS 114 253.630 10.429 10.515 880 1HG LYS 114 HG2 LYS 114 254.970 10.012 12.255 881 2HG LYS 114 HG1 LYS 114 254.620 8.319 11.900 882 1HD LYS 114 HD2 LYS 114 256.937 9.813 10.687 883 2HD LYS 114 HD1 LYS 114 257.060 8.899 12.192 884 1HE LYS 114 HE2 LYS 114 256.104 7.719 9.590 885 2HE LYS 114 HE1 LYS 114 257.783 7.667 10.125 886 1HZ LYS 114 HZ1 LYS 114 255.822 6.729 12.048 887 2HZ LYS 114 HZ2 LYS 114 257.338 6.094 11.649 888 3HZ LYS 114 HZ3 LYS 114 256.002 5.767 10.667 889 H ASP 115 HN ASP 115 251.388 9.522 8.829 890 HA ASP 115 HA ASP 115 249.889 8.540 11.130 891 1HB ASP 115 HB2 ASP 115 249.346 10.773 9.177 892 2HB ASP 115 HB1 ASP 115 248.141 10.204 10.330 893 H MET 116 HN MET 116 250.666 6.989 8.702 894 HA MET 116 HA MET 116 247.962 6.210 7.840 895 1HB MET 116 HB2 MET 116 250.485 6.540 6.278 896 2HB MET 116 HB1 MET 116 249.350 5.292 5.787 897 1HG MET 116 HG2 MET 116 247.838 6.771 5.024 898 2HG MET 116 HG1 MET 116 248.203 7.959 6.270 899 1HE MET 116 HE1 MET 116 250.275 7.332 2.258 900 2HE MET 116 HE2 MET 116 249.421 6.133 3.228 901 3HE MET 116 HE3 MET 116 251.099 6.533 3.596 902 H TRP 117 HN TRP 117 251.151 4.720 7.390 903 HA TRP 117 HA TRP 117 250.628 2.637 9.291 904 1HB TRP 117 HB2 TRP 117 249.899 2.261 6.490 905 2HB TRP 117 HB1 TRP 117 251.043 1.048 7.053 906 HD1 TRP 117 HD1 TRP 117 249.705 1.094 10.114 907 HE1 TRP 117 HE1 TRP 117 247.534 -0.250 10.433 908 HE3 TRP 117 HE3 TRP 117 248.226 0.762 5.230 909 HZ2 TRP 117 HZ2 TRP 117 245.468 -1.310 8.830 910 HZ3 TRP 117 HZ3 TRP 117 246.140 -0.435 4.709 911 HH2 TRP 117 HH2 TRP 117 244.792 -1.450 6.473 912 HA PRO 118 HA PRO 118 255.013 2.223 8.974 913 1HB PRO 118 HB2 PRO 118 255.478 -0.279 9.757 914 2HB PRO 118 HB1 PRO 118 254.719 0.888 10.843 915 1HG PRO 118 HG2 PRO 118 253.463 -1.305 9.246 916 2HG PRO 118 HG1 PRO 118 253.109 -0.780 10.901 917 1HD PRO 118 HD2 PRO 118 251.659 -0.052 8.651 918 2HD PRO 118 HD1 PRO 118 251.662 0.828 10.192 919 H ASP 119 HN ASP 119 253.278 1.168 6.509 920 HA ASP 119 HA ASP 119 255.578 -0.106 5.184 921 1HB ASP 119 HB2 ASP 119 253.813 -1.270 3.742 922 2HB ASP 119 HB1 ASP 119 254.007 -1.852 5.393 923 H ASP 120 HN ASP 120 253.183 2.352 5.117 924 HA ASP 120 HA ASP 120 252.798 2.945 2.477 925 1HB ASP 120 HB2 ASP 120 253.119 4.751 4.853 926 2HB ASP 120 HB1 ASP 120 252.666 5.357 3.260 927 H SER 121 HN SER 121 255.390 4.367 4.465 928 HA SER 121 HA SER 121 256.696 5.763 2.459 929 1HB SER 121 HB2 SER 121 257.086 5.725 5.026 930 2HB SER 121 HB1 SER 121 258.235 4.436 4.671 931 HG SER 121 HG SER 121 259.469 6.183 4.480 932 H TYR 122 HN TYR 122 256.544 2.354 2.858 933 HA TYR 122 HA TYR 122 259.037 1.808 1.528 934 1HB TYR 122 HB2 TYR 122 256.770 0.028 2.425 935 2HB TYR 122 HB1 TYR 122 258.221 -0.570 1.632 936 HD1 TYR 122 HD1 TYR 122 256.987 1.190 4.648 937 HD2 TYR 122 HD2 TYR 122 260.218 -0.915 2.852 938 HE1 TYR 122 HE1 TYR 122 258.122 1.086 6.827 939 HE2 TYR 122 HE2 TYR 122 261.361 -1.026 5.026 940 HH TYR 122 HH TYR 122 260.585 0.853 7.611 941 H TRP 123 HN TRP 123 255.626 1.968 0.635 942 HA TRP 123 HA TRP 123 256.400 1.128 -2.063 943 1HB TRP 123 HB2 TRP 123 254.032 0.602 -2.455 944 2HB TRP 123 HB1 TRP 123 254.702 -0.299 -1.101 945 HD1 TRP 123 HD1 TRP 123 253.754 0.242 1.327 946 HE1 TRP 123 HE1 TRP 123 251.609 1.437 2.111 947 HE3 TRP 123 HE3 TRP 123 252.461 2.545 -3.050 948 HZ2 TRP 123 HZ2 TRP 123 249.632 3.153 1.014 949 HZ3 TRP 123 HZ3 TRP 123 250.434 3.939 -3.095 950 HH2 TRP 123 HH2 TRP 123 249.056 4.230 -1.114 951 H PHE 124 HN PHE 124 255.519 3.883 -0.319 952 HA PHE 124 HA PHE 124 254.146 5.225 -2.437 953 1HB PHE 124 HB2 PHE 124 254.602 5.697 0.310 954 2HB PHE 124 HB1 PHE 124 255.265 7.078 -0.554 955 HD1 PHE 124 HD1 PHE 124 252.423 5.217 -1.930 956 HD2 PHE 124 HD2 PHE 124 253.614 8.573 0.389 957 HE1 PHE 124 HE1 PHE 124 250.170 6.168 -2.150 958 HE2 PHE 124 HE2 PHE 124 251.370 9.526 0.185 959 HZ PHE 124 HZ PHE 124 249.636 8.327 -1.090 960 HA PRO 125 HA PRO 125 258.492 7.410 -2.881 961 1HB PRO 125 HB2 PRO 125 260.579 5.629 -2.695 962 2HB PRO 125 HB1 PRO 125 260.077 6.720 -1.401 963 1HG PRO 125 HG2 PRO 125 259.462 3.825 -1.788 964 2HG PRO 125 HG1 PRO 125 259.836 4.704 -0.295 965 1HD PRO 125 HD2 PRO 125 257.327 4.002 -0.961 966 2HD PRO 125 HD1 PRO 125 257.678 5.497 -0.072 967 H LEU 126 HN LEU 126 257.936 4.037 -3.808 968 HA LEU 126 HA LEU 126 259.267 4.377 -6.344 969 1HB LEU 126 HB2 LEU 126 258.433 2.121 -6.858 970 2HB LEU 126 HB1 LEU 126 259.308 2.187 -5.342 971 HG LEU 126 HG LEU 126 256.643 2.573 -4.621 972 1HD1 LEU 126 HD11 LEU 126 255.845 1.869 -6.769 973 2HD1 LEU 126 HD12 LEU 126 255.547 0.574 -5.609 974 3HD1 LEU 126 HD13 LEU 126 256.892 0.450 -6.742 975 1HD2 LEU 126 HD21 LEU 126 258.005 1.353 -3.195 976 2HD2 LEU 126 HD22 LEU 126 258.577 0.295 -4.485 977 3HD2 LEU 126 HD23 LEU 126 256.937 0.118 -3.863 978 H LEU 127 HN LEU 127 256.035 4.617 -5.071 979 HA LEU 127 HA LEU 127 254.533 4.521 -7.442 980 1HB LEU 127 HB2 LEU 127 254.131 6.127 -4.915 981 2HB LEU 127 HB1 LEU 127 252.945 6.029 -6.199 982 HG LEU 127 HG LEU 127 253.374 4.269 -3.989 983 1HD1 LEU 127 HD11 LEU 127 251.210 5.006 -4.500 984 2HD1 LEU 127 HD12 LEU 127 251.224 3.296 -4.932 985 3HD1 LEU 127 HD13 LEU 127 251.354 4.527 -6.189 986 1HD2 LEU 127 HD21 LEU 127 254.774 2.950 -5.490 987 2HD2 LEU 127 HD22 LEU 127 253.483 2.930 -6.690 988 3HD2 LEU 127 HD23 LEU 127 253.261 2.117 -5.142 989 H LEU 128 HN LEU 128 255.911 7.248 -5.673 990 HA LEU 128 HA LEU 128 255.252 9.296 -7.446 991 1HB LEU 128 HB2 LEU 128 257.257 8.907 -5.294 992 2HB LEU 128 HB1 LEU 128 257.538 10.237 -6.400 993 HG LEU 128 HG LEU 128 254.830 10.013 -5.199 994 1HD1 LEU 128 HD11 LEU 128 255.381 10.591 -3.085 995 2HD1 LEU 128 HD12 LEU 128 256.829 11.465 -3.583 996 3HD1 LEU 128 HD13 LEU 128 256.855 9.705 -3.474 997 1HD2 LEU 128 HD21 LEU 128 256.660 12.350 -5.735 998 2HD2 LEU 128 HD22 LEU 128 254.963 12.430 -5.263 999 3HD2 LEU 128 HD23 LEU 128 255.411 11.762 -6.833 1000 H GLN 129 HN GLN 129 257.835 6.953 -7.529 1001 HA GLN 129 HA GLN 129 259.322 8.304 -9.590 1002 1HB GLN 129 HB2 GLN 129 260.304 6.755 -7.841 1003 2HB GLN 129 HB1 GLN 129 259.593 5.423 -8.741 1004 1HG GLN 129 HG2 GLN 129 261.922 5.683 -9.315 1005 2HG GLN 129 HG1 GLN 129 260.904 6.053 -10.706 1006 1HE2 GLN 129 HE21 GLN 129 261.591 7.717 -11.823 1007 2HE2 GLN 129 HE22 GLN 129 262.394 9.112 -11.196 1008 H LYS 130 HN LYS 130 256.470 6.585 -9.609 1009 HA LYS 130 HA LYS 130 255.161 5.765 -11.277 1010 1HB LYS 130 HB2 LYS 130 257.291 6.685 -13.209 1011 2HB LYS 130 HB1 LYS 130 255.591 6.399 -13.549 1012 1HG LYS 130 HG2 LYS 130 254.947 8.401 -12.730 1013 2HG LYS 130 HG1 LYS 130 256.183 8.407 -11.471 1014 1HD LYS 130 HD2 LYS 130 256.742 8.857 -14.400 1015 2HD LYS 130 HD1 LYS 130 256.500 10.153 -13.226 1016 1HE LYS 130 HE2 LYS 130 258.379 8.965 -11.897 1017 2HE LYS 130 HE1 LYS 130 258.743 8.179 -13.433 1018 1HZ LYS 130 HZ1 LYS 130 259.361 10.157 -14.399 1019 2HZ LYS 130 HZ2 LYS 130 259.920 10.375 -12.818 1020 3HZ LYS 130 HZ3 LYS 130 258.478 11.108 -13.313 1021 H LYS 131 HN LYS 131 256.785 3.981 -9.963 1022 HA LYS 131 HA LYS 131 257.358 2.042 -12.097 1023 1HB LYS 131 HB2 LYS 131 259.041 2.553 -9.639 1024 2HB LYS 131 HB1 LYS 131 259.259 1.190 -10.727 1025 1HG LYS 131 HG2 LYS 131 259.263 3.864 -11.973 1026 2HG LYS 131 HG1 LYS 131 260.631 3.476 -10.929 1027 1HD LYS 131 HD2 LYS 131 261.401 2.683 -12.940 1028 2HD LYS 131 HD1 LYS 131 260.625 1.233 -12.299 1029 1HE LYS 131 HE2 LYS 131 258.819 1.407 -13.730 1030 2HE LYS 131 HE1 LYS 131 259.050 3.138 -13.976 1031 1HZ LYS 131 HZ1 LYS 131 261.013 1.155 -14.955 1032 2HZ LYS 131 HZ2 LYS 131 260.814 2.763 -15.437 1033 3HZ LYS 131 HZ3 LYS 131 259.667 1.600 -15.877 1034 H LYS 132 HN LYS 132 257.250 -0.211 -11.390 1035 HA LYS 132 HA LYS 132 255.276 -0.537 -9.234 1036 1HB LYS 132 HB2 LYS 132 255.866 -2.201 -11.681 1037 2HB LYS 132 HB1 LYS 132 254.829 -2.758 -10.377 1038 1HG LYS 132 HG2 LYS 132 253.144 -1.810 -11.464 1039 2HG LYS 132 HG1 LYS 132 253.829 -0.253 -10.996 1040 1HD LYS 132 HD2 LYS 132 254.966 -1.577 -13.395 1041 2HD LYS 132 HD1 LYS 132 253.341 -0.903 -13.536 1042 1HE LYS 132 HE2 LYS 132 254.569 1.146 -12.319 1043 2HE LYS 132 HE1 LYS 132 255.943 0.458 -13.183 1044 1HZ LYS 132 HZ1 LYS 132 253.381 1.047 -14.539 1045 2HZ LYS 132 HZ2 LYS 132 254.900 0.787 -15.234 1046 3HZ LYS 132 HZ3 LYS 132 254.596 2.214 -14.379 1047 H PHE 133 HN PHE 133 255.870 -1.529 -7.429 1048 HA PHE 133 HA PHE 133 258.087 -3.452 -7.506 1049 1HB PHE 133 HB2 PHE 133 257.863 -1.000 -5.793 1050 2HB PHE 133 HB1 PHE 133 258.718 -2.415 -5.192 1051 HD1 PHE 133 HD1 PHE 133 260.978 -2.475 -5.498 1052 HD2 PHE 133 HD2 PHE 133 258.590 -0.308 -8.275 1053 HE1 PHE 133 HE1 PHE 133 263.012 -1.749 -6.676 1054 HE2 PHE 133 HE2 PHE 133 260.619 0.418 -9.460 1055 HZ PHE 133 HZ PHE 133 262.835 -0.302 -8.660 1056 H HIS 134 HN HIS 134 258.169 -4.836 -5.575 1057 HA HIS 134 HA HIS 134 255.551 -5.100 -4.257 1058 1HB HIS 134 HB2 HIS 134 257.320 -7.323 -5.301 1059 2HB HIS 134 HB1 HIS 134 255.893 -7.572 -4.301 1060 HD1 HIS 134 HD1 HIS 134 254.602 -5.050 -6.180 1061 HD2 HIS 134 HD2 HIS 134 255.792 -8.893 -7.218 1062 HE1 HIS 134 HE1 HIS 134 253.371 -5.584 -8.306 1063 HE2 HIS 134 HE2 HIS 134 254.039 -7.947 -8.867 1064 H GLY 135 HN GLY 135 255.678 -5.041 -2.076 1065 1HA GLY 135 HA2 GLY 135 258.329 -5.599 -0.893 1066 2HA GLY 135 HA1 GLY 135 257.240 -4.366 -0.283 1067 H TYR 136 HN TYR 136 258.515 -6.960 0.771 1068 HA TYR 136 HA TYR 136 256.037 -8.125 1.862 1069 1HB TYR 136 HB2 TYR 136 258.727 -9.388 1.319 1070 2HB TYR 136 HB1 TYR 136 257.521 -10.142 2.356 1071 HD1 TYR 136 HD1 TYR 136 256.507 -11.915 1.302 1072 HD2 TYR 136 HD2 TYR 136 257.382 -8.426 -0.971 1073 HE1 TYR 136 HE1 TYR 136 255.450 -12.939 -0.667 1074 HE2 TYR 136 HE2 TYR 136 256.324 -9.440 -2.945 1075 HH TYR 136 HH TYR 136 254.437 -12.289 -2.762 1076 H PHE 137 HN PHE 137 255.688 -7.342 3.842 1077 HA PHE 137 HA PHE 137 258.021 -6.797 5.562 1078 1HB PHE 137 HB2 PHE 137 255.255 -5.676 5.973 1079 2HB PHE 137 HB1 PHE 137 256.778 -5.096 6.634 1080 HD1 PHE 137 HD1 PHE 137 254.319 -4.392 4.331 1081 HD2 PHE 137 HD2 PHE 137 258.557 -4.513 4.676 1082 HE1 PHE 137 HE1 PHE 137 254.514 -2.793 2.470 1083 HE2 PHE 137 HE2 PHE 137 258.761 -2.917 2.817 1084 HZ PHE 137 HZ PHE 137 256.737 -2.053 1.712 1085 H LYS 138 HN LYS 138 258.164 -7.699 7.550 1086 HA LYS 138 HA LYS 138 256.308 -9.821 8.247 1087 1HB LYS 138 HB2 LYS 138 259.040 -8.996 9.136 1088 2HB LYS 138 HB1 LYS 138 258.055 -9.962 10.225 1089 1HG LYS 138 HG2 LYS 138 257.954 -11.161 7.656 1090 2HG LYS 138 HG1 LYS 138 259.641 -10.819 8.041 1091 1HD LYS 138 HD2 LYS 138 257.683 -12.379 9.726 1092 2HD LYS 138 HD1 LYS 138 259.059 -13.028 8.833 1093 1HE LYS 138 HE2 LYS 138 260.301 -11.168 10.332 1094 2HE LYS 138 HE1 LYS 138 258.968 -11.588 11.407 1095 1HZ LYS 138 HZ1 LYS 138 261.221 -13.221 10.512 1096 2HZ LYS 138 HZ2 LYS 138 259.744 -14.006 10.762 1097 3HZ LYS 138 HZ3 LYS 138 260.471 -13.151 12.028 1098 H PHE 139 HN PHE 139 255.022 -9.767 10.150 1099 HA PHE 139 HA PHE 139 254.948 -7.101 11.410 1100 1HB PHE 139 HB2 PHE 139 252.833 -8.831 10.339 1101 2HB PHE 139 HB1 PHE 139 252.480 -8.196 11.942 1102 HD1 PHE 139 HD1 PHE 139 250.653 -6.833 11.208 1103 HD2 PHE 139 HD2 PHE 139 254.530 -6.355 9.517 1104 HE1 PHE 139 HE1 PHE 139 249.950 -4.699 10.207 1105 HE2 PHE 139 HE2 PHE 139 253.833 -4.219 8.514 1106 HZ PHE 139 HZ PHE 139 251.541 -3.389 8.858 1107 H GLN 140 HN GLN 140 254.047 -7.041 13.605 1108 HA GLN 140 HA GLN 140 254.534 -9.443 15.208 1109 1HB GLN 140 HB2 GLN 140 256.626 -8.294 15.362 1110 2HB GLN 140 HB1 GLN 140 255.836 -6.748 15.590 1111 1HG GLN 140 HG2 GLN 140 256.901 -7.802 17.620 1112 2HG GLN 140 HG1 GLN 140 255.239 -7.249 17.797 1113 1HE2 GLN 140 HE21 GLN 140 253.692 -8.677 18.349 1114 2HE2 GLN 140 HE22 GLN 140 253.962 -10.364 18.603 1115 H GLY 141 HN GLY 141 252.116 -9.215 15.023 1116 1HA GLY 141 HA2 GLY 141 250.488 -9.003 16.850 1117 2HA GLY 141 HA1 GLY 141 251.150 -7.403 17.150 1118 H GLN 142 HN GLN 142 251.052 -5.932 15.105 1119 HA GLN 142 HA GLN 142 249.113 -6.345 13.136 1120 1HB GLN 142 HB2 GLN 142 248.081 -5.456 15.732 1121 2HB GLN 142 HB1 GLN 142 247.585 -4.440 14.386 1122 1HG GLN 142 HG2 GLN 142 246.149 -5.960 13.635 1123 2HG GLN 142 HG1 GLN 142 247.321 -7.267 13.792 1124 1HE2 GLN 142 HE21 GLN 142 244.398 -6.250 14.790 1125 2HE2 GLN 142 HE22 GLN 142 244.296 -7.058 16.314 1126 H ASP 143 HN ASP 143 250.738 -3.987 15.207 1127 HA ASP 143 HA ASP 143 250.948 -2.221 12.854 1128 1HB ASP 143 HB2 ASP 143 251.002 -0.303 14.419 1129 2HB ASP 143 HB1 ASP 143 249.487 -1.195 14.493 1130 H THR 144 HN THR 144 252.772 -4.347 14.209 1131 HA THR 144 HA THR 144 255.144 -2.600 14.360 1132 HB THR 144 HB THR 144 254.639 -5.216 15.784 1133 HG1 THR 144 HG1 THR 144 254.321 -4.015 17.487 1134 1HG2 THR 144 HG21 THR 144 256.952 -5.130 15.067 1135 2HG2 THR 144 HG22 THR 144 256.824 -4.920 16.814 1136 3HG2 THR 144 HG23 THR 144 257.127 -3.526 15.777 1137 H ILE 145 HN ILE 145 256.844 -3.052 13.056 1138 HA ILE 145 HA ILE 145 256.576 -5.451 11.392 1139 HB ILE 145 HB ILE 145 258.138 -2.977 10.663 1140 1HG1 ILE 145 HG12 ILE 145 255.381 -3.872 9.779 1141 2HG1 ILE 145 HG11 ILE 145 255.755 -2.442 10.737 1142 1HG2 ILE 145 HG21 ILE 145 258.196 -5.607 9.681 1143 2HG2 ILE 145 HG22 ILE 145 258.953 -4.180 8.978 1144 3HG2 ILE 145 HG23 ILE 145 257.331 -4.656 8.477 1145 1HD1 ILE 145 HD11 ILE 145 256.584 -2.925 7.883 1146 2HD1 ILE 145 HD12 ILE 145 256.969 -1.495 8.841 1147 3HD1 ILE 145 HD13 ILE 145 255.292 -1.856 8.432 1148 H LEU 146 HN LEU 146 258.227 -6.860 11.203 1149 HA LEU 146 HA LEU 146 260.591 -6.334 12.877 1150 1HB LEU 146 HB2 LEU 146 259.596 -9.069 12.140 1151 2HB LEU 146 HB1 LEU 146 260.674 -8.613 13.447 1152 HG LEU 146 HG LEU 146 257.790 -7.753 13.380 1153 1HD1 LEU 146 HD11 LEU 146 258.610 -10.386 13.540 1154 2HD1 LEU 146 HD12 LEU 146 257.066 -9.730 14.085 1155 3HD1 LEU 146 HD13 LEU 146 258.401 -9.902 15.223 1156 1HD2 LEU 146 HD21 LEU 146 260.053 -7.533 15.253 1157 2HD2 LEU 146 HD22 LEU 146 258.499 -7.958 15.970 1158 3HD2 LEU 146 HD23 LEU 146 258.659 -6.479 15.023 1159 H ASP 147 HN ASP 147 259.482 -6.993 9.713 1160 HA ASP 147 HA ASP 147 262.194 -6.975 8.727 1161 1HB ASP 147 HB2 ASP 147 260.976 -9.438 9.126 1162 2HB ASP 147 HB1 ASP 147 260.717 -9.123 7.413 1163 H TYR 148 HN TYR 148 262.363 -6.211 6.611 1164 HA TYR 148 HA TYR 148 259.859 -5.811 5.164 1165 1HB TYR 148 HB2 TYR 148 260.276 -3.483 4.740 1166 2HB TYR 148 HB1 TYR 148 260.273 -3.762 6.478 1167 HD1 TYR 148 HD1 TYR 148 262.456 -3.147 3.554 1168 HD2 TYR 148 HD2 TYR 148 262.191 -3.287 7.798 1169 HE1 TYR 148 HE1 TYR 148 264.666 -2.082 3.720 1170 HE2 TYR 148 HE2 TYR 148 264.401 -2.222 7.976 1171 HH TYR 148 HH TYR 148 266.535 -1.975 5.417 1172 H THR 149 HN THR 149 260.004 -6.201 3.053 1173 HA THR 149 HA THR 149 262.675 -6.162 1.818 1174 HB THR 149 HB THR 149 261.251 -8.067 0.391 1175 HG1 THR 149 HG1 THR 149 259.813 -8.050 2.298 1176 1HG2 THR 149 HG21 THR 149 263.321 -8.375 2.538 1177 2HG2 THR 149 HG22 THR 149 263.545 -8.394 0.788 1178 3HG2 THR 149 HG23 THR 149 262.712 -9.730 1.587 1179 H LEU 150 HN LEU 150 262.767 -5.477 -0.302 1180 HA LEU 150 HA LEU 150 260.264 -4.563 -1.522 1181 1HB LEU 150 HB2 LEU 150 262.766 -2.929 -1.128 1182 2HB LEU 150 HB1 LEU 150 261.503 -2.490 -2.264 1183 HG LEU 150 HG LEU 150 260.101 -2.869 0.082 1184 1HD1 LEU 150 HD11 LEU 150 261.644 -2.882 1.713 1185 2HD1 LEU 150 HD12 LEU 150 261.634 -1.136 1.466 1186 3HD1 LEU 150 HD13 LEU 150 262.877 -2.127 0.703 1187 1HD2 LEU 150 HD21 LEU 150 259.452 -0.741 -0.275 1188 2HD2 LEU 150 HD22 LEU 150 260.358 -0.931 -1.777 1189 3HD2 LEU 150 HD23 LEU 150 261.107 -0.141 -0.389 1190 H ARG 151 HN ARG 151 260.060 -5.223 -3.539 1191 HA ARG 151 HA ARG 151 262.491 -5.818 -5.093 1192 1HB ARG 151 HB2 ARG 151 259.908 -7.377 -5.241 1193 2HB ARG 151 HB1 ARG 151 261.419 -7.747 -6.062 1194 1HG ARG 151 HG2 ARG 151 262.274 -7.760 -3.518 1195 2HG ARG 151 HG1 ARG 151 260.597 -8.257 -3.278 1196 1HD ARG 151 HD2 ARG 151 260.947 -10.007 -5.025 1197 2HD ARG 151 HD1 ARG 151 262.655 -9.570 -5.047 1198 HE ARG 151 HE ARG 151 261.729 -10.195 -2.419 1199 1HH1 ARG 151 HH11 ARG 151 262.833 -11.595 -5.419 1200 2HH1 ARG 151 HH12 ARG 151 263.398 -13.053 -4.674 1201 1HH2 ARG 151 HH21 ARG 151 262.473 -12.112 -1.438 1202 2HH2 ARG 151 HH22 ARG 151 263.193 -13.347 -2.415 1203 H GLU 152 HN GLU 152 262.181 -5.744 -7.441 1204 HA GLU 152 HA GLU 152 260.274 -3.628 -8.153 1205 1HB GLU 152 HB2 GLU 152 261.702 -3.178 -10.060 1206 2HB GLU 152 HB1 GLU 152 262.676 -3.211 -8.598 1207 1HG GLU 152 HG2 GLU 152 263.926 -4.889 -9.343 1208 2HG GLU 152 HG1 GLU 152 262.521 -5.808 -9.880 1209 H VAL 153 HN VAL 153 258.976 -3.798 -10.018 1210 HA VAL 153 HA VAL 153 258.865 -6.379 -11.376 1211 HB VAL 153 HB VAL 153 256.393 -6.504 -11.084 1212 1HG1 VAL 153 HG11 VAL 153 258.349 -7.486 -9.493 1213 2HG1 VAL 153 HG12 VAL 153 256.639 -7.873 -9.314 1214 3HG1 VAL 153 HG13 VAL 153 257.367 -6.619 -8.311 1215 1HG2 VAL 153 HG21 VAL 153 256.408 -3.989 -10.311 1216 2HG2 VAL 153 HG22 VAL 153 256.601 -4.713 -8.714 1217 3HG2 VAL 153 HG23 VAL 153 255.199 -5.119 -9.703 1218 H ASP 154 HN ASP 154 257.912 -6.311 -13.414 1219 HA ASP 154 HA ASP 154 257.013 -3.677 -14.360 1220 1HB ASP 154 HB2 ASP 154 259.224 -5.375 -15.437 1221 2HB ASP 154 HB1 ASP 154 258.250 -4.442 -16.568 1222 H THR 155 HN THR 155 257.248 -7.141 -15.108 1223 HA THR 155 HA THR 155 254.880 -6.939 -16.809 1224 HB THR 155 HB THR 155 256.642 -9.339 -16.274 1225 HG1 THR 155 HG1 THR 155 257.934 -7.957 -17.327 1226 1HG2 THR 155 HG21 THR 155 254.183 -9.116 -17.651 1227 2HG2 THR 155 HG22 THR 155 255.254 -10.512 -17.523 1228 3HG2 THR 155 HG23 THR 155 255.457 -9.363 -18.845 1229 H VAL 156 HN VAL 156 253.073 -6.876 -15.599 1230 HA VAL 156 HA VAL 156 252.676 -9.060 -13.661 1231 HB VAL 156 HB VAL 156 251.523 -6.281 -13.396 1232 1HG1 VAL 156 HG11 VAL 156 251.280 -7.298 -10.966 1233 2HG1 VAL 156 HG12 VAL 156 251.261 -8.814 -11.865 1234 3HG1 VAL 156 HG13 VAL 156 250.060 -7.570 -12.211 1235 1HG2 VAL 156 HG21 VAL 156 253.466 -7.209 -11.399 1236 2HG2 VAL 156 HG22 VAL 156 253.267 -5.621 -12.138 1237 3HG2 VAL 156 HG23 VAL 156 254.139 -6.890 -12.998 Start of MODEL 17 1 1H MET 1 HT1 MET 1 242.033 -23.064 -2.838 2 2H MET 1 HT2 MET 1 241.310 -22.536 -1.374 3 3H MET 1 HT3 MET 1 241.167 -24.175 -1.861 4 HA MET 1 HA MET 1 242.786 -23.744 -0.081 5 1HB MET 1 HB2 MET 1 243.265 -25.108 -2.680 6 2HB MET 1 HB1 MET 1 244.629 -24.991 -1.578 7 1HG MET 1 HG2 MET 1 243.251 -26.053 0.177 8 2HG MET 1 HG1 MET 1 241.958 -26.254 -1.006 9 1HE MET 1 HE1 MET 1 243.450 -28.163 0.907 10 2HE MET 1 HE2 MET 1 244.275 -29.502 0.109 11 3HE MET 1 HE3 MET 1 242.535 -29.293 -0.091 12 H GLY 2 HN GLY 2 243.958 -22.078 0.619 13 1HA GLY 2 HA2 GLY 2 246.360 -21.253 -0.421 14 2HA GLY 2 HA1 GLY 2 245.172 -20.190 -1.159 15 H ALA 3 HN ALA 3 246.361 -21.354 1.969 16 HA ALA 3 HA ALA 3 245.030 -19.500 3.591 17 1HB ALA 3 HB1 ALA 3 247.738 -20.305 4.435 18 2HB ALA 3 HB2 ALA 3 246.612 -21.616 4.084 19 3HB ALA 3 HB3 ALA 3 246.203 -20.402 5.296 20 H SER 4 HN SER 4 245.082 -17.394 2.981 21 HA SER 4 HA SER 4 247.278 -15.800 3.649 22 1HB SER 4 HB2 SER 4 248.539 -16.321 1.796 23 2HB SER 4 HB1 SER 4 247.125 -16.643 0.795 24 HG SER 4 HG SER 4 246.846 -14.484 0.488 25 H ARG 5 HN ARG 5 245.926 -14.455 4.628 26 HA ARG 5 HA ARG 5 243.449 -13.588 3.727 27 1HB ARG 5 HB2 ARG 5 245.466 -12.462 5.633 28 2HB ARG 5 HB1 ARG 5 244.070 -11.493 5.189 29 1HG ARG 5 HG2 ARG 5 243.734 -12.743 7.273 30 2HG ARG 5 HG1 ARG 5 242.572 -13.190 6.021 31 1HD ARG 5 HD2 ARG 5 243.974 -15.153 5.479 32 2HD ARG 5 HD1 ARG 5 245.050 -14.721 6.806 33 HE ARG 5 HE ARG 5 243.560 -15.667 8.248 34 1HH1 ARG 5 HH11 ARG 5 241.894 -14.945 5.268 35 2HH1 ARG 5 HH12 ARG 5 240.420 -15.709 5.761 36 1HH2 ARG 5 HH21 ARG 5 241.624 -16.673 8.898 37 2HH2 ARG 5 HH22 ARG 5 240.266 -16.690 7.822 38 H LEU 6 HN LEU 6 243.412 -13.021 1.608 39 HA LEU 6 HA LEU 6 245.252 -11.027 0.588 40 1HB LEU 6 HB2 LEU 6 244.092 -13.099 -0.630 41 2HB LEU 6 HB1 LEU 6 242.877 -11.886 -0.984 42 HG LEU 6 HG LEU 6 245.751 -11.319 -1.603 43 1HD1 LEU 6 HD11 LEU 6 243.882 -12.788 -3.451 44 2HD1 LEU 6 HD12 LEU 6 245.189 -13.552 -2.549 45 3HD1 LEU 6 HD13 LEU 6 245.556 -12.328 -3.764 46 1HD2 LEU 6 HD21 LEU 6 244.938 -9.663 -2.943 47 2HD2 LEU 6 HD22 LEU 6 243.625 -9.733 -1.767 48 3HD2 LEU 6 HD23 LEU 6 243.460 -10.545 -3.322 49 H TYR 7 HN TYR 7 244.939 -8.965 0.853 50 HA TYR 7 HA TYR 7 242.194 -7.909 0.972 51 1HB TYR 7 HB2 TYR 7 244.619 -7.233 2.613 52 2HB TYR 7 HB1 TYR 7 243.339 -6.049 2.384 53 HD1 TYR 7 HD1 TYR 7 243.510 -9.706 3.180 54 HD2 TYR 7 HD2 TYR 7 241.893 -5.895 4.163 55 HE1 TYR 7 HE1 TYR 7 242.247 -10.724 5.028 56 HE2 TYR 7 HE2 TYR 7 240.627 -6.903 6.013 57 HH TYR 7 HH TYR 7 240.311 -10.295 6.393 58 H THR 8 HN THR 8 242.446 -5.334 0.726 59 HA THR 8 HA THR 8 244.119 -4.874 -1.661 60 HB THR 8 HB THR 8 242.345 -3.622 -2.666 61 HG1 THR 8 HG1 THR 8 240.756 -4.122 -0.382 62 1HG2 THR 8 HG21 THR 8 240.351 -5.343 -2.377 63 2HG2 THR 8 HG22 THR 8 241.647 -6.316 -1.681 64 3HG2 THR 8 HG23 THR 8 241.788 -5.707 -3.329 65 H LEU 9 HN LEU 9 244.368 -2.511 -2.143 66 HA LEU 9 HA LEU 9 244.193 -0.708 0.115 67 1HB LEU 9 HB2 LEU 9 246.377 -2.119 0.229 68 2HB LEU 9 HB1 LEU 9 246.901 -1.118 -1.111 69 HG LEU 9 HG LEU 9 246.238 -0.240 1.682 70 1HD1 LEU 9 HD11 LEU 9 248.530 -1.219 0.904 71 2HD1 LEU 9 HD12 LEU 9 248.470 0.204 1.945 72 3HD1 LEU 9 HD13 LEU 9 248.745 0.388 0.212 73 1HD2 LEU 9 HD21 LEU 9 246.895 2.050 0.814 74 2HD2 LEU 9 HD22 LEU 9 245.294 1.461 0.366 75 3HD2 LEU 9 HD23 LEU 9 246.614 1.398 -0.801 76 H VAL 10 HN VAL 10 243.215 0.956 -0.929 77 HA VAL 10 HA VAL 10 244.300 1.750 -3.532 78 HB VAL 10 HB VAL 10 242.080 1.173 -3.894 79 1HG1 VAL 10 HG11 VAL 10 240.299 2.350 -2.339 80 2HG1 VAL 10 HG12 VAL 10 241.632 2.202 -1.196 81 3HG1 VAL 10 HG13 VAL 10 240.991 0.767 -1.998 82 1HG2 VAL 10 HG21 VAL 10 241.964 4.131 -3.361 83 2HG2 VAL 10 HG22 VAL 10 240.916 3.221 -4.447 84 3HG2 VAL 10 HG23 VAL 10 242.632 3.388 -4.815 85 H LEU 11 HN LEU 11 245.252 3.584 -3.734 86 HA LEU 11 HA LEU 11 244.769 5.724 -1.774 87 1HB LEU 11 HB2 LEU 11 247.187 4.294 -2.347 88 2HB LEU 11 HB1 LEU 11 247.386 5.956 -2.868 89 HG LEU 11 HG LEU 11 246.864 4.921 -0.087 90 1HD1 LEU 11 HD11 LEU 11 248.827 7.036 -0.428 91 2HD1 LEU 11 HD12 LEU 11 249.190 5.618 -1.415 92 3HD1 LEU 11 HD13 LEU 11 248.990 5.451 0.329 93 1HD2 LEU 11 HD21 LEU 11 245.402 6.656 0.053 94 2HD2 LEU 11 HD22 LEU 11 246.193 7.576 -1.227 95 3HD2 LEU 11 HD23 LEU 11 246.903 7.519 0.387 96 H VAL 12 HN VAL 12 243.758 7.300 -2.854 97 HA VAL 12 HA VAL 12 244.108 7.543 -5.716 98 HB VAL 12 HB VAL 12 242.407 9.295 -3.952 99 1HG1 VAL 12 HG11 VAL 12 241.077 9.160 -6.242 100 2HG1 VAL 12 HG12 VAL 12 242.695 8.852 -6.872 101 3HG1 VAL 12 HG13 VAL 12 242.364 10.336 -5.978 102 1HG2 VAL 12 HG21 VAL 12 241.315 7.401 -3.433 103 2HG2 VAL 12 HG22 VAL 12 242.068 6.491 -4.743 104 3HG2 VAL 12 HG23 VAL 12 240.676 7.523 -5.072 105 H LEU 13 HN LEU 13 245.900 8.514 -6.353 106 HA LEU 13 HA LEU 13 246.663 11.071 -5.085 107 1HB LEU 13 HB2 LEU 13 248.220 8.925 -5.191 108 2HB LEU 13 HB1 LEU 13 248.582 9.579 -6.781 109 HG LEU 13 HG LEU 13 248.643 11.648 -4.778 110 1HD1 LEU 13 HD11 LEU 13 250.939 9.885 -4.339 111 2HD1 LEU 13 HD12 LEU 13 249.412 9.318 -3.664 112 3HD1 LEU 13 HD13 LEU 13 250.044 10.899 -3.207 113 1HD2 LEU 13 HD21 LEU 13 251.154 11.434 -5.785 114 2HD2 LEU 13 HD22 LEU 13 249.832 12.338 -6.522 115 3HD2 LEU 13 HD23 LEU 13 250.185 10.697 -7.061 116 H GLN 14 HN GLN 14 247.560 12.690 -6.520 117 HA GLN 14 HA GLN 14 246.748 12.426 -9.330 118 1HB GLN 14 HB2 GLN 14 245.351 13.957 -7.517 119 2HB GLN 14 HB1 GLN 14 246.445 15.130 -8.236 120 1HG GLN 14 HG2 GLN 14 245.378 15.111 -10.206 121 2HG GLN 14 HG1 GLN 14 245.091 13.371 -10.152 122 1HE2 GLN 14 HE21 GLN 14 243.589 16.243 -10.234 123 2HE2 GLN 14 HE22 GLN 14 242.110 15.843 -9.435 124 HA PRO 15 HA PRO 15 250.722 14.042 -10.310 125 1HB PRO 15 HB2 PRO 15 249.558 15.803 -12.362 126 2HB PRO 15 HB1 PRO 15 250.669 14.443 -12.549 127 1HG PRO 15 HG2 PRO 15 248.099 14.279 -13.310 128 2HG PRO 15 HG1 PRO 15 248.965 12.888 -12.632 129 1HD PRO 15 HD2 PRO 15 246.997 14.725 -11.316 130 2HD PRO 15 HD1 PRO 15 247.160 12.961 -11.178 131 H GLN 16 HN GLN 16 248.892 15.662 -8.450 132 HA GLN 16 HA GLN 16 250.672 17.876 -8.161 133 1HB GLN 16 HB2 GLN 16 248.666 19.525 -8.180 134 2HB GLN 16 HB1 GLN 16 249.404 19.062 -9.706 135 1HG GLN 16 HG2 GLN 16 247.518 18.164 -10.454 136 2HG GLN 16 HG1 GLN 16 247.261 17.267 -8.959 137 1HE2 GLN 16 HE21 GLN 16 247.429 20.744 -9.603 138 2HE2 GLN 16 HE22 GLN 16 245.857 21.112 -8.988 139 H ARG 17 HN ARG 17 247.628 16.358 -7.238 140 HA ARG 17 HA ARG 17 248.299 16.877 -4.429 141 1HB ARG 17 HB2 ARG 17 245.773 17.117 -4.056 142 2HB ARG 17 HB1 ARG 17 246.613 18.479 -4.783 143 1HG ARG 17 HG2 ARG 17 244.856 18.395 -6.194 144 2HG ARG 17 HG1 ARG 17 245.875 17.210 -7.011 145 1HD ARG 17 HD2 ARG 17 244.630 15.423 -6.260 146 2HD ARG 17 HD1 ARG 17 244.020 16.303 -4.859 147 HE ARG 17 HE ARG 17 242.775 16.098 -7.382 148 1HH1 ARG 17 HH11 ARG 17 243.391 18.409 -4.841 149 2HH1 ARG 17 HH12 ARG 17 241.983 19.357 -5.191 150 1HH2 ARG 17 HH21 ARG 17 240.925 17.342 -7.844 151 2HH2 ARG 17 HH22 ARG 17 240.583 18.751 -6.895 152 H VAL 18 HN VAL 18 247.312 15.361 -2.926 153 HA VAL 18 HA VAL 18 246.585 12.802 -4.206 154 HB VAL 18 HB VAL 18 248.687 12.343 -3.368 155 1HG1 VAL 18 HG11 VAL 18 248.921 14.508 -2.153 156 2HG1 VAL 18 HG12 VAL 18 249.626 13.129 -1.312 157 3HG1 VAL 18 HG13 VAL 18 248.071 13.777 -0.791 158 1HG2 VAL 18 HG21 VAL 18 247.036 10.717 -2.562 159 2HG2 VAL 18 HG22 VAL 18 246.878 11.635 -1.065 160 3HG2 VAL 18 HG23 VAL 18 248.412 10.864 -1.468 161 H LEU 19 HN LEU 19 245.206 11.409 -2.899 162 HA LEU 19 HA LEU 19 243.561 12.915 -0.971 163 1HB LEU 19 HB2 LEU 19 242.299 12.535 -2.979 164 2HB LEU 19 HB1 LEU 19 242.739 10.840 -2.992 165 HG LEU 19 HG LEU 19 241.357 10.381 -1.090 166 1HD1 LEU 19 HD11 LEU 19 239.918 12.609 -0.462 167 2HD1 LEU 19 HD12 LEU 19 241.528 13.279 -0.721 168 3HD1 LEU 19 HD13 LEU 19 241.287 11.993 0.462 169 1HD2 LEU 19 HD21 LEU 19 239.159 11.611 -2.024 170 2HD2 LEU 19 HD22 LEU 19 239.892 10.206 -2.797 171 3HD2 LEU 19 HD23 LEU 19 240.237 11.826 -3.403 172 H LEU 20 HN LEU 20 243.925 12.196 1.021 173 HA LEU 20 HA LEU 20 244.497 9.333 1.405 174 1HB LEU 20 HB2 LEU 20 245.686 11.734 2.461 175 2HB LEU 20 HB1 LEU 20 245.079 10.742 3.772 176 HG LEU 20 HG LEU 20 246.877 9.639 1.625 177 1HD1 LEU 20 HD11 LEU 20 248.772 10.177 2.829 178 2HD1 LEU 20 HD12 LEU 20 247.873 10.454 4.321 179 3HD1 LEU 20 HD13 LEU 20 247.795 11.633 3.012 180 1HD2 LEU 20 HD21 LEU 20 246.758 7.715 2.744 181 2HD2 LEU 20 HD22 LEU 20 245.385 8.414 3.602 182 3HD2 LEU 20 HD23 LEU 20 247.003 8.512 4.298 183 H GLY 21 HN GLY 21 243.425 8.172 3.008 184 1HA GLY 21 HA2 GLY 21 240.892 9.395 3.874 185 2HA GLY 21 HA1 GLY 21 241.189 7.670 3.715 186 H MET 22 HN MET 22 240.623 9.956 5.928 187 HA MET 22 HA MET 22 242.372 8.709 7.940 188 1HB MET 22 HB2 MET 22 242.854 11.056 7.785 189 2HB MET 22 HB1 MET 22 241.146 11.467 7.859 190 1HG MET 22 HG2 MET 22 241.002 10.873 10.140 191 2HG MET 22 HG1 MET 22 242.577 10.083 10.107 192 1HE MET 22 HE1 MET 22 244.995 11.651 10.586 193 2HE MET 22 HE2 MET 22 244.964 13.077 9.552 194 3HE MET 22 HE3 MET 22 244.500 11.506 8.900 195 H LYS 23 HN LYS 23 241.461 7.919 9.843 196 HA LYS 23 HA LYS 23 238.587 7.474 9.725 197 1HB LYS 23 HB2 LYS 23 240.874 6.237 11.178 198 2HB LYS 23 HB1 LYS 23 239.286 6.139 11.924 199 1HG LYS 23 HG2 LYS 23 239.249 5.426 9.106 200 2HG LYS 23 HG1 LYS 23 240.321 4.401 10.062 201 1HD LYS 23 HD2 LYS 23 237.456 4.994 10.792 202 2HD LYS 23 HD1 LYS 23 237.970 3.568 9.889 203 1HE LYS 23 HE2 LYS 23 239.647 3.644 12.108 204 2HE LYS 23 HE1 LYS 23 238.060 4.091 12.733 205 1HZ LYS 23 HZ1 LYS 23 237.802 1.874 12.830 206 2HZ LYS 23 HZ2 LYS 23 238.982 1.558 11.660 207 3HZ LYS 23 HZ3 LYS 23 237.425 2.019 11.187 208 H LYS 24 HN LYS 24 237.155 8.091 11.373 209 HA LYS 24 HA LYS 24 238.049 10.438 12.831 210 1HB LYS 24 HB2 LYS 24 235.400 9.302 12.070 211 2HB LYS 24 HB1 LYS 24 235.471 10.333 13.492 212 1HG LYS 24 HG2 LYS 24 235.620 12.177 12.265 213 2HG LYS 24 HG1 LYS 24 236.892 11.492 11.252 214 1HD LYS 24 HD2 LYS 24 235.403 10.673 9.703 215 2HD LYS 24 HD1 LYS 24 234.089 10.551 10.874 216 1HE LYS 24 HE2 LYS 24 235.124 13.260 10.244 217 2HE LYS 24 HE1 LYS 24 234.169 12.446 9.007 218 1HZ LYS 24 HZ1 LYS 24 232.981 13.909 10.733 219 2HZ LYS 24 HZ2 LYS 24 233.184 12.597 11.780 220 3HZ LYS 24 HZ3 LYS 24 232.306 12.406 10.347 221 H ARG 25 HN ARG 25 237.042 7.156 13.413 222 HA ARG 25 HA ARG 25 238.200 7.119 15.983 223 1HB ARG 25 HB2 ARG 25 236.081 6.592 17.252 224 2HB ARG 25 HB1 ARG 25 236.291 8.275 16.788 225 1HG ARG 25 HG2 ARG 25 234.683 6.369 15.125 226 2HG ARG 25 HG1 ARG 25 233.984 7.247 16.489 227 1HD ARG 25 HD2 ARG 25 235.181 9.280 15.240 228 2HD ARG 25 HD1 ARG 25 234.893 8.233 13.852 229 HE ARG 25 HE ARG 25 232.662 8.712 14.005 230 1HH1 ARG 25 HH11 ARG 25 234.203 9.602 17.006 231 2HH1 ARG 25 HH12 ARG 25 232.790 10.367 17.650 232 1HH2 ARG 25 HH21 ARG 25 230.801 9.718 14.850 233 2HH2 ARG 25 HH22 ARG 25 230.859 10.433 16.427 234 H GLY 26 HN GLY 26 239.024 5.147 16.083 235 1HA GLY 26 HA2 GLY 26 237.733 2.761 16.172 236 2HA GLY 26 HA1 GLY 26 237.970 3.018 14.450 237 H PHE 27 HN PHE 27 239.679 1.987 13.686 238 HA PHE 27 HA PHE 27 241.917 1.422 15.492 239 1HB PHE 27 HB2 PHE 27 240.768 0.085 13.109 240 2HB PHE 27 HB1 PHE 27 242.518 -0.007 13.289 241 HD1 PHE 27 HD1 PHE 27 239.715 -1.815 13.817 242 HD2 PHE 27 HD2 PHE 27 243.096 -0.410 15.988 243 HE1 PHE 27 HE1 PHE 27 239.447 -3.661 15.420 244 HE2 PHE 27 HE2 PHE 27 242.835 -2.254 17.595 245 HZ PHE 27 HZ PHE 27 241.009 -3.883 17.313 246 H GLY 28 HN GLY 28 241.390 4.027 14.080 247 1HA GLY 28 HA2 GLY 28 244.051 4.680 13.471 248 2HA GLY 28 HA1 GLY 28 243.208 4.369 11.963 249 H ALA 29 HN ALA 29 241.633 5.774 14.767 250 HA ALA 29 HA ALA 29 240.492 7.902 13.394 251 1HB ALA 29 HB1 ALA 29 241.123 8.338 16.241 252 2HB ALA 29 HB2 ALA 29 240.172 6.907 15.841 253 3HB ALA 29 HB3 ALA 29 239.600 8.508 15.369 254 H GLY 30 HN GLY 30 240.992 10.109 13.235 255 1HA GLY 30 HA2 GLY 30 242.398 11.884 12.842 256 2HA GLY 30 HA1 GLY 30 243.121 11.455 14.383 257 H ARG 31 HN ARG 31 243.182 9.150 11.801 258 HA ARG 31 HA ARG 31 245.951 9.871 11.148 259 1HB ARG 31 HB2 ARG 31 244.953 7.341 12.336 260 2HB ARG 31 HB1 ARG 31 246.150 7.192 11.057 261 1HG ARG 31 HG2 ARG 31 247.815 8.035 12.328 262 2HG ARG 31 HG1 ARG 31 246.747 9.146 13.186 263 1HD ARG 31 HD2 ARG 31 247.244 7.659 14.860 264 2HD ARG 31 HD1 ARG 31 245.778 6.932 14.204 265 HE ARG 31 HE ARG 31 247.976 5.853 12.853 266 1HH1 ARG 31 HH11 ARG 31 246.572 5.843 16.048 267 2HH1 ARG 31 HH12 ARG 31 247.179 4.272 16.446 268 1HH2 ARG 31 HH21 ARG 31 248.776 3.785 13.375 269 2HH2 ARG 31 HH22 ARG 31 248.431 3.103 14.930 270 H TRP 32 HN TRP 32 246.540 9.527 9.046 271 HA TRP 32 HA TRP 32 244.370 8.961 7.196 272 1HB TRP 32 HB2 TRP 32 247.019 9.442 6.024 273 2HB TRP 32 HB1 TRP 32 245.478 10.215 5.682 274 HD1 TRP 32 HD1 TRP 32 248.429 10.465 8.160 275 HE1 TRP 32 HE1 TRP 32 248.527 12.876 9.047 276 HE3 TRP 32 HE3 TRP 32 244.194 12.317 5.974 277 HZ2 TRP 32 HZ2 TRP 32 247.027 15.251 8.840 278 HZ3 TRP 32 HZ3 TRP 32 243.600 14.671 6.370 279 HH2 TRP 32 HH2 TRP 32 244.988 16.107 7.773 280 H ASN 33 HN ASN 33 244.543 7.416 5.470 281 HA ASN 33 HA ASN 33 246.626 5.567 5.197 282 1HB ASN 33 HB2 ASN 33 245.435 5.072 7.562 283 2HB ASN 33 HB1 ASN 33 244.402 4.107 6.511 284 1HD2 ASN 33 HD21 ASN 33 245.301 2.351 7.817 285 2HD2 ASN 33 HD22 ASN 33 246.804 1.649 7.335 286 H GLY 34 HN GLY 34 246.277 4.121 3.524 287 1HA GLY 34 HA2 GLY 34 244.410 4.809 1.579 288 2HA GLY 34 HA1 GLY 34 245.283 3.284 1.633 289 H PHE 35 HN PHE 35 242.796 3.239 0.612 290 HA PHE 35 HA PHE 35 241.031 2.332 2.772 291 1HB PHE 35 HB2 PHE 35 240.086 2.452 -0.052 292 2HB PHE 35 HB1 PHE 35 239.223 2.809 1.434 293 HD1 PHE 35 HD1 PHE 35 239.583 4.984 2.576 294 HD2 PHE 35 HD2 PHE 35 241.192 4.151 -1.273 295 HE1 PHE 35 HE1 PHE 35 239.918 7.392 2.199 296 HE2 PHE 35 HE2 PHE 35 241.531 6.556 -1.657 297 HZ PHE 35 HZ PHE 35 240.894 8.181 0.081 298 H GLY 36 HN GLY 36 241.631 0.282 3.260 299 1HA GLY 36 HA2 GLY 36 242.104 -1.602 1.072 300 2HA GLY 36 HA1 GLY 36 242.466 -1.878 2.768 301 H GLY 37 HN GLY 37 241.300 -3.899 1.518 302 1HA GLY 37 HA2 GLY 37 238.949 -4.361 2.989 303 2HA GLY 37 HA1 GLY 37 238.500 -3.914 1.350 304 H LYS 38 HN LYS 38 238.897 -6.482 3.260 305 HA LYS 38 HA LYS 38 240.503 -8.293 1.902 306 1HB LYS 38 HB2 LYS 38 239.408 -10.006 3.111 307 2HB LYS 38 HB1 LYS 38 239.376 -8.592 4.153 308 1HG LYS 38 HG2 LYS 38 237.102 -9.671 2.503 309 2HG LYS 38 HG1 LYS 38 237.256 -9.709 4.260 310 1HD LYS 38 HD2 LYS 38 237.253 -7.227 4.262 311 2HD LYS 38 HD1 LYS 38 236.962 -7.261 2.522 312 1HE LYS 38 HE2 LYS 38 234.830 -8.197 2.781 313 2HE LYS 38 HE1 LYS 38 235.157 -8.696 4.440 314 1HZ LYS 38 HZ1 LYS 38 233.728 -6.580 3.907 315 2HZ LYS 38 HZ2 LYS 38 235.244 -5.836 3.822 316 3HZ LYS 38 HZ3 LYS 38 234.765 -6.619 5.243 317 H VAL 39 HN VAL 39 240.056 -9.945 0.389 318 HA VAL 39 HA VAL 39 238.222 -9.138 -1.684 319 HB VAL 39 HB VAL 39 239.838 -11.689 -1.628 320 1HG1 VAL 39 HG11 VAL 39 239.784 -11.412 -4.076 321 2HG1 VAL 39 HG12 VAL 39 238.769 -9.986 -3.875 322 3HG1 VAL 39 HG13 VAL 39 238.169 -11.571 -3.385 323 1HG2 VAL 39 HG21 VAL 39 241.182 -9.574 -1.181 324 2HG2 VAL 39 HG22 VAL 39 240.774 -9.110 -2.832 325 3HG2 VAL 39 HG23 VAL 39 241.689 -10.586 -2.531 326 H GLN 40 HN GLN 40 236.146 -9.651 -1.642 327 HA GLN 40 HA GLN 40 234.810 -11.256 0.100 328 1HB GLN 40 HB2 GLN 40 234.207 -9.938 -2.364 329 2HB GLN 40 HB1 GLN 40 233.450 -11.525 -2.379 330 1HG GLN 40 HG2 GLN 40 233.145 -9.520 -0.158 331 2HG GLN 40 HG1 GLN 40 232.007 -9.721 -1.490 332 1HE2 GLN 40 HE21 GLN 40 231.547 -12.237 -1.796 333 2HE2 GLN 40 HE22 GLN 40 231.011 -13.014 -0.350 334 H GLU 41 HN GLU 41 233.557 -13.298 -0.401 335 HA GLU 41 HA GLU 41 235.375 -15.410 -0.839 336 1HB GLU 41 HB2 GLU 41 232.444 -15.183 -0.364 337 2HB GLU 41 HB1 GLU 41 233.049 -16.701 -1.014 338 1HG GLU 41 HG2 GLU 41 234.792 -16.251 1.023 339 2HG GLU 41 HG1 GLU 41 233.302 -15.563 1.667 340 H GLY 42 HN GLY 42 236.180 -14.678 -2.969 341 1HA GLY 42 HA2 GLY 42 236.321 -15.772 -5.109 342 2HA GLY 42 HA1 GLY 42 234.571 -15.918 -5.101 343 H GLU 43 HN GLU 43 236.663 -13.087 -4.500 344 HA GLU 43 HA GLU 43 235.500 -11.849 -6.879 345 1HB GLU 43 HB2 GLU 43 234.861 -9.946 -5.799 346 2HB GLU 43 HB1 GLU 43 234.680 -11.065 -4.460 347 1HG GLU 43 HG2 GLU 43 236.680 -10.339 -3.455 348 2HG GLU 43 HG1 GLU 43 237.193 -9.484 -4.907 349 H THR 44 HN THR 44 236.876 -9.809 -7.407 350 HA THR 44 HA THR 44 239.639 -10.753 -7.415 351 HB THR 44 HB THR 44 239.917 -9.250 -9.316 352 HG1 THR 44 HG1 THR 44 238.601 -7.617 -9.354 353 1HG2 THR 44 HG21 THR 44 239.221 -11.349 -10.025 354 2HG2 THR 44 HG22 THR 44 238.055 -10.261 -10.780 355 3HG2 THR 44 HG23 THR 44 237.615 -11.154 -9.324 356 H ILE 45 HN ILE 45 241.353 -9.509 -6.766 357 HA ILE 45 HA ILE 45 241.046 -7.876 -4.578 358 HB ILE 45 HB ILE 45 243.347 -7.480 -6.471 359 1HG1 ILE 45 HG12 ILE 45 244.222 -9.417 -4.777 360 2HG1 ILE 45 HG11 ILE 45 242.552 -9.918 -5.024 361 1HG2 ILE 45 HG21 ILE 45 243.418 -6.016 -4.630 362 2HG2 ILE 45 HG22 ILE 45 244.562 -7.310 -4.274 363 3HG2 ILE 45 HG23 ILE 45 242.976 -7.298 -3.503 364 1HD1 ILE 45 HD11 ILE 45 243.252 -10.921 -6.870 365 2HD1 ILE 45 HD12 ILE 45 244.830 -10.137 -6.777 366 3HD1 ILE 45 HD13 ILE 45 243.482 -9.317 -7.565 367 H GLU 46 HN GLU 46 240.988 -7.005 -7.976 368 HA GLU 46 HA GLU 46 241.098 -4.169 -7.548 369 1HB GLU 46 HB2 GLU 46 241.633 -5.526 -9.708 370 2HB GLU 46 HB1 GLU 46 239.896 -5.467 -9.980 371 1HG GLU 46 HG2 GLU 46 239.986 -3.013 -9.893 372 2HG GLU 46 HG1 GLU 46 241.734 -3.102 -9.683 373 H ASP 47 HN ASP 47 238.668 -6.626 -7.562 374 HA ASP 47 HA ASP 47 236.461 -4.770 -7.739 375 1HB ASP 47 HB2 ASP 47 236.754 -7.734 -7.500 376 2HB ASP 47 HB1 ASP 47 235.242 -7.012 -6.961 377 H GLY 48 HN GLY 48 238.232 -6.580 -5.317 378 1HA GLY 48 HA2 GLY 48 236.480 -5.936 -3.137 379 2HA GLY 48 HA1 GLY 48 238.114 -6.576 -3.007 380 H ALA 49 HN ALA 49 239.389 -4.522 -4.509 381 HA ALA 49 HA ALA 49 239.722 -2.550 -2.452 382 1HB ALA 49 HB1 ALA 49 241.627 -1.987 -3.530 383 2HB ALA 49 HB2 ALA 49 240.868 -2.037 -5.122 384 3HB ALA 49 HB3 ALA 49 241.377 -3.532 -4.341 385 H ARG 50 HN ARG 50 238.170 -2.775 -5.578 386 HA ARG 50 HA ARG 50 237.546 -0.005 -5.802 387 1HB ARG 50 HB2 ARG 50 237.667 -1.187 -7.836 388 2HB ARG 50 HB1 ARG 50 236.653 -2.491 -7.237 389 1HG ARG 50 HG2 ARG 50 234.696 -1.185 -7.419 390 2HG ARG 50 HG1 ARG 50 235.623 0.297 -7.665 391 1HD ARG 50 HD2 ARG 50 235.508 -0.032 -9.858 392 2HD ARG 50 HD1 ARG 50 236.444 -1.514 -9.662 393 HE ARG 50 HE ARG 50 233.849 -2.192 -9.057 394 1HH1 ARG 50 HH11 ARG 50 235.521 -0.862 -11.816 395 2HH1 ARG 50 HH12 ARG 50 234.430 -1.556 -12.968 396 1HH2 ARG 50 HH21 ARG 50 232.414 -3.104 -10.570 397 2HH2 ARG 50 HH22 ARG 50 232.665 -2.827 -12.261 398 H ARG 51 HN ARG 51 235.544 -2.876 -5.124 399 HA ARG 51 HA ARG 51 233.175 -1.489 -4.565 400 1HB ARG 51 HB2 ARG 51 234.185 -4.202 -3.739 401 2HB ARG 51 HB1 ARG 51 232.602 -3.615 -3.246 402 1HG ARG 51 HG2 ARG 51 231.779 -3.630 -5.417 403 2HG ARG 51 HG1 ARG 51 233.394 -3.638 -6.131 404 1HD ARG 51 HD2 ARG 51 232.808 -5.828 -6.439 405 2HD ARG 51 HD1 ARG 51 233.583 -5.933 -4.859 406 HE ARG 51 HE ARG 51 230.947 -5.468 -4.307 407 1HH1 ARG 51 HH11 ARG 51 232.701 -7.882 -6.117 408 2HH1 ARG 51 HH12 ARG 51 231.541 -9.131 -5.816 409 1HH2 ARG 51 HH21 ARG 51 229.420 -7.111 -3.909 410 2HH2 ARG 51 HH22 ARG 51 229.678 -8.694 -4.563 411 H GLU 52 HN GLU 52 235.905 -2.296 -2.519 412 HA GLU 52 HA GLU 52 234.570 -1.401 -0.112 413 1HB GLU 52 HB2 GLU 52 237.429 -2.247 -0.614 414 2HB GLU 52 HB1 GLU 52 236.776 -1.828 0.963 415 1HG GLU 52 HG2 GLU 52 235.316 -3.899 -0.548 416 2HG GLU 52 HG1 GLU 52 236.922 -4.333 0.038 417 H LEU 53 HN LEU 53 236.508 -0.070 -2.609 418 HA LEU 53 HA LEU 53 237.654 2.089 -1.182 419 1HB LEU 53 HB2 LEU 53 238.667 1.544 -3.227 420 2HB LEU 53 HB1 LEU 53 237.136 1.519 -4.084 421 HG LEU 53 HG LEU 53 236.986 3.969 -3.821 422 1HD1 LEU 53 HD11 LEU 53 238.410 5.166 -2.580 423 2HD1 LEU 53 HD12 LEU 53 239.812 4.247 -3.127 424 3HD1 LEU 53 HD13 LEU 53 238.799 3.620 -1.826 425 1HD2 LEU 53 HD21 LEU 53 239.160 4.396 -5.256 426 2HD2 LEU 53 HD22 LEU 53 237.795 3.487 -5.905 427 3HD2 LEU 53 HD23 LEU 53 239.206 2.633 -5.280 428 H GLN 54 HN GLN 54 234.778 1.781 -3.223 429 HA GLN 54 HA GLN 54 233.921 4.452 -3.053 430 1HB GLN 54 HB2 GLN 54 232.830 3.291 -4.711 431 2HB GLN 54 HB1 GLN 54 232.634 1.850 -3.726 432 1HG GLN 54 HG2 GLN 54 230.857 2.933 -2.467 433 2HG GLN 54 HG1 GLN 54 231.073 4.407 -3.410 434 1HE2 GLN 54 HE21 GLN 54 230.681 0.932 -4.049 435 2HE2 GLN 54 HE22 GLN 54 229.477 1.121 -5.274 436 H GLU 55 HN GLU 55 233.706 1.811 -0.838 437 HA GLU 55 HA GLU 55 231.605 2.965 0.757 438 1HB GLU 55 HB2 GLU 55 233.263 0.492 0.886 439 2HB GLU 55 HB1 GLU 55 232.444 1.033 2.344 440 1HG GLU 55 HG2 GLU 55 230.305 0.977 1.169 441 2HG GLU 55 HG1 GLU 55 231.126 0.436 -0.295 442 H GLU 56 HN GLU 56 235.064 3.168 0.718 443 HA GLU 56 HA GLU 56 235.272 3.844 3.496 444 1HB GLU 56 HB2 GLU 56 237.122 3.438 1.263 445 2HB GLU 56 HB1 GLU 56 237.638 4.667 2.412 446 1HG GLU 56 HG2 GLU 56 236.644 2.229 3.670 447 2HG GLU 56 HG1 GLU 56 238.065 1.981 2.660 448 H SER 57 HN SER 57 235.392 5.747 0.479 449 HA SER 57 HA SER 57 234.929 8.125 2.152 450 1HB SER 57 HB2 SER 57 237.016 7.736 0.032 451 2HB SER 57 HB1 SER 57 236.367 9.344 0.349 452 HG SER 57 HG SER 57 236.911 8.818 2.640 453 H GLY 58 HN GLY 58 233.189 6.387 0.412 454 1HA GLY 58 HA2 GLY 58 231.461 6.670 -1.067 455 2HA GLY 58 HA1 GLY 58 231.525 8.368 -0.618 456 H LEU 59 HN LEU 59 234.446 7.201 -1.916 457 HA LEU 59 HA LEU 59 233.858 8.552 -4.454 458 1HB LEU 59 HB2 LEU 59 236.458 7.964 -3.049 459 2HB LEU 59 HB1 LEU 59 236.365 8.603 -4.679 460 HG LEU 59 HG LEU 59 235.665 9.949 -2.090 461 1HD1 LEU 59 HD11 LEU 59 237.945 10.036 -3.230 462 2HD1 LEU 59 HD12 LEU 59 237.200 11.572 -2.787 463 3HD1 LEU 59 HD13 LEU 59 237.157 11.022 -4.461 464 1HD2 LEU 59 HD21 LEU 59 234.668 10.666 -4.841 465 2HD2 LEU 59 HD22 LEU 59 234.746 11.818 -3.509 466 3HD2 LEU 59 HD23 LEU 59 233.719 10.389 -3.381 467 H THR 60 HN THR 60 233.319 7.239 -6.016 468 HA THR 60 HA THR 60 234.358 4.508 -6.069 469 HB THR 60 HB THR 60 232.470 5.325 -8.173 470 HG1 THR 60 HG1 THR 60 231.724 5.436 -5.439 471 1HG2 THR 60 HG21 THR 60 232.146 3.138 -8.110 472 2HG2 THR 60 HG22 THR 60 231.381 3.337 -6.534 473 3HG2 THR 60 HG23 THR 60 233.107 2.993 -6.638 474 H VAL 61 HN VAL 61 235.709 3.762 -7.640 475 HA VAL 61 HA VAL 61 236.701 5.785 -9.523 476 HB VAL 61 HB VAL 61 238.732 4.471 -9.703 477 1HG1 VAL 61 HG11 VAL 61 238.867 6.071 -8.011 478 2HG1 VAL 61 HG12 VAL 61 239.413 4.585 -7.234 479 3HG1 VAL 61 HG13 VAL 61 237.777 5.179 -6.951 480 1HG2 VAL 61 HG21 VAL 61 237.081 2.437 -8.425 481 2HG2 VAL 61 HG22 VAL 61 238.669 2.608 -7.678 482 3HG2 VAL 61 HG23 VAL 61 238.538 2.264 -9.403 483 H ASP 62 HN ASP 62 236.787 5.445 -11.675 484 HA ASP 62 HA ASP 62 235.102 3.365 -12.742 485 1HB ASP 62 HB2 ASP 62 235.570 5.890 -13.555 486 2HB ASP 62 HB1 ASP 62 236.740 5.045 -14.566 487 H ALA 63 HN ALA 63 238.446 3.831 -12.126 488 HA ALA 63 HA ALA 63 239.166 1.214 -12.734 489 1HB ALA 63 HB1 ALA 63 240.530 2.792 -14.799 490 2HB ALA 63 HB2 ALA 63 238.806 2.545 -15.076 491 3HB ALA 63 HB3 ALA 63 239.872 1.157 -14.867 492 H LEU 64 HN LEU 64 240.365 1.320 -10.863 493 HA LEU 64 HA LEU 64 242.158 3.380 -10.160 494 1HB LEU 64 HB2 LEU 64 242.187 0.452 -9.403 495 2HB LEU 64 HB1 LEU 64 243.161 1.689 -8.635 496 HG LEU 64 HG LEU 64 240.471 2.563 -8.523 497 1HD1 LEU 64 HD11 LEU 64 239.514 0.480 -8.765 498 2HD1 LEU 64 HD12 LEU 64 239.715 0.586 -7.016 499 3HD1 LEU 64 HD13 LEU 64 240.861 -0.345 -7.980 500 1HD2 LEU 64 HD21 LEU 64 241.049 3.025 -6.404 501 2HD2 LEU 64 HD22 LEU 64 242.670 2.577 -6.932 502 3HD2 LEU 64 HD23 LEU 64 241.654 1.395 -6.105 503 H HIS 65 HN HIS 65 244.598 2.366 -9.666 504 HA HIS 65 HA HIS 65 245.605 1.290 -12.200 505 1HB HIS 65 HB2 HIS 65 245.879 3.954 -11.526 506 2HB HIS 65 HB1 HIS 65 247.401 3.256 -10.984 507 HD1 HIS 65 HD1 HIS 65 248.023 5.038 -13.091 508 HD2 HIS 65 HD2 HIS 65 246.479 1.289 -14.004 509 HE1 HIS 65 HE1 HIS 65 248.658 4.614 -15.486 510 HE2 HIS 65 HE2 HIS 65 247.788 2.304 -15.990 511 H LYS 66 HN LYS 66 246.220 -0.678 -11.465 512 HA LYS 66 HA LYS 66 247.273 -1.240 -8.922 513 1HB LYS 66 HB2 LYS 66 248.082 -3.362 -9.975 514 2HB LYS 66 HB1 LYS 66 246.381 -3.027 -10.263 515 1HG LYS 66 HG2 LYS 66 246.696 -2.604 -12.494 516 2HG LYS 66 HG1 LYS 66 248.386 -2.146 -12.279 517 1HD LYS 66 HD2 LYS 66 247.384 -4.956 -11.873 518 2HD LYS 66 HD1 LYS 66 247.974 -4.361 -13.427 519 1HE LYS 66 HE2 LYS 66 250.131 -3.841 -12.420 520 2HE LYS 66 HE1 LYS 66 249.544 -4.388 -10.851 521 1HZ LYS 66 HZ1 LYS 66 250.676 -6.215 -11.638 522 2HZ LYS 66 HZ2 LYS 66 250.192 -5.980 -13.242 523 3HZ LYS 66 HZ3 LYS 66 249.091 -6.578 -12.105 524 H VAL 67 HN VAL 67 249.285 -1.071 -8.070 525 HA VAL 67 HA VAL 67 251.443 -0.346 -9.955 526 HB VAL 67 HB VAL 67 252.419 1.073 -8.156 527 1HG1 VAL 67 HG11 VAL 67 251.196 2.065 -10.002 528 2HG1 VAL 67 HG12 VAL 67 250.882 2.959 -8.514 529 3HG1 VAL 67 HG13 VAL 67 249.673 1.840 -9.142 530 1HG2 VAL 67 HG21 VAL 67 249.970 0.164 -6.764 531 2HG2 VAL 67 HG22 VAL 67 250.436 1.848 -6.546 532 3HG2 VAL 67 HG23 VAL 67 251.563 0.561 -6.120 533 H GLY 68 HN GLY 68 250.827 -1.622 -6.673 534 1HA GLY 68 HA2 GLY 68 253.010 -3.513 -7.145 535 2HA GLY 68 HA1 GLY 68 253.153 -2.447 -5.758 536 H GLN 69 HN GLN 69 253.289 -4.990 -5.200 537 HA GLN 69 HA GLN 69 250.684 -5.596 -3.979 538 1HB GLN 69 HB2 GLN 69 252.559 -7.711 -5.035 539 2HB GLN 69 HB1 GLN 69 250.922 -7.932 -4.434 540 1HG GLN 69 HG2 GLN 69 250.145 -7.717 -6.486 541 2HG GLN 69 HG1 GLN 69 250.788 -6.077 -6.557 542 1HE2 GLN 69 HE21 GLN 69 250.632 -8.641 -8.348 543 2HE2 GLN 69 HE22 GLN 69 252.194 -8.670 -9.084 544 H ILE 70 HN ILE 70 250.887 -5.509 -1.849 545 HA ILE 70 HA ILE 70 253.505 -6.057 -0.642 546 HB ILE 70 HB ILE 70 251.076 -4.753 0.592 547 1HG1 ILE 70 HG12 ILE 70 253.656 -3.416 -0.208 548 2HG1 ILE 70 HG11 ILE 70 252.274 -3.515 -1.294 549 1HG2 ILE 70 HG21 ILE 70 252.895 -3.992 2.256 550 2HG2 ILE 70 HG22 ILE 70 253.824 -5.345 1.617 551 3HG2 ILE 70 HG23 ILE 70 252.264 -5.633 2.384 552 1HD1 ILE 70 HD11 ILE 70 250.926 -2.365 0.473 553 2HD1 ILE 70 HD12 ILE 70 252.211 -1.394 -0.246 554 3HD1 ILE 70 HD13 ILE 70 252.431 -2.105 1.353 555 H VAL 71 HN VAL 71 253.748 -7.488 1.060 556 HA VAL 71 HA VAL 71 251.493 -9.302 1.589 557 HB VAL 71 HB VAL 71 254.362 -10.187 1.289 558 1HG1 VAL 71 HG11 VAL 71 251.818 -11.794 1.373 559 2HG1 VAL 71 HG12 VAL 71 252.897 -11.548 2.746 560 3HG1 VAL 71 HG13 VAL 71 253.467 -12.415 1.320 561 1HG2 VAL 71 HG21 VAL 71 253.676 -11.165 -0.859 562 2HG2 VAL 71 HG22 VAL 71 253.551 -9.406 -0.864 563 3HG2 VAL 71 HG23 VAL 71 252.099 -10.393 -0.695 564 H PHE 72 HN PHE 72 251.445 -10.258 3.658 565 HA PHE 72 HA PHE 72 253.347 -9.142 5.607 566 1HB PHE 72 HB2 PHE 72 250.346 -9.304 5.810 567 2HB PHE 72 HB1 PHE 72 251.375 -9.096 7.221 568 HD1 PHE 72 HD1 PHE 72 253.399 -7.235 6.265 569 HD2 PHE 72 HD2 PHE 72 249.207 -7.325 5.540 570 HE1 PHE 72 HE1 PHE 72 253.418 -4.804 5.878 571 HE2 PHE 72 HE2 PHE 72 249.218 -4.893 5.153 572 HZ PHE 72 HZ PHE 72 251.326 -3.630 5.320 573 H GLU 73 HN GLU 73 254.423 -10.707 6.586 574 HA GLU 73 HA GLU 73 253.228 -13.378 6.766 575 1HB GLU 73 HB2 GLU 73 255.428 -13.295 5.730 576 2HB GLU 73 HB1 GLU 73 256.084 -12.446 7.122 577 1HG GLU 73 HG2 GLU 73 256.689 -14.418 7.919 578 2HG GLU 73 HG1 GLU 73 254.979 -14.755 8.186 579 H PHE 74 HN PHE 74 252.423 -14.067 8.650 580 HA PHE 74 HA PHE 74 252.891 -12.458 11.029 581 1HB PHE 74 HB2 PHE 74 250.640 -13.652 10.091 582 2HB PHE 74 HB1 PHE 74 251.196 -14.868 11.235 583 HD1 PHE 74 HD1 PHE 74 250.002 -11.425 10.849 584 HD2 PHE 74 HD2 PHE 74 251.171 -14.456 13.597 585 HE1 PHE 74 HE1 PHE 74 249.032 -10.119 12.695 586 HE2 PHE 74 HE2 PHE 74 250.202 -13.157 15.448 587 HZ PHE 74 HZ PHE 74 249.131 -10.985 14.998 588 H VAL 75 HN VAL 75 254.171 -12.941 12.601 589 HA VAL 75 HA VAL 75 255.850 -15.251 12.434 590 HB VAL 75 HB VAL 75 255.939 -13.770 14.958 591 1HG1 VAL 75 HG11 VAL 75 257.804 -15.036 14.595 592 2HG1 VAL 75 HG12 VAL 75 258.350 -13.489 13.948 593 3HG1 VAL 75 HG13 VAL 75 257.788 -14.755 12.855 594 1HG2 VAL 75 HG21 VAL 75 257.118 -11.827 13.677 595 2HG2 VAL 75 HG22 VAL 75 255.369 -11.805 13.903 596 3HG2 VAL 75 HG23 VAL 75 256.052 -12.312 12.358 597 H GLY 76 HN GLY 76 255.242 -17.189 13.094 598 1HA GLY 76 HA2 GLY 76 254.736 -18.694 14.877 599 2HA GLY 76 HA1 GLY 76 253.803 -17.417 15.645 600 H GLU 77 HN GLU 77 252.657 -16.851 12.839 601 HA GLU 77 HA GLU 77 250.606 -18.958 12.987 602 1HB GLU 77 HB2 GLU 77 250.493 -16.063 12.632 603 2HB GLU 77 HB1 GLU 77 249.553 -16.929 11.425 604 1HG GLU 77 HG2 GLU 77 249.194 -17.845 14.192 605 2HG GLU 77 HG1 GLU 77 248.629 -16.210 13.853 606 HA PRO 78 HA PRO 78 251.956 -20.367 9.004 607 1HB PRO 78 HB2 PRO 78 249.753 -21.774 8.277 608 2HB PRO 78 HB1 PRO 78 250.898 -22.349 9.493 609 1HG PRO 78 HG2 PRO 78 248.257 -20.991 9.871 610 2HG PRO 78 HG1 PRO 78 248.930 -22.386 10.734 611 1HD PRO 78 HD2 PRO 78 248.963 -19.884 11.764 612 2HD PRO 78 HD1 PRO 78 250.242 -21.070 12.098 613 H GLU 79 HN GLU 79 248.742 -18.911 9.324 614 HA GLU 79 HA GLU 79 248.364 -18.386 6.575 615 1HB GLU 79 HB2 GLU 79 246.895 -18.053 8.960 616 2HB GLU 79 HB1 GLU 79 246.999 -16.461 8.219 617 1HG GLU 79 HG2 GLU 79 245.953 -17.199 6.246 618 2HG GLU 79 HG1 GLU 79 246.140 -18.894 6.691 619 H LEU 80 HN LEU 80 248.041 -16.080 5.775 620 HA LEU 80 HA LEU 80 249.982 -14.182 6.845 621 1HB LEU 80 HB2 LEU 80 250.068 -14.538 3.905 622 2HB LEU 80 HB1 LEU 80 251.343 -14.078 5.016 623 HG LEU 80 HG LEU 80 250.343 -16.892 5.032 624 1HD1 LEU 80 HD11 LEU 80 252.338 -15.784 3.063 625 2HD1 LEU 80 HD12 LEU 80 250.728 -16.395 2.678 626 3HD1 LEU 80 HD13 LEU 80 251.958 -17.490 3.307 627 1HD2 LEU 80 HD21 LEU 80 253.058 -16.905 5.285 628 2HD2 LEU 80 HD22 LEU 80 251.918 -16.866 6.630 629 3HD2 LEU 80 HD23 LEU 80 252.633 -15.367 6.037 630 H MET 81 HN MET 81 249.919 -12.354 4.762 631 HA MET 81 HA MET 81 247.132 -11.864 4.129 632 1HB MET 81 HB2 MET 81 247.095 -10.718 6.158 633 2HB MET 81 HB1 MET 81 248.748 -10.155 5.986 634 1HG MET 81 HG2 MET 81 248.121 -8.519 4.388 635 2HG MET 81 HG1 MET 81 246.509 -9.210 4.219 636 1HE MET 81 HE1 MET 81 245.039 -8.461 7.800 637 2HE MET 81 HE2 MET 81 246.285 -9.705 7.695 638 3HE MET 81 HE3 MET 81 245.047 -9.590 6.445 639 H ASP 82 HN ASP 82 247.197 -11.538 2.011 640 HA ASP 82 HA ASP 82 249.487 -10.084 0.873 641 1HB ASP 82 HB2 ASP 82 248.966 -12.377 -0.004 642 2HB ASP 82 HB1 ASP 82 247.426 -11.753 -0.588 643 H VAL 83 HN VAL 83 248.994 -7.951 0.919 644 HA VAL 83 HA VAL 83 246.339 -7.129 -0.051 645 HB VAL 83 HB VAL 83 246.923 -6.354 2.220 646 1HG1 VAL 83 HG11 VAL 83 249.019 -4.613 0.952 647 2HG1 VAL 83 HG12 VAL 83 249.401 -6.170 1.685 648 3HG1 VAL 83 HG13 VAL 83 248.704 -4.880 2.666 649 1HG2 VAL 83 HG21 VAL 83 246.779 -3.772 1.475 650 2HG2 VAL 83 HG22 VAL 83 245.405 -4.876 1.441 651 3HG2 VAL 83 HG23 VAL 83 246.313 -4.555 -0.036 652 H HIS 84 HN HIS 84 246.261 -6.466 -2.067 653 HA HIS 84 HA HIS 84 248.624 -5.701 -3.515 654 1HB HIS 84 HB2 HIS 84 246.499 -6.937 -4.391 655 2HB HIS 84 HB1 HIS 84 245.819 -5.320 -4.531 656 HD1 HIS 84 HD1 HIS 84 247.945 -7.721 -6.269 657 HD2 HIS 84 HD2 HIS 84 247.321 -3.614 -6.356 658 HE1 HIS 84 HE1 HIS 84 248.941 -6.936 -8.440 659 HE2 HIS 84 HE2 HIS 84 248.664 -4.432 -8.409 660 H VAL 85 HN VAL 85 248.808 -3.613 -4.663 661 HA VAL 85 HA VAL 85 247.563 -1.452 -3.084 662 HB VAL 85 HB VAL 85 250.243 -1.371 -4.492 663 1HG1 VAL 85 HG11 VAL 85 250.476 0.791 -3.805 664 2HG1 VAL 85 HG12 VAL 85 249.425 0.575 -2.406 665 3HG1 VAL 85 HG13 VAL 85 248.726 0.750 -4.014 666 1HG2 VAL 85 HG21 VAL 85 249.887 -1.328 -1.524 667 2HG2 VAL 85 HG22 VAL 85 251.303 -1.773 -2.477 668 3HG2 VAL 85 HG23 VAL 85 249.922 -2.866 -2.387 669 H PHE 86 HN PHE 86 246.472 0.064 -4.153 670 HA PHE 86 HA PHE 86 246.702 0.214 -7.077 671 1HB PHE 86 HB2 PHE 86 244.293 -0.354 -5.400 672 2HB PHE 86 HB1 PHE 86 244.080 0.647 -6.831 673 HD1 PHE 86 HD1 PHE 86 243.967 -0.312 -8.969 674 HD2 PHE 86 HD2 PHE 86 245.272 -2.656 -5.665 675 HE1 PHE 86 HE1 PHE 86 243.841 -2.337 -10.361 676 HE2 PHE 86 HE2 PHE 86 245.150 -4.684 -7.051 677 HZ PHE 86 HZ PHE 86 244.432 -4.527 -9.402 678 H CYS 87 HN CYS 87 246.426 2.225 -7.948 679 HA CYS 87 HA CYS 87 245.738 4.428 -6.115 680 1HB CYS 87 HB2 CYS 87 247.415 5.832 -7.353 681 2HB CYS 87 HB1 CYS 87 248.135 4.548 -6.391 682 HG CYS 87 HG CYS 87 248.189 3.258 -8.858 683 H THR 88 HN THR 88 243.930 5.360 -6.876 684 HA THR 88 HA THR 88 243.293 5.044 -9.714 685 HB THR 88 HB THR 88 241.657 4.336 -7.961 686 HG1 THR 88 HG1 THR 88 241.095 5.056 -10.157 687 1HG2 THR 88 HG21 THR 88 242.145 6.782 -6.813 688 2HG2 THR 88 HG22 THR 88 240.841 5.667 -6.407 689 3HG2 THR 88 HG23 THR 88 240.560 6.970 -7.562 690 H ASP 89 HN ASP 89 241.608 7.031 -10.235 691 HA ASP 89 HA ASP 89 242.608 9.611 -9.486 692 1HB ASP 89 HB2 ASP 89 244.078 8.459 -11.451 693 2HB ASP 89 HB1 ASP 89 242.819 9.226 -12.416 694 H SER 90 HN SER 90 240.776 7.718 -11.832 695 HA SER 90 HA SER 90 238.860 9.849 -12.242 696 1HB SER 90 HB2 SER 90 239.719 7.734 -13.799 697 2HB SER 90 HB1 SER 90 238.136 7.188 -13.247 698 HG SER 90 HG SER 90 237.287 9.181 -14.031 699 H ILE 91 HN ILE 91 237.702 10.195 -10.392 700 HA ILE 91 HA ILE 91 236.449 7.868 -9.116 701 HB ILE 91 HB ILE 91 235.955 9.314 -7.210 702 1HG1 ILE 91 HG12 ILE 91 237.471 11.475 -8.693 703 2HG1 ILE 91 HG11 ILE 91 235.718 11.428 -8.530 704 1HG2 ILE 91 HG21 ILE 91 238.309 9.768 -6.510 705 2HG2 ILE 91 HG22 ILE 91 238.818 9.358 -8.148 706 3HG2 ILE 91 HG23 ILE 91 238.034 8.143 -7.138 707 1HD1 ILE 91 HD11 ILE 91 237.737 11.722 -6.323 708 2HD1 ILE 91 HD12 ILE 91 236.006 11.510 -6.068 709 3HD1 ILE 91 HD13 ILE 91 236.604 12.940 -6.908 710 H GLN 92 HN GLN 92 234.216 8.621 -8.049 711 HA GLN 92 HA GLN 92 232.635 10.000 -10.103 712 1HB GLN 92 HB2 GLN 92 232.170 7.277 -8.927 713 2HB GLN 92 HB1 GLN 92 230.842 8.218 -9.589 714 1HG GLN 92 HG2 GLN 92 233.189 7.986 -11.336 715 2HG GLN 92 HG1 GLN 92 232.348 6.473 -11.001 716 1HE2 GLN 92 HE21 GLN 92 230.787 5.986 -12.353 717 2HE2 GLN 92 HE22 GLN 92 229.859 7.102 -13.290 718 H GLY 93 HN GLY 93 232.071 8.362 -6.993 719 1HA GLY 93 HA2 GLY 93 230.036 10.065 -6.127 720 2HA GLY 93 HA1 GLY 93 231.030 9.069 -5.078 721 H THR 94 HN THR 94 230.733 10.887 -3.580 722 HA THR 94 HA THR 94 232.688 13.014 -4.091 723 HB THR 94 HB THR 94 230.527 13.583 -2.182 724 HG1 THR 94 HG1 THR 94 229.078 12.876 -3.545 725 1HG2 THR 94 HG21 THR 94 231.389 15.595 -2.544 726 2HG2 THR 94 HG22 THR 94 230.551 15.558 -4.096 727 3HG2 THR 94 HG23 THR 94 232.239 15.057 -3.993 728 HA PRO 95 HA PRO 95 234.712 11.958 -0.357 729 1HB PRO 95 HB2 PRO 95 234.924 14.786 0.420 730 2HB PRO 95 HB1 PRO 95 236.203 13.654 -0.030 731 1HG PRO 95 HG2 PRO 95 235.482 15.688 -1.623 732 2HG PRO 95 HG1 PRO 95 236.015 14.125 -2.270 733 1HD PRO 95 HD2 PRO 95 233.235 15.197 -1.955 734 2HD PRO 95 HD1 PRO 95 233.952 14.322 -3.325 735 H VAL 96 HN VAL 96 232.302 11.416 0.028 736 HA VAL 96 HA VAL 96 230.892 13.059 1.906 737 HB VAL 96 HB VAL 96 230.296 10.142 1.570 738 1HG1 VAL 96 HG11 VAL 96 227.935 11.268 1.504 739 2HG1 VAL 96 HG12 VAL 96 228.792 12.626 2.231 740 3HG1 VAL 96 HG13 VAL 96 228.787 11.057 3.034 741 1HG2 VAL 96 HG21 VAL 96 228.791 11.146 -0.400 742 2HG2 VAL 96 HG22 VAL 96 230.395 10.464 -0.672 743 3HG2 VAL 96 HG23 VAL 96 230.189 12.212 -0.543 744 H GLU 97 HN GLU 97 233.074 13.049 3.155 745 HA GLU 97 HA GLU 97 234.032 11.026 4.712 746 1HB GLU 97 HB2 GLU 97 234.766 12.702 6.297 747 2HB GLU 97 HB1 GLU 97 234.922 13.339 4.667 748 1HG GLU 97 HG2 GLU 97 232.480 14.251 5.245 749 2HG GLU 97 HG1 GLU 97 233.155 14.182 6.872 750 H SER 98 HN SER 98 232.892 9.559 5.808 751 HA SER 98 HA SER 98 230.418 10.291 7.137 752 1HB SER 98 HB2 SER 98 231.764 7.753 6.375 753 2HB SER 98 HB1 SER 98 230.715 7.701 7.791 754 HG SER 98 HG SER 98 229.413 7.294 6.072 755 H ASP 99 HN ASP 99 230.228 8.867 9.344 756 HA ASP 99 HA ASP 99 231.817 10.293 11.213 757 1HB ASP 99 HB2 ASP 99 229.953 7.942 11.590 758 2HB ASP 99 HB1 ASP 99 230.671 8.866 12.906 759 H GLU 100 HN GLU 100 232.440 7.483 9.437 760 HA GLU 100 HA GLU 100 234.377 6.527 11.429 761 1HB GLU 100 HB2 GLU 100 232.563 5.173 9.698 762 2HB GLU 100 HB1 GLU 100 234.198 4.747 9.211 763 1HG GLU 100 HG2 GLU 100 234.707 4.027 11.471 764 2HG GLU 100 HG1 GLU 100 233.095 4.505 12.001 765 H MET 101 HN MET 101 234.035 7.588 8.087 766 HA MET 101 HA MET 101 236.971 7.557 7.844 767 1HB MET 101 HB2 MET 101 234.816 6.868 5.988 768 2HB MET 101 HB1 MET 101 236.021 7.941 5.290 769 1HG MET 101 HG2 MET 101 237.107 5.670 6.795 770 2HG MET 101 HG1 MET 101 236.203 5.246 5.343 771 1HE MET 101 HE1 MET 101 239.248 6.007 6.910 772 2HE MET 101 HE2 MET 101 239.420 7.696 6.434 773 3HE MET 101 HE3 MET 101 240.416 6.459 5.668 774 H ARG 102 HN ARG 102 237.937 9.304 6.577 775 HA ARG 102 HA ARG 102 236.479 11.724 6.125 776 1HB ARG 102 HB2 ARG 102 236.730 11.811 8.585 777 2HB ARG 102 HB1 ARG 102 238.473 11.663 8.405 778 1HG ARG 102 HG2 ARG 102 238.253 13.922 8.677 779 2HG ARG 102 HG1 ARG 102 238.201 13.797 6.918 780 1HD ARG 102 HD2 ARG 102 236.159 14.672 6.864 781 2HD ARG 102 HD1 ARG 102 235.564 13.470 8.007 782 HE ARG 102 HE ARG 102 235.576 15.101 9.588 783 1HH1 ARG 102 HH11 ARG 102 237.926 15.952 7.152 784 2HH1 ARG 102 HH12 ARG 102 238.333 17.463 7.895 785 1HH2 ARG 102 HH21 ARG 102 236.110 17.087 10.566 786 2HH2 ARG 102 HH22 ARG 102 237.303 18.107 9.833 787 HA PRO 103 HA PRO 103 240.241 11.221 3.547 788 1HB PRO 103 HB2 PRO 103 239.177 12.225 1.282 789 2HB PRO 103 HB1 PRO 103 238.905 10.555 1.793 790 1HG PRO 103 HG2 PRO 103 237.136 12.950 2.131 791 2HG PRO 103 HG1 PRO 103 236.708 11.314 1.592 792 1HD PRO 103 HD2 PRO 103 236.296 12.149 4.134 793 2HD PRO 103 HD1 PRO 103 236.707 10.467 3.747 794 H CYS 104 HN CYS 104 241.661 12.748 2.602 795 HA CYS 104 HA CYS 104 240.972 15.570 2.831 796 1HB CYS 104 HB2 CYS 104 242.622 14.181 4.738 797 2HB CYS 104 HB1 CYS 104 243.583 15.385 3.887 798 HG CYS 104 HG CYS 104 241.219 15.989 5.776 799 H TRP 105 HN TRP 105 241.659 16.615 1.091 800 HA TRP 105 HA TRP 105 243.583 15.299 -0.665 801 1HB TRP 105 HB2 TRP 105 241.857 17.732 -1.169 802 2HB TRP 105 HB1 TRP 105 242.815 16.872 -2.371 803 HD1 TRP 105 HD1 TRP 105 240.203 15.586 0.221 804 HE1 TRP 105 HE1 TRP 105 238.504 14.113 -1.037 805 HE3 TRP 105 HE3 TRP 105 242.062 16.079 -4.517 806 HZ2 TRP 105 HZ2 TRP 105 238.020 13.278 -3.690 807 HZ3 TRP 105 HZ3 TRP 105 240.922 14.910 -6.357 808 HH2 TRP 105 HH2 TRP 105 238.944 13.540 -5.951 809 H PHE 106 HN PHE 106 245.648 15.877 -0.702 810 HA PHE 106 HA PHE 106 246.376 18.648 -0.045 811 1HB PHE 106 HB2 PHE 106 247.809 16.197 1.004 812 2HB PHE 106 HB1 PHE 106 248.275 17.869 1.291 813 HD1 PHE 106 HD1 PHE 106 245.677 19.106 1.891 814 HD2 PHE 106 HD2 PHE 106 247.298 15.360 3.093 815 HE1 PHE 106 HE1 PHE 106 244.279 19.156 3.915 816 HE2 PHE 106 HE2 PHE 106 245.903 15.403 5.120 817 HZ PHE 106 HZ PHE 106 244.392 17.302 5.533 818 H GLN 107 HN GLN 107 249.167 18.290 -0.281 819 HA GLN 107 HA GLN 107 249.392 18.158 -3.151 820 1HB GLN 107 HB2 GLN 107 251.666 18.507 -1.207 821 2HB GLN 107 HB1 GLN 107 251.573 19.044 -2.879 822 1HG GLN 107 HG2 GLN 107 249.440 20.302 -1.626 823 2HG GLN 107 HG1 GLN 107 250.756 20.385 -0.458 824 1HE2 GLN 107 HE21 GLN 107 250.151 20.854 -3.921 825 2HE2 GLN 107 HE22 GLN 107 251.162 22.246 -4.084 826 H LEU 108 HN LEU 108 250.705 16.748 -4.332 827 HA LEU 108 HA LEU 108 250.826 14.080 -3.296 828 1HB LEU 108 HB2 LEU 108 251.273 13.408 -5.466 829 2HB LEU 108 HB1 LEU 108 250.351 14.877 -5.715 830 HG LEU 108 HG LEU 108 253.355 14.630 -5.898 831 1HD1 LEU 108 HD11 LEU 108 251.493 13.825 -7.734 832 2HD1 LEU 108 HD12 LEU 108 253.152 14.302 -8.097 833 3HD1 LEU 108 HD13 LEU 108 251.844 15.476 -8.246 834 1HD2 LEU 108 HD21 LEU 108 253.361 16.917 -6.617 835 2HD2 LEU 108 HD22 LEU 108 252.537 16.826 -5.060 836 3HD2 LEU 108 HD23 LEU 108 251.600 16.993 -6.545 837 H ASP 109 HN ASP 109 252.871 16.658 -2.941 838 HA ASP 109 HA ASP 109 255.199 14.891 -2.596 839 1HB ASP 109 HB2 ASP 109 255.350 16.747 -4.363 840 2HB ASP 109 HB1 ASP 109 255.357 17.876 -3.011 841 H GLN 110 HN GLN 110 252.897 15.732 -0.799 842 HA GLN 110 HA GLN 110 254.577 16.422 1.477 843 1HB GLN 110 HB2 GLN 110 252.090 17.922 0.665 844 2HB GLN 110 HB1 GLN 110 252.791 18.019 2.275 845 1HG GLN 110 HG2 GLN 110 254.943 18.727 1.103 846 2HG GLN 110 HG1 GLN 110 253.935 18.971 -0.324 847 1HE2 GLN 110 HE21 GLN 110 255.069 20.304 2.554 848 2HE2 GLN 110 HE22 GLN 110 254.072 21.714 2.589 849 H ILE 111 HN ILE 111 252.977 14.049 0.407 850 HA ILE 111 HA ILE 111 250.857 13.690 2.309 851 HB ILE 111 HB ILE 111 251.897 11.146 1.439 852 1HG1 ILE 111 HG12 ILE 111 251.119 11.583 -1.012 853 2HG1 ILE 111 HG11 ILE 111 251.579 13.250 -0.671 854 1HG2 ILE 111 HG21 ILE 111 249.541 12.085 2.168 855 2HG2 ILE 111 HG22 ILE 111 249.722 10.657 1.150 856 3HG2 ILE 111 HG23 ILE 111 249.345 12.217 0.420 857 1HD1 ILE 111 HD11 ILE 111 253.458 12.283 -1.663 858 2HD1 ILE 111 HD12 ILE 111 253.295 10.798 -0.726 859 3HD1 ILE 111 HD13 ILE 111 253.820 12.284 0.063 860 HA PRO 112 HA PRO 112 253.608 12.330 5.526 861 1HB PRO 112 HB2 PRO 112 251.908 12.513 7.564 862 2HB PRO 112 HB1 PRO 112 252.435 13.966 6.705 863 1HG PRO 112 HG2 PRO 112 249.846 12.501 6.537 864 2HG PRO 112 HG1 PRO 112 250.164 14.238 6.409 865 1HD PRO 112 HD2 PRO 112 249.809 12.414 4.275 866 2HD PRO 112 HD1 PRO 112 250.368 14.094 4.157 867 H PHE 113 HN PHE 113 254.038 10.214 5.024 868 HA PHE 113 HA PHE 113 252.078 8.151 5.406 869 1HB PHE 113 HB2 PHE 113 254.909 7.342 5.298 870 2HB PHE 113 HB1 PHE 113 253.528 6.729 4.411 871 HD1 PHE 113 HD1 PHE 113 256.359 7.272 3.455 872 HD2 PHE 113 HD2 PHE 113 252.779 9.573 3.255 873 HE1 PHE 113 HE1 PHE 113 257.199 8.382 1.439 874 HE2 PHE 113 HE2 PHE 113 253.627 10.692 1.242 875 HZ PHE 113 HZ PHE 113 255.834 10.105 0.326 876 H LYS 114 HN LYS 114 254.284 9.801 7.421 877 HA LYS 114 HA LYS 114 254.823 7.772 9.314 878 1HB LYS 114 HB2 LYS 114 255.449 9.618 10.811 879 2HB LYS 114 HB1 LYS 114 256.153 9.827 9.214 880 1HG LYS 114 HG2 LYS 114 255.402 11.930 9.467 881 2HG LYS 114 HG1 LYS 114 253.888 11.228 8.894 882 1HD LYS 114 HD2 LYS 114 253.035 12.146 10.765 883 2HD LYS 114 HD1 LYS 114 253.713 10.718 11.549 884 1HE LYS 114 HE2 LYS 114 255.869 12.344 11.538 885 2HE LYS 114 HE1 LYS 114 254.574 13.534 11.656 886 1HZ LYS 114 HZ1 LYS 114 255.266 11.371 13.537 887 2HZ LYS 114 HZ2 LYS 114 253.711 12.034 13.525 888 3HZ LYS 114 HZ3 LYS 114 255.047 13.019 13.848 889 H ASP 115 HN ASP 115 252.160 9.890 8.690 890 HA ASP 115 HA ASP 115 250.859 9.098 11.171 891 1HB ASP 115 HB2 ASP 115 250.516 11.351 9.265 892 2HB ASP 115 HB1 ASP 115 249.070 10.773 10.085 893 H MET 116 HN MET 116 251.314 7.300 8.892 894 HA MET 116 HA MET 116 248.517 6.612 8.331 895 1HB MET 116 HB2 MET 116 250.819 6.870 6.482 896 2HB MET 116 HB1 MET 116 249.748 5.503 6.212 897 1HG MET 116 HG2 MET 116 248.105 6.786 5.412 898 2HG MET 116 HG1 MET 116 248.363 8.044 6.617 899 1HE MET 116 HE1 MET 116 249.625 6.466 3.297 900 2HE MET 116 HE2 MET 116 251.175 6.676 4.112 901 3HE MET 116 HE3 MET 116 250.781 7.658 2.701 902 H TRP 117 HN TRP 117 251.521 4.916 7.531 903 HA TRP 117 HA TRP 117 251.108 2.962 9.620 904 1HB TRP 117 HB2 TRP 117 249.952 2.534 7.066 905 2HB TRP 117 HB1 TRP 117 251.328 1.443 7.195 906 HD1 TRP 117 HD1 TRP 117 249.209 2.349 10.258 907 HE1 TRP 117 HE1 TRP 117 247.993 0.230 11.068 908 HE3 TRP 117 HE3 TRP 117 250.444 -0.809 6.432 909 HZ2 TRP 117 HZ2 TRP 117 247.610 -2.429 10.200 910 HZ3 TRP 117 HZ3 TRP 117 249.613 -3.123 6.498 911 HH2 TRP 117 HH2 TRP 117 248.225 -3.915 8.344 912 HA PRO 118 HA PRO 118 255.440 2.327 8.978 913 1HB PRO 118 HB2 PRO 118 255.856 -0.184 9.752 914 2HB PRO 118 HB1 PRO 118 255.218 1.021 10.876 915 1HG PRO 118 HG2 PRO 118 253.787 -1.156 9.421 916 2HG PRO 118 HG1 PRO 118 253.536 -0.551 11.067 917 1HD PRO 118 HD2 PRO 118 252.033 0.147 8.820 918 2HD PRO 118 HD1 PRO 118 252.068 1.030 10.357 919 H ASP 119 HN ASP 119 253.519 1.368 6.638 920 HA ASP 119 HA ASP 119 255.671 0.010 5.163 921 1HB ASP 119 HB2 ASP 119 252.715 -0.569 4.900 922 2HB ASP 119 HB1 ASP 119 254.009 -1.339 3.986 923 H ASP 120 HN ASP 120 253.161 2.398 5.207 924 HA ASP 120 HA ASP 120 252.624 2.990 2.617 925 1HB ASP 120 HB2 ASP 120 253.154 4.873 4.903 926 2HB ASP 120 HB1 ASP 120 252.514 5.402 3.348 927 H SER 121 HN SER 121 255.424 4.317 4.382 928 HA SER 121 HA SER 121 256.540 5.715 2.228 929 1HB SER 121 HB2 SER 121 258.550 4.649 4.051 930 2HB SER 121 HB1 SER 121 258.071 6.320 3.757 931 HG SER 121 HG SER 121 256.281 5.938 5.165 932 H TYR 122 HN TYR 122 256.444 2.327 2.798 933 HA TYR 122 HA TYR 122 258.820 1.757 1.268 934 1HB TYR 122 HB2 TYR 122 256.743 0.021 2.581 935 2HB TYR 122 HB1 TYR 122 258.019 -0.644 1.567 936 HD1 TYR 122 HD1 TYR 122 260.293 -0.745 2.341 937 HD2 TYR 122 HD2 TYR 122 257.288 1.089 4.729 938 HE1 TYR 122 HE1 TYR 122 261.824 -0.759 4.266 939 HE2 TYR 122 HE2 TYR 122 258.809 1.081 6.660 940 HH TYR 122 HH TYR 122 261.484 -0.751 6.888 941 H TRP 123 HN TRP 123 255.444 2.156 0.584 942 HA TRP 123 HA TRP 123 255.975 1.079 -2.095 943 1HB TRP 123 HB2 TRP 123 253.656 0.337 -2.257 944 2HB TRP 123 HB1 TRP 123 254.474 -0.415 -0.894 945 HD1 TRP 123 HD1 TRP 123 253.649 0.252 1.556 946 HE1 TRP 123 HE1 TRP 123 251.470 1.331 2.401 947 HE3 TRP 123 HE3 TRP 123 251.868 2.070 -2.878 948 HZ2 TRP 123 HZ2 TRP 123 249.283 2.773 1.328 949 HZ3 TRP 123 HZ3 TRP 123 249.723 3.278 -2.878 950 HH2 TRP 123 HH2 TRP 123 248.462 3.613 -0.822 951 H PHE 124 HN PHE 124 254.948 3.815 -0.344 952 HA PHE 124 HA PHE 124 253.334 4.949 -2.407 953 1HB PHE 124 HB2 PHE 124 253.493 5.459 0.204 954 2HB PHE 124 HB1 PHE 124 254.594 6.705 -0.368 955 HD1 PHE 124 HD1 PHE 124 251.820 5.754 -2.543 956 HD2 PHE 124 HD2 PHE 124 253.068 8.383 0.557 957 HE1 PHE 124 HE1 PHE 124 249.912 7.226 -3.019 958 HE2 PHE 124 HE2 PHE 124 251.174 9.849 0.093 959 HZ PHE 124 HZ PHE 124 249.584 9.280 -1.700 960 HA PRO 125 HA PRO 125 257.336 7.686 -3.117 961 1HB PRO 125 HB2 PRO 125 259.640 6.157 -2.883 962 2HB PRO 125 HB1 PRO 125 259.076 7.347 -1.707 963 1HG PRO 125 HG2 PRO 125 258.796 4.382 -1.690 964 2HG PRO 125 HG1 PRO 125 259.075 5.496 -0.341 965 1HD PRO 125 HD2 PRO 125 256.669 4.399 -0.817 966 2HD PRO 125 HD1 PRO 125 256.833 6.040 -0.164 967 H LEU 126 HN LEU 126 257.171 4.227 -3.807 968 HA LEU 126 HA LEU 126 258.407 4.543 -6.395 969 1HB LEU 126 HB2 LEU 126 258.095 2.212 -6.699 970 2HB LEU 126 HB1 LEU 126 258.589 2.451 -5.035 971 HG LEU 126 HG LEU 126 255.897 2.455 -4.745 972 1HD1 LEU 126 HD11 LEU 126 256.423 0.398 -6.874 973 2HD1 LEU 126 HD12 LEU 126 255.673 1.960 -7.197 974 3HD1 LEU 126 HD13 LEU 126 254.884 0.808 -6.121 975 1HD2 LEU 126 HD21 LEU 126 257.408 1.160 -3.401 976 2HD2 LEU 126 HD22 LEU 126 257.778 0.102 -4.761 977 3HD2 LEU 126 HD23 LEU 126 256.165 0.088 -4.047 978 H LEU 127 HN LEU 127 255.203 4.538 -5.050 979 HA LEU 127 HA LEU 127 253.691 4.098 -7.387 980 1HB LEU 127 HB2 LEU 127 253.110 5.765 -4.934 981 2HB LEU 127 HB1 LEU 127 251.934 5.454 -6.192 982 HG LEU 127 HG LEU 127 252.663 3.849 -3.919 983 1HD1 LEU 127 HD11 LEU 127 250.557 2.675 -4.599 984 2HD1 LEU 127 HD12 LEU 127 250.489 3.757 -5.991 985 3HD1 LEU 127 HD13 LEU 127 250.406 4.416 -4.357 986 1HD2 LEU 127 HD21 LEU 127 252.694 1.663 -4.998 987 2HD2 LEU 127 HD22 LEU 127 254.078 2.631 -5.498 988 3HD2 LEU 127 HD23 LEU 127 252.703 2.435 -6.583 989 H LEU 128 HN LEU 128 254.734 7.064 -5.780 990 HA LEU 128 HA LEU 128 253.797 8.916 -7.642 991 1HB LEU 128 HB2 LEU 128 255.916 8.903 -5.553 992 2HB LEU 128 HB1 LEU 128 255.928 10.219 -6.712 993 HG LEU 128 HG LEU 128 253.305 9.689 -5.484 994 1HD1 LEU 128 HD11 LEU 128 253.747 10.255 -3.325 995 2HD1 LEU 128 HD12 LEU 128 255.204 11.157 -3.740 996 3HD1 LEU 128 HD13 LEU 128 255.239 9.395 -3.702 997 1HD2 LEU 128 HD21 LEU 128 253.118 12.034 -5.542 998 2HD2 LEU 128 HD22 LEU 128 253.976 11.597 -7.021 999 3HD2 LEU 128 HD23 LEU 128 254.865 12.253 -5.646 1000 H GLN 129 HN GLN 129 256.652 6.909 -7.673 1001 HA GLN 129 HA GLN 129 257.940 8.326 -9.815 1002 1HB GLN 129 HB2 GLN 129 259.155 6.991 -8.079 1003 2HB GLN 129 HB1 GLN 129 258.505 5.533 -8.815 1004 1HG GLN 129 HG2 GLN 129 260.779 5.943 -9.546 1005 2HG GLN 129 HG1 GLN 129 259.652 6.055 -10.896 1006 1HE2 GLN 129 HE21 GLN 129 259.914 7.719 -12.191 1007 2HE2 GLN 129 HE22 GLN 129 260.680 9.215 -11.789 1008 H LYS 130 HN LYS 130 255.336 6.204 -9.683 1009 HA LYS 130 HA LYS 130 254.081 5.214 -11.300 1010 1HB LYS 130 HB2 LYS 130 256.010 6.340 -13.329 1011 2HB LYS 130 HB1 LYS 130 254.343 5.848 -13.592 1012 1HG LYS 130 HG2 LYS 130 253.504 7.787 -12.814 1013 2HG LYS 130 HG1 LYS 130 254.750 7.955 -11.575 1014 1HD LYS 130 HD2 LYS 130 255.381 8.319 -14.487 1015 2HD LYS 130 HD1 LYS 130 254.731 9.642 -13.515 1016 1HE LYS 130 HE2 LYS 130 256.687 8.879 -11.883 1017 2HE LYS 130 HE1 LYS 130 257.385 8.315 -13.402 1018 1HZ LYS 130 HZ1 LYS 130 256.534 11.085 -12.757 1019 2HZ LYS 130 HZ2 LYS 130 257.041 10.580 -14.289 1020 3HZ LYS 130 HZ3 LYS 130 258.118 10.536 -12.986 1021 H LYS 131 HN LYS 131 256.067 3.740 -10.008 1022 HA LYS 131 HA LYS 131 256.882 1.870 -12.139 1023 1HB LYS 131 HB2 LYS 131 258.314 2.549 -9.566 1024 2HB LYS 131 HB1 LYS 131 258.751 1.197 -10.602 1025 1HG LYS 131 HG2 LYS 131 258.922 3.015 -12.452 1026 2HG LYS 131 HG1 LYS 131 259.047 4.125 -11.086 1027 1HD LYS 131 HD2 LYS 131 261.265 3.627 -11.484 1028 2HD LYS 131 HD1 LYS 131 260.853 2.439 -10.246 1029 1HE LYS 131 HE2 LYS 131 261.795 1.002 -11.709 1030 2HE LYS 131 HE1 LYS 131 260.196 1.052 -12.452 1031 1HZ LYS 131 HZ1 LYS 131 262.711 2.182 -13.382 1032 2HZ LYS 131 HZ2 LYS 131 261.328 3.117 -13.655 1033 3HZ LYS 131 HZ3 LYS 131 261.416 1.542 -14.266 1034 H LYS 132 HN LYS 132 256.985 -0.404 -11.479 1035 HA LYS 132 HA LYS 132 254.862 -1.004 -9.550 1036 1HB LYS 132 HB2 LYS 132 255.960 -2.463 -11.931 1037 2HB LYS 132 HB1 LYS 132 255.063 -3.332 -10.694 1038 1HG LYS 132 HG2 LYS 132 253.178 -1.737 -11.046 1039 2HG LYS 132 HG1 LYS 132 254.076 -1.067 -12.409 1040 1HD LYS 132 HD2 LYS 132 254.164 -3.708 -12.996 1041 2HD LYS 132 HD1 LYS 132 252.608 -3.608 -12.170 1042 1HE LYS 132 HE2 LYS 132 252.468 -1.445 -13.794 1043 2HE LYS 132 HE1 LYS 132 253.446 -2.533 -14.778 1044 1HZ LYS 132 HZ1 LYS 132 251.521 -4.184 -13.975 1045 2HZ LYS 132 HZ2 LYS 132 251.439 -3.286 -15.406 1046 3HZ LYS 132 HZ3 LYS 132 250.653 -2.731 -14.015 1047 H PHE 133 HN PHE 133 255.209 -2.236 -7.767 1048 HA PHE 133 HA PHE 133 257.755 -3.625 -7.452 1049 1HB PHE 133 HB2 PHE 133 256.890 -1.243 -5.862 1050 2HB PHE 133 HB1 PHE 133 257.824 -2.507 -5.075 1051 HD1 PHE 133 HD1 PHE 133 257.885 -0.253 -8.038 1052 HD2 PHE 133 HD2 PHE 133 260.126 -2.460 -5.171 1053 HE1 PHE 133 HE1 PHE 133 259.960 0.761 -8.885 1054 HE2 PHE 133 HE2 PHE 133 262.205 -1.451 -6.013 1055 HZ PHE 133 HZ PHE 133 262.123 0.164 -7.872 1056 H HIS 134 HN HIS 134 257.808 -4.740 -5.267 1057 HA HIS 134 HA HIS 134 255.187 -5.475 -4.222 1058 1HB HIS 134 HB2 HIS 134 255.564 -7.133 -5.973 1059 2HB HIS 134 HB1 HIS 134 257.174 -7.468 -5.346 1060 HD1 HIS 134 HD1 HIS 134 254.040 -8.984 -5.426 1061 HD2 HIS 134 HD2 HIS 134 256.770 -8.291 -2.371 1062 HE1 HIS 134 HE1 HIS 134 253.471 -10.646 -3.626 1063 HE2 HIS 134 HE2 HIS 134 255.212 -10.287 -1.841 1064 H GLY 135 HN GLY 135 255.305 -5.484 -2.037 1065 1HA GLY 135 HA2 GLY 135 257.984 -5.918 -0.872 1066 2HA GLY 135 HA1 GLY 135 256.882 -4.696 -0.267 1067 H TYR 136 HN TYR 136 258.201 -7.403 0.622 1068 HA TYR 136 HA TYR 136 255.774 -8.528 1.859 1069 1HB TYR 136 HB2 TYR 136 257.374 -9.950 0.338 1070 2HB TYR 136 HB1 TYR 136 258.403 -9.978 1.764 1071 HD1 TYR 136 HD1 TYR 136 255.878 -10.004 3.681 1072 HD2 TYR 136 HD2 TYR 136 257.127 -12.360 0.365 1073 HE1 TYR 136 HE1 TYR 136 254.603 -11.911 4.558 1074 HE2 TYR 136 HE2 TYR 136 255.851 -14.272 1.235 1075 HH TYR 136 HH TYR 136 254.867 -14.616 4.228 1076 H PHE 137 HN PHE 137 255.540 -7.718 3.851 1077 HA PHE 137 HA PHE 137 257.969 -7.253 5.452 1078 1HB PHE 137 HB2 PHE 137 255.280 -5.956 5.876 1079 2HB PHE 137 HB1 PHE 137 256.827 -5.490 6.576 1080 HD1 PHE 137 HD1 PHE 137 255.118 -5.847 3.288 1081 HD2 PHE 137 HD2 PHE 137 258.060 -3.813 5.592 1082 HE1 PHE 137 HE1 PHE 137 255.486 -4.279 1.426 1083 HE2 PHE 137 HE2 PHE 137 258.433 -2.244 3.737 1084 HZ PHE 137 HZ PHE 137 257.146 -2.473 1.651 1085 H LYS 138 HN LYS 138 258.168 -8.157 7.430 1086 HA LYS 138 HA LYS 138 256.178 -10.103 8.275 1087 1HB LYS 138 HB2 LYS 138 258.615 -10.672 8.265 1088 2HB LYS 138 HB1 LYS 138 258.865 -9.447 9.501 1089 1HG LYS 138 HG2 LYS 138 257.506 -10.664 11.062 1090 2HG LYS 138 HG1 LYS 138 257.067 -11.839 9.820 1091 1HD LYS 138 HD2 LYS 138 259.954 -11.498 10.183 1092 2HD LYS 138 HD1 LYS 138 259.117 -12.126 11.605 1093 1HE LYS 138 HE2 LYS 138 258.062 -13.841 10.120 1094 2HE LYS 138 HE1 LYS 138 259.110 -13.277 8.819 1095 1HZ LYS 138 HZ1 LYS 138 260.994 -14.056 9.893 1096 2HZ LYS 138 HZ2 LYS 138 259.860 -15.271 10.208 1097 3HZ LYS 138 HZ3 LYS 138 260.240 -14.138 11.406 1098 H PHE 139 HN PHE 139 254.758 -9.705 9.923 1099 HA PHE 139 HA PHE 139 255.137 -7.154 11.346 1100 1HB PHE 139 HB2 PHE 139 252.855 -8.370 10.033 1101 2HB PHE 139 HB1 PHE 139 252.479 -7.941 11.700 1102 HD1 PHE 139 HD1 PHE 139 252.141 -5.704 12.331 1103 HD2 PHE 139 HD2 PHE 139 253.725 -6.610 8.487 1104 HE1 PHE 139 HE1 PHE 139 251.836 -3.359 11.655 1105 HE2 PHE 139 HE2 PHE 139 253.425 -4.264 7.807 1106 HZ PHE 139 HZ PHE 139 252.477 -2.636 9.391 1107 H GLN 140 HN GLN 140 254.170 -7.016 13.509 1108 HA GLN 140 HA GLN 140 254.188 -9.528 15.016 1109 1HB GLN 140 HB2 GLN 140 256.370 -8.872 15.472 1110 2HB GLN 140 HB1 GLN 140 255.986 -7.162 15.397 1111 1HG GLN 140 HG2 GLN 140 256.576 -8.103 17.661 1112 2HG GLN 140 HG1 GLN 140 255.095 -7.156 17.566 1113 1HE2 GLN 140 HE21 GLN 140 253.510 -7.984 18.708 1114 2HE2 GLN 140 HE22 GLN 140 253.210 -9.662 18.982 1115 H GLY 141 HN GLY 141 251.892 -9.214 15.046 1116 1HA GLY 141 HA2 GLY 141 250.288 -8.728 16.814 1117 2HA GLY 141 HA1 GLY 141 251.074 -7.169 17.013 1118 H GLN 142 HN GLN 142 250.988 -5.720 15.032 1119 HA GLN 142 HA GLN 142 249.087 -6.100 13.009 1120 1HB GLN 142 HB2 GLN 142 247.971 -5.367 15.557 1121 2HB GLN 142 HB1 GLN 142 247.696 -4.075 14.397 1122 1HG GLN 142 HG2 GLN 142 246.902 -6.962 14.101 1123 2HG GLN 142 HG1 GLN 142 245.832 -5.590 14.389 1124 1HE2 GLN 142 HE21 GLN 142 245.235 -4.298 12.710 1125 2HE2 GLN 142 HE22 GLN 142 245.627 -4.631 11.060 1126 H ASP 143 HN ASP 143 250.716 -3.772 15.110 1127 HA ASP 143 HA ASP 143 251.042 -2.017 12.762 1128 1HB ASP 143 HB2 ASP 143 250.725 -1.271 15.670 1129 2HB ASP 143 HB1 ASP 143 251.243 -0.137 14.425 1130 H THR 144 HN THR 144 252.749 -4.238 14.096 1131 HA THR 144 HA THR 144 255.203 -2.618 14.315 1132 HB THR 144 HB THR 144 254.458 -5.173 15.725 1133 HG1 THR 144 HG1 THR 144 255.130 -2.562 16.577 1134 1HG2 THR 144 HG21 THR 144 256.763 -5.391 14.991 1135 2HG2 THR 144 HG22 THR 144 256.666 -5.170 16.737 1136 3HG2 THR 144 HG23 THR 144 257.145 -3.824 15.703 1137 H ILE 145 HN ILE 145 256.841 -3.071 12.965 1138 HA ILE 145 HA ILE 145 256.552 -5.466 11.290 1139 HB ILE 145 HB ILE 145 258.087 -2.961 10.594 1140 1HG1 ILE 145 HG12 ILE 145 255.408 -3.957 9.592 1141 2HG1 ILE 145 HG11 ILE 145 255.666 -2.548 10.616 1142 1HG2 ILE 145 HG21 ILE 145 258.143 -4.009 8.329 1143 2HG2 ILE 145 HG22 ILE 145 257.467 -5.473 9.042 1144 3HG2 ILE 145 HG23 ILE 145 259.053 -4.894 9.552 1145 1HD1 ILE 145 HD11 ILE 145 256.579 -2.903 7.771 1146 2HD1 ILE 145 HD12 ILE 145 256.975 -1.519 8.791 1147 3HD1 ILE 145 HD13 ILE 145 255.297 -1.842 8.355 1148 H LEU 146 HN LEU 146 258.289 -6.800 10.947 1149 HA LEU 146 HA LEU 146 260.666 -6.275 12.605 1150 1HB LEU 146 HB2 LEU 146 259.695 -9.051 12.046 1151 2HB LEU 146 HB1 LEU 146 260.741 -8.486 13.335 1152 HG LEU 146 HG LEU 146 257.993 -7.406 13.381 1153 1HD1 LEU 146 HD11 LEU 146 258.212 -10.095 12.838 1154 2HD1 LEU 146 HD12 LEU 146 256.833 -9.292 13.587 1155 3HD1 LEU 146 HD13 LEU 146 258.069 -10.044 14.595 1156 1HD2 LEU 146 HD21 LEU 146 258.478 -8.366 15.829 1157 2HD2 LEU 146 HD22 LEU 146 259.070 -6.799 15.277 1158 3HD2 LEU 146 HD23 LEU 146 260.137 -8.203 15.254 1159 H ASP 147 HN ASP 147 259.421 -7.071 9.523 1160 HA ASP 147 HA ASP 147 262.092 -7.148 8.428 1161 1HB ASP 147 HB2 ASP 147 260.787 -9.567 8.979 1162 2HB ASP 147 HB1 ASP 147 260.586 -9.329 7.246 1163 H TYR 148 HN TYR 148 262.172 -6.355 6.343 1164 HA TYR 148 HA TYR 148 259.637 -6.101 4.911 1165 1HB TYR 148 HB2 TYR 148 259.952 -3.763 4.440 1166 2HB TYR 148 HB1 TYR 148 259.952 -4.016 6.182 1167 HD1 TYR 148 HD1 TYR 148 262.163 -3.426 3.262 1168 HD2 TYR 148 HD2 TYR 148 261.795 -3.351 7.500 1169 HE1 TYR 148 HE1 TYR 148 264.322 -2.258 3.423 1170 HE2 TYR 148 HE2 TYR 148 263.952 -2.182 7.672 1171 HH TYR 148 HH TYR 148 266.184 -2.096 5.414 1172 H THR 149 HN THR 149 259.778 -6.432 2.773 1173 HA THR 149 HA THR 149 262.446 -6.329 1.536 1174 HB THR 149 HB THR 149 261.184 -8.276 0.089 1175 HG1 THR 149 HG1 THR 149 260.366 -9.727 1.687 1176 1HG2 THR 149 HG21 THR 149 262.573 -9.399 2.388 1177 2HG2 THR 149 HG22 THR 149 263.471 -8.123 1.567 1178 3HG2 THR 149 HG23 THR 149 262.923 -9.537 0.666 1179 H LEU 150 HN LEU 150 262.511 -5.611 -0.583 1180 HA LEU 150 HA LEU 150 259.962 -4.796 -1.787 1181 1HB LEU 150 HB2 LEU 150 262.405 -3.065 -1.438 1182 2HB LEU 150 HB1 LEU 150 261.080 -2.668 -2.515 1183 HG LEU 150 HG LEU 150 259.776 -3.119 -0.137 1184 1HD1 LEU 150 HD11 LEU 150 262.336 -3.031 0.688 1185 2HD1 LEU 150 HD12 LEU 150 260.968 -2.492 1.664 1186 3HD1 LEU 150 HD13 LEU 150 261.925 -1.318 0.759 1187 1HD2 LEU 150 HD21 LEU 150 259.020 -1.277 -1.216 1188 2HD2 LEU 150 HD22 LEU 150 260.635 -0.751 -1.688 1189 3HD2 LEU 150 HD23 LEU 150 260.058 -0.461 -0.047 1190 H ARG 151 HN ARG 151 259.773 -5.526 -3.789 1191 HA ARG 151 HA ARG 151 262.195 -5.854 -5.424 1192 1HB ARG 151 HB2 ARG 151 259.909 -7.827 -5.366 1193 2HB ARG 151 HB1 ARG 151 261.406 -7.970 -6.275 1194 1HG ARG 151 HG2 ARG 151 261.836 -7.638 -3.414 1195 2HG ARG 151 HG1 ARG 151 260.897 -9.077 -3.819 1196 1HD ARG 151 HD2 ARG 151 262.931 -10.005 -4.096 1197 2HD ARG 151 HD1 ARG 151 262.844 -9.231 -5.677 1198 HE ARG 151 HE ARG 151 263.945 -7.449 -3.786 1199 1HH1 ARG 151 HH11 ARG 151 264.739 -10.328 -5.591 1200 2HH1 ARG 151 HH12 ARG 151 266.439 -10.002 -5.604 1201 1HH2 ARG 151 HH21 ARG 151 266.181 -7.018 -3.803 1202 2HH2 ARG 151 HH22 ARG 151 267.259 -8.123 -4.588 1203 H GLU 152 HN GLU 152 262.037 -4.788 -7.290 1204 HA GLU 152 HA GLU 152 259.568 -3.584 -8.094 1205 1HB GLU 152 HB2 GLU 152 261.784 -2.516 -8.431 1206 2HB GLU 152 HB1 GLU 152 262.176 -3.759 -9.609 1207 1HG GLU 152 HG2 GLU 152 260.268 -3.017 -10.981 1208 2HG GLU 152 HG1 GLU 152 259.973 -1.722 -9.821 1209 H VAL 153 HN VAL 153 258.255 -4.078 -9.816 1210 HA VAL 153 HA VAL 153 258.875 -6.537 -11.313 1211 HB VAL 153 HB VAL 153 256.471 -7.143 -11.234 1212 1HG1 VAL 153 HG11 VAL 153 256.569 -7.555 -8.595 1213 2HG1 VAL 153 HG12 VAL 153 258.252 -7.106 -8.875 1214 3HG1 VAL 153 HG13 VAL 153 257.546 -8.468 -9.745 1215 1HG2 VAL 153 HG21 VAL 153 255.333 -5.999 -9.122 1216 2HG2 VAL 153 HG22 VAL 153 255.186 -5.328 -10.747 1217 3HG2 VAL 153 HG23 VAL 153 256.364 -4.658 -9.618 1218 H ASP 154 HN ASP 154 257.376 -6.772 -13.250 1219 HA ASP 154 HA ASP 154 256.304 -4.331 -14.347 1220 1HB ASP 154 HB2 ASP 154 257.768 -4.296 -16.324 1221 2HB ASP 154 HB1 ASP 154 258.683 -4.032 -14.842 1222 H THR 155 HN THR 155 255.462 -7.089 -13.709 1223 HA THR 155 HA THR 155 255.049 -8.419 -16.226 1224 HB THR 155 HB THR 155 255.243 -9.816 -14.303 1225 HG1 THR 155 HG1 THR 155 253.691 -11.049 -14.952 1226 1HG2 THR 155 HG21 THR 155 253.091 -9.564 -12.685 1227 2HG2 THR 155 HG22 THR 155 253.447 -7.875 -13.051 1228 3HG2 THR 155 HG23 THR 155 254.690 -8.905 -12.341 1229 H VAL 156 HN VAL 156 254.024 -6.645 -17.359 1230 HA VAL 156 HA VAL 156 251.352 -5.884 -16.496 1231 HB VAL 156 HB VAL 156 252.777 -5.061 -19.026 1232 1HG1 VAL 156 HG11 VAL 156 250.286 -4.212 -17.629 1233 2HG1 VAL 156 HG12 VAL 156 250.592 -4.442 -19.350 1234 3HG1 VAL 156 HG13 VAL 156 251.214 -3.011 -18.529 1235 1HG2 VAL 156 HG21 VAL 156 254.246 -4.139 -17.569 1236 2HG2 VAL 156 HG22 VAL 156 253.098 -4.157 -16.230 1237 3HG2 VAL 156 HG23 VAL 156 252.998 -2.898 -17.461 Start of MODEL 18 1 1H MET 1 HT1 MET 1 240.020 -20.617 3.502 2 2H MET 1 HT2 MET 1 240.131 -21.513 4.963 3 3H MET 1 HT3 MET 1 238.817 -21.774 3.889 4 HA MET 1 HA MET 1 240.560 -23.484 3.847 5 1HB MET 1 HB2 MET 1 238.933 -22.536 1.937 6 2HB MET 1 HB1 MET 1 240.477 -22.205 1.165 7 1HG MET 1 HG2 MET 1 240.180 -24.285 0.366 8 2HG MET 1 HG1 MET 1 240.910 -24.731 1.907 9 1HE MET 1 HE1 MET 1 236.427 -24.928 0.885 10 2HE MET 1 HE2 MET 1 237.693 -25.026 -0.340 11 3HE MET 1 HE3 MET 1 237.472 -23.539 0.582 12 H GLY 2 HN GLY 2 241.538 -20.652 1.901 13 1HA GLY 2 HA2 GLY 2 244.292 -21.474 1.935 14 2HA GLY 2 HA1 GLY 2 243.653 -19.999 1.229 15 H ALA 3 HN ALA 3 245.984 -20.664 3.072 16 HA ALA 3 HA ALA 3 245.311 -19.055 5.412 17 1HB ALA 3 HB1 ALA 3 247.099 -19.992 6.470 18 2HB ALA 3 HB2 ALA 3 248.055 -20.111 4.993 19 3HB ALA 3 HB3 ALA 3 246.760 -21.269 5.301 20 H SER 4 HN SER 4 245.028 -17.124 4.042 21 HA SER 4 HA SER 4 247.224 -15.396 4.218 22 1HB SER 4 HB2 SER 4 248.362 -16.038 2.370 23 2HB SER 4 HB1 SER 4 246.969 -16.868 1.683 24 HG SER 4 HG SER 4 247.626 -14.123 1.552 25 H ARG 5 HN ARG 5 245.744 -14.097 5.174 26 HA ARG 5 HA ARG 5 243.251 -13.386 4.115 27 1HB ARG 5 HB2 ARG 5 245.052 -12.359 6.224 28 2HB ARG 5 HB1 ARG 5 243.912 -11.192 5.568 29 1HG ARG 5 HG2 ARG 5 242.691 -12.051 7.293 30 2HG ARG 5 HG1 ARG 5 242.182 -13.117 5.983 31 1HD ARG 5 HD2 ARG 5 242.661 -14.639 7.640 32 2HD ARG 5 HD1 ARG 5 244.196 -14.576 6.775 33 HE ARG 5 HE ARG 5 245.146 -13.803 8.688 34 1HH1 ARG 5 HH11 ARG 5 241.747 -13.020 8.784 35 2HH1 ARG 5 HH12 ARG 5 241.820 -12.337 10.373 36 1HH2 ARG 5 HH21 ARG 5 245.245 -12.906 10.779 37 2HH2 ARG 5 HH22 ARG 5 243.806 -12.272 11.506 38 H LEU 6 HN LEU 6 243.331 -12.840 1.982 39 HA LEU 6 HA LEU 6 245.168 -10.791 1.071 40 1HB LEU 6 HB2 LEU 6 244.229 -12.913 -0.211 41 2HB LEU 6 HB1 LEU 6 242.949 -11.797 -0.645 42 HG LEU 6 HG LEU 6 245.781 -10.961 -1.088 43 1HD1 LEU 6 HD11 LEU 6 245.537 -11.983 -3.406 44 2HD1 LEU 6 HD12 LEU 6 244.270 -12.988 -2.704 45 3HD1 LEU 6 HD13 LEU 6 245.915 -13.079 -2.078 46 1HD2 LEU 6 HD21 LEU 6 244.892 -9.465 -2.560 47 2HD2 LEU 6 HD22 LEU 6 243.505 -9.650 -1.487 48 3HD2 LEU 6 HD23 LEU 6 243.561 -10.530 -3.013 49 H TYR 7 HN TYR 7 244.765 -8.743 1.266 50 HA TYR 7 HA TYR 7 241.982 -7.786 1.208 51 1HB TYR 7 HB2 TYR 7 244.297 -6.961 2.949 52 2HB TYR 7 HB1 TYR 7 242.945 -5.873 2.658 53 HD1 TYR 7 HD1 TYR 7 243.290 -9.514 3.469 54 HD2 TYR 7 HD2 TYR 7 241.482 -5.786 4.426 55 HE1 TYR 7 HE1 TYR 7 242.034 -10.596 5.284 56 HE2 TYR 7 HE2 TYR 7 240.220 -6.856 6.244 57 HH TYR 7 HH TYR 7 240.908 -10.035 7.334 58 H THR 8 HN THR 8 242.165 -5.206 0.922 59 HA THR 8 HA THR 8 243.970 -4.743 -1.362 60 HB THR 8 HB THR 8 242.192 -3.457 -2.427 61 HG1 THR 8 HG1 THR 8 240.862 -2.747 -0.894 62 1HG2 THR 8 HG21 THR 8 240.465 -5.402 -2.620 63 2HG2 THR 8 HG22 THR 8 241.696 -6.302 -1.737 64 3HG2 THR 8 HG23 THR 8 242.086 -5.566 -3.289 65 H LEU 9 HN LEU 9 244.198 -2.400 -1.883 66 HA LEU 9 HA LEU 9 243.795 -0.516 0.271 67 1HB LEU 9 HB2 LEU 9 245.949 -1.873 0.718 68 2HB LEU 9 HB1 LEU 9 246.620 -0.993 -0.643 69 HG LEU 9 HG LEU 9 245.639 0.170 1.956 70 1HD1 LEU 9 HD11 LEU 9 247.810 -0.846 2.141 71 2HD1 LEU 9 HD12 LEU 9 247.989 0.909 2.145 72 3HD1 LEU 9 HD13 LEU 9 248.362 -0.013 0.689 73 1HD2 LEU 9 HD21 LEU 9 246.619 2.305 0.930 74 2HD2 LEU 9 HD22 LEU 9 245.018 1.789 0.397 75 3HD2 LEU 9 HD23 LEU 9 246.427 1.483 -0.619 76 H VAL 10 HN VAL 10 242.916 1.083 -0.946 77 HA VAL 10 HA VAL 10 244.206 1.728 -3.489 78 HB VAL 10 HB VAL 10 242.017 1.233 -4.003 79 1HG1 VAL 10 HG11 VAL 10 240.127 2.348 -2.589 80 2HG1 VAL 10 HG12 VAL 10 241.381 2.320 -1.349 81 3HG1 VAL 10 HG13 VAL 10 240.869 0.820 -2.123 82 1HG2 VAL 10 HG21 VAL 10 240.909 3.281 -4.632 83 2HG2 VAL 10 HG22 VAL 10 242.647 3.460 -4.864 84 3HG2 VAL 10 HG23 VAL 10 241.865 4.187 -3.461 85 H LEU 11 HN LEU 11 245.271 3.496 -3.711 86 HA LEU 11 HA LEU 11 244.724 5.774 -1.933 87 1HB LEU 11 HB2 LEU 11 247.108 4.214 -2.195 88 2HB LEU 11 HB1 LEU 11 247.431 5.826 -2.804 89 HG LEU 11 HG LEU 11 246.659 4.990 -0.024 90 1HD1 LEU 11 HD11 LEU 11 248.809 5.360 0.384 91 2HD1 LEU 11 HD12 LEU 11 248.618 7.040 -0.114 92 3HD1 LEU 11 HD13 LEU 11 249.063 5.813 -1.301 93 1HD2 LEU 11 HD21 LEU 11 245.201 6.735 -0.109 94 2HD2 LEU 11 HD22 LEU 11 246.113 7.584 -1.358 95 3HD2 LEU 11 HD23 LEU 11 246.677 7.603 0.313 96 H VAL 12 HN VAL 12 243.887 7.329 -3.196 97 HA VAL 12 HA VAL 12 244.454 7.383 -6.024 98 HB VAL 12 HB VAL 12 242.869 9.440 -4.503 99 1HG1 VAL 12 HG11 VAL 12 241.954 8.644 -7.140 100 2HG1 VAL 12 HG12 VAL 12 243.604 9.267 -7.162 101 3HG1 VAL 12 HG13 VAL 12 242.298 10.251 -6.500 102 1HG2 VAL 12 HG21 VAL 12 240.982 7.780 -5.502 103 2HG2 VAL 12 HG22 VAL 12 241.585 7.706 -3.846 104 3HG2 VAL 12 HG23 VAL 12 242.240 6.622 -5.073 105 H LEU 13 HN LEU 13 246.435 8.077 -6.522 106 HA LEU 13 HA LEU 13 247.247 10.721 -5.512 107 1HB LEU 13 HB2 LEU 13 248.570 8.737 -4.668 108 2HB LEU 13 HB1 LEU 13 249.150 8.549 -6.310 109 HG LEU 13 HG LEU 13 250.793 9.946 -5.831 110 1HD1 LEU 13 HD11 LEU 13 249.628 11.686 -6.876 111 2HD1 LEU 13 HD12 LEU 13 250.288 12.369 -5.393 112 3HD1 LEU 13 HD13 LEU 13 248.586 11.936 -5.477 113 1HD2 LEU 13 HD21 LEU 13 249.422 9.905 -3.259 114 2HD2 LEU 13 HD22 LEU 13 250.448 11.314 -3.514 115 3HD2 LEU 13 HD23 LEU 13 251.130 9.693 -3.638 116 H GLN 14 HN GLN 14 247.238 12.184 -7.041 117 HA GLN 14 HA GLN 14 247.631 11.371 -9.835 118 1HB GLN 14 HB2 GLN 14 246.570 14.014 -8.829 119 2HB GLN 14 HB1 GLN 14 246.495 13.387 -10.469 120 1HG GLN 14 HG2 GLN 14 244.767 11.966 -9.998 121 2HG GLN 14 HG1 GLN 14 245.190 11.841 -8.291 122 1HE2 GLN 14 HE21 GLN 14 244.290 14.402 -10.585 123 2HE2 GLN 14 HE22 GLN 14 243.129 15.154 -9.550 124 HA PRO 15 HA PRO 15 251.552 13.362 -10.100 125 1HB PRO 15 HB2 PRO 15 250.792 14.691 -12.611 126 2HB PRO 15 HB1 PRO 15 252.024 13.461 -12.321 127 1HG PRO 15 HG2 PRO 15 249.735 12.924 -13.639 128 2HG PRO 15 HG1 PRO 15 250.553 11.723 -12.625 129 1HD PRO 15 HD2 PRO 15 248.130 13.371 -12.040 130 2HD PRO 15 HD1 PRO 15 248.482 11.685 -11.606 131 H GLN 16 HN GLN 16 249.244 14.911 -8.889 132 HA GLN 16 HA GLN 16 250.597 17.449 -8.774 133 1HB GLN 16 HB2 GLN 16 247.714 17.319 -9.681 134 2HB GLN 16 HB1 GLN 16 248.628 18.783 -9.355 135 1HG GLN 16 HG2 GLN 16 249.390 16.802 -11.486 136 2HG GLN 16 HG1 GLN 16 248.344 18.187 -11.773 137 1HE2 GLN 16 HE21 GLN 16 249.495 20.180 -10.404 138 2HE2 GLN 16 HE22 GLN 16 251.085 20.499 -10.997 139 H ARG 17 HN ARG 17 247.791 15.501 -7.828 140 HA ARG 17 HA ARG 17 248.149 16.424 -5.075 141 1HB ARG 17 HB2 ARG 17 245.355 16.211 -6.121 142 2HB ARG 17 HB1 ARG 17 245.966 17.142 -4.763 143 1HG ARG 17 HG2 ARG 17 247.210 18.493 -6.617 144 2HG ARG 17 HG1 ARG 17 245.969 17.803 -7.667 145 1HD ARG 17 HD2 ARG 17 244.234 18.703 -6.176 146 2HD ARG 17 HD1 ARG 17 245.488 19.423 -5.168 147 HE ARG 17 HE ARG 17 245.730 20.262 -7.871 148 1HH1 ARG 17 HH11 ARG 17 243.873 20.785 -4.963 149 2HH1 ARG 17 HH12 ARG 17 243.451 22.413 -5.376 150 1HH2 ARG 17 HH21 ARG 17 245.176 22.404 -8.416 151 2HH2 ARG 17 HH22 ARG 17 244.190 23.333 -7.336 152 H VAL 18 HN VAL 18 246.997 15.062 -3.490 153 HA VAL 18 HA VAL 18 246.446 12.339 -4.476 154 HB VAL 18 HB VAL 18 248.661 12.217 -3.574 155 1HG1 VAL 18 HG11 VAL 18 248.364 14.364 -2.224 156 2HG1 VAL 18 HG12 VAL 18 249.366 13.096 -1.520 157 3HG1 VAL 18 HG13 VAL 18 247.713 13.331 -0.952 158 1HG2 VAL 18 HG21 VAL 18 248.373 10.635 -1.744 159 2HG2 VAL 18 HG22 VAL 18 247.158 10.368 -2.994 160 3HG2 VAL 18 HG23 VAL 18 246.720 11.198 -1.501 161 H LEU 19 HN LEU 19 245.062 11.079 -3.108 162 HA LEU 19 HA LEU 19 243.466 12.690 -1.226 163 1HB LEU 19 HB2 LEU 19 242.259 12.220 -3.329 164 2HB LEU 19 HB1 LEU 19 242.474 10.503 -3.052 165 HG LEU 19 HG LEU 19 241.048 10.561 -1.118 166 1HD1 LEU 19 HD11 LEU 19 241.200 12.451 0.087 167 2HD1 LEU 19 HD12 LEU 19 239.854 12.980 -0.922 168 3HD1 LEU 19 HD13 LEU 19 241.502 13.456 -1.332 169 1HD2 LEU 19 HD21 LEU 19 238.981 11.737 -2.284 170 2HD2 LEU 19 HD22 LEU 19 239.650 10.219 -2.885 171 3HD2 LEU 19 HD23 LEU 19 240.079 11.743 -3.664 172 H LEU 20 HN LEU 20 243.904 12.008 0.765 173 HA LEU 20 HA LEU 20 244.371 9.140 1.213 174 1HB LEU 20 HB2 LEU 20 245.473 11.593 2.355 175 2HB LEU 20 HB1 LEU 20 244.979 10.436 3.575 176 HG LEU 20 HG LEU 20 246.790 9.679 1.294 177 1HD1 LEU 20 HD11 LEU 20 248.687 10.160 2.581 178 2HD1 LEU 20 HD12 LEU 20 247.738 10.400 4.048 179 3HD1 LEU 20 HD13 LEU 20 247.664 11.588 2.746 180 1HD2 LEU 20 HD21 LEU 20 247.283 7.765 2.564 181 2HD2 LEU 20 HD22 LEU 20 245.532 7.949 2.672 182 3HD2 LEU 20 HD23 LEU 20 246.556 8.443 4.021 183 H GLY 21 HN GLY 21 243.071 7.962 2.531 184 1HA GLY 21 HA2 GLY 21 240.587 9.233 3.387 185 2HA GLY 21 HA1 GLY 21 240.898 7.506 3.308 186 H MET 22 HN MET 22 240.277 9.922 5.395 187 HA MET 22 HA MET 22 241.928 8.751 7.529 188 1HB MET 22 HB2 MET 22 242.446 11.054 7.387 189 2HB MET 22 HB1 MET 22 240.760 11.504 7.190 190 1HG MET 22 HG2 MET 22 240.280 11.078 9.464 191 2HG MET 22 HG1 MET 22 241.825 10.268 9.711 192 1HE MET 22 HE1 MET 22 243.915 11.715 8.528 193 2HE MET 22 HE2 MET 22 244.189 11.735 10.269 194 3HE MET 22 HE3 MET 22 244.335 13.224 9.339 195 H LYS 23 HN LYS 23 240.964 8.029 9.416 196 HA LYS 23 HA LYS 23 238.103 7.544 9.220 197 1HB LYS 23 HB2 LYS 23 240.373 6.293 10.585 198 2HB LYS 23 HB1 LYS 23 238.943 6.422 11.599 199 1HG LYS 23 HG2 LYS 23 237.769 5.440 9.444 200 2HG LYS 23 HG1 LYS 23 239.395 4.826 9.141 201 1HD LYS 23 HD2 LYS 23 238.319 3.124 10.352 202 2HD LYS 23 HD1 LYS 23 239.332 3.953 11.535 203 1HE LYS 23 HE2 LYS 23 237.567 4.662 12.722 204 2HE LYS 23 HE1 LYS 23 236.643 5.076 11.279 205 1HZ LYS 23 HZ1 LYS 23 235.626 3.283 12.588 206 2HZ LYS 23 HZ2 LYS 23 236.991 2.319 12.325 207 3HZ LYS 23 HZ3 LYS 23 236.022 2.785 11.020 208 H LYS 24 HN LYS 24 236.609 8.220 10.791 209 HA LYS 24 HA LYS 24 237.429 10.640 12.166 210 1HB LYS 24 HB2 LYS 24 234.808 9.425 11.409 211 2HB LYS 24 HB1 LYS 24 234.844 10.559 12.753 212 1HG LYS 24 HG2 LYS 24 234.808 12.252 11.334 213 2HG LYS 24 HG1 LYS 24 236.322 11.697 10.619 214 1HD LYS 24 HD2 LYS 24 235.231 10.482 8.955 215 2HD LYS 24 HD1 LYS 24 233.707 10.454 9.843 216 1HE LYS 24 HE2 LYS 24 234.774 13.108 9.079 217 2HE LYS 24 HE1 LYS 24 234.158 12.090 7.778 218 1HZ LYS 24 HZ1 LYS 24 232.493 12.342 10.157 219 2HZ LYS 24 HZ2 LYS 24 232.047 12.251 8.528 220 3HZ LYS 24 HZ3 LYS 24 232.614 13.710 9.168 221 H ARG 25 HN ARG 25 236.427 7.379 12.860 222 HA ARG 25 HA ARG 25 237.531 7.445 15.443 223 1HB ARG 25 HB2 ARG 25 235.403 7.023 16.719 224 2HB ARG 25 HB1 ARG 25 235.616 8.673 16.149 225 1HG ARG 25 HG2 ARG 25 234.007 6.652 14.624 226 2HG ARG 25 HG1 ARG 25 233.311 7.653 15.901 227 1HD ARG 25 HD2 ARG 25 234.498 9.573 14.512 228 2HD ARG 25 HD1 ARG 25 234.288 8.411 13.204 229 HE ARG 25 HE ARG 25 232.084 8.971 13.169 230 1HH1 ARG 25 HH11 ARG 25 233.332 9.697 16.347 231 2HH1 ARG 25 HH12 ARG 25 231.845 10.379 16.913 232 1HH2 ARG 25 HH21 ARG 25 230.127 9.868 13.912 233 2HH2 ARG 25 HH22 ARG 25 230.024 10.476 15.531 234 H GLY 26 HN GLY 26 238.303 5.467 15.683 235 1HA GLY 26 HA2 GLY 26 237.017 3.105 15.870 236 2HA GLY 26 HA1 GLY 26 237.215 3.279 14.132 237 H PHE 27 HN PHE 27 238.916 2.240 13.360 238 HA PHE 27 HA PHE 27 241.174 1.705 15.149 239 1HB PHE 27 HB2 PHE 27 240.190 0.398 12.625 240 2HB PHE 27 HB1 PHE 27 241.816 0.102 13.230 241 HD1 PHE 27 HD1 PHE 27 242.183 -1.168 15.246 242 HD2 PHE 27 HD2 PHE 27 238.244 -0.410 13.822 243 HE1 PHE 27 HE1 PHE 27 241.307 -2.899 16.760 244 HE2 PHE 27 HE2 PHE 27 237.361 -2.138 15.333 245 HZ PHE 27 HZ PHE 27 238.892 -3.385 16.805 246 H GLY 28 HN GLY 28 240.656 4.284 13.681 247 1HA GLY 28 HA2 GLY 28 243.329 4.852 12.993 248 2HA GLY 28 HA1 GLY 28 242.419 4.565 11.520 249 H ALA 29 HN ALA 29 240.935 6.030 14.337 250 HA ALA 29 HA ALA 29 239.946 8.235 12.928 251 1HB ALA 29 HB1 ALA 29 239.490 7.192 15.373 252 2HB ALA 29 HB2 ALA 29 238.904 8.763 14.828 253 3HB ALA 29 HB3 ALA 29 240.376 8.658 15.793 254 H GLY 30 HN GLY 30 240.563 10.437 12.912 255 1HA GLY 30 HA2 GLY 30 242.074 12.154 12.704 256 2HA GLY 30 HA1 GLY 30 242.727 11.576 14.229 257 H ARG 31 HN ARG 31 242.717 9.516 11.431 258 HA ARG 31 HA ARG 31 245.525 10.125 10.870 259 1HB ARG 31 HB2 ARG 31 244.444 7.574 11.948 260 2HB ARG 31 HB1 ARG 31 245.668 7.456 10.691 261 1HG ARG 31 HG2 ARG 31 246.617 9.359 12.521 262 2HG ARG 31 HG1 ARG 31 245.976 8.024 13.481 263 1HD ARG 31 HD2 ARG 31 247.824 7.584 11.151 264 2HD ARG 31 HD1 ARG 31 248.425 7.890 12.781 265 HE ARG 31 HE ARG 31 246.621 5.831 13.035 266 1HH1 ARG 31 HH11 ARG 31 249.572 6.379 11.253 267 2HH1 ARG 31 HH12 ARG 31 250.033 4.710 11.258 268 1HH2 ARG 31 HH21 ARG 31 247.225 3.636 13.043 269 2HH2 ARG 31 HH22 ARG 31 248.700 3.152 12.274 270 H TRP 32 HN TRP 32 246.136 9.766 8.748 271 HA TRP 32 HA TRP 32 243.925 9.231 6.909 272 1HB TRP 32 HB2 TRP 32 246.484 9.966 5.684 273 2HB TRP 32 HB1 TRP 32 244.883 10.653 5.450 274 HD1 TRP 32 HD1 TRP 32 247.780 10.881 8.018 275 HE1 TRP 32 HE1 TRP 32 247.816 13.275 8.955 276 HE3 TRP 32 HE3 TRP 32 243.668 12.754 5.628 277 HZ2 TRP 32 HZ2 TRP 32 246.315 15.649 8.706 278 HZ3 TRP 32 HZ3 TRP 32 243.039 15.098 6.033 279 HH2 TRP 32 HH2 TRP 32 244.335 16.515 7.538 280 H ASN 33 HN ASN 33 244.163 7.791 5.117 281 HA ASN 33 HA ASN 33 246.350 6.133 4.643 282 1HB ASN 33 HB2 ASN 33 245.443 3.991 5.641 283 2HB ASN 33 HB1 ASN 33 246.089 5.148 6.799 284 1HD2 ASN 33 HD21 ASN 33 244.854 5.719 8.448 285 2HD2 ASN 33 HD22 ASN 33 243.161 5.405 8.593 286 H GLY 34 HN GLY 34 245.936 4.530 3.046 287 1HA GLY 34 HA2 GLY 34 243.991 5.201 1.168 288 2HA GLY 34 HA1 GLY 34 244.862 3.676 1.206 289 H PHE 35 HN PHE 35 242.372 3.555 0.279 290 HA PHE 35 HA PHE 35 240.622 2.796 2.498 291 1HB PHE 35 HB2 PHE 35 239.755 2.621 -0.357 292 2HB PHE 35 HB1 PHE 35 238.822 3.040 1.069 293 HD1 PHE 35 HD1 PHE 35 239.088 5.306 2.085 294 HD2 PHE 35 HD2 PHE 35 240.777 4.280 -1.683 295 HE1 PHE 35 HE1 PHE 35 239.328 7.695 1.547 296 HE2 PHE 35 HE2 PHE 35 241.021 6.667 -2.228 297 HZ PHE 35 HZ PHE 35 240.295 8.378 -0.612 298 H GLY 36 HN GLY 36 241.247 0.821 3.211 299 1HA GLY 36 HA2 GLY 36 241.935 -1.262 1.312 300 2HA GLY 36 HA1 GLY 36 242.008 -1.383 3.063 301 H GLY 37 HN GLY 37 240.956 -3.330 1.251 302 1HA GLY 37 HA2 GLY 37 238.198 -3.437 2.280 303 2HA GLY 37 HA1 GLY 37 238.520 -3.779 0.585 304 H LYS 38 HN LYS 38 238.200 -5.903 0.324 305 HA LYS 38 HA LYS 38 239.988 -7.789 1.388 306 1HB LYS 38 HB2 LYS 38 238.674 -8.994 2.940 307 2HB LYS 38 HB1 LYS 38 238.536 -7.305 3.406 308 1HG LYS 38 HG2 LYS 38 236.384 -7.383 1.921 309 2HG LYS 38 HG1 LYS 38 236.495 -9.119 2.221 310 1HD LYS 38 HD2 LYS 38 236.882 -8.119 4.719 311 2HD LYS 38 HD1 LYS 38 235.776 -6.925 4.038 312 1HE LYS 38 HE2 LYS 38 234.423 -8.995 3.260 313 2HE LYS 38 HE1 LYS 38 235.362 -9.858 4.477 314 1HZ LYS 38 HZ1 LYS 38 233.732 -7.437 5.025 315 2HZ LYS 38 HZ2 LYS 38 234.529 -8.401 6.165 316 3HZ LYS 38 HZ3 LYS 38 233.213 -9.024 5.304 317 H VAL 39 HN VAL 39 239.961 -9.637 0.192 318 HA VAL 39 HA VAL 39 238.043 -9.734 -1.999 319 HB VAL 39 HB VAL 39 240.104 -11.858 -1.723 320 1HG1 VAL 39 HG11 VAL 39 240.319 -11.399 -4.156 321 2HG1 VAL 39 HG12 VAL 39 239.075 -10.160 -3.989 322 3HG1 VAL 39 HG13 VAL 39 238.687 -11.849 -3.660 323 1HG2 VAL 39 HG21 VAL 39 241.663 -10.294 -1.201 324 2HG2 VAL 39 HG22 VAL 39 240.729 -8.969 -1.893 325 3HG2 VAL 39 HG23 VAL 39 241.629 -10.057 -2.948 326 H GLN 40 HN GLN 40 236.131 -10.550 -1.323 327 HA GLN 40 HA GLN 40 235.697 -12.458 0.639 328 1HB GLN 40 HB2 GLN 40 234.049 -11.903 -1.833 329 2HB GLN 40 HB1 GLN 40 233.495 -12.824 -0.442 330 1HG GLN 40 HG2 GLN 40 233.462 -10.942 0.939 331 2HG GLN 40 HG1 GLN 40 234.469 -10.006 -0.164 332 1HE2 GLN 40 HE21 GLN 40 233.302 -8.381 -0.894 333 2HE2 GLN 40 HE22 GLN 40 231.688 -8.481 -1.502 334 H GLU 41 HN GLU 41 234.480 -14.624 0.019 335 HA GLU 41 HA GLU 41 236.446 -16.385 -0.949 336 1HB GLU 41 HB2 GLU 41 234.624 -18.094 -0.875 337 2HB GLU 41 HB1 GLU 41 234.810 -17.181 0.616 338 1HG GLU 41 HG2 GLU 41 232.885 -16.032 -1.261 339 2HG GLU 41 HG1 GLU 41 232.457 -17.636 -0.666 340 H GLY 42 HN GLY 42 237.013 -15.511 -3.016 341 1HA GLY 42 HA2 GLY 42 236.928 -16.296 -5.291 342 2HA GLY 42 HA1 GLY 42 235.184 -16.432 -5.132 343 H GLU 43 HN GLU 43 237.433 -13.766 -4.394 344 HA GLU 43 HA GLU 43 235.979 -12.117 -6.348 345 1HB GLU 43 HB2 GLU 43 236.027 -11.766 -3.554 346 2HB GLU 43 HB1 GLU 43 237.114 -10.547 -4.202 347 1HG GLU 43 HG2 GLU 43 235.446 -9.333 -5.030 348 2HG GLU 43 HG1 GLU 43 234.607 -10.746 -5.668 349 H THR 44 HN THR 44 237.331 -10.063 -6.795 350 HA THR 44 HA THR 44 240.119 -10.924 -7.155 351 HB THR 44 HB THR 44 240.174 -9.383 -9.079 352 HG1 THR 44 HG1 THR 44 238.408 -8.291 -9.703 353 1HG2 THR 44 HG21 THR 44 237.788 -10.885 -9.801 354 2HG2 THR 44 HG22 THR 44 239.027 -11.861 -9.014 355 3HG2 THR 44 HG23 THR 44 239.417 -10.949 -10.472 356 H ILE 45 HN ILE 45 241.754 -9.601 -6.523 357 HA ILE 45 HA ILE 45 241.377 -7.900 -4.393 358 HB ILE 45 HB ILE 45 243.680 -7.525 -6.283 359 1HG1 ILE 45 HG12 ILE 45 244.540 -9.372 -4.454 360 2HG1 ILE 45 HG11 ILE 45 242.898 -9.917 -4.782 361 1HG2 ILE 45 HG21 ILE 45 243.769 -5.979 -4.532 362 2HG2 ILE 45 HG22 ILE 45 244.854 -7.279 -4.038 363 3HG2 ILE 45 HG23 ILE 45 243.237 -7.169 -3.344 364 1HD1 ILE 45 HD11 ILE 45 244.250 -9.266 -7.230 365 2HD1 ILE 45 HD12 ILE 45 243.522 -10.787 -6.717 366 3HD1 ILE 45 HD13 ILE 45 245.190 -10.418 -6.283 367 H GLU 46 HN GLU 46 241.273 -7.160 -7.814 368 HA GLU 46 HA GLU 46 241.278 -4.305 -7.451 369 1HB GLU 46 HB2 GLU 46 241.865 -5.758 -9.579 370 2HB GLU 46 HB1 GLU 46 240.141 -5.612 -9.891 371 1HG GLU 46 HG2 GLU 46 240.321 -3.190 -9.859 372 2HG GLU 46 HG1 GLU 46 242.042 -3.313 -9.499 373 H ASP 47 HN ASP 47 238.954 -6.854 -7.357 374 HA ASP 47 HA ASP 47 236.686 -5.084 -7.676 375 1HB ASP 47 HB2 ASP 47 237.037 -8.030 -7.249 376 2HB ASP 47 HB1 ASP 47 235.485 -7.294 -6.865 377 H GLY 48 HN GLY 48 238.372 -6.831 -5.109 378 1HA GLY 48 HA2 GLY 48 236.550 -6.140 -3.031 379 2HA GLY 48 HA1 GLY 48 238.216 -6.665 -2.813 380 H ALA 49 HN ALA 49 239.396 -4.598 -4.381 381 HA ALA 49 HA ALA 49 239.536 -2.525 -2.404 382 1HB ALA 49 HB1 ALA 49 241.316 -3.506 -4.182 383 2HB ALA 49 HB2 ALA 49 241.459 -1.920 -3.425 384 3HB ALA 49 HB3 ALA 49 240.771 -2.066 -5.042 385 H ARG 50 HN ARG 50 238.257 -2.891 -5.669 386 HA ARG 50 HA ARG 50 237.472 -0.203 -6.008 387 1HB ARG 50 HB2 ARG 50 236.768 -2.788 -7.339 388 2HB ARG 50 HB1 ARG 50 235.826 -1.348 -7.702 389 1HG ARG 50 HG2 ARG 50 237.824 -0.199 -8.449 390 2HG ARG 50 HG1 ARG 50 238.809 -1.600 -8.026 391 1HD ARG 50 HD2 ARG 50 237.392 -2.930 -9.632 392 2HD ARG 50 HD1 ARG 50 236.703 -1.397 -10.166 393 HE ARG 50 HE ARG 50 239.489 -1.206 -10.301 394 1HH1 ARG 50 HH11 ARG 50 236.874 -2.920 -11.851 395 2HH1 ARG 50 HH12 ARG 50 237.704 -3.073 -13.364 396 1HH2 ARG 50 HH21 ARG 50 240.582 -1.406 -12.290 397 2HH2 ARG 50 HH22 ARG 50 239.809 -2.214 -13.612 398 H ARG 51 HN ARG 51 235.542 -3.095 -5.233 399 HA ARG 51 HA ARG 51 233.121 -1.771 -4.789 400 1HB ARG 51 HB2 ARG 51 233.839 -4.357 -4.888 401 2HB ARG 51 HB1 ARG 51 233.702 -4.172 -3.145 402 1HG ARG 51 HG2 ARG 51 231.559 -4.719 -3.519 403 2HG ARG 51 HG1 ARG 51 231.401 -3.010 -3.930 404 1HD ARG 51 HD2 ARG 51 232.226 -4.029 -6.298 405 2HD ARG 51 HD1 ARG 51 231.315 -5.393 -5.654 406 HE ARG 51 HE ARG 51 229.639 -3.303 -5.284 407 1HH1 ARG 51 HH11 ARG 51 231.387 -4.498 -8.059 408 2HH1 ARG 51 HH12 ARG 51 230.204 -3.947 -9.197 409 1HH2 ARG 51 HH21 ARG 51 228.082 -2.580 -6.779 410 2HH2 ARG 51 HH22 ARG 51 228.327 -2.857 -8.471 411 H GLU 52 HN GLU 52 235.818 -2.403 -2.626 412 HA GLU 52 HA GLU 52 234.403 -1.372 -0.322 413 1HB GLU 52 HB2 GLU 52 237.274 -2.241 -0.691 414 2HB GLU 52 HB1 GLU 52 236.591 -1.706 0.838 415 1HG GLU 52 HG2 GLU 52 235.077 -3.837 -0.475 416 2HG GLU 52 HG1 GLU 52 236.716 -4.286 -0.008 417 H LEU 53 HN LEU 53 236.397 -0.171 -2.838 418 HA LEU 53 HA LEU 53 237.466 2.088 -1.493 419 1HB LEU 53 HB2 LEU 53 238.595 1.438 -3.442 420 2HB LEU 53 HB1 LEU 53 237.113 1.315 -4.371 421 HG LEU 53 HG LEU 53 236.894 3.757 -4.339 422 1HD1 LEU 53 HD11 LEU 53 238.452 3.690 -2.151 423 2HD1 LEU 53 HD12 LEU 53 238.204 5.131 -3.135 424 3HD1 LEU 53 HD13 LEU 53 239.643 4.141 -3.369 425 1HD2 LEU 53 HD21 LEU 53 239.237 2.367 -5.501 426 2HD2 LEU 53 HD22 LEU 53 239.237 4.130 -5.559 427 3HD2 LEU 53 HD23 LEU 53 237.916 3.223 -6.296 428 H GLN 54 HN GLN 54 234.709 1.613 -3.664 429 HA GLN 54 HA GLN 54 233.827 4.286 -3.693 430 1HB GLN 54 HB2 GLN 54 232.869 3.024 -5.365 431 2HB GLN 54 HB1 GLN 54 232.599 1.640 -4.317 432 1HG GLN 54 HG2 GLN 54 230.735 2.777 -3.256 433 2HG GLN 54 HG1 GLN 54 231.026 4.207 -4.244 434 1HE2 GLN 54 HE21 GLN 54 229.448 4.368 -5.666 435 2HE2 GLN 54 HE22 GLN 54 228.815 3.085 -6.633 436 H GLU 55 HN GLU 55 233.440 1.728 -1.395 437 HA GLU 55 HA GLU 55 231.261 2.977 0.014 438 1HB GLU 55 HB2 GLU 55 232.865 0.486 0.355 439 2HB GLU 55 HB1 GLU 55 231.941 1.094 1.722 440 1HG GLU 55 HG2 GLU 55 230.619 0.758 -0.931 441 2HG GLU 55 HG1 GLU 55 230.894 -0.644 0.104 442 H GLU 56 HN GLU 56 234.714 3.111 0.185 443 HA GLU 56 HA GLU 56 234.809 3.869 2.940 444 1HB GLU 56 HB2 GLU 56 236.768 3.574 0.742 445 2HB GLU 56 HB1 GLU 56 237.211 4.651 2.061 446 1HG GLU 56 HG2 GLU 56 236.187 2.337 3.266 447 2HG GLU 56 HG1 GLU 56 237.234 1.787 1.959 448 H SER 57 HN SER 57 235.046 5.701 -0.113 449 HA SER 57 HA SER 57 234.467 8.113 1.466 450 1HB SER 57 HB2 SER 57 236.664 7.772 -0.572 451 2HB SER 57 HB1 SER 57 236.051 9.357 -0.099 452 HG SER 57 HG SER 57 236.521 8.569 2.135 453 H GLY 58 HN GLY 58 232.871 6.338 -0.352 454 1HA GLY 58 HA2 GLY 58 231.271 6.575 -1.978 455 2HA GLY 58 HA1 GLY 58 231.301 8.285 -1.574 456 H LEU 59 HN LEU 59 234.310 7.054 -2.609 457 HA LEU 59 HA LEU 59 233.934 8.351 -5.215 458 1HB LEU 59 HB2 LEU 59 236.418 7.777 -3.607 459 2HB LEU 59 HB1 LEU 59 236.446 8.388 -5.250 460 HG LEU 59 HG LEU 59 235.608 9.780 -2.736 461 1HD1 LEU 59 HD11 LEU 59 237.097 10.997 -5.002 462 2HD1 LEU 59 HD12 LEU 59 237.921 9.815 -3.987 463 3HD1 LEU 59 HD13 LEU 59 237.248 11.278 -3.268 464 1HD2 LEU 59 HD21 LEU 59 233.710 10.160 -4.135 465 2HD2 LEU 59 HD22 LEU 59 234.734 10.476 -5.535 466 3HD2 LEU 59 HD23 LEU 59 234.710 11.611 -4.187 467 H THR 60 HN THR 60 233.464 6.985 -6.752 468 HA THR 60 HA THR 60 234.497 4.254 -6.676 469 HB THR 60 HB THR 60 232.770 5.022 -8.926 470 HG1 THR 60 HG1 THR 60 231.365 6.058 -7.788 471 1HG2 THR 60 HG21 THR 60 233.270 2.734 -7.282 472 2HG2 THR 60 HG22 THR 60 232.401 2.844 -8.814 473 3HG2 THR 60 HG23 THR 60 231.546 3.101 -7.293 474 H VAL 61 HN VAL 61 235.957 3.468 -8.132 475 HA VAL 61 HA VAL 61 237.071 5.444 -9.998 476 HB VAL 61 HB VAL 61 239.123 4.157 -9.993 477 1HG1 VAL 61 HG11 VAL 61 239.124 5.799 -8.337 478 2HG1 VAL 61 HG12 VAL 61 239.627 4.338 -7.486 479 3HG1 VAL 61 HG13 VAL 61 237.970 4.922 -7.334 480 1HG2 VAL 61 HG21 VAL 61 238.918 2.348 -7.914 481 2HG2 VAL 61 HG22 VAL 61 238.965 1.960 -9.633 482 3HG2 VAL 61 HG23 VAL 61 237.415 2.125 -8.808 483 H ASP 62 HN ASP 62 237.319 5.035 -12.127 484 HA ASP 62 HA ASP 62 235.721 2.915 -13.246 485 1HB ASP 62 HB2 ASP 62 237.270 5.225 -14.383 486 2HB ASP 62 HB1 ASP 62 236.681 3.944 -15.438 487 H ALA 63 HN ALA 63 239.003 3.372 -12.374 488 HA ALA 63 HA ALA 63 239.762 0.750 -12.880 489 1HB ALA 63 HB1 ALA 63 240.141 2.595 -15.169 490 2HB ALA 63 HB2 ALA 63 239.821 0.861 -15.150 491 3HB ALA 63 HB3 ALA 63 241.444 1.462 -14.811 492 H LEU 64 HN LEU 64 240.825 0.930 -10.925 493 HA LEU 64 HA LEU 64 242.623 3.003 -10.223 494 1HB LEU 64 HB2 LEU 64 242.507 0.137 -9.264 495 2HB LEU 64 HB1 LEU 64 243.456 1.406 -8.517 496 HG LEU 64 HG LEU 64 240.807 2.365 -8.648 497 1HD1 LEU 64 HD11 LEU 64 241.025 -0.521 -7.892 498 2HD1 LEU 64 HD12 LEU 64 239.821 0.278 -8.903 499 3HD1 LEU 64 HD13 LEU 64 239.806 0.520 -7.156 500 1HD2 LEU 64 HD21 LEU 64 242.878 2.343 -6.885 501 2HD2 LEU 64 HD22 LEU 64 241.724 1.271 -6.091 502 3HD2 LEU 64 HD23 LEU 64 241.251 2.914 -6.522 503 H HIS 65 HN HIS 65 244.994 2.108 -9.544 504 HA HIS 65 HA HIS 65 246.137 0.675 -11.833 505 1HB HIS 65 HB2 HIS 65 246.408 3.444 -11.425 506 2HB HIS 65 HB1 HIS 65 247.944 2.741 -10.927 507 HD1 HIS 65 HD1 HIS 65 249.562 2.324 -12.755 508 HD2 HIS 65 HD2 HIS 65 245.659 2.561 -14.161 509 HE1 HIS 65 HE1 HIS 65 249.740 2.183 -15.259 510 HE2 HIS 65 HE2 HIS 65 247.374 2.413 -16.092 511 H LYS 66 HN LYS 66 246.726 -1.157 -10.769 512 HA LYS 66 HA LYS 66 247.715 -1.232 -8.119 513 1HB LYS 66 HB2 LYS 66 248.633 -3.531 -8.907 514 2HB LYS 66 HB1 LYS 66 246.894 -3.290 -8.845 515 1HG LYS 66 HG2 LYS 66 246.719 -3.124 -11.173 516 2HG LYS 66 HG1 LYS 66 248.452 -2.860 -11.369 517 1HD LYS 66 HD2 LYS 66 248.946 -5.075 -11.189 518 2HD LYS 66 HD1 LYS 66 247.605 -5.396 -10.088 519 1HE LYS 66 HE2 LYS 66 247.194 -6.492 -12.199 520 2HE LYS 66 HE1 LYS 66 246.040 -5.177 -11.984 521 1HZ LYS 66 HZ1 LYS 66 247.115 -5.387 -14.243 522 2HZ LYS 66 HZ2 LYS 66 248.544 -4.837 -13.525 523 3HZ LYS 66 HZ3 LYS 66 247.169 -3.852 -13.532 524 H VAL 67 HN VAL 67 249.661 -0.620 -7.362 525 HA VAL 67 HA VAL 67 251.871 -0.535 -9.319 526 HB VAL 67 HB VAL 67 252.790 1.355 -7.966 527 1HG1 VAL 67 HG11 VAL 67 251.285 3.035 -8.942 528 2HG1 VAL 67 HG12 VAL 67 250.096 1.773 -9.260 529 3HG1 VAL 67 HG13 VAL 67 251.654 1.742 -10.083 530 1HG2 VAL 67 HG21 VAL 67 251.644 1.075 -5.893 531 2HG2 VAL 67 HG22 VAL 67 250.070 1.176 -6.682 532 3HG2 VAL 67 HG23 VAL 67 251.101 2.602 -6.587 533 H GLY 68 HN GLY 68 251.127 -0.838 -5.842 534 1HA GLY 68 HA2 GLY 68 253.569 -2.488 -5.631 535 2HA GLY 68 HA1 GLY 68 253.146 -1.306 -4.404 536 H GLN 69 HN GLN 69 253.224 -4.477 -4.965 537 HA GLN 69 HA GLN 69 250.749 -5.071 -3.491 538 1HB GLN 69 HB2 GLN 69 252.612 -6.903 -5.020 539 2HB GLN 69 HB1 GLN 69 251.180 -7.430 -4.147 540 1HG GLN 69 HG2 GLN 69 250.381 -7.302 -6.285 541 2HG GLN 69 HG1 GLN 69 249.958 -5.706 -5.667 542 1HE2 GLN 69 HE21 GLN 69 249.931 -5.642 -8.192 543 2HE2 GLN 69 HE22 GLN 69 251.371 -5.011 -8.908 544 H ILE 70 HN ILE 70 251.017 -5.169 -1.347 545 HA ILE 70 HA ILE 70 253.632 -6.049 -0.324 546 HB ILE 70 HB ILE 70 251.527 -4.467 1.141 547 1HG1 ILE 70 HG12 ILE 70 254.134 -3.385 0.105 548 2HG1 ILE 70 HG11 ILE 70 252.681 -3.369 -0.889 549 1HG2 ILE 70 HG21 ILE 70 252.749 -5.352 2.843 550 2HG2 ILE 70 HG22 ILE 70 253.766 -3.959 2.472 551 3HG2 ILE 70 HG23 ILE 70 254.191 -5.553 1.848 552 1HD1 ILE 70 HD11 ILE 70 253.359 -1.780 1.511 553 2HD1 ILE 70 HD12 ILE 70 251.670 -2.227 1.274 554 3HD1 ILE 70 HD13 ILE 70 252.522 -1.308 0.033 555 H VAL 71 HN VAL 71 253.764 -7.454 1.404 556 HA VAL 71 HA VAL 71 251.342 -9.013 2.007 557 HB VAL 71 HB VAL 71 254.140 -10.094 1.614 558 1HG1 VAL 71 HG11 VAL 71 252.711 -12.293 1.687 559 2HG1 VAL 71 HG12 VAL 71 251.617 -11.294 2.642 560 3HG1 VAL 71 HG13 VAL 71 253.280 -11.535 3.174 561 1HG2 VAL 71 HG21 VAL 71 251.765 -9.905 -0.147 562 2HG2 VAL 71 HG22 VAL 71 252.692 -11.404 -0.198 563 3HG2 VAL 71 HG23 VAL 71 253.483 -9.867 -0.548 564 H PHE 72 HN PHE 72 251.195 -9.838 4.118 565 HA PHE 72 HA PHE 72 253.175 -8.762 6.012 566 1HB PHE 72 HB2 PHE 72 250.174 -8.912 6.332 567 2HB PHE 72 HB1 PHE 72 251.290 -8.481 7.624 568 HD1 PHE 72 HD1 PHE 72 251.484 -6.248 8.064 569 HD2 PHE 72 HD2 PHE 72 250.654 -7.482 4.078 570 HE1 PHE 72 HE1 PHE 72 251.397 -3.893 7.357 571 HE2 PHE 72 HE2 PHE 72 250.568 -5.130 3.364 572 HZ PHE 72 HZ PHE 72 250.939 -3.332 5.004 573 H GLU 73 HN GLU 73 254.216 -10.315 7.027 574 HA GLU 73 HA GLU 73 252.906 -12.923 7.367 575 1HB GLU 73 HB2 GLU 73 255.837 -12.201 7.538 576 2HB GLU 73 HB1 GLU 73 255.171 -13.820 7.695 577 1HG GLU 73 HG2 GLU 73 254.466 -12.367 5.233 578 2HG GLU 73 HG1 GLU 73 256.159 -12.823 5.411 579 H PHE 74 HN PHE 74 252.213 -13.478 9.324 580 HA PHE 74 HA PHE 74 252.852 -11.793 11.588 581 1HB PHE 74 HB2 PHE 74 250.913 -14.003 11.056 582 2HB PHE 74 HB1 PHE 74 251.328 -13.633 12.728 583 HD1 PHE 74 HD1 PHE 74 250.861 -11.380 9.801 584 HD2 PHE 74 HD2 PHE 74 249.479 -12.596 13.639 585 HE1 PHE 74 HE1 PHE 74 249.229 -9.538 9.794 586 HE2 PHE 74 HE2 PHE 74 247.845 -10.757 13.638 587 HZ PHE 74 HZ PHE 74 247.718 -9.225 11.714 588 H VAL 75 HN VAL 75 254.133 -12.206 13.227 589 HA VAL 75 HA VAL 75 255.963 -14.414 12.981 590 HB VAL 75 HB VAL 75 256.111 -12.864 15.462 591 1HG1 VAL 75 HG11 VAL 75 258.455 -12.511 14.364 592 2HG1 VAL 75 HG12 VAL 75 257.905 -13.782 13.272 593 3HG1 VAL 75 HG13 VAL 75 257.998 -14.089 15.007 594 1HG2 VAL 75 HG21 VAL 75 257.160 -10.928 14.002 595 2HG2 VAL 75 HG22 VAL 75 255.453 -10.930 14.444 596 3HG2 VAL 75 HG23 VAL 75 255.950 -11.472 12.841 597 H GLY 76 HN GLY 76 255.298 -16.359 13.599 598 1HA GLY 76 HA2 GLY 76 255.005 -17.870 15.447 599 2HA GLY 76 HA1 GLY 76 254.102 -16.610 16.279 600 H GLU 77 HN GLU 77 252.736 -16.045 13.599 601 HA GLU 77 HA GLU 77 250.702 -18.142 13.903 602 1HB GLU 77 HB2 GLU 77 250.467 -15.434 12.579 603 2HB GLU 77 HB1 GLU 77 249.154 -16.570 12.857 604 1HG GLU 77 HG2 GLU 77 250.094 -16.279 15.369 605 2HG GLU 77 HG1 GLU 77 250.455 -14.689 14.698 606 HA PRO 78 HA PRO 78 251.734 -19.768 9.924 607 1HB PRO 78 HB2 PRO 78 249.445 -21.078 9.334 608 2HB PRO 78 HB1 PRO 78 250.571 -21.643 10.573 609 1HG PRO 78 HG2 PRO 78 248.014 -20.124 10.887 610 2HG PRO 78 HG1 PRO 78 248.636 -21.480 11.845 611 1HD PRO 78 HD2 PRO 78 248.805 -18.879 12.644 612 2HD PRO 78 HD1 PRO 78 249.975 -20.125 13.123 613 H GLU 79 HN GLU 79 248.450 -18.377 10.105 614 HA GLU 79 HA GLU 79 248.178 -17.878 7.362 615 1HB GLU 79 HB2 GLU 79 246.594 -17.587 9.623 616 2HB GLU 79 HB1 GLU 79 246.787 -15.942 9.033 617 1HG GLU 79 HG2 GLU 79 245.987 -16.637 6.834 618 2HG GLU 79 HG1 GLU 79 245.789 -18.284 7.430 619 H LEU 80 HN LEU 80 247.906 -15.655 6.426 620 HA LEU 80 HA LEU 80 249.752 -13.661 7.499 621 1HB LEU 80 HB2 LEU 80 249.992 -14.123 4.588 622 2HB LEU 80 HB1 LEU 80 251.209 -13.639 5.752 623 HG LEU 80 HG LEU 80 250.198 -16.449 5.779 624 1HD1 LEU 80 HD11 LEU 80 250.719 -16.463 3.551 625 2HD1 LEU 80 HD12 LEU 80 252.293 -16.832 4.254 626 3HD1 LEU 80 HD13 LEU 80 251.931 -15.193 3.713 627 1HD2 LEU 80 HD21 LEU 80 252.464 -14.914 6.847 628 2HD2 LEU 80 HD22 LEU 80 252.869 -16.508 6.211 629 3HD2 LEU 80 HD23 LEU 80 251.661 -16.348 7.485 630 H MET 81 HN MET 81 249.746 -11.920 5.340 631 HA MET 81 HA MET 81 246.970 -11.527 4.574 632 1HB MET 81 HB2 MET 81 247.709 -10.335 6.854 633 2HB MET 81 HB1 MET 81 248.287 -9.124 5.718 634 1HG MET 81 HG2 MET 81 245.958 -9.198 4.701 635 2HG MET 81 HG1 MET 81 245.482 -10.093 6.143 636 1HE MET 81 HE1 MET 81 247.573 -7.299 4.953 637 2HE MET 81 HE2 MET 81 247.630 -6.143 6.283 638 3HE MET 81 HE3 MET 81 246.336 -6.050 5.088 639 H ASP 82 HN ASP 82 247.125 -11.302 2.436 640 HA ASP 82 HA ASP 82 249.409 -9.820 1.328 641 1HB ASP 82 HB2 ASP 82 248.968 -12.136 0.489 642 2HB ASP 82 HB1 ASP 82 247.417 -11.575 -0.130 643 H VAL 83 HN VAL 83 248.882 -7.689 1.295 644 HA VAL 83 HA VAL 83 246.247 -6.965 0.193 645 HB VAL 83 HB VAL 83 246.614 -6.209 2.507 646 1HG1 VAL 83 HG11 VAL 83 249.189 -5.766 1.777 647 2HG1 VAL 83 HG12 VAL 83 248.430 -5.099 3.223 648 3HG1 VAL 83 HG13 VAL 83 248.540 -4.126 1.757 649 1HG2 VAL 83 HG21 VAL 83 246.094 -4.409 0.241 650 2HG2 VAL 83 HG22 VAL 83 246.459 -3.609 1.769 651 3HG2 VAL 83 HG23 VAL 83 245.119 -4.751 1.670 652 H HIS 84 HN HIS 84 246.283 -6.269 -1.809 653 HA HIS 84 HA HIS 84 248.711 -5.334 -3.054 654 1HB HIS 84 HB2 HIS 84 245.865 -5.583 -4.049 655 2HB HIS 84 HB1 HIS 84 247.191 -4.992 -5.046 656 HD1 HIS 84 HD1 HIS 84 248.112 -7.740 -2.787 657 HD2 HIS 84 HD2 HIS 84 246.672 -7.324 -6.662 658 HE1 HIS 84 HE1 HIS 84 248.486 -9.971 -3.885 659 HE2 HIS 84 HE2 HIS 84 247.522 -9.722 -6.200 660 H VAL 85 HN VAL 85 248.975 -3.197 -3.990 661 HA VAL 85 HA VAL 85 247.301 -1.193 -2.622 662 HB VAL 85 HB VAL 85 250.134 -0.689 -3.507 663 1HG1 VAL 85 HG11 VAL 85 249.324 1.371 -3.087 664 2HG1 VAL 85 HG12 VAL 85 249.644 0.923 -1.410 665 3HG1 VAL 85 HG13 VAL 85 248.016 0.768 -2.069 666 1HG2 VAL 85 HG21 VAL 85 250.977 -1.779 -1.754 667 2HG2 VAL 85 HG22 VAL 85 249.378 -2.457 -1.458 668 3HG2 VAL 85 HG23 VAL 85 249.865 -0.966 -0.654 669 H PHE 86 HN PHE 86 245.909 -0.512 -4.070 670 HA PHE 86 HA PHE 86 246.732 -0.060 -6.840 671 1HB PHE 86 HB2 PHE 86 244.220 -0.703 -5.436 672 2HB PHE 86 HB1 PHE 86 244.037 0.502 -6.704 673 HD1 PHE 86 HD1 PHE 86 244.338 -2.968 -5.946 674 HD2 PHE 86 HD2 PHE 86 244.880 -0.091 -9.032 675 HE1 PHE 86 HE1 PHE 86 244.256 -4.762 -7.627 676 HE2 PHE 86 HE2 PHE 86 244.799 -1.880 -10.720 677 HZ PHE 86 HZ PHE 86 244.485 -4.220 -10.018 678 H CYS 87 HN CYS 87 246.844 1.930 -7.736 679 HA CYS 87 HA CYS 87 245.980 4.212 -6.073 680 1HB CYS 87 HB2 CYS 87 247.748 5.543 -7.147 681 2HB CYS 87 HB1 CYS 87 248.434 4.149 -6.322 682 HG CYS 87 HG CYS 87 249.421 4.580 -8.797 683 H THR 88 HN THR 88 244.217 5.137 -6.936 684 HA THR 88 HA THR 88 243.705 4.738 -9.788 685 HB THR 88 HB THR 88 242.050 4.123 -7.927 686 HG1 THR 88 HG1 THR 88 240.615 5.660 -9.671 687 1HG2 THR 88 HG21 THR 88 240.844 6.770 -8.151 688 2HG2 THR 88 HG22 THR 88 242.284 6.686 -7.137 689 3HG2 THR 88 HG23 THR 88 240.902 5.647 -6.792 690 H ASP 89 HN ASP 89 242.052 6.697 -10.463 691 HA ASP 89 HA ASP 89 242.972 9.304 -9.711 692 1HB ASP 89 HB2 ASP 89 244.152 7.946 -12.019 693 2HB ASP 89 HB1 ASP 89 243.426 9.495 -12.438 694 H SER 90 HN SER 90 241.301 7.318 -12.095 695 HA SER 90 HA SER 90 239.406 9.415 -12.709 696 1HB SER 90 HB2 SER 90 240.370 7.248 -14.123 697 2HB SER 90 HB1 SER 90 238.762 6.706 -13.642 698 HG SER 90 HG SER 90 239.489 8.590 -15.474 699 H ILE 91 HN ILE 91 238.133 9.830 -10.954 700 HA ILE 91 HA ILE 91 236.807 7.554 -9.659 701 HB ILE 91 HB ILE 91 236.190 9.074 -7.852 702 1HG1 ILE 91 HG12 ILE 91 237.788 11.201 -9.295 703 2HG1 ILE 91 HG11 ILE 91 236.029 11.118 -9.321 704 1HG2 ILE 91 HG21 ILE 91 238.159 8.151 -7.225 705 2HG2 ILE 91 HG22 ILE 91 238.711 9.821 -7.357 706 3HG2 ILE 91 HG23 ILE 91 239.004 8.688 -8.677 707 1HD1 ILE 91 HD11 ILE 91 236.084 11.272 -6.820 708 2HD1 ILE 91 HD12 ILE 91 236.644 12.709 -7.677 709 3HD1 ILE 91 HD13 ILE 91 237.812 11.604 -6.951 710 H GLN 92 HN GLN 92 234.503 8.335 -8.776 711 HA GLN 92 HA GLN 92 233.055 9.642 -10.967 712 1HB GLN 92 HB2 GLN 92 232.519 6.933 -9.780 713 2HB GLN 92 HB1 GLN 92 231.259 7.847 -10.598 714 1HG GLN 92 HG2 GLN 92 233.386 7.920 -12.363 715 2HG GLN 92 HG1 GLN 92 233.435 6.289 -11.696 716 1HE2 GLN 92 HE21 GLN 92 231.766 4.875 -12.116 717 2HE2 GLN 92 HE22 GLN 92 230.559 5.181 -13.312 718 H GLY 93 HN GLY 93 232.281 8.027 -7.889 719 1HA GLY 93 HA2 GLY 93 230.155 9.685 -7.194 720 2HA GLY 93 HA1 GLY 93 231.101 8.740 -6.059 721 H THR 94 HN THR 94 230.631 10.573 -4.623 722 HA THR 94 HA THR 94 232.511 12.788 -5.051 723 HB THR 94 HB THR 94 230.264 13.242 -3.215 724 HG1 THR 94 HG1 THR 94 229.049 12.233 -4.721 725 1HG2 THR 94 HG21 THR 94 231.939 14.797 -4.991 726 2HG2 THR 94 HG22 THR 94 231.014 15.298 -3.576 727 3HG2 THR 94 HG23 THR 94 230.230 15.197 -5.152 728 HA PRO 95 HA PRO 95 234.452 11.864 -1.235 729 1HB PRO 95 HB2 PRO 95 234.510 14.697 -0.475 730 2HB PRO 95 HB1 PRO 95 235.852 13.631 -0.898 731 1HG PRO 95 HG2 PRO 95 235.053 15.628 -2.506 732 2HG PRO 95 HG1 PRO 95 235.693 14.101 -3.139 733 1HD PRO 95 HD2 PRO 95 232.848 15.006 -2.896 734 2HD PRO 95 HD1 PRO 95 233.652 14.174 -4.246 735 H VAL 96 HN VAL 96 232.022 11.238 -0.940 736 HA VAL 96 HA VAL 96 230.524 12.829 0.918 737 HB VAL 96 HB VAL 96 230.043 9.898 0.459 738 1HG1 VAL 96 HG11 VAL 96 227.878 11.910 0.555 739 2HG1 VAL 96 HG12 VAL 96 228.762 11.614 2.051 740 3HG1 VAL 96 HG13 VAL 96 227.949 10.283 1.230 741 1HG2 VAL 96 HG21 VAL 96 228.471 10.904 -1.421 742 2HG2 VAL 96 HG22 VAL 96 230.136 10.427 -1.757 743 3HG2 VAL 96 HG23 VAL 96 229.743 12.124 -1.484 744 H GLU 97 HN GLU 97 232.698 12.838 2.209 745 HA GLU 97 HA GLU 97 233.628 10.798 3.771 746 1HB GLU 97 HB2 GLU 97 234.381 12.458 5.345 747 2HB GLU 97 HB1 GLU 97 234.516 13.125 3.724 748 1HG GLU 97 HG2 GLU 97 232.087 14.029 4.336 749 2HG GLU 97 HG1 GLU 97 232.760 13.916 5.962 750 H SER 98 HN SER 98 232.559 9.368 4.966 751 HA SER 98 HA SER 98 230.015 10.062 6.177 752 1HB SER 98 HB2 SER 98 231.484 7.549 5.586 753 2HB SER 98 HB1 SER 98 230.400 7.523 6.977 754 HG SER 98 HG SER 98 228.797 7.428 5.640 755 H ASP 99 HN ASP 99 229.807 8.754 8.451 756 HA ASP 99 HA ASP 99 231.321 10.324 10.280 757 1HB ASP 99 HB2 ASP 99 229.520 7.960 10.841 758 2HB ASP 99 HB1 ASP 99 230.076 9.144 12.019 759 H GLU 100 HN GLU 100 232.037 7.454 8.677 760 HA GLU 100 HA GLU 100 233.877 6.590 10.801 761 1HB GLU 100 HB2 GLU 100 232.203 5.159 8.926 762 2HB GLU 100 HB1 GLU 100 233.880 4.657 8.771 763 1HG GLU 100 HG2 GLU 100 233.968 3.813 10.907 764 2HG GLU 100 HG1 GLU 100 232.650 4.835 11.479 765 H MET 101 HN MET 101 233.670 7.470 7.396 766 HA MET 101 HA MET 101 236.613 7.460 7.273 767 1HB MET 101 HB2 MET 101 234.727 6.329 5.533 768 2HB MET 101 HB1 MET 101 235.339 7.748 4.695 769 1HG MET 101 HG2 MET 101 236.597 5.716 4.156 770 2HG MET 101 HG1 MET 101 237.602 6.954 4.906 771 1HE MET 101 HE1 MET 101 239.400 6.017 5.691 772 2HE MET 101 HE2 MET 101 239.605 4.717 6.865 773 3HE MET 101 HE3 MET 101 239.045 6.304 7.395 774 H ARG 102 HN ARG 102 237.597 9.154 5.918 775 HA ARG 102 HA ARG 102 236.140 11.538 5.323 776 1HB ARG 102 HB2 ARG 102 236.304 11.706 7.798 777 2HB ARG 102 HB1 ARG 102 238.055 11.621 7.668 778 1HG ARG 102 HG2 ARG 102 237.760 13.686 6.103 779 2HG ARG 102 HG1 ARG 102 236.205 13.838 6.924 780 1HD ARG 102 HD2 ARG 102 237.569 13.640 9.095 781 2HD ARG 102 HD1 ARG 102 238.970 13.986 8.081 782 HE ARG 102 HE ARG 102 236.821 15.871 7.771 783 1HH1 ARG 102 HH11 ARG 102 239.662 15.048 9.625 784 2HH1 ARG 102 HH12 ARG 102 239.943 16.673 10.151 785 1HH2 ARG 102 HH21 ARG 102 237.189 18.009 8.464 786 2HH2 ARG 102 HH22 ARG 102 238.538 18.355 9.493 787 HA PRO 103 HA PRO 103 239.987 11.038 2.889 788 1HB PRO 103 HB2 PRO 103 239.020 12.079 0.600 789 2HB PRO 103 HB1 PRO 103 238.683 10.414 1.091 790 1HG PRO 103 HG2 PRO 103 236.975 12.860 1.390 791 2HG PRO 103 HG1 PRO 103 236.517 11.243 0.820 792 1HD PRO 103 HD2 PRO 103 236.047 12.068 3.355 793 2HD PRO 103 HD1 PRO 103 236.415 10.378 2.964 794 H CYS 104 HN CYS 104 241.489 12.539 2.084 795 HA CYS 104 HA CYS 104 240.831 15.376 2.374 796 1HB CYS 104 HB2 CYS 104 241.849 14.694 4.503 797 2HB CYS 104 HB1 CYS 104 243.243 14.055 3.638 798 HG CYS 104 HG CYS 104 242.800 16.952 4.382 799 H TRP 105 HN TRP 105 241.365 16.376 0.566 800 HA TRP 105 HA TRP 105 243.184 15.139 -1.311 801 1HB TRP 105 HB2 TRP 105 241.601 17.713 -1.491 802 2HB TRP 105 HB1 TRP 105 242.510 16.986 -2.812 803 HD1 TRP 105 HD1 TRP 105 239.873 15.499 -0.358 804 HE1 TRP 105 HE1 TRP 105 238.117 14.233 -1.758 805 HE3 TRP 105 HE3 TRP 105 241.731 16.448 -5.026 806 HZ2 TRP 105 HZ2 TRP 105 237.593 13.718 -4.484 807 HZ3 TRP 105 HZ3 TRP 105 240.542 15.534 -6.977 808 HH2 TRP 105 HH2 TRP 105 238.516 14.197 -6.709 809 H PHE 106 HN PHE 106 245.295 15.471 -1.249 810 HA PHE 106 HA PHE 106 246.297 18.105 -0.386 811 1HB PHE 106 HB2 PHE 106 247.003 15.384 0.580 812 2HB PHE 106 HB1 PHE 106 248.333 16.515 0.374 813 HD1 PHE 106 HD1 PHE 106 247.100 19.053 1.167 814 HD2 PHE 106 HD2 PHE 106 246.728 15.166 2.858 815 HE1 PHE 106 HE1 PHE 106 246.580 20.059 3.351 816 HE2 PHE 106 HE2 PHE 106 246.204 16.164 5.046 817 HZ PHE 106 HZ PHE 106 246.130 18.613 5.295 818 H GLN 107 HN GLN 107 248.988 17.703 -0.861 819 HA GLN 107 HA GLN 107 248.993 17.542 -3.774 820 1HB GLN 107 HB2 GLN 107 250.551 18.975 -1.751 821 2HB GLN 107 HB1 GLN 107 251.539 18.283 -3.031 822 1HG GLN 107 HG2 GLN 107 250.835 20.614 -3.457 823 2HG GLN 107 HG1 GLN 107 250.328 19.479 -4.707 824 1HE2 GLN 107 HE21 GLN 107 248.731 20.976 -5.351 825 2HE2 GLN 107 HE22 GLN 107 247.262 21.153 -4.457 826 H LEU 108 HN LEU 108 250.588 16.339 -4.917 827 HA LEU 108 HA LEU 108 250.987 13.724 -3.910 828 1HB LEU 108 HB2 LEU 108 251.940 13.214 -5.993 829 2HB LEU 108 HB1 LEU 108 250.750 14.453 -6.339 830 HG LEU 108 HG LEU 108 253.735 14.865 -6.147 831 1HD1 LEU 108 HD11 LEU 108 253.655 14.079 -8.239 832 2HD1 LEU 108 HD12 LEU 108 252.931 15.636 -8.638 833 3HD1 LEU 108 HD13 LEU 108 251.902 14.237 -8.336 834 1HD2 LEU 108 HD21 LEU 108 253.254 17.144 -6.921 835 2HD2 LEU 108 HD22 LEU 108 252.542 16.821 -5.341 836 3HD2 LEU 108 HD23 LEU 108 251.527 16.819 -6.782 837 H ASP 109 HN ASP 109 252.723 16.548 -3.374 838 HA ASP 109 HA ASP 109 255.099 15.004 -2.586 839 1HB ASP 109 HB2 ASP 109 255.160 16.990 -4.377 840 2HB ASP 109 HB1 ASP 109 255.263 17.962 -2.913 841 H GLN 110 HN GLN 110 252.493 15.669 -1.191 842 HA GLN 110 HA GLN 110 253.737 16.703 1.236 843 1HB GLN 110 HB2 GLN 110 251.263 17.742 -0.095 844 2HB GLN 110 HB1 GLN 110 251.446 17.866 1.650 845 1HG GLN 110 HG2 GLN 110 253.250 19.318 1.485 846 2HG GLN 110 HG1 GLN 110 253.579 18.872 -0.189 847 1HE2 GLN 110 HE21 GLN 110 250.963 20.249 1.776 848 2HE2 GLN 110 HE22 GLN 110 250.498 21.449 0.623 849 H ILE 111 HN ILE 111 252.595 14.054 0.070 850 HA ILE 111 HA ILE 111 250.457 13.429 1.885 851 HB ILE 111 HB ILE 111 251.813 11.014 1.178 852 1HG1 ILE 111 HG12 ILE 111 251.384 11.145 -1.312 853 2HG1 ILE 111 HG11 ILE 111 251.329 12.900 -1.126 854 1HG2 ILE 111 HG21 ILE 111 249.276 11.889 1.542 855 2HG2 ILE 111 HG22 ILE 111 249.739 10.306 0.920 856 3HG2 ILE 111 HG23 ILE 111 249.324 11.606 -0.198 857 1HD1 ILE 111 HD11 ILE 111 253.521 12.876 -1.461 858 2HD1 ILE 111 HD12 ILE 111 253.589 11.120 -1.313 859 3HD1 ILE 111 HD13 ILE 111 253.680 12.131 0.129 860 HA PRO 112 HA PRO 112 253.204 12.532 5.264 861 1HB PRO 112 HB2 PRO 112 251.405 12.579 7.214 862 2HB PRO 112 HB1 PRO 112 251.763 14.054 6.304 863 1HG PRO 112 HG2 PRO 112 249.425 12.210 6.079 864 2HG PRO 112 HG1 PRO 112 249.480 13.973 5.925 865 1HD PRO 112 HD2 PRO 112 249.493 12.105 3.819 866 2HD PRO 112 HD1 PRO 112 249.847 13.839 3.695 867 H PHE 113 HN PHE 113 253.883 10.463 4.781 868 HA PHE 113 HA PHE 113 252.243 8.164 5.090 869 1HB PHE 113 HB2 PHE 113 255.238 8.098 5.273 870 2HB PHE 113 HB1 PHE 113 254.149 6.891 4.609 871 HD1 PHE 113 HD1 PHE 113 256.505 7.574 3.178 872 HD2 PHE 113 HD2 PHE 113 252.720 9.548 3.131 873 HE1 PHE 113 HE1 PHE 113 256.974 8.402 0.917 874 HE2 PHE 113 HE2 PHE 113 253.198 10.360 0.863 875 HZ PHE 113 HZ PHE 113 255.317 9.803 -0.245 876 H LYS 114 HN LYS 114 253.933 10.150 7.316 877 HA LYS 114 HA LYS 114 254.444 8.193 9.316 878 1HB LYS 114 HB2 LYS 114 255.402 10.632 8.991 879 2HB LYS 114 HB1 LYS 114 254.024 11.078 9.987 880 1HG LYS 114 HG2 LYS 114 254.860 10.062 11.851 881 2HG LYS 114 HG1 LYS 114 255.775 8.870 10.926 882 1HD LYS 114 HD2 LYS 114 257.476 10.208 11.693 883 2HD LYS 114 HD1 LYS 114 257.127 10.983 10.147 884 1HE LYS 114 HE2 LYS 114 255.999 12.757 11.151 885 2HE LYS 114 HE1 LYS 114 255.750 11.870 12.655 886 1HZ LYS 114 HZ1 LYS 114 257.787 12.408 13.416 887 2HZ LYS 114 HZ2 LYS 114 257.625 13.715 12.354 888 3HZ LYS 114 HZ3 LYS 114 258.514 12.354 11.889 889 H ASP 115 HN ASP 115 251.742 10.167 8.400 890 HA ASP 115 HA ASP 115 250.278 9.364 10.790 891 1HB ASP 115 HB2 ASP 115 249.722 11.432 8.667 892 2HB ASP 115 HB1 ASP 115 248.524 10.967 9.871 893 H MET 116 HN MET 116 250.975 7.503 8.670 894 HA MET 116 HA MET 116 248.265 6.691 7.878 895 1HB MET 116 HB2 MET 116 250.728 6.932 6.224 896 2HB MET 116 HB1 MET 116 249.660 5.574 5.900 897 1HG MET 116 HG2 MET 116 248.134 6.855 4.908 898 2HG MET 116 HG1 MET 116 248.262 8.119 6.128 899 1HE MET 116 HE1 MET 116 249.492 6.569 2.934 900 2HE MET 116 HE2 MET 116 251.153 6.757 3.496 901 3HE MET 116 HE3 MET 116 250.547 7.770 2.187 902 H TRP 117 HN TRP 117 251.427 5.149 7.441 903 HA TRP 117 HA TRP 117 251.000 3.260 9.552 904 1HB TRP 117 HB2 TRP 117 250.056 2.649 6.872 905 2HB TRP 117 HB1 TRP 117 251.260 1.485 7.411 906 HD1 TRP 117 HD1 TRP 117 250.126 1.863 10.582 907 HE1 TRP 117 HE1 TRP 117 248.038 0.486 11.186 908 HE3 TRP 117 HE3 TRP 117 248.402 0.888 5.868 909 HZ2 TRP 117 HZ2 TRP 117 245.938 -0.838 9.845 910 HZ3 TRP 117 HZ3 TRP 117 246.347 -0.441 5.616 911 HH2 TRP 117 HH2 TRP 117 245.141 -1.286 7.564 912 HA PRO 118 HA PRO 118 255.349 2.676 9.013 913 1HB PRO 118 HB2 PRO 118 255.793 0.195 9.877 914 2HB PRO 118 HB1 PRO 118 255.127 1.430 10.950 915 1HG PRO 118 HG2 PRO 118 253.726 -0.794 9.527 916 2HG PRO 118 HG1 PRO 118 253.476 -0.181 11.169 917 1HD PRO 118 HD2 PRO 118 251.929 0.479 8.966 918 2HD PRO 118 HD1 PRO 118 252.034 1.427 10.461 919 H ASP 119 HN ASP 119 253.504 1.615 6.663 920 HA ASP 119 HA ASP 119 255.709 0.218 5.304 921 1HB ASP 119 HB2 ASP 119 253.992 -1.066 4.036 922 2HB ASP 119 HB1 ASP 119 253.989 -1.417 5.763 923 H ASP 120 HN ASP 120 253.237 2.633 5.206 924 HA ASP 120 HA ASP 120 252.772 3.187 2.602 925 1HB ASP 120 HB2 ASP 120 253.303 5.113 4.850 926 2HB ASP 120 HB1 ASP 120 252.682 5.608 3.276 927 H SER 121 HN SER 121 255.515 4.625 4.374 928 HA SER 121 HA SER 121 256.662 5.888 2.160 929 1HB SER 121 HB2 SER 121 258.407 4.855 4.358 930 2HB SER 121 HB1 SER 121 258.426 6.424 3.555 931 HG SER 121 HG SER 121 257.406 5.969 5.850 932 H TYR 122 HN TYR 122 256.626 2.547 2.940 933 HA TYR 122 HA TYR 122 259.052 1.947 1.507 934 1HB TYR 122 HB2 TYR 122 257.035 0.320 3.003 935 2HB TYR 122 HB1 TYR 122 258.174 -0.469 1.918 936 HD1 TYR 122 HD1 TYR 122 260.697 0.212 2.278 937 HD2 TYR 122 HD2 TYR 122 257.646 0.631 5.212 938 HE1 TYR 122 HE1 TYR 122 262.408 0.242 4.043 939 HE2 TYR 122 HE2 TYR 122 259.348 0.661 6.986 940 HH TYR 122 HH TYR 122 262.267 -0.420 6.753 941 H TRP 123 HN TRP 123 255.766 2.395 0.612 942 HA TRP 123 HA TRP 123 256.382 1.011 -1.899 943 1HB TRP 123 HB2 TRP 123 254.020 0.335 -2.107 944 2HB TRP 123 HB1 TRP 123 254.815 -0.369 -0.707 945 HD1 TRP 123 HD1 TRP 123 253.900 0.318 1.693 946 HE1 TRP 123 HE1 TRP 123 251.744 1.502 2.459 947 HE3 TRP 123 HE3 TRP 123 252.360 2.159 -2.799 948 HZ2 TRP 123 HZ2 TRP 123 249.654 3.039 1.291 949 HZ3 TRP 123 HZ3 TRP 123 250.277 3.467 -2.898 950 HH2 TRP 123 HH2 TRP 123 248.958 3.880 -0.899 951 H PHE 124 HN PHE 124 255.400 3.963 -0.537 952 HA PHE 124 HA PHE 124 253.884 4.920 -2.793 953 1HB PHE 124 HB2 PHE 124 254.311 5.776 -0.169 954 2HB PHE 124 HB1 PHE 124 255.108 6.999 -1.144 955 HD1 PHE 124 HD1 PHE 124 252.975 7.834 0.529 956 HD2 PHE 124 HD2 PHE 124 252.742 6.135 -3.361 957 HE1 PHE 124 HE1 PHE 124 250.824 8.931 0.195 958 HE2 PHE 124 HE2 PHE 124 250.569 7.227 -3.704 959 HZ PHE 124 HZ PHE 124 249.603 8.627 -1.922 960 HA PRO 125 HA PRO 125 258.122 7.478 -3.412 961 1HB PRO 125 HB2 PRO 125 259.829 5.174 -2.571 962 2HB PRO 125 HB1 PRO 125 260.142 6.910 -2.454 963 1HG PRO 125 HG2 PRO 125 259.394 5.545 -0.310 964 2HG PRO 125 HG1 PRO 125 258.751 7.170 -0.611 965 1HD PRO 125 HD2 PRO 125 257.430 4.516 -0.940 966 2HD PRO 125 HD1 PRO 125 256.733 6.073 -0.447 967 H LEU 126 HN LEU 126 258.121 3.928 -3.883 968 HA LEU 126 HA LEU 126 259.399 4.195 -6.450 969 1HB LEU 126 HB2 LEU 126 259.133 1.760 -6.597 970 2HB LEU 126 HB1 LEU 126 259.896 2.259 -5.100 971 HG LEU 126 HG LEU 126 257.366 2.129 -4.237 972 1HD1 LEU 126 HD11 LEU 126 256.832 1.347 -6.686 973 2HD1 LEU 126 HD12 LEU 126 256.023 0.613 -5.302 974 3HD1 LEU 126 HD13 LEU 126 257.377 -0.213 -6.072 975 1HD2 LEU 126 HD21 LEU 126 257.945 0.112 -3.194 976 2HD2 LEU 126 HD22 LEU 126 259.485 0.921 -3.481 977 3HD2 LEU 126 HD23 LEU 126 258.968 -0.392 -4.538 978 H LEU 127 HN LEU 127 256.146 3.715 -5.245 979 HA LEU 127 HA LEU 127 255.026 3.070 -7.781 980 1HB LEU 127 HB2 LEU 127 253.143 2.687 -6.650 981 2HB LEU 127 HB1 LEU 127 254.166 2.815 -5.243 982 HG LEU 127 HG LEU 127 253.497 5.315 -5.250 983 1HD1 LEU 127 HD11 LEU 127 251.885 6.031 -6.612 984 2HD1 LEU 127 HD12 LEU 127 250.924 4.570 -6.388 985 3HD1 LEU 127 HD13 LEU 127 252.231 4.593 -7.571 986 1HD2 LEU 127 HD21 LEU 127 251.558 3.111 -4.584 987 2HD2 LEU 127 HD22 LEU 127 251.444 4.771 -3.997 988 3HD2 LEU 127 HD23 LEU 127 252.818 3.767 -3.543 989 H LEU 128 HN LEU 128 255.705 6.023 -6.076 990 HA LEU 128 HA LEU 128 254.029 7.713 -7.649 991 1HB LEU 128 HB2 LEU 128 256.213 8.105 -5.665 992 2HB LEU 128 HB1 LEU 128 255.825 9.446 -6.725 993 HG LEU 128 HG LEU 128 253.780 8.056 -4.998 994 1HD1 LEU 128 HD11 LEU 128 255.042 8.987 -3.345 995 2HD1 LEU 128 HD12 LEU 128 254.051 10.381 -3.773 996 3HD1 LEU 128 HD13 LEU 128 255.695 10.244 -4.397 997 1HD2 LEU 128 HD21 LEU 128 252.816 10.506 -5.418 998 2HD2 LEU 128 HD22 LEU 128 252.503 9.160 -6.514 999 3HD2 LEU 128 HD23 LEU 128 253.766 10.332 -6.894 1000 H GLN 129 HN GLN 129 257.211 6.386 -8.020 1001 HA GLN 129 HA GLN 129 257.993 8.226 -10.104 1002 1HB GLN 129 HB2 GLN 129 259.258 5.709 -9.023 1003 2HB GLN 129 HB1 GLN 129 259.957 6.660 -10.325 1004 1HG GLN 129 HG2 GLN 129 260.631 8.316 -8.944 1005 2HG GLN 129 HG1 GLN 129 259.262 8.115 -7.852 1006 1HE2 GLN 129 HE21 GLN 129 260.955 8.373 -6.219 1007 2HE2 GLN 129 HE22 GLN 129 261.838 6.976 -5.714 1008 H LYS 130 HN LYS 130 255.781 5.852 -10.084 1009 HA LYS 130 HA LYS 130 254.633 4.869 -11.798 1010 1HB LYS 130 HB2 LYS 130 256.843 5.547 -13.723 1011 2HB LYS 130 HB1 LYS 130 255.141 5.270 -14.063 1012 1HG LYS 130 HG2 LYS 130 254.688 7.427 -13.856 1013 2HG LYS 130 HG1 LYS 130 255.432 7.483 -12.258 1014 1HD LYS 130 HD2 LYS 130 257.582 7.341 -14.013 1015 2HD LYS 130 HD1 LYS 130 256.439 8.426 -14.808 1016 1HE LYS 130 HE2 LYS 130 257.043 8.789 -11.907 1017 2HE LYS 130 HE1 LYS 130 258.196 9.362 -13.112 1018 1HZ LYS 130 HZ1 LYS 130 256.673 10.871 -13.963 1019 2HZ LYS 130 HZ2 LYS 130 256.407 10.968 -12.296 1020 3HZ LYS 130 HZ3 LYS 130 255.339 10.091 -13.272 1021 H LYS 131 HN LYS 131 256.627 3.612 -10.103 1022 HA LYS 131 HA LYS 131 257.487 1.411 -11.864 1023 1HB LYS 131 HB2 LYS 131 258.600 2.008 -9.125 1024 2HB LYS 131 HB1 LYS 131 259.273 0.950 -10.357 1025 1HG LYS 131 HG2 LYS 131 259.629 2.965 -11.786 1026 2HG LYS 131 HG1 LYS 131 259.135 3.954 -10.409 1027 1HD LYS 131 HD2 LYS 131 261.493 3.902 -10.342 1028 2HD LYS 131 HD1 LYS 131 260.958 2.776 -9.094 1029 1HE LYS 131 HE2 LYS 131 261.132 1.064 -11.122 1030 2HE LYS 131 HE1 LYS 131 262.309 2.251 -11.683 1031 1HZ LYS 131 HZ1 LYS 131 263.368 0.532 -10.372 1032 2HZ LYS 131 HZ2 LYS 131 262.358 0.864 -9.057 1033 3HZ LYS 131 HZ3 LYS 131 263.479 2.020 -9.574 1034 H LYS 132 HN LYS 132 257.262 -0.750 -11.072 1035 HA LYS 132 HA LYS 132 255.153 -1.017 -9.031 1036 1HB LYS 132 HB2 LYS 132 255.475 -2.213 -11.706 1037 2HB LYS 132 HB1 LYS 132 254.990 -3.341 -10.446 1038 1HG LYS 132 HG2 LYS 132 253.065 -2.405 -11.617 1039 2HG LYS 132 HG1 LYS 132 253.072 -1.956 -9.911 1040 1HD LYS 132 HD2 LYS 132 253.396 0.242 -10.353 1041 2HD LYS 132 HD1 LYS 132 254.417 -0.083 -11.756 1042 1HE LYS 132 HE2 LYS 132 252.110 -0.962 -12.738 1043 2HE LYS 132 HE1 LYS 132 251.467 0.185 -11.565 1044 1HZ LYS 132 HZ1 LYS 132 252.538 1.959 -12.610 1045 2HZ LYS 132 HZ2 LYS 132 251.926 1.040 -13.890 1046 3HZ LYS 132 HZ3 LYS 132 253.569 0.952 -13.499 1047 H PHE 133 HN PHE 133 255.490 -2.381 -7.360 1048 HA PHE 133 HA PHE 133 257.634 -4.338 -7.480 1049 1HB PHE 133 HB2 PHE 133 259.060 -3.384 -5.993 1050 2HB PHE 133 HB1 PHE 133 258.311 -1.892 -6.548 1051 HD1 PHE 133 HD1 PHE 133 255.919 -1.516 -5.221 1052 HD2 PHE 133 HD2 PHE 133 259.394 -3.471 -3.735 1053 HE1 PHE 133 HE1 PHE 133 255.203 -1.029 -2.918 1054 HE2 PHE 133 HE2 PHE 133 258.684 -2.988 -1.431 1055 HZ PHE 133 HZ PHE 133 256.587 -1.766 -1.019 1056 H HIS 134 HN HIS 134 257.771 -5.540 -5.330 1057 HA HIS 134 HA HIS 134 255.169 -5.714 -3.995 1058 1HB HIS 134 HB2 HIS 134 256.721 -8.155 -4.877 1059 2HB HIS 134 HB1 HIS 134 255.113 -8.111 -4.160 1060 HD1 HIS 134 HD1 HIS 134 253.403 -8.617 -5.856 1061 HD2 HIS 134 HD2 HIS 134 256.564 -6.453 -7.466 1062 HE1 HIS 134 HE1 HIS 134 252.818 -8.275 -8.278 1063 HE2 HIS 134 HE2 HIS 134 254.785 -7.035 -9.251 1064 H GLY 135 HN GLY 135 255.430 -5.653 -1.824 1065 1HA GLY 135 HA2 GLY 135 258.094 -6.423 -0.794 1066 2HA GLY 135 HA1 GLY 135 257.180 -5.062 -0.165 1067 H TYR 136 HN TYR 136 258.259 -7.420 1.176 1068 HA TYR 136 HA TYR 136 255.756 -8.479 2.309 1069 1HB TYR 136 HB2 TYR 136 258.364 -9.841 1.713 1070 2HB TYR 136 HB1 TYR 136 257.348 -10.432 3.024 1071 HD1 TYR 136 HD1 TYR 136 256.890 -9.337 -0.528 1072 HD2 TYR 136 HD2 TYR 136 255.983 -12.202 2.484 1073 HE1 TYR 136 HE1 TYR 136 255.556 -10.613 -2.152 1074 HE2 TYR 136 HE2 TYR 136 254.647 -13.487 0.868 1075 HH TYR 136 HH TYR 136 254.770 -12.942 -2.463 1076 H PHE 137 HN PHE 137 255.428 -7.538 4.227 1077 HA PHE 137 HA PHE 137 257.779 -6.889 5.881 1078 1HB PHE 137 HB2 PHE 137 255.006 -5.695 6.039 1079 2HB PHE 137 HB1 PHE 137 256.432 -5.168 6.928 1080 HD1 PHE 137 HD1 PHE 137 255.332 -5.731 3.411 1081 HD2 PHE 137 HD2 PHE 137 257.587 -3.356 6.125 1082 HE1 PHE 137 HE1 PHE 137 255.886 -4.181 1.584 1083 HE2 PHE 137 HE2 PHE 137 258.146 -1.800 4.304 1084 HZ PHE 137 HZ PHE 137 257.294 -2.211 2.029 1085 H LYS 138 HN LYS 138 258.044 -7.880 7.779 1086 HA LYS 138 HA LYS 138 256.022 -9.741 8.729 1087 1HB LYS 138 HB2 LYS 138 258.872 -9.199 9.542 1088 2HB LYS 138 HB1 LYS 138 257.826 -10.282 10.445 1089 1HG LYS 138 HG2 LYS 138 257.522 -11.301 7.979 1090 2HG LYS 138 HG1 LYS 138 259.161 -10.665 7.851 1091 1HD LYS 138 HD2 LYS 138 259.754 -12.634 8.764 1092 2HD LYS 138 HD1 LYS 138 259.256 -11.880 10.279 1093 1HE LYS 138 HE2 LYS 138 257.341 -13.099 10.416 1094 2HE LYS 138 HE1 LYS 138 257.145 -13.188 8.666 1095 1HZ LYS 138 HZ1 LYS 138 259.025 -14.784 8.647 1096 2HZ LYS 138 HZ2 LYS 138 257.664 -15.350 9.475 1097 3HZ LYS 138 HZ3 LYS 138 259.004 -14.785 10.339 1098 H PHE 139 HN PHE 139 254.608 -9.192 10.298 1099 HA PHE 139 HA PHE 139 255.180 -6.735 11.815 1100 1HB PHE 139 HB2 PHE 139 252.694 -7.985 10.772 1101 2HB PHE 139 HB1 PHE 139 252.574 -7.138 12.312 1102 HD1 PHE 139 HD1 PHE 139 252.075 -4.901 12.273 1103 HD2 PHE 139 HD2 PHE 139 253.996 -6.642 8.899 1104 HE1 PHE 139 HE1 PHE 139 251.919 -2.754 11.082 1105 HE2 PHE 139 HE2 PHE 139 253.845 -4.498 7.701 1106 HZ PHE 139 HZ PHE 139 252.806 -2.550 8.793 1107 H GLN 140 HN GLN 140 255.067 -6.675 14.011 1108 HA GLN 140 HA GLN 140 255.404 -9.176 15.401 1109 1HB GLN 140 HB2 GLN 140 256.851 -7.585 16.239 1110 2HB GLN 140 HB1 GLN 140 255.697 -6.279 16.049 1111 1HG GLN 140 HG2 GLN 140 256.107 -6.658 18.377 1112 2HG GLN 140 HG1 GLN 140 254.453 -7.128 17.996 1113 1HE2 GLN 140 HE21 GLN 140 256.145 -7.945 20.217 1114 2HE2 GLN 140 HE22 GLN 140 256.258 -9.667 20.131 1115 H GLY 141 HN GLY 141 252.735 -7.527 14.410 1116 1HA GLY 141 HA2 GLY 141 250.922 -9.055 15.907 1117 2HA GLY 141 HA1 GLY 141 251.045 -7.465 16.648 1118 H GLN 142 HN GLN 142 250.576 -5.594 15.297 1119 HA GLN 142 HA GLN 142 249.223 -6.024 12.786 1120 1HB GLN 142 HB2 GLN 142 247.077 -5.090 13.491 1121 2HB GLN 142 HB1 GLN 142 247.441 -6.566 14.374 1122 1HG GLN 142 HG2 GLN 142 247.796 -5.455 16.358 1123 2HG GLN 142 HG1 GLN 142 248.158 -3.926 15.558 1124 1HE2 GLN 142 HE21 GLN 142 246.126 -4.996 17.629 1125 2HE2 GLN 142 HE22 GLN 142 244.637 -4.291 17.108 1126 H ASP 143 HN ASP 143 251.413 -4.372 14.206 1127 HA ASP 143 HA ASP 143 250.973 -1.991 12.665 1128 1HB ASP 143 HB2 ASP 143 250.829 -1.915 15.666 1129 2HB ASP 143 HB1 ASP 143 251.382 -0.517 14.750 1130 H THR 144 HN THR 144 252.925 -3.657 15.099 1131 HA THR 144 HA THR 144 255.281 -2.122 14.507 1132 HB THR 144 HB THR 144 254.768 -4.565 16.191 1133 HG1 THR 144 HG1 THR 144 254.152 -2.675 17.166 1134 1HG2 THR 144 HG21 THR 144 257.077 -4.304 17.047 1135 2HG2 THR 144 HG22 THR 144 257.406 -3.210 15.702 1136 3HG2 THR 144 HG23 THR 144 256.991 -4.896 15.388 1137 H ILE 145 HN ILE 145 256.921 -2.607 13.156 1138 HA ILE 145 HA ILE 145 256.653 -5.092 11.613 1139 HB ILE 145 HB ILE 145 258.132 -2.609 10.751 1140 1HG1 ILE 145 HG12 ILE 145 255.400 -3.614 9.915 1141 2HG1 ILE 145 HG11 ILE 145 255.712 -2.181 10.890 1142 1HG2 ILE 145 HG21 ILE 145 258.206 -3.700 8.575 1143 2HG2 ILE 145 HG22 ILE 145 257.329 -5.086 9.222 1144 3HG2 ILE 145 HG23 ILE 145 258.954 -4.721 9.804 1145 1HD1 ILE 145 HD11 ILE 145 256.907 -1.177 9.003 1146 2HD1 ILE 145 HD12 ILE 145 255.235 -1.570 8.602 1147 3HD1 ILE 145 HD13 ILE 145 256.546 -2.601 8.030 1148 H LEU 146 HN LEU 146 258.262 -6.521 11.581 1149 HA LEU 146 HA LEU 146 260.742 -5.805 12.994 1150 1HB LEU 146 HB2 LEU 146 259.728 -8.612 12.677 1151 2HB LEU 146 HB1 LEU 146 260.884 -7.990 13.841 1152 HG LEU 146 HG LEU 146 257.992 -7.157 13.873 1153 1HD1 LEU 146 HD11 LEU 146 258.767 -9.750 14.222 1154 2HD1 LEU 146 HD12 LEU 146 257.334 -9.008 14.935 1155 3HD1 LEU 146 HD13 LEU 146 258.826 -9.120 15.869 1156 1HD2 LEU 146 HD21 LEU 146 259.049 -5.688 15.250 1157 2HD2 LEU 146 HD22 LEU 146 260.366 -6.802 15.616 1158 3HD2 LEU 146 HD23 LEU 146 258.797 -7.003 16.396 1159 H ASP 147 HN ASP 147 259.407 -6.685 10.016 1160 HA ASP 147 HA ASP 147 262.033 -6.890 8.835 1161 1HB ASP 147 HB2 ASP 147 260.816 -9.257 9.532 1162 2HB ASP 147 HB1 ASP 147 260.309 -9.057 7.857 1163 H TYR 148 HN TYR 148 262.065 -6.103 6.759 1164 HA TYR 148 HA TYR 148 259.501 -5.828 5.382 1165 1HB TYR 148 HB2 TYR 148 259.900 -3.494 4.839 1166 2HB TYR 148 HB1 TYR 148 259.835 -3.726 6.583 1167 HD1 TYR 148 HD1 TYR 148 262.098 -3.956 7.812 1168 HD2 TYR 148 HD2 TYR 148 261.711 -2.375 3.881 1169 HE1 TYR 148 HE1 TYR 148 264.282 -2.852 8.047 1170 HE2 TYR 148 HE2 TYR 148 263.895 -1.268 4.106 1171 HH TYR 148 HH TYR 148 266.130 -1.943 5.866 1172 H THR 149 HN THR 149 259.707 -6.719 3.452 1173 HA THR 149 HA THR 149 262.313 -6.515 2.092 1174 HB THR 149 HB THR 149 260.948 -8.503 0.767 1175 HG1 THR 149 HG1 THR 149 260.213 -9.873 2.462 1176 1HG2 THR 149 HG21 THR 149 263.263 -8.306 2.386 1177 2HG2 THR 149 HG22 THR 149 262.867 -9.513 1.162 1178 3HG2 THR 149 HG23 THR 149 262.389 -9.768 2.840 1179 H LEU 150 HN LEU 150 262.387 -5.892 -0.026 1180 HA LEU 150 HA LEU 150 259.873 -5.108 -1.312 1181 1HB LEU 150 HB2 LEU 150 262.341 -3.377 -1.113 1182 2HB LEU 150 HB1 LEU 150 260.914 -3.001 -2.062 1183 HG LEU 150 HG LEU 150 259.762 -3.330 0.348 1184 1HD1 LEU 150 HD11 LEU 150 262.398 -3.500 1.039 1185 2HD1 LEU 150 HD12 LEU 150 261.086 -3.030 2.119 1186 3HD1 LEU 150 HD13 LEU 150 262.049 -1.793 1.313 1187 1HD2 LEU 150 HD21 LEU 150 260.512 -0.691 0.471 1188 2HD2 LEU 150 HD22 LEU 150 259.148 -1.334 -0.443 1189 3HD2 LEU 150 HD23 LEU 150 260.697 -1.072 -1.241 1190 H ARG 151 HN ARG 151 259.730 -5.829 -3.332 1191 HA ARG 151 HA ARG 151 262.216 -6.389 -4.809 1192 1HB ARG 151 HB2 ARG 151 259.739 -8.094 -5.012 1193 2HB ARG 151 HB1 ARG 151 261.339 -8.434 -5.654 1194 1HG ARG 151 HG2 ARG 151 262.049 -8.347 -3.143 1195 2HG ARG 151 HG1 ARG 151 260.334 -8.655 -2.860 1196 1HD ARG 151 HD2 ARG 151 260.430 -10.759 -3.713 1197 2HD ARG 151 HD1 ARG 151 261.688 -10.346 -4.877 1198 HE ARG 151 HE ARG 151 262.054 -11.372 -2.225 1199 1HH1 ARG 151 HH11 ARG 151 263.515 -9.477 -4.765 1200 2HH1 ARG 151 HH12 ARG 151 265.134 -9.782 -4.233 1201 1HH2 ARG 151 HH21 ARG 151 264.183 -11.773 -1.522 1202 2HH2 ARG 151 HH22 ARG 151 265.514 -11.086 -2.392 1203 H GLU 152 HN GLU 152 262.316 -5.230 -6.617 1204 HA GLU 152 HA GLU 152 259.958 -3.935 -7.661 1205 1HB GLU 152 HB2 GLU 152 261.594 -3.005 -9.348 1206 2HB GLU 152 HB1 GLU 152 261.922 -2.610 -7.667 1207 1HG GLU 152 HG2 GLU 152 263.239 -5.044 -8.629 1208 2HG GLU 152 HG1 GLU 152 263.751 -3.558 -9.429 1209 H VAL 153 HN VAL 153 258.934 -4.321 -9.577 1210 HA VAL 153 HA VAL 153 259.797 -6.711 -11.074 1211 HB VAL 153 HB VAL 153 257.378 -7.104 -11.580 1212 1HG1 VAL 153 HG11 VAL 153 258.637 -8.330 -9.818 1213 2HG1 VAL 153 HG12 VAL 153 256.904 -8.222 -9.512 1214 3HG1 VAL 153 HG13 VAL 153 258.021 -7.175 -8.636 1215 1HG2 VAL 153 HG21 VAL 153 256.890 -4.632 -10.781 1216 2HG2 VAL 153 HG22 VAL 153 256.636 -5.438 -9.233 1217 3HG2 VAL 153 HG23 VAL 153 255.678 -5.904 -10.638 1218 H ASP 154 HN ASP 154 259.026 -6.778 -13.328 1219 HA ASP 154 HA ASP 154 258.966 -4.071 -14.484 1220 1HB ASP 154 HB2 ASP 154 260.887 -5.813 -14.957 1221 2HB ASP 154 HB1 ASP 154 259.717 -6.479 -16.093 1222 H THR 155 HN THR 155 257.481 -7.242 -14.510 1223 HA THR 155 HA THR 155 255.633 -6.514 -16.626 1224 HB THR 155 HB THR 155 255.710 -9.006 -14.915 1225 HG1 THR 155 HG1 THR 155 256.932 -9.895 -16.495 1226 1HG2 THR 155 HG21 THR 155 253.769 -9.458 -15.895 1227 2HG2 THR 155 HG22 THR 155 254.711 -9.697 -17.366 1228 3HG2 THR 155 HG23 THR 155 253.943 -8.140 -17.053 1229 H VAL 156 HN VAL 156 253.854 -5.391 -16.228 1230 HA VAL 156 HA VAL 156 252.884 -4.987 -13.560 1231 HB VAL 156 HB VAL 156 251.534 -4.172 -16.133 1232 1HG1 VAL 156 HG11 VAL 156 250.394 -4.098 -13.783 1233 2HG1 VAL 156 HG12 VAL 156 250.245 -2.730 -14.886 1234 3HG1 VAL 156 HG13 VAL 156 251.404 -2.670 -13.558 1235 1HG2 VAL 156 HG21 VAL 156 252.703 -2.035 -15.913 1236 2HG2 VAL 156 HG22 VAL 156 253.840 -3.367 -16.123 1237 3HG2 VAL 156 HG23 VAL 156 253.593 -2.661 -14.525 Start of MODEL 19 1 1H MET 1 HT1 MET 1 239.508 -25.432 1.053 2 2H MET 1 HT2 MET 1 238.828 -24.497 2.321 3 3H MET 1 HT3 MET 1 239.074 -26.183 2.532 4 HA MET 1 HA MET 1 240.699 -24.747 3.651 5 1HB MET 1 HB2 MET 1 240.948 -27.178 2.709 6 2HB MET 1 HB1 MET 1 242.027 -26.420 1.545 7 1HG MET 1 HG2 MET 1 243.239 -25.448 3.568 8 2HG MET 1 HG1 MET 1 242.325 -26.618 4.519 9 1HE MET 1 HE1 MET 1 245.575 -27.053 4.767 10 2HE MET 1 HE2 MET 1 245.290 -28.794 4.762 11 3HE MET 1 HE3 MET 1 244.119 -27.711 5.515 12 H GLY 2 HN GLY 2 242.078 -23.066 3.536 13 1HA GLY 2 HA2 GLY 2 243.335 -22.282 1.067 14 2HA GLY 2 HA1 GLY 2 242.049 -21.190 1.561 15 H ALA 3 HN ALA 3 244.114 -19.797 1.466 16 HA ALA 3 HA ALA 3 244.790 -19.085 4.115 17 1HB ALA 3 HB1 ALA 3 246.859 -19.933 4.471 18 2HB ALA 3 HB2 ALA 3 247.279 -19.922 2.759 19 3HB ALA 3 HB3 ALA 3 246.261 -21.206 3.408 20 H SER 4 HN SER 4 247.130 -17.722 3.787 21 HA SER 4 HA SER 4 247.913 -15.709 3.068 22 1HB SER 4 HB2 SER 4 248.342 -15.486 0.745 23 2HB SER 4 HB1 SER 4 248.404 -17.217 1.075 24 HG SER 4 HG SER 4 246.919 -17.406 -0.383 25 H ARG 5 HN ARG 5 246.410 -14.493 4.201 26 HA ARG 5 HA ARG 5 243.866 -13.795 3.235 27 1HB ARG 5 HB2 ARG 5 245.565 -13.066 5.451 28 2HB ARG 5 HB1 ARG 5 244.802 -11.633 4.778 29 1HG ARG 5 HG2 ARG 5 243.360 -12.393 6.464 30 2HG ARG 5 HG1 ARG 5 242.611 -12.888 4.944 31 1HD ARG 5 HD2 ARG 5 242.921 -15.090 5.352 32 2HD ARG 5 HD1 ARG 5 244.464 -14.830 6.166 33 HE ARG 5 HE ARG 5 241.863 -14.968 7.381 34 1HH1 ARG 5 HH11 ARG 5 245.121 -13.766 7.724 35 2HH1 ARG 5 HH12 ARG 5 245.038 -13.676 9.451 36 1HH2 ARG 5 HH21 ARG 5 241.753 -14.850 9.653 37 2HH2 ARG 5 HH22 ARG 5 243.127 -14.292 10.547 38 H LEU 6 HN LEU 6 243.884 -13.156 1.131 39 HA LEU 6 HA LEU 6 245.677 -11.054 0.252 40 1HB LEU 6 HB2 LEU 6 244.661 -13.156 -1.056 41 2HB LEU 6 HB1 LEU 6 243.430 -11.976 -1.459 42 HG LEU 6 HG LEU 6 246.325 -11.344 -1.915 43 1HD1 LEU 6 HD11 LEU 6 244.521 -12.891 -3.768 44 2HD1 LEU 6 HD12 LEU 6 245.992 -13.483 -2.997 45 3HD1 LEU 6 HD13 LEU 6 246.083 -12.203 -4.206 46 1HD2 LEU 6 HD21 LEU 6 244.154 -9.794 -2.134 47 2HD2 LEU 6 HD22 LEU 6 244.150 -10.523 -3.739 48 3HD2 LEU 6 HD23 LEU 6 245.563 -9.627 -3.182 49 H TYR 7 HN TYR 7 245.243 -9.000 0.504 50 HA TYR 7 HA TYR 7 242.438 -8.112 0.585 51 1HB TYR 7 HB2 TYR 7 244.770 -7.381 2.317 52 2HB TYR 7 HB1 TYR 7 243.486 -6.208 2.050 53 HD1 TYR 7 HD1 TYR 7 243.705 -9.866 2.822 54 HD2 TYR 7 HD2 TYR 7 241.918 -6.113 3.729 55 HE1 TYR 7 HE1 TYR 7 242.372 -10.934 4.591 56 HE2 TYR 7 HE2 TYR 7 240.580 -7.171 5.500 57 HH TYR 7 HH TYR 7 240.344 -10.571 5.842 58 H THR 8 HN THR 8 242.525 -5.526 0.428 59 HA THR 8 HA THR 8 244.136 -4.871 -1.960 60 HB THR 8 HB THR 8 242.276 -3.628 -2.824 61 HG1 THR 8 HG1 THR 8 241.204 -2.740 -1.207 62 1HG2 THR 8 HG21 THR 8 240.819 -5.291 -3.420 63 2HG2 THR 8 HG22 THR 8 240.849 -6.036 -1.823 64 3HG2 THR 8 HG23 THR 8 242.223 -6.228 -2.910 65 H LEU 9 HN LEU 9 244.341 -2.498 -2.308 66 HA LEU 9 HA LEU 9 244.128 -0.784 0.007 67 1HB LEU 9 HB2 LEU 9 246.284 -2.110 0.260 68 2HB LEU 9 HB1 LEU 9 246.857 -1.286 -1.176 69 HG LEU 9 HG LEU 9 246.105 0.031 1.432 70 1HD1 LEU 9 HD11 LEU 9 248.165 -1.123 1.688 71 2HD1 LEU 9 HD12 LEU 9 248.549 0.581 1.452 72 3HD1 LEU 9 HD13 LEU 9 248.746 -0.559 0.122 73 1HD2 LEU 9 HD21 LEU 9 245.602 1.624 -0.195 74 2HD2 LEU 9 HD22 LEU 9 246.950 1.134 -1.222 75 3HD2 LEU 9 HD23 LEU 9 247.256 2.009 0.278 76 H VAL 10 HN VAL 10 243.157 0.902 -1.000 77 HA VAL 10 HA VAL 10 244.298 1.794 -3.550 78 HB VAL 10 HB VAL 10 242.116 1.094 -3.989 79 1HG1 VAL 10 HG11 VAL 10 240.240 2.257 -2.530 80 2HG1 VAL 10 HG12 VAL 10 241.527 2.144 -1.332 81 3HG1 VAL 10 HG13 VAL 10 240.946 0.690 -2.143 82 1HG2 VAL 10 HG21 VAL 10 241.805 4.041 -3.510 83 2HG2 VAL 10 HG22 VAL 10 240.972 3.058 -4.713 84 3HG2 VAL 10 HG23 VAL 10 242.702 3.356 -4.864 85 H LEU 11 HN LEU 11 245.077 3.714 -3.736 86 HA LEU 11 HA LEU 11 244.438 5.768 -1.734 87 1HB LEU 11 HB2 LEU 11 246.965 4.534 -2.347 88 2HB LEU 11 HB1 LEU 11 247.032 6.236 -2.760 89 HG LEU 11 HG LEU 11 246.567 4.988 -0.057 90 1HD1 LEU 11 HD11 LEU 11 248.871 5.778 -1.208 91 2HD1 LEU 11 HD12 LEU 11 248.583 5.824 0.532 92 3HD1 LEU 11 HD13 LEU 11 248.381 7.285 -0.431 93 1HD2 LEU 11 HD21 LEU 11 245.683 7.638 -1.042 94 2HD2 LEU 11 HD22 LEU 11 246.403 7.558 0.567 95 3HD2 LEU 11 HD23 LEU 11 244.979 6.588 0.189 96 H VAL 12 HN VAL 12 243.334 7.312 -2.804 97 HA VAL 12 HA VAL 12 243.702 7.617 -5.656 98 HB VAL 12 HB VAL 12 241.920 9.314 -3.920 99 1HG1 VAL 12 HG11 VAL 12 240.614 9.019 -6.232 100 2HG1 VAL 12 HG12 VAL 12 242.268 8.841 -6.818 101 3HG1 VAL 12 HG13 VAL 12 241.792 10.303 -5.954 102 1HG2 VAL 12 HG21 VAL 12 240.318 7.382 -5.076 103 2HG2 VAL 12 HG22 VAL 12 240.798 7.461 -3.383 104 3HG2 VAL 12 HG23 VAL 12 241.726 6.478 -4.516 105 H LEU 13 HN LEU 13 245.690 8.502 -5.979 106 HA LEU 13 HA LEU 13 246.281 11.105 -4.743 107 1HB LEU 13 HB2 LEU 13 247.895 9.004 -4.950 108 2HB LEU 13 HB1 LEU 13 248.238 9.746 -6.506 109 HG LEU 13 HG LEU 13 248.236 11.712 -4.399 110 1HD1 LEU 13 HD11 LEU 13 249.641 10.921 -2.861 111 2HD1 LEU 13 HD12 LEU 13 250.597 10.029 -4.045 112 3HD1 LEU 13 HD13 LEU 13 249.097 9.341 -3.424 113 1HD2 LEU 13 HD21 LEU 13 249.749 10.976 -6.756 114 2HD2 LEU 13 HD22 LEU 13 250.765 11.571 -5.443 115 3HD2 LEU 13 HD23 LEU 13 249.438 12.561 -6.050 116 H GLN 14 HN GLN 14 247.137 12.799 -6.102 117 HA GLN 14 HA GLN 14 246.343 12.655 -8.925 118 1HB GLN 14 HB2 GLN 14 245.046 14.192 -6.913 119 2HB GLN 14 HB1 GLN 14 245.917 15.315 -7.949 120 1HG GLN 14 HG2 GLN 14 244.690 13.566 -9.714 121 2HG GLN 14 HG1 GLN 14 243.490 13.832 -8.450 122 1HE2 GLN 14 HE21 GLN 14 242.122 15.037 -9.706 123 2HE2 GLN 14 HE22 GLN 14 242.506 16.625 -10.268 124 HA PRO 15 HA PRO 15 250.270 14.459 -9.752 125 1HB PRO 15 HB2 PRO 15 249.740 16.172 -11.806 126 2HB PRO 15 HB1 PRO 15 249.823 14.418 -11.994 127 1HG PRO 15 HG2 PRO 15 247.424 16.179 -11.686 128 2HG PRO 15 HG1 PRO 15 247.672 14.804 -12.778 129 1HD PRO 15 HD2 PRO 15 246.253 14.585 -10.495 130 2HD PRO 15 HD1 PRO 15 247.240 13.250 -11.123 131 H GLN 16 HN GLN 16 248.356 15.916 -7.854 132 HA GLN 16 HA GLN 16 250.038 18.183 -7.433 133 1HB GLN 16 HB2 GLN 16 247.327 18.507 -8.618 134 2HB GLN 16 HB1 GLN 16 247.804 19.648 -7.368 135 1HG GLN 16 HG2 GLN 16 249.892 20.063 -8.728 136 2HG GLN 16 HG1 GLN 16 249.112 19.156 -10.023 137 1HE2 GLN 16 HE21 GLN 16 249.782 22.146 -9.118 138 2HE2 GLN 16 HE22 GLN 16 248.416 22.999 -9.743 139 H ARG 17 HN ARG 17 247.048 16.498 -6.637 140 HA ARG 17 HA ARG 17 247.651 16.923 -3.795 141 1HB ARG 17 HB2 ARG 17 245.115 16.978 -3.447 142 2HB ARG 17 HB1 ARG 17 245.862 18.420 -4.118 143 1HG ARG 17 HG2 ARG 17 245.222 17.105 -6.386 144 2HG ARG 17 HG1 ARG 17 243.934 16.554 -5.314 145 1HD ARG 17 HD2 ARG 17 243.495 18.944 -4.742 146 2HD ARG 17 HD1 ARG 17 244.660 19.401 -5.983 147 HE ARG 17 HE ARG 17 241.969 18.468 -6.384 148 1HH1 ARG 17 HH11 ARG 17 245.129 18.800 -7.828 149 2HH1 ARG 17 HH12 ARG 17 244.526 18.778 -9.451 150 1HH2 ARG 17 HH21 ARG 17 241.175 18.439 -8.518 151 2HH2 ARG 17 HH22 ARG 17 242.283 18.572 -9.844 152 H VAL 18 HN VAL 18 246.619 15.289 -2.378 153 HA VAL 18 HA VAL 18 246.128 12.749 -3.789 154 HB VAL 18 HB VAL 18 248.264 12.395 -2.984 155 1HG1 VAL 18 HG11 VAL 18 249.210 13.184 -0.981 156 2HG1 VAL 18 HG12 VAL 18 247.631 13.516 -0.269 157 3HG1 VAL 18 HG13 VAL 18 248.236 14.523 -1.583 158 1HG2 VAL 18 HG21 VAL 18 246.726 10.614 -2.280 159 2HG2 VAL 18 HG22 VAL 18 246.525 11.421 -0.724 160 3HG2 VAL 18 HG23 VAL 18 248.101 10.780 -1.188 161 H LEU 19 HN LEU 19 244.852 11.194 -2.568 162 HA LEU 19 HA LEU 19 243.111 12.477 -0.564 163 1HB LEU 19 HB2 LEU 19 242.156 11.827 -2.880 164 2HB LEU 19 HB1 LEU 19 242.256 10.179 -2.289 165 HG LEU 19 HG LEU 19 240.712 10.655 -0.502 166 1HD1 LEU 19 HD11 LEU 19 241.087 12.789 0.257 167 2HD1 LEU 19 HD12 LEU 19 239.589 13.010 -0.648 168 3HD1 LEU 19 HD13 LEU 19 241.130 13.477 -1.367 169 1HD2 LEU 19 HD21 LEU 19 238.857 10.574 -1.787 170 2HD2 LEU 19 HD22 LEU 19 240.036 10.451 -3.093 171 3HD2 LEU 19 HD23 LEU 19 239.302 12.008 -2.711 172 H LEU 20 HN LEU 20 243.494 11.701 1.395 173 HA LEU 20 HA LEU 20 244.330 8.892 1.664 174 1HB LEU 20 HB2 LEU 20 245.131 11.382 2.980 175 2HB LEU 20 HB1 LEU 20 244.810 10.071 4.099 176 HG LEU 20 HG LEU 20 246.679 9.771 1.759 177 1HD1 LEU 20 HD11 LEU 20 247.362 11.621 3.322 178 2HD1 LEU 20 HD12 LEU 20 248.516 10.296 3.167 179 3HD1 LEU 20 HD13 LEU 20 247.479 10.402 4.591 180 1HD2 LEU 20 HD21 LEU 20 245.700 7.747 2.894 181 2HD2 LEU 20 HD22 LEU 20 246.561 8.246 4.350 182 3HD2 LEU 20 HD23 LEU 20 247.461 7.839 2.889 183 H GLY 21 HN GLY 21 243.303 7.532 3.095 184 1HA GLY 21 HA2 GLY 21 240.597 8.290 3.813 185 2HA GLY 21 HA1 GLY 21 241.318 6.695 3.987 186 H MET 22 HN MET 22 240.337 9.484 5.598 187 HA MET 22 HA MET 22 242.047 8.962 7.911 188 1HB MET 22 HB2 MET 22 241.868 11.290 7.211 189 2HB MET 22 HB1 MET 22 240.118 11.221 7.343 190 1HG MET 22 HG2 MET 22 240.135 11.438 9.585 191 2HG MET 22 HG1 MET 22 241.633 10.532 9.775 192 1HE MET 22 HE1 MET 22 243.954 11.699 8.555 193 2HE MET 22 HE2 MET 22 243.856 11.603 10.312 194 3HE MET 22 HE3 MET 22 244.407 13.089 9.540 195 H LYS 23 HN LYS 23 241.234 8.328 9.920 196 HA LYS 23 HA LYS 23 238.576 7.140 9.826 197 1HB LYS 23 HB2 LYS 23 241.056 6.644 11.290 198 2HB LYS 23 HB1 LYS 23 239.632 6.582 12.321 199 1HG LYS 23 HG2 LYS 23 238.718 5.072 10.358 200 2HG LYS 23 HG1 LYS 23 240.441 4.812 10.081 201 1HD LYS 23 HD2 LYS 23 239.959 3.107 11.552 202 2HD LYS 23 HD1 LYS 23 240.488 4.376 12.658 203 1HE LYS 23 HE2 LYS 23 238.568 3.899 13.727 204 2HE LYS 23 HE1 LYS 23 237.853 4.936 12.493 205 1HZ LYS 23 HZ1 LYS 23 236.794 2.680 12.867 206 2HZ LYS 23 HZ2 LYS 23 238.147 2.019 12.097 207 3HZ LYS 23 HZ3 LYS 23 237.144 3.096 11.265 208 H LYS 24 HN LYS 24 236.939 7.646 11.312 209 HA LYS 24 HA LYS 24 237.149 10.354 12.333 210 1HB LYS 24 HB2 LYS 24 235.026 8.707 11.325 211 2HB LYS 24 HB1 LYS 24 234.598 9.270 12.934 212 1HG LYS 24 HG2 LYS 24 233.794 11.024 11.775 213 2HG LYS 24 HG1 LYS 24 235.469 11.572 11.891 214 1HD LYS 24 HD2 LYS 24 235.940 10.608 9.698 215 2HD LYS 24 HD1 LYS 24 234.273 10.042 9.582 216 1HE LYS 24 HE2 LYS 24 234.547 12.092 8.317 217 2HE LYS 24 HE1 LYS 24 233.491 12.368 9.701 218 1HZ LYS 24 HZ1 LYS 24 236.390 12.978 9.752 219 2HZ LYS 24 HZ2 LYS 24 235.205 13.478 10.850 220 3HZ LYS 24 HZ3 LYS 24 235.224 14.112 9.283 221 H ARG 25 HN ARG 25 236.774 7.075 13.513 222 HA ARG 25 HA ARG 25 237.739 7.815 16.072 223 1HB ARG 25 HB2 ARG 25 235.632 6.931 17.276 224 2HB ARG 25 HB1 ARG 25 235.626 8.581 16.672 225 1HG ARG 25 HG2 ARG 25 233.523 7.418 16.217 226 2HG ARG 25 HG1 ARG 25 234.347 7.903 14.733 227 1HD ARG 25 HD2 ARG 25 234.884 5.749 14.165 228 2HD ARG 25 HD1 ARG 25 234.872 5.193 15.840 229 HE ARG 25 HE ARG 25 232.291 5.967 14.798 230 1HH1 ARG 25 HH11 ARG 25 234.566 3.356 15.253 231 2HH1 ARG 25 HH12 ARG 25 233.358 2.121 15.145 232 1HH2 ARG 25 HH21 ARG 25 230.705 4.341 14.656 233 2HH2 ARG 25 HH22 ARG 25 231.167 2.679 14.805 234 H GLY 26 HN GLY 26 238.199 6.034 17.424 235 1HA GLY 26 HA2 GLY 26 237.843 3.582 17.757 236 2HA GLY 26 HA1 GLY 26 238.045 3.441 16.015 237 H PHE 27 HN PHE 27 239.917 2.431 15.663 238 HA PHE 27 HA PHE 27 242.223 3.111 17.336 239 1HB PHE 27 HB2 PHE 27 241.519 0.747 15.636 240 2HB PHE 27 HB1 PHE 27 243.208 1.077 16.012 241 HD1 PHE 27 HD1 PHE 27 243.357 1.837 18.699 242 HD2 PHE 27 HD2 PHE 27 240.660 -0.934 16.923 243 HE1 PHE 27 HE1 PHE 27 243.097 0.707 20.869 244 HE2 PHE 27 HE2 PHE 27 240.393 -2.069 19.090 245 HZ PHE 27 HZ PHE 27 241.613 -1.248 21.067 246 H GLY 28 HN GLY 28 241.101 4.704 15.012 247 1HA GLY 28 HA2 GLY 28 243.690 5.208 13.785 248 2HA GLY 28 HA1 GLY 28 242.424 4.689 12.691 249 H ALA 29 HN ALA 29 240.840 6.451 14.998 250 HA ALA 29 HA ALA 29 240.043 8.526 13.414 251 1HB ALA 29 HB1 ALA 29 238.913 9.163 15.198 252 2HB ALA 29 HB2 ALA 29 240.378 9.427 16.141 253 3HB ALA 29 HB3 ALA 29 239.670 7.814 16.041 254 H GLY 30 HN GLY 30 240.635 10.763 13.250 255 1HA GLY 30 HA2 GLY 30 242.153 12.444 12.857 256 2HA GLY 30 HA1 GLY 30 242.827 11.999 14.416 257 H ARG 31 HN ARG 31 242.800 9.586 11.956 258 HA ARG 31 HA ARG 31 245.636 10.107 11.370 259 1HB ARG 31 HB2 ARG 31 244.867 8.075 12.962 260 2HB ARG 31 HB1 ARG 31 244.707 7.289 11.397 261 1HG ARG 31 HG2 ARG 31 246.937 7.239 11.039 262 2HG ARG 31 HG1 ARG 31 247.216 8.770 11.871 263 1HD ARG 31 HD2 ARG 31 246.410 7.207 13.931 264 2HD ARG 31 HD1 ARG 31 247.219 6.018 12.911 265 HE ARG 31 HE ARG 31 248.814 8.345 13.232 266 1HH1 ARG 31 HH11 ARG 31 247.787 5.447 14.883 267 2HH1 ARG 31 HH12 ARG 31 249.200 5.368 15.882 268 1HH2 ARG 31 HH21 ARG 31 250.671 8.242 14.545 269 2HH2 ARG 31 HH22 ARG 31 250.837 6.954 15.691 270 H TRP 32 HN TRP 32 246.372 9.176 9.320 271 HA TRP 32 HA TRP 32 244.167 9.040 7.373 272 1HB TRP 32 HB2 TRP 32 246.884 9.565 6.349 273 2HB TRP 32 HB1 TRP 32 245.349 10.296 5.905 274 HD1 TRP 32 HD1 TRP 32 247.697 10.475 9.013 275 HE1 TRP 32 HE1 TRP 32 247.799 12.928 9.771 276 HE3 TRP 32 HE3 TRP 32 244.548 12.537 5.548 277 HZ2 TRP 32 HZ2 TRP 32 246.710 15.411 9.002 278 HZ3 TRP 32 HZ3 TRP 32 244.140 14.962 5.630 279 HH2 TRP 32 HH2 TRP 32 245.197 16.367 7.320 280 H ASN 33 HN ASN 33 244.353 7.554 5.601 281 HA ASN 33 HA ASN 33 246.423 5.700 5.283 282 1HB ASN 33 HB2 ASN 33 245.274 3.664 6.215 283 2HB ASN 33 HB1 ASN 33 245.877 4.789 7.428 284 1HD2 ASN 33 HD21 ASN 33 243.030 3.590 5.799 285 2HD2 ASN 33 HD22 ASN 33 241.890 4.123 6.984 286 H GLY 34 HN GLY 34 246.074 4.285 3.571 287 1HA GLY 34 HA2 GLY 34 244.223 5.069 1.629 288 2HA GLY 34 HA1 GLY 34 245.114 3.553 1.620 289 H PHE 35 HN PHE 35 242.846 3.146 0.548 290 HA PHE 35 HA PHE 35 240.993 2.269 2.664 291 1HB PHE 35 HB2 PHE 35 240.080 2.379 -0.165 292 2HB PHE 35 HB1 PHE 35 239.203 2.733 1.312 293 HD1 PHE 35 HD1 PHE 35 241.116 4.089 -1.415 294 HD2 PHE 35 HD2 PHE 35 239.566 4.920 2.459 295 HE1 PHE 35 HE1 PHE 35 241.424 6.496 -1.812 296 HE2 PHE 35 HE2 PHE 35 239.867 7.330 2.067 297 HZ PHE 35 HZ PHE 35 240.797 8.121 -0.071 298 H GLY 36 HN GLY 36 242.013 0.305 3.076 299 1HA GLY 36 HA2 GLY 36 242.268 -1.561 0.831 300 2HA GLY 36 HA1 GLY 36 242.979 -1.766 2.424 301 H GLY 37 HN GLY 37 241.470 -3.700 0.941 302 1HA GLY 37 HA2 GLY 37 239.474 -4.301 2.980 303 2HA GLY 37 HA1 GLY 37 238.889 -4.166 1.328 304 H LYS 38 HN LYS 38 238.249 -6.455 1.891 305 HA LYS 38 HA LYS 38 240.499 -8.303 1.456 306 1HB LYS 38 HB2 LYS 38 239.188 -10.024 2.503 307 2HB LYS 38 HB1 LYS 38 239.186 -8.614 3.552 308 1HG LYS 38 HG2 LYS 38 236.952 -8.043 2.373 309 2HG LYS 38 HG1 LYS 38 236.967 -9.744 1.902 310 1HD LYS 38 HD2 LYS 38 237.573 -9.880 4.566 311 2HD LYS 38 HD1 LYS 38 236.456 -8.514 4.511 312 1HE LYS 38 HE2 LYS 38 234.828 -9.903 3.319 313 2HE LYS 38 HE1 LYS 38 235.944 -11.266 3.384 314 1HZ LYS 38 HZ1 LYS 38 235.632 -11.528 5.634 315 2HZ LYS 38 HZ2 LYS 38 234.085 -11.049 5.146 316 3HZ LYS 38 HZ3 LYS 38 235.124 -9.932 5.876 317 H VAL 39 HN VAL 39 240.447 -9.773 -0.200 318 HA VAL 39 HA VAL 39 238.702 -9.161 -2.403 319 HB VAL 39 HB VAL 39 240.596 -11.506 -2.272 320 1HG1 VAL 39 HG11 VAL 39 239.139 -11.485 -4.195 321 2HG1 VAL 39 HG12 VAL 39 240.773 -11.062 -4.701 322 3HG1 VAL 39 HG13 VAL 39 239.551 -9.803 -4.529 323 1HG2 VAL 39 HG21 VAL 39 242.313 -10.025 -3.213 324 2HG2 VAL 39 HG22 VAL 39 241.852 -9.560 -1.576 325 3HG2 VAL 39 HG23 VAL 39 241.245 -8.647 -2.956 326 H GLN 40 HN GLN 40 236.715 -9.939 -2.571 327 HA GLN 40 HA GLN 40 235.452 -11.762 -0.993 328 1HB GLN 40 HB2 GLN 40 234.904 -10.455 -3.481 329 2HB GLN 40 HB1 GLN 40 234.354 -12.121 -3.584 330 1HG GLN 40 HG2 GLN 40 233.558 -10.073 -1.532 331 2HG GLN 40 HG1 GLN 40 232.555 -10.743 -2.817 332 1HE2 GLN 40 HE21 GLN 40 233.956 -11.274 0.300 333 2HE2 GLN 40 HE22 GLN 40 233.090 -12.720 0.677 334 H GLU 41 HN GLU 41 234.525 -13.929 -1.666 335 HA GLU 41 HA GLU 41 236.641 -15.770 -1.981 336 1HB GLU 41 HB2 GLU 41 233.664 -15.967 -1.835 337 2HB GLU 41 HB1 GLU 41 234.576 -17.372 -2.371 338 1HG GLU 41 HG2 GLU 41 235.278 -15.950 0.167 339 2HG GLU 41 HG1 GLU 41 233.994 -17.157 0.116 340 H GLY 42 HN GLY 42 237.541 -14.880 -4.006 341 1HA GLY 42 HA2 GLY 42 238.006 -15.890 -6.147 342 2HA GLY 42 HA1 GLY 42 236.289 -16.216 -6.314 343 H GLU 43 HN GLU 43 237.940 -13.191 -5.402 344 HA GLU 43 HA GLU 43 236.933 -12.007 -7.879 345 1HB GLU 43 HB2 GLU 43 235.905 -10.264 -6.845 346 2HB GLU 43 HB1 GLU 43 235.741 -11.434 -5.548 347 1HG GLU 43 HG2 GLU 43 237.508 -10.468 -4.325 348 2HG GLU 43 HG1 GLU 43 238.025 -9.492 -5.698 349 H THR 44 HN THR 44 238.089 -9.782 -8.168 350 HA THR 44 HA THR 44 240.934 -10.369 -7.820 351 HB THR 44 HB THR 44 241.259 -8.793 -9.668 352 HG1 THR 44 HG1 THR 44 239.464 -7.914 -10.694 353 1HG2 THR 44 HG21 THR 44 239.060 -10.466 -10.694 354 2HG2 THR 44 HG22 THR 44 240.373 -11.306 -9.872 355 3HG2 THR 44 HG23 THR 44 240.717 -10.289 -11.272 356 H ILE 45 HN ILE 45 242.366 -8.926 -6.942 357 HA ILE 45 HA ILE 45 241.590 -7.376 -4.825 358 HB ILE 45 HB ILE 45 244.037 -7.093 -6.560 359 1HG1 ILE 45 HG12 ILE 45 244.500 -8.027 -3.893 360 2HG1 ILE 45 HG11 ILE 45 243.243 -9.001 -4.648 361 1HG2 ILE 45 HG21 ILE 45 244.662 -6.068 -4.063 362 2HG2 ILE 45 HG22 ILE 45 243.087 -5.371 -4.437 363 3HG2 ILE 45 HG23 ILE 45 244.434 -5.148 -5.550 364 1HD1 ILE 45 HD11 ILE 45 245.186 -8.758 -6.605 365 2HD1 ILE 45 HD12 ILE 45 244.874 -10.165 -5.590 366 3HD1 ILE 45 HD13 ILE 45 246.088 -8.982 -5.107 367 H GLU 46 HN GLU 46 241.744 -6.475 -8.211 368 HA GLU 46 HA GLU 46 241.438 -3.660 -7.747 369 1HB GLU 46 HB2 GLU 46 242.393 -4.772 -9.848 370 2HB GLU 46 HB1 GLU 46 240.725 -5.114 -10.292 371 1HG GLU 46 HG2 GLU 46 240.204 -2.763 -10.323 372 2HG GLU 46 HG1 GLU 46 241.821 -2.366 -9.745 373 H ASP 47 HN ASP 47 239.341 -6.406 -8.209 374 HA ASP 47 HA ASP 47 236.964 -4.830 -8.527 375 1HB ASP 47 HB2 ASP 47 237.635 -7.712 -8.419 376 2HB ASP 47 HB1 ASP 47 236.027 -7.283 -7.840 377 H GLY 48 HN GLY 48 238.649 -6.499 -5.951 378 1HA GLY 48 HA2 GLY 48 236.593 -6.051 -3.981 379 2HA GLY 48 HA1 GLY 48 238.214 -6.657 -3.679 380 H ALA 49 HN ALA 49 239.512 -4.410 -4.996 381 HA ALA 49 HA ALA 49 239.613 -2.607 -2.764 382 1HB ALA 49 HB1 ALA 49 241.479 -1.681 -3.762 383 2HB ALA 49 HB2 ALA 49 240.899 -2.002 -5.396 384 3HB ALA 49 HB3 ALA 49 241.517 -3.319 -4.405 385 H ARG 50 HN ARG 50 238.239 -2.655 -5.978 386 HA ARG 50 HA ARG 50 237.539 0.074 -6.143 387 1HB ARG 50 HB2 ARG 50 236.848 -2.415 -7.596 388 2HB ARG 50 HB1 ARG 50 235.698 -1.093 -7.729 389 1HG ARG 50 HG2 ARG 50 237.830 0.309 -8.299 390 2HG ARG 50 HG1 ARG 50 238.505 -1.271 -8.703 391 1HD ARG 50 HD2 ARG 50 236.217 -1.514 -10.004 392 2HD ARG 50 HD1 ARG 50 236.300 0.247 -9.999 393 HE ARG 50 HE ARG 50 238.749 -0.475 -10.880 394 1HH1 ARG 50 HH11 ARG 50 235.517 -1.344 -11.868 395 2HH1 ARG 50 HH12 ARG 50 235.957 -1.598 -13.524 396 1HH2 ARG 50 HH21 ARG 50 239.330 -0.808 -13.057 397 2HH2 ARG 50 HH22 ARG 50 238.121 -1.294 -14.199 398 H ARG 51 HN ARG 51 235.576 -2.802 -5.359 399 HA ARG 51 HA ARG 51 233.277 -1.297 -4.649 400 1HB ARG 51 HB2 ARG 51 232.476 -3.421 -3.616 401 2HB ARG 51 HB1 ARG 51 232.991 -3.587 -5.287 402 1HG ARG 51 HG2 ARG 51 235.282 -4.232 -4.071 403 2HG ARG 51 HG1 ARG 51 234.138 -4.729 -2.822 404 1HD ARG 51 HD2 ARG 51 233.419 -5.541 -5.550 405 2HD ARG 51 HD1 ARG 51 234.897 -6.271 -4.927 406 HE ARG 51 HE ARG 51 233.074 -6.576 -2.915 407 1HH1 ARG 51 HH11 ARG 51 233.199 -7.474 -6.285 408 2HH1 ARG 51 HH12 ARG 51 232.215 -8.883 -6.074 409 1HH2 ARG 51 HH21 ARG 51 231.780 -8.429 -2.637 410 2HH2 ARG 51 HH22 ARG 51 231.409 -9.426 -4.004 411 H GLU 52 HN GLU 52 236.121 -2.240 -2.915 412 HA GLU 52 HA GLU 52 235.005 -1.616 -0.312 413 1HB GLU 52 HB2 GLU 52 237.709 -2.489 -1.291 414 2HB GLU 52 HB1 GLU 52 237.521 -1.842 0.328 415 1HG GLU 52 HG2 GLU 52 237.448 -4.382 -0.004 416 2HG GLU 52 HG1 GLU 52 236.249 -3.630 1.044 417 H LEU 53 HN LEU 53 236.594 -0.038 -2.894 418 HA LEU 53 HA LEU 53 237.757 2.098 -1.412 419 1HB LEU 53 HB2 LEU 53 238.717 1.573 -3.513 420 2HB LEU 53 HB1 LEU 53 237.161 1.628 -4.322 421 HG LEU 53 HG LEU 53 237.066 4.051 -3.959 422 1HD1 LEU 53 HD11 LEU 53 238.491 5.167 -2.652 423 2HD1 LEU 53 HD12 LEU 53 239.890 4.291 -3.269 424 3HD1 LEU 53 HD13 LEU 53 238.900 3.584 -1.994 425 1HD2 LEU 53 HD21 LEU 53 239.225 2.732 -5.504 426 2HD2 LEU 53 HD22 LEU 53 239.282 4.490 -5.364 427 3HD2 LEU 53 HD23 LEU 53 237.864 3.704 -6.058 428 H GLN 54 HN GLN 54 234.915 1.825 -3.522 429 HA GLN 54 HA GLN 54 233.971 4.439 -3.207 430 1HB GLN 54 HB2 GLN 54 232.937 3.313 -4.931 431 2HB GLN 54 HB1 GLN 54 232.742 1.838 -3.998 432 1HG GLN 54 HG2 GLN 54 230.911 2.796 -2.769 433 2HG GLN 54 HG1 GLN 54 231.162 4.360 -3.544 434 1HE2 GLN 54 HE21 GLN 54 230.840 0.986 -4.610 435 2HE2 GLN 54 HE22 GLN 54 229.659 1.306 -5.830 436 H GLU 55 HN GLU 55 233.817 1.701 -1.109 437 HA GLU 55 HA GLU 55 231.669 2.724 0.513 438 1HB GLU 55 HB2 GLU 55 233.483 0.338 0.726 439 2HB GLU 55 HB1 GLU 55 232.361 0.765 2.010 440 1HG GLU 55 HG2 GLU 55 231.160 0.660 -0.655 441 2HG GLU 55 HG1 GLU 55 231.802 -0.877 -0.078 442 H GLU 56 HN GLU 56 235.121 3.037 0.511 443 HA GLU 56 HA GLU 56 235.275 3.615 3.320 444 1HB GLU 56 HB2 GLU 56 237.173 3.353 1.093 445 2HB GLU 56 HB1 GLU 56 237.645 4.496 2.343 446 1HG GLU 56 HG2 GLU 56 236.683 2.128 3.593 447 2HG GLU 56 HG1 GLU 56 237.863 1.683 2.361 448 H SER 57 HN SER 57 235.429 5.604 0.362 449 HA SER 57 HA SER 57 234.921 7.933 2.091 450 1HB SER 57 HB2 SER 57 236.999 7.640 -0.060 451 2HB SER 57 HB1 SER 57 236.364 9.226 0.374 452 HG SER 57 HG SER 57 236.942 8.560 2.612 453 H GLY 58 HN GLY 58 233.205 6.224 0.304 454 1HA GLY 58 HA2 GLY 58 231.499 6.518 -1.200 455 2HA GLY 58 HA1 GLY 58 231.512 8.195 -0.676 456 H LEU 59 HN LEU 59 234.464 7.111 -2.013 457 HA LEU 59 HA LEU 59 233.858 8.550 -4.504 458 1HB LEU 59 HB2 LEU 59 236.473 8.046 -3.096 459 2HB LEU 59 HB1 LEU 59 236.339 8.774 -4.684 460 HG LEU 59 HG LEU 59 235.664 9.916 -2.016 461 1HD1 LEU 59 HD11 LEU 59 237.735 10.239 -3.732 462 2HD1 LEU 59 HD12 LEU 59 237.213 11.452 -2.563 463 3HD1 LEU 59 HD13 LEU 59 236.672 11.551 -4.238 464 1HD2 LEU 59 HD21 LEU 59 234.348 11.685 -3.051 465 2HD2 LEU 59 HD22 LEU 59 233.580 10.116 -3.299 466 3HD2 LEU 59 HD23 LEU 59 234.471 10.880 -4.616 467 H THR 60 HN THR 60 233.339 7.190 -6.044 468 HA THR 60 HA THR 60 234.534 4.551 -6.176 469 HB THR 60 HB THR 60 232.864 5.362 -8.431 470 HG1 THR 60 HG1 THR 60 231.035 5.793 -7.345 471 1HG2 THR 60 HG21 THR 60 233.346 3.050 -6.857 472 2HG2 THR 60 HG22 THR 60 232.442 3.193 -8.365 473 3HG2 THR 60 HG23 THR 60 231.620 3.407 -6.819 474 H VAL 61 HN VAL 61 235.222 3.868 -8.514 475 HA VAL 61 HA VAL 61 236.658 6.072 -9.813 476 HB VAL 61 HB VAL 61 238.700 4.774 -10.006 477 1HG1 VAL 61 HG11 VAL 61 239.241 4.629 -7.497 478 2HG1 VAL 61 HG12 VAL 61 237.602 5.237 -7.258 479 3HG1 VAL 61 HG13 VAL 61 238.774 6.192 -8.165 480 1HG2 VAL 61 HG21 VAL 61 238.421 2.545 -9.965 481 2HG2 VAL 61 HG22 VAL 61 236.999 2.640 -8.928 482 3HG2 VAL 61 HG23 VAL 61 238.613 2.725 -8.221 483 H ASP 62 HN ASP 62 236.901 5.913 -11.986 484 HA ASP 62 HA ASP 62 235.238 3.984 -13.332 485 1HB ASP 62 HB2 ASP 62 236.954 6.264 -14.333 486 2HB ASP 62 HB1 ASP 62 236.014 5.221 -15.397 487 H ALA 63 HN ALA 63 238.549 4.289 -12.483 488 HA ALA 63 HA ALA 63 239.227 1.711 -13.293 489 1HB ALA 63 HB1 ALA 63 240.106 1.836 -15.360 490 2HB ALA 63 HB2 ALA 63 240.762 3.453 -15.098 491 3HB ALA 63 HB3 ALA 63 239.061 3.249 -15.513 492 H LEU 64 HN LEU 64 240.191 1.717 -11.252 493 HA LEU 64 HA LEU 64 242.003 3.565 -10.214 494 1HB LEU 64 HB2 LEU 64 241.513 0.647 -9.809 495 2HB LEU 64 HB1 LEU 64 242.979 1.333 -9.141 496 HG LEU 64 HG LEU 64 240.585 2.878 -8.482 497 1HD1 LEU 64 HD11 LEU 64 239.809 0.439 -8.571 498 2HD1 LEU 64 HD12 LEU 64 239.508 1.349 -7.090 499 3HD1 LEU 64 HD13 LEU 64 240.845 0.201 -7.164 500 1HD2 LEU 64 HD21 LEU 64 241.751 3.315 -6.606 501 2HD2 LEU 64 HD22 LEU 64 243.109 2.694 -7.543 502 3HD2 LEU 64 HD23 LEU 64 242.266 1.641 -6.407 503 H HIS 65 HN HIS 65 244.418 2.667 -9.729 504 HA HIS 65 HA HIS 65 245.581 1.725 -12.253 505 1HB HIS 65 HB2 HIS 65 245.686 4.351 -11.651 506 2HB HIS 65 HB1 HIS 65 247.127 3.796 -10.805 507 HD1 HIS 65 HD1 HIS 65 246.138 5.071 -13.960 508 HD2 HIS 65 HD2 HIS 65 248.794 2.125 -12.723 509 HE1 HIS 65 HE1 HIS 65 247.710 4.729 -15.893 510 HE2 HIS 65 HE2 HIS 65 249.360 3.003 -15.089 511 H LYS 66 HN LYS 66 246.262 -0.241 -11.568 512 HA LYS 66 HA LYS 66 247.282 -0.820 -9.003 513 1HB LYS 66 HB2 LYS 66 248.132 -2.904 -10.036 514 2HB LYS 66 HB1 LYS 66 246.452 -2.590 -10.450 515 1HG LYS 66 HG2 LYS 66 248.315 -1.465 -12.379 516 2HG LYS 66 HG1 LYS 66 248.472 -3.214 -12.207 517 1HD LYS 66 HD2 LYS 66 245.775 -2.945 -12.294 518 2HD LYS 66 HD1 LYS 66 246.277 -1.608 -13.332 519 1HE LYS 66 HE2 LYS 66 247.825 -3.398 -14.419 520 2HE LYS 66 HE1 LYS 66 246.713 -4.547 -13.674 521 1HZ LYS 66 HZ1 LYS 66 244.988 -2.901 -14.829 522 2HZ LYS 66 HZ2 LYS 66 245.629 -4.257 -15.613 523 3HZ LYS 66 HZ3 LYS 66 246.286 -2.725 -15.901 524 H VAL 67 HN VAL 67 249.293 -0.632 -8.136 525 HA VAL 67 HA VAL 67 251.423 0.257 -9.980 526 HB VAL 67 HB VAL 67 252.305 1.681 -8.139 527 1HG1 VAL 67 HG11 VAL 67 250.597 2.335 -10.040 528 2HG1 VAL 67 HG12 VAL 67 251.064 3.490 -8.791 529 3HG1 VAL 67 HG13 VAL 67 249.532 2.625 -8.665 530 1HG2 VAL 67 HG21 VAL 67 250.475 2.315 -6.428 531 2HG2 VAL 67 HG22 VAL 67 251.417 0.849 -6.164 532 3HG2 VAL 67 HG23 VAL 67 249.785 0.744 -6.824 533 H GLY 68 HN GLY 68 250.842 -1.133 -6.737 534 1HA GLY 68 HA2 GLY 68 253.145 -2.881 -7.221 535 2HA GLY 68 HA1 GLY 68 253.177 -1.861 -5.793 536 H GLN 69 HN GLN 69 253.459 -4.424 -5.348 537 HA GLN 69 HA GLN 69 250.872 -5.227 -4.204 538 1HB GLN 69 HB2 GLN 69 251.556 -6.566 -6.268 539 2HB GLN 69 HB1 GLN 69 252.869 -7.209 -5.290 540 1HG GLN 69 HG2 GLN 69 250.882 -7.751 -3.633 541 2HG GLN 69 HG1 GLN 69 249.953 -7.717 -5.131 542 1HE2 GLN 69 HE21 GLN 69 250.375 -9.251 -6.727 543 2HE2 GLN 69 HE22 GLN 69 251.248 -10.703 -6.393 544 H ILE 70 HN ILE 70 251.047 -5.213 -2.070 545 HA ILE 70 HA ILE 70 253.676 -5.700 -0.859 546 HB ILE 70 HB ILE 70 251.216 -4.528 0.437 547 1HG1 ILE 70 HG12 ILE 70 253.654 -2.943 -0.288 548 2HG1 ILE 70 HG11 ILE 70 252.425 -3.252 -1.512 549 1HG2 ILE 70 HG21 ILE 70 254.086 -4.557 1.355 550 2HG2 ILE 70 HG22 ILE 70 252.809 -5.603 1.976 551 3HG2 ILE 70 HG23 ILE 70 252.715 -3.859 2.216 552 1HD1 ILE 70 HD11 ILE 70 250.785 -2.328 0.260 553 2HD1 ILE 70 HD12 ILE 70 251.792 -1.211 -0.660 554 3HD1 ILE 70 HD13 ILE 70 252.236 -1.643 0.991 555 H VAL 71 HN VAL 71 253.955 -7.170 0.796 556 HA VAL 71 HA VAL 71 251.733 -9.031 1.302 557 HB VAL 71 HB VAL 71 254.614 -9.859 0.952 558 1HG1 VAL 71 HG11 VAL 71 253.610 -11.432 2.337 559 2HG1 VAL 71 HG12 VAL 71 253.425 -12.131 0.728 560 3HG1 VAL 71 HG13 VAL 71 252.061 -11.323 1.501 561 1HG2 VAL 71 HG21 VAL 71 252.348 -9.719 -0.984 562 2HG2 VAL 71 HG22 VAL 71 253.531 -11.019 -1.127 563 3HG2 VAL 71 HG23 VAL 71 254.053 -9.337 -1.220 564 H PHE 72 HN PHE 72 251.714 -10.018 3.346 565 HA PHE 72 HA PHE 72 253.573 -8.857 5.309 566 1HB PHE 72 HB2 PHE 72 250.599 -9.314 5.601 567 2HB PHE 72 HB1 PHE 72 251.668 -8.887 6.934 568 HD1 PHE 72 HD1 PHE 72 251.622 -6.692 7.558 569 HD2 PHE 72 HD2 PHE 72 250.981 -7.668 3.466 570 HE1 PHE 72 HE1 PHE 72 251.319 -4.307 7.040 571 HE2 PHE 72 HE2 PHE 72 250.679 -5.285 2.940 572 HZ PHE 72 HZ PHE 72 250.847 -3.600 4.729 573 H GLU 73 HN GLU 73 254.766 -10.367 6.232 574 HA GLU 73 HA GLU 73 253.743 -13.115 6.356 575 1HB GLU 73 HB2 GLU 73 256.563 -12.070 6.684 576 2HB GLU 73 HB1 GLU 73 256.094 -13.764 6.734 577 1HG GLU 73 HG2 GLU 73 255.084 -13.168 4.361 578 2HG GLU 73 HG1 GLU 73 256.331 -11.924 4.425 579 H PHE 74 HN PHE 74 253.038 -13.886 8.238 580 HA PHE 74 HA PHE 74 253.489 -12.340 10.657 581 1HB PHE 74 HB2 PHE 74 251.854 -14.853 10.235 582 2HB PHE 74 HB1 PHE 74 251.852 -13.851 11.683 583 HD1 PHE 74 HD1 PHE 74 250.037 -14.609 8.875 584 HD2 PHE 74 HD2 PHE 74 251.438 -11.232 11.054 585 HE1 PHE 74 HE1 PHE 74 248.223 -13.246 7.922 586 HE2 PHE 74 HE2 PHE 74 249.626 -9.864 10.106 587 HZ PHE 74 HZ PHE 74 248.017 -10.870 8.538 588 H VAL 75 HN VAL 75 254.810 -12.798 12.229 589 HA VAL 75 HA VAL 75 256.690 -14.939 11.895 590 HB VAL 75 HB VAL 75 256.740 -13.569 14.481 591 1HG1 VAL 75 HG11 VAL 75 259.085 -13.040 13.348 592 2HG1 VAL 75 HG12 VAL 75 258.576 -14.372 12.309 593 3HG1 VAL 75 HG13 VAL 75 258.705 -14.612 14.051 594 1HG2 VAL 75 HG21 VAL 75 257.749 -11.495 13.206 595 2HG2 VAL 75 HG22 VAL 75 256.031 -11.589 13.590 596 3HG2 VAL 75 HG23 VAL 75 256.596 -11.988 11.966 597 H GLY 76 HN GLY 76 256.094 -16.946 12.380 598 1HA GLY 76 HA2 GLY 76 255.802 -18.589 14.102 599 2HA GLY 76 HA1 GLY 76 254.866 -17.412 15.012 600 H GLU 77 HN GLU 77 253.494 -16.696 12.370 601 HA GLU 77 HA GLU 77 251.516 -18.859 12.521 602 1HB GLU 77 HB2 GLU 77 251.361 -15.953 11.822 603 2HB GLU 77 HB1 GLU 77 250.142 -17.055 11.198 604 1HG GLU 77 HG2 GLU 77 250.656 -17.329 14.064 605 2HG GLU 77 HG1 GLU 77 250.014 -15.760 13.582 606 HA PRO 78 HA PRO 78 252.682 -20.220 8.469 607 1HB PRO 78 HB2 PRO 78 250.435 -21.585 7.798 608 2HB PRO 78 HB1 PRO 78 251.615 -22.195 8.963 609 1HG PRO 78 HG2 PRO 78 249.003 -20.818 9.456 610 2HG PRO 78 HG1 PRO 78 249.698 -22.227 10.277 611 1HD PRO 78 HD2 PRO 78 249.787 -19.731 11.329 612 2HD PRO 78 HD1 PRO 78 251.058 -20.935 11.614 613 H GLU 79 HN GLU 79 249.345 -18.990 8.760 614 HA GLU 79 HA GLU 79 249.011 -18.327 6.061 615 1HB GLU 79 HB2 GLU 79 247.461 -18.224 8.363 616 2HB GLU 79 HB1 GLU 79 247.590 -16.541 7.868 617 1HG GLU 79 HG2 GLU 79 246.760 -17.119 5.655 618 2HG GLU 79 HG1 GLU 79 246.651 -18.812 6.133 619 H LEU 80 HN LEU 80 248.528 -15.967 5.404 620 HA LEU 80 HA LEU 80 250.377 -14.026 6.532 621 1HB LEU 80 HB2 LEU 80 250.566 -14.303 3.587 622 2HB LEU 80 HB1 LEU 80 251.780 -13.801 4.746 623 HG LEU 80 HG LEU 80 250.928 -16.669 4.619 624 1HD1 LEU 80 HD11 LEU 80 252.489 -17.167 2.925 625 2HD1 LEU 80 HD12 LEU 80 253.146 -15.530 2.943 626 3HD1 LEU 80 HD13 LEU 80 251.524 -15.823 2.316 627 1HD2 LEU 80 HD21 LEU 80 252.535 -15.400 6.338 628 2HD2 LEU 80 HD22 LEU 80 253.712 -15.789 5.082 629 3HD2 LEU 80 HD23 LEU 80 252.784 -17.077 5.850 630 H MET 81 HN MET 81 250.274 -12.130 4.525 631 HA MET 81 HA MET 81 247.468 -11.768 3.845 632 1HB MET 81 HB2 MET 81 248.348 -10.660 6.163 633 2HB MET 81 HB1 MET 81 248.704 -9.364 5.030 634 1HG MET 81 HG2 MET 81 246.250 -9.773 4.242 635 2HG MET 81 HG1 MET 81 246.076 -10.514 5.831 636 1HE MET 81 HE1 MET 81 247.716 -7.756 4.025 637 2HE MET 81 HE2 MET 81 248.303 -6.820 5.400 638 3HE MET 81 HE3 MET 81 246.845 -6.314 4.547 639 H ASP 82 HN ASP 82 247.558 -11.414 1.715 640 HA ASP 82 HA ASP 82 249.775 -9.794 0.660 641 1HB ASP 82 HB2 ASP 82 249.565 -12.049 -0.299 642 2HB ASP 82 HB1 ASP 82 247.911 -11.693 -0.788 643 H VAL 83 HN VAL 83 249.133 -7.707 0.702 644 HA VAL 83 HA VAL 83 246.468 -7.058 -0.372 645 HB VAL 83 HB VAL 83 246.864 -6.285 1.930 646 1HG1 VAL 83 HG11 VAL 83 248.724 -4.157 1.163 647 2HG1 VAL 83 HG12 VAL 83 249.416 -5.778 1.125 648 3HG1 VAL 83 HG13 VAL 83 248.685 -5.167 2.608 649 1HG2 VAL 83 HG21 VAL 83 246.357 -3.844 1.501 650 2HG2 VAL 83 HG22 VAL 83 245.305 -5.008 0.694 651 3HG2 VAL 83 HG23 VAL 83 246.580 -4.194 -0.213 652 H HIS 84 HN HIS 84 246.450 -6.365 -2.388 653 HA HIS 84 HA HIS 84 248.831 -5.420 -3.691 654 1HB HIS 84 HB2 HIS 84 246.495 -6.609 -4.556 655 2HB HIS 84 HB1 HIS 84 246.292 -4.939 -5.078 656 HD1 HIS 84 HD1 HIS 84 247.732 -8.055 -6.131 657 HD2 HIS 84 HD2 HIS 84 248.659 -4.039 -6.663 658 HE1 HIS 84 HE1 HIS 84 249.268 -7.977 -8.121 659 HE2 HIS 84 HE2 HIS 84 249.883 -5.546 -8.371 660 H VAL 85 HN VAL 85 248.890 -3.300 -4.838 661 HA VAL 85 HA VAL 85 247.486 -1.261 -3.237 662 HB VAL 85 HB VAL 85 250.183 -0.978 -4.584 663 1HG1 VAL 85 HG11 VAL 85 248.496 1.027 -4.071 664 2HG1 VAL 85 HG12 VAL 85 250.244 1.187 -3.896 665 3HG1 VAL 85 HG13 VAL 85 249.238 0.880 -2.480 666 1HG2 VAL 85 HG21 VAL 85 249.788 -0.984 -1.627 667 2HG2 VAL 85 HG22 VAL 85 251.225 -1.377 -2.570 668 3HG2 VAL 85 HG23 VAL 85 249.884 -2.518 -2.492 669 H PHE 86 HN PHE 86 246.399 0.303 -4.277 670 HA PHE 86 HA PHE 86 246.651 0.512 -7.191 671 1HB PHE 86 HB2 PHE 86 244.187 -0.110 -5.590 672 2HB PHE 86 HB1 PHE 86 244.044 0.768 -7.109 673 HD1 PHE 86 HD1 PHE 86 243.807 -0.428 -9.068 674 HD2 PHE 86 HD2 PHE 86 245.594 -2.313 -5.698 675 HE1 PHE 86 HE1 PHE 86 243.877 -2.556 -10.301 676 HE2 PHE 86 HE2 PHE 86 245.670 -4.443 -6.925 677 HZ PHE 86 HZ PHE 86 244.810 -4.567 -9.230 678 H CYS 87 HN CYS 87 246.380 2.526 -8.008 679 HA CYS 87 HA CYS 87 245.598 4.672 -6.139 680 1HB CYS 87 HB2 CYS 87 248.059 4.357 -7.737 681 2HB CYS 87 HB1 CYS 87 247.284 5.928 -7.907 682 HG CYS 87 HG CYS 87 247.437 5.776 -5.094 683 H THR 88 HN THR 88 243.777 5.613 -6.895 684 HA THR 88 HA THR 88 243.192 5.384 -9.754 685 HB THR 88 HB THR 88 241.539 4.580 -8.047 686 HG1 THR 88 HG1 THR 88 240.238 6.603 -9.432 687 1HG2 THR 88 HG21 THR 88 241.943 6.843 -6.701 688 2HG2 THR 88 HG22 THR 88 240.466 5.887 -6.592 689 3HG2 THR 88 HG23 THR 88 240.526 7.301 -7.644 690 H ASP 89 HN ASP 89 241.661 7.329 -10.445 691 HA ASP 89 HA ASP 89 242.600 9.903 -9.500 692 1HB ASP 89 HB2 ASP 89 244.268 9.114 -11.241 693 2HB ASP 89 HB1 ASP 89 242.957 9.180 -12.415 694 H SER 90 HN SER 90 240.801 8.147 -11.988 695 HA SER 90 HA SER 90 238.861 10.289 -12.234 696 1HB SER 90 HB2 SER 90 239.774 8.367 -13.987 697 2HB SER 90 HB1 SER 90 238.211 7.712 -13.495 698 HG SER 90 HG SER 90 238.405 9.333 -15.348 699 H ILE 91 HN ILE 91 237.690 10.433 -10.373 700 HA ILE 91 HA ILE 91 236.496 7.976 -9.312 701 HB ILE 91 HB ILE 91 235.926 9.305 -7.304 702 1HG1 ILE 91 HG12 ILE 91 237.670 11.504 -8.393 703 2HG1 ILE 91 HG11 ILE 91 235.938 11.494 -8.704 704 1HG2 ILE 91 HG21 ILE 91 238.262 9.602 -6.502 705 2HG2 ILE 91 HG22 ILE 91 238.821 9.329 -8.152 706 3HG2 ILE 91 HG23 ILE 91 237.972 8.049 -7.286 707 1HD1 ILE 91 HD11 ILE 91 235.843 11.178 -6.081 708 2HD1 ILE 91 HD12 ILE 91 235.980 12.768 -6.829 709 3HD1 ILE 91 HD13 ILE 91 237.415 11.971 -6.184 710 H GLN 92 HN GLN 92 234.267 8.560 -8.160 711 HA GLN 92 HA GLN 92 232.623 10.132 -10.014 712 1HB GLN 92 HB2 GLN 92 232.215 7.252 -9.251 713 2HB GLN 92 HB1 GLN 92 230.890 8.254 -9.823 714 1HG GLN 92 HG2 GLN 92 233.260 8.349 -11.524 715 2HG GLN 92 HG1 GLN 92 232.535 6.748 -11.391 716 1HE2 GLN 92 HE21 GLN 92 230.609 6.344 -12.359 717 2HE2 GLN 92 HE22 GLN 92 229.773 7.482 -13.354 718 H GLY 93 HN GLY 93 232.013 7.983 -7.241 719 1HA GLY 93 HA2 GLY 93 229.944 9.400 -6.107 720 2HA GLY 93 HA1 GLY 93 231.056 8.393 -5.195 721 H THR 94 HN THR 94 230.157 10.339 -3.753 722 HA THR 94 HA THR 94 232.050 12.570 -3.938 723 HB THR 94 HB THR 94 229.872 12.802 -2.001 724 HG1 THR 94 HG1 THR 94 229.292 12.549 -4.760 725 1HG2 THR 94 HG21 THR 94 231.354 14.514 -3.786 726 2HG2 THR 94 HG22 THR 94 230.429 14.918 -2.339 727 3HG2 THR 94 HG23 THR 94 229.618 14.800 -3.899 728 HA PRO 95 HA PRO 95 234.145 11.483 -0.254 729 1HB PRO 95 HB2 PRO 95 233.914 14.211 0.810 730 2HB PRO 95 HB1 PRO 95 235.355 13.337 0.284 731 1HG PRO 95 HG2 PRO 95 234.355 15.392 -1.115 732 2HG PRO 95 HG1 PRO 95 235.125 14.001 -1.901 733 1HD PRO 95 HD2 PRO 95 232.213 14.609 -1.555 734 2HD PRO 95 HD1 PRO 95 233.071 13.996 -2.985 735 H VAL 96 HN VAL 96 231.804 10.569 -0.008 736 HA VAL 96 HA VAL 96 230.198 11.760 2.050 737 HB VAL 96 HB VAL 96 230.079 8.909 1.059 738 1HG1 VAL 96 HG11 VAL 96 227.696 10.438 1.944 739 2HG1 VAL 96 HG12 VAL 96 228.821 9.876 3.181 740 3HG1 VAL 96 HG13 VAL 96 228.061 8.719 2.090 741 1HG2 VAL 96 HG21 VAL 96 229.685 9.876 -0.938 742 2HG2 VAL 96 HG22 VAL 96 229.280 11.437 -0.224 743 3HG2 VAL 96 HG23 VAL 96 228.080 10.146 -0.259 744 H GLU 97 HN GLU 97 232.425 11.824 3.282 745 HA GLU 97 HA GLU 97 233.588 9.716 4.565 746 1HB GLU 97 HB2 GLU 97 234.220 11.226 6.325 747 2HB GLU 97 HB1 GLU 97 234.225 12.117 4.810 748 1HG GLU 97 HG2 GLU 97 231.734 12.650 5.603 749 2HG GLU 97 HG1 GLU 97 232.489 12.409 7.176 750 H SER 98 HN SER 98 232.902 8.135 5.845 751 HA SER 98 HA SER 98 230.224 8.244 6.955 752 1HB SER 98 HB2 SER 98 230.379 5.918 7.239 753 2HB SER 98 HB1 SER 98 231.312 6.214 5.771 754 HG SER 98 HG SER 98 233.176 6.326 7.282 755 H ASP 99 HN ASP 99 230.304 6.800 9.208 756 HA ASP 99 HA ASP 99 231.240 8.680 11.122 757 1HB ASP 99 HB2 ASP 99 230.168 5.881 11.519 758 2HB ASP 99 HB1 ASP 99 230.392 7.077 12.793 759 H GLU 100 HN GLU 100 232.871 6.227 9.493 760 HA GLU 100 HA GLU 100 234.961 6.238 11.558 761 1HB GLU 100 HB2 GLU 100 233.702 3.903 10.199 762 2HB GLU 100 HB1 GLU 100 235.417 3.820 10.578 763 1HG GLU 100 HG2 GLU 100 235.060 3.670 12.801 764 2HG GLU 100 HG1 GLU 100 233.635 4.705 12.755 765 H MET 101 HN MET 101 234.294 7.302 8.602 766 HA MET 101 HA MET 101 237.085 7.038 7.750 767 1HB MET 101 HB2 MET 101 234.896 5.787 6.451 768 2HB MET 101 HB1 MET 101 235.422 7.110 5.420 769 1HG MET 101 HG2 MET 101 236.520 4.981 4.885 770 2HG MET 101 HG1 MET 101 237.661 6.240 5.355 771 1HE MET 101 HE1 MET 101 239.198 6.152 7.430 772 2HE MET 101 HE2 MET 101 239.704 5.063 6.137 773 3HE MET 101 HE3 MET 101 239.773 4.531 7.817 774 H ARG 102 HN ARG 102 237.679 8.667 6.081 775 HA ARG 102 HA ARG 102 236.044 10.915 5.571 776 1HB ARG 102 HB2 ARG 102 236.361 11.351 7.953 777 2HB ARG 102 HB1 ARG 102 238.104 11.231 7.766 778 1HG ARG 102 HG2 ARG 102 237.520 13.164 5.953 779 2HG ARG 102 HG1 ARG 102 236.290 13.458 7.184 780 1HD ARG 102 HD2 ARG 102 237.838 13.974 8.803 781 2HD ARG 102 HD1 ARG 102 239.110 13.017 8.042 782 HE ARG 102 HE ARG 102 238.517 15.124 6.328 783 1HH1 ARG 102 HH11 ARG 102 239.819 14.666 9.533 784 2HH1 ARG 102 HH12 ARG 102 240.796 16.095 9.476 785 1HH2 ARG 102 HH21 ARG 102 239.800 17.004 6.251 786 2HH2 ARG 102 HH22 ARG 102 240.785 17.423 7.613 787 HA PRO 103 HA PRO 103 239.567 10.720 2.713 788 1HB PRO 103 HB2 PRO 103 238.371 11.966 0.652 789 2HB PRO 103 HB1 PRO 103 238.010 10.283 1.057 790 1HG PRO 103 HG2 PRO 103 236.480 12.766 1.752 791 2HG PRO 103 HG1 PRO 103 235.871 11.222 1.125 792 1HD PRO 103 HD2 PRO 103 235.774 11.876 3.757 793 2HD PRO 103 HD1 PRO 103 235.966 10.203 3.196 794 H CYS 104 HN CYS 104 241.196 12.112 2.939 795 HA CYS 104 HA CYS 104 240.570 14.982 3.153 796 1HB CYS 104 HB2 CYS 104 243.092 13.635 4.121 797 2HB CYS 104 HB1 CYS 104 242.521 15.257 4.499 798 HG CYS 104 HG CYS 104 241.302 12.659 5.688 799 H TRP 105 HN TRP 105 241.092 16.165 1.456 800 HA TRP 105 HA TRP 105 242.856 15.120 -0.584 801 1HB TRP 105 HB2 TRP 105 241.344 17.739 -0.432 802 2HB TRP 105 HB1 TRP 105 242.210 17.144 -1.845 803 HD1 TRP 105 HD1 TRP 105 239.532 15.499 0.462 804 HE1 TRP 105 HE1 TRP 105 237.719 14.463 -1.051 805 HE3 TRP 105 HE3 TRP 105 241.419 16.847 -4.095 806 HZ2 TRP 105 HZ2 TRP 105 237.171 14.251 -3.811 807 HZ3 TRP 105 HZ3 TRP 105 240.189 16.187 -6.122 808 HH2 TRP 105 HH2 TRP 105 238.110 14.916 -5.981 809 H PHE 106 HN PHE 106 244.965 15.219 -0.088 810 HA PHE 106 HA PHE 106 246.024 17.734 1.020 811 1HB PHE 106 HB2 PHE 106 246.332 15.120 1.921 812 2HB PHE 106 HB1 PHE 106 247.846 15.458 1.090 813 HD1 PHE 106 HD1 PHE 106 247.895 18.452 1.710 814 HD2 PHE 106 HD2 PHE 106 247.177 15.020 4.119 815 HE1 PHE 106 HE1 PHE 106 248.702 19.676 3.687 816 HE2 PHE 106 HE2 PHE 106 247.981 16.237 6.102 817 HZ PHE 106 HZ PHE 106 248.745 18.568 5.886 818 H GLN 107 HN GLN 107 248.744 17.178 0.452 819 HA GLN 107 HA GLN 107 248.747 17.668 -2.440 820 1HB GLN 107 HB2 GLN 107 249.712 19.396 -0.903 821 2HB GLN 107 HB1 GLN 107 250.950 18.231 -0.456 822 1HG GLN 107 HG2 GLN 107 252.162 19.036 -2.125 823 2HG GLN 107 HG1 GLN 107 251.021 18.260 -3.222 824 1HE2 GLN 107 HE21 GLN 107 248.808 19.799 -2.970 825 2HE2 GLN 107 HE22 GLN 107 249.128 21.406 -3.516 826 H LEU 108 HN LEU 108 250.084 16.539 -3.821 827 HA LEU 108 HA LEU 108 250.670 13.857 -3.094 828 1HB LEU 108 HB2 LEU 108 251.194 13.518 -5.333 829 2HB LEU 108 HB1 LEU 108 250.039 14.833 -5.397 830 HG LEU 108 HG LEU 108 253.037 15.096 -5.638 831 1HD1 LEU 108 HD11 LEU 108 252.353 14.257 -7.678 832 2HD1 LEU 108 HD12 LEU 108 252.243 15.998 -7.936 833 3HD1 LEU 108 HD13 LEU 108 250.786 15.062 -7.602 834 1HD2 LEU 108 HD21 LEU 108 250.932 17.227 -5.941 835 2HD2 LEU 108 HD22 LEU 108 252.680 17.429 -6.019 836 3HD2 LEU 108 HD23 LEU 108 251.910 17.004 -4.492 837 H ASP 109 HN ASP 109 252.393 16.694 -2.602 838 HA ASP 109 HA ASP 109 254.904 15.186 -2.320 839 1HB ASP 109 HB2 ASP 109 254.633 17.257 -3.989 840 2HB ASP 109 HB1 ASP 109 254.959 18.159 -2.513 841 H GLN 110 HN GLN 110 252.569 15.695 -0.468 842 HA GLN 110 HA GLN 110 254.190 16.445 1.813 843 1HB GLN 110 HB2 GLN 110 251.538 17.808 1.391 844 2HB GLN 110 HB1 GLN 110 252.739 18.146 2.629 845 1HG GLN 110 HG2 GLN 110 254.290 18.851 0.789 846 2HG GLN 110 HG1 GLN 110 252.920 18.725 -0.313 847 1HE2 GLN 110 HE21 GLN 110 254.371 20.514 2.267 848 2HE2 GLN 110 HE22 GLN 110 253.312 21.877 2.199 849 H ILE 111 HN ILE 111 252.670 14.053 0.699 850 HA ILE 111 HA ILE 111 250.527 13.610 2.559 851 HB ILE 111 HB ILE 111 251.670 11.113 1.669 852 1HG1 ILE 111 HG12 ILE 111 250.888 11.582 -0.786 853 2HG1 ILE 111 HG11 ILE 111 251.323 13.247 -0.401 854 1HG2 ILE 111 HG21 ILE 111 249.530 10.538 1.420 855 2HG2 ILE 111 HG22 ILE 111 249.102 12.038 0.595 856 3HG2 ILE 111 HG23 ILE 111 249.252 12.009 2.352 857 1HD1 ILE 111 HD11 ILE 111 253.568 12.315 0.328 858 2HD1 ILE 111 HD12 ILE 111 253.220 12.302 -1.401 859 3HD1 ILE 111 HD13 ILE 111 253.076 10.817 -0.461 860 HA PRO 112 HA PRO 112 253.267 12.275 5.800 861 1HB PRO 112 HB2 PRO 112 251.540 12.408 7.816 862 2HB PRO 112 HB1 PRO 112 252.036 13.878 6.969 863 1HG PRO 112 HG2 PRO 112 249.489 12.346 6.771 864 2HG PRO 112 HG1 PRO 112 249.763 14.091 6.641 865 1HD PRO 112 HD2 PRO 112 249.488 12.244 4.509 866 2HD PRO 112 HD1 PRO 112 249.980 13.946 4.392 867 H PHE 113 HN PHE 113 253.751 10.165 5.291 868 HA PHE 113 HA PHE 113 251.807 8.077 5.688 869 1HB PHE 113 HB2 PHE 113 254.599 7.218 5.481 870 2HB PHE 113 HB1 PHE 113 253.194 6.714 4.561 871 HD1 PHE 113 HD1 PHE 113 256.115 7.308 3.733 872 HD2 PHE 113 HD2 PHE 113 252.490 9.536 3.478 873 HE1 PHE 113 HE1 PHE 113 257.000 8.501 1.786 874 HE2 PHE 113 HE2 PHE 113 253.385 10.738 1.531 875 HZ PHE 113 HZ PHE 113 255.636 10.229 0.678 876 H LYS 114 HN LYS 114 254.072 9.721 7.642 877 HA LYS 114 HA LYS 114 254.706 7.678 9.482 878 1HB LYS 114 HB2 LYS 114 254.649 10.688 9.719 879 2HB LYS 114 HB1 LYS 114 255.157 9.644 11.038 880 1HG LYS 114 HG2 LYS 114 256.440 9.721 8.316 881 2HG LYS 114 HG1 LYS 114 257.041 10.562 9.746 882 1HD LYS 114 HD2 LYS 114 256.699 7.577 9.464 883 2HD LYS 114 HD1 LYS 114 258.229 8.453 9.383 884 1HE LYS 114 HE2 LYS 114 257.809 9.269 11.696 885 2HE LYS 114 HE1 LYS 114 256.382 8.236 11.757 886 1HZ LYS 114 HZ1 LYS 114 259.196 7.525 11.911 887 2HZ LYS 114 HZ2 LYS 114 258.222 6.473 11.015 888 3HZ LYS 114 HZ3 LYS 114 257.852 6.793 12.633 889 H ASP 115 HN ASP 115 252.006 9.799 9.014 890 HA ASP 115 HA ASP 115 250.788 8.881 11.495 891 1HB ASP 115 HB2 ASP 115 250.304 11.214 9.689 892 2HB ASP 115 HB1 ASP 115 248.981 10.624 10.691 893 H MET 116 HN MET 116 251.152 7.258 9.045 894 HA MET 116 HA MET 116 248.325 6.642 8.523 895 1HB MET 116 HB2 MET 116 250.620 6.925 6.678 896 2HB MET 116 HB1 MET 116 249.550 5.568 6.366 897 1HG MET 116 HG2 MET 116 247.862 6.878 5.674 898 2HG MET 116 HG1 MET 116 248.228 8.153 6.832 899 1HE MET 116 HE1 MET 116 251.002 6.661 4.531 900 2HE MET 116 HE2 MET 116 250.829 7.608 3.054 901 3HE MET 116 HE3 MET 116 249.586 6.441 3.504 902 H TRP 117 HN TRP 117 251.246 4.876 7.603 903 HA TRP 117 HA TRP 117 250.784 2.850 9.621 904 1HB TRP 117 HB2 TRP 117 249.881 2.549 6.861 905 2HB TRP 117 HB1 TRP 117 250.983 1.268 7.348 906 HD1 TRP 117 HD1 TRP 117 249.830 1.342 10.478 907 HE1 TRP 117 HE1 TRP 117 247.606 0.122 10.912 908 HE3 TRP 117 HE3 TRP 117 248.049 1.174 5.689 909 HZ2 TRP 117 HZ2 TRP 117 245.390 -0.792 9.422 910 HZ3 TRP 117 HZ3 TRP 117 245.868 0.108 5.278 911 HH2 TRP 117 HH2 TRP 117 244.568 -0.854 7.108 912 HA PRO 118 HA PRO 118 255.116 2.204 9.038 913 1HB PRO 118 HB2 PRO 118 255.490 -0.328 9.765 914 2HB PRO 118 HB1 PRO 118 254.850 0.858 10.907 915 1HG PRO 118 HG2 PRO 118 253.400 -1.237 9.341 916 2HG PRO 118 HG1 PRO 118 253.165 -0.735 11.025 917 1HD PRO 118 HD2 PRO 118 251.627 0.119 8.883 918 2HD PRO 118 HD1 PRO 118 251.772 0.968 10.435 919 H ASP 119 HN ASP 119 253.212 1.334 6.649 920 HA ASP 119 HA ASP 119 255.360 -0.029 5.177 921 1HB ASP 119 HB2 ASP 119 253.488 -1.193 3.888 922 2HB ASP 119 HB1 ASP 119 253.792 -1.756 5.528 923 H ASP 120 HN ASP 120 252.902 2.407 5.229 924 HA ASP 120 HA ASP 120 252.430 2.951 2.585 925 1HB ASP 120 HB2 ASP 120 252.621 4.698 4.999 926 2HB ASP 120 HB1 ASP 120 252.382 5.425 3.412 927 H SER 121 HN SER 121 255.088 4.338 4.509 928 HA SER 121 HA SER 121 256.290 5.819 2.485 929 1HB SER 121 HB2 SER 121 258.154 6.017 3.908 930 2HB SER 121 HB1 SER 121 256.797 5.771 5.008 931 HG SER 121 HG SER 121 258.928 4.096 4.400 932 H TYR 122 HN TYR 122 256.188 2.394 2.821 933 HA TYR 122 HA TYR 122 258.612 1.934 1.331 934 1HB TYR 122 HB2 TYR 122 256.529 0.171 2.563 935 2HB TYR 122 HB1 TYR 122 257.657 -0.491 1.386 936 HD1 TYR 122 HD1 TYR 122 260.152 0.886 2.047 937 HD2 TYR 122 HD2 TYR 122 257.158 -0.700 4.621 938 HE1 TYR 122 HE1 TYR 122 261.833 0.601 3.818 939 HE2 TYR 122 HE2 TYR 122 258.831 -0.988 6.399 940 HH TYR 122 HH TYR 122 261.637 0.489 6.544 941 H TRP 123 HN TRP 123 255.122 1.853 0.692 942 HA TRP 123 HA TRP 123 255.749 1.106 -2.064 943 1HB TRP 123 HB2 TRP 123 253.390 0.502 -2.309 944 2HB TRP 123 HB1 TRP 123 254.152 -0.356 -0.978 945 HD1 TRP 123 HD1 TRP 123 253.332 0.240 1.499 946 HE1 TRP 123 HE1 TRP 123 251.182 1.363 2.365 947 HE3 TRP 123 HE3 TRP 123 251.684 2.322 -2.869 948 HZ2 TRP 123 HZ2 TRP 123 249.066 2.935 1.331 949 HZ3 TRP 123 HZ3 TRP 123 249.587 3.609 -2.843 950 HH2 TRP 123 HH2 TRP 123 248.310 3.898 -0.791 951 H PHE 124 HN PHE 124 254.817 3.838 -0.259 952 HA PHE 124 HA PHE 124 253.341 5.114 -2.344 953 1HB PHE 124 HB2 PHE 124 253.530 5.550 0.325 954 2HB PHE 124 HB1 PHE 124 254.561 6.835 -0.287 955 HD1 PHE 124 HD1 PHE 124 251.773 5.763 -2.384 956 HD2 PHE 124 HD2 PHE 124 252.982 8.445 0.687 957 HE1 PHE 124 HE1 PHE 124 249.792 7.151 -2.813 958 HE2 PHE 124 HE2 PHE 124 251.012 9.826 0.270 959 HZ PHE 124 HZ PHE 124 249.407 9.188 -1.483 960 HA PRO 125 HA PRO 125 257.578 7.477 -2.901 961 1HB PRO 125 HB2 PRO 125 259.739 5.793 -2.827 962 2HB PRO 125 HB1 PRO 125 259.225 6.805 -1.472 963 1HG PRO 125 HG2 PRO 125 258.707 3.905 -1.977 964 2HG PRO 125 HG1 PRO 125 259.130 4.723 -0.463 965 1HD PRO 125 HD2 PRO 125 256.612 3.975 -1.025 966 2HD PRO 125 HD1 PRO 125 256.961 5.451 -0.106 967 H LEU 126 HN LEU 126 257.181 4.079 -3.845 968 HA LEU 126 HA LEU 126 258.374 4.503 -6.426 969 1HB LEU 126 HB2 LEU 126 257.507 2.223 -6.936 970 2HB LEU 126 HB1 LEU 126 258.552 2.303 -5.532 971 HG LEU 126 HG LEU 126 255.940 2.613 -4.548 972 1HD1 LEU 126 HD11 LEU 126 254.831 0.583 -5.364 973 2HD1 LEU 126 HD12 LEU 126 256.119 0.365 -6.549 974 3HD1 LEU 126 HD13 LEU 126 255.061 1.772 -6.647 975 1HD2 LEU 126 HD21 LEU 126 257.368 1.503 -3.154 976 2HD2 LEU 126 HD22 LEU 126 258.089 0.562 -4.460 977 3HD2 LEU 126 HD23 LEU 126 256.496 0.131 -3.838 978 H LEU 127 HN LEU 127 255.188 4.625 -5.028 979 HA LEU 127 HA LEU 127 253.618 4.518 -7.350 980 1HB LEU 127 HB2 LEU 127 253.208 6.091 -4.802 981 2HB LEU 127 HB1 LEU 127 251.990 5.899 -6.043 982 HG LEU 127 HG LEU 127 252.662 4.166 -3.848 983 1HD1 LEU 127 HD11 LEU 127 250.453 4.291 -5.876 984 2HD1 LEU 127 HD12 LEU 127 250.434 4.871 -4.211 985 3HD1 LEU 127 HD13 LEU 127 250.482 3.139 -4.542 986 1HD2 LEU 127 HD21 LEU 127 252.485 2.024 -5.053 987 2HD2 LEU 127 HD22 LEU 127 253.972 2.891 -5.426 988 3HD2 LEU 127 HD23 LEU 127 252.640 2.894 -6.580 989 H LEU 128 HN LEU 128 254.996 7.248 -5.588 990 HA LEU 128 HA LEU 128 254.231 9.266 -7.403 991 1HB LEU 128 HB2 LEU 128 256.205 9.024 -5.183 992 2HB LEU 128 HB1 LEU 128 256.359 10.388 -6.274 993 HG LEU 128 HG LEU 128 253.661 9.905 -5.154 994 1HD1 LEU 128 HD11 LEU 128 255.505 11.409 -3.396 995 2HD1 LEU 128 HD12 LEU 128 255.611 9.648 -3.351 996 3HD1 LEU 128 HD13 LEU 128 254.081 10.449 -2.995 997 1HD2 LEU 128 HD21 LEU 128 255.318 12.404 -5.472 998 2HD2 LEU 128 HD22 LEU 128 253.589 12.310 -5.133 999 3HD2 LEU 128 HD23 LEU 128 254.212 11.767 -6.691 1000 H GLN 129 HN GLN 129 256.786 6.945 -7.436 1001 HA GLN 129 HA GLN 129 258.391 8.358 -9.380 1002 1HB GLN 129 HB2 GLN 129 258.992 6.496 -7.503 1003 2HB GLN 129 HB1 GLN 129 258.872 5.480 -8.933 1004 1HG GLN 129 HG2 GLN 129 260.383 7.699 -9.711 1005 2HG GLN 129 HG1 GLN 129 260.979 7.248 -8.115 1006 1HE2 GLN 129 HE21 GLN 129 261.696 6.891 -11.176 1007 2HE2 GLN 129 HE22 GLN 129 262.326 5.282 -11.202 1008 H LYS 130 HN LYS 130 255.516 6.870 -9.656 1009 HA LYS 130 HA LYS 130 254.323 5.931 -11.329 1010 1HB LYS 130 HB2 LYS 130 254.553 6.916 -13.370 1011 2HB LYS 130 HB1 LYS 130 255.573 7.996 -12.437 1012 1HG LYS 130 HG2 LYS 130 257.347 6.066 -13.254 1013 2HG LYS 130 HG1 LYS 130 256.249 6.196 -14.627 1014 1HD LYS 130 HD2 LYS 130 257.534 7.926 -15.242 1015 2HD LYS 130 HD1 LYS 130 256.670 8.818 -13.987 1016 1HE LYS 130 HE2 LYS 130 259.162 9.016 -13.885 1017 2HE LYS 130 HE1 LYS 130 258.408 8.427 -12.405 1018 1HZ LYS 130 HZ1 LYS 130 259.257 6.398 -14.307 1019 2HZ LYS 130 HZ2 LYS 130 259.360 6.410 -12.618 1020 3HZ LYS 130 HZ3 LYS 130 260.498 7.257 -13.541 1021 H LYS 131 HN LYS 131 256.488 4.381 -10.031 1022 HA LYS 131 HA LYS 131 256.908 2.376 -12.151 1023 1HB LYS 131 HB2 LYS 131 258.609 2.926 -9.711 1024 2HB LYS 131 HB1 LYS 131 258.877 1.616 -10.853 1025 1HG LYS 131 HG2 LYS 131 258.717 4.315 -12.019 1026 2HG LYS 131 HG1 LYS 131 260.111 3.997 -10.985 1027 1HD LYS 131 HD2 LYS 131 260.623 3.477 -13.309 1028 2HD LYS 131 HD1 LYS 131 260.646 2.014 -12.322 1029 1HE LYS 131 HE2 LYS 131 258.440 1.409 -13.109 1030 2HE LYS 131 HE1 LYS 131 258.315 2.918 -14.011 1031 1HZ LYS 131 HZ1 LYS 131 260.348 2.134 -15.253 1032 2HZ LYS 131 HZ2 LYS 131 258.918 1.286 -15.562 1033 3HZ LYS 131 HZ3 LYS 131 260.096 0.616 -14.550 1034 H LYS 132 HN LYS 132 256.902 0.123 -11.432 1035 HA LYS 132 HA LYS 132 254.980 -0.265 -9.242 1036 1HB LYS 132 HB2 LYS 132 255.616 -2.026 -11.615 1037 2HB LYS 132 HB1 LYS 132 254.478 -2.439 -10.341 1038 1HG LYS 132 HG2 LYS 132 252.883 -1.041 -11.119 1039 2HG LYS 132 HG1 LYS 132 254.051 0.147 -11.699 1040 1HD LYS 132 HD2 LYS 132 254.202 -0.807 -13.742 1041 2HD LYS 132 HD1 LYS 132 254.069 -2.446 -13.099 1042 1HE LYS 132 HE2 LYS 132 251.748 -2.383 -13.073 1043 2HE LYS 132 HE1 LYS 132 251.699 -0.621 -13.094 1044 1HZ LYS 132 HZ1 LYS 132 252.906 -1.918 -15.404 1045 2HZ LYS 132 HZ2 LYS 132 251.915 -0.550 -15.326 1046 3HZ LYS 132 HZ3 LYS 132 251.232 -2.095 -15.234 1047 H PHE 133 HN PHE 133 255.504 -1.429 -7.494 1048 HA PHE 133 HA PHE 133 257.826 -3.204 -7.573 1049 1HB PHE 133 HB2 PHE 133 257.535 -0.788 -5.809 1050 2HB PHE 133 HB1 PHE 133 258.477 -2.173 -5.279 1051 HD1 PHE 133 HD1 PHE 133 260.722 -2.212 -5.741 1052 HD2 PHE 133 HD2 PHE 133 258.153 0.118 -8.207 1053 HE1 PHE 133 HE1 PHE 133 262.677 -1.353 -6.960 1054 HE2 PHE 133 HE2 PHE 133 260.104 0.979 -9.432 1055 HZ PHE 133 HZ PHE 133 262.369 0.245 -8.809 1056 H HIS 134 HN HIS 134 257.938 -4.654 -5.742 1057 HA HIS 134 HA HIS 134 255.347 -5.019 -4.383 1058 1HB HIS 134 HB2 HIS 134 257.207 -7.043 -5.614 1059 2HB HIS 134 HB1 HIS 134 256.071 -7.503 -4.349 1060 HD1 HIS 134 HD1 HIS 134 254.971 -9.062 -6.190 1061 HD2 HIS 134 HD2 HIS 134 254.652 -4.978 -6.884 1062 HE1 HIS 134 HE1 HIS 134 253.189 -8.816 -7.947 1063 HE2 HIS 134 HE2 HIS 134 253.075 -6.342 -8.413 1064 H GLY 135 HN GLY 135 255.466 -4.928 -2.206 1065 1HA GLY 135 HA2 GLY 135 258.142 -5.310 -1.009 1066 2HA GLY 135 HA1 GLY 135 256.977 -4.142 -0.414 1067 H TYR 136 HN TYR 136 258.405 -6.726 0.580 1068 HA TYR 136 HA TYR 136 255.996 -7.990 1.711 1069 1HB TYR 136 HB2 TYR 136 258.728 -9.122 1.111 1070 2HB TYR 136 HB1 TYR 136 257.585 -9.939 2.172 1071 HD1 TYR 136 HD1 TYR 136 257.277 -8.208 -1.136 1072 HD2 TYR 136 HD2 TYR 136 256.637 -11.754 1.125 1073 HE1 TYR 136 HE1 TYR 136 256.225 -9.259 -3.094 1074 HE2 TYR 136 HE2 TYR 136 255.582 -12.815 -0.826 1075 HH TYR 136 HH TYR 136 254.699 -11.048 -3.625 1076 H PHE 137 HN PHE 137 255.634 -7.219 3.691 1077 HA PHE 137 HA PHE 137 257.952 -6.601 5.400 1078 1HB PHE 137 HB2 PHE 137 255.139 -5.643 5.885 1079 2HB PHE 137 HB1 PHE 137 256.645 -4.985 6.514 1080 HD1 PHE 137 HD1 PHE 137 258.332 -4.486 4.332 1081 HD2 PHE 137 HD2 PHE 137 254.091 -4.188 4.471 1082 HE1 PHE 137 HE1 PHE 137 258.392 -2.861 2.487 1083 HE2 PHE 137 HE2 PHE 137 254.143 -2.562 2.625 1084 HZ PHE 137 HZ PHE 137 256.294 -1.897 1.631 1085 H LYS 138 HN LYS 138 258.320 -7.814 7.133 1086 HA LYS 138 HA LYS 138 256.399 -9.846 7.926 1087 1HB LYS 138 HB2 LYS 138 259.203 -9.703 7.860 1088 2HB LYS 138 HB1 LYS 138 258.778 -9.738 9.565 1089 1HG LYS 138 HG2 LYS 138 257.184 -11.703 8.543 1090 2HG LYS 138 HG1 LYS 138 258.630 -11.838 7.541 1091 1HD LYS 138 HD2 LYS 138 259.992 -12.336 9.350 1092 2HD LYS 138 HD1 LYS 138 258.878 -11.614 10.514 1093 1HE LYS 138 HE2 LYS 138 257.697 -13.509 10.740 1094 2HE LYS 138 HE1 LYS 138 257.753 -13.863 9.014 1095 1HZ LYS 138 HZ1 LYS 138 258.936 -15.486 10.475 1096 2HZ LYS 138 HZ2 LYS 138 260.062 -14.274 10.830 1097 3HZ LYS 138 HZ3 LYS 138 259.887 -14.827 9.240 1098 H PHE 139 HN PHE 139 254.999 -9.502 9.559 1099 HA PHE 139 HA PHE 139 255.525 -7.219 11.330 1100 1HB PHE 139 HB2 PHE 139 253.037 -8.499 10.290 1101 2HB PHE 139 HB1 PHE 139 252.973 -7.682 11.849 1102 HD1 PHE 139 HD1 PHE 139 252.570 -5.414 11.924 1103 HD2 PHE 139 HD2 PHE 139 254.066 -7.136 8.332 1104 HE1 PHE 139 HE1 PHE 139 252.299 -3.252 10.780 1105 HE2 PHE 139 HE2 PHE 139 253.799 -4.977 7.182 1106 HZ PHE 139 HZ PHE 139 252.914 -3.031 8.406 1107 H GLN 140 HN GLN 140 255.318 -7.354 13.531 1108 HA GLN 140 HA GLN 140 255.875 -9.933 14.689 1109 1HB GLN 140 HB2 GLN 140 257.141 -8.378 15.784 1110 2HB GLN 140 HB1 GLN 140 255.968 -7.095 15.543 1111 1HG GLN 140 HG2 GLN 140 256.142 -7.495 17.870 1112 2HG GLN 140 HG1 GLN 140 254.582 -8.124 17.343 1113 1HE2 GLN 140 HE21 GLN 140 254.393 -9.541 19.051 1114 2HE2 GLN 140 HE22 GLN 140 255.372 -10.956 19.209 1115 H GLY 141 HN GLY 141 253.082 -8.373 13.832 1116 1HA GLY 141 HA2 GLY 141 251.394 -10.221 15.138 1117 2HA GLY 141 HA1 GLY 141 251.347 -8.682 15.990 1118 H GLN 142 HN GLN 142 250.784 -6.761 14.710 1119 HA GLN 142 HA GLN 142 249.522 -7.138 12.154 1120 1HB GLN 142 HB2 GLN 142 247.274 -6.502 12.834 1121 2HB GLN 142 HB1 GLN 142 247.770 -7.970 13.663 1122 1HG GLN 142 HG2 GLN 142 248.367 -5.514 15.130 1123 2HG GLN 142 HG1 GLN 142 246.648 -5.790 14.846 1124 1HE2 GLN 142 HE21 GLN 142 246.473 -6.031 17.142 1125 2HE2 GLN 142 HE22 GLN 142 246.880 -7.535 17.890 1126 H ASP 143 HN ASP 143 251.515 -5.401 13.709 1127 HA ASP 143 HA ASP 143 250.852 -2.954 12.365 1128 1HB ASP 143 HB2 ASP 143 250.723 -3.133 15.365 1129 2HB ASP 143 HB1 ASP 143 251.119 -1.619 14.557 1130 H THR 144 HN THR 144 252.933 -4.570 14.732 1131 HA THR 144 HA THR 144 255.156 -2.822 14.229 1132 HB THR 144 HB THR 144 254.825 -5.368 15.798 1133 HG1 THR 144 HG1 THR 144 254.125 -3.703 16.975 1134 1HG2 THR 144 HG21 THR 144 257.076 -5.471 14.949 1135 2HG2 THR 144 HG22 THR 144 257.101 -5.044 16.660 1136 3HG2 THR 144 HG23 THR 144 257.368 -3.802 15.436 1137 H ILE 145 HN ILE 145 256.836 -3.107 12.871 1138 HA ILE 145 HA ILE 145 256.778 -5.524 11.202 1139 HB ILE 145 HB ILE 145 257.994 -2.854 10.494 1140 1HG1 ILE 145 HG12 ILE 145 255.437 -4.155 9.526 1141 2HG1 ILE 145 HG11 ILE 145 255.538 -2.749 10.581 1142 1HG2 ILE 145 HG21 ILE 145 257.551 -5.316 8.806 1143 2HG2 ILE 145 HG22 ILE 145 259.100 -4.798 9.468 1144 3HG2 ILE 145 HG23 ILE 145 258.274 -3.798 8.273 1145 1HD1 ILE 145 HD11 ILE 145 255.055 -1.970 8.399 1146 2HD1 ILE 145 HD12 ILE 145 256.349 -2.940 7.697 1147 3HD1 ILE 145 HD13 ILE 145 256.739 -1.566 8.731 1148 H LEU 146 HN LEU 146 258.482 -6.831 11.149 1149 HA LEU 146 HA LEU 146 260.906 -5.981 12.590 1150 1HB LEU 146 HB2 LEU 146 260.123 -8.843 12.139 1151 2HB LEU 146 HB1 LEU 146 261.226 -8.185 13.332 1152 HG LEU 146 HG LEU 146 258.313 -7.490 13.443 1153 1HD1 LEU 146 HD11 LEU 146 257.739 -9.600 13.809 1154 2HD1 LEU 146 HD12 LEU 146 258.734 -9.561 15.264 1155 3HD1 LEU 146 HD13 LEU 146 259.419 -10.131 13.742 1156 1HD2 LEU 146 HD21 LEU 146 260.678 -7.367 15.226 1157 2HD2 LEU 146 HD22 LEU 146 259.112 -7.691 15.969 1158 3HD2 LEU 146 HD23 LEU 146 259.351 -6.224 15.019 1159 H ASP 147 HN ASP 147 259.657 -6.759 9.565 1160 HA ASP 147 HA ASP 147 262.301 -6.774 8.402 1161 1HB ASP 147 HB2 ASP 147 260.927 -9.220 8.842 1162 2HB ASP 147 HB1 ASP 147 260.870 -8.900 7.111 1163 H TYR 148 HN TYR 148 262.322 -5.876 6.371 1164 HA TYR 148 HA TYR 148 259.761 -5.583 4.995 1165 1HB TYR 148 HB2 TYR 148 260.063 -3.221 4.613 1166 2HB TYR 148 HB1 TYR 148 260.099 -3.541 6.343 1167 HD1 TYR 148 HD1 TYR 148 262.151 -3.266 7.619 1168 HD2 TYR 148 HD2 TYR 148 262.066 -2.501 3.434 1169 HE1 TYR 148 HE1 TYR 148 264.313 -2.106 7.793 1170 HE2 TYR 148 HE2 TYR 148 264.226 -1.339 3.596 1171 HH TYR 148 HH TYR 148 265.482 -0.063 5.642 1172 H THR 149 HN THR 149 259.894 -5.974 2.875 1173 HA THR 149 HA THR 149 262.545 -5.771 1.607 1174 HB THR 149 HB THR 149 261.170 -7.695 0.153 1175 HG1 THR 149 HG1 THR 149 260.883 -8.243 2.920 1176 1HG2 THR 149 HG21 THR 149 262.698 -9.279 1.623 1177 2HG2 THR 149 HG22 THR 149 263.421 -7.733 2.067 1178 3HG2 THR 149 HG23 THR 149 263.354 -8.222 0.373 1179 H LEU 150 HN LEU 150 262.600 -5.061 -0.506 1180 HA LEU 150 HA LEU 150 260.060 -4.202 -1.695 1181 1HB LEU 150 HB2 LEU 150 262.509 -2.511 -1.246 1182 2HB LEU 150 HB1 LEU 150 261.293 -2.099 -2.442 1183 HG LEU 150 HG LEU 150 259.816 -2.522 -0.129 1184 1HD1 LEU 150 HD11 LEU 150 262.011 -0.685 0.694 1185 2HD1 LEU 150 HD12 LEU 150 262.200 -2.422 0.936 1186 3HD1 LEU 150 HD13 LEU 150 260.848 -1.570 1.682 1187 1HD2 LEU 150 HD21 LEU 150 260.010 -0.629 -2.038 1188 2HD2 LEU 150 HD22 LEU 150 260.683 0.242 -0.659 1189 3HD2 LEU 150 HD23 LEU 150 259.061 -0.445 -0.562 1190 H ARG 151 HN ARG 151 259.861 -4.900 -3.708 1191 HA ARG 151 HA ARG 151 262.302 -5.368 -5.288 1192 1HB ARG 151 HB2 ARG 151 259.799 -7.062 -5.352 1193 2HB ARG 151 HB1 ARG 151 261.270 -7.335 -6.276 1194 1HG ARG 151 HG2 ARG 151 262.385 -8.215 -4.511 1195 2HG ARG 151 HG1 ARG 151 261.539 -7.209 -3.333 1196 1HD ARG 151 HD2 ARG 151 260.733 -9.356 -2.911 1197 2HD ARG 151 HD1 ARG 151 259.475 -8.622 -3.904 1198 HE ARG 151 HE ARG 151 261.074 -9.871 -5.708 1199 1HH1 ARG 151 HH11 ARG 151 259.424 -10.910 -2.814 1200 2HH1 ARG 151 HH12 ARG 151 259.204 -12.534 -3.371 1201 1HH2 ARG 151 HH21 ARG 151 260.786 -12.008 -6.444 1202 2HH2 ARG 151 HH22 ARG 151 259.977 -13.157 -5.432 1203 H GLU 152 HN GLU 152 261.962 -5.301 -7.636 1204 HA GLU 152 HA GLU 152 259.974 -3.254 -8.308 1205 1HB GLU 152 HB2 GLU 152 261.323 -2.808 -10.276 1206 2HB GLU 152 HB1 GLU 152 262.344 -2.793 -8.845 1207 1HG GLU 152 HG2 GLU 152 262.554 -5.386 -9.630 1208 2HG GLU 152 HG1 GLU 152 262.392 -4.557 -11.177 1209 H VAL 153 HN VAL 153 258.596 -3.467 -10.096 1210 HA VAL 153 HA VAL 153 258.483 -6.049 -11.449 1211 HB VAL 153 HB VAL 153 255.978 -6.132 -11.050 1212 1HG1 VAL 153 HG11 VAL 153 257.245 -6.519 -8.409 1213 2HG1 VAL 153 HG12 VAL 153 257.999 -7.346 -9.772 1214 3HG1 VAL 153 HG13 VAL 153 256.302 -7.639 -9.394 1215 1HG2 VAL 153 HG21 VAL 153 254.991 -4.927 -9.312 1216 2HG2 VAL 153 HG22 VAL 153 256.005 -3.734 -10.124 1217 3HG2 VAL 153 HG23 VAL 153 256.548 -4.472 -8.617 1218 H ASP 154 HN ASP 154 257.012 -6.042 -13.298 1219 HA ASP 154 HA ASP 154 255.985 -3.505 -14.218 1220 1HB ASP 154 HB2 ASP 154 258.483 -4.709 -15.327 1221 2HB ASP 154 HB1 ASP 154 257.368 -3.921 -16.438 1222 H THR 155 HN THR 155 254.953 -6.162 -13.624 1223 HA THR 155 HA THR 155 253.509 -6.576 -16.107 1224 HB THR 155 HB THR 155 254.916 -8.893 -14.769 1225 HG1 THR 155 HG1 THR 155 256.292 -8.856 -16.539 1226 1HG2 THR 155 HG21 THR 155 253.513 -8.775 -17.426 1227 2HG2 THR 155 HG22 THR 155 252.843 -9.487 -15.957 1228 3HG2 THR 155 HG23 THR 155 254.288 -10.180 -16.694 1229 H VAL 156 HN VAL 156 254.039 -8.087 -12.917 1230 HA VAL 156 HA VAL 156 252.601 -8.664 -11.250 1231 HB VAL 156 HB VAL 156 250.615 -6.795 -12.544 1232 1HG1 VAL 156 HG11 VAL 156 249.743 -8.283 -10.784 1233 2HG1 VAL 156 HG12 VAL 156 249.698 -6.584 -10.315 1234 3HG1 VAL 156 HG13 VAL 156 250.951 -7.643 -9.670 1235 1HG2 VAL 156 HG21 VAL 156 252.263 -5.271 -12.249 1236 2HG2 VAL 156 HG22 VAL 156 253.106 -6.254 -11.051 1237 3HG2 VAL 156 HG23 VAL 156 251.690 -5.312 -10.581 Start of MODEL 20 1 1H MET 1 HT1 MET 1 247.948 -28.963 0.987 2 2H MET 1 HT2 MET 1 247.610 -28.131 2.450 3 3H MET 1 HT3 MET 1 249.155 -27.990 1.717 4 HA MET 1 HA MET 1 248.018 -27.027 -0.239 5 1HB MET 1 HB2 MET 1 245.779 -26.129 0.155 6 2HB MET 1 HB1 MET 1 245.786 -27.876 0.350 7 1HG MET 1 HG2 MET 1 245.324 -27.776 2.557 8 2HG MET 1 HG1 MET 1 246.221 -26.277 2.791 9 1HE MET 1 HE1 MET 1 242.695 -25.625 4.126 10 2HE MET 1 HE2 MET 1 243.967 -26.832 4.306 11 3HE MET 1 HE3 MET 1 242.498 -27.226 3.414 12 H GLY 2 HN GLY 2 247.030 -24.568 0.127 13 1HA GLY 2 HA2 GLY 2 248.362 -23.308 2.394 14 2HA GLY 2 HA1 GLY 2 248.995 -22.909 0.804 15 H ALA 3 HN ALA 3 247.990 -20.959 2.480 16 HA ALA 3 HA ALA 3 245.676 -20.058 0.922 17 1HB ALA 3 HB1 ALA 3 245.848 -20.118 3.925 18 2HB ALA 3 HB2 ALA 3 244.631 -20.863 2.889 19 3HB ALA 3 HB3 ALA 3 244.701 -19.109 3.045 20 H SER 4 HN SER 4 245.202 -17.641 1.771 21 HA SER 4 HA SER 4 247.268 -16.021 2.668 22 1HB SER 4 HB2 SER 4 248.711 -16.147 0.931 23 2HB SER 4 HB1 SER 4 247.483 -16.771 -0.168 24 HG SER 4 HG SER 4 246.860 -14.738 -0.650 25 H ARG 5 HN ARG 5 245.840 -14.779 3.638 26 HA ARG 5 HA ARG 5 243.379 -13.948 2.636 27 1HB ARG 5 HB2 ARG 5 244.632 -13.700 5.022 28 2HB ARG 5 HB1 ARG 5 244.797 -12.058 4.418 29 1HG ARG 5 HG2 ARG 5 242.792 -11.751 5.355 30 2HG ARG 5 HG1 ARG 5 242.180 -12.539 3.900 31 1HD ARG 5 HD2 ARG 5 241.170 -13.889 5.405 32 2HD ARG 5 HD1 ARG 5 242.733 -14.703 5.386 33 HE ARG 5 HE ARG 5 242.706 -12.637 7.323 34 1HH1 ARG 5 HH11 ARG 5 241.509 -15.862 6.732 35 2HH1 ARG 5 HH12 ARG 5 241.426 -16.273 8.412 36 1HH2 ARG 5 HH21 ARG 5 242.597 -13.176 9.533 37 2HH2 ARG 5 HH22 ARG 5 242.044 -14.749 10.003 38 H LEU 6 HN LEU 6 243.463 -13.192 0.576 39 HA LEU 6 HA LEU 6 245.296 -11.063 -0.131 40 1HB LEU 6 HB2 LEU 6 244.388 -13.044 -1.614 41 2HB LEU 6 HB1 LEU 6 243.071 -11.929 -1.922 42 HG LEU 6 HG LEU 6 245.895 -11.022 -2.328 43 1HD1 LEU 6 HD11 LEU 6 246.126 -12.007 -4.383 44 2HD1 LEU 6 HD12 LEU 6 244.390 -12.241 -4.590 45 3HD1 LEU 6 HD13 LEU 6 245.298 -13.287 -3.498 46 1HD2 LEU 6 HD21 LEU 6 243.545 -10.340 -4.036 47 2HD2 LEU 6 HD22 LEU 6 244.970 -9.377 -3.646 48 3HD2 LEU 6 HD23 LEU 6 243.699 -9.599 -2.443 49 H TYR 7 HN TYR 7 244.897 -9.041 0.256 50 HA TYR 7 HA TYR 7 242.116 -8.073 0.303 51 1HB TYR 7 HB2 TYR 7 244.359 -7.705 2.201 52 2HB TYR 7 HB1 TYR 7 243.423 -6.261 1.843 53 HD1 TYR 7 HD1 TYR 7 241.923 -9.625 1.888 54 HD2 TYR 7 HD2 TYR 7 242.545 -6.024 4.064 55 HE1 TYR 7 HE1 TYR 7 240.226 -10.327 3.520 56 HE2 TYR 7 HE2 TYR 7 240.849 -6.716 5.704 57 HH TYR 7 HH TYR 7 238.758 -9.386 5.172 58 H THR 8 HN THR 8 242.293 -5.484 0.259 59 HA THR 8 HA THR 8 244.084 -4.764 -1.973 60 HB THR 8 HB THR 8 242.313 -3.537 -3.015 61 HG1 THR 8 HG1 THR 8 241.081 -2.722 -1.445 62 1HG2 THR 8 HG21 THR 8 240.822 -5.218 -3.696 63 2HG2 THR 8 HG22 THR 8 241.012 -6.106 -2.185 64 3HG2 THR 8 HG23 THR 8 242.342 -6.035 -3.341 65 H LEU 9 HN LEU 9 244.274 -2.388 -2.254 66 HA LEU 9 HA LEU 9 243.783 -0.721 0.054 67 1HB LEU 9 HB2 LEU 9 245.923 -2.009 0.516 68 2HB LEU 9 HB1 LEU 9 246.628 -1.161 -0.845 69 HG LEU 9 HG LEU 9 245.587 0.122 1.680 70 1HD1 LEU 9 HD11 LEU 9 248.018 0.692 1.960 71 2HD1 LEU 9 HD12 LEU 9 248.357 -0.458 0.666 72 3HD1 LEU 9 HD13 LEU 9 247.611 -1.011 2.166 73 1HD2 LEU 9 HD21 LEU 9 245.258 1.720 0.006 74 2HD2 LEU 9 HD22 LEU 9 246.726 1.255 -0.853 75 3HD2 LEU 9 HD23 LEU 9 246.838 2.120 0.680 76 H VAL 10 HN VAL 10 242.884 0.954 -1.030 77 HA VAL 10 HA VAL 10 244.190 1.851 -3.496 78 HB VAL 10 HB VAL 10 241.992 1.302 -4.027 79 1HG1 VAL 10 HG11 VAL 10 240.142 2.499 -2.535 80 2HG1 VAL 10 HG12 VAL 10 241.396 2.224 -1.331 81 3HG1 VAL 10 HG13 VAL 10 240.740 0.868 -2.248 82 1HG2 VAL 10 HG21 VAL 10 241.667 4.217 -3.418 83 2HG2 VAL 10 HG22 VAL 10 241.002 3.301 -4.769 84 3HG2 VAL 10 HG23 VAL 10 242.730 3.639 -4.698 85 H LEU 11 HN LEU 11 245.110 3.715 -3.624 86 HA LEU 11 HA LEU 11 244.521 5.783 -1.621 87 1HB LEU 11 HB2 LEU 11 246.981 4.405 -2.123 88 2HB LEU 11 HB1 LEU 11 247.178 6.085 -2.579 89 HG LEU 11 HG LEU 11 246.596 4.928 0.127 90 1HD1 LEU 11 HD11 LEU 11 248.394 7.201 -0.035 91 2HD1 LEU 11 HD12 LEU 11 248.900 5.878 -1.086 92 3HD1 LEU 11 HD13 LEU 11 248.663 5.593 0.637 93 1HD2 LEU 11 HD21 LEU 11 245.816 7.614 -0.889 94 2HD2 LEU 11 HD22 LEU 11 246.390 7.452 0.771 95 3HD2 LEU 11 HD23 LEU 11 244.978 6.541 0.234 96 H VAL 12 HN VAL 12 243.550 7.393 -2.697 97 HA VAL 12 HA VAL 12 244.056 7.724 -5.530 98 HB VAL 12 HB VAL 12 242.206 9.384 -3.826 99 1HG1 VAL 12 HG11 VAL 12 241.109 9.101 -6.323 100 2HG1 VAL 12 HG12 VAL 12 242.834 9.209 -6.671 101 3HG1 VAL 12 HG13 VAL 12 242.037 10.492 -5.763 102 1HG2 VAL 12 HG21 VAL 12 241.183 7.410 -3.420 103 2HG2 VAL 12 HG22 VAL 12 241.972 6.603 -4.774 104 3HG2 VAL 12 HG23 VAL 12 240.567 7.629 -5.058 105 H LEU 13 HN LEU 13 246.080 8.571 -5.719 106 HA LEU 13 HA LEU 13 246.658 11.133 -4.399 107 1HB LEU 13 HB2 LEU 13 248.237 9.000 -4.603 108 2HB LEU 13 HB1 LEU 13 248.670 9.795 -6.109 109 HG LEU 13 HG LEU 13 248.599 11.681 -3.939 110 1HD1 LEU 13 HD11 LEU 13 250.857 9.832 -3.547 111 2HD1 LEU 13 HD12 LEU 13 249.287 9.322 -2.921 112 3HD1 LEU 13 HD13 LEU 13 249.997 10.845 -2.387 113 1HD2 LEU 13 HD21 LEU 13 249.852 12.515 -5.577 114 2HD2 LEU 13 HD22 LEU 13 250.305 10.921 -6.184 115 3HD2 LEU 13 HD23 LEU 13 251.153 11.613 -4.800 116 H GLN 14 HN GLN 14 247.603 12.846 -5.675 117 HA GLN 14 HA GLN 14 246.948 12.783 -8.534 118 1HB GLN 14 HB2 GLN 14 245.555 14.280 -6.550 119 2HB GLN 14 HB1 GLN 14 246.465 15.417 -7.535 120 1HG GLN 14 HG2 GLN 14 244.753 15.339 -8.944 121 2HG GLN 14 HG1 GLN 14 245.347 13.743 -9.402 122 1HE2 GLN 14 HE21 GLN 14 243.565 15.068 -6.630 123 2HE2 GLN 14 HE22 GLN 14 242.285 13.910 -6.681 124 HA PRO 15 HA PRO 15 250.911 14.618 -9.098 125 1HB PRO 15 HB2 PRO 15 250.491 16.362 -11.148 126 2HB PRO 15 HB1 PRO 15 250.581 14.610 -11.361 127 1HG PRO 15 HG2 PRO 15 248.172 16.372 -11.150 128 2HG PRO 15 HG1 PRO 15 248.476 15.020 -12.256 129 1HD PRO 15 HD2 PRO 15 246.937 14.757 -10.055 130 2HD PRO 15 HD1 PRO 15 247.952 13.433 -10.660 131 H GLN 16 HN GLN 16 248.910 16.014 -7.263 132 HA GLN 16 HA GLN 16 250.532 18.304 -6.734 133 1HB GLN 16 HB2 GLN 16 247.923 18.592 -8.097 134 2HB GLN 16 HB1 GLN 16 248.180 19.658 -6.722 135 1HG GLN 16 HG2 GLN 16 250.469 19.564 -8.506 136 2HG GLN 16 HG1 GLN 16 248.996 20.104 -9.309 137 1HE2 GLN 16 HE21 GLN 16 251.086 20.684 -6.534 138 2HE2 GLN 16 HE22 GLN 16 250.713 22.363 -6.372 139 H ARG 17 HN ARG 17 247.523 16.577 -6.096 140 HA ARG 17 HA ARG 17 248.021 16.915 -3.223 141 1HB ARG 17 HB2 ARG 17 245.271 16.720 -3.375 142 2HB ARG 17 HB1 ARG 17 246.183 18.192 -3.081 143 1HG ARG 17 HG2 ARG 17 246.232 18.452 -5.626 144 2HG ARG 17 HG1 ARG 17 244.966 17.220 -5.641 145 1HD ARG 17 HD2 ARG 17 243.620 18.620 -4.133 146 2HD ARG 17 HD1 ARG 17 244.876 19.857 -4.181 147 HE ARG 17 HE ARG 17 242.917 19.289 -6.212 148 1HH1 ARG 17 HH11 ARG 17 246.037 20.707 -5.548 149 2HH1 ARG 17 HH12 ARG 17 245.994 21.752 -6.927 150 1HH2 ARG 17 HH21 ARG 17 242.860 20.662 -8.027 151 2HH2 ARG 17 HH22 ARG 17 244.192 21.728 -8.335 152 H VAL 18 HN VAL 18 246.934 15.238 -1.891 153 HA VAL 18 HA VAL 18 246.476 12.747 -3.399 154 HB VAL 18 HB VAL 18 248.605 12.380 -2.563 155 1HG1 VAL 18 HG11 VAL 18 247.877 13.336 0.188 156 2HG1 VAL 18 HG12 VAL 18 248.518 14.421 -1.045 157 3HG1 VAL 18 HG13 VAL 18 249.480 13.053 -0.488 158 1HG2 VAL 18 HG21 VAL 18 246.799 11.265 -0.425 159 2HG2 VAL 18 HG22 VAL 18 248.396 10.661 -0.869 160 3HG2 VAL 18 HG23 VAL 18 247.061 10.551 -2.017 161 H LEU 19 HN LEU 19 245.174 11.153 -2.230 162 HA LEU 19 HA LEU 19 243.322 12.442 -0.340 163 1HB LEU 19 HB2 LEU 19 242.324 11.702 -2.469 164 2HB LEU 19 HB1 LEU 19 242.850 10.064 -2.132 165 HG LEU 19 HG LEU 19 241.366 9.918 -0.229 166 1HD1 LEU 19 HD11 LEU 19 241.107 12.837 -0.684 167 2HD1 LEU 19 HD12 LEU 19 241.178 11.924 0.824 168 3HD1 LEU 19 HD13 LEU 19 239.684 11.965 -0.112 169 1HD2 LEU 19 HD21 LEU 19 240.535 9.525 -2.584 170 2HD2 LEU 19 HD22 LEU 19 239.793 11.123 -2.490 171 3HD2 LEU 19 HD23 LEU 19 239.301 9.853 -1.369 172 H LEU 20 HN LEU 20 243.434 11.801 1.695 173 HA LEU 20 HA LEU 20 244.397 9.075 2.261 174 1HB LEU 20 HB2 LEU 20 245.356 11.647 3.201 175 2HB LEU 20 HB1 LEU 20 244.900 10.608 4.536 176 HG LEU 20 HG LEU 20 246.818 9.799 2.353 177 1HD1 LEU 20 HD11 LEU 20 248.612 10.333 3.754 178 2HD1 LEU 20 HD12 LEU 20 247.570 10.530 5.163 179 3HD1 LEU 20 HD13 LEU 20 247.539 11.728 3.869 180 1HD2 LEU 20 HD21 LEU 20 247.102 7.824 3.444 181 2HD2 LEU 20 HD22 LEU 20 245.423 8.138 3.883 182 3HD2 LEU 20 HD23 LEU 20 246.717 8.511 5.021 183 H GLY 21 HN GLY 21 243.009 7.830 3.336 184 1HA GLY 21 HA2 GLY 21 240.493 8.893 4.220 185 2HA GLY 21 HA1 GLY 21 241.014 7.218 4.329 186 H MET 22 HN MET 22 240.014 9.685 6.153 187 HA MET 22 HA MET 22 241.770 8.976 8.408 188 1HB MET 22 HB2 MET 22 241.928 11.333 7.895 189 2HB MET 22 HB1 MET 22 240.177 11.495 7.903 190 1HG MET 22 HG2 MET 22 240.061 11.209 10.240 191 2HG MET 22 HG1 MET 22 241.729 10.648 10.328 192 1HE MET 22 HE1 MET 22 243.594 11.835 9.588 193 2HE MET 22 HE2 MET 22 243.924 13.238 10.605 194 3HE MET 22 HE3 MET 22 243.581 13.453 8.890 195 H LYS 23 HN LYS 23 240.828 8.329 10.362 196 HA LYS 23 HA LYS 23 238.026 7.541 10.152 197 1HB LYS 23 HB2 LYS 23 240.383 6.562 11.579 198 2HB LYS 23 HB1 LYS 23 238.948 6.628 12.592 199 1HG LYS 23 HG2 LYS 23 238.724 5.399 9.895 200 2HG LYS 23 HG1 LYS 23 239.535 4.495 11.176 201 1HD LYS 23 HD2 LYS 23 236.878 5.753 11.704 202 2HD LYS 23 HD1 LYS 23 236.963 4.231 10.815 203 1HE LYS 23 HE2 LYS 23 238.647 3.805 12.946 204 2HE LYS 23 HE1 LYS 23 237.354 4.775 13.651 205 1HZ LYS 23 HZ1 LYS 23 237.236 2.130 13.377 206 2HZ LYS 23 HZ2 LYS 23 236.498 2.601 11.930 207 3HZ LYS 23 HZ3 LYS 23 235.866 3.124 13.409 208 H LYS 24 HN LYS 24 236.452 8.204 11.625 209 HA LYS 24 HA LYS 24 237.094 10.714 12.946 210 1HB LYS 24 HB2 LYS 24 234.595 9.408 12.001 211 2HB LYS 24 HB1 LYS 24 234.462 10.499 13.372 212 1HG LYS 24 HG2 LYS 24 234.680 12.304 12.090 213 2HG LYS 24 HG1 LYS 24 236.050 11.619 11.216 214 1HD LYS 24 HD2 LYS 24 234.719 10.680 9.594 215 2HD LYS 24 HD1 LYS 24 233.317 10.570 10.660 216 1HE LYS 24 HE2 LYS 24 234.287 13.290 10.046 217 2HE LYS 24 HE1 LYS 24 233.563 12.402 8.706 218 1HZ LYS 24 HZ1 LYS 24 232.010 13.796 10.083 219 2HZ LYS 24 HZ2 LYS 24 232.228 12.680 11.334 220 3HZ LYS 24 HZ3 LYS 24 231.548 12.183 9.868 221 H ARG 25 HN ARG 25 236.163 7.437 13.682 222 HA ARG 25 HA ARG 25 237.113 7.623 16.322 223 1HB ARG 25 HB2 ARG 25 234.919 7.102 17.471 224 2HB ARG 25 HB1 ARG 25 235.134 8.761 16.933 225 1HG ARG 25 HG2 ARG 25 233.723 6.781 15.198 226 2HG ARG 25 HG1 ARG 25 232.879 7.581 16.528 227 1HD ARG 25 HD2 ARG 25 234.052 9.704 15.407 228 2HD ARG 25 HD1 ARG 25 233.898 8.679 13.982 229 HE ARG 25 HE ARG 25 231.438 8.527 14.843 230 1HH1 ARG 25 HH11 ARG 25 233.489 11.360 14.838 231 2HH1 ARG 25 HH12 ARG 25 232.166 12.464 14.692 232 1HH2 ARG 25 HH21 ARG 25 229.706 9.985 14.651 233 2HH2 ARG 25 HH22 ARG 25 230.022 11.688 14.586 234 H GLY 26 HN GLY 26 237.919 5.683 16.726 235 1HA GLY 26 HA2 GLY 26 236.728 3.277 16.885 236 2HA GLY 26 HA1 GLY 26 237.045 3.405 15.162 237 H PHE 27 HN PHE 27 238.814 2.352 14.580 238 HA PHE 27 HA PHE 27 240.974 2.029 16.532 239 1HB PHE 27 HB2 PHE 27 239.967 0.431 14.253 240 2HB PHE 27 HB1 PHE 27 241.712 0.425 14.485 241 HD1 PHE 27 HD1 PHE 27 238.565 0.008 16.439 242 HD2 PHE 27 HD2 PHE 27 242.627 -1.138 15.897 243 HE1 PHE 27 HE1 PHE 27 238.319 -1.684 18.208 244 HE2 PHE 27 HE2 PHE 27 242.388 -2.833 17.665 245 HZ PHE 27 HZ PHE 27 240.232 -3.108 18.823 246 H GLY 28 HN GLY 28 240.442 4.468 14.838 247 1HA GLY 28 HA2 GLY 28 243.144 5.078 14.260 248 2HA GLY 28 HA1 GLY 28 242.299 4.699 12.770 249 H ALA 29 HN ALA 29 240.524 6.209 15.351 250 HA ALA 29 HA ALA 29 239.578 8.326 13.843 251 1HB ALA 29 HB1 ALA 29 239.076 7.411 16.314 252 2HB ALA 29 HB2 ALA 29 238.495 8.957 15.694 253 3HB ALA 29 HB3 ALA 29 239.945 8.895 16.697 254 H GLY 30 HN GLY 30 240.602 10.008 12.958 255 1HA GLY 30 HA2 GLY 30 241.859 12.010 13.086 256 2HA GLY 30 HA1 GLY 30 242.696 11.365 14.491 257 H ARG 31 HN ARG 31 243.128 8.772 13.060 258 HA ARG 31 HA ARG 31 245.622 9.506 11.819 259 1HB ARG 31 HB2 ARG 31 244.271 6.875 12.391 260 2HB ARG 31 HB1 ARG 31 245.758 6.968 11.458 261 1HG ARG 31 HG2 ARG 31 246.658 8.302 13.486 262 2HG ARG 31 HG1 ARG 31 245.299 7.575 14.346 263 1HD ARG 31 HD2 ARG 31 246.085 5.365 13.836 264 2HD ARG 31 HD1 ARG 31 247.346 6.008 12.784 265 HE ARG 31 HE ARG 31 247.632 7.048 15.394 266 1HH1 ARG 31 HH11 ARG 31 248.079 4.107 13.571 267 2HH1 ARG 31 HH12 ARG 31 249.344 3.515 14.595 268 1HH2 ARG 31 HH21 ARG 31 249.296 6.273 16.743 269 2HH2 ARG 31 HH22 ARG 31 250.035 4.745 16.396 270 H TRP 32 HN TRP 32 246.247 8.822 9.673 271 HA TRP 32 HA TRP 32 243.971 8.819 7.811 272 1HB TRP 32 HB2 TRP 32 246.641 9.507 6.748 273 2HB TRP 32 HB1 TRP 32 245.071 10.205 6.392 274 HD1 TRP 32 HD1 TRP 32 247.332 10.246 9.579 275 HE1 TRP 32 HE1 TRP 32 247.435 12.671 10.421 276 HE3 TRP 32 HE3 TRP 32 244.418 12.474 6.013 277 HZ2 TRP 32 HZ2 TRP 32 246.431 15.196 9.673 278 HZ3 TRP 32 HZ3 TRP 32 244.050 14.905 6.149 279 HH2 TRP 32 HH2 TRP 32 245.035 16.234 7.941 280 H ASN 33 HN ASN 33 244.131 7.509 5.895 281 HA ASN 33 HA ASN 33 246.240 5.745 5.350 282 1HB ASN 33 HB2 ASN 33 245.598 4.723 7.506 283 2HB ASN 33 HB1 ASN 33 243.966 4.470 6.893 284 1HD2 ASN 33 HD21 ASN 33 247.303 3.502 6.658 285 2HD2 ASN 33 HD22 ASN 33 247.020 2.021 5.814 286 H GLY 34 HN GLY 34 245.734 4.203 3.665 287 1HA GLY 34 HA2 GLY 34 243.952 5.242 1.742 288 2HA GLY 34 HA1 GLY 34 244.766 3.687 1.649 289 H PHE 35 HN PHE 35 242.674 3.115 0.601 290 HA PHE 35 HA PHE 35 240.687 2.364 2.645 291 1HB PHE 35 HB2 PHE 35 240.219 3.085 -0.256 292 2HB PHE 35 HB1 PHE 35 238.983 2.472 0.832 293 HD1 PHE 35 HD1 PHE 35 239.724 3.980 3.302 294 HD2 PHE 35 HD2 PHE 35 239.430 5.217 -0.759 295 HE1 PHE 35 HE1 PHE 35 239.250 6.279 4.041 296 HE2 PHE 35 HE2 PHE 35 238.956 7.518 -0.028 297 HZ PHE 35 HZ PHE 35 238.866 8.051 2.375 298 H GLY 36 HN GLY 36 241.617 0.345 3.031 299 1HA GLY 36 HA2 GLY 36 242.045 -1.454 0.792 300 2HA GLY 36 HA1 GLY 36 242.393 -1.793 2.480 301 H GLY 37 HN GLY 37 241.082 -3.501 0.567 302 1HA GLY 37 HA2 GLY 37 238.524 -3.848 1.992 303 2HA GLY 37 HA1 GLY 37 238.594 -3.970 0.240 304 H LYS 38 HN LYS 38 238.172 -6.077 -0.138 305 HA LYS 38 HA LYS 38 240.176 -8.008 0.495 306 1HB LYS 38 HB2 LYS 38 238.853 -9.511 1.837 307 2HB LYS 38 HB1 LYS 38 238.902 -7.940 2.625 308 1HG LYS 38 HG2 LYS 38 236.653 -7.552 1.366 309 2HG LYS 38 HG1 LYS 38 236.627 -9.315 1.277 310 1HD LYS 38 HD2 LYS 38 237.260 -8.970 3.877 311 2HD LYS 38 HD1 LYS 38 236.288 -7.525 3.596 312 1HE LYS 38 HE2 LYS 38 234.575 -9.099 2.542 313 2HE LYS 38 HE1 LYS 38 235.497 -10.407 3.283 314 1HZ LYS 38 HZ1 LYS 38 235.204 -8.928 5.402 315 2HZ LYS 38 HZ2 LYS 38 233.973 -9.978 4.906 316 3HZ LYS 38 HZ3 LYS 38 233.868 -8.327 4.555 317 H VAL 39 HN VAL 39 240.100 -9.766 -0.867 318 HA VAL 39 HA VAL 39 238.238 -9.555 -3.078 319 HB VAL 39 HB VAL 39 240.212 -11.797 -2.824 320 1HG1 VAL 39 HG11 VAL 39 239.337 -10.129 -5.177 321 2HG1 VAL 39 HG12 VAL 39 238.646 -11.691 -4.734 322 3HG1 VAL 39 HG13 VAL 39 240.335 -11.580 -5.225 323 1HG2 VAL 39 HG21 VAL 39 241.850 -10.314 -2.474 324 2HG2 VAL 39 HG22 VAL 39 240.838 -8.942 -2.923 325 3HG2 VAL 39 HG23 VAL 39 241.623 -9.905 -4.174 326 H GLN 40 HN GLN 40 236.249 -10.297 -2.645 327 HA GLN 40 HA GLN 40 235.469 -12.211 -0.832 328 1HB GLN 40 HB2 GLN 40 234.276 -11.115 -3.329 329 2HB GLN 40 HB1 GLN 40 233.542 -12.557 -2.641 330 1HG GLN 40 HG2 GLN 40 233.706 -11.061 -0.432 331 2HG GLN 40 HG1 GLN 40 233.583 -9.784 -1.639 332 1HE2 GLN 40 HE21 GLN 40 231.590 -9.770 -0.001 333 2HE2 GLN 40 HE22 GLN 40 230.162 -10.484 -0.660 334 H GLU 41 HN GLU 41 234.184 -14.283 -1.692 335 HA GLU 41 HA GLU 41 236.203 -16.126 -2.464 336 1HB GLU 41 HB2 GLU 41 233.307 -16.276 -1.799 337 2HB GLU 41 HB1 GLU 41 234.004 -17.618 -2.696 338 1HG GLU 41 HG2 GLU 41 235.740 -17.809 -0.918 339 2HG GLU 41 HG1 GLU 41 234.851 -16.595 0.001 340 H GLY 42 HN GLY 42 236.582 -14.701 -4.514 341 1HA GLY 42 HA2 GLY 42 236.701 -15.712 -6.794 342 2HA GLY 42 HA1 GLY 42 234.953 -15.839 -6.701 343 H GLU 43 HN GLU 43 237.095 -13.117 -5.818 344 HA GLU 43 HA GLU 43 235.843 -11.581 -7.972 345 1HB GLU 43 HB2 GLU 43 235.278 -9.816 -6.638 346 2HB GLU 43 HB1 GLU 43 235.108 -11.101 -5.457 347 1HG GLU 43 HG2 GLU 43 237.142 -10.546 -4.413 348 2HG GLU 43 HG1 GLU 43 237.639 -9.517 -5.754 349 H THR 44 HN THR 44 237.199 -9.482 -8.279 350 HA THR 44 HA THR 44 239.973 -10.393 -8.460 351 HB THR 44 HB THR 44 240.201 -8.709 -10.217 352 HG1 THR 44 HG1 THR 44 238.464 -7.475 -10.831 353 1HG2 THR 44 HG21 THR 44 238.989 -11.063 -10.479 354 2HG2 THR 44 HG22 THR 44 239.197 -9.945 -11.826 355 3HG2 THR 44 HG23 THR 44 237.659 -10.012 -10.966 356 H ILE 45 HN ILE 45 241.659 -9.230 -7.656 357 HA ILE 45 HA ILE 45 241.324 -7.782 -5.348 358 HB ILE 45 HB ILE 45 243.646 -7.294 -7.198 359 1HG1 ILE 45 HG12 ILE 45 244.455 -9.305 -5.535 360 2HG1 ILE 45 HG11 ILE 45 242.789 -9.768 -5.868 361 1HG2 ILE 45 HG21 ILE 45 243.459 -7.401 -4.199 362 2HG2 ILE 45 HG22 ILE 45 243.471 -5.926 -5.165 363 3HG2 ILE 45 HG23 ILE 45 244.882 -6.984 -5.152 364 1HD1 ILE 45 HD11 ILE 45 243.336 -10.498 -7.884 365 2HD1 ILE 45 HD12 ILE 45 245.025 -10.257 -7.441 366 3HD1 ILE 45 HD13 ILE 45 244.144 -8.982 -8.283 367 H GLU 46 HN GLU 46 241.286 -6.640 -8.656 368 HA GLU 46 HA GLU 46 241.381 -3.845 -7.977 369 1HB GLU 46 HB2 GLU 46 242.033 -4.957 -10.220 370 2HB GLU 46 HB1 GLU 46 240.307 -4.974 -10.556 371 1HG GLU 46 HG2 GLU 46 240.254 -2.530 -10.258 372 2HG GLU 46 HG1 GLU 46 241.998 -2.545 -10.009 373 H ASP 47 HN ASP 47 238.973 -6.312 -8.271 374 HA ASP 47 HA ASP 47 236.754 -4.471 -8.398 375 1HB ASP 47 HB2 ASP 47 237.051 -7.447 -8.271 376 2HB ASP 47 HB1 ASP 47 235.509 -6.732 -7.815 377 H GLY 48 HN GLY 48 238.441 -6.433 -6.022 378 1HA GLY 48 HA2 GLY 48 236.613 -5.942 -3.877 379 2HA GLY 48 HA1 GLY 48 238.263 -6.532 -3.720 380 H ALA 49 HN ALA 49 239.500 -4.340 -5.066 381 HA ALA 49 HA ALA 49 239.692 -2.489 -2.881 382 1HB ALA 49 HB1 ALA 49 241.439 -3.313 -4.785 383 2HB ALA 49 HB2 ALA 49 241.636 -1.850 -3.820 384 3HB ALA 49 HB3 ALA 49 240.943 -1.752 -5.439 385 H ARG 50 HN ARG 50 238.248 -2.564 -6.073 386 HA ARG 50 HA ARG 50 237.559 0.199 -6.135 387 1HB ARG 50 HB2 ARG 50 236.928 -2.204 -7.776 388 2HB ARG 50 HB1 ARG 50 235.850 -0.821 -7.911 389 1HG ARG 50 HG2 ARG 50 238.045 0.520 -8.275 390 2HG ARG 50 HG1 ARG 50 238.724 -1.060 -8.668 391 1HD ARG 50 HD2 ARG 50 236.533 -1.200 -10.162 392 2HD ARG 50 HD1 ARG 50 236.695 0.556 -10.112 393 HE ARG 50 HE ARG 50 239.178 -0.278 -10.789 394 1HH1 ARG 50 HH11 ARG 50 236.002 -0.930 -12.082 395 2HH1 ARG 50 HH12 ARG 50 236.572 -1.163 -13.700 396 1HH2 ARG 50 HH21 ARG 50 239.929 -0.584 -12.917 397 2HH2 ARG 50 HH22 ARG 50 238.801 -0.968 -14.175 398 H ARG 51 HN ARG 51 235.623 -2.755 -5.681 399 HA ARG 51 HA ARG 51 233.205 -1.488 -5.077 400 1HB ARG 51 HB2 ARG 51 233.419 -3.882 -5.643 401 2HB ARG 51 HB1 ARG 51 234.190 -4.170 -4.088 402 1HG ARG 51 HG2 ARG 51 232.163 -3.520 -2.930 403 2HG ARG 51 HG1 ARG 51 231.385 -3.141 -4.468 404 1HD ARG 51 HD2 ARG 51 231.056 -5.323 -4.997 405 2HD ARG 51 HD1 ARG 51 232.531 -5.852 -4.191 406 HE ARG 51 HE ARG 51 229.897 -5.695 -3.059 407 1HH1 ARG 51 HH11 ARG 51 233.314 -5.672 -2.348 408 2HH1 ARG 51 HH12 ARG 51 233.106 -6.217 -0.718 409 1HH2 ARG 51 HH21 ARG 51 229.622 -6.413 -0.915 410 2HH2 ARG 51 HH22 ARG 51 231.010 -6.639 0.096 411 H GLU 52 HN GLU 52 235.939 -2.303 -3.044 412 HA GLU 52 HA GLU 52 234.557 -1.567 -0.611 413 1HB GLU 52 HB2 GLU 52 237.430 -2.338 -1.144 414 2HB GLU 52 HB1 GLU 52 236.792 -1.964 0.451 415 1HG GLU 52 HG2 GLU 52 235.246 -3.976 -0.993 416 2HG GLU 52 HG1 GLU 52 236.913 -4.449 -0.665 417 H LEU 53 HN LEU 53 236.543 -0.094 -3.001 418 HA LEU 53 HA LEU 53 237.556 2.054 -1.457 419 1HB LEU 53 HB2 LEU 53 238.689 1.619 -3.461 420 2HB LEU 53 HB1 LEU 53 237.205 1.541 -4.392 421 HG LEU 53 HG LEU 53 236.925 3.975 -4.101 422 1HD1 LEU 53 HD11 LEU 53 238.256 5.243 -2.812 423 2HD1 LEU 53 HD12 LEU 53 239.704 4.320 -3.216 424 3HD1 LEU 53 HD13 LEU 53 238.583 3.715 -1.996 425 1HD2 LEU 53 HD21 LEU 53 237.873 3.584 -6.142 426 2HD2 LEU 53 HD22 LEU 53 239.274 2.762 -5.458 427 3HD2 LEU 53 HD23 LEU 53 239.168 4.522 -5.398 428 H GLN 54 HN GLN 54 234.866 1.799 -3.755 429 HA GLN 54 HA GLN 54 233.909 4.419 -3.478 430 1HB GLN 54 HB2 GLN 54 233.020 3.288 -5.298 431 2HB GLN 54 HB1 GLN 54 232.706 1.829 -4.372 432 1HG GLN 54 HG2 GLN 54 230.758 2.717 -3.419 433 2HG GLN 54 HG1 GLN 54 231.179 4.364 -3.887 434 1HE2 GLN 54 HE21 GLN 54 230.089 5.127 -5.541 435 2HE2 GLN 54 HE22 GLN 54 229.390 4.203 -6.822 436 H GLU 55 HN GLU 55 233.559 1.614 -1.487 437 HA GLU 55 HA GLU 55 231.351 2.657 0.044 438 1HB GLU 55 HB2 GLU 55 232.993 0.171 0.090 439 2HB GLU 55 HB1 GLU 55 232.098 0.609 1.539 440 1HG GLU 55 HG2 GLU 55 230.717 0.545 -1.106 441 2HG GLU 55 HG1 GLU 55 231.025 -0.953 -0.228 442 H GLU 56 HN GLU 56 234.803 2.829 0.231 443 HA GLU 56 HA GLU 56 234.943 3.253 3.042 444 1HB GLU 56 HB2 GLU 56 236.789 3.027 0.858 445 2HB GLU 56 HB1 GLU 56 237.210 4.420 1.848 446 1HG GLU 56 HG2 GLU 56 236.889 1.574 2.774 447 2HG GLU 56 HG1 GLU 56 238.391 2.485 2.640 448 H SER 57 HN SER 57 234.943 5.491 0.261 449 HA SER 57 HA SER 57 234.125 7.603 2.116 450 1HB SER 57 HB2 SER 57 236.682 7.582 1.698 451 2HB SER 57 HB1 SER 57 236.272 8.202 0.099 452 HG SER 57 HG SER 57 235.000 9.824 1.364 453 H GLY 58 HN GLY 58 232.755 6.096 0.015 454 1HA GLY 58 HA2 GLY 58 231.317 6.465 -1.735 455 2HA GLY 58 HA1 GLY 58 231.260 8.122 -1.153 456 H LEU 59 HN LEU 59 234.386 7.089 -2.018 457 HA LEU 59 HA LEU 59 234.248 8.698 -4.464 458 1HB LEU 59 HB2 LEU 59 236.578 7.778 -2.781 459 2HB LEU 59 HB1 LEU 59 236.751 8.636 -4.300 460 HG LEU 59 HG LEU 59 235.901 9.653 -1.635 461 1HD1 LEU 59 HD11 LEU 59 237.671 10.981 -1.909 462 2HD1 LEU 59 HD12 LEU 59 237.166 11.454 -3.531 463 3HD1 LEU 59 HD13 LEU 59 238.088 9.970 -3.293 464 1HD2 LEU 59 HD21 LEU 59 234.887 11.641 -2.711 465 2HD2 LEU 59 HD22 LEU 59 233.941 10.169 -2.931 466 3HD2 LEU 59 HD23 LEU 59 234.931 10.788 -4.253 467 H THR 60 HN THR 60 233.806 7.548 -6.200 468 HA THR 60 HA THR 60 234.759 4.797 -6.383 469 HB THR 60 HB THR 60 233.327 5.859 -8.696 470 HG1 THR 60 HG1 THR 60 231.345 6.068 -7.588 471 1HG2 THR 60 HG21 THR 60 232.818 3.713 -8.814 472 2HG2 THR 60 HG22 THR 60 231.818 3.903 -7.372 473 3HG2 THR 60 HG23 THR 60 233.509 3.427 -7.217 474 H VAL 61 HN VAL 61 235.438 4.247 -8.817 475 HA VAL 61 HA VAL 61 237.186 6.356 -9.835 476 HB VAL 61 HB VAL 61 239.126 4.919 -9.963 477 1HG1 VAL 61 HG11 VAL 61 237.882 5.167 -7.239 478 2HG1 VAL 61 HG12 VAL 61 239.067 6.225 -8.002 479 3HG1 VAL 61 HG13 VAL 61 239.536 4.606 -7.484 480 1HG2 VAL 61 HG21 VAL 61 237.194 2.852 -9.224 481 2HG2 VAL 61 HG22 VAL 61 238.717 2.758 -8.339 482 3HG2 VAL 61 HG23 VAL 61 238.718 2.721 -10.103 483 H ASP 62 HN ASP 62 237.472 6.351 -11.988 484 HA ASP 62 HA ASP 62 235.815 4.583 -13.546 485 1HB ASP 62 HB2 ASP 62 236.525 7.167 -13.882 486 2HB ASP 62 HB1 ASP 62 237.727 6.393 -14.911 487 H ALA 63 HN ALA 63 239.043 4.628 -12.452 488 HA ALA 63 HA ALA 63 239.690 2.123 -13.452 489 1HB ALA 63 HB1 ALA 63 241.546 3.117 -15.089 490 2HB ALA 63 HB2 ALA 63 240.315 4.364 -15.285 491 3HB ALA 63 HB3 ALA 63 239.928 2.681 -15.641 492 H LEU 64 HN LEU 64 240.571 1.882 -11.400 493 HA LEU 64 HA LEU 64 242.386 3.605 -10.137 494 1HB LEU 64 HB2 LEU 64 241.750 0.693 -9.916 495 2HB LEU 64 HB1 LEU 64 243.182 1.298 -9.108 496 HG LEU 64 HG LEU 64 240.695 2.807 -8.590 497 1HD1 LEU 64 HD11 LEU 64 241.063 0.236 -7.126 498 2HD1 LEU 64 HD12 LEU 64 240.196 0.251 -8.662 499 3HD1 LEU 64 HD13 LEU 64 239.618 1.229 -7.312 500 1HD2 LEU 64 HD21 LEU 64 242.336 1.736 -6.404 501 2HD2 LEU 64 HD22 LEU 64 241.777 3.381 -6.704 502 3HD2 LEU 64 HD23 LEU 64 243.205 2.771 -7.539 503 H HIS 65 HN HIS 65 244.729 2.783 -9.615 504 HA HIS 65 HA HIS 65 246.012 1.743 -12.041 505 1HB HIS 65 HB2 HIS 65 246.054 4.394 -11.550 506 2HB HIS 65 HB1 HIS 65 247.464 3.899 -10.617 507 HD1 HIS 65 HD1 HIS 65 246.126 3.802 -14.153 508 HD2 HIS 65 HD2 HIS 65 249.714 3.396 -12.098 509 HE1 HIS 65 HE1 HIS 65 247.908 3.710 -15.924 510 HE2 HIS 65 HE2 HIS 65 250.078 3.553 -14.654 511 H LYS 66 HN LYS 66 246.694 -0.182 -11.238 512 HA LYS 66 HA LYS 66 247.630 -0.602 -8.603 513 1HB LYS 66 HB2 LYS 66 248.712 -2.688 -9.692 514 2HB LYS 66 HB1 LYS 66 246.961 -2.565 -9.679 515 1HG LYS 66 HG2 LYS 66 246.822 -2.403 -11.919 516 2HG LYS 66 HG1 LYS 66 248.293 -1.437 -12.048 517 1HD LYS 66 HD2 LYS 66 249.009 -3.383 -13.019 518 2HD LYS 66 HD1 LYS 66 249.435 -3.706 -11.337 519 1HE LYS 66 HE2 LYS 66 246.700 -4.465 -12.118 520 2HE LYS 66 HE1 LYS 66 247.988 -5.380 -12.900 521 1HZ LYS 66 HZ1 LYS 66 248.828 -5.417 -10.381 522 2HZ LYS 66 HZ2 LYS 66 247.823 -6.608 -11.038 523 3HZ LYS 66 HZ3 LYS 66 247.158 -5.355 -10.117 524 H VAL 67 HN VAL 67 249.626 -0.378 -7.696 525 HA VAL 67 HA VAL 67 251.828 0.306 -9.536 526 HB VAL 67 HB VAL 67 252.663 1.973 -7.939 527 1HG1 VAL 67 HG11 VAL 67 249.961 2.268 -9.181 528 2HG1 VAL 67 HG12 VAL 67 251.502 2.979 -9.661 529 3HG1 VAL 67 HG13 VAL 67 250.650 3.595 -8.246 530 1HG2 VAL 67 HG21 VAL 67 250.881 2.794 -6.257 531 2HG2 VAL 67 HG22 VAL 67 251.856 1.384 -5.847 532 3HG2 VAL 67 HG23 VAL 67 250.205 1.175 -6.429 533 H GLY 68 HN GLY 68 251.076 -0.695 -6.184 534 1HA GLY 68 HA2 GLY 68 253.454 -2.417 -6.340 535 2HA GLY 68 HA1 GLY 68 253.286 -1.321 -4.982 536 H GLN 69 HN GLN 69 253.145 -4.403 -5.645 537 HA GLN 69 HA GLN 69 250.727 -4.977 -4.079 538 1HB GLN 69 HB2 GLN 69 252.476 -6.808 -5.736 539 2HB GLN 69 HB1 GLN 69 251.063 -7.323 -4.825 540 1HG GLN 69 HG2 GLN 69 249.603 -6.091 -6.224 541 2HG GLN 69 HG1 GLN 69 250.947 -5.247 -6.993 542 1HE2 GLN 69 HE21 GLN 69 251.188 -5.903 -8.997 543 2HE2 GLN 69 HE22 GLN 69 251.052 -7.527 -9.567 544 H ILE 70 HN ILE 70 251.034 -5.227 -1.960 545 HA ILE 70 HA ILE 70 253.674 -6.132 -1.032 546 HB ILE 70 HB ILE 70 251.553 -4.680 0.541 547 1HG1 ILE 70 HG12 ILE 70 254.162 -3.510 -0.386 548 2HG1 ILE 70 HG11 ILE 70 252.725 -3.444 -1.402 549 1HG2 ILE 70 HG21 ILE 70 253.305 -4.360 2.203 550 2HG2 ILE 70 HG22 ILE 70 254.430 -5.281 1.206 551 3HG2 ILE 70 HG23 ILE 70 253.021 -6.075 1.910 552 1HD1 ILE 70 HD11 ILE 70 251.559 -2.325 0.527 553 2HD1 ILE 70 HD12 ILE 70 252.838 -1.392 -0.250 554 3HD1 ILE 70 HD13 ILE 70 253.142 -2.192 1.293 555 H VAL 71 HN VAL 71 253.846 -7.654 0.601 556 HA VAL 71 HA VAL 71 251.479 -9.356 1.021 557 HB VAL 71 HB VAL 71 254.343 -10.302 0.900 558 1HG1 VAL 71 HG11 VAL 71 251.762 -11.843 0.774 559 2HG1 VAL 71 HG12 VAL 71 252.757 -11.660 2.219 560 3HG1 VAL 71 HG13 VAL 71 253.395 -12.507 0.808 561 1HG2 VAL 71 HG21 VAL 71 253.929 -11.109 -1.316 562 2HG2 VAL 71 HG22 VAL 71 253.542 -9.389 -1.278 563 3HG2 VAL 71 HG23 VAL 71 252.247 -10.585 -1.246 564 H PHE 72 HN PHE 72 251.275 -10.348 3.074 565 HA PHE 72 HA PHE 72 253.072 -9.293 5.149 566 1HB PHE 72 HB2 PHE 72 250.059 -9.462 5.227 567 2HB PHE 72 HB1 PHE 72 251.056 -9.152 6.644 568 HD1 PHE 72 HD1 PHE 72 251.229 -6.966 7.285 569 HD2 PHE 72 HD2 PHE 72 250.732 -7.856 3.154 570 HE1 PHE 72 HE1 PHE 72 251.215 -4.560 6.773 571 HE2 PHE 72 HE2 PHE 72 250.720 -5.452 2.633 572 HZ PHE 72 HZ PHE 72 250.961 -3.800 4.443 573 H GLU 73 HN GLU 73 254.064 -10.879 6.168 574 HA GLU 73 HA GLU 73 252.788 -13.523 6.273 575 1HB GLU 73 HB2 GLU 73 254.976 -13.578 5.270 576 2HB GLU 73 HB1 GLU 73 255.668 -12.669 6.605 577 1HG GLU 73 HG2 GLU 73 255.498 -14.497 8.073 578 2HG GLU 73 HG1 GLU 73 254.421 -15.370 6.985 579 H PHE 74 HN PHE 74 251.769 -14.009 8.096 580 HA PHE 74 HA PHE 74 252.333 -12.538 10.531 581 1HB PHE 74 HB2 PHE 74 250.296 -14.649 9.821 582 2HB PHE 74 HB1 PHE 74 250.477 -14.023 11.457 583 HD1 PHE 74 HD1 PHE 74 248.684 -13.697 8.508 584 HD2 PHE 74 HD2 PHE 74 250.506 -11.350 11.553 585 HE1 PHE 74 HE1 PHE 74 247.194 -11.821 7.948 586 HE2 PHE 74 HE2 PHE 74 249.019 -9.470 11.000 587 HZ PHE 74 HZ PHE 74 247.361 -9.703 9.195 588 H VAL 75 HN VAL 75 253.432 -13.098 12.162 589 HA VAL 75 HA VAL 75 254.889 -15.585 12.050 590 HB VAL 75 HB VAL 75 255.209 -13.461 14.133 591 1HG1 VAL 75 HG11 VAL 75 256.465 -15.260 14.740 592 2HG1 VAL 75 HG12 VAL 75 257.620 -14.360 13.753 593 3HG1 VAL 75 HG13 VAL 75 256.768 -15.747 13.072 594 1HG2 VAL 75 HG21 VAL 75 256.251 -12.051 12.734 595 2HG2 VAL 75 HG22 VAL 75 255.372 -12.898 11.464 596 3HG2 VAL 75 HG23 VAL 75 257.031 -13.358 11.844 597 H GLY 76 HN GLY 76 252.053 -14.739 13.224 598 1HA GLY 76 HA2 GLY 76 252.241 -16.626 15.483 599 2HA GLY 76 HA1 GLY 76 251.192 -15.211 15.515 600 H GLU 77 HN GLU 77 251.202 -16.255 12.417 601 HA GLU 77 HA GLU 77 249.060 -18.230 12.796 602 1HB GLU 77 HB2 GLU 77 248.866 -15.610 11.353 603 2HB GLU 77 HB1 GLU 77 247.912 -16.981 10.805 604 1HG GLU 77 HG2 GLU 77 247.306 -17.060 13.402 605 2HG GLU 77 HG1 GLU 77 247.651 -15.338 13.243 606 HA PRO 78 HA PRO 78 251.109 -20.296 9.476 607 1HB PRO 78 HB2 PRO 78 249.116 -21.833 8.503 608 2HB PRO 78 HB1 PRO 78 249.852 -22.133 10.082 609 1HG PRO 78 HG2 PRO 78 247.283 -20.744 9.423 610 2HG PRO 78 HG1 PRO 78 247.622 -21.919 10.707 611 1HD PRO 78 HD2 PRO 78 247.517 -19.231 11.136 612 2HD PRO 78 HD1 PRO 78 248.529 -20.328 12.094 613 H GLU 79 HN GLU 79 248.046 -18.694 8.764 614 HA GLU 79 HA GLU 79 248.420 -18.703 5.928 615 1HB GLU 79 HB2 GLU 79 246.304 -18.187 7.677 616 2HB GLU 79 HB1 GLU 79 246.616 -16.644 6.891 617 1HG GLU 79 HG2 GLU 79 246.604 -18.052 4.712 618 2HG GLU 79 HG1 GLU 79 245.746 -19.235 5.700 619 H LEU 80 HN LEU 80 247.794 -16.172 5.124 620 HA LEU 80 HA LEU 80 249.734 -14.316 6.242 621 1HB LEU 80 HB2 LEU 80 249.905 -14.664 3.299 622 2HB LEU 80 HB1 LEU 80 251.138 -14.162 4.440 623 HG LEU 80 HG LEU 80 250.185 -17.003 4.363 624 1HD1 LEU 80 HD11 LEU 80 250.982 -16.067 2.082 625 2HD1 LEU 80 HD12 LEU 80 251.643 -17.591 2.672 626 3HD1 LEU 80 HD13 LEU 80 252.582 -16.106 2.824 627 1HD2 LEU 80 HD21 LEU 80 251.797 -15.730 6.105 628 2HD2 LEU 80 HD22 LEU 80 252.983 -16.270 4.915 629 3HD2 LEU 80 HD23 LEU 80 251.936 -17.445 5.712 630 H MET 81 HN MET 81 249.732 -12.416 4.246 631 HA MET 81 HA MET 81 246.961 -11.945 3.505 632 1HB MET 81 HB2 MET 81 247.873 -10.885 5.865 633 2HB MET 81 HB1 MET 81 248.177 -9.573 4.734 634 1HG MET 81 HG2 MET 81 245.695 -10.115 4.005 635 2HG MET 81 HG1 MET 81 245.612 -10.733 5.655 636 1HE MET 81 HE1 MET 81 247.685 -7.131 4.624 637 2HE MET 81 HE2 MET 81 246.107 -6.548 4.094 638 3HE MET 81 HE3 MET 81 246.770 -8.036 3.417 639 H ASP 82 HN ASP 82 247.140 -11.566 1.385 640 HA ASP 82 HA ASP 82 249.444 -10.020 0.414 641 1HB ASP 82 HB2 ASP 82 249.011 -12.241 -0.626 642 2HB ASP 82 HB1 ASP 82 247.442 -11.655 -1.167 643 H VAL 83 HN VAL 83 248.928 -7.884 0.560 644 HA VAL 83 HA VAL 83 246.298 -7.062 -0.477 645 HB VAL 83 HB VAL 83 246.682 -6.484 1.884 646 1HG1 VAL 83 HG11 VAL 83 249.255 -6.015 1.188 647 2HG1 VAL 83 HG12 VAL 83 248.505 -5.425 2.671 648 3HG1 VAL 83 HG13 VAL 83 248.627 -4.369 1.264 649 1HG2 VAL 83 HG21 VAL 83 246.514 -4.197 -0.068 650 2HG2 VAL 83 HG22 VAL 83 246.206 -4.029 1.660 651 3HG2 VAL 83 HG23 VAL 83 245.184 -5.080 0.680 652 H HIS 84 HN HIS 84 246.323 -6.211 -2.421 653 HA HIS 84 HA HIS 84 248.741 -5.219 -3.624 654 1HB HIS 84 HB2 HIS 84 245.875 -5.426 -4.545 655 2HB HIS 84 HB1 HIS 84 247.100 -4.609 -5.510 656 HD1 HIS 84 HD1 HIS 84 246.621 -6.493 -7.321 657 HD2 HIS 84 HD2 HIS 84 248.359 -7.806 -3.783 658 HE1 HIS 84 HE1 HIS 84 247.510 -8.791 -7.823 659 HE2 HIS 84 HE2 HIS 84 248.478 -9.601 -5.641 660 H VAL 85 HN VAL 85 249.016 -3.030 -4.414 661 HA VAL 85 HA VAL 85 247.460 -1.094 -2.823 662 HB VAL 85 HB VAL 85 250.282 -0.653 -3.798 663 1HG1 VAL 85 HG11 VAL 85 249.896 0.889 -1.594 664 2HG1 VAL 85 HG12 VAL 85 248.286 0.894 -2.314 665 3HG1 VAL 85 HG13 VAL 85 249.677 1.433 -3.257 666 1HG2 VAL 85 HG21 VAL 85 251.085 -1.915 -2.151 667 2HG2 VAL 85 HG22 VAL 85 249.443 -2.418 -1.750 668 3HG2 VAL 85 HG23 VAL 85 250.148 -1.005 -0.967 669 H PHE 86 HN PHE 86 246.004 -0.333 -4.192 670 HA PHE 86 HA PHE 86 246.767 0.374 -6.926 671 1HB PHE 86 HB2 PHE 86 244.279 -0.403 -5.544 672 2HB PHE 86 HB1 PHE 86 244.079 0.902 -6.705 673 HD1 PHE 86 HD1 PHE 86 244.294 -2.603 -6.251 674 HD2 PHE 86 HD2 PHE 86 244.994 0.500 -9.078 675 HE1 PHE 86 HE1 PHE 86 244.193 -4.250 -8.077 676 HE2 PHE 86 HE2 PHE 86 244.895 -1.141 -10.909 677 HZ PHE 86 HZ PHE 86 244.493 -3.519 -10.409 678 H CYS 87 HN CYS 87 246.338 2.424 -7.778 679 HA CYS 87 HA CYS 87 245.619 4.563 -5.898 680 1HB CYS 87 HB2 CYS 87 248.162 4.298 -7.460 681 2HB CYS 87 HB1 CYS 87 247.458 5.902 -7.278 682 HG CYS 87 HG CYS 87 247.885 5.810 -4.771 683 H THR 88 HN THR 88 243.896 5.546 -6.797 684 HA THR 88 HA THR 88 243.518 5.331 -9.682 685 HB THR 88 HB THR 88 241.680 4.684 -8.166 686 HG1 THR 88 HG1 THR 88 241.209 5.461 -10.266 687 1HG2 THR 88 HG21 THR 88 240.825 7.398 -7.619 688 2HG2 THR 88 HG22 THR 88 242.271 6.915 -6.731 689 3HG2 THR 88 HG23 THR 88 240.792 5.960 -6.598 690 H ASP 89 HN ASP 89 242.175 7.352 -10.528 691 HA ASP 89 HA ASP 89 243.366 9.863 -9.634 692 1HB ASP 89 HB2 ASP 89 244.758 8.774 -11.515 693 2HB ASP 89 HB1 ASP 89 243.398 9.162 -12.565 694 H SER 90 HN SER 90 241.193 8.270 -11.934 695 HA SER 90 HA SER 90 239.468 10.625 -11.995 696 1HB SER 90 HB2 SER 90 240.187 8.874 -13.969 697 2HB SER 90 HB1 SER 90 238.631 8.209 -13.472 698 HG SER 90 HG SER 90 237.708 10.254 -13.846 699 H ILE 91 HN ILE 91 238.435 10.631 -10.007 700 HA ILE 91 HA ILE 91 236.983 8.198 -9.259 701 HB ILE 91 HB ILE 91 236.620 9.367 -7.048 702 1HG1 ILE 91 HG12 ILE 91 238.866 11.187 -7.889 703 2HG1 ILE 91 HG11 ILE 91 237.189 11.648 -8.165 704 1HG2 ILE 91 HG21 ILE 91 239.131 9.132 -6.428 705 2HG2 ILE 91 HG22 ILE 91 239.309 8.567 -8.089 706 3HG2 ILE 91 HG23 ILE 91 238.237 7.715 -6.978 707 1HD1 ILE 91 HD11 ILE 91 237.247 10.837 -5.518 708 2HD1 ILE 91 HD12 ILE 91 237.208 12.494 -6.120 709 3HD1 ILE 91 HD13 ILE 91 238.752 11.730 -5.744 710 H GLN 92 HN GLN 92 234.917 8.804 -7.918 711 HA GLN 92 HA GLN 92 233.280 10.501 -9.676 712 1HB GLN 92 HB2 GLN 92 232.479 8.254 -7.815 713 2HB GLN 92 HB1 GLN 92 231.351 9.228 -8.747 714 1HG GLN 92 HG2 GLN 92 233.555 7.673 -10.056 715 2HG GLN 92 HG1 GLN 92 231.996 6.945 -9.671 716 1HE2 GLN 92 HE21 GLN 92 233.529 9.582 -11.434 717 2HE2 GLN 92 HE22 GLN 92 232.312 9.716 -12.655 718 H GLY 93 HN GLY 93 234.228 12.305 -8.478 719 1HA GLY 93 HA2 GLY 93 234.381 13.154 -6.059 720 2HA GLY 93 HA1 GLY 93 233.439 14.118 -7.180 721 H THR 94 HN THR 94 233.364 11.906 -4.525 722 HA THR 94 HA THR 94 230.859 12.938 -3.605 723 HB THR 94 HB THR 94 231.023 10.043 -4.450 724 HG1 THR 94 HG1 THR 94 230.225 10.822 -6.211 725 1HG2 THR 94 HG21 THR 94 229.166 11.445 -2.650 726 2HG2 THR 94 HG22 THR 94 229.607 9.740 -2.731 727 3HG2 THR 94 HG23 THR 94 228.437 10.403 -3.872 728 HA PRO 95 HA PRO 95 233.833 11.164 -0.457 729 1HB PRO 95 HB2 PRO 95 234.756 13.473 0.596 730 2HB PRO 95 HB1 PRO 95 235.525 12.705 -0.797 731 1HG PRO 95 HG2 PRO 95 233.652 15.025 -0.703 732 2HG PRO 95 HG1 PRO 95 235.083 14.777 -1.720 733 1HD PRO 95 HD2 PRO 95 232.503 14.391 -2.568 734 2HD PRO 95 HD1 PRO 95 233.915 13.580 -3.272 735 H VAL 96 HN VAL 96 231.489 10.753 0.054 736 HA VAL 96 HA VAL 96 230.098 12.666 1.669 737 HB VAL 96 HB VAL 96 229.457 9.730 1.627 738 1HG1 VAL 96 HG11 VAL 96 227.111 11.005 1.454 739 2HG1 VAL 96 HG12 VAL 96 228.059 12.252 2.264 740 3HG1 VAL 96 HG13 VAL 96 227.907 10.651 2.988 741 1HG2 VAL 96 HG21 VAL 96 227.933 10.544 -0.383 742 2HG2 VAL 96 HG22 VAL 96 229.564 9.926 -0.642 743 3HG2 VAL 96 HG23 VAL 96 229.273 11.665 -0.619 744 H GLU 97 HN GLU 97 232.178 12.829 2.987 745 HA GLU 97 HA GLU 97 233.225 11.084 4.754 746 1HB GLU 97 HB2 GLU 97 232.368 13.786 5.758 747 2HB GLU 97 HB1 GLU 97 233.824 12.884 6.149 748 1HG GLU 97 HG2 GLU 97 234.829 14.250 4.707 749 2HG GLU 97 HG1 GLU 97 234.096 13.239 3.462 750 H SER 98 HN SER 98 232.181 9.537 5.839 751 HA SER 98 HA SER 98 229.596 10.051 7.050 752 1HB SER 98 HB2 SER 98 230.965 7.469 7.546 753 2HB SER 98 HB1 SER 98 229.301 7.791 7.061 754 HG SER 98 HG SER 98 231.187 6.929 5.525 755 H ASP 99 HN ASP 99 229.531 8.590 9.290 756 HA ASP 99 HA ASP 99 230.964 10.253 11.146 757 1HB ASP 99 HB2 ASP 99 229.005 7.986 11.499 758 2HB ASP 99 HB1 ASP 99 229.765 8.807 12.858 759 H GLU 100 HN GLU 100 231.820 7.495 9.494 760 HA GLU 100 HA GLU 100 233.624 6.633 11.656 761 1HB GLU 100 HB2 GLU 100 231.879 5.132 9.979 762 2HB GLU 100 HB1 GLU 100 233.530 4.697 9.562 763 1HG GLU 100 HG2 GLU 100 233.989 4.179 11.903 764 2HG GLU 100 HG1 GLU 100 232.333 4.616 12.323 765 H MET 101 HN MET 101 233.384 7.284 8.184 766 HA MET 101 HA MET 101 236.323 7.358 8.064 767 1HB MET 101 HB2 MET 101 234.467 6.110 6.384 768 2HB MET 101 HB1 MET 101 235.013 7.517 5.483 769 1HG MET 101 HG2 MET 101 236.327 5.491 5.015 770 2HG MET 101 HG1 MET 101 237.298 6.814 5.658 771 1HE MET 101 HE1 MET 101 239.417 4.870 7.872 772 2HE MET 101 HE2 MET 101 238.792 6.514 8.012 773 3HE MET 101 HE3 MET 101 239.221 5.864 6.429 774 H ARG 102 HN ARG 102 237.332 9.048 6.822 775 HA ARG 102 HA ARG 102 235.769 11.392 6.164 776 1HB ARG 102 HB2 ARG 102 236.107 11.693 8.570 777 2HB ARG 102 HB1 ARG 102 237.839 11.457 8.374 778 1HG ARG 102 HG2 ARG 102 238.037 13.497 7.130 779 2HG ARG 102 HG1 ARG 102 236.284 13.703 7.109 780 1HD ARG 102 HD2 ARG 102 236.265 13.956 9.525 781 2HD ARG 102 HD1 ARG 102 238.006 13.676 9.586 782 HE ARG 102 HE ARG 102 237.772 15.799 7.922 783 1HH1 ARG 102 HH11 ARG 102 236.571 15.130 11.130 784 2HH1 ARG 102 HH12 ARG 102 236.592 16.792 11.620 785 1HH2 ARG 102 HH21 ARG 102 237.801 17.983 8.564 786 2HH2 ARG 102 HH22 ARG 102 237.290 18.412 10.162 787 HA PRO 103 HA PRO 103 239.282 10.883 3.287 788 1HB PRO 103 HB2 PRO 103 238.180 12.359 1.291 789 2HB PRO 103 HB1 PRO 103 237.768 10.662 1.566 790 1HG PRO 103 HG2 PRO 103 236.303 13.128 2.436 791 2HG PRO 103 HG1 PRO 103 235.657 11.656 1.687 792 1HD PRO 103 HD2 PRO 103 235.497 12.061 4.339 793 2HD PRO 103 HD1 PRO 103 235.784 10.442 3.668 794 H CYS 104 HN CYS 104 241.015 12.189 3.059 795 HA CYS 104 HA CYS 104 240.632 15.066 3.529 796 1HB CYS 104 HB2 CYS 104 243.033 13.526 4.505 797 2HB CYS 104 HB1 CYS 104 242.568 15.176 4.906 798 HG CYS 104 HG CYS 104 240.445 13.945 6.148 799 H TRP 105 HN TRP 105 241.261 16.220 1.866 800 HA TRP 105 HA TRP 105 243.037 15.072 -0.128 801 1HB TRP 105 HB2 TRP 105 241.595 17.737 -0.117 802 2HB TRP 105 HB1 TRP 105 242.421 17.010 -1.491 803 HD1 TRP 105 HD1 TRP 105 239.724 15.551 0.920 804 HE1 TRP 105 HE1 TRP 105 237.834 14.554 -0.522 805 HE3 TRP 105 HE3 TRP 105 241.532 16.743 -3.713 806 HZ2 TRP 105 HZ2 TRP 105 237.203 14.311 -3.262 807 HZ3 TRP 105 HZ3 TRP 105 240.224 16.092 -5.693 808 HH2 TRP 105 HH2 TRP 105 238.105 14.900 -5.470 809 H PHE 106 HN PHE 106 245.148 15.214 0.328 810 HA PHE 106 HA PHE 106 246.156 17.729 1.487 811 1HB PHE 106 HB2 PHE 106 246.359 15.249 2.574 812 2HB PHE 106 HB1 PHE 106 247.846 15.305 1.637 813 HD1 PHE 106 HD1 PHE 106 246.230 18.189 3.313 814 HD2 PHE 106 HD2 PHE 106 249.409 15.358 3.380 815 HE1 PHE 106 HE1 PHE 106 247.318 19.459 5.116 816 HE2 PHE 106 HE2 PHE 106 250.502 16.627 5.183 817 HZ PHE 106 HZ PHE 106 249.457 18.679 6.054 818 H GLN 107 HN GLN 107 248.888 17.209 1.055 819 HA GLN 107 HA GLN 107 249.020 17.687 -1.829 820 1HB GLN 107 HB2 GLN 107 250.548 18.609 0.510 821 2HB GLN 107 HB1 GLN 107 251.521 18.245 -0.908 822 1HG GLN 107 HG2 GLN 107 250.377 19.841 -2.220 823 2HG GLN 107 HG1 GLN 107 249.115 20.037 -1.004 824 1HE2 GLN 107 HE21 GLN 107 249.981 22.317 -1.672 825 2HE2 GLN 107 HE22 GLN 107 251.156 22.980 -0.593 826 H LEU 108 HN LEU 108 250.435 16.586 -3.172 827 HA LEU 108 HA LEU 108 250.919 13.865 -2.491 828 1HB LEU 108 HB2 LEU 108 251.525 13.568 -4.713 829 2HB LEU 108 HB1 LEU 108 250.414 14.921 -4.797 830 HG LEU 108 HG LEU 108 253.426 15.110 -4.877 831 1HD1 LEU 108 HD11 LEU 108 252.772 16.066 -7.204 832 2HD1 LEU 108 HD12 LEU 108 251.293 15.136 -6.966 833 3HD1 LEU 108 HD13 LEU 108 252.858 14.320 -6.967 834 1HD2 LEU 108 HD21 LEU 108 252.282 17.025 -3.768 835 2HD2 LEU 108 HD22 LEU 108 251.382 17.287 -5.260 836 3HD2 LEU 108 HD23 LEU 108 253.136 17.456 -5.249 837 H ASP 109 HN ASP 109 252.667 16.658 -1.855 838 HA ASP 109 HA ASP 109 255.147 15.107 -1.525 839 1HB ASP 109 HB2 ASP 109 254.963 17.243 -3.117 840 2HB ASP 109 HB1 ASP 109 255.235 18.085 -1.594 841 H GLN 110 HN GLN 110 252.739 15.590 0.254 842 HA GLN 110 HA GLN 110 254.283 16.228 2.624 843 1HB GLN 110 HB2 GLN 110 252.023 17.868 1.595 844 2HB GLN 110 HB1 GLN 110 252.136 17.625 3.332 845 1HG GLN 110 HG2 GLN 110 254.679 18.324 2.774 846 2HG GLN 110 HG1 GLN 110 253.815 19.224 1.528 847 1HE2 GLN 110 HE21 GLN 110 254.823 20.987 2.864 848 2HE2 GLN 110 HE22 GLN 110 253.878 21.618 4.166 849 H ILE 111 HN ILE 111 252.807 13.893 1.348 850 HA ILE 111 HA ILE 111 250.599 13.361 3.108 851 HB ILE 111 HB ILE 111 251.793 10.924 2.104 852 1HG1 ILE 111 HG12 ILE 111 251.016 11.584 -0.334 853 2HG1 ILE 111 HG11 ILE 111 251.506 13.194 0.193 854 1HG2 ILE 111 HG21 ILE 111 249.681 10.333 1.956 855 2HG2 ILE 111 HG22 ILE 111 249.266 11.721 0.952 856 3HG2 ILE 111 HG23 ILE 111 249.305 11.885 2.707 857 1HD1 ILE 111 HD11 ILE 111 253.412 12.320 -0.804 858 2HD1 ILE 111 HD12 ILE 111 253.161 10.723 -0.101 859 3HD1 ILE 111 HD13 ILE 111 253.689 12.061 0.918 860 HA PRO 112 HA PRO 112 253.261 11.912 6.364 861 1HB PRO 112 HB2 PRO 112 251.495 11.990 8.346 862 2HB PRO 112 HB1 PRO 112 252.007 13.486 7.553 863 1HG PRO 112 HG2 PRO 112 249.478 11.934 7.218 864 2HG PRO 112 HG1 PRO 112 249.725 13.688 7.213 865 1HD PRO 112 HD2 PRO 112 249.510 12.019 4.957 866 2HD PRO 112 HD1 PRO 112 250.064 13.705 4.971 867 H PHE 113 HN PHE 113 253.746 9.827 5.780 868 HA PHE 113 HA PHE 113 251.804 7.722 6.060 869 1HB PHE 113 HB2 PHE 113 254.628 6.921 5.931 870 2HB PHE 113 HB1 PHE 113 253.259 6.383 4.976 871 HD1 PHE 113 HD1 PHE 113 256.165 7.057 4.191 872 HD2 PHE 113 HD2 PHE 113 252.500 9.217 3.941 873 HE1 PHE 113 HE1 PHE 113 257.043 8.299 2.270 874 HE2 PHE 113 HE2 PHE 113 253.384 10.462 2.016 875 HZ PHE 113 HZ PHE 113 255.652 10.014 1.177 876 H LYS 114 HN LYS 114 253.996 9.308 8.147 877 HA LYS 114 HA LYS 114 254.575 7.206 9.937 878 1HB LYS 114 HB2 LYS 114 255.523 9.691 9.706 879 2HB LYS 114 HB1 LYS 114 254.312 10.001 10.942 880 1HG LYS 114 HG2 LYS 114 256.342 9.582 12.069 881 2HG LYS 114 HG1 LYS 114 255.347 8.139 12.275 882 1HD LYS 114 HD2 LYS 114 257.300 7.135 11.675 883 2HD LYS 114 HD1 LYS 114 256.635 7.414 10.064 884 1HE LYS 114 HE2 LYS 114 258.749 8.255 9.792 885 2HE LYS 114 HE1 LYS 114 257.886 9.709 10.292 886 1HZ LYS 114 HZ1 LYS 114 258.902 9.732 12.308 887 2HZ LYS 114 HZ2 LYS 114 260.128 8.975 11.422 888 3HZ LYS 114 HZ3 LYS 114 259.085 8.052 12.382 889 H ASP 115 HN ASP 115 251.881 9.331 9.456 890 HA ASP 115 HA ASP 115 250.598 8.310 11.866 891 1HB ASP 115 HB2 ASP 115 249.874 10.630 10.071 892 2HB ASP 115 HB1 ASP 115 248.901 10.105 11.442 893 H MET 116 HN MET 116 251.005 6.790 9.372 894 HA MET 116 HA MET 116 248.186 6.236 8.752 895 1HB MET 116 HB2 MET 116 250.519 6.588 6.959 896 2HB MET 116 HB1 MET 116 249.405 5.292 6.548 897 1HG MET 116 HG2 MET 116 247.755 6.707 5.957 898 2HG MET 116 HG1 MET 116 248.189 7.900 7.176 899 1HE MET 116 HE1 MET 116 250.792 6.327 4.948 900 2HE MET 116 HE2 MET 116 251.041 7.460 3.623 901 3HE MET 116 HE3 MET 116 249.622 6.413 3.632 902 H TRP 117 HN TRP 117 251.112 4.496 7.780 903 HA TRP 117 HA TRP 117 250.584 2.367 9.671 904 1HB TRP 117 HB2 TRP 117 249.558 2.249 7.006 905 2HB TRP 117 HB1 TRP 117 250.837 1.048 7.157 906 HD1 TRP 117 HD1 TRP 117 248.855 1.709 10.305 907 HE1 TRP 117 HE1 TRP 117 247.308 -0.291 10.775 908 HE3 TRP 117 HE3 TRP 117 249.418 -0.812 5.891 909 HZ2 TRP 117 HZ2 TRP 117 246.439 -2.628 9.454 910 HZ3 TRP 117 HZ3 TRP 117 248.193 -2.922 5.575 911 HH2 TRP 117 HH2 TRP 117 246.735 -3.810 7.321 912 HA PRO 118 HA PRO 118 254.917 1.665 9.160 913 1HB PRO 118 HB2 PRO 118 255.226 -0.907 9.749 914 2HB PRO 118 HB1 PRO 118 254.554 0.216 10.937 915 1HG PRO 118 HG2 PRO 118 253.139 -1.749 9.179 916 2HG PRO 118 HG1 PRO 118 252.853 -1.367 10.885 917 1HD PRO 118 HD2 PRO 118 251.398 -0.338 8.767 918 2HD PRO 118 HD1 PRO 118 251.509 0.402 10.375 919 H ASP 119 HN ASP 119 253.076 0.980 6.667 920 HA ASP 119 HA ASP 119 255.236 -0.364 5.189 921 1HB ASP 119 HB2 ASP 119 253.304 -1.273 3.721 922 2HB ASP 119 HB1 ASP 119 253.626 -2.052 5.267 923 H ASP 120 HN ASP 120 252.757 2.080 5.254 924 HA ASP 120 HA ASP 120 252.473 2.892 2.677 925 1HB ASP 120 HB2 ASP 120 252.693 4.504 5.198 926 2HB ASP 120 HB1 ASP 120 252.332 5.250 3.643 927 H SER 121 HN SER 121 255.085 4.002 4.827 928 HA SER 121 HA SER 121 256.409 5.607 2.961 929 1HB SER 121 HB2 SER 121 257.981 4.131 5.032 930 2HB SER 121 HB1 SER 121 258.077 5.822 4.543 931 HG SER 121 HG SER 121 256.803 6.238 6.145 932 H TYR 122 HN TYR 122 256.222 2.182 3.088 933 HA TYR 122 HA TYR 122 258.741 1.735 1.769 934 1HB TYR 122 HB2 TYR 122 256.459 -0.135 2.412 935 2HB TYR 122 HB1 TYR 122 257.976 -0.637 1.674 936 HD1 TYR 122 HD1 TYR 122 256.626 1.071 4.699 937 HD2 TYR 122 HD2 TYR 122 259.772 -1.251 3.024 938 HE1 TYR 122 HE1 TYR 122 257.625 0.827 6.932 939 HE2 TYR 122 HE2 TYR 122 260.779 -1.504 5.253 940 HH TYR 122 HH TYR 122 260.129 -1.397 7.590 941 H TRP 123 HN TRP 123 255.395 2.149 0.797 942 HA TRP 123 HA TRP 123 256.242 1.531 -1.944 943 1HB TRP 123 HB2 TRP 123 253.851 1.139 -2.480 944 2HB TRP 123 HB1 TRP 123 254.506 0.013 -1.301 945 HD1 TRP 123 HD1 TRP 123 253.688 0.374 1.290 946 HE1 TRP 123 HE1 TRP 123 251.457 1.287 2.193 947 HE3 TRP 123 HE3 TRP 123 252.036 2.791 -2.904 948 HZ2 TRP 123 HZ2 TRP 123 249.282 2.844 1.253 949 HZ3 TRP 123 HZ3 TRP 123 249.867 3.954 -2.812 950 HH2 TRP 123 HH2 TRP 123 248.527 3.966 -0.784 951 H PHE 124 HN PHE 124 255.182 4.044 0.095 952 HA PHE 124 HA PHE 124 253.867 5.706 -1.752 953 1HB PHE 124 HB2 PHE 124 255.114 6.020 0.899 954 2HB PHE 124 HB1 PHE 124 255.091 7.485 -0.075 955 HD1 PHE 124 HD1 PHE 124 252.749 4.691 0.753 956 HD2 PHE 124 HD2 PHE 124 253.319 8.881 0.294 957 HE1 PHE 124 HE1 PHE 124 250.419 5.085 1.434 958 HE2 PHE 124 HE2 PHE 124 251.004 9.284 0.974 959 HZ PHE 124 HZ PHE 124 249.543 7.385 1.547 960 HA PRO 125 HA PRO 125 258.304 7.737 -2.417 961 1HB PRO 125 HB2 PRO 125 259.953 5.314 -1.950 962 2HB PRO 125 HB1 PRO 125 260.276 6.995 -1.518 963 1HG PRO 125 HG2 PRO 125 259.578 5.216 0.339 964 2HG PRO 125 HG1 PRO 125 258.990 6.888 0.405 965 1HD PRO 125 HD2 PRO 125 257.564 4.406 -0.462 966 2HD PRO 125 HD1 PRO 125 256.956 5.796 0.460 967 H LEU 126 HN LEU 126 257.582 4.374 -3.172 968 HA LEU 126 HA LEU 126 258.928 4.454 -5.715 969 1HB LEU 126 HB2 LEU 126 257.210 2.456 -4.290 970 2HB LEU 126 HB1 LEU 126 257.555 2.253 -5.998 971 HG LEU 126 HG LEU 126 259.871 2.713 -4.198 972 1HD1 LEU 126 HD11 LEU 126 259.296 -0.099 -4.347 973 2HD1 LEU 126 HD12 LEU 126 257.986 0.757 -3.535 974 3HD1 LEU 126 HD13 LEU 126 259.638 0.903 -2.938 975 1HD2 LEU 126 HD21 LEU 126 259.683 2.241 -6.811 976 2HD2 LEU 126 HD22 LEU 126 259.731 0.572 -6.242 977 3HD2 LEU 126 HD23 LEU 126 261.046 1.677 -5.842 978 H LEU 127 HN LEU 127 255.704 4.956 -4.491 979 HA LEU 127 HA LEU 127 254.281 4.816 -6.919 980 1HB LEU 127 HB2 LEU 127 253.754 6.444 -4.432 981 2HB LEU 127 HB1 LEU 127 252.613 6.253 -5.748 982 HG LEU 127 HG LEU 127 253.125 4.534 -3.485 983 1HD1 LEU 127 HD11 LEU 127 250.936 5.216 -3.873 984 2HD1 LEU 127 HD12 LEU 127 250.955 3.534 -4.403 985 3HD1 LEU 127 HD13 LEU 127 251.021 4.833 -5.593 986 1HD2 LEU 127 HD21 LEU 127 253.117 3.197 -6.191 987 2HD2 LEU 127 HD22 LEU 127 252.991 2.386 -4.631 988 3HD2 LEU 127 HD23 LEU 127 254.473 3.232 -5.066 989 H LEU 128 HN LEU 128 255.603 7.565 -5.116 990 HA LEU 128 HA LEU 128 254.989 9.578 -6.955 991 1HB LEU 128 HB2 LEU 128 256.928 9.258 -4.731 992 2HB LEU 128 HB1 LEU 128 257.231 10.563 -5.862 993 HG LEU 128 HG LEU 128 254.500 10.326 -4.695 994 1HD1 LEU 128 HD11 LEU 128 256.474 11.907 -3.164 995 2HD1 LEU 128 HD12 LEU 128 256.501 10.158 -2.942 996 3HD1 LEU 128 HD13 LEU 128 255.024 11.066 -2.620 997 1HD2 LEU 128 HD21 LEU 128 256.239 12.713 -5.293 998 2HD2 LEU 128 HD22 LEU 128 254.512 12.708 -4.939 999 3HD2 LEU 128 HD23 LEU 128 255.107 11.996 -6.439 1000 H GLN 129 HN GLN 129 257.463 7.163 -6.982 1001 HA GLN 129 HA GLN 129 259.069 8.477 -8.992 1002 1HB GLN 129 HB2 GLN 129 259.323 6.165 -7.247 1003 2HB GLN 129 HB1 GLN 129 259.860 5.812 -8.883 1004 1HG GLN 129 HG2 GLN 129 261.710 6.558 -7.521 1005 2HG GLN 129 HG1 GLN 129 261.375 7.726 -8.800 1006 1HE2 GLN 129 HE21 GLN 129 260.775 9.765 -8.278 1007 2HE2 GLN 129 HE22 GLN 129 260.682 10.361 -6.659 1008 H LYS 130 HN LYS 130 256.141 7.102 -9.170 1009 HA LYS 130 HA LYS 130 254.878 6.106 -10.758 1010 1HB LYS 130 HB2 LYS 130 255.112 6.906 -12.950 1011 2HB LYS 130 HB1 LYS 130 255.770 8.183 -11.941 1012 1HG LYS 130 HG2 LYS 130 257.784 6.267 -12.837 1013 2HG LYS 130 HG1 LYS 130 256.964 7.105 -14.153 1014 1HD LYS 130 HD2 LYS 130 257.773 9.154 -13.540 1015 2HD LYS 130 HD1 LYS 130 257.890 8.718 -11.834 1016 1HE LYS 130 HE2 LYS 130 260.079 8.473 -12.167 1017 2HE LYS 130 HE1 LYS 130 259.685 7.019 -13.082 1018 1HZ LYS 130 HZ1 LYS 130 261.048 9.086 -14.078 1019 2HZ LYS 130 HZ2 LYS 130 259.481 9.505 -14.557 1020 3HZ LYS 130 HZ3 LYS 130 260.137 8.019 -15.025 1021 H LYS 131 HN LYS 131 256.820 4.455 -9.523 1022 HA LYS 131 HA LYS 131 257.381 2.555 -11.709 1023 1HB LYS 131 HB2 LYS 131 258.914 3.059 -9.155 1024 2HB LYS 131 HB1 LYS 131 259.186 1.661 -10.187 1025 1HG LYS 131 HG2 LYS 131 259.273 4.280 -11.530 1026 2HG LYS 131 HG1 LYS 131 260.568 3.956 -10.375 1027 1HD LYS 131 HD2 LYS 131 261.117 1.893 -11.541 1028 2HD LYS 131 HD1 LYS 131 259.783 2.154 -12.666 1029 1HE LYS 131 HE2 LYS 131 260.931 4.375 -13.218 1030 2HE LYS 131 HE1 LYS 131 262.338 3.708 -12.392 1031 1HZ LYS 131 HZ1 LYS 131 262.539 3.266 -14.710 1032 2HZ LYS 131 HZ2 LYS 131 260.987 2.597 -14.789 1033 3HZ LYS 131 HZ3 LYS 131 262.211 1.796 -13.940 1034 H LYS 132 HN LYS 132 257.239 0.275 -11.125 1035 HA LYS 132 HA LYS 132 255.242 -0.171 -9.006 1036 1HB LYS 132 HB2 LYS 132 255.713 -1.733 -11.554 1037 2HB LYS 132 HB1 LYS 132 254.539 -2.156 -10.315 1038 1HG LYS 132 HG2 LYS 132 253.143 -1.037 -11.682 1039 2HG LYS 132 HG1 LYS 132 253.767 0.360 -10.802 1040 1HD LYS 132 HD2 LYS 132 255.503 0.610 -12.580 1041 2HD LYS 132 HD1 LYS 132 254.692 -0.674 -13.481 1042 1HE LYS 132 HE2 LYS 132 253.413 1.921 -12.623 1043 2HE LYS 132 HE1 LYS 132 254.050 1.592 -14.234 1044 1HZ LYS 132 HZ1 LYS 132 252.429 -0.472 -13.964 1045 2HZ LYS 132 HZ2 LYS 132 251.908 1.013 -14.583 1046 3HZ LYS 132 HZ3 LYS 132 251.613 0.621 -12.965 1047 H PHE 133 HN PHE 133 255.573 -1.769 -7.509 1048 HA PHE 133 HA PHE 133 257.816 -3.591 -7.827 1049 1HB PHE 133 HB2 PHE 133 259.104 -2.855 -6.054 1050 2HB PHE 133 HB1 PHE 133 258.524 -1.329 -6.711 1051 HD1 PHE 133 HD1 PHE 133 259.127 -2.983 -3.776 1052 HD2 PHE 133 HD2 PHE 133 256.076 -0.700 -5.670 1053 HE1 PHE 133 HE1 PHE 133 258.201 -2.401 -1.573 1054 HE2 PHE 133 HE2 PHE 133 255.145 -0.111 -3.470 1055 HZ PHE 133 HZ PHE 133 256.209 -0.962 -1.417 1056 H HIS 134 HN HIS 134 257.996 -5.035 -5.837 1057 HA HIS 134 HA HIS 134 255.365 -5.548 -4.629 1058 1HB HIS 134 HB2 HIS 134 256.106 -7.081 -6.644 1059 2HB HIS 134 HB1 HIS 134 257.131 -7.836 -5.429 1060 HD1 HIS 134 HD1 HIS 134 253.984 -8.286 -6.928 1061 HD2 HIS 134 HD2 HIS 134 255.351 -8.497 -3.009 1062 HE1 HIS 134 HE1 HIS 134 252.283 -9.669 -5.696 1063 HE2 HIS 134 HE2 HIS 134 253.083 -9.704 -3.308 1064 H GLY 135 HN GLY 135 255.517 -5.671 -2.445 1065 1HA GLY 135 HA2 GLY 135 258.172 -6.372 -1.344 1066 2HA GLY 135 HA1 GLY 135 257.184 -5.086 -0.669 1067 H TYR 136 HN TYR 136 258.276 -7.544 0.523 1068 HA TYR 136 HA TYR 136 255.752 -8.723 1.477 1069 1HB TYR 136 HB2 TYR 136 257.468 -10.178 0.118 1070 2HB TYR 136 HB1 TYR 136 258.353 -10.206 1.636 1071 HD1 TYR 136 HD1 TYR 136 255.732 -10.202 3.359 1072 HD2 TYR 136 HD2 TYR 136 257.100 -12.550 0.085 1073 HE1 TYR 136 HE1 TYR 136 254.342 -12.075 4.126 1074 HE2 TYR 136 HE2 TYR 136 255.710 -14.430 0.845 1075 HH TYR 136 HH TYR 136 253.251 -14.128 3.041 1076 H PHE 137 HN PHE 137 255.349 -7.924 3.448 1077 HA PHE 137 HA PHE 137 257.631 -7.390 5.231 1078 1HB PHE 137 HB2 PHE 137 254.850 -6.264 5.528 1079 2HB PHE 137 HB1 PHE 137 256.334 -5.709 6.295 1080 HD1 PHE 137 HD1 PHE 137 257.971 -5.971 3.638 1081 HD2 PHE 137 HD2 PHE 137 254.301 -4.083 4.672 1082 HE1 PHE 137 HE1 PHE 137 258.300 -4.347 1.820 1083 HE2 PHE 137 HE2 PHE 137 254.624 -2.455 2.855 1084 HZ PHE 137 HZ PHE 137 256.624 -2.586 1.427 1085 H LYS 138 HN LYS 138 257.890 -8.654 6.944 1086 HA LYS 138 HA LYS 138 255.797 -10.514 7.730 1087 1HB LYS 138 HB2 LYS 138 258.614 -10.594 7.699 1088 2HB LYS 138 HB1 LYS 138 258.148 -10.621 9.395 1089 1HG LYS 138 HG2 LYS 138 256.430 -12.438 8.409 1090 2HG LYS 138 HG1 LYS 138 257.779 -12.645 7.291 1091 1HD LYS 138 HD2 LYS 138 259.215 -13.354 8.950 1092 2HD LYS 138 HD1 LYS 138 258.317 -12.528 10.225 1093 1HE LYS 138 HE2 LYS 138 256.540 -14.160 10.082 1094 2HE LYS 138 HE1 LYS 138 257.333 -14.946 8.717 1095 1HZ LYS 138 HZ1 LYS 138 258.139 -16.268 10.326 1096 2HZ LYS 138 HZ2 LYS 138 257.923 -15.123 11.552 1097 3HZ LYS 138 HZ3 LYS 138 259.273 -15.030 10.538 1098 H PHE 139 HN PHE 139 254.441 -10.092 9.380 1099 HA PHE 139 HA PHE 139 255.098 -7.821 11.117 1100 1HB PHE 139 HB2 PHE 139 252.557 -9.005 10.119 1101 2HB PHE 139 HB1 PHE 139 252.532 -8.234 11.702 1102 HD1 PHE 139 HD1 PHE 139 253.625 -7.611 8.197 1103 HD2 PHE 139 HD2 PHE 139 252.178 -5.961 11.843 1104 HE1 PHE 139 HE1 PHE 139 253.419 -5.411 7.115 1105 HE2 PHE 139 HE2 PHE 139 251.967 -3.759 10.767 1106 HZ PHE 139 HZ PHE 139 252.588 -3.482 8.400 1107 H GLN 140 HN GLN 140 254.796 -7.901 13.343 1108 HA GLN 140 HA GLN 140 255.432 -10.444 14.536 1109 1HB GLN 140 HB2 GLN 140 256.627 -8.793 15.591 1110 2HB GLN 140 HB1 GLN 140 255.355 -7.600 15.400 1111 1HG GLN 140 HG2 GLN 140 255.699 -8.120 17.732 1112 2HG GLN 140 HG1 GLN 140 254.098 -8.640 17.213 1113 1HE2 GLN 140 HE21 GLN 140 253.979 -10.088 18.950 1114 2HE2 GLN 140 HE22 GLN 140 254.851 -11.579 18.949 1115 H GLY 141 HN GLY 141 252.608 -8.527 14.040 1116 1HA GLY 141 HA2 GLY 141 250.951 -10.587 15.189 1117 2HA GLY 141 HA1 GLY 141 250.916 -9.076 16.086 1118 H GLN 142 HN GLN 142 251.086 -7.266 13.951 1119 HA GLN 142 HA GLN 142 249.393 -7.668 11.806 1120 1HB GLN 142 HB2 GLN 142 247.947 -7.573 14.263 1121 2HB GLN 142 HB1 GLN 142 247.566 -6.119 13.351 1122 1HG GLN 142 HG2 GLN 142 247.130 -7.667 11.380 1123 2HG GLN 142 HG1 GLN 142 247.158 -8.979 12.556 1124 1HE2 GLN 142 HE21 GLN 142 244.921 -8.546 11.086 1125 2HE2 GLN 142 HE22 GLN 142 243.663 -7.913 12.085 1126 H ASP 143 HN ASP 143 250.525 -5.462 14.285 1127 HA ASP 143 HA ASP 143 250.477 -3.281 12.304 1128 1HB ASP 143 HB2 ASP 143 250.325 -3.216 15.314 1129 2HB ASP 143 HB1 ASP 143 250.669 -1.782 14.352 1130 H THR 144 HN THR 144 252.474 -5.155 14.449 1131 HA THR 144 HA THR 144 254.757 -3.391 14.092 1132 HB THR 144 HB THR 144 254.314 -5.920 15.661 1133 HG1 THR 144 HG1 THR 144 253.706 -4.260 16.868 1134 1HG2 THR 144 HG21 THR 144 256.565 -6.115 14.807 1135 2HG2 THR 144 HG22 THR 144 256.597 -5.709 16.524 1136 3HG2 THR 144 HG23 THR 144 256.927 -4.465 15.317 1137 H ILE 145 HN ILE 145 256.483 -3.765 12.796 1138 HA ILE 145 HA ILE 145 256.316 -6.129 11.059 1139 HB ILE 145 HB ILE 145 257.709 -3.514 10.475 1140 1HG1 ILE 145 HG12 ILE 145 255.136 -4.653 9.360 1141 2HG1 ILE 145 HG11 ILE 145 255.259 -3.285 10.462 1142 1HG2 ILE 145 HG21 ILE 145 258.816 -5.370 9.396 1143 2HG2 ILE 145 HG22 ILE 145 257.928 -4.437 8.190 1144 3HG2 ILE 145 HG23 ILE 145 257.278 -5.968 8.776 1145 1HD1 ILE 145 HD11 ILE 145 256.593 -2.109 8.703 1146 2HD1 ILE 145 HD12 ILE 145 254.911 -2.426 8.280 1147 3HD1 ILE 145 HD13 ILE 145 256.193 -3.434 7.610 1148 H LEU 146 HN LEU 146 257.946 -7.541 10.997 1149 HA LEU 146 HA LEU 146 260.378 -6.889 12.525 1150 1HB LEU 146 HB2 LEU 146 259.407 -9.678 11.980 1151 2HB LEU 146 HB1 LEU 146 260.559 -9.142 13.189 1152 HG LEU 146 HG LEU 146 257.748 -8.163 13.380 1153 1HD1 LEU 146 HD11 LEU 146 256.995 -10.279 13.319 1154 2HD1 LEU 146 HD12 LEU 146 257.656 -10.360 14.953 1155 3HD1 LEU 146 HD13 LEU 146 258.596 -10.969 13.590 1156 1HD2 LEU 146 HD21 LEU 146 258.598 -8.845 15.864 1157 2HD2 LEU 146 HD22 LEU 146 258.815 -7.255 15.137 1158 3HD2 LEU 146 HD23 LEU 146 260.125 -8.433 15.084 1159 H ASP 147 HN ASP 147 259.149 -7.562 9.452 1160 HA ASP 147 HA ASP 147 261.818 -7.696 8.349 1161 1HB ASP 147 HB2 ASP 147 260.338 -10.076 8.752 1162 2HB ASP 147 HB1 ASP 147 260.293 -9.745 7.023 1163 H TYR 148 HN TYR 148 261.928 -6.730 6.362 1164 HA TYR 148 HA TYR 148 259.430 -6.350 4.896 1165 1HB TYR 148 HB2 TYR 148 259.804 -3.987 4.579 1166 2HB TYR 148 HB1 TYR 148 259.749 -4.351 6.301 1167 HD1 TYR 148 HD1 TYR 148 262.021 -3.559 3.487 1168 HD2 TYR 148 HD2 TYR 148 261.600 -3.883 7.708 1169 HE1 TYR 148 HE1 TYR 148 264.198 -2.455 3.782 1170 HE2 TYR 148 HE2 TYR 148 263.776 -2.778 8.016 1171 HH TYR 148 HH TYR 148 265.216 -1.119 6.582 1172 H THR 149 HN THR 149 259.622 -6.587 2.756 1173 HA THR 149 HA THR 149 262.314 -6.439 1.580 1174 HB THR 149 HB THR 149 261.129 -8.288 -0.006 1175 HG1 THR 149 HG1 THR 149 260.245 -8.849 2.628 1176 1HG2 THR 149 HG21 THR 149 262.541 -9.071 2.526 1177 2HG2 THR 149 HG22 THR 149 263.363 -8.436 1.101 1178 3HG2 THR 149 HG23 THR 149 262.473 -9.956 1.003 1179 H LEU 150 HN LEU 150 262.461 -5.553 -0.430 1180 HA LEU 150 HA LEU 150 259.980 -4.699 -1.739 1181 1HB LEU 150 HB2 LEU 150 262.355 -2.958 -1.095 1182 2HB LEU 150 HB1 LEU 150 261.118 -2.509 -2.254 1183 HG LEU 150 HG LEU 150 259.580 -3.071 -0.092 1184 1HD1 LEU 150 HD11 LEU 150 260.568 -2.718 1.898 1185 2HD1 LEU 150 HD12 LEU 150 261.684 -1.515 1.252 1186 3HD1 LEU 150 HD13 LEU 150 262.019 -3.233 1.036 1187 1HD2 LEU 150 HD21 LEU 150 259.876 -0.977 -1.637 1188 2HD2 LEU 150 HD22 LEU 150 260.798 -0.356 -0.269 1189 3HD2 LEU 150 HD23 LEU 150 259.112 -0.824 -0.057 1190 H ARG 151 HN ARG 151 259.944 -5.244 -3.817 1191 HA ARG 151 HA ARG 151 262.500 -5.479 -5.259 1192 1HB ARG 151 HB2 ARG 151 260.182 -7.387 -5.587 1193 2HB ARG 151 HB1 ARG 151 261.761 -7.497 -6.351 1194 1HG ARG 151 HG2 ARG 151 261.767 -7.439 -3.407 1195 2HG ARG 151 HG1 ARG 151 261.056 -8.872 -4.153 1196 1HD ARG 151 HD2 ARG 151 263.298 -8.596 -5.639 1197 2HD ARG 151 HD1 ARG 151 263.853 -7.951 -4.095 1198 HE ARG 151 HE ARG 151 262.478 -10.442 -3.812 1199 1HH1 ARG 151 HH11 ARG 151 265.551 -8.994 -4.611 1200 2HH1 ARG 151 HH12 ARG 151 266.470 -10.387 -4.150 1201 1HH2 ARG 151 HH21 ARG 151 263.685 -12.276 -3.206 1202 2HH2 ARG 151 HH22 ARG 151 265.410 -12.252 -3.352 1203 H GLU 152 HN GLU 152 262.527 -4.161 -6.954 1204 HA GLU 152 HA GLU 152 260.086 -2.983 -7.939 1205 1HB GLU 152 HB2 GLU 152 261.664 -1.785 -9.509 1206 2HB GLU 152 HB1 GLU 152 261.940 -1.510 -7.794 1207 1HG GLU 152 HG2 GLU 152 263.921 -2.633 -7.785 1208 2HG GLU 152 HG1 GLU 152 263.453 -3.694 -9.113 1209 H VAL 153 HN VAL 153 259.122 -3.292 -9.902 1210 HA VAL 153 HA VAL 153 260.283 -5.305 -11.698 1211 HB VAL 153 HB VAL 153 258.032 -6.285 -12.049 1212 1HG1 VAL 153 HG11 VAL 153 259.540 -7.454 -10.608 1213 2HG1 VAL 153 HG12 VAL 153 257.939 -7.505 -9.872 1214 3HG1 VAL 153 HG13 VAL 153 259.158 -6.389 -9.255 1215 1HG2 VAL 153 HG21 VAL 153 256.987 -4.104 -10.981 1216 2HG2 VAL 153 HG22 VAL 153 257.074 -5.072 -9.510 1217 3HG2 VAL 153 HG23 VAL 153 256.160 -5.660 -10.899 1218 H ASP 154 HN ASP 154 259.428 -5.241 -13.877 1219 HA ASP 154 HA ASP 154 257.938 -2.842 -14.612 1220 1HB ASP 154 HB2 ASP 154 260.785 -3.387 -15.307 1221 2HB ASP 154 HB1 ASP 154 259.761 -2.668 -16.547 1222 H THR 155 HN THR 155 257.363 -5.697 -14.608 1223 HA THR 155 HA THR 155 257.073 -6.166 -17.503 1224 HB THR 155 HB THR 155 258.413 -7.882 -16.377 1225 HG1 THR 155 HG1 THR 155 257.326 -8.803 -17.985 1226 1HG2 THR 155 HG21 THR 155 257.502 -9.368 -14.733 1227 2HG2 THR 155 HG22 THR 155 255.961 -8.510 -14.754 1228 3HG2 THR 155 HG23 THR 155 257.407 -7.714 -14.131 1229 H VAL 156 HN VAL 156 255.078 -6.855 -18.308 1230 HA VAL 156 HA VAL 156 252.807 -6.745 -16.446 1231 HB VAL 156 HB VAL 156 252.778 -5.429 -19.162 1232 1HG1 VAL 156 HG11 VAL 156 250.750 -4.312 -17.865 1233 2HG1 VAL 156 HG12 VAL 156 250.792 -5.846 -16.997 1234 3HG1 VAL 156 HG13 VAL 156 250.576 -5.829 -18.747 1235 1HG2 VAL 156 HG21 VAL 156 254.261 -4.119 -17.862 1236 2HG2 VAL 156 HG22 VAL 156 253.240 -4.252 -16.431 1237 3HG2 VAL 156 HG23 VAL 156 252.705 -3.293 -17.811 Start of MODEL 21 1 1H MET 1 HT1 MET 1 247.232 -19.620 -0.731 2 2H MET 1 HT2 MET 1 247.129 -19.332 -2.419 3 3H MET 1 HT3 MET 1 247.864 -20.768 -1.836 4 HA MET 1 HA MET 1 245.032 -19.999 -1.630 5 1HB MET 1 HB2 MET 1 246.342 -21.005 -3.763 6 2HB MET 1 HB1 MET 1 245.978 -22.501 -2.914 7 1HG MET 1 HG2 MET 1 244.211 -22.175 -4.416 8 2HG MET 1 HG1 MET 1 243.578 -21.724 -2.833 9 1HE MET 1 HE1 MET 1 242.605 -20.486 -6.210 10 2HE MET 1 HE2 MET 1 244.284 -21.022 -6.269 11 3HE MET 1 HE3 MET 1 243.886 -19.334 -6.588 12 H GLY 2 HN GLY 2 244.735 -20.356 0.555 13 1HA GLY 2 HA2 GLY 2 243.878 -22.546 1.666 14 2HA GLY 2 HA1 GLY 2 245.588 -22.948 1.641 15 H ALA 3 HN ALA 3 246.448 -20.211 2.167 16 HA ALA 3 HA ALA 3 245.297 -19.379 4.653 17 1HB ALA 3 HB1 ALA 3 246.590 -21.410 5.318 18 2HB ALA 3 HB2 ALA 3 247.092 -19.927 6.130 19 3HB ALA 3 HB3 ALA 3 248.057 -20.577 4.804 20 H SER 4 HN SER 4 245.237 -17.357 3.690 21 HA SER 4 HA SER 4 247.458 -15.691 4.067 22 1HB SER 4 HB2 SER 4 248.625 -16.193 2.192 23 2HB SER 4 HB1 SER 4 247.228 -16.926 1.405 24 HG SER 4 HG SER 4 246.826 -15.098 0.440 25 H ARG 5 HN ARG 5 246.154 -14.285 5.025 26 HA ARG 5 HA ARG 5 243.614 -13.514 4.167 27 1HB ARG 5 HB2 ARG 5 245.665 -12.099 5.869 28 2HB ARG 5 HB1 ARG 5 244.057 -11.448 5.584 29 1HG ARG 5 HG2 ARG 5 243.755 -14.137 6.411 30 2HG ARG 5 HG1 ARG 5 244.894 -13.361 7.511 31 1HD ARG 5 HD2 ARG 5 243.345 -11.746 8.168 32 2HD ARG 5 HD1 ARG 5 242.321 -12.021 6.760 33 HE ARG 5 HE ARG 5 242.243 -13.429 9.250 34 1HH1 ARG 5 HH11 ARG 5 241.607 -13.699 5.830 35 2HH1 ARG 5 HH12 ARG 5 240.428 -14.952 6.020 36 1HH2 ARG 5 HH21 ARG 5 240.691 -15.076 9.504 37 2HH2 ARG 5 HH22 ARG 5 239.907 -15.735 8.106 38 H LEU 6 HN LEU 6 243.520 -13.037 2.023 39 HA LEU 6 HA LEU 6 245.306 -11.058 0.878 40 1HB LEU 6 HB2 LEU 6 244.227 -13.189 -0.249 41 2HB LEU 6 HB1 LEU 6 242.899 -12.087 -0.560 42 HG LEU 6 HG LEU 6 245.683 -11.322 -1.363 43 1HD1 LEU 6 HD11 LEU 6 243.977 -13.421 -2.565 44 2HD1 LEU 6 HD12 LEU 6 245.733 -13.251 -2.551 45 3HD1 LEU 6 HD13 LEU 6 244.763 -12.289 -3.667 46 1HD2 LEU 6 HD21 LEU 6 244.673 -9.764 -2.688 47 2HD2 LEU 6 HD22 LEU 6 243.454 -9.885 -1.421 48 3HD2 LEU 6 HD23 LEU 6 243.233 -10.749 -2.941 49 H TYR 7 HN TYR 7 244.957 -8.987 1.043 50 HA TYR 7 HA TYR 7 242.191 -7.993 1.204 51 1HB TYR 7 HB2 TYR 7 244.640 -7.217 2.753 52 2HB TYR 7 HB1 TYR 7 243.363 -6.036 2.483 53 HD1 TYR 7 HD1 TYR 7 241.943 -5.783 4.272 54 HD2 TYR 7 HD2 TYR 7 243.526 -9.648 3.463 55 HE1 TYR 7 HE1 TYR 7 240.699 -6.686 6.191 56 HE2 TYR 7 HE2 TYR 7 242.286 -10.563 5.379 57 HH TYR 7 HH TYR 7 240.980 -8.723 7.773 58 H THR 8 HN THR 8 242.361 -5.435 0.853 59 HA THR 8 HA THR 8 243.917 -5.001 -1.619 60 HB THR 8 HB THR 8 242.060 -3.830 -2.569 61 HG1 THR 8 HG1 THR 8 240.035 -4.018 -1.074 62 1HG2 THR 8 HG21 THR 8 240.495 -5.512 -2.915 63 2HG2 THR 8 HG22 THR 8 240.706 -6.173 -1.295 64 3HG2 THR 8 HG23 THR 8 241.967 -6.389 -2.507 65 H LEU 9 HN LEU 9 244.096 -2.644 -2.158 66 HA LEU 9 HA LEU 9 243.965 -0.793 0.057 67 1HB LEU 9 HB2 LEU 9 246.140 -2.172 0.227 68 2HB LEU 9 HB1 LEU 9 246.657 -1.277 -1.189 69 HG LEU 9 HG LEU 9 245.981 -0.133 1.510 70 1HD1 LEU 9 HD11 LEU 9 248.238 -1.346 0.920 71 2HD1 LEU 9 HD12 LEU 9 248.218 0.141 1.869 72 3HD1 LEU 9 HD13 LEU 9 248.598 0.198 0.148 73 1HD2 LEU 9 HD21 LEU 9 246.633 1.215 -1.092 74 2HD2 LEU 9 HD22 LEU 9 246.824 2.005 0.472 75 3HD2 LEU 9 HD23 LEU 9 245.230 1.467 -0.054 76 H VAL 10 HN VAL 10 242.965 0.841 -1.017 77 HA VAL 10 HA VAL 10 244.006 1.563 -3.654 78 HB VAL 10 HB VAL 10 241.767 1.056 -3.963 79 1HG1 VAL 10 HG11 VAL 10 241.391 2.132 -1.261 80 2HG1 VAL 10 HG12 VAL 10 240.753 0.668 -2.011 81 3HG1 VAL 10 HG13 VAL 10 240.035 2.233 -2.381 82 1HG2 VAL 10 HG21 VAL 10 240.643 3.128 -4.499 83 2HG2 VAL 10 HG22 VAL 10 242.358 3.263 -4.890 84 3HG2 VAL 10 HG23 VAL 10 241.724 4.016 -3.426 85 H LEU 11 HN LEU 11 245.015 3.363 -3.915 86 HA LEU 11 HA LEU 11 244.635 5.542 -1.979 87 1HB LEU 11 HB2 LEU 11 247.000 4.031 -2.607 88 2HB LEU 11 HB1 LEU 11 247.237 5.705 -3.068 89 HG LEU 11 HG LEU 11 246.710 4.579 -0.326 90 1HD1 LEU 11 HD11 LEU 11 249.043 5.214 -1.612 91 2HD1 LEU 11 HD12 LEU 11 248.832 5.116 0.136 92 3HD1 LEU 11 HD13 LEU 11 248.717 6.676 -0.677 93 1HD2 LEU 11 HD21 LEU 11 246.809 7.160 0.245 94 2HD2 LEU 11 HD22 LEU 11 245.287 6.335 -0.099 95 3HD2 LEU 11 HD23 LEU 11 246.079 7.287 -1.356 96 H VAL 12 HN VAL 12 243.679 7.150 -3.046 97 HA VAL 12 HA VAL 12 244.003 7.388 -5.913 98 HB VAL 12 HB VAL 12 242.377 9.168 -4.105 99 1HG1 VAL 12 HG11 VAL 12 241.554 8.560 -6.872 100 2HG1 VAL 12 HG12 VAL 12 242.998 9.557 -6.693 101 3HG1 VAL 12 HG13 VAL 12 241.475 10.074 -5.969 102 1HG2 VAL 12 HG21 VAL 12 241.924 6.404 -5.011 103 2HG2 VAL 12 HG22 VAL 12 240.564 7.506 -5.225 104 3HG2 VAL 12 HG23 VAL 12 241.263 7.269 -3.623 105 H LEU 13 HN LEU 13 245.575 8.508 -6.777 106 HA LEU 13 HA LEU 13 246.480 10.993 -5.466 107 1HB LEU 13 HB2 LEU 13 248.005 8.812 -5.457 108 2HB LEU 13 HB1 LEU 13 248.435 9.427 -7.046 109 HG LEU 13 HG LEU 13 248.445 11.541 -5.096 110 1HD1 LEU 13 HD11 LEU 13 249.135 9.229 -3.888 111 2HD1 LEU 13 HD12 LEU 13 249.758 10.818 -3.441 112 3HD1 LEU 13 HD13 LEU 13 250.697 9.770 -4.505 113 1HD2 LEU 13 HD21 LEU 13 250.985 11.302 -5.975 114 2HD2 LEU 13 HD22 LEU 13 249.699 12.155 -6.827 115 3HD2 LEU 13 HD23 LEU 13 250.096 10.494 -7.264 116 H GLN 14 HN GLN 14 247.448 12.537 -6.928 117 HA GLN 14 HA GLN 14 246.746 12.184 -9.758 118 1HB GLN 14 HB2 GLN 14 245.454 13.947 -7.929 119 2HB GLN 14 HB1 GLN 14 246.389 14.931 -9.046 120 1HG GLN 14 HG2 GLN 14 245.081 12.980 -10.593 121 2HG GLN 14 HG1 GLN 14 243.893 13.606 -9.452 122 1HE2 GLN 14 HE21 GLN 14 244.902 16.220 -9.224 123 2HE2 GLN 14 HE22 GLN 14 244.631 17.036 -10.723 124 HA PRO 15 HA PRO 15 250.770 13.779 -10.579 125 1HB PRO 15 HB2 PRO 15 250.383 15.289 -12.811 126 2HB PRO 15 HB1 PRO 15 250.396 13.522 -12.820 127 1HG PRO 15 HG2 PRO 15 248.066 15.398 -12.781 128 2HG PRO 15 HG1 PRO 15 248.295 13.917 -13.728 129 1HD PRO 15 HD2 PRO 15 246.787 13.973 -11.491 130 2HD PRO 15 HD1 PRO 15 247.736 12.546 -11.954 131 H GLN 16 HN GLN 16 248.884 15.453 -8.871 132 HA GLN 16 HA GLN 16 250.597 17.730 -8.661 133 1HB GLN 16 HB2 GLN 16 247.950 17.952 -9.965 134 2HB GLN 16 HB1 GLN 16 248.295 19.162 -8.736 135 1HG GLN 16 HG2 GLN 16 249.904 18.585 -11.211 136 2HG GLN 16 HG1 GLN 16 248.923 20.012 -10.886 137 1HE2 GLN 16 HE21 GLN 16 251.934 18.444 -10.391 138 2HE2 GLN 16 HE22 GLN 16 252.710 19.719 -9.522 139 H ARG 17 HN ARG 17 247.553 16.203 -7.739 140 HA ARG 17 HA ARG 17 248.170 16.810 -4.937 141 1HB ARG 17 HB2 ARG 17 245.646 17.064 -4.606 142 2HB ARG 17 HB1 ARG 17 246.498 18.402 -5.365 143 1HG ARG 17 HG2 ARG 17 244.995 18.318 -6.988 144 2HG ARG 17 HG1 ARG 17 245.710 16.783 -7.482 145 1HD ARG 17 HD2 ARG 17 243.719 15.872 -7.078 146 2HD ARG 17 HD1 ARG 17 244.083 16.086 -5.367 147 HE ARG 17 HE ARG 17 242.571 17.814 -5.282 148 1HH1 ARG 17 HH11 ARG 17 243.178 16.981 -8.618 149 2HH1 ARG 17 HH12 ARG 17 241.888 17.961 -9.226 150 1HH2 ARG 17 HH21 ARG 17 240.874 19.102 -6.083 151 2HH2 ARG 17 HH22 ARG 17 240.580 19.166 -7.789 152 H VAL 18 HN VAL 18 247.057 15.359 -3.409 153 HA VAL 18 HA VAL 18 246.390 12.758 -4.629 154 HB VAL 18 HB VAL 18 248.495 12.330 -3.780 155 1HG1 VAL 18 HG11 VAL 18 247.897 13.725 -1.185 156 2HG1 VAL 18 HG12 VAL 18 248.642 14.537 -2.562 157 3HG1 VAL 18 HG13 VAL 18 249.460 13.178 -1.794 158 1HG2 VAL 18 HG21 VAL 18 246.700 11.643 -1.461 159 2HG2 VAL 18 HG22 VAL 18 248.217 10.853 -1.894 160 3HG2 VAL 18 HG23 VAL 18 246.818 10.721 -2.960 161 H LEU 19 HN LEU 19 244.988 11.407 -3.341 162 HA LEU 19 HA LEU 19 243.366 12.919 -1.398 163 1HB LEU 19 HB2 LEU 19 242.058 12.583 -3.364 164 2HB LEU 19 HB1 LEU 19 242.527 10.899 -3.464 165 HG LEU 19 HG LEU 19 241.183 10.325 -1.570 166 1HD1 LEU 19 HD11 LEU 19 241.330 13.195 -1.044 167 2HD1 LEU 19 HD12 LEU 19 241.112 11.845 0.068 168 3HD1 LEU 19 HD13 LEU 19 239.727 12.502 -0.801 169 1HD2 LEU 19 HD21 LEU 19 239.010 11.792 -2.496 170 2HD2 LEU 19 HD22 LEU 19 239.535 10.204 -3.057 171 3HD2 LEU 19 HD23 LEU 19 240.088 11.660 -3.886 172 H LEU 20 HN LEU 20 243.618 12.164 0.597 173 HA LEU 20 HA LEU 20 244.156 9.287 0.944 174 1HB LEU 20 HB2 LEU 20 245.498 11.631 1.966 175 2HB LEU 20 HB1 LEU 20 244.933 10.621 3.284 176 HG LEU 20 HG LEU 20 246.607 9.584 1.002 177 1HD1 LEU 20 HD11 LEU 20 247.704 10.050 3.731 178 2HD1 LEU 20 HD12 LEU 20 247.603 11.403 2.604 179 3HD1 LEU 20 HD13 LEU 20 248.537 9.968 2.178 180 1HD2 LEU 20 HD21 LEU 20 246.822 7.617 2.238 181 2HD2 LEU 20 HD22 LEU 20 245.120 8.046 2.418 182 3HD2 LEU 20 HD23 LEU 20 246.257 8.380 3.725 183 H GLY 21 HN GLY 21 243.122 8.178 2.605 184 1HA GLY 21 HA2 GLY 21 240.671 9.489 3.561 185 2HA GLY 21 HA1 GLY 21 240.917 7.756 3.425 186 H MET 22 HN MET 22 240.438 10.044 5.620 187 HA MET 22 HA MET 22 242.255 8.827 7.591 188 1HB MET 22 HB2 MET 22 242.744 11.159 7.436 189 2HB MET 22 HB1 MET 22 241.040 11.586 7.483 190 1HG MET 22 HG2 MET 22 240.866 11.029 9.775 191 2HG MET 22 HG1 MET 22 242.444 10.243 9.774 192 1HE MET 22 HE1 MET 22 244.869 11.837 10.159 193 2HE MET 22 HE2 MET 22 244.801 13.267 9.134 194 3HE MET 22 HE3 MET 22 244.342 11.694 8.484 195 H LYS 23 HN LYS 23 241.416 8.051 9.520 196 HA LYS 23 HA LYS 23 238.545 7.581 9.503 197 1HB LYS 23 HB2 LYS 23 240.896 6.363 10.842 198 2HB LYS 23 HB1 LYS 23 239.378 6.313 11.725 199 1HG LYS 23 HG2 LYS 23 239.148 5.506 8.926 200 2HG LYS 23 HG1 LYS 23 240.206 4.474 9.891 201 1HD LYS 23 HD2 LYS 23 237.406 5.244 10.702 202 2HD LYS 23 HD1 LYS 23 237.808 3.756 9.842 203 1HE LYS 23 HE2 LYS 23 239.522 3.462 11.807 204 2HE LYS 23 HE1 LYS 23 238.432 4.567 12.644 205 1HZ LYS 23 HZ1 LYS 23 236.864 2.999 12.835 206 2HZ LYS 23 HZ2 LYS 23 238.123 1.905 12.557 207 3HZ LYS 23 HZ3 LYS 23 237.121 2.380 11.281 208 H LYS 24 HN LYS 24 237.162 8.214 11.191 209 HA LYS 24 HA LYS 24 238.089 10.590 12.576 210 1HB LYS 24 HB2 LYS 24 235.440 9.445 11.876 211 2HB LYS 24 HB1 LYS 24 235.516 10.411 13.344 212 1HG LYS 24 HG2 LYS 24 235.530 12.295 12.182 213 2HG LYS 24 HG1 LYS 24 236.889 11.745 11.201 214 1HD LYS 24 HD2 LYS 24 235.473 10.748 9.609 215 2HD LYS 24 HD1 LYS 24 234.079 10.809 10.689 216 1HE LYS 24 HE2 LYS 24 233.746 13.070 10.346 217 2HE LYS 24 HE1 LYS 24 235.416 13.346 9.855 218 1HZ LYS 24 HZ1 LYS 24 234.249 13.484 7.882 219 2HZ LYS 24 HZ2 LYS 24 233.190 12.228 8.281 220 3HZ LYS 24 HZ3 LYS 24 234.789 11.881 7.858 221 H ARG 25 HN ARG 25 237.149 7.306 13.248 222 HA ARG 25 HA ARG 25 238.409 7.328 15.768 223 1HB ARG 25 HB2 ARG 25 236.366 6.804 17.142 224 2HB ARG 25 HB1 ARG 25 236.508 8.476 16.619 225 1HG ARG 25 HG2 ARG 25 234.875 6.475 15.099 226 2HG ARG 25 HG1 ARG 25 234.219 7.388 16.461 227 1HD ARG 25 HD2 ARG 25 235.320 9.393 15.073 228 2HD ARG 25 HD1 ARG 25 234.966 8.287 13.746 229 HE ARG 25 HE ARG 25 232.769 8.840 13.969 230 1HH1 ARG 25 HH11 ARG 25 234.369 9.511 16.998 231 2HH1 ARG 25 HH12 ARG 25 232.960 10.200 17.732 232 1HH2 ARG 25 HH21 ARG 25 230.915 9.746 14.934 233 2HH2 ARG 25 HH22 ARG 25 230.999 10.333 16.561 234 H GLY 26 HN GLY 26 239.224 5.360 15.953 235 1HA GLY 26 HA2 GLY 26 237.997 2.963 16.109 236 2HA GLY 26 HA1 GLY 26 238.148 3.189 14.373 237 H PHE 27 HN PHE 27 239.829 2.145 13.561 238 HA PHE 27 HA PHE 27 242.165 1.680 15.266 239 1HB PHE 27 HB2 PHE 27 240.851 0.192 13.105 240 2HB PHE 27 HB1 PHE 27 242.607 0.226 12.979 241 HD1 PHE 27 HD1 PHE 27 239.793 -0.686 15.193 242 HD2 PHE 27 HD2 PHE 27 243.954 -1.082 14.392 243 HE1 PHE 27 HE1 PHE 27 239.942 -2.476 16.875 244 HE2 PHE 27 HE2 PHE 27 244.111 -2.874 16.072 245 HZ PHE 27 HZ PHE 27 242.103 -3.573 17.316 246 H GLY 28 HN GLY 28 241.513 4.222 13.786 247 1HA GLY 28 HA2 GLY 28 244.141 4.864 12.995 248 2HA GLY 28 HA1 GLY 28 243.182 4.539 11.562 249 H ALA 29 HN ALA 29 241.777 5.972 14.433 250 HA ALA 29 HA ALA 29 240.610 8.117 13.091 251 1HB ALA 29 HB1 ALA 29 239.751 8.691 15.083 252 2HB ALA 29 HB2 ALA 29 241.301 8.565 15.915 253 3HB ALA 29 HB3 ALA 29 240.370 7.110 15.560 254 H GLY 30 HN GLY 30 241.131 10.336 12.974 255 1HA GLY 30 HA2 GLY 30 242.550 12.097 12.570 256 2HA GLY 30 HA1 GLY 30 243.325 11.619 14.071 257 H ARG 31 HN ARG 31 243.248 9.389 11.419 258 HA ARG 31 HA ARG 31 245.994 10.095 10.662 259 1HB ARG 31 HB2 ARG 31 245.017 7.373 11.529 260 2HB ARG 31 HB1 ARG 31 246.500 7.607 10.614 261 1HG ARG 31 HG2 ARG 31 247.636 8.361 12.396 262 2HG ARG 31 HG1 ARG 31 246.258 9.269 13.021 263 1HD ARG 31 HD2 ARG 31 246.371 7.659 14.624 264 2HD ARG 31 HD1 ARG 31 245.339 6.819 13.469 265 HE ARG 31 HE ARG 31 247.039 5.331 13.077 266 1HH1 ARG 31 HH11 ARG 31 248.315 8.094 14.786 267 2HH1 ARG 31 HH12 ARG 31 249.862 7.365 15.062 268 1HH2 ARG 31 HH21 ARG 31 249.072 4.372 13.441 269 2HH2 ARG 31 HH22 ARG 31 250.292 5.253 14.299 270 H TRP 32 HN TRP 32 246.502 9.725 8.528 271 HA TRP 32 HA TRP 32 244.231 9.122 6.792 272 1HB TRP 32 HB2 TRP 32 246.742 9.790 5.442 273 2HB TRP 32 HB1 TRP 32 245.148 10.508 5.268 274 HD1 TRP 32 HD1 TRP 32 248.232 10.752 7.596 275 HE1 TRP 32 HE1 TRP 32 248.339 13.149 8.520 276 HE3 TRP 32 HE3 TRP 32 243.903 12.597 5.596 277 HZ2 TRP 32 HZ2 TRP 32 246.811 15.514 8.407 278 HZ3 TRP 32 HZ3 TRP 32 243.303 14.939 6.052 279 HH2 TRP 32 HH2 TRP 32 244.726 16.366 7.427 280 H ASN 33 HN ASN 33 244.395 7.616 5.040 281 HA ASN 33 HA ASN 33 246.577 5.938 4.566 282 1HB ASN 33 HB2 ASN 33 245.659 5.312 7.010 283 2HB ASN 33 HB1 ASN 33 244.586 4.302 6.048 284 1HD2 ASN 33 HD21 ASN 33 246.099 2.935 7.638 285 2HD2 ASN 33 HD22 ASN 33 247.438 2.201 6.828 286 H GLY 34 HN GLY 34 246.109 4.234 3.067 287 1HA GLY 34 HA2 GLY 34 244.094 4.878 1.215 288 2HA GLY 34 HA1 GLY 34 245.035 3.393 1.222 289 H PHE 35 HN PHE 35 242.482 3.223 0.399 290 HA PHE 35 HA PHE 35 240.912 2.297 2.694 291 1HB PHE 35 HB2 PHE 35 239.826 2.298 -0.089 292 2HB PHE 35 HB1 PHE 35 239.000 2.591 1.431 293 HD1 PHE 35 HD1 PHE 35 239.334 4.788 2.594 294 HD2 PHE 35 HD2 PHE 35 240.660 4.070 -1.385 295 HE1 PHE 35 HE1 PHE 35 239.470 7.214 2.205 296 HE2 PHE 35 HE2 PHE 35 240.803 6.493 -1.780 297 HZ PHE 35 HZ PHE 35 240.208 8.070 0.016 298 H GLY 36 HN GLY 36 241.669 0.292 3.202 299 1HA GLY 36 HA2 GLY 36 242.018 -1.639 1.025 300 2HA GLY 36 HA1 GLY 36 242.611 -1.827 2.667 301 H GLY 37 HN GLY 37 241.193 -3.782 1.185 302 1HA GLY 37 HA2 GLY 37 239.068 -4.315 3.085 303 2HA GLY 37 HA1 GLY 37 238.540 -4.117 1.422 304 H LYS 38 HN LYS 38 238.388 -6.489 3.115 305 HA LYS 38 HA LYS 38 240.376 -8.323 2.105 306 1HB LYS 38 HB2 LYS 38 239.208 -10.008 3.406 307 2HB LYS 38 HB1 LYS 38 239.452 -8.563 4.377 308 1HG LYS 38 HG2 LYS 38 237.069 -7.927 3.645 309 2HG LYS 38 HG1 LYS 38 236.921 -9.625 3.187 310 1HD LYS 38 HD2 LYS 38 237.958 -9.892 5.658 311 2HD LYS 38 HD1 LYS 38 237.067 -8.382 5.861 312 1HE LYS 38 HE2 LYS 38 235.202 -9.816 4.588 313 2HE LYS 38 HE1 LYS 38 236.078 -11.130 5.370 314 1HZ LYS 38 HZ1 LYS 38 235.684 -10.173 7.491 315 2HZ LYS 38 HZ2 LYS 38 234.199 -10.201 6.683 316 3HZ LYS 38 HZ3 LYS 38 235.057 -8.752 6.819 317 H VAL 39 HN VAL 39 240.088 -9.941 0.604 318 HA VAL 39 HA VAL 39 238.092 -9.471 -1.400 319 HB VAL 39 HB VAL 39 239.922 -11.871 -1.261 320 1HG1 VAL 39 HG11 VAL 39 238.743 -10.374 -3.600 321 2HG1 VAL 39 HG12 VAL 39 238.141 -11.905 -2.962 322 3HG1 VAL 39 HG13 VAL 39 239.748 -11.819 -3.684 323 1HG2 VAL 39 HG21 VAL 39 241.296 -10.296 -2.860 324 2HG2 VAL 39 HG22 VAL 39 241.525 -10.259 -1.112 325 3HG2 VAL 39 HG23 VAL 39 240.526 -9.035 -1.897 326 H GLN 40 HN GLN 40 236.061 -10.098 -1.137 327 HA GLN 40 HA GLN 40 234.987 -11.765 0.727 328 1HB GLN 40 HB2 GLN 40 234.111 -10.913 -1.988 329 2HB GLN 40 HB1 GLN 40 233.208 -12.202 -1.204 330 1HG GLN 40 HG2 GLN 40 233.742 -9.523 0.054 331 2HG GLN 40 HG1 GLN 40 232.287 -9.914 -0.862 332 1HE2 GLN 40 HE21 GLN 40 231.183 -9.366 1.128 333 2HE2 GLN 40 HE22 GLN 40 231.025 -10.559 2.367 334 H GLU 41 HN GLU 41 233.784 -13.879 0.265 335 HA GLU 41 HA GLU 41 235.713 -15.877 -0.286 336 1HB GLU 41 HB2 GLU 41 233.627 -15.960 1.254 337 2HB GLU 41 HB1 GLU 41 232.758 -16.409 -0.208 338 1HG GLU 41 HG2 GLU 41 233.440 -18.348 1.132 339 2HG GLU 41 HG1 GLU 41 234.140 -18.359 -0.487 340 H GLY 42 HN GLY 42 236.137 -14.838 -2.513 341 1HA GLY 42 HA2 GLY 42 236.185 -16.103 -4.638 342 2HA GLY 42 HA1 GLY 42 234.438 -16.221 -4.495 343 H GLU 43 HN GLU 43 236.580 -13.401 -4.024 344 HA GLU 43 HA GLU 43 235.284 -12.166 -6.338 345 1HB GLU 43 HB2 GLU 43 234.744 -10.238 -5.236 346 2HB GLU 43 HB1 GLU 43 234.578 -11.366 -3.903 347 1HG GLU 43 HG2 GLU 43 236.637 -10.701 -2.962 348 2HG GLU 43 HG1 GLU 43 237.105 -9.828 -4.420 349 H THR 44 HN THR 44 236.627 -10.133 -6.951 350 HA THR 44 HA THR 44 239.389 -11.075 -7.093 351 HB THR 44 HB THR 44 239.573 -9.597 -9.023 352 HG1 THR 44 HG1 THR 44 237.985 -8.260 -9.603 353 1HG2 THR 44 HG21 THR 44 238.308 -11.931 -8.992 354 2HG2 THR 44 HG22 THR 44 238.460 -10.959 -10.456 355 3HG2 THR 44 HG23 THR 44 236.970 -10.909 -9.513 356 H ILE 45 HN ILE 45 241.115 -9.861 -6.477 357 HA ILE 45 HA ILE 45 240.891 -8.188 -4.315 358 HB ILE 45 HB ILE 45 243.128 -7.904 -6.307 359 1HG1 ILE 45 HG12 ILE 45 244.030 -9.731 -4.507 360 2HG1 ILE 45 HG11 ILE 45 242.345 -10.216 -4.667 361 1HG2 ILE 45 HG21 ILE 45 243.248 -7.803 -3.316 362 2HG2 ILE 45 HG22 ILE 45 242.895 -6.380 -4.298 363 3HG2 ILE 45 HG23 ILE 45 244.433 -7.223 -4.486 364 1HD1 ILE 45 HD11 ILE 45 244.524 -10.755 -6.392 365 2HD1 ILE 45 HD12 ILE 45 243.368 -9.747 -7.265 366 3HD1 ILE 45 HD13 ILE 45 242.843 -11.269 -6.542 367 H GLU 46 HN GLU 46 240.735 -7.378 -7.721 368 HA GLU 46 HA GLU 46 240.882 -4.534 -7.338 369 1HB GLU 46 HB2 GLU 46 241.367 -5.937 -9.487 370 2HB GLU 46 HB1 GLU 46 239.628 -5.847 -9.733 371 1HG GLU 46 HG2 GLU 46 239.688 -3.478 -9.878 372 2HG GLU 46 HG1 GLU 46 241.366 -3.428 -9.342 373 H ASP 47 HN ASP 47 238.432 -6.983 -7.306 374 HA ASP 47 HA ASP 47 236.229 -5.136 -7.489 375 1HB ASP 47 HB2 ASP 47 236.510 -8.091 -7.080 376 2HB ASP 47 HB1 ASP 47 234.994 -7.313 -6.636 377 H GLY 48 HN GLY 48 238.022 -6.864 -5.017 378 1HA GLY 48 HA2 GLY 48 236.302 -6.136 -2.844 379 2HA GLY 48 HA1 GLY 48 237.947 -6.747 -2.708 380 H ALA 49 HN ALA 49 239.132 -4.713 -4.346 381 HA ALA 49 HA ALA 49 239.490 -2.673 -2.359 382 1HB ALA 49 HB1 ALA 49 241.094 -3.702 -4.292 383 2HB ALA 49 HB2 ALA 49 241.380 -2.170 -3.469 384 3HB ALA 49 HB3 ALA 49 240.584 -2.190 -5.043 385 H ARG 50 HN ARG 50 237.796 -3.032 -5.396 386 HA ARG 50 HA ARG 50 237.160 -0.260 -5.674 387 1HB ARG 50 HB2 ARG 50 236.389 -2.783 -7.060 388 2HB ARG 50 HB1 ARG 50 235.357 -1.375 -7.273 389 1HG ARG 50 HG2 ARG 50 237.550 -0.150 -7.871 390 2HG ARG 50 HG1 ARG 50 238.198 -1.774 -8.105 391 1HD ARG 50 HD2 ARG 50 236.020 -2.091 -9.534 392 2HD ARG 50 HD1 ARG 50 236.077 -0.332 -9.626 393 HE ARG 50 HE ARG 50 238.585 -1.063 -10.320 394 1HH1 ARG 50 HH11 ARG 50 235.425 -2.028 -11.445 395 2HH1 ARG 50 HH12 ARG 50 235.965 -2.367 -13.055 396 1HH2 ARG 50 HH21 ARG 50 239.296 -1.507 -12.437 397 2HH2 ARG 50 HH22 ARG 50 238.162 -2.072 -13.619 398 H ARG 51 HN ARG 51 235.241 -3.136 -4.822 399 HA ARG 51 HA ARG 51 232.870 -1.774 -4.207 400 1HB ARG 51 HB2 ARG 51 233.982 -4.458 -3.485 401 2HB ARG 51 HB1 ARG 51 232.503 -3.898 -2.717 402 1HG ARG 51 HG2 ARG 51 231.929 -3.400 -5.308 403 2HG ARG 51 HG1 ARG 51 232.981 -4.807 -5.469 404 1HD ARG 51 HD2 ARG 51 231.046 -5.118 -3.325 405 2HD ARG 51 HD1 ARG 51 230.273 -4.826 -4.883 406 HE ARG 51 HE ARG 51 230.983 -6.887 -5.596 407 1HH1 ARG 51 HH11 ARG 51 232.648 -6.062 -2.640 408 2HH1 ARG 51 HH12 ARG 51 233.334 -7.639 -2.440 409 1HH2 ARG 51 HH21 ARG 51 231.886 -8.961 -5.333 410 2HH2 ARG 51 HH22 ARG 51 232.903 -9.284 -3.969 411 H GLU 52 HN GLU 52 235.704 -2.472 -2.269 412 HA GLU 52 HA GLU 52 234.471 -1.534 0.174 413 1HB GLU 52 HB2 GLU 52 237.314 -2.353 -0.449 414 2HB GLU 52 HB1 GLU 52 236.741 -1.891 1.148 415 1HG GLU 52 HG2 GLU 52 235.241 -4.033 -0.221 416 2HG GLU 52 HG1 GLU 52 236.876 -4.421 0.312 417 H LEU 53 HN LEU 53 236.238 -0.232 -2.452 418 HA LEU 53 HA LEU 53 237.396 1.993 -1.117 419 1HB LEU 53 HB2 LEU 53 238.392 1.379 -3.151 420 2HB LEU 53 HB1 LEU 53 236.851 1.299 -3.987 421 HG LEU 53 HG LEU 53 236.669 3.753 -3.827 422 1HD1 LEU 53 HD11 LEU 53 238.141 5.050 -2.719 423 2HD1 LEU 53 HD12 LEU 53 239.514 4.012 -3.106 424 3HD1 LEU 53 HD13 LEU 53 238.413 3.569 -1.802 425 1HD2 LEU 53 HD21 LEU 53 238.935 2.413 -5.225 426 2HD2 LEU 53 HD22 LEU 53 238.801 4.171 -5.300 427 3HD2 LEU 53 HD23 LEU 53 237.482 3.160 -5.890 428 H GLN 54 HN GLN 54 234.502 1.560 -3.114 429 HA GLN 54 HA GLN 54 233.609 4.223 -3.031 430 1HB GLN 54 HB2 GLN 54 232.526 2.989 -4.640 431 2HB GLN 54 HB1 GLN 54 232.352 1.583 -3.603 432 1HG GLN 54 HG2 GLN 54 230.568 2.684 -2.375 433 2HG GLN 54 HG1 GLN 54 230.764 4.131 -3.363 434 1HE2 GLN 54 HE21 GLN 54 229.267 4.324 -4.851 435 2HE2 GLN 54 HE22 GLN 54 228.496 3.035 -5.705 436 H GLU 55 HN GLU 55 233.446 1.661 -0.723 437 HA GLU 55 HA GLU 55 231.340 2.843 0.845 438 1HB GLU 55 HB2 GLU 55 233.178 0.528 1.459 439 2HB GLU 55 HB1 GLU 55 231.770 0.990 2.405 440 1HG GLU 55 HG2 GLU 55 231.575 0.276 -0.501 441 2HG GLU 55 HG1 GLU 55 231.499 -0.935 0.778 442 H GLU 56 HN GLU 56 234.794 3.091 0.771 443 HA GLU 56 HA GLU 56 235.023 3.858 3.522 444 1HB GLU 56 HB2 GLU 56 236.902 3.670 1.219 445 2HB GLU 56 HB1 GLU 56 237.379 4.600 2.634 446 1HG GLU 56 HG2 GLU 56 236.341 2.178 3.600 447 2HG GLU 56 HG1 GLU 56 237.384 1.767 2.240 448 H SER 57 HN SER 57 235.088 5.669 0.447 449 HA SER 57 HA SER 57 234.604 8.091 2.047 450 1HB SER 57 HB2 SER 57 236.700 7.655 -0.053 451 2HB SER 57 HB1 SER 57 236.028 9.266 0.197 452 HG SER 57 HG SER 57 237.092 9.420 2.007 453 H GLY 58 HN GLY 58 232.888 6.278 0.360 454 1HA GLY 58 HA2 GLY 58 231.155 6.494 -1.125 455 2HA GLY 58 HA1 GLY 58 231.201 8.208 -0.735 456 H LEU 59 HN LEU 59 234.137 7.025 -1.983 457 HA LEU 59 HA LEU 59 233.557 8.302 -4.559 458 1HB LEU 59 HB2 LEU 59 236.149 7.728 -3.132 459 2HB LEU 59 HB1 LEU 59 236.068 8.315 -4.781 460 HG LEU 59 HG LEU 59 235.398 9.752 -2.238 461 1HD1 LEU 59 HD11 LEU 59 237.624 9.721 -3.715 462 2HD1 LEU 59 HD12 LEU 59 237.079 11.146 -2.830 463 3HD1 LEU 59 HD13 LEU 59 236.744 10.998 -4.555 464 1HD2 LEU 59 HD21 LEU 59 233.433 10.153 -3.521 465 2HD2 LEU 59 HD22 LEU 59 234.368 10.395 -4.996 466 3HD2 LEU 59 HD23 LEU 59 234.460 11.577 -3.691 467 H THR 60 HN THR 60 232.987 6.938 -6.070 468 HA THR 60 HA THR 60 234.032 4.209 -6.060 469 HB THR 60 HB THR 60 232.134 4.960 -8.176 470 HG1 THR 60 HG1 THR 60 230.705 5.866 -6.962 471 1HG2 THR 60 HG21 THR 60 231.797 2.779 -8.035 472 2HG2 THR 60 HG22 THR 60 231.052 3.031 -6.458 473 3HG2 THR 60 HG23 THR 60 232.775 2.679 -6.572 474 H VAL 61 HN VAL 61 235.380 3.430 -7.618 475 HA VAL 61 HA VAL 61 236.337 5.408 -9.568 476 HB VAL 61 HB VAL 61 238.406 4.160 -9.684 477 1HG1 VAL 61 HG11 VAL 61 237.432 4.850 -6.929 478 2HG1 VAL 61 HG12 VAL 61 238.426 5.818 -8.016 479 3HG1 VAL 61 HG13 VAL 61 239.100 4.379 -7.251 480 1HG2 VAL 61 HG21 VAL 61 236.811 2.107 -8.361 481 2HG2 VAL 61 HG22 VAL 61 238.395 2.343 -7.622 482 3HG2 VAL 61 HG23 VAL 61 238.271 1.955 -9.337 483 H ASP 62 HN ASP 62 236.438 4.983 -11.706 484 HA ASP 62 HA ASP 62 234.802 2.827 -12.690 485 1HB ASP 62 HB2 ASP 62 235.212 5.328 -13.598 486 2HB ASP 62 HB1 ASP 62 236.400 4.472 -14.578 487 H ALA 63 HN ALA 63 238.135 3.364 -12.077 488 HA ALA 63 HA ALA 63 238.899 0.745 -12.611 489 1HB ALA 63 HB1 ALA 63 239.109 2.593 -14.923 490 2HB ALA 63 HB2 ALA 63 238.786 0.860 -14.883 491 3HB ALA 63 HB3 ALA 63 240.430 1.457 -14.654 492 H LEU 64 HN LEU 64 240.133 0.892 -10.775 493 HA LEU 64 HA LEU 64 241.909 3.010 -10.156 494 1HB LEU 64 HB2 LEU 64 242.010 0.122 -9.269 495 2HB LEU 64 HB1 LEU 64 242.890 1.447 -8.531 496 HG LEU 64 HG LEU 64 240.150 2.164 -8.550 497 1HD1 LEU 64 HD11 LEU 64 239.469 -0.082 -8.781 498 2HD1 LEU 64 HD12 LEU 64 239.326 0.300 -7.064 499 3HD1 LEU 64 HD13 LEU 64 240.696 -0.647 -7.647 500 1HD2 LEU 64 HD21 LEU 64 241.338 1.204 -6.042 501 2HD2 LEU 64 HD22 LEU 64 240.618 2.765 -6.439 502 3HD2 LEU 64 HD23 LEU 64 242.283 2.419 -6.905 503 H HIS 65 HN HIS 65 244.352 2.035 -9.640 504 HA HIS 65 HA HIS 65 245.340 0.846 -12.133 505 1HB HIS 65 HB2 HIS 65 245.555 3.499 -11.773 506 2HB HIS 65 HB1 HIS 65 247.005 2.983 -10.918 507 HD1 HIS 65 HD1 HIS 65 248.950 2.099 -12.318 508 HD2 HIS 65 HD2 HIS 65 245.571 3.006 -14.561 509 HE1 HIS 65 HE1 HIS 65 249.696 2.024 -14.718 510 HE2 HIS 65 HE2 HIS 65 247.653 2.651 -16.053 511 H LYS 66 HN LYS 66 245.995 -1.088 -11.320 512 HA LYS 66 HA LYS 66 247.117 -1.508 -8.775 513 1HB LYS 66 HB2 LYS 66 247.983 -3.652 -9.782 514 2HB LYS 66 HB1 LYS 66 246.254 -3.397 -9.964 515 1HG LYS 66 HG2 LYS 66 247.816 -2.357 -12.195 516 2HG LYS 66 HG1 LYS 66 247.988 -4.098 -11.959 517 1HD LYS 66 HD2 LYS 66 245.266 -2.866 -11.909 518 2HD LYS 66 HD1 LYS 66 246.064 -3.146 -13.458 519 1HE LYS 66 HE2 LYS 66 246.378 -5.519 -12.810 520 2HE LYS 66 HE1 LYS 66 245.457 -5.206 -11.340 521 1HZ LYS 66 HZ1 LYS 66 243.544 -4.642 -12.671 522 2HZ LYS 66 HZ2 LYS 66 244.097 -6.180 -13.106 523 3HZ LYS 66 HZ3 LYS 66 244.424 -4.853 -14.103 524 H VAL 67 HN VAL 67 249.056 -0.940 -7.989 525 HA VAL 67 HA VAL 67 251.190 -0.434 -9.977 526 HB VAL 67 HB VAL 67 252.108 1.232 -8.312 527 1HG1 VAL 67 HG11 VAL 67 250.510 1.570 -10.422 528 2HG1 VAL 67 HG12 VAL 67 251.078 2.913 -9.431 529 3HG1 VAL 67 HG13 VAL 67 249.465 2.247 -9.173 530 1HG2 VAL 67 HG21 VAL 67 250.309 2.249 -6.844 531 2HG2 VAL 67 HG22 VAL 67 250.975 0.705 -6.315 532 3HG2 VAL 67 HG23 VAL 67 249.398 0.764 -7.102 533 H GLY 68 HN GLY 68 250.689 -1.253 -6.533 534 1HA GLY 68 HA2 GLY 68 253.093 -2.944 -6.764 535 2HA GLY 68 HA1 GLY 68 252.915 -1.844 -5.409 536 H GLN 69 HN GLN 69 253.342 -4.495 -4.987 537 HA GLN 69 HA GLN 69 250.771 -5.334 -3.835 538 1HB GLN 69 HB2 GLN 69 252.744 -6.986 -5.394 539 2HB GLN 69 HB1 GLN 69 251.650 -7.729 -4.237 540 1HG GLN 69 HG2 GLN 69 249.760 -7.167 -5.482 541 2HG GLN 69 HG1 GLN 69 250.633 -5.965 -6.430 542 1HE2 GLN 69 HE21 GLN 69 251.314 -9.352 -5.636 543 2HE2 GLN 69 HE22 GLN 69 251.459 -9.887 -7.272 544 H ILE 70 HN ILE 70 250.985 -5.242 -1.702 545 HA ILE 70 HA ILE 70 253.618 -5.799 -0.516 546 HB ILE 70 HB ILE 70 251.246 -4.438 0.764 547 1HG1 ILE 70 HG12 ILE 70 253.645 -2.845 0.205 548 2HG1 ILE 70 HG11 ILE 70 252.819 -3.408 -1.244 549 1HG2 ILE 70 HG21 ILE 70 252.399 -5.011 2.609 550 2HG2 ILE 70 HG22 ILE 70 253.410 -3.637 2.163 551 3HG2 ILE 70 HG23 ILE 70 253.899 -5.272 1.720 552 1HD1 ILE 70 HD11 ILE 70 251.829 -1.592 0.907 553 2HD1 ILE 70 HD12 ILE 70 250.697 -2.484 -0.109 554 3HD1 ILE 70 HD13 ILE 70 251.840 -1.359 -0.840 555 H VAL 71 HN VAL 71 253.830 -7.188 1.217 556 HA VAL 71 HA VAL 71 251.541 -8.946 1.792 557 HB VAL 71 HB VAL 71 254.406 -9.857 1.508 558 1HG1 VAL 71 HG11 VAL 71 253.356 -11.332 2.972 559 2HG1 VAL 71 HG12 VAL 71 253.188 -12.114 1.399 560 3HG1 VAL 71 HG13 VAL 71 251.823 -11.249 2.104 561 1HG2 VAL 71 HG21 VAL 71 252.130 -10.343 -0.405 562 2HG2 VAL 71 HG22 VAL 71 253.813 -10.838 -0.595 563 3HG2 VAL 71 HG23 VAL 71 253.385 -9.127 -0.645 564 H PHE 72 HN PHE 72 251.473 -9.819 3.901 565 HA PHE 72 HA PHE 72 253.401 -8.670 5.795 566 1HB PHE 72 HB2 PHE 72 250.396 -8.715 6.034 567 2HB PHE 72 HB1 PHE 72 251.463 -8.416 7.401 568 HD1 PHE 72 HD1 PHE 72 252.619 -6.332 7.643 569 HD2 PHE 72 HD2 PHE 72 250.210 -7.095 4.219 570 HE1 PHE 72 HE1 PHE 72 252.696 -3.942 7.061 571 HE2 PHE 72 HE2 PHE 72 250.284 -4.708 3.630 572 HZ PHE 72 HZ PHE 72 251.528 -3.128 5.051 573 H GLU 73 HN GLU 73 254.385 -10.178 6.931 574 HA GLU 73 HA GLU 73 253.153 -12.822 7.184 575 1HB GLU 73 HB2 GLU 73 255.432 -12.763 6.306 576 2HB GLU 73 HB1 GLU 73 255.980 -11.891 7.729 577 1HG GLU 73 HG2 GLU 73 255.743 -13.758 9.108 578 2HG GLU 73 HG1 GLU 73 254.718 -14.598 7.946 579 H PHE 74 HN PHE 74 252.320 -13.502 9.062 580 HA PHE 74 HA PHE 74 252.386 -11.708 11.319 581 1HB PHE 74 HB2 PHE 74 251.065 -14.413 11.053 582 2HB PHE 74 HB1 PHE 74 250.782 -13.245 12.339 583 HD1 PHE 74 HD1 PHE 74 249.096 -14.599 9.870 584 HD2 PHE 74 HD2 PHE 74 250.535 -10.732 10.912 585 HE1 PHE 74 HE1 PHE 74 247.300 -13.575 8.537 586 HE2 PHE 74 HE2 PHE 74 248.741 -9.701 9.581 587 HZ PHE 74 HZ PHE 74 247.120 -11.123 8.391 588 H VAL 75 HN VAL 75 253.627 -11.847 13.067 589 HA VAL 75 HA VAL 75 255.802 -13.621 13.183 590 HB VAL 75 HB VAL 75 255.049 -11.294 14.510 591 1HG1 VAL 75 HG11 VAL 75 255.320 -11.747 16.878 592 2HG1 VAL 75 HG12 VAL 75 255.438 -13.477 16.554 593 3HG1 VAL 75 HG13 VAL 75 253.927 -12.622 16.243 594 1HG2 VAL 75 HG21 VAL 75 257.416 -13.121 14.735 595 2HG2 VAL 75 HG22 VAL 75 257.334 -11.588 15.602 596 3HG2 VAL 75 HG23 VAL 75 257.265 -11.608 13.840 597 H GLY 76 HN GLY 76 256.035 -15.605 13.991 598 1HA GLY 76 HA2 GLY 76 255.532 -17.606 14.991 599 2HA GLY 76 HA1 GLY 76 254.719 -16.655 16.222 600 H GLU 77 HN GLU 77 253.640 -16.385 12.942 601 HA GLU 77 HA GLU 77 251.416 -18.224 13.499 602 1HB GLU 77 HB2 GLU 77 251.303 -15.334 12.791 603 2HB GLU 77 HB1 GLU 77 250.092 -16.394 12.084 604 1HG GLU 77 HG2 GLU 77 249.654 -17.194 14.466 605 2HG GLU 77 HG1 GLU 77 250.587 -15.787 14.976 606 HA PRO 78 HA PRO 78 252.417 -19.733 9.453 607 1HB PRO 78 HB2 PRO 78 250.174 -21.151 8.938 608 2HB PRO 78 HB1 PRO 78 251.386 -21.686 10.107 609 1HG PRO 78 HG2 PRO 78 248.780 -20.289 10.584 610 2HG PRO 78 HG1 PRO 78 249.494 -21.655 11.462 611 1HD PRO 78 HD2 PRO 78 249.609 -19.099 12.370 612 2HD PRO 78 HD1 PRO 78 250.875 -20.296 12.704 613 H GLU 79 HN GLU 79 249.141 -18.414 9.901 614 HA GLU 79 HA GLU 79 248.586 -17.924 7.205 615 1HB GLU 79 HB2 GLU 79 247.256 -17.590 9.614 616 2HB GLU 79 HB1 GLU 79 247.422 -15.949 9.005 617 1HG GLU 79 HG2 GLU 79 246.408 -16.675 6.877 618 2HG GLU 79 HG1 GLU 79 246.167 -18.277 7.572 619 H LEU 80 HN LEU 80 248.271 -15.718 6.254 620 HA LEU 80 HA LEU 80 250.245 -13.744 7.114 621 1HB LEU 80 HB2 LEU 80 250.181 -14.322 4.203 622 2HB LEU 80 HB1 LEU 80 251.499 -13.736 5.199 623 HG LEU 80 HG LEU 80 250.567 -16.567 5.474 624 1HD1 LEU 80 HD11 LEU 80 252.533 -15.571 3.417 625 2HD1 LEU 80 HD12 LEU 80 250.920 -16.199 3.078 626 3HD1 LEU 80 HD13 LEU 80 252.151 -17.257 3.768 627 1HD2 LEU 80 HD21 LEU 80 252.167 -16.416 7.033 628 2HD2 LEU 80 HD22 LEU 80 252.810 -14.917 6.362 629 3HD2 LEU 80 HD23 LEU 80 253.296 -16.469 5.680 630 H MET 81 HN MET 81 250.094 -12.010 5.002 631 HA MET 81 HA MET 81 247.279 -11.561 4.430 632 1HB MET 81 HB2 MET 81 248.358 -10.325 6.619 633 2HB MET 81 HB1 MET 81 248.625 -9.122 5.366 634 1HG MET 81 HG2 MET 81 245.944 -10.249 5.309 635 2HG MET 81 HG1 MET 81 246.331 -9.453 6.832 636 1HE MET 81 HE1 MET 81 248.473 -7.134 5.529 637 2HE MET 81 HE2 MET 81 247.419 -7.093 6.941 638 3HE MET 81 HE3 MET 81 247.271 -5.856 5.693 639 H ASP 82 HN ASP 82 247.281 -11.347 2.286 640 HA ASP 82 HA ASP 82 249.512 -9.911 1.016 641 1HB ASP 82 HB2 ASP 82 248.578 -12.362 0.393 642 2HB ASP 82 HB1 ASP 82 247.550 -11.388 -0.653 643 H VAL 83 HN VAL 83 248.968 -7.791 0.952 644 HA VAL 83 HA VAL 83 246.275 -7.094 -0.010 645 HB VAL 83 HB VAL 83 246.850 -6.219 2.226 646 1HG1 VAL 83 HG11 VAL 83 248.858 -4.437 0.880 647 2HG1 VAL 83 HG12 VAL 83 249.314 -5.959 1.647 648 3HG1 VAL 83 HG13 VAL 83 248.578 -4.673 2.605 649 1HG2 VAL 83 HG21 VAL 83 246.283 -3.838 1.744 650 2HG2 VAL 83 HG22 VAL 83 245.234 -5.007 0.941 651 3HG2 VAL 83 HG23 VAL 83 246.500 -4.186 0.028 652 H HIS 84 HN HIS 84 246.158 -6.505 -2.049 653 HA HIS 84 HA HIS 84 248.490 -5.680 -3.532 654 1HB HIS 84 HB2 HIS 84 246.389 -7.075 -4.316 655 2HB HIS 84 HB1 HIS 84 245.703 -5.483 -4.619 656 HD1 HIS 84 HD1 HIS 84 247.515 -8.052 -6.272 657 HD2 HIS 84 HD2 HIS 84 247.617 -3.900 -6.357 658 HE1 HIS 84 HE1 HIS 84 248.652 -7.452 -8.434 659 HE2 HIS 84 HE2 HIS 84 248.786 -4.936 -8.418 660 H VAL 85 HN VAL 85 248.636 -3.629 -4.685 661 HA VAL 85 HA VAL 85 247.222 -1.491 -3.227 662 HB VAL 85 HB VAL 85 249.894 -1.365 -4.656 663 1HG1 VAL 85 HG11 VAL 85 250.087 0.877 -3.916 664 2HG1 VAL 85 HG12 VAL 85 248.638 0.748 -2.919 665 3HG1 VAL 85 HG13 VAL 85 248.504 0.738 -4.677 666 1HG2 VAL 85 HG21 VAL 85 249.614 -0.897 -1.740 667 2HG2 VAL 85 HG22 VAL 85 250.949 -1.602 -2.654 668 3HG2 VAL 85 HG23 VAL 85 249.508 -2.562 -2.312 669 H PHE 86 HN PHE 86 246.053 -0.051 -4.338 670 HA PHE 86 HA PHE 86 246.210 -0.031 -7.271 671 1HB PHE 86 HB2 PHE 86 243.888 -0.681 -5.521 672 2HB PHE 86 HB1 PHE 86 243.559 0.338 -6.917 673 HD1 PHE 86 HD1 PHE 86 243.889 -0.523 -9.187 674 HD2 PHE 86 HD2 PHE 86 244.441 -2.991 -5.765 675 HE1 PHE 86 HE1 PHE 86 243.774 -2.523 -10.615 676 HE2 PHE 86 HE2 PHE 86 244.329 -4.996 -7.186 677 HZ PHE 86 HZ PHE 86 243.995 -4.763 -9.615 678 H CYS 87 HN CYS 87 246.364 1.994 -8.046 679 HA CYS 87 HA CYS 87 245.456 4.200 -6.305 680 1HB CYS 87 HB2 CYS 87 247.868 4.282 -6.671 681 2HB CYS 87 HB1 CYS 87 247.637 4.169 -8.412 682 HG CYS 87 HG CYS 87 247.884 6.630 -8.171 683 H THR 88 HN THR 88 243.616 5.080 -7.035 684 HA THR 88 HA THR 88 242.908 4.705 -9.843 685 HB THR 88 HB THR 88 241.342 4.047 -8.011 686 HG1 THR 88 HG1 THR 88 239.880 5.944 -9.337 687 1HG2 THR 88 HG21 THR 88 240.628 5.417 -6.451 688 2HG2 THR 88 HG22 THR 88 240.197 6.649 -7.637 689 3HG2 THR 88 HG23 THR 88 241.841 6.569 -7.003 690 H ASP 89 HN ASP 89 241.241 6.667 -10.418 691 HA ASP 89 HA ASP 89 242.232 9.274 -9.748 692 1HB ASP 89 HB2 ASP 89 243.891 8.393 -11.456 693 2HB ASP 89 HB1 ASP 89 242.567 8.381 -12.618 694 H SER 90 HN SER 90 240.370 7.282 -11.983 695 HA SER 90 HA SER 90 238.449 9.399 -12.456 696 1HB SER 90 HB2 SER 90 239.302 7.224 -13.945 697 2HB SER 90 HB1 SER 90 237.713 6.713 -13.373 698 HG SER 90 HG SER 90 236.789 8.213 -14.560 699 H ILE 91 HN ILE 91 237.313 9.794 -10.593 700 HA ILE 91 HA ILE 91 236.083 7.495 -9.247 701 HB ILE 91 HB ILE 91 235.618 8.971 -7.363 702 1HG1 ILE 91 HG12 ILE 91 237.086 11.120 -8.913 703 2HG1 ILE 91 HG11 ILE 91 235.337 11.060 -8.712 704 1HG2 ILE 91 HG21 ILE 91 238.481 9.146 -8.299 705 2HG2 ILE 91 HG22 ILE 91 237.748 7.795 -7.434 706 3HG2 ILE 91 HG23 ILE 91 237.923 9.361 -6.640 707 1HD1 ILE 91 HD11 ILE 91 237.328 11.271 -6.465 708 2HD1 ILE 91 HD12 ILE 91 235.571 11.317 -6.323 709 3HD1 ILE 91 HD13 ILE 91 236.422 12.617 -7.157 710 H GLN 92 HN GLN 92 233.869 8.268 -8.161 711 HA GLN 92 HA GLN 92 232.249 9.579 -10.231 712 1HB GLN 92 HB2 GLN 92 231.812 6.904 -8.940 713 2HB GLN 92 HB1 GLN 92 230.468 7.818 -9.610 714 1HG GLN 92 HG2 GLN 92 232.694 7.625 -11.457 715 2HG GLN 92 HG1 GLN 92 232.090 6.045 -10.961 716 1HE2 GLN 92 HE21 GLN 92 231.916 7.064 -13.569 717 2HE2 GLN 92 HE22 GLN 92 230.248 7.278 -13.958 718 H GLY 93 HN GLY 93 231.706 8.052 -7.061 719 1HA GLY 93 HA2 GLY 93 229.706 9.812 -6.231 720 2HA GLY 93 HA1 GLY 93 230.691 8.832 -5.160 721 H THR 94 HN THR 94 230.432 10.697 -3.715 722 HA THR 94 HA THR 94 232.412 12.781 -4.300 723 HB THR 94 HB THR 94 230.282 13.435 -2.386 724 HG1 THR 94 HG1 THR 94 229.738 12.953 -5.113 725 1HG2 THR 94 HG21 THR 94 231.147 15.429 -2.833 726 2HG2 THR 94 HG22 THR 94 230.301 15.341 -4.376 727 3HG2 THR 94 HG23 THR 94 231.985 14.831 -4.263 728 HA PRO 95 HA PRO 95 234.464 11.817 -0.559 729 1HB PRO 95 HB2 PRO 95 234.665 14.664 0.156 730 2HB PRO 95 HB1 PRO 95 235.948 13.526 -0.265 731 1HG PRO 95 HG2 PRO 95 235.228 15.512 -1.910 732 2HG PRO 95 HG1 PRO 95 235.752 13.930 -2.519 733 1HD PRO 95 HD2 PRO 95 232.976 15.020 -2.216 734 2HD PRO 95 HD1 PRO 95 233.685 14.112 -3.570 735 H VAL 96 HN VAL 96 232.062 11.269 -0.143 736 HA VAL 96 HA VAL 96 230.657 12.939 1.716 737 HB VAL 96 HB VAL 96 230.103 10.006 1.399 738 1HG1 VAL 96 HG11 VAL 96 228.892 11.873 2.898 739 2HG1 VAL 96 HG12 VAL 96 228.056 10.477 2.219 740 3HG1 VAL 96 HG13 VAL 96 227.968 12.039 1.405 741 1HG2 VAL 96 HG21 VAL 96 229.886 12.105 -0.672 742 2HG2 VAL 96 HG22 VAL 96 228.509 11.015 -0.499 743 3HG2 VAL 96 HG23 VAL 96 230.113 10.363 -0.837 744 H GLU 97 HN GLU 97 232.851 12.971 2.940 745 HA GLU 97 HA GLU 97 233.849 10.997 4.528 746 1HB GLU 97 HB2 GLU 97 234.598 12.710 6.051 747 2HB GLU 97 HB1 GLU 97 234.685 13.338 4.412 748 1HG GLU 97 HG2 GLU 97 232.349 14.321 4.922 749 2HG GLU 97 HG1 GLU 97 232.794 14.051 6.607 750 H SER 98 HN SER 98 232.785 9.548 5.714 751 HA SER 98 HA SER 98 230.296 10.246 7.031 752 1HB SER 98 HB2 SER 98 230.538 7.733 7.761 753 2HB SER 98 HB1 SER 98 230.108 8.129 6.097 754 HG SER 98 HG SER 98 232.007 6.597 6.718 755 H ASP 99 HN ASP 99 230.156 8.937 9.299 756 HA ASP 99 HA ASP 99 231.714 10.480 11.093 757 1HB ASP 99 HB2 ASP 99 229.874 8.125 11.523 758 2HB ASP 99 HB1 ASP 99 230.653 8.994 12.843 759 H GLU 100 HN GLU 100 232.408 7.609 9.434 760 HA GLU 100 HA GLU 100 234.414 6.827 11.437 761 1HB GLU 100 HB2 GLU 100 232.662 5.327 9.684 762 2HB GLU 100 HB1 GLU 100 234.340 4.864 9.442 763 1HG GLU 100 HG2 GLU 100 234.528 3.936 11.495 764 2HG GLU 100 HG1 GLU 100 233.413 5.082 12.238 765 H MET 101 HN MET 101 233.957 7.644 8.036 766 HA MET 101 HA MET 101 236.880 7.652 7.695 767 1HB MET 101 HB2 MET 101 234.666 6.886 5.969 768 2HB MET 101 HB1 MET 101 235.756 8.019 5.180 769 1HG MET 101 HG2 MET 101 237.041 5.793 6.615 770 2HG MET 101 HG1 MET 101 236.100 5.355 5.190 771 1HE MET 101 HE1 MET 101 239.097 6.239 6.694 772 2HE MET 101 HE2 MET 101 239.385 7.885 6.129 773 3HE MET 101 HE3 MET 101 240.253 6.536 5.395 774 H ARG 102 HN ARG 102 237.781 9.367 6.314 775 HA ARG 102 HA ARG 102 236.336 11.790 5.887 776 1HB ARG 102 HB2 ARG 102 236.685 11.850 8.369 777 2HB ARG 102 HB1 ARG 102 238.420 11.823 8.083 778 1HG ARG 102 HG2 ARG 102 237.769 13.918 6.553 779 2HG ARG 102 HG1 ARG 102 236.475 14.018 7.748 780 1HD ARG 102 HD2 ARG 102 238.197 13.931 9.536 781 2HD ARG 102 HD1 ARG 102 239.441 13.982 8.288 782 HE ARG 102 HE ARG 102 237.557 16.147 8.132 783 1HH1 ARG 102 HH11 ARG 102 240.522 15.034 9.597 784 2HH1 ARG 102 HH12 ARG 102 241.109 16.631 9.920 785 1HH2 ARG 102 HH21 ARG 102 238.328 18.249 8.555 786 2HH2 ARG 102 HH22 ARG 102 239.865 18.456 9.328 787 HA PRO 103 HA PRO 103 240.056 11.279 3.257 788 1HB PRO 103 HB2 PRO 103 238.960 12.195 0.980 789 2HB PRO 103 HB1 PRO 103 238.680 10.546 1.555 790 1HG PRO 103 HG2 PRO 103 236.936 12.970 1.831 791 2HG PRO 103 HG1 PRO 103 236.487 11.321 1.353 792 1HD PRO 103 HD2 PRO 103 236.130 12.259 3.876 793 2HD PRO 103 HD1 PRO 103 236.485 10.555 3.535 794 H CYS 104 HN CYS 104 241.467 12.786 2.311 795 HA CYS 104 HA CYS 104 240.747 15.605 2.421 796 1HB CYS 104 HB2 CYS 104 242.321 14.335 4.440 797 2HB CYS 104 HB1 CYS 104 243.361 15.424 3.527 798 HG CYS 104 HG CYS 104 242.257 16.729 5.502 799 H TRP 105 HN TRP 105 241.420 16.559 0.628 800 HA TRP 105 HA TRP 105 243.380 15.199 -1.043 801 1HB TRP 105 HB2 TRP 105 241.664 17.612 -1.664 802 2HB TRP 105 HB1 TRP 105 242.621 16.689 -2.818 803 HD1 TRP 105 HD1 TRP 105 239.994 15.526 -0.181 804 HE1 TRP 105 HE1 TRP 105 238.283 14.021 -1.384 805 HE3 TRP 105 HE3 TRP 105 241.856 15.826 -4.934 806 HZ2 TRP 105 HZ2 TRP 105 237.792 13.092 -4.003 807 HZ3 TRP 105 HZ3 TRP 105 240.706 14.600 -6.730 808 HH2 TRP 105 HH2 TRP 105 238.716 13.261 -6.273 809 H PHE 106 HN PHE 106 245.442 15.803 -1.131 810 HA PHE 106 HA PHE 106 246.148 18.588 -0.509 811 1HB PHE 106 HB2 PHE 106 247.594 16.151 0.558 812 2HB PHE 106 HB1 PHE 106 248.073 17.824 0.813 813 HD1 PHE 106 HD1 PHE 106 247.091 15.348 2.664 814 HD2 PHE 106 HD2 PHE 106 245.496 19.093 1.421 815 HE1 PHE 106 HE1 PHE 106 245.716 15.435 4.702 816 HE2 PHE 106 HE2 PHE 106 244.116 19.186 3.457 817 HZ PHE 106 HZ PHE 106 244.227 17.355 5.102 818 H GLN 107 HN GLN 107 248.961 18.189 -0.744 819 HA GLN 107 HA GLN 107 249.157 18.048 -3.626 820 1HB GLN 107 HB2 GLN 107 251.277 18.618 -1.546 821 2HB GLN 107 HB1 GLN 107 251.471 18.807 -3.283 822 1HG GLN 107 HG2 GLN 107 249.992 20.626 -3.360 823 2HG GLN 107 HG1 GLN 107 249.363 20.285 -1.749 824 1HE2 GLN 107 HE21 GLN 107 251.404 22.204 -3.500 825 2HE2 GLN 107 HE22 GLN 107 252.396 22.804 -2.219 826 H LEU 108 HN LEU 108 250.559 16.671 -4.778 827 HA LEU 108 HA LEU 108 250.710 14.013 -3.712 828 1HB LEU 108 HB2 LEU 108 251.205 13.327 -5.866 829 2HB LEU 108 HB1 LEU 108 250.272 14.783 -6.152 830 HG LEU 108 HG LEU 108 253.284 14.570 -6.266 831 1HD1 LEU 108 HD11 LEU 108 252.423 13.491 -8.171 832 2HD1 LEU 108 HD12 LEU 108 252.835 15.123 -8.698 833 3HD1 LEU 108 HD13 LEU 108 251.153 14.698 -8.380 834 1HD2 LEU 108 HD21 LEU 108 253.286 16.847 -6.997 835 2HD2 LEU 108 HD22 LEU 108 252.403 16.766 -5.472 836 3HD2 LEU 108 HD23 LEU 108 251.524 16.905 -6.994 837 H ASP 109 HN ASP 109 252.681 16.636 -3.315 838 HA ASP 109 HA ASP 109 255.054 14.937 -2.936 839 1HB ASP 109 HB2 ASP 109 254.752 17.749 -3.907 840 2HB ASP 109 HB1 ASP 109 256.193 17.330 -2.986 841 H GLN 110 HN GLN 110 252.664 15.746 -1.193 842 HA GLN 110 HA GLN 110 254.272 16.404 1.150 843 1HB GLN 110 HB2 GLN 110 251.752 17.850 0.330 844 2HB GLN 110 HB1 GLN 110 252.471 17.966 1.930 845 1HG GLN 110 HG2 GLN 110 254.584 18.547 0.292 846 2HG GLN 110 HG1 GLN 110 253.223 19.268 -0.565 847 1HE2 GLN 110 HE21 GLN 110 255.582 19.963 1.512 848 2HE2 GLN 110 HE22 GLN 110 254.844 21.230 2.426 849 H ILE 111 HN ILE 111 252.818 14.006 0.010 850 HA ILE 111 HA ILE 111 250.596 13.539 1.762 851 HB ILE 111 HB ILE 111 251.823 11.060 0.928 852 1HG1 ILE 111 HG12 ILE 111 251.157 11.531 -1.564 853 2HG1 ILE 111 HG11 ILE 111 251.558 13.196 -1.147 854 1HG2 ILE 111 HG21 ILE 111 249.277 12.038 -0.212 855 2HG2 ILE 111 HG22 ILE 111 249.384 11.808 1.533 856 3HG2 ILE 111 HG23 ILE 111 249.706 10.457 0.444 857 1HD1 ILE 111 HD11 ILE 111 253.510 12.260 -2.058 858 2HD1 ILE 111 HD12 ILE 111 253.335 10.782 -1.112 859 3HD1 ILE 111 HD13 ILE 111 253.771 12.293 -0.315 860 HA PRO 112 HA PRO 112 253.175 12.220 5.148 861 1HB PRO 112 HB2 PRO 112 251.338 12.330 7.064 862 2HB PRO 112 HB1 PRO 112 251.863 13.811 6.253 863 1HG PRO 112 HG2 PRO 112 249.351 12.247 5.902 864 2HG PRO 112 HG1 PRO 112 249.607 13.997 5.805 865 1HD PRO 112 HD2 PRO 112 249.474 12.171 3.643 866 2HD PRO 112 HD1 PRO 112 249.958 13.877 3.570 867 H PHE 113 HN PHE 113 253.700 10.112 4.658 868 HA PHE 113 HA PHE 113 251.742 8.016 4.888 869 1HB PHE 113 HB2 PHE 113 254.548 7.174 4.866 870 2HB PHE 113 HB1 PHE 113 253.210 6.668 3.855 871 HD1 PHE 113 HD1 PHE 113 256.158 7.269 3.208 872 HD2 PHE 113 HD2 PHE 113 252.566 9.506 2.768 873 HE1 PHE 113 HE1 PHE 113 257.154 8.462 1.318 874 HE2 PHE 113 HE2 PHE 113 253.565 10.717 0.877 875 HZ PHE 113 HZ PHE 113 255.859 10.203 0.145 876 H LYS 114 HN LYS 114 253.851 9.611 7.042 877 HA LYS 114 HA LYS 114 254.365 7.518 8.862 878 1HB LYS 114 HB2 LYS 114 254.335 10.522 9.133 879 2HB LYS 114 HB1 LYS 114 254.690 9.468 10.495 880 1HG LYS 114 HG2 LYS 114 256.232 9.593 7.912 881 2HG LYS 114 HG1 LYS 114 256.728 10.290 9.456 882 1HD LYS 114 HD2 LYS 114 256.650 7.991 10.431 883 2HD LYS 114 HD1 LYS 114 256.355 7.368 8.807 884 1HE LYS 114 HE2 LYS 114 258.603 7.173 8.779 885 2HE LYS 114 HE1 LYS 114 258.527 8.876 8.331 886 1HZ LYS 114 HZ1 LYS 114 258.809 9.449 10.674 887 2HZ LYS 114 HZ2 LYS 114 260.111 8.533 10.103 888 3HZ LYS 114 HZ3 LYS 114 258.931 7.809 11.073 889 H ASP 115 HN ASP 115 251.657 9.557 8.222 890 HA ASP 115 HA ASP 115 250.341 8.696 10.670 891 1HB ASP 115 HB2 ASP 115 249.914 10.933 8.752 892 2HB ASP 115 HB1 ASP 115 248.508 10.311 9.611 893 H MET 116 HN MET 116 250.894 6.908 8.414 894 HA MET 116 HA MET 116 248.127 6.094 7.855 895 1HB MET 116 HB2 MET 116 250.341 5.705 5.859 896 2HB MET 116 HB1 MET 116 248.609 5.556 5.604 897 1HG MET 116 HG2 MET 116 248.565 8.078 6.193 898 2HG MET 116 HG1 MET 116 250.282 8.013 5.826 899 1HE MET 116 HE1 MET 116 251.051 7.767 2.757 900 2HE MET 116 HE2 MET 116 250.140 6.317 2.335 901 3HE MET 116 HE3 MET 116 250.966 6.418 3.889 902 H TRP 117 HN TRP 117 251.519 4.996 7.858 903 HA TRP 117 HA TRP 117 251.154 2.835 9.540 904 1HB TRP 117 HB2 TRP 117 249.969 2.333 7.020 905 2HB TRP 117 HB1 TRP 117 251.431 1.358 7.089 906 HD1 TRP 117 HD1 TRP 117 250.232 -0.950 7.361 907 HE1 TRP 117 HE1 TRP 117 248.878 -2.040 9.256 908 HE3 TRP 117 HE3 TRP 117 249.456 3.173 10.305 909 HZ2 TRP 117 HZ2 TRP 117 247.646 -1.267 11.668 910 HZ3 TRP 117 HZ3 TRP 117 248.178 2.902 12.387 911 HH2 TRP 117 HH2 TRP 117 247.292 0.729 13.054 912 HA PRO 118 HA PRO 118 255.503 2.476 8.824 913 1HB PRO 118 HB2 PRO 118 256.080 0.022 9.659 914 2HB PRO 118 HB1 PRO 118 255.364 1.207 10.755 915 1HG PRO 118 HG2 PRO 118 254.084 -1.096 9.362 916 2HG PRO 118 HG1 PRO 118 253.787 -0.461 10.987 917 1HD PRO 118 HD2 PRO 118 252.265 0.070 8.698 918 2HD PRO 118 HD1 PRO 118 252.202 0.971 10.224 919 H ASP 119 HN ASP 119 253.638 1.356 6.513 920 HA ASP 119 HA ASP 119 255.869 0.094 5.067 921 1HB ASP 119 HB2 ASP 119 254.067 -1.239 3.837 922 2HB ASP 119 HB1 ASP 119 254.431 -1.726 5.490 923 H ASP 120 HN ASP 120 253.242 2.339 5.063 924 HA ASP 120 HA ASP 120 252.664 2.788 2.441 925 1HB ASP 120 HB2 ASP 120 253.073 4.848 4.602 926 2HB ASP 120 HB1 ASP 120 252.272 5.156 3.063 927 H SER 121 HN SER 121 255.358 4.339 4.182 928 HA SER 121 HA SER 121 256.401 5.770 2.017 929 1HB SER 121 HB2 SER 121 258.255 4.656 4.080 930 2HB SER 121 HB1 SER 121 258.171 6.282 3.406 931 HG SER 121 HG SER 121 257.408 6.254 5.542 932 H TYR 122 HN TYR 122 256.488 2.382 2.610 933 HA TYR 122 HA TYR 122 258.888 1.941 1.075 934 1HB TYR 122 HB2 TYR 122 256.999 0.208 2.597 935 2HB TYR 122 HB1 TYR 122 258.009 -0.531 1.359 936 HD1 TYR 122 HD1 TYR 122 257.827 0.351 4.748 937 HD2 TYR 122 HD2 TYR 122 260.570 0.127 1.503 938 HE1 TYR 122 HE1 TYR 122 259.697 0.254 6.342 939 HE2 TYR 122 HE2 TYR 122 262.447 0.028 3.088 940 HH TYR 122 HH TYR 122 262.333 0.932 6.132 941 H TRP 123 HN TRP 123 255.434 1.938 0.464 942 HA TRP 123 HA TRP 123 256.031 0.886 -2.210 943 1HB TRP 123 HB2 TRP 123 253.699 0.143 -2.364 944 2HB TRP 123 HB1 TRP 123 254.539 -0.589 -1.004 945 HD1 TRP 123 HD1 TRP 123 253.751 0.131 1.458 946 HE1 TRP 123 HE1 TRP 123 251.554 1.163 2.311 947 HE3 TRP 123 HE3 TRP 123 251.847 1.782 -2.989 948 HZ2 TRP 123 HZ2 TRP 123 249.307 2.514 1.239 949 HZ3 TRP 123 HZ3 TRP 123 249.665 2.921 -2.983 950 HH2 TRP 123 HH2 TRP 123 248.426 3.269 -0.917 951 H PHE 124 HN PHE 124 255.089 3.717 -0.623 952 HA PHE 124 HA PHE 124 253.431 4.762 -2.706 953 1HB PHE 124 HB2 PHE 124 253.775 5.443 -0.107 954 2HB PHE 124 HB1 PHE 124 254.753 6.677 -0.889 955 HD1 PHE 124 HD1 PHE 124 253.295 8.445 -0.112 956 HD2 PHE 124 HD2 PHE 124 251.783 5.321 -2.573 957 HE1 PHE 124 HE1 PHE 124 251.286 9.764 -0.535 958 HE2 PHE 124 HE2 PHE 124 249.764 6.648 -3.011 959 HZ PHE 124 HZ PHE 124 249.509 8.875 -1.991 960 HA PRO 125 HA PRO 125 257.671 7.307 -3.469 961 1HB PRO 125 HB2 PRO 125 259.292 4.805 -3.236 962 2HB PRO 125 HB1 PRO 125 259.757 6.481 -2.916 963 1HG PRO 125 HG2 PRO 125 259.210 4.831 -0.910 964 2HG PRO 125 HG1 PRO 125 258.687 6.525 -0.858 965 1HD PRO 125 HD2 PRO 125 257.086 4.061 -1.339 966 2HD PRO 125 HD1 PRO 125 256.614 5.580 -0.554 967 H LEU 126 HN LEU 126 257.198 3.892 -4.396 968 HA LEU 126 HA LEU 126 258.177 4.323 -7.055 969 1HB LEU 126 HB2 LEU 126 257.248 2.045 -7.492 970 2HB LEU 126 HB1 LEU 126 258.407 2.125 -6.180 971 HG LEU 126 HG LEU 126 255.744 2.458 -5.145 972 1HD1 LEU 126 HD11 LEU 126 254.982 0.124 -5.635 973 2HD1 LEU 126 HD12 LEU 126 256.222 0.051 -6.887 974 3HD1 LEU 126 HD13 LEU 126 254.915 1.228 -7.008 975 1HD2 LEU 126 HD21 LEU 126 256.582 0.165 -4.094 976 2HD2 LEU 126 HD22 LEU 126 257.215 1.727 -3.575 977 3HD2 LEU 126 HD23 LEU 126 258.125 0.745 -4.723 978 H LEU 127 HN LEU 127 255.087 4.423 -5.452 979 HA LEU 127 HA LEU 127 253.409 4.319 -7.702 980 1HB LEU 127 HB2 LEU 127 253.031 5.787 -5.090 981 2HB LEU 127 HB1 LEU 127 251.769 5.510 -6.270 982 HG LEU 127 HG LEU 127 252.799 3.759 -4.190 983 1HD1 LEU 127 HD11 LEU 127 250.309 4.010 -5.831 984 2HD1 LEU 127 HD12 LEU 127 250.538 4.305 -4.107 985 3HD1 LEU 127 HD13 LEU 127 250.558 2.655 -4.731 986 1HD2 LEU 127 HD21 LEU 127 252.475 1.672 -5.499 987 2HD2 LEU 127 HD22 LEU 127 253.905 2.588 -5.971 988 3HD2 LEU 127 HD23 LEU 127 252.452 2.646 -6.969 989 H LEU 128 HN LEU 128 254.853 7.022 -5.952 990 HA LEU 128 HA LEU 128 253.856 9.065 -7.644 991 1HB LEU 128 HB2 LEU 128 255.917 8.859 -5.507 992 2HB LEU 128 HB1 LEU 128 255.990 10.250 -6.571 993 HG LEU 128 HG LEU 128 253.414 9.553 -5.212 994 1HD1 LEU 128 HD11 LEU 128 254.465 11.467 -3.598 995 2HD1 LEU 128 HD12 LEU 128 255.886 10.478 -3.934 996 3HD1 LEU 128 HD13 LEU 128 254.446 9.742 -3.231 997 1HD2 LEU 128 HD21 LEU 128 252.907 11.834 -5.527 998 2HD2 LEU 128 HD22 LEU 128 253.637 11.294 -7.039 999 3HD2 LEU 128 HD23 LEU 128 254.584 12.239 -5.890 1000 H GLN 129 HN GLN 129 256.661 6.997 -7.755 1001 HA GLN 129 HA GLN 129 257.955 8.546 -9.831 1002 1HB GLN 129 HB2 GLN 129 259.132 7.216 -7.985 1003 2HB GLN 129 HB1 GLN 129 258.735 5.784 -8.924 1004 1HG GLN 129 HG2 GLN 129 260.891 6.288 -9.589 1005 2HG GLN 129 HG1 GLN 129 259.897 6.981 -10.869 1006 1HE2 GLN 129 HE21 GLN 129 261.365 7.859 -7.764 1007 2HE2 GLN 129 HE22 GLN 129 261.812 9.462 -8.231 1008 H LYS 130 HN LYS 130 255.342 6.602 -9.892 1009 HA LYS 130 HA LYS 130 254.233 5.469 -11.518 1010 1HB LYS 130 HB2 LYS 130 256.310 6.581 -13.408 1011 2HB LYS 130 HB1 LYS 130 254.701 6.007 -13.822 1012 1HG LYS 130 HG2 LYS 130 253.712 7.930 -13.214 1013 2HG LYS 130 HG1 LYS 130 254.787 8.171 -11.836 1014 1HD LYS 130 HD2 LYS 130 255.622 8.584 -14.702 1015 2HD LYS 130 HD1 LYS 130 255.014 9.875 -13.662 1016 1HE LYS 130 HE2 LYS 130 256.885 8.994 -12.037 1017 2HE LYS 130 HE1 LYS 130 257.586 8.373 -13.530 1018 1HZ LYS 130 HZ1 LYS 130 258.333 10.647 -12.849 1019 2HZ LYS 130 HZ2 LYS 130 256.771 11.202 -13.186 1020 3HZ LYS 130 HZ3 LYS 130 257.716 10.540 -14.422 1021 H LYS 131 HN LYS 131 255.719 3.835 -10.099 1022 HA LYS 131 HA LYS 131 256.742 1.934 -12.079 1023 1HB LYS 131 HB2 LYS 131 258.168 2.691 -9.523 1024 2HB LYS 131 HB1 LYS 131 258.614 1.341 -10.557 1025 1HG LYS 131 HG2 LYS 131 258.461 4.094 -11.698 1026 2HG LYS 131 HG1 LYS 131 259.871 3.602 -10.757 1027 1HD LYS 131 HD2 LYS 131 260.574 2.114 -12.334 1028 2HD LYS 131 HD1 LYS 131 258.935 1.753 -12.880 1029 1HE LYS 131 HE2 LYS 131 259.608 2.959 -14.677 1030 2HE LYS 131 HE1 LYS 131 259.085 4.302 -13.660 1031 1HZ LYS 131 HZ1 LYS 131 261.850 3.336 -14.108 1032 2HZ LYS 131 HZ2 LYS 131 261.448 4.407 -12.862 1033 3HZ LYS 131 HZ3 LYS 131 261.208 4.858 -14.474 1034 H LYS 132 HN LYS 132 256.810 -0.296 -11.267 1035 HA LYS 132 HA LYS 132 254.769 -0.715 -9.187 1036 1HB LYS 132 HB2 LYS 132 255.518 -2.507 -11.505 1037 2HB LYS 132 HB1 LYS 132 254.291 -2.862 -10.297 1038 1HG LYS 132 HG2 LYS 132 252.782 -1.440 -11.206 1039 2HG LYS 132 HG1 LYS 132 254.018 -0.312 -11.768 1040 1HD LYS 132 HD2 LYS 132 254.564 -2.492 -13.293 1041 2HD LYS 132 HD1 LYS 132 252.813 -2.629 -13.118 1042 1HE LYS 132 HE2 LYS 132 252.408 -0.697 -14.270 1043 2HE LYS 132 HE1 LYS 132 253.941 0.034 -13.797 1044 1HZ LYS 132 HZ1 LYS 132 253.808 -0.570 -16.176 1045 2HZ LYS 132 HZ2 LYS 132 253.694 -2.199 -15.737 1046 3HZ LYS 132 HZ3 LYS 132 255.092 -1.321 -15.369 1047 H PHE 133 HN PHE 133 255.344 -1.741 -7.389 1048 HA PHE 133 HA PHE 133 257.707 -3.482 -7.425 1049 1HB PHE 133 HB2 PHE 133 257.224 -1.116 -5.636 1050 2HB PHE 133 HB1 PHE 133 258.207 -2.468 -5.088 1051 HD1 PHE 133 HD1 PHE 133 257.904 -0.203 -8.042 1052 HD2 PHE 133 HD2 PHE 133 260.465 -2.337 -5.398 1053 HE1 PHE 133 HE1 PHE 133 259.867 0.774 -9.160 1054 HE2 PHE 133 HE2 PHE 133 262.431 -1.364 -6.510 1055 HZ PHE 133 HZ PHE 133 262.134 0.193 -8.394 1056 H HIS 134 HN HIS 134 257.879 -4.671 -5.270 1057 HA HIS 134 HA HIS 134 255.267 -5.228 -4.070 1058 1HB HIS 134 HB2 HIS 134 255.558 -6.914 -5.827 1059 2HB HIS 134 HB1 HIS 134 257.139 -7.336 -5.180 1060 HD1 HIS 134 HD1 HIS 134 256.887 -8.082 -2.446 1061 HD2 HIS 134 HD2 HIS 134 253.680 -8.667 -5.023 1062 HE1 HIS 134 HE1 HIS 134 255.442 -9.815 -1.338 1063 HE2 HIS 134 HE2 HIS 134 253.551 -10.214 -2.954 1064 H GLY 135 HN GLY 135 255.435 -5.222 -1.898 1065 1HA GLY 135 HA2 GLY 135 258.116 -5.742 -0.772 1066 2HA GLY 135 HA1 GLY 135 257.052 -4.494 -0.147 1067 H TYR 136 HN TYR 136 258.320 -7.138 0.819 1068 HA TYR 136 HA TYR 136 255.883 -8.277 2.020 1069 1HB TYR 136 HB2 TYR 136 257.271 -9.794 0.550 1070 2HB TYR 136 HB1 TYR 136 258.575 -9.625 1.715 1071 HD1 TYR 136 HD1 TYR 136 255.743 -11.511 0.773 1072 HD2 TYR 136 HD2 TYR 136 258.012 -10.314 4.165 1073 HE1 TYR 136 HE1 TYR 136 254.840 -13.414 2.037 1074 HE2 TYR 136 HE2 TYR 136 257.116 -12.214 5.442 1075 HH TYR 136 HH TYR 136 254.466 -13.919 4.586 1076 H PHE 137 HN PHE 137 255.629 -7.447 4.009 1077 HA PHE 137 HA PHE 137 258.040 -7.015 5.648 1078 1HB PHE 137 HB2 PHE 137 255.409 -5.611 6.052 1079 2HB PHE 137 HB1 PHE 137 256.992 -5.166 6.679 1080 HD1 PHE 137 HD1 PHE 137 258.256 -3.580 5.578 1081 HD2 PHE 137 HD2 PHE 137 255.138 -5.572 3.479 1082 HE1 PHE 137 HE1 PHE 137 258.605 -2.089 3.655 1083 HE2 PHE 137 HE2 PHE 137 255.480 -4.082 1.550 1084 HZ PHE 137 HZ PHE 137 257.216 -2.338 1.636 1085 H LYS 138 HN LYS 138 258.172 -7.923 7.633 1086 HA LYS 138 HA LYS 138 256.074 -9.758 8.463 1087 1HB LYS 138 HB2 LYS 138 258.828 -9.885 8.560 1088 2HB LYS 138 HB1 LYS 138 258.403 -9.487 10.219 1089 1HG LYS 138 HG2 LYS 138 256.635 -11.466 9.716 1090 2HG LYS 138 HG1 LYS 138 257.989 -11.964 8.700 1091 1HD LYS 138 HD2 LYS 138 259.325 -12.413 10.472 1092 2HD LYS 138 HD1 LYS 138 258.677 -11.080 11.430 1093 1HE LYS 138 HE2 LYS 138 256.769 -12.338 12.054 1094 2HE LYS 138 HE1 LYS 138 257.124 -13.594 10.867 1095 1HZ LYS 138 HZ1 LYS 138 259.077 -14.206 12.125 1096 2HZ LYS 138 HZ2 LYS 138 257.714 -14.264 13.126 1097 3HZ LYS 138 HZ3 LYS 138 258.794 -12.968 13.243 1098 H PHE 139 HN PHE 139 254.753 -9.413 10.223 1099 HA PHE 139 HA PHE 139 255.078 -6.804 11.527 1100 1HB PHE 139 HB2 PHE 139 252.840 -6.555 11.432 1101 2HB PHE 139 HB1 PHE 139 252.900 -7.859 10.260 1102 HD1 PHE 139 HD1 PHE 139 250.731 -6.823 12.341 1103 HD2 PHE 139 HD2 PHE 139 253.356 -10.162 12.145 1104 HE1 PHE 139 HE1 PHE 139 249.166 -8.129 13.717 1105 HE2 PHE 139 HE2 PHE 139 251.799 -11.471 13.529 1106 HZ PHE 139 HZ PHE 139 249.701 -10.456 14.315 1107 H GLN 140 HN GLN 140 254.336 -6.649 13.823 1108 HA GLN 140 HA GLN 140 255.192 -9.030 15.336 1109 1HB GLN 140 HB2 GLN 140 256.924 -7.451 15.571 1110 2HB GLN 140 HB1 GLN 140 255.804 -6.117 15.744 1111 1HG GLN 140 HG2 GLN 140 256.939 -6.686 17.836 1112 2HG GLN 140 HG1 GLN 140 255.188 -6.853 17.948 1113 1HE2 GLN 140 HE21 GLN 140 257.503 -8.094 19.411 1114 2HE2 GLN 140 HE22 GLN 140 257.195 -9.793 19.346 1115 H GLY 141 HN GLY 141 252.541 -7.188 14.655 1116 1HA GLY 141 HA2 GLY 141 250.904 -8.321 16.581 1117 2HA GLY 141 HA1 GLY 141 251.443 -6.791 17.252 1118 H GLN 142 HN GLN 142 251.476 -5.253 14.878 1119 HA GLN 142 HA GLN 142 249.241 -5.391 13.266 1120 1HB GLN 142 HB2 GLN 142 248.565 -4.668 15.973 1121 2HB GLN 142 HB1 GLN 142 248.182 -3.342 14.883 1122 1HG GLN 142 HG2 GLN 142 247.288 -6.174 14.421 1123 2HG GLN 142 HG1 GLN 142 246.332 -4.978 15.295 1124 1HE2 GLN 142 HE21 GLN 142 245.344 -3.331 14.182 1125 2HE2 GLN 142 HE22 GLN 142 245.236 -3.292 12.459 1126 H ASP 143 HN ASP 143 251.100 -3.107 15.253 1127 HA ASP 143 HA ASP 143 251.333 -1.390 12.868 1128 1HB ASP 143 HB2 ASP 143 251.613 0.518 14.445 1129 2HB ASP 143 HB1 ASP 143 250.029 -0.244 14.540 1130 H THR 144 HN THR 144 253.065 -3.610 14.298 1131 HA THR 144 HA THR 144 255.560 -2.042 14.208 1132 HB THR 144 HB THR 144 254.895 -4.465 15.880 1133 HG1 THR 144 HG1 THR 144 255.107 -3.098 17.559 1134 1HG2 THR 144 HG21 THR 144 257.548 -3.096 15.526 1135 2HG2 THR 144 HG22 THR 144 257.145 -4.759 15.097 1136 3HG2 THR 144 HG23 THR 144 257.171 -4.267 16.790 1137 H ILE 145 HN ILE 145 257.143 -2.696 12.874 1138 HA ILE 145 HA ILE 145 256.670 -5.189 11.401 1139 HB ILE 145 HB ILE 145 258.308 -2.832 10.471 1140 1HG1 ILE 145 HG12 ILE 145 255.561 -3.747 9.584 1141 2HG1 ILE 145 HG11 ILE 145 255.884 -2.328 10.575 1142 1HG2 ILE 145 HG21 ILE 145 259.070 -4.979 9.594 1143 2HG2 ILE 145 HG22 ILE 145 258.331 -4.007 8.322 1144 3HG2 ILE 145 HG23 ILE 145 257.435 -5.344 9.042 1145 1HD1 ILE 145 HD11 ILE 145 257.146 -1.337 8.739 1146 2HD1 ILE 145 HD12 ILE 145 255.493 -1.718 8.261 1147 3HD1 ILE 145 HD13 ILE 145 256.821 -2.758 7.749 1148 H LEU 146 HN LEU 146 258.321 -6.639 11.113 1149 HA LEU 146 HA LEU 146 260.741 -6.150 12.717 1150 1HB LEU 146 HB2 LEU 146 259.529 -8.858 12.234 1151 2HB LEU 146 HB1 LEU 146 260.734 -8.404 13.427 1152 HG LEU 146 HG LEU 146 257.974 -7.227 13.530 1153 1HD1 LEU 146 HD11 LEU 146 257.015 -9.050 14.392 1154 2HD1 LEU 146 HD12 LEU 146 258.464 -9.518 15.281 1155 3HD1 LEU 146 HD13 LEU 146 258.308 -9.926 13.573 1156 1HD2 LEU 146 HD21 LEU 146 259.095 -6.117 15.133 1157 2HD2 LEU 146 HD22 LEU 146 260.370 -7.331 15.229 1158 3HD2 LEU 146 HD23 LEU 146 258.843 -7.587 16.073 1159 H ASP 147 HN ASP 147 259.489 -6.906 9.652 1160 HA ASP 147 HA ASP 147 262.154 -7.153 8.572 1161 1HB ASP 147 HB2 ASP 147 260.706 -9.489 9.119 1162 2HB ASP 147 HB1 ASP 147 260.512 -9.235 7.387 1163 H TYR 148 HN TYR 148 262.282 -6.274 6.533 1164 HA TYR 148 HA TYR 148 259.777 -5.917 5.071 1165 1HB TYR 148 HB2 TYR 148 260.134 -3.582 4.681 1166 2HB TYR 148 HB1 TYR 148 260.160 -3.875 6.416 1167 HD1 TYR 148 HD1 TYR 148 262.191 -2.993 3.483 1168 HD2 TYR 148 HD2 TYR 148 262.181 -3.552 7.701 1169 HE1 TYR 148 HE1 TYR 148 264.374 -1.873 3.631 1170 HE2 TYR 148 HE2 TYR 148 264.365 -2.433 7.860 1171 HH TYR 148 HH TYR 148 265.742 -0.898 6.619 1172 H THR 149 HN THR 149 259.933 -6.252 2.955 1173 HA THR 149 HA THR 149 262.603 -6.174 1.721 1174 HB THR 149 HB THR 149 261.276 -8.104 0.279 1175 HG1 THR 149 HG1 THR 149 260.730 -8.552 3.025 1176 1HG2 THR 149 HG21 THR 149 262.739 -9.716 1.267 1177 2HG2 THR 149 HG22 THR 149 263.025 -8.667 2.657 1178 3HG2 THR 149 HG23 THR 149 263.615 -8.199 1.061 1179 H LEU 150 HN LEU 150 262.676 -5.498 -0.423 1180 HA LEU 150 HA LEU 150 260.143 -4.618 -1.613 1181 1HB LEU 150 HB2 LEU 150 262.626 -2.968 -1.213 1182 2HB LEU 150 HB1 LEU 150 261.418 -2.558 -2.417 1183 HG LEU 150 HG LEU 150 259.924 -2.887 -0.109 1184 1HD1 LEU 150 HD11 LEU 150 262.413 -2.766 0.881 1185 2HD1 LEU 150 HD12 LEU 150 261.000 -2.123 1.718 1186 3HD1 LEU 150 HD13 LEU 150 262.042 -1.044 0.790 1187 1HD2 LEU 150 HD21 LEU 150 261.072 -0.333 -1.231 1188 2HD2 LEU 150 HD22 LEU 150 259.640 -0.477 -0.211 1189 3HD2 LEU 150 HD23 LEU 150 259.639 -1.166 -1.835 1190 H ARG 151 HN ARG 151 259.911 -5.382 -3.597 1191 HA ARG 151 HA ARG 151 262.319 -5.859 -5.224 1192 1HB ARG 151 HB2 ARG 151 259.890 -7.642 -5.293 1193 2HB ARG 151 HB1 ARG 151 261.464 -7.929 -6.022 1194 1HG ARG 151 HG2 ARG 151 262.103 -7.667 -3.380 1195 2HG ARG 151 HG1 ARG 151 260.525 -8.454 -3.308 1196 1HD ARG 151 HD2 ARG 151 262.291 -10.115 -3.371 1197 2HD ARG 151 HD1 ARG 151 261.333 -10.185 -4.849 1198 HE ARG 151 HE ARG 151 263.393 -8.542 -5.497 1199 1HH1 ARG 151 HH11 ARG 151 263.199 -11.757 -4.154 1200 2HH1 ARG 151 HH12 ARG 151 264.696 -12.274 -4.852 1201 1HH2 ARG 151 HH21 ARG 151 265.364 -9.220 -6.416 1202 2HH2 ARG 151 HH22 ARG 151 265.927 -10.834 -6.135 1203 H GLU 152 HN GLU 152 262.256 -4.967 -7.193 1204 HA GLU 152 HA GLU 152 259.970 -3.439 -7.991 1205 1HB GLU 152 HB2 GLU 152 261.309 -2.773 -9.897 1206 2HB GLU 152 HB1 GLU 152 262.297 -2.719 -8.446 1207 1HG GLU 152 HG2 GLU 152 263.796 -3.863 -9.615 1208 2HG GLU 152 HG1 GLU 152 262.744 -5.256 -9.368 1209 H VAL 153 HN VAL 153 258.539 -3.811 -9.652 1210 HA VAL 153 HA VAL 153 258.740 -6.397 -11.044 1211 HB VAL 153 HB VAL 153 256.230 -6.566 -10.866 1212 1HG1 VAL 153 HG11 VAL 153 256.448 -7.944 -9.093 1213 2HG1 VAL 153 HG12 VAL 153 257.190 -6.703 -8.084 1214 3HG1 VAL 153 HG13 VAL 153 258.161 -7.565 -9.277 1215 1HG2 VAL 153 HG21 VAL 153 255.982 -4.143 -10.176 1216 2HG2 VAL 153 HG22 VAL 153 256.525 -4.641 -8.574 1217 3HG2 VAL 153 HG23 VAL 153 255.043 -5.314 -9.251 1218 H ASP 154 HN ASP 154 258.045 -6.429 -13.149 1219 HA ASP 154 HA ASP 154 256.666 -4.138 -14.270 1220 1HB ASP 154 HB2 ASP 154 259.497 -4.860 -15.024 1221 2HB ASP 154 HB1 ASP 154 258.446 -3.917 -16.076 1222 H THR 155 HN THR 155 258.545 -7.024 -15.200 1223 HA THR 155 HA THR 155 256.293 -7.803 -16.935 1224 HB THR 155 HB THR 155 259.177 -8.543 -17.418 1225 HG1 THR 155 HG1 THR 155 259.456 -6.619 -18.157 1226 1HG2 THR 155 HG21 THR 155 258.526 -9.128 -19.603 1227 2HG2 THR 155 HG22 THR 155 256.925 -8.419 -19.395 1228 3HG2 THR 155 HG23 THR 155 257.359 -9.886 -18.519 1229 H VAL 156 HN VAL 156 255.394 -8.992 -15.178 1230 HA VAL 156 HA VAL 156 256.893 -11.135 -13.971 1231 HB VAL 156 HB VAL 156 253.910 -10.684 -13.845 1232 1HG1 VAL 156 HG11 VAL 156 254.920 -12.897 -13.107 1233 2HG1 VAL 156 HG12 VAL 156 253.928 -12.045 -11.923 1234 3HG1 VAL 156 HG13 VAL 156 255.686 -11.991 -11.803 1235 1HG2 VAL 156 HG21 VAL 156 255.343 -8.696 -13.170 1236 2HG2 VAL 156 HG22 VAL 156 255.919 -9.698 -11.838 1237 3HG2 VAL 156 HG23 VAL 156 254.206 -9.298 -11.965 Start of MODEL 22 1 1H MET 1 HT1 MET 1 244.191 -22.725 -1.987 2 2H MET 1 HT2 MET 1 245.062 -21.266 -2.229 3 3H MET 1 HT3 MET 1 244.741 -22.307 -3.556 4 HA MET 1 HA MET 1 243.346 -20.272 -3.352 5 1HB MET 1 HB2 MET 1 242.928 -22.716 -4.422 6 2HB MET 1 HB1 MET 1 241.572 -22.647 -3.305 7 1HG MET 1 HG2 MET 1 240.601 -21.750 -5.149 8 2HG MET 1 HG1 MET 1 241.223 -20.281 -4.399 9 1HE MET 1 HE1 MET 1 242.620 -23.164 -6.906 10 2HE MET 1 HE2 MET 1 242.448 -22.165 -8.350 11 3HE MET 1 HE3 MET 1 241.041 -22.511 -7.344 12 H GLY 2 HN GLY 2 244.054 -20.664 -0.611 13 1HA GLY 2 HA2 GLY 2 241.481 -20.016 0.587 14 2HA GLY 2 HA1 GLY 2 242.311 -21.412 1.257 15 H ALA 3 HN ALA 3 244.730 -20.914 1.751 16 HA ALA 3 HA ALA 3 244.804 -19.025 3.813 17 1HB ALA 3 HB1 ALA 3 246.301 -21.061 3.455 18 2HB ALA 3 HB2 ALA 3 247.058 -19.606 4.103 19 3HB ALA 3 HB3 ALA 3 247.260 -20.023 2.400 20 H SER 4 HN SER 4 247.173 -17.631 3.563 21 HA SER 4 HA SER 4 247.944 -15.594 2.901 22 1HB SER 4 HB2 SER 4 248.386 -15.305 0.587 23 2HB SER 4 HB1 SER 4 248.468 -17.042 0.876 24 HG SER 4 HG SER 4 246.966 -17.238 -0.564 25 H ARG 5 HN ARG 5 246.400 -14.443 4.062 26 HA ARG 5 HA ARG 5 243.865 -13.739 3.081 27 1HB ARG 5 HB2 ARG 5 245.671 -12.739 5.223 28 2HB ARG 5 HB1 ARG 5 244.375 -11.672 4.700 29 1HG ARG 5 HG2 ARG 5 243.439 -12.823 6.476 30 2HG ARG 5 HG1 ARG 5 242.840 -13.700 5.067 31 1HD ARG 5 HD2 ARG 5 243.573 -15.508 6.189 32 2HD ARG 5 HD1 ARG 5 245.141 -15.034 5.537 33 HE ARG 5 HE ARG 5 245.815 -14.540 7.659 34 1HH1 ARG 5 HH11 ARG 5 242.326 -14.603 7.600 35 2HH1 ARG 5 HH12 ARG 5 242.169 -14.406 9.313 36 1HH2 ARG 5 HH21 ARG 5 245.610 -14.281 9.913 37 2HH2 ARG 5 HH22 ARG 5 244.033 -14.222 10.627 38 H LEU 6 HN LEU 6 243.891 -13.015 1.011 39 HA LEU 6 HA LEU 6 245.683 -10.877 0.220 40 1HB LEU 6 HB2 LEU 6 244.769 -12.902 -1.202 41 2HB LEU 6 HB1 LEU 6 243.426 -11.815 -1.497 42 HG LEU 6 HG LEU 6 246.217 -10.857 -1.994 43 1HD1 LEU 6 HD11 LEU 6 246.289 -12.880 -3.193 44 2HD1 LEU 6 HD12 LEU 6 245.872 -11.643 -4.378 45 3HD1 LEU 6 HD13 LEU 6 244.621 -12.709 -3.739 46 1HD2 LEU 6 HD21 LEU 6 243.845 -10.276 -3.697 47 2HD2 LEU 6 HD22 LEU 6 245.224 -9.252 -3.292 48 3HD2 LEU 6 HD23 LEU 6 243.946 -9.521 -2.107 49 H TYR 7 HN TYR 7 245.253 -8.831 0.509 50 HA TYR 7 HA TYR 7 242.451 -7.935 0.584 51 1HB TYR 7 HB2 TYR 7 244.776 -7.196 2.334 52 2HB TYR 7 HB1 TYR 7 243.443 -6.069 2.102 53 HD1 TYR 7 HD1 TYR 7 241.896 -6.071 3.801 54 HD2 TYR 7 HD2 TYR 7 243.807 -9.733 2.785 55 HE1 TYR 7 HE1 TYR 7 240.615 -7.220 5.558 56 HE2 TYR 7 HE2 TYR 7 242.530 -10.893 4.538 57 HH TYR 7 HH TYR 7 240.325 -10.528 5.757 58 H THR 8 HN THR 8 242.556 -5.343 0.452 59 HA THR 8 HA THR 8 244.292 -4.650 -1.832 60 HB THR 8 HB THR 8 242.484 -3.557 -2.927 61 HG1 THR 8 HG1 THR 8 240.794 -4.213 -0.758 62 1HG2 THR 8 HG21 THR 8 241.933 -6.311 -2.012 63 2HG2 THR 8 HG22 THR 8 242.130 -5.669 -3.641 64 3HG2 THR 8 HG23 THR 8 240.613 -5.428 -2.778 65 H LEU 9 HN LEU 9 244.329 -2.249 -2.210 66 HA LEU 9 HA LEU 9 243.816 -0.560 0.075 67 1HB LEU 9 HB2 LEU 9 246.063 -1.739 0.447 68 2HB LEU 9 HB1 LEU 9 246.657 -0.785 -0.898 69 HG LEU 9 HG LEU 9 245.599 0.280 1.710 70 1HD1 LEU 9 HD11 LEU 9 247.846 0.974 2.144 71 2HD1 LEU 9 HD12 LEU 9 248.370 0.428 0.551 72 3HD1 LEU 9 HD13 LEU 9 247.859 -0.748 1.763 73 1HD2 LEU 9 HD21 LEU 9 246.399 1.648 -0.825 74 2HD2 LEU 9 HD22 LEU 9 246.533 2.458 0.737 75 3HD2 LEU 9 HD23 LEU 9 244.962 1.895 0.167 76 H VAL 10 HN VAL 10 242.799 1.049 -1.001 77 HA VAL 10 HA VAL 10 243.953 1.961 -3.528 78 HB VAL 10 HB VAL 10 241.738 1.419 -3.947 79 1HG1 VAL 10 HG11 VAL 10 239.909 2.419 -2.391 80 2HG1 VAL 10 HG12 VAL 10 241.222 2.394 -1.217 81 3HG1 VAL 10 HG13 VAL 10 240.716 0.902 -2.010 82 1HG2 VAL 10 HG21 VAL 10 240.580 3.481 -4.415 83 2HG2 VAL 10 HG22 VAL 10 242.300 3.693 -4.727 84 3HG2 VAL 10 HG23 VAL 10 241.584 4.341 -3.251 85 H LEU 11 HN LEU 11 245.009 3.734 -3.606 86 HA LEU 11 HA LEU 11 244.462 5.866 -1.656 87 1HB LEU 11 HB2 LEU 11 246.867 4.359 -2.122 88 2HB LEU 11 HB1 LEU 11 247.148 6.041 -2.525 89 HG LEU 11 HG LEU 11 246.369 4.873 0.144 90 1HD1 LEU 11 HD11 LEU 11 248.798 5.912 -1.034 91 2HD1 LEU 11 HD12 LEU 11 248.569 5.005 0.458 92 3HD1 LEU 11 HD13 LEU 11 248.386 6.760 0.458 93 1HD2 LEU 11 HD21 LEU 11 245.072 6.663 0.457 94 2HD2 LEU 11 HD22 LEU 11 245.742 7.516 -0.933 95 3HD2 LEU 11 HD23 LEU 11 246.590 7.546 0.612 96 H VAL 12 HN VAL 12 243.589 7.498 -2.782 97 HA VAL 12 HA VAL 12 244.096 7.771 -5.607 98 HB VAL 12 HB VAL 12 242.524 9.689 -3.898 99 1HG1 VAL 12 HG11 VAL 12 241.251 9.544 -6.265 100 2HG1 VAL 12 HG12 VAL 12 242.906 9.217 -6.783 101 3HG1 VAL 12 HG13 VAL 12 242.532 10.706 -5.914 102 1HG2 VAL 12 HG21 VAL 12 241.287 7.876 -3.356 103 2HG2 VAL 12 HG22 VAL 12 241.903 6.921 -4.705 104 3HG2 VAL 12 HG23 VAL 12 240.626 8.107 -4.973 105 H LEU 13 HN LEU 13 246.154 8.427 -5.955 106 HA LEU 13 HA LEU 13 246.959 11.003 -4.775 107 1HB LEU 13 HB2 LEU 13 248.307 8.889 -4.283 108 2HB LEU 13 HB1 LEU 13 248.845 9.003 -5.947 109 HG LEU 13 HG LEU 13 250.497 10.284 -5.214 110 1HD1 LEU 13 HD11 LEU 13 250.001 12.638 -4.575 111 2HD1 LEU 13 HD12 LEU 13 248.290 12.231 -4.631 112 3HD1 LEU 13 HD13 LEU 13 249.272 12.113 -6.090 113 1HD2 LEU 13 HD21 LEU 13 250.031 11.373 -2.752 114 2HD2 LEU 13 HD22 LEU 13 250.803 9.816 -3.058 115 3HD2 LEU 13 HD23 LEU 13 249.077 9.892 -2.711 116 H GLN 14 HN GLN 14 246.871 12.630 -6.121 117 HA GLN 14 HA GLN 14 247.201 12.146 -9.003 118 1HB GLN 14 HB2 GLN 14 245.562 14.064 -7.417 119 2HB GLN 14 HB1 GLN 14 246.189 14.617 -8.963 120 1HG GLN 14 HG2 GLN 14 245.166 12.526 -9.963 121 2HG GLN 14 HG1 GLN 14 244.325 12.330 -8.426 122 1HE2 GLN 14 HE21 GLN 14 245.045 15.057 -10.585 123 2HE2 GLN 14 HE22 GLN 14 243.420 15.639 -10.671 124 HA PRO 15 HA PRO 15 250.959 14.440 -9.100 125 1HB PRO 15 HB2 PRO 15 250.678 15.967 -11.349 126 2HB PRO 15 HB1 PRO 15 251.053 14.240 -11.371 127 1HG PRO 15 HG2 PRO 15 248.421 15.614 -11.745 128 2HG PRO 15 HG1 PRO 15 249.109 14.246 -12.642 129 1HD PRO 15 HD2 PRO 15 247.247 13.901 -10.729 130 2HD PRO 15 HD1 PRO 15 248.549 12.722 -10.993 131 H GLN 16 HN GLN 16 248.650 15.670 -7.616 132 HA GLN 16 HA GLN 16 249.828 18.241 -7.220 133 1HB GLN 16 HB2 GLN 16 247.336 17.951 -8.780 134 2HB GLN 16 HB1 GLN 16 247.287 19.160 -7.505 135 1HG GLN 16 HG2 GLN 16 249.224 19.030 -9.802 136 2HG GLN 16 HG1 GLN 16 247.930 20.201 -9.563 137 1HE2 GLN 16 HE21 GLN 16 250.713 20.747 -9.941 138 2HE2 GLN 16 HE22 GLN 16 251.269 21.565 -8.526 139 H ARG 17 HN ARG 17 247.111 16.071 -6.578 140 HA ARG 17 HA ARG 17 247.357 16.725 -3.734 141 1HB ARG 17 HB2 ARG 17 244.820 16.570 -3.590 142 2HB ARG 17 HB1 ARG 17 245.478 18.029 -4.318 143 1HG ARG 17 HG2 ARG 17 244.074 17.666 -5.999 144 2HG ARG 17 HG1 ARG 17 245.137 16.339 -6.471 145 1HD ARG 17 HD2 ARG 17 243.805 14.742 -5.366 146 2HD ARG 17 HD1 ARG 17 242.922 15.980 -4.473 147 HE ARG 17 HE ARG 17 242.297 14.980 -7.050 148 1HH1 ARG 17 HH11 ARG 17 242.278 17.913 -5.158 149 2HH1 ARG 17 HH12 ARG 17 240.982 18.630 -6.055 150 1HH2 ARG 17 HH21 ARG 17 240.591 15.922 -8.229 151 2HH2 ARG 17 HH22 ARG 17 240.024 17.500 -7.797 152 H VAL 18 HN VAL 18 246.353 15.091 -2.317 153 HA VAL 18 HA VAL 18 246.104 12.438 -3.571 154 HB VAL 18 HB VAL 18 248.332 12.422 -2.744 155 1HG1 VAL 18 HG11 VAL 18 249.075 13.268 -0.710 156 2HG1 VAL 18 HG12 VAL 18 247.463 13.238 0.002 157 3HG1 VAL 18 HG13 VAL 18 247.865 14.445 -1.218 158 1HG2 VAL 18 HG21 VAL 18 246.972 10.427 -2.214 159 2HG2 VAL 18 HG22 VAL 18 246.631 11.112 -0.624 160 3HG2 VAL 18 HG23 VAL 18 248.285 10.686 -1.065 161 H LEU 19 HN LEU 19 244.972 10.870 -2.208 162 HA LEU 19 HA LEU 19 243.187 12.172 -0.258 163 1HB LEU 19 HB2 LEU 19 242.170 11.461 -2.484 164 2HB LEU 19 HB1 LEU 19 242.428 9.810 -1.951 165 HG LEU 19 HG LEU 19 241.052 10.432 0.114 166 1HD1 LEU 19 HD11 LEU 19 239.725 12.508 -1.509 167 2HD1 LEU 19 HD12 LEU 19 241.258 12.956 -0.761 168 3HD1 LEU 19 HD13 LEU 19 239.924 12.384 0.239 169 1HD2 LEU 19 HD21 LEU 19 238.966 9.990 -1.038 170 2HD2 LEU 19 HD22 LEU 19 240.259 8.994 -1.705 171 3HD2 LEU 19 HD23 LEU 19 239.704 10.422 -2.580 172 H LEU 20 HN LEU 20 243.131 11.323 1.716 173 HA LEU 20 HA LEU 20 244.109 8.576 2.093 174 1HB LEU 20 HB2 LEU 20 244.960 11.087 3.453 175 2HB LEU 20 HB1 LEU 20 244.895 9.613 4.399 176 HG LEU 20 HG LEU 20 246.463 9.856 1.837 177 1HD1 LEU 20 HD11 LEU 20 248.447 10.001 3.340 178 2HD1 LEU 20 HD12 LEU 20 247.341 10.269 4.688 179 3HD1 LEU 20 HD13 LEU 20 247.414 11.431 3.362 180 1HD2 LEU 20 HD21 LEU 20 245.709 7.590 2.753 181 2HD2 LEU 20 HD22 LEU 20 246.843 7.888 4.070 182 3HD2 LEU 20 HD23 LEU 20 247.425 7.802 2.408 183 H GLY 21 HN GLY 21 242.720 7.320 3.131 184 1HA GLY 21 HA2 GLY 21 240.225 8.298 4.057 185 2HA GLY 21 HA1 GLY 21 240.829 6.660 4.255 186 H MET 22 HN MET 22 239.842 9.343 5.877 187 HA MET 22 HA MET 22 241.595 8.909 8.177 188 1HB MET 22 HB2 MET 22 241.333 11.227 7.547 189 2HB MET 22 HB1 MET 22 239.582 11.080 7.570 190 1HG MET 22 HG2 MET 22 239.490 11.013 9.888 191 2HG MET 22 HG1 MET 22 241.187 10.562 10.038 192 1HE MET 22 HE1 MET 22 243.063 13.452 8.843 193 2HE MET 22 HE2 MET 22 243.005 11.793 9.435 194 3HE MET 22 HE3 MET 22 243.125 13.133 10.574 195 H LYS 23 HN LYS 23 240.811 8.226 10.179 196 HA LYS 23 HA LYS 23 238.251 6.858 10.072 197 1HB LYS 23 HB2 LYS 23 240.687 6.719 11.755 198 2HB LYS 23 HB1 LYS 23 239.170 6.308 12.541 199 1HG LYS 23 HG2 LYS 23 239.607 5.048 9.922 200 2HG LYS 23 HG1 LYS 23 240.722 4.554 11.198 201 1HD LYS 23 HD2 LYS 23 237.729 4.573 11.531 202 2HD LYS 23 HD1 LYS 23 238.633 3.163 10.978 203 1HE LYS 23 HE2 LYS 23 239.359 4.574 13.521 204 2HE LYS 23 HE1 LYS 23 238.074 3.367 13.485 205 1HZ LYS 23 HZ1 LYS 23 239.601 1.718 12.762 206 2HZ LYS 23 HZ2 LYS 23 240.304 2.490 14.092 207 3HZ LYS 23 HZ3 LYS 23 240.834 2.852 12.528 208 H LYS 24 HN LYS 24 236.545 7.259 11.511 209 HA LYS 24 HA LYS 24 236.508 9.995 12.482 210 1HB LYS 24 HB2 LYS 24 234.560 8.195 11.423 211 2HB LYS 24 HB1 LYS 24 234.045 8.673 13.036 212 1HG LYS 24 HG2 LYS 24 233.092 10.342 11.833 213 2HG LYS 24 HG1 LYS 24 234.669 11.077 12.129 214 1HD LYS 24 HD2 LYS 24 235.433 10.203 9.939 215 2HD LYS 24 HD1 LYS 24 233.801 9.603 9.646 216 1HE LYS 24 HE2 LYS 24 234.674 12.466 9.973 217 2HE LYS 24 HE1 LYS 24 234.029 11.701 8.522 218 1HZ LYS 24 HZ1 LYS 24 232.616 12.509 10.974 219 2HZ LYS 24 HZ2 LYS 24 231.987 11.264 10.016 220 3HZ LYS 24 HZ3 LYS 24 232.210 12.807 9.358 221 H ARG 25 HN ARG 25 236.446 6.724 13.717 222 HA ARG 25 HA ARG 25 237.165 7.673 16.312 223 1HB ARG 25 HB2 ARG 25 235.176 6.290 17.340 224 2HB ARG 25 HB1 ARG 25 234.961 7.973 16.885 225 1HG ARG 25 HG2 ARG 25 233.105 6.475 16.195 226 2HG ARG 25 HG1 ARG 25 233.850 7.362 14.864 227 1HD ARG 25 HD2 ARG 25 234.828 5.482 13.978 228 2HD ARG 25 HD1 ARG 25 234.871 4.645 15.530 229 HE ARG 25 HE ARG 25 232.745 4.611 13.604 230 1HH1 ARG 25 HH11 ARG 25 233.525 4.251 16.986 231 2HH1 ARG 25 HH12 ARG 25 232.140 3.270 17.329 232 1HH2 ARG 25 HH21 ARG 25 230.923 3.321 14.053 233 2HH2 ARG 25 HH22 ARG 25 230.663 2.741 15.664 234 H GLY 26 HN GLY 26 236.988 5.633 17.916 235 1HA GLY 26 HA2 GLY 26 237.411 3.337 18.233 236 2HA GLY 26 HA1 GLY 26 237.696 3.173 16.506 237 H PHE 27 HN PHE 27 239.687 2.273 16.459 238 HA PHE 27 HA PHE 27 241.819 3.522 18.036 239 1HB PHE 27 HB2 PHE 27 241.545 0.852 16.680 240 2HB PHE 27 HB1 PHE 27 243.126 1.468 17.151 241 HD1 PHE 27 HD1 PHE 27 240.927 -0.828 18.112 242 HD2 PHE 27 HD2 PHE 27 242.732 2.682 19.705 243 HE1 PHE 27 HE1 PHE 27 240.574 -1.686 20.390 244 HE2 PHE 27 HE2 PHE 27 242.383 1.830 21.986 245 HZ PHE 27 HZ PHE 27 241.303 -0.357 22.332 246 H GLY 28 HN GLY 28 240.598 4.608 15.515 247 1HA GLY 28 HA2 GLY 28 243.143 4.991 14.098 248 2HA GLY 28 HA1 GLY 28 241.722 4.523 13.182 249 H ALA 29 HN ALA 29 240.096 6.279 15.127 250 HA ALA 29 HA ALA 29 239.485 8.408 13.648 251 1HB ALA 29 HB1 ALA 29 239.083 7.707 16.287 252 2HB ALA 29 HB2 ALA 29 238.300 9.011 15.395 253 3HB ALA 29 HB3 ALA 29 239.743 9.341 16.350 254 H GLY 30 HN GLY 30 240.481 10.143 12.800 255 1HA GLY 30 HA2 GLY 30 241.834 12.072 12.870 256 2HA GLY 30 HA1 GLY 30 242.680 11.400 14.255 257 H ARG 31 HN ARG 31 242.999 8.793 12.804 258 HA ARG 31 HA ARG 31 245.491 9.461 11.523 259 1HB ARG 31 HB2 ARG 31 244.121 6.778 11.792 260 2HB ARG 31 HB1 ARG 31 245.790 7.044 11.307 261 1HG ARG 31 HG2 ARG 31 245.752 8.337 13.679 262 2HG ARG 31 HG1 ARG 31 244.569 7.062 13.977 263 1HD ARG 31 HD2 ARG 31 247.368 6.633 12.937 264 2HD ARG 31 HD1 ARG 31 246.860 6.406 14.611 265 HE ARG 31 HE ARG 31 245.229 4.866 12.903 266 1HH1 ARG 31 HH11 ARG 31 248.477 4.970 14.178 267 2HH1 ARG 31 HH12 ARG 31 248.705 3.256 14.077 268 1HH2 ARG 31 HH21 ARG 31 245.527 2.612 12.769 269 2HH2 ARG 31 HH22 ARG 31 247.031 1.918 13.277 270 H TRP 32 HN TRP 32 246.050 9.027 9.363 271 HA TRP 32 HA TRP 32 243.749 8.889 7.531 272 1HB TRP 32 HB2 TRP 32 246.349 9.865 6.491 273 2HB TRP 32 HB1 TRP 32 244.719 10.421 6.143 274 HD1 TRP 32 HD1 TRP 32 246.956 10.568 9.344 275 HE1 TRP 32 HE1 TRP 32 246.820 12.958 10.276 276 HE3 TRP 32 HE3 TRP 32 243.846 12.638 5.847 277 HZ2 TRP 32 HZ2 TRP 32 245.582 15.399 9.619 278 HZ3 TRP 32 HZ3 TRP 32 243.245 15.015 6.075 279 HH2 TRP 32 HH2 TRP 32 244.095 16.363 7.920 280 H ASN 33 HN ASN 33 243.999 7.630 5.580 281 HA ASN 33 HA ASN 33 246.215 6.162 4.833 282 1HB ASN 33 HB2 ASN 33 245.503 3.865 5.729 283 2HB ASN 33 HB1 ASN 33 246.301 4.960 6.856 284 1HD2 ASN 33 HD21 ASN 33 245.445 4.298 8.734 285 2HD2 ASN 33 HD22 ASN 33 243.760 4.333 9.112 286 H GLY 34 HN GLY 34 245.847 4.750 3.123 287 1HA GLY 34 HA2 GLY 34 243.708 5.296 1.454 288 2HA GLY 34 HA1 GLY 34 244.732 3.874 1.323 289 H PHE 35 HN PHE 35 242.344 3.384 0.498 290 HA PHE 35 HA PHE 35 240.816 2.273 2.750 291 1HB PHE 35 HB2 PHE 35 239.686 2.364 -0.010 292 2HB PHE 35 HB1 PHE 35 238.872 2.531 1.538 293 HD1 PHE 35 HD1 PHE 35 238.972 4.682 2.760 294 HD2 PHE 35 HD2 PHE 35 240.501 4.252 -1.188 295 HE1 PHE 35 HE1 PHE 35 238.956 7.128 2.492 296 HE2 PHE 35 HE2 PHE 35 240.488 6.697 -1.463 297 HZ PHE 35 HZ PHE 35 239.715 8.138 0.378 298 H GLY 36 HN GLY 36 241.151 0.176 3.119 299 1HA GLY 36 HA2 GLY 36 241.971 -1.503 0.842 300 2HA GLY 36 HA1 GLY 36 242.361 -1.832 2.522 301 H GLY 37 HN GLY 37 241.391 -3.864 1.105 302 1HA GLY 37 HA2 GLY 37 239.048 -4.596 2.535 303 2HA GLY 37 HA1 GLY 37 238.652 -4.217 0.865 304 H LYS 38 HN LYS 38 238.573 -6.779 2.376 305 HA LYS 38 HA LYS 38 240.670 -8.401 1.252 306 1HB LYS 38 HB2 LYS 38 239.561 -10.263 2.336 307 2HB LYS 38 HB1 LYS 38 239.666 -8.908 3.451 308 1HG LYS 38 HG2 LYS 38 237.283 -8.347 2.683 309 2HG LYS 38 HG1 LYS 38 237.263 -9.986 2.030 310 1HD LYS 38 HD2 LYS 38 238.226 -10.435 4.525 311 2HD LYS 38 HD1 LYS 38 237.164 -9.056 4.818 312 1HE LYS 38 HE2 LYS 38 235.482 -10.454 3.365 313 2HE LYS 38 HE1 LYS 38 236.501 -11.804 3.865 314 1HZ LYS 38 HZ1 LYS 38 234.762 -10.088 5.486 315 2HZ LYS 38 HZ2 LYS 38 236.145 -10.740 6.208 316 3HZ LYS 38 HZ3 LYS 38 234.977 -11.765 5.543 317 H VAL 39 HN VAL 39 240.500 -9.927 -0.377 318 HA VAL 39 HA VAL 39 238.599 -9.335 -2.441 319 HB VAL 39 HB VAL 39 240.482 -11.696 -2.399 320 1HG1 VAL 39 HG11 VAL 39 239.361 -10.047 -4.661 321 2HG1 VAL 39 HG12 VAL 39 238.803 -11.651 -4.188 322 3HG1 VAL 39 HG13 VAL 39 240.434 -11.435 -4.820 323 1HG2 VAL 39 HG21 VAL 39 241.044 -8.806 -2.756 324 2HG2 VAL 39 HG22 VAL 39 241.884 -9.954 -3.799 325 3HG2 VAL 39 HG23 VAL 39 242.040 -10.076 -2.046 326 H GLN 40 HN GLN 40 236.584 -10.057 -2.408 327 HA GLN 40 HA GLN 40 235.436 -11.876 -0.735 328 1HB GLN 40 HB2 GLN 40 234.731 -10.864 -3.444 329 2HB GLN 40 HB1 GLN 40 233.822 -12.236 -2.823 330 1HG GLN 40 HG2 GLN 40 233.785 -10.539 -0.694 331 2HG GLN 40 HG1 GLN 40 233.743 -9.418 -2.053 332 1HE2 GLN 40 HE21 GLN 40 232.278 -10.704 -3.898 333 2HE2 GLN 40 HE22 GLN 40 230.676 -10.991 -3.320 334 H GLU 41 HN GLU 41 234.342 -13.990 -1.436 335 HA GLU 41 HA GLU 41 236.383 -15.882 -1.972 336 1HB GLU 41 HB2 GLU 41 234.420 -16.331 -0.525 337 2HB GLU 41 HB1 GLU 41 233.388 -16.293 -1.946 338 1HG GLU 41 HG2 GLU 41 235.107 -18.137 -2.770 339 2HG GLU 41 HG1 GLU 41 235.290 -18.367 -1.032 340 H GLY 42 HN GLY 42 236.916 -14.674 -4.090 341 1HA GLY 42 HA2 GLY 42 237.162 -15.791 -6.284 342 2HA GLY 42 HA1 GLY 42 235.418 -15.984 -6.276 343 H GLU 43 HN GLU 43 237.385 -13.121 -5.459 344 HA GLU 43 HA GLU 43 236.220 -11.785 -7.783 345 1HB GLU 43 HB2 GLU 43 235.504 -9.959 -6.606 346 2HB GLU 43 HB1 GLU 43 235.285 -11.182 -5.368 347 1HG GLU 43 HG2 GLU 43 237.246 -10.507 -4.231 348 2HG GLU 43 HG1 GLU 43 237.762 -9.494 -5.577 349 H THR 44 HN THR 44 237.513 -9.650 -8.140 350 HA THR 44 HA THR 44 240.313 -10.471 -8.129 351 HB THR 44 HB THR 44 240.577 -8.832 -9.915 352 HG1 THR 44 HG1 THR 44 239.145 -7.343 -10.221 353 1HG2 THR 44 HG21 THR 44 238.095 -10.172 -10.759 354 2HG2 THR 44 HG22 THR 44 239.374 -11.214 -10.137 355 3HG2 THR 44 HG23 THR 44 239.689 -10.157 -11.513 356 H ILE 45 HN ILE 45 241.939 -9.232 -7.320 357 HA ILE 45 HA ILE 45 241.506 -7.762 -5.044 358 HB ILE 45 HB ILE 45 243.842 -7.216 -6.861 359 1HG1 ILE 45 HG12 ILE 45 244.713 -9.161 -5.163 360 2HG1 ILE 45 HG11 ILE 45 243.067 -9.697 -5.487 361 1HG2 ILE 45 HG21 ILE 45 245.008 -7.001 -4.668 362 2HG2 ILE 45 HG22 ILE 45 243.430 -7.134 -3.890 363 3HG2 ILE 45 HG23 ILE 45 243.770 -5.782 -4.971 364 1HD1 ILE 45 HD11 ILE 45 244.031 -9.050 -7.981 365 2HD1 ILE 45 HD12 ILE 45 243.910 -10.670 -7.296 366 3HD1 ILE 45 HD13 ILE 45 245.423 -9.772 -7.173 367 H GLU 46 HN GLU 46 241.543 -6.665 -8.376 368 HA GLU 46 HA GLU 46 241.514 -3.862 -7.740 369 1HB GLU 46 HB2 GLU 46 242.334 -4.757 -9.917 370 2HB GLU 46 HB1 GLU 46 240.692 -5.256 -10.300 371 1HG GLU 46 HG2 GLU 46 239.970 -2.915 -10.195 372 2HG GLU 46 HG1 GLU 46 241.630 -2.431 -9.855 373 H ASP 47 HN ASP 47 239.198 -6.412 -8.127 374 HA ASP 47 HA ASP 47 236.917 -4.670 -8.313 375 1HB ASP 47 HB2 ASP 47 237.331 -7.626 -8.098 376 2HB ASP 47 HB1 ASP 47 235.750 -6.964 -7.699 377 H GLY 48 HN GLY 48 238.689 -6.402 -5.850 378 1HA GLY 48 HA2 GLY 48 236.759 -5.908 -3.764 379 2HA GLY 48 HA1 GLY 48 238.394 -6.522 -3.551 380 H ALA 49 HN ALA 49 239.664 -4.337 -4.950 381 HA ALA 49 HA ALA 49 239.875 -2.490 -2.771 382 1HB ALA 49 HB1 ALA 49 241.607 -3.315 -4.676 383 2HB ALA 49 HB2 ALA 49 241.809 -1.845 -3.726 384 3HB ALA 49 HB3 ALA 49 241.109 -1.761 -5.342 385 H ARG 50 HN ARG 50 238.293 -2.559 -5.899 386 HA ARG 50 HA ARG 50 237.652 0.249 -5.773 387 1HB ARG 50 HB2 ARG 50 236.456 -0.107 -7.873 388 2HB ARG 50 HB1 ARG 50 238.079 -0.774 -7.948 389 1HG ARG 50 HG2 ARG 50 237.036 -2.542 -8.836 390 2HG ARG 50 HG1 ARG 50 236.706 -2.951 -7.154 391 1HD ARG 50 HD2 ARG 50 234.557 -1.700 -7.347 392 2HD ARG 50 HD1 ARG 50 234.889 -1.492 -9.066 393 HE ARG 50 HE ARG 50 234.957 -4.232 -8.198 394 1HH1 ARG 50 HH11 ARG 50 232.913 -1.640 -9.329 395 2HH1 ARG 50 HH12 ARG 50 231.690 -2.703 -9.939 396 1HH2 ARG 50 HH21 ARG 50 233.350 -5.632 -9.000 397 2HH2 ARG 50 HH22 ARG 50 231.938 -4.969 -9.753 398 H ARG 51 HN ARG 51 235.848 -2.812 -5.526 399 HA ARG 51 HA ARG 51 233.324 -1.653 -5.080 400 1HB ARG 51 HB2 ARG 51 234.490 -4.341 -4.389 401 2HB ARG 51 HB1 ARG 51 232.841 -3.913 -3.954 402 1HG ARG 51 HG2 ARG 51 233.011 -3.247 -6.632 403 2HG ARG 51 HG1 ARG 51 233.933 -4.746 -6.503 404 1HD ARG 51 HD2 ARG 51 231.359 -4.681 -5.063 405 2HD ARG 51 HD1 ARG 51 231.258 -4.651 -6.823 406 HE ARG 51 HE ARG 51 233.037 -6.674 -6.106 407 1HH1 ARG 51 HH11 ARG 51 229.642 -5.933 -5.786 408 2HH1 ARG 51 HH12 ARG 51 229.153 -7.595 -5.760 409 1HH2 ARG 51 HH21 ARG 51 232.397 -8.859 -6.071 410 2HH2 ARG 51 HH22 ARG 51 230.718 -9.256 -5.921 411 H GLU 52 HN GLU 52 235.974 -2.439 -2.935 412 HA GLU 52 HA GLU 52 234.462 -1.803 -0.549 413 1HB GLU 52 HB2 GLU 52 237.400 -2.422 -0.931 414 2HB GLU 52 HB1 GLU 52 236.609 -2.207 0.625 415 1HG GLU 52 HG2 GLU 52 235.668 -4.279 -1.320 416 2HG GLU 52 HG1 GLU 52 237.015 -4.588 -0.224 417 H LEU 53 HN LEU 53 236.386 -0.194 -2.866 418 HA LEU 53 HA LEU 53 237.390 1.913 -1.274 419 1HB LEU 53 HB2 LEU 53 238.452 1.593 -3.336 420 2HB LEU 53 HB1 LEU 53 236.935 1.518 -4.212 421 HG LEU 53 HG LEU 53 236.607 3.922 -3.825 422 1HD1 LEU 53 HD11 LEU 53 239.399 4.266 -2.937 423 2HD1 LEU 53 HD12 LEU 53 238.258 3.649 -1.742 424 3HD1 LEU 53 HD13 LEU 53 237.955 5.195 -2.536 425 1HD2 LEU 53 HD21 LEU 53 238.836 4.580 -5.118 426 2HD2 LEU 53 HD22 LEU 53 237.529 3.683 -5.890 427 3HD2 LEU 53 HD23 LEU 53 238.945 2.827 -5.282 428 H GLN 54 HN GLN 54 234.556 1.608 -3.375 429 HA GLN 54 HA GLN 54 233.571 4.224 -2.938 430 1HB GLN 54 HB2 GLN 54 232.580 3.302 -4.773 431 2HB GLN 54 HB1 GLN 54 232.504 1.696 -4.067 432 1HG GLN 54 HG2 GLN 54 230.611 2.410 -2.678 433 2HG GLN 54 HG1 GLN 54 230.681 4.006 -3.424 434 1HE2 GLN 54 HE21 GLN 54 229.250 4.300 -4.960 435 2HE2 GLN 54 HE22 GLN 54 228.604 3.088 -6.007 436 H GLU 55 HN GLU 55 233.431 1.316 -1.097 437 HA GLU 55 HA GLU 55 231.219 2.137 0.557 438 1HB GLU 55 HB2 GLU 55 233.115 -0.199 0.639 439 2HB GLU 55 HB1 GLU 55 231.921 0.083 1.899 440 1HG GLU 55 HG2 GLU 55 230.828 0.156 -0.810 441 2HG GLU 55 HG1 GLU 55 231.526 -1.397 -0.351 442 H GLU 56 HN GLU 56 234.656 2.547 0.625 443 HA GLU 56 HA GLU 56 234.781 2.913 3.469 444 1HB GLU 56 HB2 GLU 56 236.697 2.958 1.225 445 2HB GLU 56 HB1 GLU 56 237.119 3.945 2.619 446 1HG GLU 56 HG2 GLU 56 236.201 1.297 3.371 447 2HG GLU 56 HG1 GLU 56 237.608 1.252 2.312 448 H SER 57 HN SER 57 234.848 5.123 0.668 449 HA SER 57 HA SER 57 234.201 7.284 2.555 450 1HB SER 57 HB2 SER 57 236.308 7.345 0.397 451 2HB SER 57 HB1 SER 57 235.670 8.801 1.158 452 HG SER 57 HG SER 57 236.289 7.647 3.203 453 H GLY 58 HN GLY 58 233.102 5.608 -0.017 454 1HA GLY 58 HA2 GLY 58 231.159 6.099 -1.231 455 2HA GLY 58 HA1 GLY 58 231.340 7.790 -0.791 456 H LEU 59 HN LEU 59 234.241 7.595 -1.670 457 HA LEU 59 HA LEU 59 233.901 8.598 -4.289 458 1HB LEU 59 HB2 LEU 59 236.380 7.621 -2.871 459 2HB LEU 59 HB1 LEU 59 236.376 8.497 -4.389 460 HG LEU 59 HG LEU 59 235.818 9.499 -1.628 461 1HD1 LEU 59 HD11 LEU 59 237.985 9.642 -3.176 462 2HD1 LEU 59 HD12 LEU 59 237.534 10.917 -2.044 463 3HD1 LEU 59 HD13 LEU 59 237.136 11.075 -3.755 464 1HD2 LEU 59 HD21 LEU 59 233.822 10.102 -2.930 465 2HD2 LEU 59 HD22 LEU 59 234.856 10.850 -4.147 466 3HD2 LEU 59 HD23 LEU 59 234.796 11.513 -2.514 467 H THR 60 HN THR 60 233.308 7.416 -5.952 468 HA THR 60 HA THR 60 234.182 4.617 -6.083 469 HB THR 60 HB THR 60 232.289 5.575 -8.120 470 HG1 THR 60 HG1 THR 60 231.489 6.782 -6.422 471 1HG2 THR 60 HG21 THR 60 232.894 3.159 -6.719 472 2HG2 THR 60 HG22 THR 60 231.893 3.402 -8.151 473 3HG2 THR 60 HG23 THR 60 231.182 3.543 -6.544 474 H VAL 61 HN VAL 61 235.478 3.872 -7.682 475 HA VAL 61 HA VAL 61 236.511 5.904 -9.536 476 HB VAL 61 HB VAL 61 238.547 4.598 -9.692 477 1HG1 VAL 61 HG11 VAL 61 239.184 4.685 -7.194 478 2HG1 VAL 61 HG12 VAL 61 237.559 5.331 -6.963 479 3HG1 VAL 61 HG13 VAL 61 238.706 6.178 -8.000 480 1HG2 VAL 61 HG21 VAL 61 238.370 2.391 -9.391 481 2HG2 VAL 61 HG22 VAL 61 236.888 2.555 -8.450 482 3HG2 VAL 61 HG23 VAL 61 238.455 2.732 -7.662 483 H ASP 62 HN ASP 62 236.571 5.585 -11.677 484 HA ASP 62 HA ASP 62 234.958 3.455 -12.760 485 1HB ASP 62 HB2 ASP 62 235.098 5.914 -13.584 486 2HB ASP 62 HB1 ASP 62 236.568 5.395 -14.403 487 H ALA 63 HN ALA 63 238.250 3.962 -12.037 488 HA ALA 63 HA ALA 63 239.070 1.405 -12.725 489 1HB ALA 63 HB1 ALA 63 239.491 3.439 -14.885 490 2HB ALA 63 HB2 ALA 63 238.862 1.797 -15.013 491 3HB ALA 63 HB3 ALA 63 240.578 2.063 -14.702 492 H LEU 64 HN LEU 64 240.250 1.486 -10.838 493 HA LEU 64 HA LEU 64 241.993 3.586 -10.080 494 1HB LEU 64 HB2 LEU 64 242.064 0.657 -9.330 495 2HB LEU 64 HB1 LEU 64 242.980 1.920 -8.535 496 HG LEU 64 HG LEU 64 240.267 2.717 -8.492 497 1HD1 LEU 64 HD11 LEU 64 239.500 0.721 -7.033 498 2HD1 LEU 64 HD12 LEU 64 240.716 -0.183 -7.935 499 3HD1 LEU 64 HD13 LEU 64 239.387 0.600 -8.789 500 1HD2 LEU 64 HD21 LEU 64 242.416 2.776 -6.838 501 2HD2 LEU 64 HD22 LEU 64 241.408 1.563 -6.049 502 3HD2 LEU 64 HD23 LEU 64 240.768 3.178 -6.354 503 H HIS 65 HN HIS 65 244.441 2.687 -9.580 504 HA HIS 65 HA HIS 65 245.495 1.558 -12.074 505 1HB HIS 65 HB2 HIS 65 245.663 4.251 -11.496 506 2HB HIS 65 HB1 HIS 65 247.211 3.634 -10.927 507 HD1 HIS 65 HD1 HIS 65 247.709 1.508 -13.120 508 HD2 HIS 65 HD2 HIS 65 246.431 5.394 -13.851 509 HE1 HIS 65 HE1 HIS 65 248.382 2.002 -15.492 510 HE2 HIS 65 HE2 HIS 65 247.673 4.387 -15.885 511 H LYS 66 HN LYS 66 246.194 -0.364 -11.269 512 HA LYS 66 HA LYS 66 247.315 -0.745 -8.708 513 1HB LYS 66 HB2 LYS 66 248.032 -2.928 -9.535 514 2HB LYS 66 HB1 LYS 66 246.390 -2.589 -10.063 515 1HG LYS 66 HG2 LYS 66 247.571 -1.707 -12.217 516 2HG LYS 66 HG1 LYS 66 248.903 -2.721 -11.655 517 1HD LYS 66 HD2 LYS 66 246.942 -4.487 -11.378 518 2HD LYS 66 HD1 LYS 66 246.202 -3.488 -12.631 519 1HE LYS 66 HE2 LYS 66 247.450 -5.340 -13.610 520 2HE LYS 66 HE1 LYS 66 248.172 -3.791 -14.042 521 1HZ LYS 66 HZ1 LYS 66 249.216 -5.077 -11.651 522 2HZ LYS 66 HZ2 LYS 66 250.030 -4.231 -12.868 523 3HZ LYS 66 HZ3 LYS 66 249.574 -5.839 -13.119 524 H VAL 67 HN VAL 67 249.338 -0.359 -7.938 525 HA VAL 67 HA VAL 67 251.413 0.202 -9.969 526 HB VAL 67 HB VAL 67 252.348 1.928 -8.420 527 1HG1 VAL 67 HG11 VAL 67 251.094 2.568 -10.387 528 2HG1 VAL 67 HG12 VAL 67 250.700 3.653 -9.053 529 3HG1 VAL 67 HG13 VAL 67 249.573 2.378 -9.514 530 1HG2 VAL 67 HG21 VAL 67 251.541 1.917 -6.335 531 2HG2 VAL 67 HG22 VAL 67 250.097 1.025 -6.805 532 3HG2 VAL 67 HG23 VAL 67 250.151 2.772 -7.002 533 H GLY 68 HN GLY 68 250.913 -0.678 -6.541 534 1HA GLY 68 HA2 GLY 68 253.373 -2.287 -6.774 535 2HA GLY 68 HA1 GLY 68 253.147 -1.219 -5.399 536 H GLN 69 HN GLN 69 253.503 -4.127 -5.520 537 HA GLN 69 HA GLN 69 250.985 -4.939 -4.220 538 1HB GLN 69 HB2 GLN 69 251.811 -6.117 -6.411 539 2HB GLN 69 HB1 GLN 69 252.935 -6.928 -5.329 540 1HG GLN 69 HG2 GLN 69 250.165 -6.946 -4.399 541 2HG GLN 69 HG1 GLN 69 250.422 -7.785 -5.929 542 1HE2 GLN 69 HE21 GLN 69 250.558 -9.873 -5.551 543 2HE2 GLN 69 HE22 GLN 69 251.466 -10.624 -4.286 544 H ILE 70 HN ILE 70 251.218 -4.996 -2.083 545 HA ILE 70 HA ILE 70 253.871 -5.584 -0.975 546 HB ILE 70 HB ILE 70 251.477 -4.392 0.425 547 1HG1 ILE 70 HG12 ILE 70 253.967 -2.896 -0.339 548 2HG1 ILE 70 HG11 ILE 70 252.638 -3.062 -1.481 549 1HG2 ILE 70 HG21 ILE 70 252.975 -5.530 1.950 550 2HG2 ILE 70 HG22 ILE 70 253.112 -3.784 2.161 551 3HG2 ILE 70 HG23 ILE 70 254.355 -4.665 1.275 552 1HD1 ILE 70 HD11 ILE 70 252.652 -1.667 1.171 553 2HD1 ILE 70 HD12 ILE 70 251.158 -2.094 0.335 554 3HD1 ILE 70 HD13 ILE 70 252.315 -0.999 -0.425 555 H VAL 71 HN VAL 71 254.139 -7.069 0.690 556 HA VAL 71 HA VAL 71 251.921 -8.965 1.074 557 HB VAL 71 HB VAL 71 254.820 -9.784 0.983 558 1HG1 VAL 71 HG11 VAL 71 252.198 -11.252 0.987 559 2HG1 VAL 71 HG12 VAL 71 253.517 -11.362 2.154 560 3HG1 VAL 71 HG13 VAL 71 253.718 -12.019 0.529 561 1HG2 VAL 71 HG21 VAL 71 254.647 -9.227 -1.216 562 2HG2 VAL 71 HG22 VAL 71 252.889 -9.358 -1.225 563 3HG2 VAL 71 HG23 VAL 71 253.882 -10.814 -1.291 564 H PHE 72 HN PHE 72 251.801 -9.988 3.089 565 HA PHE 72 HA PHE 72 253.484 -8.816 5.204 566 1HB PHE 72 HB2 PHE 72 251.331 -7.743 5.317 567 2HB PHE 72 HB1 PHE 72 250.498 -9.284 5.184 568 HD1 PHE 72 HD1 PHE 72 250.887 -10.974 7.103 569 HD2 PHE 72 HD2 PHE 72 251.728 -6.812 7.387 570 HE1 PHE 72 HE1 PHE 72 250.767 -11.123 9.555 571 HE2 PHE 72 HE2 PHE 72 251.604 -6.954 9.841 572 HZ PHE 72 HZ PHE 72 251.127 -9.111 10.928 573 H GLU 73 HN GLU 73 254.628 -10.346 6.176 574 HA GLU 73 HA GLU 73 253.519 -13.075 6.276 575 1HB GLU 73 HB2 GLU 73 256.154 -13.410 6.891 576 2HB GLU 73 HB1 GLU 73 255.476 -13.581 5.279 577 1HG GLU 73 HG2 GLU 73 256.516 -10.954 6.279 578 2HG GLU 73 HG1 GLU 73 257.576 -12.163 5.554 579 H PHE 74 HN PHE 74 253.081 -13.970 8.191 580 HA PHE 74 HA PHE 74 253.740 -12.414 10.583 581 1HB PHE 74 HB2 PHE 74 251.359 -13.258 9.981 582 2HB PHE 74 HB1 PHE 74 251.939 -14.821 10.548 583 HD1 PHE 74 HD1 PHE 74 250.969 -11.443 11.506 584 HD2 PHE 74 HD2 PHE 74 252.485 -15.170 12.893 585 HE1 PHE 74 HE1 PHE 74 250.463 -10.783 13.822 586 HE2 PHE 74 HE2 PHE 74 251.980 -14.517 15.211 587 HZ PHE 74 HZ PHE 74 250.967 -12.321 15.678 588 H VAL 75 HN VAL 75 254.933 -13.131 12.214 589 HA VAL 75 HA VAL 75 256.654 -15.381 11.689 590 HB VAL 75 HB VAL 75 256.885 -14.152 14.333 591 1HG1 VAL 75 HG11 VAL 75 259.234 -13.744 13.182 592 2HG1 VAL 75 HG12 VAL 75 258.604 -14.946 12.055 593 3HG1 VAL 75 HG13 VAL 75 258.745 -15.334 13.770 594 1HG2 VAL 75 HG21 VAL 75 256.865 -12.440 11.887 595 2HG2 VAL 75 HG22 VAL 75 257.977 -12.076 13.206 596 3HG2 VAL 75 HG23 VAL 75 256.239 -12.100 13.501 597 H GLY 76 HN GLY 76 256.161 -17.381 12.257 598 1HA GLY 76 HA2 GLY 76 255.726 -19.024 13.926 599 2HA GLY 76 HA1 GLY 76 254.793 -17.829 14.816 600 H GLU 77 HN GLU 77 253.523 -17.058 12.134 601 HA GLU 77 HA GLU 77 251.540 -19.233 12.154 602 1HB GLU 77 HB2 GLU 77 251.332 -16.281 11.725 603 2HB GLU 77 HB1 GLU 77 250.146 -17.338 10.975 604 1HG GLU 77 HG2 GLU 77 250.642 -17.842 13.824 605 2HG GLU 77 HG1 GLU 77 249.911 -16.282 13.447 606 HA PRO 78 HA PRO 78 252.733 -20.209 8.001 607 1HB PRO 78 HB2 PRO 78 250.530 -21.577 7.214 608 2HB PRO 78 HB1 PRO 78 251.717 -22.245 8.342 609 1HG PRO 78 HG2 PRO 78 249.069 -20.970 8.913 610 2HG PRO 78 HG1 PRO 78 249.786 -22.426 9.626 611 1HD PRO 78 HD2 PRO 78 249.814 -20.018 10.872 612 2HD PRO 78 HD1 PRO 78 251.105 -21.219 11.078 613 H GLU 79 HN GLU 79 249.383 -19.061 8.421 614 HA GLU 79 HA GLU 79 248.956 -18.227 5.798 615 1HB GLU 79 HB2 GLU 79 247.514 -18.215 8.173 616 2HB GLU 79 HB1 GLU 79 247.645 -16.513 7.749 617 1HG GLU 79 HG2 GLU 79 246.652 -16.916 5.604 618 2HG GLU 79 HG1 GLU 79 246.655 -18.655 5.886 619 H LEU 80 HN LEU 80 248.583 -15.905 5.157 620 HA LEU 80 HA LEU 80 250.430 -13.992 6.342 621 1HB LEU 80 HB2 LEU 80 250.633 -14.232 3.395 622 2HB LEU 80 HB1 LEU 80 251.846 -13.754 4.565 623 HG LEU 80 HG LEU 80 250.972 -16.608 4.431 624 1HD1 LEU 80 HD11 LEU 80 252.939 -15.270 2.587 625 2HD1 LEU 80 HD12 LEU 80 251.453 -16.106 2.137 626 3HD1 LEU 80 HD13 LEU 80 252.806 -17.013 2.812 627 1HD2 LEU 80 HD21 LEU 80 252.927 -17.052 5.542 628 2HD2 LEU 80 HD22 LEU 80 252.564 -15.444 6.166 629 3HD2 LEU 80 HD23 LEU 80 253.752 -15.642 4.877 630 H MET 81 HN MET 81 250.347 -12.071 4.330 631 HA MET 81 HA MET 81 247.536 -11.693 3.680 632 1HB MET 81 HB2 MET 81 248.671 -10.489 5.945 633 2HB MET 81 HB1 MET 81 248.592 -9.217 4.735 634 1HG MET 81 HG2 MET 81 246.413 -8.983 5.021 635 2HG MET 81 HG1 MET 81 246.139 -10.705 4.773 636 1HE MET 81 HE1 MET 81 247.179 -11.936 8.413 637 2HE MET 81 HE2 MET 81 247.713 -12.053 6.736 638 3HE MET 81 HE3 MET 81 246.072 -12.529 7.174 639 H ASP 82 HN ASP 82 247.604 -11.341 1.554 640 HA ASP 82 HA ASP 82 249.822 -9.762 0.449 641 1HB ASP 82 HB2 ASP 82 249.438 -11.978 -0.564 642 2HB ASP 82 HB1 ASP 82 247.787 -11.510 -0.964 643 H VAL 83 HN VAL 83 249.273 -7.637 0.589 644 HA VAL 83 HA VAL 83 246.582 -6.875 -0.330 645 HB VAL 83 HB VAL 83 247.077 -6.259 2.006 646 1HG1 VAL 83 HG11 VAL 83 248.775 -4.759 2.618 647 2HG1 VAL 83 HG12 VAL 83 249.100 -4.308 0.944 648 3HG1 VAL 83 HG13 VAL 83 249.555 -5.907 1.531 649 1HG2 VAL 83 HG21 VAL 83 246.728 -4.025 0.018 650 2HG2 VAL 83 HG22 VAL 83 246.541 -3.809 1.757 651 3HG2 VAL 83 HG23 VAL 83 245.476 -4.913 0.887 652 H HIS 84 HN HIS 84 246.503 -6.053 -2.287 653 HA HIS 84 HA HIS 84 248.853 -5.041 -3.603 654 1HB HIS 84 HB2 HIS 84 245.957 -5.291 -4.418 655 2HB HIS 84 HB1 HIS 84 247.153 -4.508 -5.444 656 HD1 HIS 84 HD1 HIS 84 246.977 -7.838 -3.591 657 HD2 HIS 84 HD2 HIS 84 248.098 -6.253 -7.264 658 HE1 HIS 84 HE1 HIS 84 247.758 -9.799 -4.959 659 HE2 HIS 84 HE2 HIS 84 248.348 -8.827 -7.207 660 H VAL 85 HN VAL 85 249.014 -2.871 -4.491 661 HA VAL 85 HA VAL 85 247.543 -0.913 -2.845 662 HB VAL 85 HB VAL 85 250.332 -0.627 -3.991 663 1HG1 VAL 85 HG11 VAL 85 249.695 1.214 -1.897 664 2HG1 VAL 85 HG12 VAL 85 248.473 1.322 -3.163 665 3HG1 VAL 85 HG13 VAL 85 250.176 1.545 -3.561 666 1HG2 VAL 85 HG21 VAL 85 249.317 -1.693 -1.453 667 2HG2 VAL 85 HG22 VAL 85 250.596 -0.491 -1.289 668 3HG2 VAL 85 HG23 VAL 85 250.869 -1.944 -2.250 669 H PHE 86 HN PHE 86 245.978 -0.239 -4.140 670 HA PHE 86 HA PHE 86 246.536 0.383 -6.941 671 1HB PHE 86 HB2 PHE 86 244.103 -0.247 -5.332 672 2HB PHE 86 HB1 PHE 86 243.895 0.822 -6.715 673 HD1 PHE 86 HD1 PHE 86 243.884 -0.021 -8.916 674 HD2 PHE 86 HD2 PHE 86 245.027 -2.537 -5.680 675 HE1 PHE 86 HE1 PHE 86 243.784 -1.977 -10.406 676 HE2 PHE 86 HE2 PHE 86 244.931 -4.497 -7.165 677 HZ PHE 86 HZ PHE 86 244.308 -4.218 -9.531 678 H CYS 87 HN CYS 87 246.299 2.413 -7.784 679 HA CYS 87 HA CYS 87 245.580 4.583 -5.920 680 1HB CYS 87 HB2 CYS 87 247.277 6.012 -7.004 681 2HB CYS 87 HB1 CYS 87 248.019 4.607 -6.247 682 HG CYS 87 HG CYS 87 247.957 3.633 -8.847 683 H THR 88 HN THR 88 243.765 5.513 -6.687 684 HA THR 88 HA THR 88 243.158 5.218 -9.531 685 HB THR 88 HB THR 88 241.569 4.543 -7.633 686 HG1 THR 88 HG1 THR 88 240.248 6.240 -9.406 687 1HG2 THR 88 HG21 THR 88 241.837 7.055 -6.733 688 2HG2 THR 88 HG22 THR 88 240.436 6.028 -6.422 689 3HG2 THR 88 HG23 THR 88 240.388 7.217 -7.725 690 H ASP 89 HN ASP 89 241.679 7.103 -10.327 691 HA ASP 89 HA ASP 89 242.665 9.722 -9.512 692 1HB ASP 89 HB2 ASP 89 243.192 10.328 -11.876 693 2HB ASP 89 HB1 ASP 89 244.272 9.106 -11.212 694 H SER 90 HN SER 90 240.631 7.877 -11.748 695 HA SER 90 HA SER 90 238.772 10.071 -12.068 696 1HB SER 90 HB2 SER 90 239.468 7.951 -13.666 697 2HB SER 90 HB1 SER 90 237.935 7.398 -12.990 698 HG SER 90 HG SER 90 238.274 9.957 -14.157 699 H ILE 91 HN ILE 91 237.944 10.413 -9.979 700 HA ILE 91 HA ILE 91 236.482 8.166 -8.781 701 HB ILE 91 HB ILE 91 236.368 9.500 -6.722 702 1HG1 ILE 91 HG12 ILE 91 238.376 11.455 -7.671 703 2HG1 ILE 91 HG11 ILE 91 236.752 11.673 -8.313 704 1HG2 ILE 91 HG21 ILE 91 239.244 9.674 -7.277 705 2HG2 ILE 91 HG22 ILE 91 238.509 8.129 -7.701 706 3HG2 ILE 91 HG23 ILE 91 238.374 8.747 -6.055 707 1HD1 ILE 91 HD11 ILE 91 236.091 11.416 -5.777 708 2HD1 ILE 91 HD12 ILE 91 236.620 12.959 -6.446 709 3HD1 ILE 91 HD13 ILE 91 237.752 11.958 -5.537 710 H GLN 92 HN GLN 92 234.434 8.626 -7.755 711 HA GLN 92 HA GLN 92 232.793 10.387 -9.425 712 1HB GLN 92 HB2 GLN 92 232.211 7.914 -7.810 713 2HB GLN 92 HB1 GLN 92 230.915 8.978 -8.339 714 1HG GLN 92 HG2 GLN 92 232.732 8.270 -10.492 715 2HG GLN 92 HG1 GLN 92 231.975 6.864 -9.744 716 1HE2 GLN 92 HE21 GLN 92 230.479 6.280 -11.180 717 2HE2 GLN 92 HE22 GLN 92 229.228 7.303 -11.789 718 H GLY 93 HN GLY 93 233.549 12.214 -8.201 719 1HA GLY 93 HA2 GLY 93 233.727 13.014 -5.771 720 2HA GLY 93 HA1 GLY 93 232.634 13.908 -6.810 721 H THR 94 HN THR 94 232.898 11.536 -4.281 722 HA THR 94 HA THR 94 230.358 12.301 -3.185 723 HB THR 94 HB THR 94 230.738 9.418 -3.983 724 HG1 THR 94 HG1 THR 94 229.066 11.335 -5.228 725 1HG2 THR 94 HG21 THR 94 228.023 10.162 -3.700 726 2HG2 THR 94 HG22 THR 94 228.890 10.682 -2.254 727 3HG2 THR 94 HG23 THR 94 228.951 8.994 -2.761 728 HA PRO 95 HA PRO 95 233.699 10.789 -0.253 729 1HB PRO 95 HB2 PRO 95 233.515 13.478 0.900 730 2HB PRO 95 HB1 PRO 95 234.936 12.609 0.319 731 1HG PRO 95 HG2 PRO 95 233.937 14.732 -0.978 732 2HG PRO 95 HG1 PRO 95 234.695 13.372 -1.827 733 1HD PRO 95 HD2 PRO 95 231.787 13.971 -1.426 734 2HD PRO 95 HD1 PRO 95 232.634 13.441 -2.896 735 H VAL 96 HN VAL 96 231.463 9.794 0.082 736 HA VAL 96 HA VAL 96 229.779 10.988 2.075 737 HB VAL 96 HB VAL 96 229.790 8.111 1.155 738 1HG1 VAL 96 HG11 VAL 96 228.417 8.079 2.977 739 2HG1 VAL 96 HG12 VAL 96 227.255 8.563 1.742 740 3HG1 VAL 96 HG13 VAL 96 227.966 9.775 2.807 741 1HG2 VAL 96 HG21 VAL 96 227.781 9.075 -0.233 742 2HG2 VAL 96 HG22 VAL 96 229.433 9.174 -0.842 743 3HG2 VAL 96 HG23 VAL 96 228.686 10.582 -0.088 744 H GLU 97 HN GLU 97 231.932 11.221 3.369 745 HA GLU 97 HA GLU 97 233.229 9.242 4.717 746 1HB GLU 97 HB2 GLU 97 233.663 10.818 6.483 747 2HB GLU 97 HB1 GLU 97 233.644 11.690 4.957 748 1HG GLU 97 HG2 GLU 97 231.096 12.028 5.640 749 2HG GLU 97 HG1 GLU 97 231.785 11.833 7.251 750 H SER 98 HN SER 98 232.646 7.609 5.987 751 HA SER 98 HA SER 98 229.939 7.487 7.020 752 1HB SER 98 HB2 SER 98 232.118 5.408 7.285 753 2HB SER 98 HB1 SER 98 230.381 5.168 7.468 754 HG SER 98 HG SER 98 230.121 5.262 5.335 755 H ASP 99 HN ASP 99 230.065 6.067 9.279 756 HA ASP 99 HA ASP 99 230.787 8.016 11.215 757 1HB ASP 99 HB2 ASP 99 229.990 5.128 11.628 758 2HB ASP 99 HB1 ASP 99 230.006 6.383 12.863 759 H GLU 100 HN GLU 100 232.592 5.589 9.674 760 HA GLU 100 HA GLU 100 234.669 5.828 11.744 761 1HB GLU 100 HB2 GLU 100 233.312 3.494 11.149 762 2HB GLU 100 HB1 GLU 100 234.794 3.342 10.215 763 1HG GLU 100 HG2 GLU 100 235.776 4.176 12.594 764 2HG GLU 100 HG1 GLU 100 234.367 3.254 13.114 765 H MET 101 HN MET 101 233.920 6.702 8.716 766 HA MET 101 HA MET 101 236.737 6.639 7.893 767 1HB MET 101 HB2 MET 101 234.558 5.337 6.574 768 2HB MET 101 HB1 MET 101 235.146 6.635 5.545 769 1HG MET 101 HG2 MET 101 236.228 4.470 5.100 770 2HG MET 101 HG1 MET 101 237.363 5.732 5.568 771 1HE MET 101 HE1 MET 101 239.138 5.262 7.834 772 2HE MET 101 HE2 MET 101 239.213 4.687 6.169 773 3HE MET 101 HE3 MET 101 239.503 3.570 7.501 774 H ARG 102 HN ARG 102 237.270 8.301 6.276 775 HA ARG 102 HA ARG 102 235.519 10.465 5.748 776 1HB ARG 102 HB2 ARG 102 235.829 10.930 8.123 777 2HB ARG 102 HB1 ARG 102 237.575 10.872 7.932 778 1HG ARG 102 HG2 ARG 102 237.316 12.808 6.313 779 2HG ARG 102 HG1 ARG 102 235.660 12.943 6.905 780 1HD ARG 102 HD2 ARG 102 236.403 13.392 9.119 781 2HD ARG 102 HD1 ARG 102 238.065 12.969 8.715 782 HE ARG 102 HE ARG 102 237.158 15.120 7.110 783 1HH1 ARG 102 HH11 ARG 102 238.233 14.365 10.342 784 2HH1 ARG 102 HH12 ARG 102 238.825 15.962 10.653 785 1HH2 ARG 102 HH21 ARG 102 237.937 17.222 7.516 786 2HH2 ARG 102 HH22 ARG 102 238.657 17.584 9.049 787 HA PRO 103 HA PRO 103 238.992 10.245 2.798 788 1HB PRO 103 HB2 PRO 103 237.732 11.713 0.870 789 2HB PRO 103 HB1 PRO 103 237.492 9.976 1.084 790 1HG PRO 103 HG2 PRO 103 235.809 12.255 2.058 791 2HG PRO 103 HG1 PRO 103 235.299 10.737 1.292 792 1HD PRO 103 HD2 PRO 103 235.153 11.077 3.946 793 2HD PRO 103 HD1 PRO 103 235.601 9.509 3.244 794 H CYS 104 HN CYS 104 240.668 11.566 3.030 795 HA CYS 104 HA CYS 104 240.144 14.432 3.444 796 1HB CYS 104 HB2 CYS 104 242.312 12.621 4.478 797 2HB CYS 104 HB1 CYS 104 242.515 14.370 4.447 798 HG CYS 104 HG CYS 104 240.478 14.541 6.103 799 H TRP 105 HN TRP 105 240.659 15.710 1.825 800 HA TRP 105 HA TRP 105 242.385 14.764 -0.306 801 1HB TRP 105 HB2 TRP 105 240.894 17.386 -0.033 802 2HB TRP 105 HB1 TRP 105 241.681 16.789 -1.490 803 HD1 TRP 105 HD1 TRP 105 239.106 15.092 0.898 804 HE1 TRP 105 HE1 TRP 105 237.180 14.167 -0.547 805 HE3 TRP 105 HE3 TRP 105 240.717 16.666 -3.693 806 HZ2 TRP 105 HZ2 TRP 105 236.453 14.116 -3.272 807 HZ3 TRP 105 HZ3 TRP 105 239.348 16.138 -5.668 808 HH2 TRP 105 HH2 TRP 105 237.260 14.889 -5.460 809 H PHE 106 HN PHE 106 244.523 15.034 -0.143 810 HA PHE 106 HA PHE 106 245.526 17.464 1.186 811 1HB PHE 106 HB2 PHE 106 245.841 14.865 2.077 812 2HB PHE 106 HB1 PHE 106 247.350 15.177 1.229 813 HD1 PHE 106 HD1 PHE 106 248.834 15.243 3.036 814 HD2 PHE 106 HD2 PHE 106 245.337 17.671 3.092 815 HE1 PHE 106 HE1 PHE 106 249.697 16.438 5.007 816 HE2 PHE 106 HE2 PHE 106 246.195 18.869 5.060 817 HZ PHE 106 HZ PHE 106 248.378 18.253 6.020 818 H GLN 107 HN GLN 107 248.217 17.120 0.675 819 HA GLN 107 HA GLN 107 248.290 17.561 -2.224 820 1HB GLN 107 HB2 GLN 107 250.300 18.364 -0.116 821 2HB GLN 107 HB1 GLN 107 250.354 18.803 -1.817 822 1HG GLN 107 HG2 GLN 107 247.893 19.703 -1.122 823 2HG GLN 107 HG1 GLN 107 248.786 19.941 0.379 824 1HE2 GLN 107 HE21 GLN 107 247.696 21.905 -1.483 825 2HE2 GLN 107 HE22 GLN 107 249.030 22.882 -1.985 826 H LEU 108 HN LEU 108 249.958 16.686 -3.496 827 HA LEU 108 HA LEU 108 250.686 14.015 -2.800 828 1HB LEU 108 HB2 LEU 108 251.470 13.811 -4.992 829 2HB LEU 108 HB1 LEU 108 250.153 14.958 -5.122 830 HG LEU 108 HG LEU 108 253.097 15.631 -5.107 831 1HD1 LEU 108 HD11 LEU 108 251.149 15.051 -7.213 832 2HD1 LEU 108 HD12 LEU 108 252.911 15.029 -7.255 833 3HD1 LEU 108 HD13 LEU 108 252.044 16.553 -7.444 834 1HD2 LEU 108 HD21 LEU 108 251.752 17.362 -4.016 835 2HD2 LEU 108 HD22 LEU 108 250.702 17.434 -5.430 836 3HD2 LEU 108 HD23 LEU 108 252.392 17.915 -5.562 837 H ASP 109 HN ASP 109 252.078 16.959 -2.045 838 HA ASP 109 HA ASP 109 254.708 15.695 -1.655 839 1HB ASP 109 HB2 ASP 109 253.945 18.455 -2.505 840 2HB ASP 109 HB1 ASP 109 255.393 18.256 -1.524 841 H GLN 110 HN GLN 110 252.224 15.827 0.047 842 HA GLN 110 HA GLN 110 253.592 16.582 2.484 843 1HB GLN 110 HB2 GLN 110 250.905 17.773 1.788 844 2HB GLN 110 HB1 GLN 110 251.780 18.000 3.295 845 1HG GLN 110 HG2 GLN 110 253.649 18.963 1.815 846 2HG GLN 110 HG1 GLN 110 252.398 19.087 0.580 847 1HE2 GLN 110 HE21 GLN 110 253.983 21.032 2.341 848 2HE2 GLN 110 HE22 GLN 110 252.771 22.109 2.937 849 H ILE 111 HN ILE 111 252.407 14.143 1.112 850 HA ILE 111 HA ILE 111 250.181 13.373 2.753 851 HB ILE 111 HB ILE 111 251.633 11.066 1.805 852 1HG1 ILE 111 HG12 ILE 111 250.979 11.651 -0.673 853 2HG1 ILE 111 HG11 ILE 111 251.256 13.306 -0.133 854 1HG2 ILE 111 HG21 ILE 111 249.103 11.724 0.528 855 2HG2 ILE 111 HG22 ILE 111 249.061 11.759 2.291 856 3HG2 ILE 111 HG23 ILE 111 249.591 10.301 1.448 857 1HD1 ILE 111 HD11 ILE 111 253.190 11.020 -0.218 858 2HD1 ILE 111 HD12 ILE 111 253.500 12.487 0.710 859 3HD1 ILE 111 HD13 ILE 111 253.290 12.577 -1.039 860 HA PRO 112 HA PRO 112 252.784 12.093 6.133 861 1HB PRO 112 HB2 PRO 112 250.908 11.981 8.008 862 2HB PRO 112 HB1 PRO 112 251.336 13.534 7.276 863 1HG PRO 112 HG2 PRO 112 248.969 11.787 6.764 864 2HG PRO 112 HG1 PRO 112 249.068 13.555 6.811 865 1HD PRO 112 HD2 PRO 112 249.119 11.938 4.511 866 2HD PRO 112 HD1 PRO 112 249.531 13.661 4.594 867 H PHE 113 HN PHE 113 253.462 10.048 5.545 868 HA PHE 113 HA PHE 113 251.644 7.818 5.640 869 1HB PHE 113 HB2 PHE 113 254.509 7.173 5.676 870 2HB PHE 113 HB1 PHE 113 253.238 6.604 4.611 871 HD1 PHE 113 HD1 PHE 113 256.149 7.419 4.037 872 HD2 PHE 113 HD2 PHE 113 252.424 9.446 3.620 873 HE1 PHE 113 HE1 PHE 113 257.100 8.768 2.224 874 HE2 PHE 113 HE2 PHE 113 253.382 10.804 1.808 875 HZ PHE 113 HZ PHE 113 255.715 10.472 1.105 876 H LYS 114 HN LYS 114 253.577 9.491 7.903 877 HA LYS 114 HA LYS 114 254.194 7.404 9.693 878 1HB LYS 114 HB2 LYS 114 253.975 10.386 9.919 879 2HB LYS 114 HB1 LYS 114 254.133 9.419 11.379 880 1HG LYS 114 HG2 LYS 114 256.321 9.937 10.932 881 2HG LYS 114 HG1 LYS 114 256.166 8.371 10.133 882 1HD LYS 114 HD2 LYS 114 255.567 9.719 8.035 883 2HD LYS 114 HD1 LYS 114 256.219 11.109 8.905 884 1HE LYS 114 HE2 LYS 114 258.218 9.369 9.295 885 2HE LYS 114 HE1 LYS 114 257.602 8.759 7.759 886 1HZ LYS 114 HZ1 LYS 114 259.392 10.688 7.912 887 2HZ LYS 114 HZ2 LYS 114 257.995 11.639 7.967 888 3HZ LYS 114 HZ3 LYS 114 258.260 10.603 6.658 889 H ASP 115 HN ASP 115 251.382 9.350 9.087 890 HA ASP 115 HA ASP 115 250.006 8.147 11.355 891 1HB ASP 115 HB2 ASP 115 249.137 10.389 9.521 892 2HB ASP 115 HB1 ASP 115 248.219 9.797 10.902 893 H MET 116 HN MET 116 250.758 6.674 8.977 894 HA MET 116 HA MET 116 248.091 5.884 8.018 895 1HB MET 116 HB2 MET 116 250.405 6.748 6.536 896 2HB MET 116 HB1 MET 116 250.002 5.097 6.104 897 1HG MET 116 HG2 MET 116 247.567 6.268 6.042 898 2HG MET 116 HG1 MET 116 248.600 7.597 5.528 899 1HE MET 116 HE1 MET 116 250.465 5.921 2.480 900 2HE MET 116 HE2 MET 116 250.915 6.310 4.139 901 3HE MET 116 HE3 MET 116 250.070 7.503 3.152 902 H TRP 117 HN TRP 117 251.318 4.518 7.539 903 HA TRP 117 HA TRP 117 250.893 2.346 9.355 904 1HB TRP 117 HB2 TRP 117 249.928 2.055 6.695 905 2HB TRP 117 HB1 TRP 117 251.364 1.050 6.837 906 HD1 TRP 117 HD1 TRP 117 250.158 0.830 10.175 907 HE1 TRP 117 HE1 TRP 117 248.570 -1.161 10.531 908 HE3 TRP 117 HE3 TRP 117 249.045 -0.210 5.292 909 HZ2 TRP 117 HZ2 TRP 117 247.047 -2.939 8.957 910 HZ3 TRP 117 HZ3 TRP 117 247.513 -2.073 4.805 911 HH2 TRP 117 HH2 TRP 117 246.537 -3.408 6.601 912 HA PRO 118 HA PRO 118 255.298 2.211 9.018 913 1HB PRO 118 HB2 PRO 118 255.918 -0.272 9.750 914 2HB PRO 118 HB1 PRO 118 255.106 0.829 10.868 915 1HG PRO 118 HG2 PRO 118 253.944 -1.379 9.212 916 2HG PRO 118 HG1 PRO 118 253.616 -0.957 10.903 917 1HD PRO 118 HD2 PRO 118 252.026 -0.215 8.781 918 2HD PRO 118 HD1 PRO 118 252.100 0.653 10.327 919 H ASP 119 HN ASP 119 253.602 1.125 6.548 920 HA ASP 119 HA ASP 119 255.949 -0.004 5.178 921 1HB ASP 119 HB2 ASP 119 254.172 -1.212 3.732 922 2HB ASP 119 HB1 ASP 119 254.546 -1.862 5.325 923 H ASP 120 HN ASP 120 253.384 2.291 5.160 924 HA ASP 120 HA ASP 120 253.009 2.861 2.491 925 1HB ASP 120 HB2 ASP 120 253.015 4.671 4.890 926 2HB ASP 120 HB1 ASP 120 252.511 5.201 3.284 927 H SER 121 HN SER 121 255.428 4.353 4.631 928 HA SER 121 HA SER 121 256.621 6.007 2.728 929 1HB SER 121 HB2 SER 121 256.954 5.820 5.324 930 2HB SER 121 HB1 SER 121 258.269 4.730 4.883 931 HG SER 121 HG SER 121 258.758 7.070 5.101 932 H TYR 122 HN TYR 122 256.754 2.586 2.982 933 HA TYR 122 HA TYR 122 259.307 2.323 1.678 934 1HB TYR 122 HB2 TYR 122 257.287 0.455 2.811 935 2HB TYR 122 HB1 TYR 122 258.390 -0.168 1.590 936 HD1 TYR 122 HD1 TYR 122 257.964 -0.382 4.859 937 HD2 TYR 122 HD2 TYR 122 260.902 1.149 2.189 938 HE1 TYR 122 HE1 TYR 122 259.687 -0.689 6.587 939 HE2 TYR 122 HE2 TYR 122 262.632 0.845 3.908 940 HH TYR 122 HH TYR 122 262.006 0.410 7.092 941 H TRP 123 HN TRP 123 255.914 2.239 0.715 942 HA TRP 123 HA TRP 123 256.818 1.507 -1.976 943 1HB TRP 123 HB2 TRP 123 254.503 0.822 -2.448 944 2HB TRP 123 HB1 TRP 123 255.209 -0.062 -1.102 945 HD1 TRP 123 HD1 TRP 123 254.125 0.285 1.298 946 HE1 TRP 123 HE1 TRP 123 251.876 1.293 2.054 947 HE3 TRP 123 HE3 TRP 123 252.832 2.698 -3.012 948 HZ2 TRP 123 HZ2 TRP 123 249.821 2.921 0.959 949 HZ3 TRP 123 HZ3 TRP 123 250.715 3.947 -3.075 950 HH2 TRP 123 HH2 TRP 123 249.248 4.044 -1.142 951 H PHE 124 HN PHE 124 254.969 3.945 -0.231 952 HA PHE 124 HA PHE 124 253.781 5.281 -2.312 953 1HB PHE 124 HB2 PHE 124 254.151 5.785 0.381 954 2HB PHE 124 HB1 PHE 124 254.970 7.135 -0.391 955 HD1 PHE 124 HD1 PHE 124 252.119 5.621 -2.100 956 HD2 PHE 124 HD2 PHE 124 253.335 8.663 0.611 957 HE1 PHE 124 HE1 PHE 124 249.963 6.753 -2.400 958 HE2 PHE 124 HE2 PHE 124 251.188 9.791 0.322 959 HZ PHE 124 HZ PHE 124 249.491 8.841 -1.186 960 HA PRO 125 HA PRO 125 257.919 7.909 -2.862 961 1HB PRO 125 HB2 PRO 125 260.102 6.185 -2.550 962 2HB PRO 125 HB1 PRO 125 259.631 7.476 -1.442 963 1HG PRO 125 HG2 PRO 125 259.090 4.553 -1.287 964 2HG PRO 125 HG1 PRO 125 259.418 5.710 0.014 965 1HD PRO 125 HD2 PRO 125 256.945 4.798 -0.457 966 2HD PRO 125 HD1 PRO 125 257.226 6.473 0.057 967 H LEU 126 HN LEU 126 257.342 4.545 -3.569 968 HA LEU 126 HA LEU 126 258.763 4.594 -6.085 969 1HB LEU 126 HB2 LEU 126 256.815 2.540 -5.028 970 2HB LEU 126 HB1 LEU 126 257.909 2.335 -6.384 971 HG LEU 126 HG LEU 126 259.008 2.940 -3.665 972 1HD1 LEU 126 HD11 LEU 126 258.541 0.941 -2.809 973 2HD1 LEU 126 HD12 LEU 126 258.988 0.115 -4.302 974 3HD1 LEU 126 HD13 LEU 126 257.359 0.759 -4.105 975 1HD2 LEU 126 HD21 LEU 126 260.703 1.222 -4.819 976 2HD2 LEU 126 HD22 LEU 126 260.779 2.965 -5.072 977 3HD2 LEU 126 HD23 LEU 126 259.988 1.933 -6.265 978 H LEU 127 HN LEU 127 255.500 4.931 -4.897 979 HA LEU 127 HA LEU 127 254.071 4.752 -7.307 980 1HB LEU 127 HB2 LEU 127 253.566 6.336 -4.788 981 2HB LEU 127 HB1 LEU 127 252.414 6.231 -6.100 982 HG LEU 127 HG LEU 127 252.665 4.540 -3.889 983 1HD1 LEU 127 HD11 LEU 127 251.055 4.401 -6.424 984 2HD1 LEU 127 HD12 LEU 127 250.571 5.061 -4.863 985 3HD1 LEU 127 HD13 LEU 127 250.795 3.323 -5.052 986 1HD2 LEU 127 HD21 LEU 127 253.444 3.127 -6.437 987 2HD2 LEU 127 HD22 LEU 127 252.910 2.321 -4.964 988 3HD2 LEU 127 HD23 LEU 127 254.401 3.259 -4.963 989 H LEU 128 HN LEU 128 255.171 7.604 -5.521 990 HA LEU 128 HA LEU 128 254.514 9.559 -7.376 991 1HB LEU 128 HB2 LEU 128 256.519 9.341 -5.189 992 2HB LEU 128 HB1 LEU 128 256.691 10.673 -6.316 993 HG LEU 128 HG LEU 128 253.983 10.308 -5.199 994 1HD1 LEU 128 HD11 LEU 128 256.352 11.019 -3.499 995 2HD1 LEU 128 HD12 LEU 128 255.072 9.851 -3.173 996 3HD1 LEU 128 HD13 LEU 128 254.724 11.578 -3.122 997 1HD2 LEU 128 HD21 LEU 128 254.665 12.156 -6.710 998 2HD2 LEU 128 HD22 LEU 128 255.760 12.730 -5.452 999 3HD2 LEU 128 HD23 LEU 128 254.021 12.709 -5.164 1000 H GLN 129 HN GLN 129 257.107 7.263 -7.417 1001 HA GLN 129 HA GLN 129 258.607 8.654 -9.463 1002 1HB GLN 129 HB2 GLN 129 259.659 7.238 -7.662 1003 2HB GLN 129 HB1 GLN 129 258.992 5.828 -8.476 1004 1HG GLN 129 HG2 GLN 129 261.357 6.249 -9.019 1005 2HG GLN 129 HG1 GLN 129 260.304 6.263 -10.432 1006 1HE2 GLN 129 HE21 GLN 129 261.731 7.486 -11.644 1007 2HE2 GLN 129 HE22 GLN 129 262.006 9.165 -11.340 1008 H LYS 130 HN LYS 130 255.779 7.068 -9.568 1009 HA LYS 130 HA LYS 130 254.556 5.998 -11.138 1010 1HB LYS 130 HB2 LYS 130 254.620 6.929 -13.222 1011 2HB LYS 130 HB1 LYS 130 255.588 8.107 -12.354 1012 1HG LYS 130 HG2 LYS 130 257.469 6.293 -13.214 1013 2HG LYS 130 HG1 LYS 130 256.312 6.330 -14.542 1014 1HD LYS 130 HD2 LYS 130 257.573 8.095 -15.191 1015 2HD LYS 130 HD1 LYS 130 256.517 8.960 -14.071 1016 1HE LYS 130 HE2 LYS 130 258.175 8.730 -12.305 1017 2HE LYS 130 HE1 LYS 130 259.219 7.805 -13.384 1018 1HZ LYS 130 HZ1 LYS 130 259.501 10.394 -13.026 1019 2HZ LYS 130 HZ2 LYS 130 258.376 10.449 -14.288 1020 3HZ LYS 130 HZ3 LYS 130 259.851 9.651 -14.506 1021 H LYS 131 HN LYS 131 256.765 4.537 -9.911 1022 HA LYS 131 HA LYS 131 257.252 2.567 -12.051 1023 1HB LYS 131 HB2 LYS 131 258.961 3.136 -9.623 1024 2HB LYS 131 HB1 LYS 131 259.275 1.889 -10.822 1025 1HG LYS 131 HG2 LYS 131 258.965 4.630 -11.861 1026 2HG LYS 131 HG1 LYS 131 260.396 4.323 -10.874 1027 1HD LYS 131 HD2 LYS 131 261.342 2.997 -12.434 1028 2HD LYS 131 HD1 LYS 131 259.801 2.270 -12.895 1029 1HE LYS 131 HE2 LYS 131 259.276 4.034 -14.345 1030 2HE LYS 131 HE1 LYS 131 260.486 5.098 -13.629 1031 1HZ LYS 131 HZ1 LYS 131 260.919 3.908 -15.897 1032 2HZ LYS 131 HZ2 LYS 131 261.381 2.615 -14.908 1033 3HZ LYS 131 HZ3 LYS 131 262.172 4.104 -14.776 1034 H LYS 132 HN LYS 132 256.744 0.460 -11.678 1035 HA LYS 132 HA LYS 132 255.035 -0.084 -9.412 1036 1HB LYS 132 HB2 LYS 132 255.888 -1.869 -11.697 1037 2HB LYS 132 HB1 LYS 132 254.651 -2.256 -10.510 1038 1HG LYS 132 HG2 LYS 132 253.252 -0.475 -11.305 1039 2HG LYS 132 HG1 LYS 132 254.522 0.090 -12.392 1040 1HD LYS 132 HD2 LYS 132 254.083 -1.496 -13.932 1041 2HD LYS 132 HD1 LYS 132 253.774 -2.736 -12.714 1042 1HE LYS 132 HE2 LYS 132 251.551 -2.049 -12.419 1043 2HE LYS 132 HE1 LYS 132 251.834 -0.501 -13.213 1044 1HZ LYS 132 HZ1 LYS 132 250.621 -2.378 -14.478 1045 2HZ LYS 132 HZ2 LYS 132 252.173 -3.004 -14.724 1046 3HZ LYS 132 HZ3 LYS 132 251.787 -1.458 -15.290 1047 H PHE 133 HN PHE 133 255.536 -1.218 -7.635 1048 HA PHE 133 HA PHE 133 257.960 -2.857 -7.589 1049 1HB PHE 133 HB2 PHE 133 257.460 -0.410 -5.938 1050 2HB PHE 133 HB1 PHE 133 258.355 -1.750 -5.235 1051 HD1 PHE 133 HD1 PHE 133 260.635 -1.808 -5.477 1052 HD2 PHE 133 HD2 PHE 133 258.319 0.400 -8.282 1053 HE1 PHE 133 HE1 PHE 133 262.701 -0.975 -6.521 1054 HE2 PHE 133 HE2 PHE 133 260.382 1.233 -9.335 1055 HZ PHE 133 HZ PHE 133 262.576 0.546 -8.454 1056 H HIS 134 HN HIS 134 258.004 -4.403 -5.908 1057 HA HIS 134 HA HIS 134 255.447 -4.807 -4.499 1058 1HB HIS 134 HB2 HIS 134 257.221 -6.791 -5.911 1059 2HB HIS 134 HB1 HIS 134 256.128 -7.303 -4.631 1060 HD1 HIS 134 HD1 HIS 134 254.801 -8.727 -6.360 1061 HD2 HIS 134 HD2 HIS 134 254.787 -4.642 -7.121 1062 HE1 HIS 134 HE1 HIS 134 252.995 -8.368 -8.071 1063 HE2 HIS 134 HE2 HIS 134 253.065 -5.902 -8.580 1064 H GLY 135 HN GLY 135 255.657 -4.842 -2.318 1065 1HA GLY 135 HA2 GLY 135 258.357 -5.418 -1.259 1066 2HA GLY 135 HA1 GLY 135 257.331 -4.159 -0.596 1067 H TYR 136 HN TYR 136 258.579 -6.817 0.354 1068 HA TYR 136 HA TYR 136 256.133 -7.995 1.491 1069 1HB TYR 136 HB2 TYR 136 258.893 -9.138 1.041 1070 2HB TYR 136 HB1 TYR 136 257.699 -9.928 2.064 1071 HD1 TYR 136 HD1 TYR 136 256.645 -11.703 1.055 1072 HD2 TYR 136 HD2 TYR 136 257.715 -8.346 -1.330 1073 HE1 TYR 136 HE1 TYR 136 255.691 -12.811 -0.922 1074 HE2 TYR 136 HE2 TYR 136 256.762 -9.443 -3.313 1075 HH TYR 136 HH TYR 136 255.114 -11.179 -3.844 1076 H PHE 137 HN PHE 137 255.703 -7.434 3.525 1077 HA PHE 137 HA PHE 137 257.946 -6.572 5.236 1078 1HB PHE 137 HB2 PHE 137 255.043 -5.745 5.420 1079 2HB PHE 137 HB1 PHE 137 256.375 -5.125 6.391 1080 HD1 PHE 137 HD1 PHE 137 258.427 -4.285 4.830 1081 HD2 PHE 137 HD2 PHE 137 254.316 -4.369 3.745 1082 HE1 PHE 137 HE1 PHE 137 258.839 -2.530 3.156 1083 HE2 PHE 137 HE2 PHE 137 254.718 -2.614 2.068 1084 HZ PHE 137 HZ PHE 137 256.983 -1.693 1.772 1085 H LYS 138 HN LYS 138 258.402 -7.815 6.904 1086 HA LYS 138 HA LYS 138 256.522 -9.823 7.854 1087 1HB LYS 138 HB2 LYS 138 258.982 -10.314 7.451 1088 2HB LYS 138 HB1 LYS 138 259.327 -9.293 8.839 1089 1HG LYS 138 HG2 LYS 138 258.720 -10.869 10.309 1090 2HG LYS 138 HG1 LYS 138 257.337 -11.381 9.341 1091 1HD LYS 138 HD2 LYS 138 259.339 -12.273 7.784 1092 2HD LYS 138 HD1 LYS 138 260.117 -12.382 9.364 1093 1HE LYS 138 HE2 LYS 138 258.279 -13.739 10.196 1094 2HE LYS 138 HE1 LYS 138 257.447 -13.590 8.649 1095 1HZ LYS 138 HZ1 LYS 138 259.248 -14.779 7.589 1096 2HZ LYS 138 HZ2 LYS 138 258.620 -15.703 8.859 1097 3HZ LYS 138 HZ3 LYS 138 260.089 -14.887 9.054 1098 H PHE 139 HN PHE 139 255.486 -9.676 9.848 1099 HA PHE 139 HA PHE 139 256.092 -7.223 11.370 1100 1HB PHE 139 HB2 PHE 139 253.486 -8.433 10.559 1101 2HB PHE 139 HB1 PHE 139 253.570 -7.512 12.058 1102 HD1 PHE 139 HD1 PHE 139 253.121 -5.266 11.959 1103 HD2 PHE 139 HD2 PHE 139 254.625 -7.220 8.491 1104 HE1 PHE 139 HE1 PHE 139 252.887 -3.174 10.684 1105 HE2 PHE 139 HE2 PHE 139 254.396 -5.132 7.210 1106 HZ PHE 139 HZ PHE 139 253.526 -3.106 8.306 1107 H GLN 140 HN GLN 140 255.390 -7.236 13.620 1108 HA GLN 140 HA GLN 140 255.510 -9.876 14.900 1109 1HB GLN 140 HB2 GLN 140 257.675 -9.215 15.347 1110 2HB GLN 140 HB1 GLN 140 257.282 -7.507 15.293 1111 1HG GLN 140 HG2 GLN 140 257.979 -8.400 17.522 1112 2HG GLN 140 HG1 GLN 140 256.446 -7.535 17.501 1113 1HE2 GLN 140 HE21 GLN 140 254.965 -8.448 18.715 1114 2HE2 GLN 140 HE22 GLN 140 254.770 -10.141 18.998 1115 H GLY 141 HN GLY 141 253.259 -9.761 15.205 1116 1HA GLY 141 HA2 GLY 141 251.778 -9.423 17.112 1117 2HA GLY 141 HA1 GLY 141 252.440 -7.802 17.257 1118 H GLN 142 HN GLN 142 252.179 -6.504 15.081 1119 HA GLN 142 HA GLN 142 250.114 -7.024 13.306 1120 1HB GLN 142 HB2 GLN 142 248.366 -5.436 14.274 1121 2HB GLN 142 HB1 GLN 142 248.498 -7.026 15.013 1122 1HG GLN 142 HG2 GLN 142 248.751 -6.063 16.982 1123 2HG GLN 142 HG1 GLN 142 250.259 -5.346 16.418 1124 1HE2 GLN 142 HE21 GLN 142 248.618 -4.136 18.303 1125 2HE2 GLN 142 HE22 GLN 142 247.960 -2.689 17.626 1126 H ASP 143 HN ASP 143 251.813 -4.557 15.167 1127 HA ASP 143 HA ASP 143 251.712 -2.819 12.786 1128 1HB ASP 143 HB2 ASP 143 251.469 -2.210 15.687 1129 2HB ASP 143 HB1 ASP 143 252.307 -1.035 14.676 1130 H THR 144 HN THR 144 253.768 -4.542 14.916 1131 HA THR 144 HA THR 144 256.098 -2.906 14.423 1132 HB THR 144 HB THR 144 255.677 -5.537 15.828 1133 HG1 THR 144 HG1 THR 144 256.317 -2.908 16.639 1134 1HG2 THR 144 HG21 THR 144 257.874 -5.666 14.815 1135 2HG2 THR 144 HG22 THR 144 258.002 -5.443 16.560 1136 3HG2 THR 144 HG23 THR 144 258.287 -4.083 15.473 1137 H ILE 145 HN ILE 145 257.674 -3.238 12.934 1138 HA ILE 145 HA ILE 145 257.304 -5.539 11.141 1139 HB ILE 145 HB ILE 145 258.689 -2.935 10.483 1140 1HG1 ILE 145 HG12 ILE 145 255.970 -3.990 9.666 1141 2HG1 ILE 145 HG11 ILE 145 256.281 -2.596 10.695 1142 1HG2 ILE 145 HG21 ILE 145 259.591 -4.883 9.301 1143 2HG2 ILE 145 HG22 ILE 145 258.745 -3.794 8.200 1144 3HG2 ILE 145 HG23 ILE 145 257.972 -5.288 8.733 1145 1HD1 ILE 145 HD11 ILE 145 257.064 -2.819 7.796 1146 2HD1 ILE 145 HD12 ILE 145 257.273 -1.408 8.833 1147 3HD1 ILE 145 HD13 ILE 145 255.652 -1.962 8.412 1148 H LEU 146 HN LEU 146 258.912 -6.959 10.866 1149 HA LEU 146 HA LEU 146 261.468 -6.384 12.215 1150 1HB LEU 146 HB2 LEU 146 260.559 -9.168 11.618 1151 2HB LEU 146 HB1 LEU 146 261.656 -8.604 12.862 1152 HG LEU 146 HG LEU 146 258.882 -7.653 13.146 1153 1HD1 LEU 146 HD11 LEU 146 259.055 -10.231 12.350 1154 2HD1 LEU 146 HD12 LEU 146 257.806 -9.602 13.422 1155 3HD1 LEU 146 HD13 LEU 146 259.221 -10.409 14.096 1156 1HD2 LEU 146 HD21 LEU 146 261.069 -7.654 14.713 1157 2HD2 LEU 146 HD22 LEU 146 260.290 -9.135 15.270 1158 3HD2 LEU 146 HD23 LEU 146 259.421 -7.601 15.336 1159 H ASP 147 HN ASP 147 259.982 -6.959 9.228 1160 HA ASP 147 HA ASP 147 262.553 -7.041 7.909 1161 1HB ASP 147 HB2 ASP 147 261.261 -9.450 8.407 1162 2HB ASP 147 HB1 ASP 147 260.812 -9.075 6.745 1163 H TYR 148 HN TYR 148 262.508 -5.960 5.998 1164 HA TYR 148 HA TYR 148 259.920 -5.592 4.692 1165 1HB TYR 148 HB2 TYR 148 260.181 -3.216 4.475 1166 2HB TYR 148 HB1 TYR 148 260.294 -3.645 6.179 1167 HD1 TYR 148 HD1 TYR 148 262.418 -3.460 7.372 1168 HD2 TYR 148 HD2 TYR 148 262.105 -2.355 3.275 1169 HE1 TYR 148 HE1 TYR 148 264.570 -2.282 7.532 1170 HE2 TYR 148 HE2 TYR 148 264.257 -1.174 3.424 1171 HH TYR 148 HH TYR 148 266.421 -1.600 5.897 1172 H THR 149 HN THR 149 260.109 -6.206 2.660 1173 HA THR 149 HA THR 149 262.708 -5.834 1.327 1174 HB THR 149 HB THR 149 261.174 -7.650 -0.167 1175 HG1 THR 149 HG1 THR 149 261.145 -8.279 2.598 1176 1HG2 THR 149 HG21 THR 149 263.571 -7.886 1.584 1177 2HG2 THR 149 HG22 THR 149 263.431 -8.063 -0.165 1178 3HG2 THR 149 HG23 THR 149 262.830 -9.333 0.901 1179 H LEU 150 HN LEU 150 262.757 -5.050 -0.760 1180 HA LEU 150 HA LEU 150 260.241 -4.024 -1.858 1181 1HB LEU 150 HB2 LEU 150 262.789 -2.463 -1.454 1182 2HB LEU 150 HB1 LEU 150 261.490 -1.932 -2.506 1183 HG LEU 150 HG LEU 150 260.100 -2.349 -0.225 1184 1HD1 LEU 150 HD11 LEU 150 261.731 -2.878 1.299 1185 2HD1 LEU 150 HD12 LEU 150 261.633 -1.129 1.499 1186 3HD1 LEU 150 HD13 LEU 150 262.933 -1.835 0.540 1187 1HD2 LEU 150 HD21 LEU 150 260.105 0.037 0.061 1188 2HD2 LEU 150 HD22 LEU 150 260.136 -0.329 -1.664 1189 3HD2 LEU 150 HD23 LEU 150 261.612 0.185 -0.845 1190 H ARG 151 HN ARG 151 259.971 -4.560 -3.901 1191 HA ARG 151 HA ARG 151 262.333 -5.038 -5.587 1192 1HB ARG 151 HB2 ARG 151 259.829 -6.735 -5.566 1193 2HB ARG 151 HB1 ARG 151 261.236 -6.970 -6.595 1194 1HG ARG 151 HG2 ARG 151 261.926 -6.916 -3.775 1195 2HG ARG 151 HG1 ARG 151 260.763 -8.184 -4.168 1196 1HD ARG 151 HD2 ARG 151 263.205 -8.819 -4.330 1197 2HD ARG 151 HD1 ARG 151 262.216 -9.162 -5.748 1198 HE ARG 151 HE ARG 151 263.549 -6.618 -5.857 1199 1HH1 ARG 151 HH11 ARG 151 263.848 -10.034 -6.508 1200 2HH1 ARG 151 HH12 ARG 151 265.076 -9.825 -7.710 1201 1HH2 ARG 151 HH21 ARG 151 265.165 -6.342 -7.438 1202 2HH2 ARG 151 HH22 ARG 151 265.825 -7.729 -8.238 1203 H GLU 152 HN GLU 152 261.854 -4.909 -7.924 1204 HA GLU 152 HA GLU 152 259.712 -2.945 -8.414 1205 1HB GLU 152 HB2 GLU 152 261.996 -2.137 -8.848 1206 2HB GLU 152 HB1 GLU 152 262.240 -3.444 -9.995 1207 1HG GLU 152 HG2 GLU 152 260.422 -2.540 -11.380 1208 2HG GLU 152 HG1 GLU 152 260.249 -1.203 -10.245 1209 H VAL 153 HN VAL 153 258.435 -3.133 -10.302 1210 HA VAL 153 HA VAL 153 258.637 -5.628 -11.813 1211 HB VAL 153 HB VAL 153 256.214 -6.060 -11.577 1212 1HG1 VAL 153 HG11 VAL 153 258.199 -6.837 -9.937 1213 2HG1 VAL 153 HG12 VAL 153 256.531 -7.389 -9.779 1214 3HG1 VAL 153 HG13 VAL 153 257.123 -6.068 -8.771 1215 1HG2 VAL 153 HG21 VAL 153 256.398 -3.648 -9.846 1216 2HG2 VAL 153 HG22 VAL 153 255.258 -4.918 -9.399 1217 3HG2 VAL 153 HG23 VAL 153 255.134 -4.134 -10.975 1218 H ASP 154 HN ASP 154 256.813 -5.621 -13.561 1219 HA ASP 154 HA ASP 154 255.808 -3.143 -14.481 1220 1HB ASP 154 HB2 ASP 154 258.211 -2.751 -14.950 1221 2HB ASP 154 HB1 ASP 154 258.225 -4.184 -15.974 1222 H THR 155 HN THR 155 256.952 -6.359 -15.411 1223 HA THR 155 HA THR 155 254.962 -6.587 -17.503 1224 HB THR 155 HB THR 155 256.752 -8.770 -16.434 1225 HG1 THR 155 HG1 THR 155 257.331 -6.965 -18.540 1226 1HG2 THR 155 HG21 THR 155 255.274 -9.777 -17.904 1227 2HG2 THR 155 HG22 THR 155 256.671 -9.408 -18.916 1228 3HG2 THR 155 HG23 THR 155 255.238 -8.381 -18.981 1229 H VAL 156 HN VAL 156 252.916 -6.905 -16.917 1230 HA VAL 156 HA VAL 156 252.079 -7.973 -14.451 1231 HB VAL 156 HB VAL 156 250.650 -6.513 -15.815 1232 1HG1 VAL 156 HG11 VAL 156 249.765 -8.678 -17.598 1233 2HG1 VAL 156 HG12 VAL 156 251.372 -8.032 -17.931 1234 3HG1 VAL 156 HG13 VAL 156 249.973 -6.956 -17.915 1235 1HG2 VAL 156 HG21 VAL 156 249.426 -9.227 -15.321 1236 2HG2 VAL 156 HG22 VAL 156 248.549 -7.706 -15.482 1237 3HG2 VAL 156 HG23 VAL 156 249.637 -7.955 -14.117 Start of MODEL 23 1 1H MET 1 HT1 MET 1 246.344 -25.899 0.317 2 2H MET 1 HT2 MET 1 246.355 -27.561 0.745 3 3H MET 1 HT3 MET 1 247.658 -26.895 -0.153 4 HA MET 1 HA MET 1 246.904 -26.288 2.626 5 1HB MET 1 HB2 MET 1 248.191 -28.449 1.786 6 2HB MET 1 HB1 MET 1 249.550 -27.335 1.716 7 1HG MET 1 HG2 MET 1 249.070 -26.753 4.105 8 2HG MET 1 HG1 MET 1 247.904 -28.074 4.120 9 1HE MET 1 HE1 MET 1 249.955 -31.247 4.026 10 2HE MET 1 HE2 MET 1 249.191 -30.522 2.611 11 3HE MET 1 HE3 MET 1 248.381 -30.466 4.177 12 H GLY 2 HN GLY 2 246.737 -24.021 2.023 13 1HA GLY 2 HA2 GLY 2 248.965 -22.511 2.618 14 2HA GLY 2 HA1 GLY 2 248.947 -22.635 0.866 15 H ALA 3 HN ALA 3 247.669 -21.055 3.597 16 HA ALA 3 HA ALA 3 245.531 -19.802 2.027 17 1HB ALA 3 HB1 ALA 3 246.044 -20.098 4.953 18 2HB ALA 3 HB2 ALA 3 244.589 -20.462 4.025 19 3HB ALA 3 HB3 ALA 3 245.018 -18.786 4.371 20 H SER 4 HN SER 4 245.196 -17.391 2.769 21 HA SER 4 HA SER 4 247.317 -15.765 3.508 22 1HB SER 4 HB2 SER 4 248.645 -16.186 1.671 23 2HB SER 4 HB1 SER 4 247.266 -16.468 0.609 24 HG SER 4 HG SER 4 248.664 -14.229 0.944 25 H ARG 5 HN ARG 5 245.977 -14.408 4.463 26 HA ARG 5 HA ARG 5 243.473 -13.610 3.508 27 1HB ARG 5 HB2 ARG 5 245.276 -12.834 5.678 28 2HB ARG 5 HB1 ARG 5 244.318 -11.490 5.070 29 1HG ARG 5 HG2 ARG 5 243.006 -12.345 6.769 30 2HG ARG 5 HG1 ARG 5 242.316 -13.091 5.326 31 1HD ARG 5 HD2 ARG 5 242.652 -15.091 6.227 32 2HD ARG 5 HD1 ARG 5 244.388 -14.786 6.216 33 HE ARG 5 HE ARG 5 244.304 -14.444 8.474 34 1HH1 ARG 5 HH11 ARG 5 241.063 -14.255 7.191 35 2HH1 ARG 5 HH12 ARG 5 240.316 -14.174 8.752 36 1HH2 ARG 5 HH21 ARG 5 243.323 -14.337 10.527 37 2HH2 ARG 5 HH22 ARG 5 241.599 -14.220 10.645 38 H LEU 6 HN LEU 6 243.535 -12.973 1.401 39 HA LEU 6 HA LEU 6 245.353 -10.879 0.566 40 1HB LEU 6 HB2 LEU 6 244.455 -12.939 -0.804 41 2HB LEU 6 HB1 LEU 6 243.121 -11.857 -1.157 42 HG LEU 6 HG LEU 6 245.935 -10.951 -1.644 43 1HD1 LEU 6 HD11 LEU 6 244.381 -12.305 -3.801 44 2HD1 LEU 6 HD12 LEU 6 245.365 -13.264 -2.695 45 3HD1 LEU 6 HD13 LEU 6 246.115 -12.008 -3.680 46 1HD2 LEU 6 HD21 LEU 6 244.973 -9.417 -3.105 47 2HD2 LEU 6 HD22 LEU 6 243.812 -9.487 -1.779 48 3HD2 LEU 6 HD23 LEU 6 243.496 -10.362 -3.276 49 H TYR 7 HN TYR 7 244.949 -8.832 0.772 50 HA TYR 7 HA TYR 7 242.162 -7.889 0.811 51 1HB TYR 7 HB2 TYR 7 244.517 -6.805 2.376 52 2HB TYR 7 HB1 TYR 7 242.902 -6.106 2.358 53 HD1 TYR 7 HD1 TYR 7 245.016 -7.955 4.304 54 HD2 TYR 7 HD2 TYR 7 241.030 -8.085 2.832 55 HE1 TYR 7 HE1 TYR 7 244.372 -9.401 6.187 56 HE2 TYR 7 HE2 TYR 7 240.374 -9.531 4.708 57 HH TYR 7 HH TYR 7 241.365 -11.039 6.303 58 H THR 8 HN THR 8 242.317 -5.306 0.563 59 HA THR 8 HA THR 8 244.013 -4.790 -1.800 60 HB THR 8 HB THR 8 242.207 -3.584 -2.812 61 HG1 THR 8 HG1 THR 8 240.594 -4.170 -0.568 62 1HG2 THR 8 HG21 THR 8 241.893 -5.801 -3.387 63 2HG2 THR 8 HG22 THR 8 240.320 -5.326 -2.751 64 3HG2 THR 8 HG23 THR 8 241.428 -6.263 -1.752 65 H LEU 9 HN LEU 9 244.263 -2.445 -2.262 66 HA LEU 9 HA LEU 9 244.028 -0.648 0.002 67 1HB LEU 9 HB2 LEU 9 246.211 -2.011 0.174 68 2HB LEU 9 HB1 LEU 9 246.747 -1.077 -1.208 69 HG LEU 9 HG LEU 9 246.017 -0.015 1.510 70 1HD1 LEU 9 HD11 LEU 9 248.379 0.707 1.527 71 2HD1 LEU 9 HD12 LEU 9 248.621 -0.162 0.011 72 3HD1 LEU 9 HD13 LEU 9 248.187 -1.046 1.475 73 1HD2 LEU 9 HD21 LEU 9 246.660 1.412 -1.049 74 2HD2 LEU 9 HD22 LEU 9 246.859 2.163 0.534 75 3HD2 LEU 9 HD23 LEU 9 245.264 1.629 0.006 76 H VAL 10 HN VAL 10 243.039 1.011 -1.038 77 HA VAL 10 HA VAL 10 244.118 1.813 -3.641 78 HB VAL 10 HB VAL 10 241.888 1.246 -3.982 79 1HG1 VAL 10 HG11 VAL 10 241.470 2.308 -1.289 80 2HG1 VAL 10 HG12 VAL 10 240.821 0.863 -2.063 81 3HG1 VAL 10 HG13 VAL 10 240.130 2.442 -2.423 82 1HG2 VAL 10 HG21 VAL 10 240.852 3.222 -4.716 83 2HG2 VAL 10 HG22 VAL 10 242.581 3.562 -4.772 84 3HG2 VAL 10 HG23 VAL 10 241.604 4.178 -3.441 85 H LEU 11 HN LEU 11 245.076 3.643 -3.855 86 HA LEU 11 HA LEU 11 244.598 5.782 -1.897 87 1HB LEU 11 HB2 LEU 11 247.019 4.349 -2.482 88 2HB LEU 11 HB1 LEU 11 247.218 6.030 -2.937 89 HG LEU 11 HG LEU 11 246.673 4.884 -0.209 90 1HD1 LEU 11 HD11 LEU 11 249.015 5.502 -1.382 91 2HD1 LEU 11 HD12 LEU 11 248.733 5.602 0.357 92 3HD1 LEU 11 HD13 LEU 11 248.623 7.054 -0.636 93 1HD2 LEU 11 HD21 LEU 11 246.660 7.453 0.383 94 2HD2 LEU 11 HD22 LEU 11 245.177 6.585 -0.017 95 3HD2 LEU 11 HD23 LEU 11 245.975 7.576 -1.239 96 H VAL 12 HN VAL 12 243.621 7.378 -2.965 97 HA VAL 12 HA VAL 12 243.992 7.643 -5.822 98 HB VAL 12 HB VAL 12 242.279 9.355 -4.028 99 1HG1 VAL 12 HG11 VAL 12 242.556 8.991 -6.975 100 2HG1 VAL 12 HG12 VAL 12 242.351 10.470 -6.038 101 3HG1 VAL 12 HG13 VAL 12 240.977 9.396 -6.301 102 1HG2 VAL 12 HG21 VAL 12 241.171 7.444 -3.617 103 2HG2 VAL 12 HG22 VAL 12 241.956 6.589 -4.945 104 3HG2 VAL 12 HG23 VAL 12 240.570 7.632 -5.264 105 H LEU 13 HN LEU 13 246.173 8.297 -5.849 106 HA LEU 13 HA LEU 13 246.790 10.970 -4.800 107 1HB LEU 13 HB2 LEU 13 248.275 8.771 -4.683 108 2HB LEU 13 HB1 LEU 13 248.809 9.356 -6.252 109 HG LEU 13 HG LEU 13 248.745 11.493 -4.329 110 1HD1 LEU 13 HD11 LEU 13 250.105 10.800 -2.653 111 2HD1 LEU 13 HD12 LEU 13 250.859 9.543 -3.635 112 3HD1 LEU 13 HD13 LEU 13 249.244 9.292 -2.970 113 1HD2 LEU 13 HD21 LEU 13 250.504 10.389 -6.383 114 2HD2 LEU 13 HD22 LEU 13 251.322 11.218 -5.059 115 3HD2 LEU 13 HD23 LEU 13 250.095 12.061 -6.004 116 H GLN 14 HN GLN 14 247.872 12.501 -6.202 117 HA GLN 14 HA GLN 14 247.350 12.150 -9.070 118 1HB GLN 14 HB2 GLN 14 245.946 13.917 -7.334 119 2HB GLN 14 HB1 GLN 14 246.964 14.899 -8.379 120 1HG GLN 14 HG2 GLN 14 245.756 12.963 -10.021 121 2HG GLN 14 HG1 GLN 14 244.494 13.591 -8.963 122 1HE2 GLN 14 HE21 GLN 14 245.497 16.199 -8.653 123 2HE2 GLN 14 HE22 GLN 14 245.337 17.021 -10.164 124 HA PRO 15 HA PRO 15 251.426 13.731 -9.627 125 1HB PRO 15 HB2 PRO 15 251.195 15.214 -11.896 126 2HB PRO 15 HB1 PRO 15 251.198 13.447 -11.886 127 1HG PRO 15 HG2 PRO 15 248.881 15.338 -12.020 128 2HG PRO 15 HG1 PRO 15 249.164 13.846 -12.937 129 1HD PRO 15 HD2 PRO 15 247.512 13.935 -10.803 130 2HD PRO 15 HD1 PRO 15 248.476 12.497 -11.193 131 H GLN 16 HN GLN 16 249.440 15.410 -8.058 132 HA GLN 16 HA GLN 16 251.119 17.703 -7.767 133 1HB GLN 16 HB2 GLN 16 249.149 19.307 -8.062 134 2HB GLN 16 HB1 GLN 16 249.880 18.665 -9.527 135 1HG GLN 16 HG2 GLN 16 248.064 16.923 -9.535 136 2HG GLN 16 HG1 GLN 16 247.289 17.847 -8.248 137 1HE2 GLN 16 HE21 GLN 16 248.766 18.415 -11.428 138 2HE2 GLN 16 HE22 GLN 16 247.541 19.494 -11.994 139 H ARG 17 HN ARG 17 248.044 16.148 -7.015 140 HA ARG 17 HA ARG 17 248.487 16.770 -4.183 141 1HB ARG 17 HB2 ARG 17 245.959 17.036 -3.997 142 2HB ARG 17 HB1 ARG 17 246.838 18.358 -4.753 143 1HG ARG 17 HG2 ARG 17 245.609 18.180 -6.583 144 2HG ARG 17 HG1 ARG 17 246.056 16.481 -6.759 145 1HD ARG 17 HD2 ARG 17 244.177 15.735 -5.679 146 2HD ARG 17 HD1 ARG 17 244.007 17.209 -4.730 147 HE ARG 17 HE ARG 17 242.841 18.189 -6.477 148 1HH1 ARG 17 HH11 ARG 17 244.053 15.055 -7.438 149 2HH1 ARG 17 HH12 ARG 17 243.061 14.970 -8.854 150 1HH2 ARG 17 HH21 ARG 17 241.542 18.074 -8.341 151 2HH2 ARG 17 HH22 ARG 17 241.639 16.683 -9.368 152 H VAL 18 HN VAL 18 247.273 15.312 -2.724 153 HA VAL 18 HA VAL 18 246.669 12.718 -3.991 154 HB VAL 18 HB VAL 18 248.742 12.310 -3.030 155 1HG1 VAL 18 HG11 VAL 18 248.778 14.471 -1.733 156 2HG1 VAL 18 HG12 VAL 18 249.544 13.094 -0.943 157 3HG1 VAL 18 HG13 VAL 18 247.934 13.613 -0.444 158 1HG2 VAL 18 HG21 VAL 18 246.788 11.518 -0.880 159 2HG2 VAL 18 HG22 VAL 18 248.350 10.769 -1.211 160 3HG2 VAL 18 HG23 VAL 18 247.045 10.647 -2.391 161 H LEU 19 HN LEU 19 245.214 11.355 -2.747 162 HA LEU 19 HA LEU 19 243.506 12.873 -0.886 163 1HB LEU 19 HB2 LEU 19 242.335 12.545 -2.971 164 2HB LEU 19 HB1 LEU 19 242.715 10.835 -2.959 165 HG LEU 19 HG LEU 19 241.235 10.435 -1.116 166 1HD1 LEU 19 HD11 LEU 19 241.155 12.065 0.418 167 2HD1 LEU 19 HD12 LEU 19 239.837 12.704 -0.564 168 3HD1 LEU 19 HD13 LEU 19 241.473 13.332 -0.765 169 1HD2 LEU 19 HD21 LEU 19 239.113 11.683 -2.144 170 2HD2 LEU 19 HD22 LEU 19 239.876 10.298 -2.924 171 3HD2 LEU 19 HD23 LEU 19 240.250 11.933 -3.468 172 H LEU 20 HN LEU 20 243.781 12.107 1.108 173 HA LEU 20 HA LEU 20 244.199 9.209 1.438 174 1HB LEU 20 HB2 LEU 20 245.513 11.537 2.602 175 2HB LEU 20 HB1 LEU 20 244.966 10.399 3.818 176 HG LEU 20 HG LEU 20 246.694 9.624 1.473 177 1HD1 LEU 20 HD11 LEU 20 247.637 9.987 4.299 178 2HD1 LEU 20 HD12 LEU 20 247.716 11.288 3.111 179 3HD1 LEU 20 HD13 LEU 20 248.597 9.785 2.832 180 1HD2 LEU 20 HD21 LEU 20 245.235 7.906 2.672 181 2HD2 LEU 20 HD22 LEU 20 246.300 8.151 4.056 182 3HD2 LEU 20 HD23 LEU 20 246.958 7.554 2.534 183 H GLY 21 HN GLY 21 243.002 8.087 2.933 184 1HA GLY 21 HA2 GLY 21 240.580 9.458 3.849 185 2HA GLY 21 HA1 GLY 21 240.798 7.720 3.725 186 H MET 22 HN MET 22 240.255 9.999 5.898 187 HA MET 22 HA MET 22 241.989 8.777 7.936 188 1HB MET 22 HB2 MET 22 242.502 11.094 7.831 189 2HB MET 22 HB1 MET 22 240.805 11.542 7.756 190 1HG MET 22 HG2 MET 22 240.463 11.009 10.032 191 2HG MET 22 HG1 MET 22 242.024 10.203 10.148 192 1HE MET 22 HE1 MET 22 244.478 13.198 9.716 193 2HE MET 22 HE2 MET 22 244.025 11.690 8.923 194 3HE MET 22 HE3 MET 22 244.422 11.698 10.638 195 H LYS 23 HN LYS 23 241.078 8.001 9.826 196 HA LYS 23 HA LYS 23 238.223 7.498 9.687 197 1HB LYS 23 HB2 LYS 23 240.512 6.187 10.856 198 2HB LYS 23 HB1 LYS 23 239.267 6.424 12.075 199 1HG LYS 23 HG2 LYS 23 237.647 5.379 10.452 200 2HG LYS 23 HG1 LYS 23 239.046 4.942 9.472 201 1HD LYS 23 HD2 LYS 23 238.783 3.036 10.732 202 2HD LYS 23 HD1 LYS 23 239.929 3.939 11.726 203 1HE LYS 23 HE2 LYS 23 238.486 4.065 13.417 204 2HE LYS 23 HE1 LYS 23 237.198 4.643 12.361 205 1HZ LYS 23 HZ1 LYS 23 236.557 2.575 13.369 206 2HZ LYS 23 HZ2 LYS 23 237.961 1.810 12.818 207 3HZ LYS 23 HZ3 LYS 23 236.790 2.324 11.712 208 H LYS 24 HN LYS 24 236.744 8.126 11.291 209 HA LYS 24 HA LYS 24 237.532 10.556 12.668 210 1HB LYS 24 HB2 LYS 24 235.015 9.382 11.728 211 2HB LYS 24 HB1 LYS 24 234.884 10.121 13.318 212 1HG LYS 24 HG2 LYS 24 234.828 12.146 12.429 213 2HG LYS 24 HG1 LYS 24 236.341 11.858 11.569 214 1HD LYS 24 HD2 LYS 24 235.173 10.878 9.717 215 2HD LYS 24 HD1 LYS 24 233.645 10.918 10.598 216 1HE LYS 24 HE2 LYS 24 235.252 13.300 9.681 217 2HE LYS 24 HE1 LYS 24 233.736 12.728 8.985 218 1HZ LYS 24 HZ1 LYS 24 233.017 14.391 10.364 219 2HZ LYS 24 HZ2 LYS 24 234.203 14.108 11.536 220 3HZ LYS 24 HZ3 LYS 24 232.882 13.060 11.401 221 H ARG 25 HN ARG 25 236.657 7.260 13.368 222 HA ARG 25 HA ARG 25 237.798 7.399 15.943 223 1HB ARG 25 HB2 ARG 25 235.323 6.491 16.796 224 2HB ARG 25 HB1 ARG 25 236.043 8.048 17.166 225 1HG ARG 25 HG2 ARG 25 233.711 8.174 16.340 226 2HG ARG 25 HG1 ARG 25 234.862 9.098 15.374 227 1HD ARG 25 HD2 ARG 25 234.245 7.987 13.561 228 2HD ARG 25 HD1 ARG 25 234.734 6.472 14.314 229 HE ARG 25 HE ARG 25 232.525 5.970 14.453 230 1HH1 ARG 25 HH11 ARG 25 232.823 9.448 14.608 231 2HH1 ARG 25 HH12 ARG 25 231.119 9.708 14.760 232 1HH2 ARG 25 HH21 ARG 25 230.287 6.317 14.648 233 2HH2 ARG 25 HH22 ARG 25 229.680 7.935 14.781 234 H GLY 26 HN GLY 26 238.353 5.415 16.699 235 1HA GLY 26 HA2 GLY 26 237.469 2.996 16.715 236 2HA GLY 26 HA1 GLY 26 237.602 3.156 14.969 237 H PHE 27 HN PHE 27 239.302 2.047 14.276 238 HA PHE 27 HA PHE 27 241.706 1.944 15.948 239 1HB PHE 27 HB2 PHE 27 240.409 0.098 14.100 240 2HB PHE 27 HB1 PHE 27 242.136 0.253 13.795 241 HD1 PHE 27 HD1 PHE 27 243.508 -1.221 14.878 242 HD2 PHE 27 HD2 PHE 27 239.836 -0.104 16.715 243 HE1 PHE 27 HE1 PHE 27 243.976 -2.761 16.740 244 HE2 PHE 27 HE2 PHE 27 240.297 -1.640 18.580 245 HZ PHE 27 HZ PHE 27 242.370 -2.970 18.595 246 H GLY 28 HN GLY 28 240.861 4.236 14.179 247 1HA GLY 28 HA2 GLY 28 243.466 4.776 13.119 248 2HA GLY 28 HA1 GLY 28 242.302 4.449 11.848 249 H ALA 29 HN ALA 29 241.129 5.980 14.723 250 HA ALA 29 HA ALA 29 240.123 8.209 13.355 251 1HB ALA 29 HB1 ALA 29 239.750 7.155 15.819 252 2HB ALA 29 HB2 ALA 29 239.137 8.720 15.284 253 3HB ALA 29 HB3 ALA 29 240.643 8.628 16.199 254 H GLY 30 HN GLY 30 240.782 10.393 13.323 255 1HA GLY 30 HA2 GLY 30 242.312 12.085 13.071 256 2HA GLY 30 HA1 GLY 30 242.991 11.501 14.582 257 H ARG 31 HN ARG 31 242.889 9.468 11.753 258 HA ARG 31 HA ARG 31 245.693 10.039 11.146 259 1HB ARG 31 HB2 ARG 31 244.645 7.263 11.735 260 2HB ARG 31 HB1 ARG 31 246.264 7.646 11.166 261 1HG ARG 31 HG2 ARG 31 246.858 8.662 13.196 262 2HG ARG 31 HG1 ARG 31 245.178 8.759 13.731 263 1HD ARG 31 HD2 ARG 31 245.136 6.252 13.739 264 2HD ARG 31 HD1 ARG 31 246.872 6.283 13.437 265 HE ARG 31 HE ARG 31 245.535 6.816 15.922 266 1HH1 ARG 31 HH11 ARG 31 248.426 7.395 14.056 267 2HH1 ARG 31 HH12 ARG 31 249.409 7.714 15.445 268 1HH2 ARG 31 HH21 ARG 31 246.827 7.232 17.751 269 2HH2 ARG 31 HH22 ARG 31 248.502 7.621 17.543 270 H TRP 32 HN TRP 32 246.248 9.712 9.015 271 HA TRP 32 HA TRP 32 244.011 9.125 7.215 272 1HB TRP 32 HB2 TRP 32 246.493 9.945 5.911 273 2HB TRP 32 HB1 TRP 32 244.876 10.617 5.769 274 HD1 TRP 32 HD1 TRP 32 247.900 10.835 8.191 275 HE1 TRP 32 HE1 TRP 32 247.958 13.214 9.165 276 HE3 TRP 32 HE3 TRP 32 243.650 12.696 6.048 277 HZ2 TRP 32 HZ2 TRP 32 246.420 15.573 9.033 278 HZ3 TRP 32 HZ3 TRP 32 243.016 15.025 6.523 279 HH2 TRP 32 HH2 TRP 32 244.373 16.434 7.984 280 H ASN 33 HN ASN 33 244.269 7.693 5.414 281 HA ASN 33 HA ASN 33 246.539 6.126 4.941 282 1HB ASN 33 HB2 ASN 33 245.808 3.965 5.913 283 2HB ASN 33 HB1 ASN 33 246.163 5.174 7.143 284 1HD2 ASN 33 HD21 ASN 33 244.639 5.681 8.581 285 2HD2 ASN 33 HD22 ASN 33 243.010 5.107 8.545 286 H GLY 34 HN GLY 34 246.169 4.414 3.392 287 1HA GLY 34 HA2 GLY 34 244.306 5.077 1.417 288 2HA GLY 34 HA1 GLY 34 245.170 3.549 1.515 289 H PHE 35 HN PHE 35 242.750 3.342 0.494 290 HA PHE 35 HA PHE 35 240.977 2.542 2.700 291 1HB PHE 35 HB2 PHE 35 239.984 2.606 -0.107 292 2HB PHE 35 HB1 PHE 35 239.153 3.007 1.386 293 HD1 PHE 35 HD1 PHE 35 239.479 5.214 2.433 294 HD2 PHE 35 HD2 PHE 35 241.143 4.262 -1.365 295 HE1 PHE 35 HE1 PHE 35 239.819 7.609 1.987 296 HE2 PHE 35 HE2 PHE 35 241.489 6.655 -1.817 297 HZ PHE 35 HZ PHE 35 240.827 8.332 -0.140 298 H GLY 36 HN GLY 36 241.715 0.515 3.192 299 1HA GLY 36 HA2 GLY 36 242.090 -1.403 1.024 300 2HA GLY 36 HA1 GLY 36 242.512 -1.652 2.710 301 H GLY 37 HN GLY 37 241.201 -3.585 1.215 302 1HA GLY 37 HA2 GLY 37 238.701 -3.778 2.728 303 2HA GLY 37 HA1 GLY 37 238.609 -3.932 0.979 304 H LYS 38 HN LYS 38 238.265 -6.012 0.520 305 HA LYS 38 HA LYS 38 240.240 -7.965 1.129 306 1HB LYS 38 HB2 LYS 38 239.114 -9.382 2.614 307 2HB LYS 38 HB1 LYS 38 238.838 -7.777 3.271 308 1HG LYS 38 HG2 LYS 38 236.859 -9.222 1.523 309 2HG LYS 38 HG1 LYS 38 236.853 -9.291 3.285 310 1HD LYS 38 HD2 LYS 38 235.807 -7.332 3.421 311 2HD LYS 38 HD1 LYS 38 237.003 -6.559 2.382 312 1HE LYS 38 HE2 LYS 38 235.791 -6.976 0.455 313 2HE LYS 38 HE1 LYS 38 234.900 -8.312 1.185 314 1HZ LYS 38 HZ1 LYS 38 234.409 -5.833 2.520 315 2HZ LYS 38 HZ2 LYS 38 233.309 -6.937 1.862 316 3HZ LYS 38 HZ3 LYS 38 234.006 -5.751 0.878 317 H VAL 39 HN VAL 39 240.154 -9.690 -0.249 318 HA VAL 39 HA VAL 39 238.283 -9.466 -2.440 319 HB VAL 39 HB VAL 39 240.236 -11.729 -2.138 320 1HG1 VAL 39 HG11 VAL 39 240.325 -11.589 -4.561 321 2HG1 VAL 39 HG12 VAL 39 239.269 -10.178 -4.535 322 3HG1 VAL 39 HG13 VAL 39 238.654 -11.748 -4.018 323 1HG2 VAL 39 HG21 VAL 39 241.607 -9.890 -3.602 324 2HG2 VAL 39 HG22 VAL 39 241.874 -10.225 -1.892 325 3HG2 VAL 39 HG23 VAL 39 240.844 -8.877 -2.376 326 H GLN 40 HN GLN 40 236.284 -10.200 -2.110 327 HA GLN 40 HA GLN 40 235.390 -12.020 -0.262 328 1HB GLN 40 HB2 GLN 40 234.194 -10.511 -2.154 329 2HB GLN 40 HB1 GLN 40 234.010 -12.102 -2.879 330 1HG GLN 40 HG2 GLN 40 232.171 -12.280 -1.647 331 2HG GLN 40 HG1 GLN 40 233.253 -12.534 -0.279 332 1HE2 GLN 40 HE21 GLN 40 232.257 -9.701 -2.173 333 2HE2 GLN 40 HE22 GLN 40 231.774 -8.749 -0.813 334 H GLU 41 HN GLU 41 234.187 -14.147 -1.001 335 HA GLU 41 HA GLU 41 236.233 -16.014 -1.625 336 1HB GLU 41 HB2 GLU 41 234.041 -16.268 -0.201 337 2HB GLU 41 HB1 GLU 41 233.333 -16.739 -1.741 338 1HG GLU 41 HG2 GLU 41 235.317 -18.386 -1.881 339 2HG GLU 41 HG1 GLU 41 235.460 -18.102 -0.147 340 H GLY 42 HN GLY 42 236.659 -14.746 -3.748 341 1HA GLY 42 HA2 GLY 42 236.822 -15.873 -5.963 342 2HA GLY 42 HA1 GLY 42 235.074 -16.019 -5.895 343 H GLU 43 HN GLU 43 237.145 -13.221 -5.111 344 HA GLU 43 HA GLU 43 235.936 -11.817 -7.374 345 1HB GLU 43 HB2 GLU 43 235.269 -10.022 -6.142 346 2HB GLU 43 HB1 GLU 43 235.140 -11.236 -4.883 347 1HG GLU 43 HG2 GLU 43 237.145 -10.536 -3.866 348 2HG GLU 43 HG1 GLU 43 237.606 -9.568 -5.265 349 H THR 44 HN THR 44 237.271 -9.709 -7.736 350 HA THR 44 HA THR 44 240.063 -10.588 -7.779 351 HB THR 44 HB THR 44 240.308 -8.922 -9.589 352 HG1 THR 44 HG1 THR 44 237.494 -8.671 -9.461 353 1HG2 THR 44 HG21 THR 44 238.434 -11.197 -9.700 354 2HG2 THR 44 HG22 THR 44 239.916 -10.902 -10.610 355 3HG2 THR 44 HG23 THR 44 238.418 -10.090 -11.071 356 H ILE 45 HN ILE 45 241.702 -9.350 -7.025 357 HA ILE 45 HA ILE 45 241.298 -7.828 -4.776 358 HB ILE 45 HB ILE 45 243.663 -7.215 -6.505 359 1HG1 ILE 45 HG12 ILE 45 243.187 -9.787 -4.989 360 2HG1 ILE 45 HG11 ILE 45 243.433 -9.620 -6.721 361 1HG2 ILE 45 HG21 ILE 45 243.645 -6.030 -4.490 362 2HG2 ILE 45 HG22 ILE 45 244.748 -7.378 -4.216 363 3HG2 ILE 45 HG23 ILE 45 243.108 -7.436 -3.572 364 1HD1 ILE 45 HD11 ILE 45 245.371 -10.403 -5.184 365 2HD1 ILE 45 HD12 ILE 45 245.553 -8.679 -4.861 366 3HD1 ILE 45 HD13 ILE 45 245.684 -9.286 -6.511 367 H GLU 46 HN GLU 46 241.323 -6.795 -8.125 368 HA GLU 46 HA GLU 46 241.348 -3.979 -7.536 369 1HB GLU 46 HB2 GLU 46 242.108 -5.044 -9.713 370 2HB GLU 46 HB1 GLU 46 240.410 -5.307 -10.084 371 1HG GLU 46 HG2 GLU 46 240.002 -2.912 -10.001 372 2HG GLU 46 HG1 GLU 46 241.693 -2.630 -9.583 373 H ASP 47 HN ASP 47 238.994 -6.495 -7.737 374 HA ASP 47 HA ASP 47 236.742 -4.705 -7.998 375 1HB ASP 47 HB2 ASP 47 237.126 -7.650 -7.803 376 2HB ASP 47 HB1 ASP 47 235.587 -7.008 -7.240 377 H GLY 48 HN GLY 48 238.358 -6.594 -5.512 378 1HA GLY 48 HA2 GLY 48 236.538 -5.982 -3.408 379 2HA GLY 48 HA1 GLY 48 238.189 -6.560 -3.211 380 H ALA 49 HN ALA 49 239.389 -4.407 -4.700 381 HA ALA 49 HA ALA 49 239.605 -2.468 -2.593 382 1HB ALA 49 HB1 ALA 49 240.792 -1.782 -5.186 383 2HB ALA 49 HB2 ALA 49 241.305 -3.340 -4.539 384 3HB ALA 49 HB3 ALA 49 241.530 -1.874 -3.587 385 H ARG 50 HN ARG 50 238.118 -2.687 -5.761 386 HA ARG 50 HA ARG 50 237.391 0.050 -5.961 387 1HB ARG 50 HB2 ARG 50 236.733 -2.459 -7.416 388 2HB ARG 50 HB1 ARG 50 235.622 -1.108 -7.600 389 1HG ARG 50 HG2 ARG 50 237.502 0.301 -8.336 390 2HG ARG 50 HG1 ARG 50 238.567 -1.102 -8.223 391 1HD ARG 50 HD2 ARG 50 236.073 -1.175 -9.885 392 2HD ARG 50 HD1 ARG 50 237.569 -0.490 -10.519 393 HE ARG 50 HE ARG 50 238.076 -3.041 -9.437 394 1HH1 ARG 50 HH11 ARG 50 236.520 -1.520 -12.165 395 2HH1 ARG 50 HH12 ARG 50 236.762 -2.874 -13.217 396 1HH2 ARG 50 HH21 ARG 50 238.395 -4.824 -10.820 397 2HH2 ARG 50 HH22 ARG 50 237.825 -4.750 -12.454 398 H ARG 51 HN ARG 51 235.485 -2.869 -5.224 399 HA ARG 51 HA ARG 51 233.095 -1.523 -4.614 400 1HB ARG 51 HB2 ARG 51 233.843 -4.144 -4.862 401 2HB ARG 51 HB1 ARG 51 233.557 -4.019 -3.132 402 1HG ARG 51 HG2 ARG 51 231.485 -2.837 -4.858 403 2HG ARG 51 HG1 ARG 51 231.649 -4.592 -4.934 404 1HD ARG 51 HD2 ARG 51 231.549 -4.591 -2.414 405 2HD ARG 51 HD1 ARG 51 231.094 -2.890 -2.515 406 HE ARG 51 HE ARG 51 229.342 -4.219 -4.162 407 1HH1 ARG 51 HH11 ARG 51 230.206 -4.356 -0.784 408 2HH1 ARG 51 HH12 ARG 51 228.636 -4.878 -0.275 409 1HH2 ARG 51 HH21 ARG 51 227.275 -4.905 -3.494 410 2HH2 ARG 51 HH22 ARG 51 226.971 -5.191 -1.812 411 H GLU 52 HN GLU 52 235.890 -2.303 -2.657 412 HA GLU 52 HA GLU 52 234.603 -1.493 -0.196 413 1HB GLU 52 HB2 GLU 52 237.452 -2.280 -0.818 414 2HB GLU 52 HB1 GLU 52 236.880 -1.851 0.787 415 1HG GLU 52 HG2 GLU 52 235.345 -3.943 -0.599 416 2HG GLU 52 HG1 GLU 52 236.995 -4.366 -0.146 417 H LEU 53 HN LEU 53 236.365 -0.041 -2.733 418 HA LEU 53 HA LEU 53 237.473 2.137 -1.262 419 1HB LEU 53 HB2 LEU 53 238.556 1.607 -3.277 420 2HB LEU 53 HB1 LEU 53 237.050 1.541 -4.174 421 HG LEU 53 HG LEU 53 236.834 3.993 -3.923 422 1HD1 LEU 53 HD11 LEU 53 238.261 5.254 -2.725 423 2HD1 LEU 53 HD12 LEU 53 239.656 4.257 -3.136 424 3HD1 LEU 53 HD13 LEU 53 238.545 3.739 -1.869 425 1HD2 LEU 53 HD21 LEU 53 237.691 3.567 -5.985 426 2HD2 LEU 53 HD22 LEU 53 239.069 2.670 -5.351 427 3HD2 LEU 53 HD23 LEU 53 239.065 4.432 -5.299 428 H GLN 54 HN GLN 54 234.662 1.738 -3.378 429 HA GLN 54 HA GLN 54 233.743 4.379 -3.305 430 1HB GLN 54 HB2 GLN 54 232.718 3.100 -4.929 431 2HB GLN 54 HB1 GLN 54 232.481 1.730 -3.855 432 1HG GLN 54 HG2 GLN 54 230.669 2.871 -2.738 433 2HG GLN 54 HG1 GLN 54 230.945 4.316 -3.710 434 1HE2 GLN 54 HE21 GLN 54 230.784 0.869 -4.526 435 2HE2 GLN 54 HE22 GLN 54 229.529 1.029 -5.704 436 H GLU 55 HN GLU 55 233.527 1.853 -0.944 437 HA GLU 55 HA GLU 55 231.374 3.086 0.520 438 1HB GLU 55 HB2 GLU 55 231.511 1.253 2.016 439 2HB GLU 55 HB1 GLU 55 231.760 0.609 0.400 440 1HG GLU 55 HG2 GLU 55 233.733 -0.222 0.955 441 2HG GLU 55 HG1 GLU 55 234.273 1.323 1.606 442 H GLU 56 HN GLU 56 234.844 3.237 0.611 443 HA GLU 56 HA GLU 56 235.029 4.068 3.319 444 1HB GLU 56 HB2 GLU 56 236.871 3.773 1.048 445 2HB GLU 56 HB1 GLU 56 237.334 4.992 2.228 446 1HG GLU 56 HG2 GLU 56 236.495 2.634 3.598 447 2HG GLU 56 HG1 GLU 56 237.688 2.204 2.374 448 H SER 57 HN SER 57 235.004 5.904 0.263 449 HA SER 57 HA SER 57 234.372 8.285 1.864 450 1HB SER 57 HB2 SER 57 236.676 8.610 1.426 451 2HB SER 57 HB1 SER 57 236.521 8.041 -0.236 452 HG SER 57 HG SER 57 236.646 10.292 -0.201 453 H GLY 58 HN GLY 58 232.815 6.417 0.095 454 1HA GLY 58 HA2 GLY 58 231.146 6.570 -1.474 455 2HA GLY 58 HA1 GLY 58 231.104 8.281 -1.075 456 H LEU 59 HN LEU 59 234.142 7.214 -2.185 457 HA LEU 59 HA LEU 59 233.655 8.515 -4.765 458 1HB LEU 59 HB2 LEU 59 236.190 7.937 -3.239 459 2HB LEU 59 HB1 LEU 59 236.176 8.549 -4.880 460 HG LEU 59 HG LEU 59 235.394 9.941 -2.346 461 1HD1 LEU 59 HD11 LEU 59 237.314 10.324 -4.583 462 2HD1 LEU 59 HD12 LEU 59 237.558 10.480 -2.844 463 3HD1 LEU 59 HD13 LEU 59 236.708 11.744 -3.732 464 1HD2 LEU 59 HD21 LEU 59 234.491 11.782 -3.787 465 2HD2 LEU 59 HD22 LEU 59 233.478 10.341 -3.709 466 3HD2 LEU 59 HD23 LEU 59 234.477 10.639 -5.130 467 H THR 60 HN THR 60 233.170 7.179 -6.335 468 HA THR 60 HA THR 60 234.256 4.461 -6.328 469 HB THR 60 HB THR 60 232.391 5.206 -8.475 470 HG1 THR 60 HG1 THR 60 231.647 5.433 -5.755 471 1HG2 THR 60 HG21 THR 60 233.038 2.915 -6.878 472 2HG2 THR 60 HG22 THR 60 232.120 3.012 -8.381 473 3HG2 THR 60 HG23 THR 60 231.303 3.224 -6.832 474 H VAL 61 HN VAL 61 235.660 3.734 -7.864 475 HA VAL 61 HA VAL 61 236.617 5.757 -9.766 476 HB VAL 61 HB VAL 61 238.718 4.602 -9.838 477 1HG1 VAL 61 HG11 VAL 61 237.591 5.168 -7.123 478 2HG1 VAL 61 HG12 VAL 61 238.712 6.128 -8.087 479 3HG1 VAL 61 HG13 VAL 61 239.263 4.641 -7.316 480 1HG2 VAL 61 HG21 VAL 61 238.688 2.379 -9.612 481 2HG2 VAL 61 HG22 VAL 61 237.163 2.407 -8.728 482 3HG2 VAL 61 HG23 VAL 61 238.684 2.662 -7.872 483 H ASP 62 HN ASP 62 236.721 5.389 -11.904 484 HA ASP 62 HA ASP 62 235.160 3.206 -12.948 485 1HB ASP 62 HB2 ASP 62 236.494 5.621 -14.127 486 2HB ASP 62 HB1 ASP 62 235.954 4.319 -15.182 487 H ALA 63 HN ALA 63 238.456 3.770 -12.250 488 HA ALA 63 HA ALA 63 239.267 1.194 -12.940 489 1HB ALA 63 HB1 ALA 63 239.098 1.644 -15.225 490 2HB ALA 63 HB2 ALA 63 240.812 1.867 -14.874 491 3HB ALA 63 HB3 ALA 63 239.758 3.269 -15.047 492 H LEU 64 HN LEU 64 240.386 1.238 -11.024 493 HA LEU 64 HA LEU 64 242.128 3.295 -10.167 494 1HB LEU 64 HB2 LEU 64 241.848 0.378 -9.494 495 2HB LEU 64 HB1 LEU 64 243.167 1.320 -8.828 496 HG LEU 64 HG LEU 64 240.590 2.620 -8.450 497 1HD1 LEU 64 HD11 LEU 64 240.825 -0.235 -7.888 498 2HD1 LEU 64 HD12 LEU 64 239.397 0.794 -7.973 499 3HD1 LEU 64 HD13 LEU 64 240.352 0.731 -6.492 500 1HD2 LEU 64 HD21 LEU 64 243.056 2.697 -7.303 501 2HD2 LEU 64 HD22 LEU 64 242.155 1.722 -6.141 502 3HD2 LEU 64 HD23 LEU 64 241.584 3.334 -6.571 503 H HIS 65 HN HIS 65 244.562 2.391 -9.652 504 HA HIS 65 HA HIS 65 245.668 1.307 -12.142 505 1HB HIS 65 HB2 HIS 65 245.797 3.964 -11.673 506 2HB HIS 65 HB1 HIS 65 247.256 3.441 -10.837 507 HD1 HIS 65 HD1 HIS 65 247.051 5.127 -13.570 508 HD2 HIS 65 HD2 HIS 65 248.005 1.102 -13.170 509 HE1 HIS 65 HE1 HIS 65 248.355 4.537 -15.638 510 HE2 HIS 65 HE2 HIS 65 248.848 2.076 -15.413 511 H LYS 66 HN LYS 66 246.353 -0.625 -11.360 512 HA LYS 66 HA LYS 66 247.370 -1.102 -8.790 513 1HB LYS 66 HB2 LYS 66 248.437 -3.145 -9.914 514 2HB LYS 66 HB1 LYS 66 246.687 -3.007 -9.996 515 1HG LYS 66 HG2 LYS 66 246.720 -2.419 -12.254 516 2HG LYS 66 HG1 LYS 66 248.435 -2.007 -12.214 517 1HD LYS 66 HD2 LYS 66 248.602 -4.578 -11.503 518 2HD LYS 66 HD1 LYS 66 247.116 -4.648 -12.453 519 1HE LYS 66 HE2 LYS 66 249.384 -3.161 -13.633 520 2HE LYS 66 HE1 LYS 66 249.556 -4.912 -13.525 521 1HZ LYS 66 HZ1 LYS 66 247.349 -3.442 -14.862 522 2HZ LYS 66 HZ2 LYS 66 247.427 -5.123 -14.698 523 3HZ LYS 66 HZ3 LYS 66 248.585 -4.310 -15.625 524 H VAL 67 HN VAL 67 249.250 -0.548 -7.872 525 HA VAL 67 HA VAL 67 251.432 0.253 -9.695 526 HB VAL 67 HB VAL 67 252.276 1.685 -7.852 527 1HG1 VAL 67 HG11 VAL 67 250.492 2.286 -9.726 528 2HG1 VAL 67 HG12 VAL 67 251.017 3.459 -8.518 529 3HG1 VAL 67 HG13 VAL 67 249.492 2.599 -8.309 530 1HG2 VAL 67 HG21 VAL 67 251.379 0.715 -5.904 531 2HG2 VAL 67 HG22 VAL 67 249.732 0.785 -6.529 532 3HG2 VAL 67 HG23 VAL 67 250.565 2.269 -6.076 533 H GLY 68 HN GLY 68 250.881 -1.159 -6.454 534 1HA GLY 68 HA2 GLY 68 253.215 -2.863 -6.956 535 2HA GLY 68 HA1 GLY 68 253.215 -1.867 -5.513 536 H GLN 69 HN GLN 69 253.449 -4.643 -5.505 537 HA GLN 69 HA GLN 69 250.895 -5.456 -4.280 538 1HB GLN 69 HB2 GLN 69 251.892 -6.691 -6.389 539 2HB GLN 69 HB1 GLN 69 252.918 -7.463 -5.188 540 1HG GLN 69 HG2 GLN 69 250.437 -7.710 -4.072 541 2HG GLN 69 HG1 GLN 69 250.096 -7.872 -5.794 542 1HE2 GLN 69 HE21 GLN 69 252.158 -9.094 -3.204 543 2HE2 GLN 69 HE22 GLN 69 252.345 -10.682 -3.857 544 H ILE 70 HN ILE 70 251.030 -5.428 -2.139 545 HA ILE 70 HA ILE 70 253.637 -5.904 -0.882 546 HB ILE 70 HB ILE 70 251.153 -4.781 0.407 547 1HG1 ILE 70 HG12 ILE 70 253.559 -3.308 -0.687 548 2HG1 ILE 70 HG11 ILE 70 251.964 -3.336 -1.433 549 1HG2 ILE 70 HG21 ILE 70 254.031 -4.721 1.294 550 2HG2 ILE 70 HG22 ILE 70 252.799 -5.815 1.922 551 3HG2 ILE 70 HG23 ILE 70 252.645 -4.075 2.172 552 1HD1 ILE 70 HD11 ILE 70 251.196 -2.419 0.891 553 2HD1 ILE 70 HD12 ILE 70 251.902 -1.344 -0.317 554 3HD1 ILE 70 HD13 ILE 70 252.887 -1.935 1.021 555 H VAL 71 HN VAL 71 253.907 -7.364 0.778 556 HA VAL 71 HA VAL 71 251.701 -9.249 1.261 557 HB VAL 71 HB VAL 71 254.553 -10.185 1.137 558 1HG1 VAL 71 HG11 VAL 71 252.858 -11.595 2.219 559 2HG1 VAL 71 HG12 VAL 71 253.520 -12.347 0.766 560 3HG1 VAL 71 HG13 VAL 71 251.923 -11.598 0.723 561 1HG2 VAL 71 HG21 VAL 71 253.765 -11.059 -1.207 562 2HG2 VAL 71 HG22 VAL 71 254.447 -9.441 -1.038 563 3HG2 VAL 71 HG23 VAL 71 252.699 -9.656 -1.140 564 H PHE 72 HN PHE 72 251.670 -10.224 3.322 565 HA PHE 72 HA PHE 72 253.560 -9.118 5.281 566 1HB PHE 72 HB2 PHE 72 250.557 -9.273 5.588 567 2HB PHE 72 HB1 PHE 72 251.676 -8.840 6.875 568 HD1 PHE 72 HD1 PHE 72 251.918 -6.614 7.317 569 HD2 PHE 72 HD2 PHE 72 250.939 -7.824 3.357 570 HE1 PHE 72 HE1 PHE 72 251.796 -4.255 6.630 571 HE2 PHE 72 HE2 PHE 72 250.820 -5.467 2.662 572 HZ PHE 72 HZ PHE 72 251.248 -3.678 4.299 573 H GLU 73 HN GLU 73 254.436 -10.601 6.562 574 HA GLU 73 HA GLU 73 253.174 -13.262 6.656 575 1HB GLU 73 HB2 GLU 73 255.409 -13.295 5.695 576 2HB GLU 73 HB1 GLU 73 256.055 -12.457 7.097 577 1HG GLU 73 HG2 GLU 73 256.548 -14.452 7.922 578 2HG GLU 73 HG1 GLU 73 254.818 -14.682 8.171 579 H PHE 74 HN PHE 74 252.016 -13.539 8.445 580 HA PHE 74 HA PHE 74 252.652 -12.075 10.865 581 1HB PHE 74 HB2 PHE 74 250.475 -14.098 10.290 582 2HB PHE 74 HB1 PHE 74 250.623 -13.172 11.779 583 HD1 PHE 74 HD1 PHE 74 248.620 -13.371 9.149 584 HD2 PHE 74 HD2 PHE 74 251.210 -10.500 10.926 585 HE1 PHE 74 HE1 PHE 74 247.292 -11.558 8.147 586 HE2 PHE 74 HE2 PHE 74 249.887 -8.682 9.928 587 HZ PHE 74 HZ PHE 74 247.925 -9.210 8.536 588 H VAL 75 HN VAL 75 253.699 -12.685 12.499 589 HA VAL 75 HA VAL 75 254.883 -15.313 12.498 590 HB VAL 75 HB VAL 75 255.387 -13.157 14.513 591 1HG1 VAL 75 HG11 VAL 75 256.387 -15.118 15.181 592 2HG1 VAL 75 HG12 VAL 75 257.678 -14.293 14.306 593 3HG1 VAL 75 HG13 VAL 75 256.778 -15.597 13.530 594 1HG2 VAL 75 HG21 VAL 75 255.630 -12.658 11.871 595 2HG2 VAL 75 HG22 VAL 75 257.202 -13.379 12.205 596 3HG2 VAL 75 HG23 VAL 75 256.676 -11.957 13.103 597 H GLY 76 HN GLY 76 252.128 -14.151 13.584 598 1HA GLY 76 HA2 GLY 76 252.083 -15.965 15.908 599 2HA GLY 76 HA1 GLY 76 251.185 -14.451 15.873 600 H GLU 77 HN GLU 77 251.142 -15.597 12.810 601 HA GLU 77 HA GLU 77 248.801 -17.325 13.212 602 1HB GLU 77 HB2 GLU 77 248.892 -14.711 11.789 603 2HB GLU 77 HB1 GLU 77 247.917 -15.992 11.082 604 1HG GLU 77 HG2 GLU 77 246.849 -16.212 13.390 605 2HG GLU 77 HG1 GLU 77 247.604 -14.658 13.745 606 HA PRO 78 HA PRO 78 251.079 -19.852 10.321 607 1HB PRO 78 HB2 PRO 78 248.372 -20.951 9.760 608 2HB PRO 78 HB1 PRO 78 249.862 -21.795 10.197 609 1HG PRO 78 HG2 PRO 78 247.905 -21.481 11.976 610 2HG PRO 78 HG1 PRO 78 249.606 -21.350 12.459 611 1HD PRO 78 HD2 PRO 78 247.590 -19.192 12.012 612 2HD PRO 78 HD1 PRO 78 248.879 -19.299 13.228 613 H GLU 79 HN GLU 79 248.250 -17.968 9.543 614 HA GLU 79 HA GLU 79 248.578 -18.298 6.685 615 1HB GLU 79 HB2 GLU 79 246.518 -17.335 8.463 616 2HB GLU 79 HB1 GLU 79 246.811 -16.167 7.182 617 1HG GLU 79 HG2 GLU 79 246.282 -17.723 5.500 618 2HG GLU 79 HG1 GLU 79 246.356 -19.078 6.625 619 H LEU 80 HN LEU 80 248.076 -15.841 5.661 620 HA LEU 80 HA LEU 80 250.132 -14.023 6.676 621 1HB LEU 80 HB2 LEU 80 250.061 -14.475 3.735 622 2HB LEU 80 HB1 LEU 80 251.390 -13.953 4.753 623 HG LEU 80 HG LEU 80 250.373 -16.762 4.936 624 1HD1 LEU 80 HD11 LEU 80 251.866 -15.530 2.707 625 2HD1 LEU 80 HD12 LEU 80 250.811 -16.943 2.727 626 3HD1 LEU 80 HD13 LEU 80 252.471 -17.074 3.307 627 1HD2 LEU 80 HD21 LEU 80 251.928 -16.629 6.558 628 2HD2 LEU 80 HD22 LEU 80 252.701 -15.214 5.845 629 3HD2 LEU 80 HD23 LEU 80 253.063 -16.823 5.222 630 H MET 81 HN MET 81 250.087 -12.206 4.559 631 HA MET 81 HA MET 81 247.291 -11.539 4.099 632 1HB MET 81 HB2 MET 81 248.724 -10.383 6.220 633 2HB MET 81 HB1 MET 81 248.681 -9.157 4.961 634 1HG MET 81 HG2 MET 81 246.153 -9.726 4.857 635 2HG MET 81 HG1 MET 81 246.428 -10.411 6.458 636 1HE MET 81 HE1 MET 81 246.962 -6.037 5.216 637 2HE MET 81 HE2 MET 81 247.081 -7.467 4.191 638 3HE MET 81 HE3 MET 81 248.426 -7.020 5.240 639 H ASP 82 HN ASP 82 247.238 -11.269 1.958 640 HA ASP 82 HA ASP 82 249.507 -9.906 0.666 641 1HB ASP 82 HB2 ASP 82 249.053 -12.174 -0.169 642 2HB ASP 82 HB1 ASP 82 247.399 -11.708 -0.553 643 H VAL 83 HN VAL 83 249.022 -7.768 0.663 644 HA VAL 83 HA VAL 83 246.346 -6.984 -0.288 645 HB VAL 83 HB VAL 83 246.886 -6.215 1.996 646 1HG1 VAL 83 HG11 VAL 83 248.886 -4.313 0.851 647 2HG1 VAL 83 HG12 VAL 83 249.387 -5.931 1.343 648 3HG1 VAL 83 HG13 VAL 83 248.663 -4.834 2.520 649 1HG2 VAL 83 HG21 VAL 83 245.362 -4.950 0.517 650 2HG2 VAL 83 HG22 VAL 83 246.724 -3.954 0.007 651 3HG2 VAL 83 HG23 VAL 83 246.191 -3.925 1.689 652 H HIS 84 HN HIS 84 246.284 -6.308 -2.301 653 HA HIS 84 HA HIS 84 248.676 -5.416 -3.659 654 1HB HIS 84 HB2 HIS 84 246.618 -6.829 -4.572 655 2HB HIS 84 HB1 HIS 84 245.970 -5.228 -4.912 656 HD1 HIS 84 HD1 HIS 84 247.868 -7.799 -6.460 657 HD2 HIS 84 HD2 HIS 84 248.038 -3.647 -6.475 658 HE1 HIS 84 HE1 HIS 84 249.183 -7.187 -8.514 659 HE2 HIS 84 HE2 HIS 84 249.345 -4.673 -8.456 660 H VAL 85 HN VAL 85 248.885 -3.337 -4.676 661 HA VAL 85 HA VAL 85 247.366 -1.268 -3.236 662 HB VAL 85 HB VAL 85 250.025 -1.012 -4.666 663 1HG1 VAL 85 HG11 VAL 85 250.148 1.188 -3.866 664 2HG1 VAL 85 HG12 VAL 85 248.804 0.949 -2.750 665 3HG1 VAL 85 HG13 VAL 85 248.505 1.031 -4.485 666 1HG2 VAL 85 HG21 VAL 85 251.114 -1.336 -2.691 667 2HG2 VAL 85 HG22 VAL 85 249.716 -2.372 -2.408 668 3HG2 VAL 85 HG23 VAL 85 249.763 -0.748 -1.722 669 H PHE 86 HN PHE 86 246.252 0.260 -4.324 670 HA PHE 86 HA PHE 86 246.403 0.320 -7.251 671 1HB PHE 86 HB2 PHE 86 244.136 -0.539 -5.578 672 2HB PHE 86 HB1 PHE 86 243.715 0.666 -6.787 673 HD1 PHE 86 HD1 PHE 86 244.727 0.156 -9.198 674 HD2 PHE 86 HD2 PHE 86 243.994 -2.745 -6.172 675 HE1 PHE 86 HE1 PHE 86 244.621 -1.602 -10.916 676 HE2 PHE 86 HE2 PHE 86 243.887 -4.509 -7.884 677 HZ PHE 86 HZ PHE 86 244.201 -3.938 -10.259 678 H CYS 87 HN CYS 87 246.545 2.342 -7.988 679 HA CYS 87 HA CYS 87 245.598 4.530 -6.245 680 1HB CYS 87 HB2 CYS 87 247.996 4.658 -6.494 681 2HB CYS 87 HB1 CYS 87 247.879 4.453 -8.237 682 HG CYS 87 HG CYS 87 247.927 6.896 -8.317 683 H THR 88 HN THR 88 243.786 5.450 -7.032 684 HA THR 88 HA THR 88 243.193 5.135 -9.878 685 HB THR 88 HB THR 88 241.526 4.421 -8.179 686 HG1 THR 88 HG1 THR 88 240.118 6.393 -9.418 687 1HG2 THR 88 HG21 THR 88 240.428 7.034 -7.698 688 2HG2 THR 88 HG22 THR 88 242.027 6.850 -6.979 689 3HG2 THR 88 HG23 THR 88 240.743 5.710 -6.578 690 H ASP 89 HN ASP 89 241.530 7.122 -10.445 691 HA ASP 89 HA ASP 89 242.505 9.705 -9.672 692 1HB ASP 89 HB2 ASP 89 243.355 8.449 -12.244 693 2HB ASP 89 HB1 ASP 89 242.948 10.161 -12.258 694 H SER 90 HN SER 90 240.687 7.770 -11.988 695 HA SER 90 HA SER 90 238.778 9.912 -12.435 696 1HB SER 90 HB2 SER 90 239.676 7.825 -14.007 697 2HB SER 90 HB1 SER 90 238.090 7.257 -13.481 698 HG SER 90 HG SER 90 238.542 8.891 -15.424 699 H ILE 91 HN ILE 91 237.586 10.224 -10.598 700 HA ILE 91 HA ILE 91 236.352 7.864 -9.361 701 HB ILE 91 HB ILE 91 235.815 9.285 -7.448 702 1HG1 ILE 91 HG12 ILE 91 237.327 11.485 -8.876 703 2HG1 ILE 91 HG11 ILE 91 235.571 11.408 -8.765 704 1HG2 ILE 91 HG21 ILE 91 237.907 8.144 -7.357 705 2HG2 ILE 91 HG22 ILE 91 238.157 9.770 -6.720 706 3HG2 ILE 91 HG23 ILE 91 238.686 9.372 -8.355 707 1HD1 ILE 91 HD11 ILE 91 235.957 12.761 -7.000 708 2HD1 ILE 91 HD12 ILE 91 237.575 12.117 -6.717 709 3HD1 ILE 91 HD13 ILE 91 236.160 11.217 -6.173 710 H GLN 92 HN GLN 92 234.097 8.551 -8.320 711 HA GLN 92 HA GLN 92 232.510 9.879 -10.407 712 1HB GLN 92 HB2 GLN 92 232.070 7.216 -9.099 713 2HB GLN 92 HB1 GLN 92 230.721 8.122 -9.771 714 1HG GLN 92 HG2 GLN 92 233.056 7.780 -11.534 715 2HG GLN 92 HG1 GLN 92 232.146 6.320 -11.150 716 1HE2 GLN 92 HE21 GLN 92 232.476 8.077 -13.606 717 2HE2 GLN 92 HE22 GLN 92 230.856 8.350 -14.140 718 H GLY 93 HN GLY 93 231.843 8.365 -7.258 719 1HA GLY 93 HA2 GLY 93 229.879 10.202 -6.492 720 2HA GLY 93 HA1 GLY 93 230.770 9.161 -5.396 721 H THR 94 HN THR 94 230.508 11.037 -3.948 722 HA THR 94 HA THR 94 232.612 13.030 -4.406 723 HB THR 94 HB THR 94 230.457 13.760 -2.560 724 HG1 THR 94 HG1 THR 94 229.220 12.713 -4.128 725 1HG2 THR 94 HG21 THR 94 230.599 15.639 -4.591 726 2HG2 THR 94 HG22 THR 94 232.259 15.088 -4.375 727 3HG2 THR 94 HG23 THR 94 231.359 15.734 -3.004 728 HA PRO 95 HA PRO 95 234.490 11.955 -0.607 729 1HB PRO 95 HB2 PRO 95 234.591 14.779 0.235 730 2HB PRO 95 HB1 PRO 95 235.918 13.667 -0.117 731 1HG PRO 95 HG2 PRO 95 235.322 15.684 -1.762 732 2HG PRO 95 HG1 PRO 95 235.868 14.113 -2.377 733 1HD PRO 95 HD2 PRO 95 233.087 15.218 -2.216 734 2HD PRO 95 HD1 PRO 95 233.873 14.347 -3.551 735 H VAL 96 HN VAL 96 232.102 11.331 -0.328 736 HA VAL 96 HA VAL 96 230.556 12.876 1.526 737 HB VAL 96 HB VAL 96 230.160 9.946 0.950 738 1HG1 VAL 96 HG11 VAL 96 227.930 11.869 1.263 739 2HG1 VAL 96 HG12 VAL 96 228.865 11.468 2.704 740 3HG1 VAL 96 HG13 VAL 96 228.067 10.191 1.787 741 1HG2 VAL 96 HG21 VAL 96 229.817 12.260 -0.844 742 2HG2 VAL 96 HG22 VAL 96 228.471 11.121 -0.784 743 3HG2 VAL 96 HG23 VAL 96 230.085 10.559 -1.221 744 H GLU 97 HN GLU 97 232.713 12.894 2.847 745 HA GLU 97 HA GLU 97 233.653 10.858 4.401 746 1HB GLU 97 HB2 GLU 97 234.350 12.506 6.004 747 2HB GLU 97 HB1 GLU 97 234.471 13.218 4.402 748 1HG GLU 97 HG2 GLU 97 232.067 14.099 4.948 749 2HG GLU 97 HG1 GLU 97 232.584 13.839 6.614 750 H SER 98 HN SER 98 232.674 9.419 5.657 751 HA SER 98 HA SER 98 230.046 9.978 6.750 752 1HB SER 98 HB2 SER 98 231.722 7.460 6.907 753 2HB SER 98 HB1 SER 98 230.029 7.607 7.378 754 HG SER 98 HG SER 98 229.481 7.420 5.361 755 H ASP 99 HN ASP 99 229.802 8.798 9.060 756 HA ASP 99 HA ASP 99 231.132 10.513 10.881 757 1HB ASP 99 HB2 ASP 99 229.315 8.137 11.217 758 2HB ASP 99 HB1 ASP 99 230.038 8.942 12.606 759 H GLU 100 HN GLU 100 232.126 7.619 9.433 760 HA GLU 100 HA GLU 100 234.026 7.099 11.623 761 1HB GLU 100 HB2 GLU 100 232.393 5.347 10.032 762 2HB GLU 100 HB1 GLU 100 234.090 4.954 9.786 763 1HG GLU 100 HG2 GLU 100 234.413 4.355 11.982 764 2HG GLU 100 HG1 GLU 100 233.059 5.327 12.557 765 H MET 101 HN MET 101 233.701 7.707 8.185 766 HA MET 101 HA MET 101 236.631 7.679 7.930 767 1HB MET 101 HB2 MET 101 234.645 6.572 6.299 768 2HB MET 101 HB1 MET 101 235.217 7.984 5.420 769 1HG MET 101 HG2 MET 101 236.424 5.939 4.816 770 2HG MET 101 HG1 MET 101 237.482 7.171 5.499 771 1HE MET 101 HE1 MET 101 239.256 6.400 6.260 772 2HE MET 101 HE2 MET 101 239.606 4.906 7.132 773 3HE MET 101 HE3 MET 101 239.108 6.348 8.018 774 H ARG 102 HN ARG 102 237.568 9.339 6.477 775 HA ARG 102 HA ARG 102 236.170 11.742 5.907 776 1HB ARG 102 HB2 ARG 102 236.333 11.908 8.396 777 2HB ARG 102 HB1 ARG 102 238.085 11.860 8.249 778 1HG ARG 102 HG2 ARG 102 237.550 13.896 6.585 779 2HG ARG 102 HG1 ARG 102 236.194 14.053 7.704 780 1HD ARG 102 HD2 ARG 102 238.172 13.707 9.469 781 2HD ARG 102 HD1 ARG 102 239.094 14.438 8.156 782 HE ARG 102 HE ARG 102 236.795 15.972 8.573 783 1HH1 ARG 102 HH11 ARG 102 239.758 15.149 10.223 784 2HH1 ARG 102 HH12 ARG 102 239.827 16.637 11.107 785 1HH2 ARG 102 HH21 ARG 102 236.883 17.929 9.734 786 2HH2 ARG 102 HH22 ARG 102 238.194 18.215 10.830 787 HA PRO 103 HA PRO 103 240.047 11.315 3.549 788 1HB PRO 103 HB2 PRO 103 239.128 12.176 1.200 789 2HB PRO 103 HB1 PRO 103 238.700 10.569 1.807 790 1HG PRO 103 HG2 PRO 103 237.111 13.112 1.897 791 2HG PRO 103 HG1 PRO 103 236.582 11.485 1.434 792 1HD PRO 103 HD2 PRO 103 236.167 12.550 3.919 793 2HD PRO 103 HD1 PRO 103 236.333 10.809 3.621 794 H CYS 104 HN CYS 104 241.504 12.829 2.620 795 HA CYS 104 HA CYS 104 240.766 15.645 2.710 796 1HB CYS 104 HB2 CYS 104 242.213 14.417 4.815 797 2HB CYS 104 HB1 CYS 104 243.356 15.414 3.919 798 HG CYS 104 HG CYS 104 242.173 16.812 5.815 799 H TRP 105 HN TRP 105 241.488 16.604 0.947 800 HA TRP 105 HA TRP 105 243.479 15.266 -0.694 801 1HB TRP 105 HB2 TRP 105 241.829 17.739 -1.262 802 2HB TRP 105 HB1 TRP 105 242.822 16.869 -2.427 803 HD1 TRP 105 HD1 TRP 105 240.085 15.594 0.043 804 HE1 TRP 105 HE1 TRP 105 238.410 14.173 -1.305 805 HE3 TRP 105 HE3 TRP 105 242.130 16.131 -4.613 806 HZ2 TRP 105 HZ2 TRP 105 238.014 13.389 -3.986 807 HZ3 TRP 105 HZ3 TRP 105 241.042 15.012 -6.515 808 HH2 TRP 105 HH2 TRP 105 239.026 13.670 -6.205 809 H PHE 106 HN PHE 106 245.563 15.743 -0.512 810 HA PHE 106 HA PHE 106 246.333 18.505 0.160 811 1HB PHE 106 HB2 PHE 106 247.619 15.975 1.215 812 2HB PHE 106 HB1 PHE 106 248.195 17.609 1.514 813 HD1 PHE 106 HD1 PHE 106 247.065 15.212 3.335 814 HD2 PHE 106 HD2 PHE 106 245.621 18.994 2.024 815 HE1 PHE 106 HE1 PHE 106 245.635 15.354 5.332 816 HE2 PHE 106 HE2 PHE 106 244.187 19.143 4.017 817 HZ PHE 106 HZ PHE 106 244.195 17.322 5.676 818 H GLN 107 HN GLN 107 249.138 18.027 0.023 819 HA GLN 107 HA GLN 107 249.438 17.931 -2.858 820 1HB GLN 107 HB2 GLN 107 251.396 18.555 -0.641 821 2HB GLN 107 HB1 GLN 107 251.797 18.602 -2.353 822 1HG GLN 107 HG2 GLN 107 250.121 20.347 -2.697 823 2HG GLN 107 HG1 GLN 107 249.726 20.302 -0.979 824 1HE2 GLN 107 HE21 GLN 107 251.267 21.047 0.524 825 2HE2 GLN 107 HE22 GLN 107 252.529 22.127 0.052 826 H LEU 108 HN LEU 108 250.918 16.574 -3.953 827 HA LEU 108 HA LEU 108 251.001 13.899 -2.926 828 1HB LEU 108 HB2 LEU 108 251.647 13.246 -5.054 829 2HB LEU 108 HB1 LEU 108 250.702 14.689 -5.369 830 HG LEU 108 HG LEU 108 253.719 14.550 -5.305 831 1HD1 LEU 108 HD11 LEU 108 253.096 13.487 -7.278 832 2HD1 LEU 108 HD12 LEU 108 253.341 15.163 -7.770 833 3HD1 LEU 108 HD13 LEU 108 251.708 14.545 -7.523 834 1HD2 LEU 108 HD21 LEU 108 253.674 16.834 -6.072 835 2HD2 LEU 108 HD22 LEU 108 252.785 16.712 -4.554 836 3HD2 LEU 108 HD23 LEU 108 251.911 16.833 -6.080 837 H ASP 109 HN ASP 109 252.935 16.490 -2.313 838 HA ASP 109 HA ASP 109 255.292 14.785 -1.872 839 1HB ASP 109 HB2 ASP 109 255.025 17.621 -2.764 840 2HB ASP 109 HB1 ASP 109 256.397 17.205 -1.741 841 H GLN 110 HN GLN 110 252.796 15.515 -0.241 842 HA GLN 110 HA GLN 110 254.262 16.075 2.219 843 1HB GLN 110 HB2 GLN 110 251.883 17.605 1.198 844 2HB GLN 110 HB1 GLN 110 252.258 17.530 2.914 845 1HG GLN 110 HG2 GLN 110 254.663 18.241 1.874 846 2HG GLN 110 HG1 GLN 110 253.549 19.038 0.764 847 1HE2 GLN 110 HE21 GLN 110 253.657 21.107 1.353 848 2HE2 GLN 110 HE22 GLN 110 253.349 21.708 2.943 849 H ILE 111 HN ILE 111 252.895 13.718 0.897 850 HA ILE 111 HA ILE 111 250.585 13.167 2.507 851 HB ILE 111 HB ILE 111 251.879 10.739 1.611 852 1HG1 ILE 111 HG12 ILE 111 251.269 11.368 -0.883 853 2HG1 ILE 111 HG11 ILE 111 251.698 12.989 -0.339 854 1HG2 ILE 111 HG21 ILE 111 249.788 10.119 1.275 855 2HG2 ILE 111 HG22 ILE 111 249.422 11.535 0.289 856 3HG2 ILE 111 HG23 ILE 111 249.351 11.643 2.047 857 1HD1 ILE 111 HD11 ILE 111 253.671 12.102 -1.221 858 2HD1 ILE 111 HD12 ILE 111 253.412 10.537 -0.453 859 3HD1 ILE 111 HD13 ILE 111 253.851 11.936 0.525 860 HA PRO 112 HA PRO 112 253.024 11.811 5.970 861 1HB PRO 112 HB2 PRO 112 251.097 11.805 7.803 862 2HB PRO 112 HB1 PRO 112 251.630 13.324 7.070 863 1HG PRO 112 HG2 PRO 112 249.181 11.709 6.515 864 2HG PRO 112 HG1 PRO 112 249.381 13.468 6.545 865 1HD PRO 112 HD2 PRO 112 249.387 11.827 4.263 866 2HD PRO 112 HD1 PRO 112 249.910 13.521 4.340 867 H PHE 113 HN PHE 113 253.635 9.756 5.423 868 HA PHE 113 HA PHE 113 251.804 7.559 5.476 869 1HB PHE 113 HB2 PHE 113 254.706 7.028 5.728 870 2HB PHE 113 HB1 PHE 113 253.508 6.251 4.712 871 HD1 PHE 113 HD1 PHE 113 256.293 7.028 3.964 872 HD2 PHE 113 HD2 PHE 113 252.585 9.086 3.531 873 HE1 PHE 113 HE1 PHE 113 257.194 8.216 2.022 874 HE2 PHE 113 HE2 PHE 113 253.499 10.284 1.588 875 HZ PHE 113 HZ PHE 113 255.796 9.856 0.826 876 H LYS 114 HN LYS 114 253.604 9.225 7.854 877 HA LYS 114 HA LYS 114 253.925 7.064 9.688 878 1HB LYS 114 HB2 LYS 114 254.321 10.013 9.749 879 2HB LYS 114 HB1 LYS 114 254.113 9.196 11.292 880 1HG LYS 114 HG2 LYS 114 256.406 9.209 11.012 881 2HG LYS 114 HG1 LYS 114 255.954 7.602 10.442 882 1HD LYS 114 HD2 LYS 114 255.951 9.725 8.399 883 2HD LYS 114 HD1 LYS 114 257.533 9.311 9.065 884 1HE LYS 114 HE2 LYS 114 255.597 7.254 8.026 885 2HE LYS 114 HE1 LYS 114 256.816 8.023 7.010 886 1HZ LYS 114 HZ1 LYS 114 257.335 6.400 9.443 887 2HZ LYS 114 HZ2 LYS 114 258.522 7.182 8.528 888 3HZ LYS 114 HZ3 LYS 114 257.621 5.925 7.844 889 H ASP 115 HN ASP 115 251.398 9.271 8.881 890 HA ASP 115 HA ASP 115 249.918 8.597 11.297 891 1HB ASP 115 HB2 ASP 115 249.692 10.733 9.230 892 2HB ASP 115 HB1 ASP 115 248.228 10.245 10.080 893 H MET 116 HN MET 116 250.463 6.680 9.105 894 HA MET 116 HA MET 116 247.674 5.924 8.589 895 1HB MET 116 HB2 MET 116 249.628 5.244 6.467 896 2HB MET 116 HB1 MET 116 247.927 5.658 6.337 897 1HG MET 116 HG2 MET 116 248.697 8.041 6.951 898 2HG MET 116 HG1 MET 116 250.299 7.463 6.508 899 1HE MET 116 HE1 MET 116 250.877 7.561 3.344 900 2HE MET 116 HE2 MET 116 249.881 6.134 3.056 901 3HE MET 116 HE3 MET 116 250.821 6.267 4.540 902 H TRP 117 HN TRP 117 250.861 4.538 7.771 903 HA TRP 117 HA TRP 117 250.515 2.406 9.680 904 1HB TRP 117 HB2 TRP 117 249.756 2.070 6.877 905 2HB TRP 117 HB1 TRP 117 250.941 0.882 7.410 906 HD1 TRP 117 HD1 TRP 117 249.673 0.777 10.473 907 HE1 TRP 117 HE1 TRP 117 247.532 -0.612 10.797 908 HE3 TRP 117 HE3 TRP 117 248.059 0.628 5.625 909 HZ2 TRP 117 HZ2 TRP 117 245.435 -1.637 9.209 910 HZ3 TRP 117 HZ3 TRP 117 245.977 -0.578 5.112 911 HH2 TRP 117 HH2 TRP 117 244.693 -1.687 6.868 912 HA PRO 118 HA PRO 118 254.914 2.184 9.256 913 1HB PRO 118 HB2 PRO 118 255.480 -0.291 10.044 914 2HB PRO 118 HB1 PRO 118 254.693 0.849 11.141 915 1HG PRO 118 HG2 PRO 118 253.494 -1.383 9.553 916 2HG PRO 118 HG1 PRO 118 253.156 -0.892 11.221 917 1HD PRO 118 HD2 PRO 118 251.623 -0.198 9.023 918 2HD PRO 118 HD1 PRO 118 251.643 0.680 10.565 919 H ASP 119 HN ASP 119 253.171 1.091 6.825 920 HA ASP 119 HA ASP 119 255.479 -0.132 5.471 921 1HB ASP 119 HB2 ASP 119 252.579 -0.888 5.074 922 2HB ASP 119 HB1 ASP 119 253.957 -1.585 4.229 923 H ASP 120 HN ASP 120 253.023 2.253 5.424 924 HA ASP 120 HA ASP 120 252.575 2.699 2.740 925 1HB ASP 120 HB2 ASP 120 252.640 4.516 5.113 926 2HB ASP 120 HB1 ASP 120 252.350 5.166 3.500 927 H SER 121 HN SER 121 255.249 3.935 4.713 928 HA SER 121 HA SER 121 256.432 5.551 2.747 929 1HB SER 121 HB2 SER 121 256.942 5.413 5.268 930 2HB SER 121 HB1 SER 121 258.014 4.078 4.845 931 HG SER 121 HG SER 121 258.373 6.754 4.532 932 H TYR 122 HN TYR 122 256.278 2.133 2.957 933 HA TYR 122 HA TYR 122 258.694 1.679 1.454 934 1HB TYR 122 HB2 TYR 122 256.540 -0.116 2.535 935 2HB TYR 122 HB1 TYR 122 257.767 -0.722 1.427 936 HD1 TYR 122 HD1 TYR 122 257.020 -1.039 4.611 937 HD2 TYR 122 HD2 TYR 122 260.183 0.651 2.322 938 HE1 TYR 122 HE1 TYR 122 258.556 -1.368 6.503 939 HE2 TYR 122 HE2 TYR 122 261.728 0.326 4.206 940 HH TYR 122 HH TYR 122 261.650 0.055 6.627 941 H TRP 123 HN TRP 123 255.187 1.572 0.823 942 HA TRP 123 HA TRP 123 255.810 0.984 -1.962 943 1HB TRP 123 HB2 TRP 123 253.429 0.499 -2.264 944 2HB TRP 123 HB1 TRP 123 254.138 -0.458 -0.971 945 HD1 TRP 123 HD1 TRP 123 253.425 0.234 1.573 946 HE1 TRP 123 HE1 TRP 123 251.252 1.302 2.447 947 HE3 TRP 123 HE3 TRP 123 251.628 2.132 -2.819 948 HZ2 TRP 123 HZ2 TRP 123 249.063 2.774 1.408 949 HZ3 TRP 123 HZ3 TRP 123 249.485 3.343 -2.788 950 HH2 TRP 123 HH2 TRP 123 248.236 3.645 -0.723 951 H PHE 124 HN PHE 124 255.393 3.710 -0.170 952 HA PHE 124 HA PHE 124 253.765 5.221 -1.974 953 1HB PHE 124 HB2 PHE 124 255.154 5.701 0.559 954 2HB PHE 124 HB1 PHE 124 255.167 7.090 -0.523 955 HD1 PHE 124 HD1 PHE 124 252.725 4.483 0.563 956 HD2 PHE 124 HD2 PHE 124 253.468 8.603 -0.201 957 HE1 PHE 124 HE1 PHE 124 250.427 5.025 1.244 958 HE2 PHE 124 HE2 PHE 124 251.180 9.148 0.476 959 HZ PHE 124 HZ PHE 124 249.651 7.361 1.203 960 HA PRO 125 HA PRO 125 258.185 7.158 -3.080 961 1HB PRO 125 HB2 PRO 125 260.063 5.081 -3.154 962 2HB PRO 125 HB1 PRO 125 259.982 6.377 -1.960 963 1HG PRO 125 HG2 PRO 125 258.982 3.580 -1.793 964 2HG PRO 125 HG1 PRO 125 259.675 4.606 -0.526 965 1HD PRO 125 HD2 PRO 125 257.051 4.129 -0.659 966 2HD PRO 125 HD1 PRO 125 257.670 5.711 -0.152 967 H LEU 126 HN LEU 126 257.251 3.835 -3.883 968 HA LEU 126 HA LEU 126 258.248 4.055 -6.574 969 1HB LEU 126 HB2 LEU 126 256.848 1.913 -6.880 970 2HB LEU 126 HB1 LEU 126 258.276 1.853 -5.868 971 HG LEU 126 HG LEU 126 256.005 2.496 -4.239 972 1HD1 LEU 126 HD11 LEU 126 255.703 -0.091 -5.743 973 2HD1 LEU 126 HD12 LEU 126 254.780 1.365 -6.111 974 3HD1 LEU 126 HD13 LEU 126 254.617 0.593 -4.534 975 1HD2 LEU 126 HD21 LEU 126 257.658 1.510 -3.050 976 2HD2 LEU 126 HD22 LEU 126 258.172 0.494 -4.395 977 3HD2 LEU 126 HD23 LEU 126 256.751 0.051 -3.449 978 H LEU 127 HN LEU 127 255.218 4.509 -4.912 979 HA LEU 127 HA LEU 127 253.482 4.583 -7.117 980 1HB LEU 127 HB2 LEU 127 253.401 6.057 -4.485 981 2HB LEU 127 HB1 LEU 127 252.085 6.065 -5.639 982 HG LEU 127 HG LEU 127 252.647 4.198 -3.570 983 1HD1 LEU 127 HD11 LEU 127 250.457 4.930 -3.858 984 2HD1 LEU 127 HD12 LEU 127 250.427 3.266 -4.442 985 3HD1 LEU 127 HD13 LEU 127 250.477 4.603 -5.591 986 1HD2 LEU 127 HD21 LEU 127 252.607 2.992 -6.334 987 2HD2 LEU 127 HD22 LEU 127 252.362 2.093 -4.838 988 3HD2 LEU 127 HD23 LEU 127 253.908 2.878 -5.150 989 H LEU 128 HN LEU 128 255.124 7.181 -5.373 990 HA LEU 128 HA LEU 128 254.364 9.275 -7.102 991 1HB LEU 128 HB2 LEU 128 256.380 8.897 -4.958 992 2HB LEU 128 HB1 LEU 128 256.639 10.237 -6.058 993 HG LEU 128 HG LEU 128 254.002 9.877 -4.669 994 1HD1 LEU 128 HD11 LEU 128 256.575 10.764 -3.523 995 2HD1 LEU 128 HD12 LEU 128 255.165 10.051 -2.739 996 3HD1 LEU 128 HD13 LEU 128 255.165 11.762 -3.167 997 1HD2 LEU 128 HD21 LEU 128 254.718 11.546 -6.647 998 2HD2 LEU 128 HD22 LEU 128 255.186 12.517 -5.250 999 3HD2 LEU 128 HD23 LEU 128 253.523 11.954 -5.416 1000 H GLN 129 HN GLN 129 256.902 6.906 -7.279 1001 HA GLN 129 HA GLN 129 258.386 8.330 -9.310 1002 1HB GLN 129 HB2 GLN 129 259.349 6.727 -7.550 1003 2HB GLN 129 HB1 GLN 129 258.744 5.434 -8.576 1004 1HG GLN 129 HG2 GLN 129 261.031 5.759 -9.101 1005 2HG GLN 129 HG1 GLN 129 260.085 6.392 -10.447 1006 1HE2 GLN 129 HE21 GLN 129 260.584 8.340 -11.151 1007 2HE2 GLN 129 HE22 GLN 129 261.491 9.531 -10.288 1008 H LYS 130 HN LYS 130 255.506 6.826 -9.436 1009 HA LYS 130 HA LYS 130 254.222 5.933 -11.068 1010 1HB LYS 130 HB2 LYS 130 254.373 6.967 -13.075 1011 2HB LYS 130 HB1 LYS 130 255.568 7.946 -12.241 1012 1HG LYS 130 HG2 LYS 130 257.147 5.967 -13.165 1013 2HG LYS 130 HG1 LYS 130 255.899 5.983 -14.410 1014 1HD LYS 130 HD2 LYS 130 257.576 7.484 -15.137 1015 2HD LYS 130 HD1 LYS 130 256.247 8.483 -14.546 1016 1HE LYS 130 HE2 LYS 130 257.453 8.647 -12.362 1017 2HE LYS 130 HE1 LYS 130 258.819 7.828 -13.118 1018 1HZ LYS 130 HZ1 LYS 130 257.654 10.368 -14.117 1019 2HZ LYS 130 HZ2 LYS 130 259.077 9.622 -14.645 1020 3HZ LYS 130 HZ3 LYS 130 258.996 10.284 -13.091 1021 H LYS 131 HN LYS 131 256.596 4.412 -9.913 1022 HA LYS 131 HA LYS 131 256.826 2.376 -12.027 1023 1HB LYS 131 HB2 LYS 131 258.612 2.861 -9.636 1024 2HB LYS 131 HB1 LYS 131 258.825 1.577 -10.818 1025 1HG LYS 131 HG2 LYS 131 258.736 4.421 -11.718 1026 2HG LYS 131 HG1 LYS 131 260.212 3.761 -11.007 1027 1HD LYS 131 HD2 LYS 131 258.876 2.176 -13.133 1028 2HD LYS 131 HD1 LYS 131 259.718 3.648 -13.618 1029 1HE LYS 131 HE2 LYS 131 261.705 2.775 -12.309 1030 2HE LYS 131 HE1 LYS 131 260.846 1.238 -12.215 1031 1HZ LYS 131 HZ1 LYS 131 260.986 0.933 -14.501 1032 2HZ LYS 131 HZ2 LYS 131 262.502 1.566 -14.105 1033 3HZ LYS 131 HZ3 LYS 131 261.330 2.561 -14.811 1034 H LYS 132 HN LYS 132 256.807 0.116 -11.318 1035 HA LYS 132 HA LYS 132 254.942 -0.247 -9.077 1036 1HB LYS 132 HB2 LYS 132 255.485 -2.018 -11.466 1037 2HB LYS 132 HB1 LYS 132 254.365 -2.403 -10.166 1038 1HG LYS 132 HG2 LYS 132 252.836 -0.813 -10.829 1039 2HG LYS 132 HG1 LYS 132 254.047 0.146 -11.683 1040 1HD LYS 132 HD2 LYS 132 254.175 -1.488 -13.444 1041 2HD LYS 132 HD1 LYS 132 253.118 -2.587 -12.557 1042 1HE LYS 132 HE2 LYS 132 251.916 -1.416 -14.342 1043 2HE LYS 132 HE1 LYS 132 251.280 -1.008 -12.748 1044 1HZ LYS 132 HZ1 LYS 132 252.313 1.085 -12.811 1045 2HZ LYS 132 HZ2 LYS 132 251.612 0.895 -14.339 1046 3HZ LYS 132 HZ3 LYS 132 253.278 0.678 -14.140 1047 H PHE 133 HN PHE 133 255.478 -1.459 -7.358 1048 HA PHE 133 HA PHE 133 257.805 -3.228 -7.511 1049 1HB PHE 133 HB2 PHE 133 257.489 -0.895 -5.635 1050 2HB PHE 133 HB1 PHE 133 258.487 -2.278 -5.207 1051 HD1 PHE 133 HD1 PHE 133 260.719 -2.228 -5.740 1052 HD2 PHE 133 HD2 PHE 133 258.009 0.161 -7.990 1053 HE1 PHE 133 HE1 PHE 133 262.609 -1.244 -6.965 1054 HE2 PHE 133 HE2 PHE 133 259.897 1.147 -9.220 1055 HZ PHE 133 HZ PHE 133 262.200 0.446 -8.709 1056 H HIS 134 HN HIS 134 257.967 -4.686 -5.661 1057 HA HIS 134 HA HIS 134 255.365 -5.169 -4.361 1058 1HB HIS 134 HB2 HIS 134 257.317 -7.098 -5.599 1059 2HB HIS 134 HB1 HIS 134 256.201 -7.626 -4.345 1060 HD1 HIS 134 HD1 HIS 134 254.969 -9.178 -6.003 1061 HD2 HIS 134 HD2 HIS 134 254.882 -5.160 -7.055 1062 HE1 HIS 134 HE1 HIS 134 253.236 -8.995 -7.815 1063 HE2 HIS 134 HE2 HIS 134 253.270 -6.571 -8.502 1064 H GLY 135 HN GLY 135 255.441 -5.110 -2.180 1065 1HA GLY 135 HA2 GLY 135 258.100 -5.454 -0.934 1066 2HA GLY 135 HA1 GLY 135 256.928 -4.279 -0.368 1067 H TYR 136 HN TYR 136 258.334 -6.890 0.629 1068 HA TYR 136 HA TYR 136 255.906 -8.121 1.757 1069 1HB TYR 136 HB2 TYR 136 256.985 -9.845 0.592 1070 2HB TYR 136 HB1 TYR 136 258.588 -9.264 1.020 1071 HD1 TYR 136 HD1 TYR 136 259.502 -11.258 1.909 1072 HD2 TYR 136 HD2 TYR 136 255.787 -9.797 3.380 1073 HE1 TYR 136 HE1 TYR 136 259.599 -12.882 3.753 1074 HE2 TYR 136 HE2 TYR 136 255.875 -11.412 5.226 1075 HH TYR 136 HH TYR 136 257.594 -14.032 5.300 1076 H PHE 137 HN PHE 137 255.545 -7.608 3.818 1077 HA PHE 137 HA PHE 137 257.864 -6.892 5.494 1078 1HB PHE 137 HB2 PHE 137 255.052 -5.901 5.930 1079 2HB PHE 137 HB1 PHE 137 256.547 -5.276 6.617 1080 HD1 PHE 137 HD1 PHE 137 258.321 -4.629 4.655 1081 HD2 PHE 137 HD2 PHE 137 254.082 -4.583 4.336 1082 HE1 PHE 137 HE1 PHE 137 258.485 -2.998 2.821 1083 HE2 PHE 137 HE2 PHE 137 254.236 -2.949 2.502 1084 HZ PHE 137 HZ PHE 137 256.438 -2.158 1.741 1085 H LYS 138 HN LYS 138 258.227 -8.094 7.227 1086 HA LYS 138 HA LYS 138 256.291 -10.106 8.047 1087 1HB LYS 138 HB2 LYS 138 259.098 -9.993 7.955 1088 2HB LYS 138 HB1 LYS 138 258.684 -10.023 9.663 1089 1HG LYS 138 HG2 LYS 138 257.058 -11.964 8.701 1090 2HG LYS 138 HG1 LYS 138 258.446 -12.113 7.622 1091 1HD LYS 138 HD2 LYS 138 259.888 -12.666 9.341 1092 2HD LYS 138 HD1 LYS 138 258.879 -11.900 10.570 1093 1HE LYS 138 HE2 LYS 138 257.199 -13.678 10.252 1094 2HE LYS 138 HE1 LYS 138 258.274 -14.458 9.092 1095 1HZ LYS 138 HZ1 LYS 138 258.253 -15.178 11.585 1096 2HZ LYS 138 HZ2 LYS 138 259.296 -13.860 11.776 1097 3HZ LYS 138 HZ3 LYS 138 259.708 -15.118 10.724 1098 H PHE 139 HN PHE 139 254.925 -9.756 9.712 1099 HA PHE 139 HA PHE 139 255.466 -7.439 11.433 1100 1HB PHE 139 HB2 PHE 139 253.011 -8.734 10.402 1101 2HB PHE 139 HB1 PHE 139 252.919 -8.097 12.042 1102 HD1 PHE 139 HD1 PHE 139 252.493 -5.850 12.391 1103 HD2 PHE 139 HD2 PHE 139 253.885 -7.140 8.582 1104 HE1 PHE 139 HE1 PHE 139 252.122 -3.589 11.492 1105 HE2 PHE 139 HE2 PHE 139 253.518 -4.881 7.679 1106 HZ PHE 139 HZ PHE 139 252.635 -3.103 9.135 1107 H GLN 140 HN GLN 140 255.042 -7.541 13.682 1108 HA GLN 140 HA GLN 140 255.812 -10.092 14.850 1109 1HB GLN 140 HB2 GLN 140 257.107 -8.439 15.800 1110 2HB GLN 140 HB1 GLN 140 255.827 -7.241 15.719 1111 1HG GLN 140 HG2 GLN 140 256.357 -7.810 18.013 1112 2HG GLN 140 HG1 GLN 140 254.709 -8.285 17.608 1113 1HE2 GLN 140 HE21 GLN 140 256.037 -9.334 19.785 1114 2HE2 GLN 140 HE22 GLN 140 256.351 -11.011 19.509 1115 H GLY 141 HN GLY 141 253.018 -8.119 14.449 1116 1HA GLY 141 HA2 GLY 141 251.367 -10.110 15.717 1117 2HA GLY 141 HA1 GLY 141 251.414 -8.584 16.588 1118 H GLN 142 HN GLN 142 251.495 -6.785 14.472 1119 HA GLN 142 HA GLN 142 249.706 -7.180 12.393 1120 1HB GLN 142 HB2 GLN 142 248.414 -6.762 14.990 1121 2HB GLN 142 HB1 GLN 142 247.878 -5.634 13.754 1122 1HG GLN 142 HG2 GLN 142 247.820 -8.019 12.423 1123 2HG GLN 142 HG1 GLN 142 247.345 -8.483 14.056 1124 1HE2 GLN 142 HE21 GLN 142 245.688 -6.949 15.048 1125 2HE2 GLN 142 HE22 GLN 142 244.374 -6.491 14.025 1126 H ASP 143 HN ASP 143 250.913 -4.952 14.830 1127 HA ASP 143 HA ASP 143 250.895 -2.809 12.806 1128 1HB ASP 143 HB2 ASP 143 250.882 -2.591 15.822 1129 2HB ASP 143 HB1 ASP 143 250.978 -1.225 14.714 1130 H THR 144 HN THR 144 252.885 -4.782 14.807 1131 HA THR 144 HA THR 144 255.181 -3.007 14.526 1132 HB THR 144 HB THR 144 254.746 -5.587 16.016 1133 HG1 THR 144 HG1 THR 144 254.069 -3.555 16.935 1134 1HG2 THR 144 HG21 THR 144 257.025 -5.372 16.888 1135 2HG2 THR 144 HG22 THR 144 257.334 -4.080 15.729 1136 3HG2 THR 144 HG23 THR 144 256.999 -5.714 15.158 1137 H ILE 145 HN ILE 145 256.853 -3.334 13.170 1138 HA ILE 145 HA ILE 145 256.685 -5.687 11.421 1139 HB ILE 145 HB ILE 145 258.024 -3.050 10.820 1140 1HG1 ILE 145 HG12 ILE 145 255.454 -4.216 9.724 1141 2HG1 ILE 145 HG11 ILE 145 255.555 -2.895 10.884 1142 1HG2 ILE 145 HG21 ILE 145 258.149 -3.981 8.508 1143 2HG2 ILE 145 HG22 ILE 145 257.614 -5.531 9.157 1144 3HG2 ILE 145 HG23 ILE 145 259.147 -4.836 9.684 1145 1HD1 ILE 145 HD11 ILE 145 255.146 -2.025 8.683 1146 2HD1 ILE 145 HD12 ILE 145 256.555 -2.874 8.048 1147 3HD1 ILE 145 HD13 ILE 145 256.764 -1.561 9.207 1148 H LEU 146 HN LEU 146 258.395 -7.006 11.174 1149 HA LEU 146 HA LEU 146 260.820 -6.352 12.711 1150 1HB LEU 146 HB2 LEU 146 259.894 -9.151 12.141 1151 2HB LEU 146 HB1 LEU 146 261.053 -8.608 13.340 1152 HG LEU 146 HG LEU 146 258.224 -7.690 13.584 1153 1HD1 LEU 146 HD11 LEU 146 258.269 -9.922 15.152 1154 2HD1 LEU 146 HD12 LEU 146 259.107 -10.474 13.703 1155 3HD1 LEU 146 HD13 LEU 146 257.483 -9.798 13.578 1156 1HD2 LEU 146 HD21 LEU 146 259.087 -8.330 16.051 1157 2HD2 LEU 146 HD22 LEU 146 259.349 -6.755 15.302 1158 3HD2 LEU 146 HD23 LEU 146 260.627 -7.969 15.271 1159 H ASP 147 HN ASP 147 259.541 -7.044 9.644 1160 HA ASP 147 HA ASP 147 262.193 -7.061 8.497 1161 1HB ASP 147 HB2 ASP 147 260.827 -9.508 8.920 1162 2HB ASP 147 HB1 ASP 147 260.759 -9.181 7.192 1163 H TYR 148 HN TYR 148 262.240 -6.165 6.467 1164 HA TYR 148 HA TYR 148 259.698 -5.864 5.061 1165 1HB TYR 148 HB2 TYR 148 259.990 -3.504 4.694 1166 2HB TYR 148 HB1 TYR 148 260.031 -3.825 6.424 1167 HD1 TYR 148 HD1 TYR 148 262.122 -3.605 7.680 1168 HD2 TYR 148 HD2 TYR 148 261.951 -2.712 3.524 1169 HE1 TYR 148 HE1 TYR 148 264.279 -2.436 7.848 1170 HE2 TYR 148 HE2 TYR 148 264.107 -1.541 3.680 1171 HH TYR 148 HH TYR 148 265.436 -0.368 5.528 1172 H THR 149 HN THR 149 259.833 -6.081 2.902 1173 HA THR 149 HA THR 149 262.507 -5.975 1.677 1174 HB THR 149 HB THR 149 261.143 -7.835 0.165 1175 HG1 THR 149 HG1 THR 149 260.649 -8.383 2.903 1176 1HG2 THR 149 HG21 THR 149 262.634 -9.476 1.020 1177 2HG2 THR 149 HG22 THR 149 262.920 -8.534 2.483 1178 3HG2 THR 149 HG23 THR 149 263.505 -7.946 0.926 1179 H LEU 150 HN LEU 150 262.602 -5.216 -0.423 1180 HA LEU 150 HA LEU 150 260.091 -4.281 -1.615 1181 1HB LEU 150 HB2 LEU 150 262.552 -2.656 -1.050 1182 2HB LEU 150 HB1 LEU 150 261.434 -2.204 -2.323 1183 HG LEU 150 HG LEU 150 259.793 -2.601 -0.118 1184 1HD1 LEU 150 HD11 LEU 150 260.743 -1.825 1.779 1185 2HD1 LEU 150 HD12 LEU 150 261.853 -0.758 0.919 1186 3HD1 LEU 150 HD13 LEU 150 262.199 -2.484 1.032 1187 1HD2 LEU 150 HD21 LEU 150 259.118 -0.509 -0.594 1188 2HD2 LEU 150 HD22 LEU 150 260.165 -0.704 -1.999 1189 3HD2 LEU 150 HD23 LEU 150 260.756 0.143 -0.568 1190 H ARG 151 HN ARG 151 259.890 -4.948 -3.636 1191 HA ARG 151 HA ARG 151 262.327 -5.407 -5.224 1192 1HB ARG 151 HB2 ARG 151 259.824 -7.094 -5.356 1193 2HB ARG 151 HB1 ARG 151 261.334 -7.372 -6.214 1194 1HG ARG 151 HG2 ARG 151 262.245 -7.387 -3.692 1195 2HG ARG 151 HG1 ARG 151 260.601 -7.967 -3.423 1196 1HD ARG 151 HD2 ARG 151 260.955 -9.910 -4.553 1197 2HD ARG 151 HD1 ARG 151 262.110 -9.178 -5.665 1198 HE ARG 151 HE ARG 151 263.087 -9.388 -2.973 1199 1HH1 ARG 151 HH11 ARG 151 262.717 -11.063 -6.012 1200 2HH1 ARG 151 HH12 ARG 151 264.033 -12.147 -5.718 1201 1HH2 ARG 151 HH21 ARG 151 264.820 -10.814 -2.585 1202 2HH2 ARG 151 HH22 ARG 151 265.227 -12.007 -3.772 1203 H GLU 152 HN GLU 152 261.992 -5.296 -7.566 1204 HA GLU 152 HA GLU 152 259.985 -3.258 -8.212 1205 1HB GLU 152 HB2 GLU 152 261.343 -2.763 -10.167 1206 2HB GLU 152 HB1 GLU 152 262.345 -2.742 -8.722 1207 1HG GLU 152 HG2 GLU 152 263.620 -4.433 -9.430 1208 2HG GLU 152 HG1 GLU 152 262.245 -5.338 -10.059 1209 H VAL 153 HN VAL 153 258.630 -3.451 -10.022 1210 HA VAL 153 HA VAL 153 258.553 -6.029 -11.395 1211 HB VAL 153 HB VAL 153 256.096 -6.209 -11.050 1212 1HG1 VAL 153 HG11 VAL 153 257.691 -6.253 -8.491 1213 2HG1 VAL 153 HG12 VAL 153 257.707 -7.519 -9.719 1214 3HG1 VAL 153 HG13 VAL 153 256.223 -7.168 -8.833 1215 1HG2 VAL 153 HG21 VAL 153 254.883 -4.801 -9.742 1216 2HG2 VAL 153 HG22 VAL 153 256.129 -3.665 -10.258 1217 3HG2 VAL 153 HG23 VAL 153 256.243 -4.439 -8.677 1218 H ASP 154 HN ASP 154 257.626 -5.969 -13.429 1219 HA ASP 154 HA ASP 154 256.284 -3.587 -14.365 1220 1HB ASP 154 HB2 ASP 154 259.098 -4.253 -15.131 1221 2HB ASP 154 HB1 ASP 154 258.032 -3.544 -16.340 1222 H THR 155 HN THR 155 257.878 -6.617 -15.307 1223 HA THR 155 HA THR 155 256.402 -7.032 -17.670 1224 HB THR 155 HB THR 155 257.668 -9.107 -15.871 1225 HG1 THR 155 HG1 THR 155 259.449 -8.217 -16.486 1226 1HG2 THR 155 HG21 THR 155 257.635 -9.455 -18.791 1227 2HG2 THR 155 HG22 THR 155 256.093 -9.667 -17.963 1228 3HG2 THR 155 HG23 THR 155 257.486 -10.644 -17.497 1229 H VAL 156 HN VAL 156 254.560 -8.205 -18.103 1230 HA VAL 156 HA VAL 156 252.839 -8.725 -15.780 1231 HB VAL 156 HB VAL 156 251.978 -8.448 -18.659 1232 1HG1 VAL 156 HG11 VAL 156 249.805 -7.823 -17.325 1233 2HG1 VAL 156 HG12 VAL 156 250.571 -8.777 -16.054 1234 3HG1 VAL 156 HG13 VAL 156 250.229 -9.509 -17.621 1235 1HG2 VAL 156 HG21 VAL 156 252.588 -6.413 -16.609 1236 2HG2 VAL 156 HG22 VAL 156 251.083 -6.193 -17.499 1237 3HG2 VAL 156 HG23 VAL 156 252.612 -6.298 -18.369 Start of MODEL 24 1 1H MET 1 HT1 MET 1 244.749 -24.897 -0.566 2 2H MET 1 HT2 MET 1 244.309 -25.393 1.017 3 3H MET 1 HT3 MET 1 244.933 -23.817 0.752 4 HA MET 1 HA MET 1 243.016 -23.366 -0.674 5 1HB MET 1 HB2 MET 1 242.494 -26.165 0.166 6 2HB MET 1 HB1 MET 1 241.104 -25.091 0.113 7 1HG MET 1 HG2 MET 1 242.239 -24.532 -2.266 8 2HG MET 1 HG1 MET 1 242.711 -26.219 -2.071 9 1HE MET 1 HE1 MET 1 241.176 -27.361 -4.056 10 2HE MET 1 HE2 MET 1 239.817 -28.111 -3.220 11 3HE MET 1 HE3 MET 1 241.416 -28.105 -2.476 12 H GLY 2 HN GLY 2 242.743 -21.603 0.582 13 1HA GLY 2 HA2 GLY 2 241.290 -20.536 2.157 14 2HA GLY 2 HA1 GLY 2 241.318 -22.002 3.124 15 H ALA 3 HN ALA 3 243.594 -19.560 1.866 16 HA ALA 3 HA ALA 3 244.539 -18.951 4.499 17 1HB ALA 3 HB1 ALA 3 245.825 -21.071 3.108 18 2HB ALA 3 HB2 ALA 3 246.238 -20.367 4.672 19 3HB ALA 3 HB3 ALA 3 246.939 -19.706 3.194 20 H SER 4 HN SER 4 246.733 -17.603 4.188 21 HA SER 4 HA SER 4 247.606 -15.635 3.461 22 1HB SER 4 HB2 SER 4 248.516 -16.368 1.522 23 2HB SER 4 HB1 SER 4 247.029 -17.166 1.014 24 HG SER 4 HG SER 4 247.577 -15.377 -0.322 25 H ARG 5 HN ARG 5 246.223 -14.311 4.561 26 HA ARG 5 HA ARG 5 243.666 -13.550 3.647 27 1HB ARG 5 HB2 ARG 5 245.525 -12.730 5.768 28 2HB ARG 5 HB1 ARG 5 244.508 -11.426 5.172 29 1HG ARG 5 HG2 ARG 5 243.531 -12.563 7.108 30 2HG ARG 5 HG1 ARG 5 242.516 -12.703 5.671 31 1HD ARG 5 HD2 ARG 5 244.502 -14.844 6.284 32 2HD ARG 5 HD1 ARG 5 242.983 -14.792 7.176 33 HE ARG 5 HE ARG 5 243.349 -15.690 4.517 34 1HH1 ARG 5 HH11 ARG 5 241.102 -13.941 6.536 35 2HH1 ARG 5 HH12 ARG 5 239.720 -14.373 5.587 36 1HH2 ARG 5 HH21 ARG 5 241.531 -16.258 3.267 37 2HH2 ARG 5 HH22 ARG 5 239.963 -15.689 3.731 38 H LEU 6 HN LEU 6 243.702 -12.924 1.529 39 HA LEU 6 HA LEU 6 245.538 -10.856 0.652 40 1HB LEU 6 HB2 LEU 6 244.698 -12.877 -0.726 41 2HB LEU 6 HB1 LEU 6 243.242 -11.930 -0.958 42 HG LEU 6 HG LEU 6 245.891 -10.719 -1.642 43 1HD1 LEU 6 HD11 LEU 6 245.542 -13.093 -2.655 44 2HD1 LEU 6 HD12 LEU 6 246.064 -11.762 -3.688 45 3HD1 LEU 6 HD13 LEU 6 244.375 -12.270 -3.691 46 1HD2 LEU 6 HD21 LEU 6 243.808 -9.374 -1.657 47 2HD2 LEU 6 HD22 LEU 6 243.161 -10.457 -2.887 48 3HD2 LEU 6 HD23 LEU 6 244.584 -9.477 -3.237 49 H TYR 7 HN TYR 7 245.152 -8.799 0.884 50 HA TYR 7 HA TYR 7 242.369 -7.842 0.943 51 1HB TYR 7 HB2 TYR 7 244.716 -6.684 2.465 52 2HB TYR 7 HB1 TYR 7 243.053 -6.111 2.521 53 HD1 TYR 7 HD1 TYR 7 244.869 -7.034 4.842 54 HD2 TYR 7 HD2 TYR 7 241.870 -9.009 2.561 55 HE1 TYR 7 HE1 TYR 7 244.423 -8.534 6.738 56 HE2 TYR 7 HE2 TYR 7 241.415 -10.514 4.451 57 HH TYR 7 HH TYR 7 241.694 -10.600 6.846 58 H THR 8 HN THR 8 242.531 -5.261 0.679 59 HA THR 8 HA THR 8 244.222 -4.787 -1.691 60 HB THR 8 HB THR 8 242.346 -3.344 -2.509 61 HG1 THR 8 HG1 THR 8 240.261 -4.060 -1.470 62 1HG2 THR 8 HG21 THR 8 240.757 -5.314 -2.968 63 2HG2 THR 8 HG22 THR 8 241.987 -6.286 -2.162 64 3HG2 THR 8 HG23 THR 8 242.397 -5.371 -3.613 65 H LEU 9 HN LEU 9 244.389 -2.421 -2.219 66 HA LEU 9 HA LEU 9 244.227 -0.569 -0.005 67 1HB LEU 9 HB2 LEU 9 246.417 -1.953 0.155 68 2HB LEU 9 HB1 LEU 9 246.932 -1.011 -1.229 69 HG LEU 9 HG LEU 9 246.291 -0.017 1.530 70 1HD1 LEU 9 HD11 LEU 9 248.631 0.942 1.208 71 2HD1 LEU 9 HD12 LEU 9 248.759 -0.170 -0.155 72 3HD1 LEU 9 HD13 LEU 9 248.489 -0.795 1.471 73 1HD2 LEU 9 HD21 LEU 9 246.628 1.516 -1.026 74 2HD2 LEU 9 HD22 LEU 9 246.942 2.237 0.553 75 3HD2 LEU 9 HD23 LEU 9 245.331 1.633 0.164 76 H VAL 10 HN VAL 10 243.232 1.061 -1.098 77 HA VAL 10 HA VAL 10 244.303 1.771 -3.733 78 HB VAL 10 HB VAL 10 242.083 1.167 -4.058 79 1HG1 VAL 10 HG11 VAL 10 240.967 0.839 -2.171 80 2HG1 VAL 10 HG12 VAL 10 240.328 2.443 -2.518 81 3HG1 VAL 10 HG13 VAL 10 241.667 2.254 -1.389 82 1HG2 VAL 10 HG21 VAL 10 241.937 4.140 -3.636 83 2HG2 VAL 10 HG22 VAL 10 240.931 3.178 -4.714 84 3HG2 VAL 10 HG23 VAL 10 242.650 3.361 -5.049 85 H LEU 11 HN LEU 11 245.191 3.628 -4.048 86 HA LEU 11 HA LEU 11 244.681 5.834 -2.173 87 1HB LEU 11 HB2 LEU 11 247.132 4.446 -2.699 88 2HB LEU 11 HB1 LEU 11 247.282 6.088 -3.292 89 HG LEU 11 HG LEU 11 246.818 5.154 -0.471 90 1HD1 LEU 11 HD11 LEU 11 248.662 7.276 -0.622 91 2HD1 LEU 11 HD12 LEU 11 249.050 6.180 -1.949 92 3HD1 LEU 11 HD13 LEU 11 248.991 5.575 -0.293 93 1HD2 LEU 11 HD21 LEU 11 246.039 7.742 -1.700 94 2HD2 LEU 11 HD22 LEU 11 246.735 7.757 -0.080 95 3HD2 LEU 11 HD23 LEU 11 245.272 6.827 -0.403 96 H VAL 12 HN VAL 12 243.622 7.336 -3.307 97 HA VAL 12 HA VAL 12 243.858 7.474 -6.171 98 HB VAL 12 HB VAL 12 242.382 9.396 -4.380 99 1HG1 VAL 12 HG11 VAL 12 240.910 9.303 -6.570 100 2HG1 VAL 12 HG12 VAL 12 242.445 8.829 -7.299 101 3HG1 VAL 12 HG13 VAL 12 242.310 10.369 -6.450 102 1HG2 VAL 12 HG21 VAL 12 241.832 6.596 -5.072 103 2HG2 VAL 12 HG22 VAL 12 240.484 7.701 -5.331 104 3HG2 VAL 12 HG23 VAL 12 241.226 7.575 -3.736 105 H LEU 13 HN LEU 13 245.884 8.123 -6.701 106 HA LEU 13 HA LEU 13 246.702 10.800 -5.788 107 1HB LEU 13 HB2 LEU 13 248.118 8.802 -5.140 108 2HB LEU 13 HB1 LEU 13 248.536 8.673 -6.836 109 HG LEU 13 HG LEU 13 250.177 10.120 -6.537 110 1HD1 LEU 13 HD11 LEU 13 249.691 12.480 -5.795 111 2HD1 LEU 13 HD12 LEU 13 248.005 11.997 -5.687 112 3HD1 LEU 13 HD13 LEU 13 248.848 11.912 -7.230 113 1HD2 LEU 13 HD21 LEU 13 250.110 11.268 -4.057 114 2HD2 LEU 13 HD22 LEU 13 250.870 9.730 -4.458 115 3HD2 LEU 13 HD23 LEU 13 249.229 9.760 -3.814 116 H GLN 14 HN GLN 14 246.527 12.307 -7.277 117 HA GLN 14 HA GLN 14 246.775 11.561 -10.109 118 1HB GLN 14 HB2 GLN 14 245.357 13.334 -10.685 119 2HB GLN 14 HB1 GLN 14 244.639 12.698 -9.215 120 1HG GLN 14 HG2 GLN 14 245.515 14.500 -7.923 121 2HG GLN 14 HG1 GLN 14 246.477 15.073 -9.284 122 1HE2 GLN 14 HE21 GLN 14 243.570 15.344 -7.636 123 2HE2 GLN 14 HE22 GLN 14 242.710 16.303 -8.786 124 HA PRO 15 HA PRO 15 250.590 13.670 -10.591 125 1HB PRO 15 HB2 PRO 15 250.151 15.252 -12.812 126 2HB PRO 15 HB1 PRO 15 250.557 13.534 -12.850 127 1HG PRO 15 HG2 PRO 15 247.883 14.857 -13.064 128 2HG PRO 15 HG1 PRO 15 248.527 13.476 -13.971 129 1HD PRO 15 HD2 PRO 15 246.800 13.124 -11.963 130 2HD PRO 15 HD1 PRO 15 248.140 11.990 -12.227 131 H GLN 16 HN GLN 16 248.600 15.091 -8.841 132 HA GLN 16 HA GLN 16 250.043 17.543 -8.663 133 1HB GLN 16 HB2 GLN 16 247.884 18.938 -8.739 134 2HB GLN 16 HB1 GLN 16 248.595 18.436 -10.266 135 1HG GLN 16 HG2 GLN 16 246.987 16.620 -10.435 136 2HG GLN 16 HG1 GLN 16 246.286 17.088 -8.885 137 1HE2 GLN 16 HE21 GLN 16 246.140 17.458 -12.206 138 2HE2 GLN 16 HE22 GLN 16 245.082 18.823 -12.272 139 H ARG 17 HN ARG 17 247.228 15.686 -7.606 140 HA ARG 17 HA ARG 17 247.927 16.309 -4.839 141 1HB ARG 17 HB2 ARG 17 245.102 16.283 -4.904 142 2HB ARG 17 HB1 ARG 17 246.159 17.627 -4.505 143 1HG ARG 17 HG2 ARG 17 246.269 18.032 -7.038 144 2HG ARG 17 HG1 ARG 17 244.859 16.974 -7.119 145 1HD ARG 17 HD2 ARG 17 243.579 18.430 -5.759 146 2HD ARG 17 HD1 ARG 17 245.001 19.368 -5.306 147 HE ARG 17 HE ARG 17 244.805 19.576 -8.045 148 1HH1 ARG 17 HH11 ARG 17 242.797 20.369 -5.303 149 2HH1 ARG 17 HH12 ARG 17 242.029 21.704 -6.093 150 1HH2 ARG 17 HH21 ARG 17 243.795 21.332 -9.086 151 2HH2 ARG 17 HH22 ARG 17 242.594 22.252 -8.241 152 H VAL 18 HN VAL 18 246.840 14.859 -3.271 153 HA VAL 18 HA VAL 18 246.045 12.287 -4.467 154 HB VAL 18 HB VAL 18 248.325 12.001 -3.787 155 1HG1 VAL 18 HG11 VAL 18 248.131 13.961 -2.101 156 2HG1 VAL 18 HG12 VAL 18 249.250 12.641 -1.764 157 3HG1 VAL 18 HG13 VAL 18 247.686 12.700 -0.951 158 1HG2 VAL 18 HG21 VAL 18 246.739 10.158 -3.321 159 2HG2 VAL 18 HG22 VAL 18 246.562 10.768 -1.675 160 3HG2 VAL 18 HG23 VAL 18 248.126 10.171 -2.230 161 H LEU 19 HN LEU 19 244.802 10.902 -3.033 162 HA LEU 19 HA LEU 19 243.251 12.461 -1.074 163 1HB LEU 19 HB2 LEU 19 242.059 11.607 -3.121 164 2HB LEU 19 HB1 LEU 19 242.367 9.981 -2.541 165 HG LEU 19 HG LEU 19 240.998 10.356 -0.586 166 1HD1 LEU 19 HD11 LEU 19 241.183 13.171 -1.466 167 2HD1 LEU 19 HD12 LEU 19 241.132 12.487 0.159 168 3HD1 LEU 19 HD13 LEU 19 239.646 12.650 -0.776 169 1HD2 LEU 19 HD21 LEU 19 239.492 11.423 -2.963 170 2HD2 LEU 19 HD22 LEU 19 238.868 10.467 -1.619 171 3HD2 LEU 19 HD23 LEU 19 239.957 9.730 -2.794 172 H LEU 20 HN LEU 20 243.684 11.968 0.967 173 HA LEU 20 HA LEU 20 244.526 9.217 1.601 174 1HB LEU 20 HB2 LEU 20 245.555 11.805 2.374 175 2HB LEU 20 HB1 LEU 20 245.122 10.864 3.787 176 HG LEU 20 HG LEU 20 246.934 9.857 1.600 177 1HD1 LEU 20 HD11 LEU 20 247.759 11.881 2.915 178 2HD1 LEU 20 HD12 LEU 20 248.796 10.454 2.888 179 3HD1 LEU 20 HD13 LEU 20 247.810 10.801 4.309 180 1HD2 LEU 20 HD21 LEU 20 247.242 7.973 2.841 181 2HD2 LEU 20 HD22 LEU 20 245.577 8.343 3.289 182 3HD2 LEU 20 HD23 LEU 20 246.900 8.786 4.366 183 H GLY 21 HN GLY 21 243.325 8.029 2.958 184 1HA GLY 21 HA2 GLY 21 240.855 9.203 3.958 185 2HA GLY 21 HA1 GLY 21 241.257 7.493 3.922 186 H MET 22 HN MET 22 240.692 10.008 5.926 187 HA MET 22 HA MET 22 242.509 9.014 8.012 188 1HB MET 22 HB2 MET 22 242.857 11.339 7.755 189 2HB MET 22 HB1 MET 22 241.135 11.666 7.619 190 1HG MET 22 HG2 MET 22 240.784 11.389 9.916 191 2HG MET 22 HG1 MET 22 242.331 10.576 10.142 192 1HE MET 22 HE1 MET 22 244.693 12.025 10.641 193 2HE MET 22 HE2 MET 22 244.868 13.463 9.640 194 3HE MET 22 HE3 MET 22 244.415 11.927 8.904 195 H LYS 23 HN LYS 23 241.672 8.311 9.989 196 HA LYS 23 HA LYS 23 238.861 7.595 9.935 197 1HB LYS 23 HB2 LYS 23 241.267 6.710 11.383 198 2HB LYS 23 HB1 LYS 23 239.789 6.690 12.335 199 1HG LYS 23 HG2 LYS 23 239.539 5.521 9.659 200 2HG LYS 23 HG1 LYS 23 240.642 4.669 10.741 201 1HD LYS 23 HD2 LYS 23 237.838 5.450 11.513 202 2HD LYS 23 HD1 LYS 23 238.247 3.890 10.799 203 1HE LYS 23 HE2 LYS 23 240.051 3.931 12.758 204 2HE LYS 23 HE1 LYS 23 238.831 4.966 13.498 205 1HZ LYS 23 HZ1 LYS 23 237.729 3.145 14.057 206 2HZ LYS 23 HZ2 LYS 23 238.844 2.161 13.252 207 3HZ LYS 23 HZ3 LYS 23 237.503 2.773 12.422 208 H LYS 24 HN LYS 24 237.347 8.264 11.490 209 HA LYS 24 HA LYS 24 238.017 10.828 12.685 210 1HB LYS 24 HB2 LYS 24 235.528 9.487 11.832 211 2HB LYS 24 HB1 LYS 24 235.386 10.494 13.266 212 1HG LYS 24 HG2 LYS 24 235.396 12.346 12.052 213 2HG LYS 24 HG1 LYS 24 236.872 11.860 11.216 214 1HD LYS 24 HD2 LYS 24 235.650 10.664 9.572 215 2HD LYS 24 HD1 LYS 24 234.155 10.784 10.501 216 1HE LYS 24 HE2 LYS 24 235.595 13.222 9.508 217 2HE LYS 24 HE1 LYS 24 234.452 12.347 8.490 218 1HZ LYS 24 HZ1 LYS 24 232.739 12.712 10.139 219 2HZ LYS 24 HZ2 LYS 24 233.403 14.192 9.660 220 3HZ LYS 24 HZ3 LYS 24 233.833 13.515 11.149 221 H ARG 25 HN ARG 25 237.129 7.577 13.620 222 HA ARG 25 HA ARG 25 238.170 7.975 16.224 223 1HB ARG 25 HB2 ARG 25 235.939 7.329 17.362 224 2HB ARG 25 HB1 ARG 25 236.192 9.003 16.888 225 1HG ARG 25 HG2 ARG 25 233.938 8.192 16.352 226 2HG ARG 25 HG1 ARG 25 234.836 8.695 14.918 227 1HD ARG 25 HD2 ARG 25 235.090 6.541 14.154 228 2HD ARG 25 HD1 ARG 25 234.934 5.842 15.765 229 HE ARG 25 HE ARG 25 232.538 7.098 14.759 230 1HH1 ARG 25 HH11 ARG 25 234.377 4.138 14.969 231 2HH1 ARG 25 HH12 ARG 25 233.003 3.120 14.705 232 1HH2 ARG 25 HH21 ARG 25 230.730 5.759 14.413 233 2HH2 ARG 25 HH22 ARG 25 230.932 4.039 14.389 234 H GLY 26 HN GLY 26 238.269 6.047 17.482 235 1HA GLY 26 HA2 GLY 26 237.743 3.692 17.735 236 2HA GLY 26 HA1 GLY 26 237.579 3.599 15.987 237 H PHE 27 HN PHE 27 239.151 2.361 15.211 238 HA PHE 27 HA PHE 27 241.812 2.506 16.431 239 1HB PHE 27 HB2 PHE 27 240.393 0.313 15.855 240 2HB PHE 27 HB1 PHE 27 241.201 0.517 14.304 241 HD1 PHE 27 HD1 PHE 27 241.755 0.039 17.923 242 HD2 PHE 27 HD2 PHE 27 243.477 -0.032 14.032 243 HE1 PHE 27 HE1 PHE 27 243.766 -1.045 18.837 244 HE2 PHE 27 HE2 PHE 27 245.490 -1.118 14.938 245 HZ PHE 27 HZ PHE 27 245.636 -1.626 17.344 246 H GLY 28 HN GLY 28 242.169 4.619 15.396 247 1HA GLY 28 HA2 GLY 28 243.968 4.840 13.515 248 2HA GLY 28 HA1 GLY 28 242.587 4.481 12.495 249 H ALA 29 HN ALA 29 241.188 6.165 14.875 250 HA ALA 29 HA ALA 29 240.491 8.395 13.509 251 1HB ALA 29 HB1 ALA 29 241.063 8.941 16.328 252 2HB ALA 29 HB2 ALA 29 240.051 7.532 16.008 253 3HB ALA 29 HB3 ALA 29 239.572 9.119 15.405 254 H GLY 30 HN GLY 30 241.291 10.425 13.091 255 1HA GLY 30 HA2 GLY 30 242.845 12.086 12.791 256 2HA GLY 30 HA1 GLY 30 243.508 11.608 14.346 257 H ARG 31 HN ARG 31 243.344 9.310 11.741 258 HA ARG 31 HA ARG 31 246.180 9.740 11.125 259 1HB ARG 31 HB2 ARG 31 245.035 6.995 11.646 260 2HB ARG 31 HB1 ARG 31 246.716 7.413 11.352 261 1HG ARG 31 HG2 ARG 31 245.334 8.618 13.694 262 2HG ARG 31 HG1 ARG 31 245.845 6.931 13.772 263 1HD ARG 31 HD2 ARG 31 248.059 8.152 12.739 264 2HD ARG 31 HD1 ARG 31 247.436 9.389 13.830 265 HE ARG 31 HE ARG 31 247.384 7.166 15.355 266 1HH1 ARG 31 HH11 ARG 31 249.875 8.633 13.398 267 2HH1 ARG 31 HH12 ARG 31 251.169 8.055 14.390 268 1HH2 ARG 31 HH21 ARG 31 249.088 6.406 16.662 269 2HH2 ARG 31 HH22 ARG 31 250.724 6.790 16.243 270 H TRP 32 HN TRP 32 246.625 9.625 9.012 271 HA TRP 32 HA TRP 32 244.465 9.070 7.171 272 1HB TRP 32 HB2 TRP 32 247.177 9.552 6.088 273 2HB TRP 32 HB1 TRP 32 245.633 10.239 5.606 274 HD1 TRP 32 HD1 TRP 32 248.432 10.736 8.200 275 HE1 TRP 32 HE1 TRP 32 248.356 13.177 9.011 276 HE3 TRP 32 HE3 TRP 32 244.175 12.258 5.815 277 HZ2 TRP 32 HZ2 TRP 32 246.722 15.449 8.677 278 HZ3 TRP 32 HZ3 TRP 32 243.426 14.582 6.115 279 HH2 TRP 32 HH2 TRP 32 244.673 16.143 7.514 280 H ASN 33 HN ASN 33 244.607 7.553 5.415 281 HA ASN 33 HA ASN 33 246.652 5.667 5.110 282 1HB ASN 33 HB2 ASN 33 245.582 3.670 6.113 283 2HB ASN 33 HB1 ASN 33 246.038 4.866 7.322 284 1HD2 ASN 33 HD21 ASN 33 243.762 2.733 6.653 285 2HD2 ASN 33 HD22 ASN 33 242.369 3.509 7.320 286 H GLY 34 HN GLY 34 246.271 4.245 3.413 287 1HA GLY 34 HA2 GLY 34 244.427 5.025 1.473 288 2HA GLY 34 HA1 GLY 34 245.270 3.483 1.493 289 H PHE 35 HN PHE 35 242.931 3.217 0.441 290 HA PHE 35 HA PHE 35 241.084 2.418 2.587 291 1HB PHE 35 HB2 PHE 35 240.167 2.530 -0.244 292 2HB PHE 35 HB1 PHE 35 239.297 2.909 1.231 293 HD1 PHE 35 HD1 PHE 35 240.989 4.237 -1.583 294 HD2 PHE 35 HD2 PHE 35 239.981 5.062 2.467 295 HE1 PHE 35 HE1 PHE 35 241.358 6.636 -1.983 296 HE2 PHE 35 HE2 PHE 35 240.347 7.462 2.074 297 HZ PHE 35 HZ PHE 35 241.036 8.252 -0.154 298 H GLY 36 HN GLY 36 241.766 0.380 3.076 299 1HA GLY 36 HA2 GLY 36 241.870 -1.548 0.840 300 2HA GLY 36 HA1 GLY 36 242.779 -1.717 2.334 301 H GLY 37 HN GLY 37 241.072 -3.689 1.206 302 1HA GLY 37 HA2 GLY 37 239.197 -3.971 3.448 303 2HA GLY 37 HA1 GLY 37 238.587 -4.158 1.811 304 H LYS 38 HN LYS 38 238.352 -6.209 1.248 305 HA LYS 38 HA LYS 38 240.483 -8.091 1.509 306 1HB LYS 38 HB2 LYS 38 239.396 -9.686 2.961 307 2HB LYS 38 HB1 LYS 38 239.537 -8.147 3.798 308 1HG LYS 38 HG2 LYS 38 237.135 -7.723 2.981 309 2HG LYS 38 HG1 LYS 38 237.094 -9.460 2.677 310 1HD LYS 38 HD2 LYS 38 238.121 -9.394 5.189 311 2HD LYS 38 HD1 LYS 38 237.065 -7.981 5.218 312 1HE LYS 38 HE2 LYS 38 235.163 -9.283 4.659 313 2HE LYS 38 HE1 LYS 38 236.156 -10.683 4.257 314 1HZ LYS 38 HZ1 LYS 38 234.976 -10.695 6.486 315 2HZ LYS 38 HZ2 LYS 38 236.112 -9.545 6.985 316 3HZ LYS 38 HZ3 LYS 38 236.624 -11.080 6.494 317 H VAL 39 HN VAL 39 240.336 -9.625 -0.031 318 HA VAL 39 HA VAL 39 238.185 -9.463 -1.921 319 HB VAL 39 HB VAL 39 240.399 -11.520 -1.840 320 1HG1 VAL 39 HG11 VAL 39 238.978 -10.423 -4.244 321 2HG1 VAL 39 HG12 VAL 39 238.390 -11.839 -3.373 322 3HG1 VAL 39 HG13 VAL 39 239.984 -11.864 -4.126 323 1HG2 VAL 39 HG21 VAL 39 241.647 -9.611 -1.909 324 2HG2 VAL 39 HG22 VAL 39 240.373 -8.677 -2.693 325 3HG2 VAL 39 HG23 VAL 39 241.319 -9.837 -3.627 326 H GLN 40 HN GLN 40 236.269 -10.261 -1.317 327 HA GLN 40 HA GLN 40 235.668 -12.180 0.531 328 1HB GLN 40 HB2 GLN 40 234.292 -11.197 -1.920 329 2HB GLN 40 HB1 GLN 40 233.652 -12.639 -1.145 330 1HG GLN 40 HG2 GLN 40 233.977 -10.972 0.981 331 2HG GLN 40 HG1 GLN 40 233.548 -9.842 -0.304 332 1HE2 GLN 40 HE21 GLN 40 232.545 -13.157 0.474 333 2HE2 GLN 40 HE22 GLN 40 230.851 -12.819 0.509 334 H GLU 41 HN GLU 41 234.607 -14.367 0.032 335 HA GLU 41 HA GLU 41 236.614 -16.070 -1.033 336 1HB GLU 41 HB2 GLU 41 234.916 -16.560 0.837 337 2HB GLU 41 HB1 GLU 41 233.783 -16.914 -0.460 338 1HG GLU 41 HG2 GLU 41 234.737 -18.882 -0.934 339 2HG GLU 41 HG1 GLU 41 236.372 -18.264 -0.699 340 H GLY 42 HN GLY 42 236.460 -14.748 -3.176 341 1HA GLY 42 HA2 GLY 42 236.170 -16.032 -5.361 342 2HA GLY 42 HA1 GLY 42 234.466 -16.009 -4.943 343 H GLU 43 HN GLU 43 236.736 -13.312 -4.480 344 HA GLU 43 HA GLU 43 235.379 -11.915 -6.664 345 1HB GLU 43 HB2 GLU 43 234.913 -10.048 -5.425 346 2HB GLU 43 HB1 GLU 43 234.764 -11.258 -4.163 347 1HG GLU 43 HG2 GLU 43 236.874 -10.696 -3.255 348 2HG GLU 43 HG1 GLU 43 237.294 -9.719 -4.660 349 H THR 44 HN THR 44 236.747 -9.864 -7.191 350 HA THR 44 HA THR 44 239.494 -10.844 -7.430 351 HB THR 44 HB THR 44 239.652 -9.221 -9.295 352 HG1 THR 44 HG1 THR 44 236.862 -8.898 -8.965 353 1HG2 THR 44 HG21 THR 44 239.125 -11.350 -10.041 354 2HG2 THR 44 HG22 THR 44 237.832 -10.362 -10.721 355 3HG2 THR 44 HG23 THR 44 237.538 -11.329 -9.275 356 H ILE 45 HN ILE 45 241.231 -9.673 -6.827 357 HA ILE 45 HA ILE 45 241.080 -8.082 -4.604 358 HB ILE 45 HB ILE 45 243.286 -7.683 -6.607 359 1HG1 ILE 45 HG12 ILE 45 242.957 -10.013 -4.708 360 2HG1 ILE 45 HG11 ILE 45 242.891 -10.102 -6.462 361 1HG2 ILE 45 HG21 ILE 45 242.937 -7.383 -3.673 362 2HG2 ILE 45 HG22 ILE 45 243.697 -6.299 -4.837 363 3HG2 ILE 45 HG23 ILE 45 244.536 -7.759 -4.313 364 1HD1 ILE 45 HD11 ILE 45 245.319 -9.081 -5.051 365 2HD1 ILE 45 HD12 ILE 45 245.169 -9.718 -6.688 366 3HD1 ILE 45 HD13 ILE 45 245.046 -10.804 -5.303 367 H GLU 46 HN GLU 46 240.867 -7.140 -7.974 368 HA GLU 46 HA GLU 46 241.044 -4.313 -7.490 369 1HB GLU 46 HB2 GLU 46 241.506 -5.625 -9.690 370 2HB GLU 46 HB1 GLU 46 239.765 -5.547 -9.914 371 1HG GLU 46 HG2 GLU 46 239.982 -3.040 -9.622 372 2HG GLU 46 HG1 GLU 46 241.722 -3.278 -9.773 373 H ASP 47 HN ASP 47 238.574 -6.732 -7.447 374 HA ASP 47 HA ASP 47 236.389 -4.854 -7.586 375 1HB ASP 47 HB2 ASP 47 236.663 -7.807 -7.318 376 2HB ASP 47 HB1 ASP 47 235.195 -7.079 -6.676 377 H GLY 48 HN GLY 48 238.170 -6.661 -5.167 378 1HA GLY 48 HA2 GLY 48 236.511 -5.963 -2.954 379 2HA GLY 48 HA1 GLY 48 238.159 -6.569 -2.863 380 H ALA 49 HN ALA 49 239.332 -4.498 -4.452 381 HA ALA 49 HA ALA 49 239.667 -2.490 -2.422 382 1HB ALA 49 HB1 ALA 49 241.547 -1.883 -3.543 383 2HB ALA 49 HB2 ALA 49 240.802 -2.082 -5.129 384 3HB ALA 49 HB3 ALA 49 241.357 -3.495 -4.231 385 H ARG 50 HN ARG 50 238.050 -2.789 -5.516 386 HA ARG 50 HA ARG 50 237.444 -0.026 -5.806 387 1HB ARG 50 HB2 ARG 50 236.618 -2.553 -7.138 388 2HB ARG 50 HB1 ARG 50 235.563 -1.159 -7.329 389 1HG ARG 50 HG2 ARG 50 237.683 0.100 -8.035 390 2HG ARG 50 HG1 ARG 50 238.400 -1.501 -8.219 391 1HD ARG 50 HD2 ARG 50 237.449 -0.593 -10.323 392 2HD ARG 50 HD1 ARG 50 236.732 -2.126 -9.829 393 HE ARG 50 HE ARG 50 235.249 0.123 -8.879 394 1HH1 ARG 50 HH11 ARG 50 235.802 -1.908 -11.663 395 2HH1 ARG 50 HH12 ARG 50 234.243 -1.603 -12.352 396 1HH2 ARG 50 HH21 ARG 50 233.198 0.525 -9.784 397 2HH2 ARG 50 HH22 ARG 50 232.765 -0.220 -11.285 398 H ARG 51 HN ARG 51 235.471 -2.832 -4.841 399 HA ARG 51 HA ARG 51 233.175 -1.337 -4.164 400 1HB ARG 51 HB2 ARG 51 234.131 -4.111 -3.687 401 2HB ARG 51 HB1 ARG 51 232.838 -3.520 -2.652 402 1HG ARG 51 HG2 ARG 51 232.655 -3.286 -5.631 403 2HG ARG 51 HG1 ARG 51 232.220 -4.781 -4.800 404 1HD ARG 51 HD2 ARG 51 230.803 -3.154 -3.302 405 2HD ARG 51 HD1 ARG 51 230.912 -2.103 -4.714 406 HE ARG 51 HE ARG 51 230.100 -4.465 -5.756 407 1HH1 ARG 51 HH11 ARG 51 228.918 -2.471 -3.147 408 2HH1 ARG 51 HH12 ARG 51 227.269 -2.960 -3.354 409 1HH2 ARG 51 HH21 ARG 51 227.933 -5.108 -6.030 410 2HH2 ARG 51 HH22 ARG 51 226.710 -4.458 -4.990 411 H GLU 52 HN GLU 52 236.059 -2.169 -2.402 412 HA GLU 52 HA GLU 52 235.000 -1.297 0.146 413 1HB GLU 52 HB2 GLU 52 236.644 -3.152 -0.005 414 2HB GLU 52 HB1 GLU 52 237.836 -2.015 -0.620 415 1HG GLU 52 HG2 GLU 52 238.375 -2.184 1.618 416 2HG GLU 52 HG1 GLU 52 237.406 -0.713 1.554 417 H LEU 53 HN LEU 53 236.575 0.053 -2.562 418 HA LEU 53 HA LEU 53 237.858 2.235 -1.255 419 1HB LEU 53 HB2 LEU 53 238.747 1.613 -3.338 420 2HB LEU 53 HB1 LEU 53 237.168 1.575 -4.100 421 HG LEU 53 HG LEU 53 237.043 4.023 -3.939 422 1HD1 LEU 53 HD11 LEU 53 239.885 4.339 -3.337 423 2HD1 LEU 53 HD12 LEU 53 238.918 3.750 -1.986 424 3HD1 LEU 53 HD13 LEU 53 238.493 5.266 -2.780 425 1HD2 LEU 53 HD21 LEU 53 239.220 4.372 -5.428 426 2HD2 LEU 53 HD22 LEU 53 237.794 3.524 -6.024 427 3HD2 LEU 53 HD23 LEU 53 239.178 2.610 -5.429 428 H GLN 54 HN GLN 54 234.886 1.893 -3.153 429 HA GLN 54 HA GLN 54 234.062 4.569 -3.041 430 1HB GLN 54 HB2 GLN 54 232.911 3.314 -4.601 431 2HB GLN 54 HB1 GLN 54 232.679 1.962 -3.502 432 1HG GLN 54 HG2 GLN 54 230.975 3.184 -2.300 433 2HG GLN 54 HG1 GLN 54 231.255 4.608 -3.302 434 1HE2 GLN 54 HE21 GLN 54 229.605 4.876 -4.616 435 2HE2 GLN 54 HE22 GLN 54 228.803 3.638 -5.515 436 H GLU 55 HN GLU 55 233.858 2.031 -0.685 437 HA GLU 55 HA GLU 55 231.859 3.360 0.908 438 1HB GLU 55 HB2 GLU 55 232.292 1.512 2.527 439 2HB GLU 55 HB1 GLU 55 231.824 0.977 0.919 440 1HG GLU 55 HG2 GLU 55 234.051 0.359 0.388 441 2HG GLU 55 HG1 GLU 55 234.676 1.125 1.848 442 H GLU 56 HN GLU 56 235.320 3.406 0.768 443 HA GLU 56 HA GLU 56 235.644 4.195 3.501 444 1HB GLU 56 HB2 GLU 56 237.406 3.673 1.215 445 2HB GLU 56 HB1 GLU 56 237.996 4.896 2.332 446 1HG GLU 56 HG2 GLU 56 236.991 2.654 3.801 447 2HG GLU 56 HG1 GLU 56 238.146 2.106 2.588 448 H SER 57 HN SER 57 235.717 5.961 0.405 449 HA SER 57 HA SER 57 235.429 8.430 1.986 450 1HB SER 57 HB2 SER 57 237.186 8.037 -0.444 451 2HB SER 57 HB1 SER 57 236.844 9.599 0.301 452 HG SER 57 HG SER 57 237.941 7.431 1.750 453 H GLY 58 HN GLY 58 233.558 6.631 0.383 454 1HA GLY 58 HA2 GLY 58 231.748 6.901 -1.001 455 2HA GLY 58 HA1 GLY 58 231.840 8.602 -0.572 456 H LEU 59 HN LEU 59 234.680 7.408 -2.020 457 HA LEU 59 HA LEU 59 233.941 8.709 -4.546 458 1HB LEU 59 HB2 LEU 59 236.623 8.232 -3.264 459 2HB LEU 59 HB1 LEU 59 236.416 8.858 -4.889 460 HG LEU 59 HG LEU 59 235.890 10.188 -2.266 461 1HD1 LEU 59 HD11 LEU 59 237.470 11.622 -2.963 462 2HD1 LEU 59 HD12 LEU 59 236.845 11.667 -4.611 463 3HD1 LEU 59 HD13 LEU 59 237.891 10.343 -4.101 464 1HD2 LEU 59 HD21 LEU 59 233.764 10.366 -3.471 465 2HD2 LEU 59 HD22 LEU 59 234.614 11.000 -4.881 466 3HD2 LEU 59 HD23 LEU 59 234.585 11.924 -3.379 467 H THR 60 HN THR 60 233.271 7.278 -5.938 468 HA THR 60 HA THR 60 234.382 4.601 -6.023 469 HB THR 60 HB THR 60 232.531 5.376 -8.164 470 HG1 THR 60 HG1 THR 60 230.784 5.744 -6.857 471 1HG2 THR 60 HG21 THR 60 233.115 3.092 -6.560 472 2HG2 THR 60 HG22 THR 60 232.124 3.207 -8.013 473 3HG2 THR 60 HG23 THR 60 231.400 3.473 -6.428 474 H VAL 61 HN VAL 61 235.391 3.720 -7.919 475 HA VAL 61 HA VAL 61 236.522 5.797 -9.679 476 HB VAL 61 HB VAL 61 238.575 4.524 -9.841 477 1HG1 VAL 61 HG11 VAL 61 237.625 5.193 -7.075 478 2HG1 VAL 61 HG12 VAL 61 238.663 6.134 -8.145 479 3HG1 VAL 61 HG13 VAL 61 239.276 4.662 -7.391 480 1HG2 VAL 61 HG21 VAL 61 238.416 2.315 -9.541 481 2HG2 VAL 61 HG22 VAL 61 236.966 2.463 -8.548 482 3HG2 VAL 61 HG23 VAL 61 238.559 2.664 -7.819 483 H ASP 62 HN ASP 62 236.729 5.380 -11.832 484 HA ASP 62 HA ASP 62 235.026 3.300 -12.886 485 1HB ASP 62 HB2 ASP 62 235.537 5.811 -13.734 486 2HB ASP 62 HB1 ASP 62 236.690 4.924 -14.727 487 H ALA 63 HN ALA 63 238.374 3.768 -12.252 488 HA ALA 63 HA ALA 63 239.083 1.131 -12.806 489 1HB ALA 63 HB1 ALA 63 239.014 1.269 -15.075 490 2HB ALA 63 HB2 ALA 63 240.656 1.861 -14.821 491 3HB ALA 63 HB3 ALA 63 239.339 3.002 -15.091 492 H LEU 64 HN LEU 64 240.328 1.183 -10.987 493 HA LEU 64 HA LEU 64 242.119 3.269 -10.290 494 1HB LEU 64 HB2 LEU 64 242.174 0.364 -9.460 495 2HB LEU 64 HB1 LEU 64 243.038 1.673 -8.675 496 HG LEU 64 HG LEU 64 240.288 2.378 -8.768 497 1HD1 LEU 64 HD11 LEU 64 239.510 0.485 -7.247 498 2HD1 LEU 64 HD12 LEU 64 240.856 -0.435 -7.917 499 3HD1 LEU 64 HD13 LEU 64 239.584 0.165 -8.980 500 1HD2 LEU 64 HD21 LEU 64 242.389 2.642 -7.069 501 2HD2 LEU 64 HD22 LEU 64 241.403 1.449 -6.224 502 3HD2 LEU 64 HD23 LEU 64 240.714 3.012 -6.662 503 H HIS 65 HN HIS 65 244.538 2.278 -9.762 504 HA HIS 65 HA HIS 65 245.556 1.099 -12.249 505 1HB HIS 65 HB2 HIS 65 245.784 3.754 -11.841 506 2HB HIS 65 HB1 HIS 65 247.233 3.204 -11.006 507 HD1 HIS 65 HD1 HIS 65 248.258 1.036 -12.824 508 HD2 HIS 65 HD2 HIS 65 246.678 4.606 -14.246 509 HE1 HIS 65 HE1 HIS 65 249.218 1.325 -15.131 510 HE2 HIS 65 HE2 HIS 65 248.318 3.536 -15.935 511 H LYS 66 HN LYS 66 246.186 -0.843 -11.440 512 HA LYS 66 HA LYS 66 247.280 -1.274 -8.879 513 1HB LYS 66 HB2 LYS 66 246.399 -2.919 -10.830 514 2HB LYS 66 HB1 LYS 66 248.132 -3.072 -11.083 515 1HG LYS 66 HG2 LYS 66 248.478 -3.939 -8.925 516 2HG LYS 66 HG1 LYS 66 246.870 -3.452 -8.386 517 1HD LYS 66 HD2 LYS 66 246.639 -5.739 -8.744 518 2HD LYS 66 HD1 LYS 66 246.018 -5.036 -10.239 519 1HE LYS 66 HE2 LYS 66 247.568 -6.991 -10.533 520 2HE LYS 66 HE1 LYS 66 248.025 -5.528 -11.406 521 1HZ LYS 66 HZ1 LYS 66 249.737 -6.895 -9.954 522 2HZ LYS 66 HZ2 LYS 66 249.140 -5.888 -8.733 523 3HZ LYS 66 HZ3 LYS 66 249.841 -5.214 -10.116 524 H VAL 67 HN VAL 67 249.242 -0.765 -8.088 525 HA VAL 67 HA VAL 67 251.466 -0.560 -10.011 526 HB VAL 67 HB VAL 67 252.267 1.498 -8.832 527 1HG1 VAL 67 HG11 VAL 67 249.649 1.575 -10.323 528 2HG1 VAL 67 HG12 VAL 67 251.274 1.723 -10.992 529 3HG1 VAL 67 HG13 VAL 67 250.620 3.004 -9.972 530 1HG2 VAL 67 HG21 VAL 67 250.125 2.731 -7.818 531 2HG2 VAL 67 HG22 VAL 67 251.226 1.768 -6.831 532 3HG2 VAL 67 HG23 VAL 67 249.710 1.068 -7.399 533 H GLY 68 HN GLY 68 250.671 -0.437 -6.531 534 1HA GLY 68 HA2 GLY 68 253.306 -1.623 -5.994 535 2HA GLY 68 HA1 GLY 68 252.301 -0.795 -4.816 536 H GLN 69 HN GLN 69 253.587 -3.452 -4.781 537 HA GLN 69 HA GLN 69 251.180 -4.996 -4.102 538 1HB GLN 69 HB2 GLN 69 252.599 -5.640 -6.286 539 2HB GLN 69 HB1 GLN 69 253.557 -6.490 -5.083 540 1HG GLN 69 HG2 GLN 69 251.790 -7.888 -4.486 541 2HG GLN 69 HG1 GLN 69 250.588 -6.834 -5.229 542 1HE2 GLN 69 HE21 GLN 69 251.384 -6.414 -7.692 543 2HE2 GLN 69 HE22 GLN 69 251.568 -7.884 -8.579 544 H ILE 70 HN ILE 70 251.230 -5.279 -1.952 545 HA ILE 70 HA ILE 70 253.865 -5.708 -0.704 546 HB ILE 70 HB ILE 70 251.468 -4.483 0.635 547 1HG1 ILE 70 HG12 ILE 70 253.762 -2.739 0.198 548 2HG1 ILE 70 HG11 ILE 70 253.040 -3.287 -1.311 549 1HG2 ILE 70 HG21 ILE 70 253.075 -3.842 2.365 550 2HG2 ILE 70 HG22 ILE 70 254.355 -4.668 1.475 551 3HG2 ILE 70 HG23 ILE 70 253.014 -5.592 2.153 552 1HD1 ILE 70 HD11 ILE 70 251.839 -1.639 0.866 553 2HD1 ILE 70 HD12 ILE 70 250.811 -2.563 -0.230 554 3HD1 ILE 70 HD13 ILE 70 251.902 -1.333 -0.869 555 H VAL 71 HN VAL 71 254.030 -7.139 1.002 556 HA VAL 71 HA VAL 71 251.785 -9.007 1.369 557 HB VAL 71 HB VAL 71 254.678 -9.851 1.340 558 1HG1 VAL 71 HG11 VAL 71 253.395 -11.432 2.484 559 2HG1 VAL 71 HG12 VAL 71 253.531 -12.078 0.848 560 3HG1 VAL 71 HG13 VAL 71 252.044 -11.280 1.360 561 1HG2 VAL 71 HG21 VAL 71 252.702 -9.957 -0.937 562 2HG2 VAL 71 HG22 VAL 71 254.283 -10.739 -0.920 563 3HG2 VAL 71 HG23 VAL 71 254.169 -8.980 -0.867 564 H PHE 72 HN PHE 72 251.628 -9.962 3.445 565 HA PHE 72 HA PHE 72 253.413 -8.845 5.491 566 1HB PHE 72 HB2 PHE 72 250.447 -8.644 5.318 567 2HB PHE 72 HB1 PHE 72 251.168 -8.860 6.910 568 HD1 PHE 72 HD1 PHE 72 249.897 -6.471 4.877 569 HD2 PHE 72 HD2 PHE 72 253.449 -7.285 7.074 570 HE1 PHE 72 HE1 PHE 72 250.380 -4.061 4.979 571 HE2 PHE 72 HE2 PHE 72 253.940 -4.876 7.179 572 HZ PHE 72 HZ PHE 72 252.404 -3.261 6.132 573 H GLU 73 HN GLU 73 254.354 -10.425 6.570 574 HA GLU 73 HA GLU 73 253.054 -13.046 6.712 575 1HB GLU 73 HB2 GLU 73 255.351 -13.015 5.891 576 2HB GLU 73 HB1 GLU 73 255.887 -12.203 7.352 577 1HG GLU 73 HG2 GLU 73 255.991 -14.107 8.511 578 2HG GLU 73 HG1 GLU 73 254.468 -14.704 7.853 579 H PHE 74 HN PHE 74 252.295 -13.889 8.573 580 HA PHE 74 HA PHE 74 252.560 -12.223 10.980 581 1HB PHE 74 HB2 PHE 74 250.453 -14.049 9.941 582 2HB PHE 74 HB1 PHE 74 250.648 -13.958 11.688 583 HD1 PHE 74 HD1 PHE 74 249.311 -12.460 12.781 584 HD2 PHE 74 HD2 PHE 74 250.498 -11.618 8.783 585 HE1 PHE 74 HE1 PHE 74 247.972 -10.396 12.823 586 HE2 PHE 74 HE2 PHE 74 249.162 -9.552 8.816 587 HZ PHE 74 HZ PHE 74 247.897 -8.939 10.839 588 H VAL 75 HN VAL 75 253.577 -12.860 12.706 589 HA VAL 75 HA VAL 75 255.096 -15.288 12.621 590 HB VAL 75 HB VAL 75 255.005 -13.910 15.204 591 1HG1 VAL 75 HG11 VAL 75 256.982 -15.016 13.298 592 2HG1 VAL 75 HG12 VAL 75 256.806 -15.285 15.033 593 3HG1 VAL 75 HG13 VAL 75 257.538 -13.793 14.440 594 1HG2 VAL 75 HG21 VAL 75 256.494 -12.038 14.133 595 2HG2 VAL 75 HG22 VAL 75 254.741 -11.861 14.202 596 3HG2 VAL 75 HG23 VAL 75 255.518 -12.373 12.703 597 H GLY 76 HN GLY 76 254.461 -17.211 13.310 598 1HA GLY 76 HA2 GLY 76 253.597 -18.712 14.919 599 2HA GLY 76 HA1 GLY 76 252.649 -17.398 15.599 600 H GLU 77 HN GLU 77 251.881 -16.721 12.697 601 HA GLU 77 HA GLU 77 249.719 -18.708 12.530 602 1HB GLU 77 HB2 GLU 77 249.783 -15.891 11.436 603 2HB GLU 77 HB1 GLU 77 248.412 -16.991 11.391 604 1HG GLU 77 HG2 GLU 77 249.527 -16.476 14.060 605 2HG GLU 77 HG1 GLU 77 248.780 -15.091 13.265 606 HA PRO 78 HA PRO 78 252.027 -20.230 8.943 607 1HB PRO 78 HB2 PRO 78 249.330 -21.458 8.545 608 2HB PRO 78 HB1 PRO 78 250.932 -22.196 8.415 609 1HG PRO 78 HG2 PRO 78 249.419 -22.620 10.562 610 2HG PRO 78 HG1 PRO 78 251.172 -22.398 10.713 611 1HD PRO 78 HD2 PRO 78 248.960 -20.523 11.383 612 2HD PRO 78 HD1 PRO 78 250.552 -20.711 12.142 613 H GLU 79 HN GLU 79 248.883 -18.678 8.979 614 HA GLU 79 HA GLU 79 248.712 -18.291 6.156 615 1HB GLU 79 HB2 GLU 79 247.111 -17.681 8.500 616 2HB GLU 79 HB1 GLU 79 247.129 -16.337 7.368 617 1HG GLU 79 HG2 GLU 79 245.800 -17.390 5.935 618 2HG GLU 79 HG1 GLU 79 246.726 -18.886 6.047 619 H LEU 80 HN LEU 80 248.354 -15.914 5.385 620 HA LEU 80 HA LEU 80 250.307 -14.077 6.541 621 1HB LEU 80 HB2 LEU 80 250.400 -14.363 3.587 622 2HB LEU 80 HB1 LEU 80 251.667 -13.904 4.707 623 HG LEU 80 HG LEU 80 250.704 -16.726 4.723 624 1HD1 LEU 80 HD11 LEU 80 252.908 -16.009 2.871 625 2HD1 LEU 80 HD12 LEU 80 251.249 -15.764 2.325 626 3HD1 LEU 80 HD13 LEU 80 251.785 -17.368 2.825 627 1HD2 LEU 80 HD21 LEU 80 252.735 -17.181 5.688 628 2HD2 LEU 80 HD22 LEU 80 252.464 -15.538 6.267 629 3HD2 LEU 80 HD23 LEU 80 253.537 -15.825 4.898 630 H MET 81 HN MET 81 250.254 -12.236 4.373 631 HA MET 81 HA MET 81 247.446 -11.649 3.927 632 1HB MET 81 HB2 MET 81 249.191 -10.154 5.783 633 2HB MET 81 HB1 MET 81 248.236 -9.172 4.681 634 1HG MET 81 HG2 MET 81 246.200 -10.255 5.467 635 2HG MET 81 HG1 MET 81 247.152 -11.259 6.560 636 1HE MET 81 HE1 MET 81 248.424 -7.450 6.253 637 2HE MET 81 HE2 MET 81 246.958 -6.681 6.862 638 3HE MET 81 HE3 MET 81 246.901 -7.649 5.388 639 H ASP 82 HN ASP 82 247.369 -11.364 1.792 640 HA ASP 82 HA ASP 82 249.630 -10.055 0.454 641 1HB ASP 82 HB2 ASP 82 248.966 -12.222 -0.464 642 2HB ASP 82 HB1 ASP 82 247.316 -11.648 -0.684 643 H VAL 83 HN VAL 83 249.346 -7.895 0.554 644 HA VAL 83 HA VAL 83 246.685 -6.777 -0.038 645 HB VAL 83 HB VAL 83 249.075 -5.320 1.090 646 1HG1 VAL 83 HG11 VAL 83 246.292 -4.456 1.587 647 2HG1 VAL 83 HG12 VAL 83 246.913 -4.240 -0.050 648 3HG1 VAL 83 HG13 VAL 83 247.749 -3.500 1.316 649 1HG2 VAL 83 HG21 VAL 83 248.726 -6.669 2.871 650 2HG2 VAL 83 HG22 VAL 83 247.074 -7.058 2.391 651 3HG2 VAL 83 HG23 VAL 83 247.423 -5.525 3.191 652 H HIS 84 HN HIS 84 246.329 -6.019 -1.989 653 HA HIS 84 HA HIS 84 248.581 -5.348 -3.723 654 1HB HIS 84 HB2 HIS 84 245.799 -6.230 -4.129 655 2HB HIS 84 HB1 HIS 84 246.338 -4.989 -5.255 656 HD1 HIS 84 HD1 HIS 84 247.870 -5.706 -7.118 657 HD2 HIS 84 HD2 HIS 84 247.342 -8.660 -4.244 658 HE1 HIS 84 HE1 HIS 84 248.938 -7.772 -8.074 659 HE2 HIS 84 HE2 HIS 84 248.537 -9.567 -6.351 660 H VAL 85 HN VAL 85 248.826 -3.311 -4.675 661 HA VAL 85 HA VAL 85 247.330 -1.173 -3.312 662 HB VAL 85 HB VAL 85 249.982 -0.936 -4.748 663 1HG1 VAL 85 HG11 VAL 85 250.047 1.248 -4.105 664 2HG1 VAL 85 HG12 VAL 85 249.044 0.974 -2.680 665 3HG1 VAL 85 HG13 VAL 85 248.303 1.054 -4.278 666 1HG2 VAL 85 HG21 VAL 85 250.542 -0.571 -2.114 667 2HG2 VAL 85 HG22 VAL 85 250.784 -2.082 -2.990 668 3HG2 VAL 85 HG23 VAL 85 249.320 -1.840 -2.037 669 H PHE 86 HN PHE 86 246.173 0.248 -4.474 670 HA PHE 86 HA PHE 86 246.426 0.240 -7.398 671 1HB PHE 86 HB2 PHE 86 244.115 -0.568 -5.755 672 2HB PHE 86 HB1 PHE 86 243.724 0.601 -7.010 673 HD1 PHE 86 HD1 PHE 86 244.245 0.047 -9.395 674 HD2 PHE 86 HD2 PHE 86 244.515 -2.825 -6.266 675 HE1 PHE 86 HE1 PHE 86 244.158 -1.766 -11.056 676 HE2 PHE 86 HE2 PHE 86 244.431 -4.643 -7.921 677 HZ PHE 86 HZ PHE 86 244.252 -4.115 -10.320 678 H CYS 87 HN CYS 87 246.582 2.261 -8.176 679 HA CYS 87 HA CYS 87 245.626 4.463 -6.465 680 1HB CYS 87 HB2 CYS 87 247.977 4.188 -8.292 681 2HB CYS 87 HB1 CYS 87 247.231 5.774 -8.132 682 HG CYS 87 HG CYS 87 247.747 4.917 -5.389 683 H THR 88 HN THR 88 243.780 5.333 -7.198 684 HA THR 88 HA THR 88 243.067 4.942 -9.999 685 HB THR 88 HB THR 88 241.481 4.328 -8.172 686 HG1 THR 88 HG1 THR 88 240.626 4.719 -10.191 687 1HG2 THR 88 HG21 THR 88 242.052 6.816 -7.145 688 2HG2 THR 88 HG22 THR 88 240.773 5.718 -6.627 689 3HG2 THR 88 HG23 THR 88 240.428 6.976 -7.815 690 H ASP 89 HN ASP 89 241.399 6.937 -10.562 691 HA ASP 89 HA ASP 89 242.465 9.528 -9.946 692 1HB ASP 89 HB2 ASP 89 243.970 8.407 -11.786 693 2HB ASP 89 HB1 ASP 89 242.629 8.814 -12.853 694 H SER 90 HN SER 90 240.546 7.604 -12.203 695 HA SER 90 HA SER 90 238.647 9.757 -12.591 696 1HB SER 90 HB2 SER 90 239.444 7.638 -14.162 697 2HB SER 90 HB1 SER 90 237.887 7.081 -13.548 698 HG SER 90 HG SER 90 237.184 8.264 -15.157 699 H ILE 91 HN ILE 91 237.533 10.131 -10.717 700 HA ILE 91 HA ILE 91 236.321 7.822 -9.382 701 HB ILE 91 HB ILE 91 235.880 9.294 -7.474 702 1HG1 ILE 91 HG12 ILE 91 237.423 11.436 -8.949 703 2HG1 ILE 91 HG11 ILE 91 235.663 11.380 -8.913 704 1HG2 ILE 91 HG21 ILE 91 238.236 8.198 -8.146 705 2HG2 ILE 91 HG22 ILE 91 237.969 9.075 -6.640 706 3HG2 ILE 91 HG23 ILE 91 238.725 9.888 -8.011 707 1HD1 ILE 91 HD11 ILE 91 235.765 11.504 -6.440 708 2HD1 ILE 91 HD12 ILE 91 236.432 12.919 -7.253 709 3HD1 ILE 91 HD13 ILE 91 237.512 11.708 -6.565 710 H GLN 92 HN GLN 92 234.140 8.574 -8.232 711 HA GLN 92 HA GLN 92 232.470 10.026 -10.148 712 1HB GLN 92 HB2 GLN 92 231.968 7.222 -9.165 713 2HB GLN 92 HB1 GLN 92 230.727 8.217 -9.910 714 1HG GLN 92 HG2 GLN 92 233.315 7.692 -11.313 715 2HG GLN 92 HG1 GLN 92 231.999 6.519 -11.359 716 1HE2 GLN 92 HE21 GLN 92 229.786 7.842 -11.694 717 2HE2 GLN 92 HE22 GLN 92 229.811 8.838 -13.105 718 H GLY 93 HN GLY 93 232.069 8.089 -7.187 719 1HA GLY 93 HA2 GLY 93 229.990 9.550 -6.080 720 2HA GLY 93 HA1 GLY 93 231.145 8.608 -5.153 721 H THR 94 HN THR 94 230.493 10.493 -3.665 722 HA THR 94 HA THR 94 232.333 12.740 -4.107 723 HB THR 94 HB THR 94 230.165 13.107 -2.161 724 HG1 THR 94 HG1 THR 94 228.794 12.218 -3.530 725 1HG2 THR 94 HG21 THR 94 230.834 15.188 -2.531 726 2HG2 THR 94 HG22 THR 94 229.991 15.082 -4.076 727 3HG2 THR 94 HG23 THR 94 231.716 14.728 -3.987 728 HA PRO 95 HA PRO 95 234.485 11.796 -0.414 729 1HB PRO 95 HB2 PRO 95 234.437 14.615 0.423 730 2HB PRO 95 HB1 PRO 95 235.813 13.616 -0.054 731 1HG PRO 95 HG2 PRO 95 234.902 15.602 -1.605 732 2HG PRO 95 HG1 PRO 95 235.562 14.104 -2.286 733 1HD PRO 95 HD2 PRO 95 232.702 14.920 -1.926 734 2HD PRO 95 HD1 PRO 95 233.481 14.140 -3.320 735 H VAL 96 HN VAL 96 232.106 11.047 -0.032 736 HA VAL 96 HA VAL 96 230.613 12.509 1.932 737 HB VAL 96 HB VAL 96 230.281 9.575 1.334 738 1HG1 VAL 96 HG11 VAL 96 228.452 11.751 2.316 739 2HG1 VAL 96 HG12 VAL 96 228.945 10.279 3.154 740 3HG1 VAL 96 HG13 VAL 96 227.872 10.183 1.757 741 1HG2 VAL 96 HG21 VAL 96 230.077 10.207 -0.823 742 2HG2 VAL 96 HG22 VAL 96 229.777 11.897 -0.414 743 3HG2 VAL 96 HG23 VAL 96 228.472 10.716 -0.299 744 H GLU 97 HN GLU 97 232.846 12.580 3.124 745 HA GLU 97 HA GLU 97 233.939 10.550 4.586 746 1HB GLU 97 HB2 GLU 97 234.666 12.199 6.183 747 2HB GLU 97 HB1 GLU 97 234.694 12.927 4.583 748 1HG GLU 97 HG2 GLU 97 232.266 13.698 5.294 749 2HG GLU 97 HG1 GLU 97 232.953 13.512 6.907 750 H SER 98 HN SER 98 233.066 9.057 5.855 751 HA SER 98 HA SER 98 230.499 9.525 7.122 752 1HB SER 98 HB2 SER 98 232.179 7.152 6.512 753 2HB SER 98 HB1 SER 98 231.138 7.040 7.931 754 HG SER 98 HG SER 98 230.184 7.889 5.406 755 H ASP 99 HN ASP 99 230.428 8.292 9.416 756 HA ASP 99 HA ASP 99 231.825 10.003 11.190 757 1HB ASP 99 HB2 ASP 99 230.251 7.480 11.737 758 2HB ASP 99 HB1 ASP 99 230.812 8.602 12.973 759 H GLU 100 HN GLU 100 232.818 7.184 9.614 760 HA GLU 100 HA GLU 100 234.853 6.663 11.676 761 1HB GLU 100 HB2 GLU 100 233.144 4.899 10.230 762 2HB GLU 100 HB1 GLU 100 234.802 4.570 9.745 763 1HG GLU 100 HG2 GLU 100 235.452 4.137 11.994 764 2HG GLU 100 HG1 GLU 100 233.900 4.703 12.609 765 H MET 101 HN MET 101 234.308 7.455 8.323 766 HA MET 101 HA MET 101 237.225 7.499 7.909 767 1HB MET 101 HB2 MET 101 235.176 6.313 6.354 768 2HB MET 101 HB1 MET 101 235.803 7.671 5.430 769 1HG MET 101 HG2 MET 101 236.938 5.541 4.939 770 2HG MET 101 HG1 MET 101 238.028 6.793 5.532 771 1HE MET 101 HE1 MET 101 239.873 5.684 6.174 772 2HE MET 101 HE2 MET 101 240.084 4.594 7.545 773 3HE MET 101 HE3 MET 101 239.665 6.285 7.818 774 H ARG 102 HN ARG 102 238.061 9.182 6.515 775 HA ARG 102 HA ARG 102 236.492 11.491 5.903 776 1HB ARG 102 HB2 ARG 102 236.788 11.764 8.358 777 2HB ARG 102 HB1 ARG 102 238.531 11.730 8.129 778 1HG ARG 102 HG2 ARG 102 238.225 13.732 6.601 779 2HG ARG 102 HG1 ARG 102 236.580 13.827 7.231 780 1HD ARG 102 HD2 ARG 102 238.038 13.607 9.523 781 2HD ARG 102 HD1 ARG 102 239.133 14.530 8.494 782 HE ARG 102 HE ARG 102 236.807 15.501 9.755 783 1HH1 ARG 102 HH11 ARG 102 238.532 15.708 6.728 784 2HH1 ARG 102 HH12 ARG 102 237.946 17.295 6.359 785 1HH2 ARG 102 HH21 ARG 102 236.035 17.588 9.271 786 2HH2 ARG 102 HH22 ARG 102 236.529 18.363 7.803 787 HA PRO 103 HA PRO 103 240.181 11.037 3.251 788 1HB PRO 103 HB2 PRO 103 239.082 12.084 1.026 789 2HB PRO 103 HB1 PRO 103 238.766 10.420 1.536 790 1HG PRO 103 HG2 PRO 103 237.092 12.874 1.942 791 2HG PRO 103 HG1 PRO 103 236.593 11.260 1.398 792 1HD PRO 103 HD2 PRO 103 236.283 12.084 3.961 793 2HD PRO 103 HD1 PRO 103 236.619 10.392 3.545 794 H CYS 104 HN CYS 104 241.584 12.546 2.239 795 HA CYS 104 HA CYS 104 240.977 15.378 2.551 796 1HB CYS 104 HB2 CYS 104 242.368 14.129 4.544 797 2HB CYS 104 HB1 CYS 104 243.674 14.684 3.503 798 HG CYS 104 HG CYS 104 242.664 17.137 3.806 799 H TRP 105 HN TRP 105 241.471 16.325 0.706 800 HA TRP 105 HA TRP 105 243.253 15.030 -1.172 801 1HB TRP 105 HB2 TRP 105 241.659 17.589 -1.436 802 2HB TRP 105 HB1 TRP 105 242.498 16.759 -2.742 803 HD1 TRP 105 HD1 TRP 105 239.975 15.432 -0.081 804 HE1 TRP 105 HE1 TRP 105 238.126 14.136 -1.324 805 HE3 TRP 105 HE3 TRP 105 241.571 16.162 -4.885 806 HZ2 TRP 105 HZ2 TRP 105 237.442 13.514 -3.990 807 HZ3 TRP 105 HZ3 TRP 105 240.261 15.182 -6.722 808 HH2 TRP 105 HH2 TRP 105 238.240 13.886 -6.284 809 H PHE 106 HN PHE 106 245.370 15.322 -0.896 810 HA PHE 106 HA PHE 106 246.334 18.031 -0.240 811 1HB PHE 106 HB2 PHE 106 247.384 15.331 0.603 812 2HB PHE 106 HB1 PHE 106 248.354 16.793 0.720 813 HD1 PHE 106 HD1 PHE 106 246.399 18.770 1.620 814 HD2 PHE 106 HD2 PHE 106 246.927 14.708 2.774 815 HE1 PHE 106 HE1 PHE 106 245.392 19.265 3.809 816 HE2 PHE 106 HE2 PHE 106 245.921 15.196 4.966 817 HZ PHE 106 HZ PHE 106 245.152 17.477 5.486 818 H GLN 107 HN GLN 107 249.009 17.714 -0.720 819 HA GLN 107 HA GLN 107 249.041 17.608 -3.614 820 1HB GLN 107 HB2 GLN 107 251.402 18.176 -1.836 821 2HB GLN 107 HB1 GLN 107 251.144 18.682 -3.502 822 1HG GLN 107 HG2 GLN 107 249.313 20.142 -2.746 823 2HG GLN 107 HG1 GLN 107 249.656 19.674 -1.081 824 1HE2 GLN 107 HE21 GLN 107 249.932 21.997 -0.801 825 2HE2 GLN 107 HE22 GLN 107 251.467 22.706 -1.159 826 H LEU 108 HN LEU 108 250.475 16.353 -4.846 827 HA LEU 108 HA LEU 108 250.787 13.676 -3.925 828 1HB LEU 108 HB2 LEU 108 251.476 13.165 -6.110 829 2HB LEU 108 HB1 LEU 108 250.330 14.476 -6.307 830 HG LEU 108 HG LEU 108 253.335 14.780 -6.369 831 1HD1 LEU 108 HD11 LEU 108 252.985 13.775 -8.377 832 2HD1 LEU 108 HD12 LEU 108 252.582 15.431 -8.828 833 3HD1 LEU 108 HD13 LEU 108 251.297 14.279 -8.463 834 1HD2 LEU 108 HD21 LEU 108 252.799 17.034 -7.246 835 2HD2 LEU 108 HD22 LEU 108 252.275 16.794 -5.580 836 3HD2 LEU 108 HD23 LEU 108 251.098 16.733 -6.892 837 H ASP 109 HN ASP 109 252.691 16.394 -3.501 838 HA ASP 109 HA ASP 109 255.062 14.726 -3.000 839 1HB ASP 109 HB2 ASP 109 254.946 17.657 -3.756 840 2HB ASP 109 HB1 ASP 109 256.414 16.775 -3.346 841 H GLN 110 HN GLN 110 252.669 15.478 -1.332 842 HA GLN 110 HA GLN 110 254.205 16.384 0.966 843 1HB GLN 110 HB2 GLN 110 251.583 17.604 0.106 844 2HB GLN 110 HB1 GLN 110 252.362 17.901 1.654 845 1HG GLN 110 HG2 GLN 110 253.744 18.458 -0.947 846 2HG GLN 110 HG1 GLN 110 252.675 19.633 -0.182 847 1HE2 GLN 110 HE21 GLN 110 255.777 18.231 -0.222 848 2HE2 GLN 110 HE22 GLN 110 256.445 19.100 1.113 849 H ILE 111 HN ILE 111 252.758 13.857 -0.081 850 HA ILE 111 HA ILE 111 250.684 13.439 1.861 851 HB ILE 111 HB ILE 111 251.816 10.911 1.108 852 1HG1 ILE 111 HG12 ILE 111 251.144 11.099 -1.350 853 2HG1 ILE 111 HG11 ILE 111 251.335 12.841 -1.153 854 1HG2 ILE 111 HG21 ILE 111 249.351 12.048 1.587 855 2HG2 ILE 111 HG22 ILE 111 249.685 10.375 1.143 856 3HG2 ILE 111 HG23 ILE 111 249.287 11.556 -0.104 857 1HD1 ILE 111 HD11 ILE 111 253.404 12.296 -1.917 858 2HD1 ILE 111 HD12 ILE 111 253.366 10.685 -1.201 859 3HD1 ILE 111 HD13 ILE 111 253.677 12.094 -0.187 860 HA PRO 112 HA PRO 112 253.542 12.388 5.107 861 1HB PRO 112 HB2 PRO 112 251.878 12.682 7.149 862 2HB PRO 112 HB1 PRO 112 252.328 14.085 6.169 863 1HG PRO 112 HG2 PRO 112 249.810 12.474 6.126 864 2HG PRO 112 HG1 PRO 112 250.024 14.223 5.940 865 1HD PRO 112 HD2 PRO 112 249.721 12.357 3.867 866 2HD PRO 112 HD1 PRO 112 250.277 14.033 3.697 867 H PHE 113 HN PHE 113 253.988 10.232 4.713 868 HA PHE 113 HA PHE 113 252.059 8.186 5.281 869 1HB PHE 113 HB2 PHE 113 254.905 7.407 5.167 870 2HB PHE 113 HB1 PHE 113 253.510 6.696 4.376 871 HD1 PHE 113 HD1 PHE 113 256.266 7.151 3.254 872 HD2 PHE 113 HD2 PHE 113 252.708 9.484 3.049 873 HE1 PHE 113 HE1 PHE 113 257.020 8.091 1.122 874 HE2 PHE 113 HE2 PHE 113 253.469 10.435 0.915 875 HZ PHE 113 HZ PHE 113 255.622 9.746 -0.056 876 H LYS 114 HN LYS 114 254.285 9.992 7.135 877 HA LYS 114 HA LYS 114 254.946 8.135 9.138 878 1HB LYS 114 HB2 LYS 114 254.664 11.145 9.294 879 2HB LYS 114 HB1 LYS 114 255.403 10.142 10.534 880 1HG LYS 114 HG2 LYS 114 257.069 9.398 8.829 881 2HG LYS 114 HG1 LYS 114 256.388 10.600 7.730 882 1HD LYS 114 HD2 LYS 114 257.545 11.206 10.450 883 2HD LYS 114 HD1 LYS 114 258.406 11.401 8.923 884 1HE LYS 114 HE2 LYS 114 256.859 13.075 8.190 885 2HE LYS 114 HE1 LYS 114 255.801 12.772 9.567 886 1HZ LYS 114 HZ1 LYS 114 257.372 13.702 11.040 887 2HZ LYS 114 HZ2 LYS 114 257.262 14.781 9.742 888 3HZ LYS 114 HZ3 LYS 114 258.588 13.737 9.863 889 H ASP 115 HN ASP 115 252.154 10.073 8.465 890 HA ASP 115 HA ASP 115 250.935 9.269 10.983 891 1HB ASP 115 HB2 ASP 115 250.296 11.408 8.980 892 2HB ASP 115 HB1 ASP 115 249.062 10.854 10.106 893 H MET 116 HN MET 116 251.456 7.464 8.762 894 HA MET 116 HA MET 116 248.716 6.529 8.298 895 1HB MET 116 HB2 MET 116 250.882 7.010 6.298 896 2HB MET 116 HB1 MET 116 249.799 5.652 6.045 897 1HG MET 116 HG2 MET 116 248.070 6.961 5.484 898 2HG MET 116 HG1 MET 116 248.481 8.194 6.673 899 1HE MET 116 HE1 MET 116 250.981 7.860 2.819 900 2HE MET 116 HE2 MET 116 249.642 6.743 3.079 901 3HE MET 116 HE3 MET 116 251.015 6.744 4.185 902 H TRP 117 HN TRP 117 249.158 4.182 7.063 903 HA TRP 117 HA TRP 117 249.906 2.445 9.088 904 1HB TRP 117 HB2 TRP 117 249.252 2.226 6.242 905 2HB TRP 117 HB1 TRP 117 250.351 0.970 6.801 906 HD1 TRP 117 HD1 TRP 117 248.848 -1.099 7.066 907 HE1 TRP 117 HE1 TRP 117 246.667 -1.626 8.327 908 HE3 TRP 117 HE3 TRP 117 247.676 3.613 8.665 909 HZ2 TRP 117 HZ2 TRP 117 244.708 -0.229 9.803 910 HZ3 TRP 117 HZ3 TRP 117 245.632 3.932 9.997 911 HH2 TRP 117 HH2 TRP 117 244.179 2.049 10.553 912 HA PRO 118 HA PRO 118 254.305 2.101 8.764 913 1HB PRO 118 HB2 PRO 118 254.786 -0.398 9.517 914 2HB PRO 118 HB1 PRO 118 253.971 0.727 10.611 915 1HG PRO 118 HG2 PRO 118 252.803 -1.442 8.912 916 2HG PRO 118 HG1 PRO 118 252.403 -0.987 10.578 917 1HD PRO 118 HD2 PRO 118 250.987 -0.200 8.324 918 2HD PRO 118 HD1 PRO 118 250.937 0.619 9.898 919 H ASP 119 HN ASP 119 252.594 1.112 6.273 920 HA ASP 119 HA ASP 119 254.873 -0.212 4.958 921 1HB ASP 119 HB2 ASP 119 253.010 -1.161 3.413 922 2HB ASP 119 HB1 ASP 119 253.268 -1.899 4.990 923 H ASP 120 HN ASP 120 252.542 2.329 4.884 924 HA ASP 120 HA ASP 120 252.227 3.058 2.298 925 1HB ASP 120 HB2 ASP 120 252.816 4.872 4.634 926 2HB ASP 120 HB1 ASP 120 252.172 5.416 3.087 927 H SER 121 HN SER 121 254.958 4.246 4.268 928 HA SER 121 HA SER 121 256.311 5.530 2.182 929 1HB SER 121 HB2 SER 121 258.198 5.634 3.664 930 2HB SER 121 HB1 SER 121 256.743 5.799 4.648 931 HG SER 121 HG SER 121 256.999 3.748 5.381 932 H TYR 122 HN TYR 122 255.996 2.173 2.801 933 HA TYR 122 HA TYR 122 258.456 1.433 1.502 934 1HB TYR 122 HB2 TYR 122 256.144 -0.231 2.504 935 2HB TYR 122 HB1 TYR 122 257.639 -0.888 1.846 936 HD1 TYR 122 HD1 TYR 122 259.574 -1.089 3.191 937 HD2 TYR 122 HD2 TYR 122 256.244 1.144 4.611 938 HE1 TYR 122 HE1 TYR 122 260.614 -0.960 5.415 939 HE2 TYR 122 HE2 TYR 122 257.273 1.275 6.840 940 HH TYR 122 HH TYR 122 259.840 1.143 7.692 941 H TRP 123 HN TRP 123 255.216 2.072 0.482 942 HA TRP 123 HA TRP 123 255.922 0.899 -2.111 943 1HB TRP 123 HB2 TRP 123 253.578 0.299 -2.488 944 2HB TRP 123 HB1 TRP 123 254.246 -0.510 -1.077 945 HD1 TRP 123 HD1 TRP 123 253.228 0.111 1.293 946 HE1 TRP 123 HE1 TRP 123 251.062 1.322 1.985 947 HE3 TRP 123 HE3 TRP 123 252.004 2.221 -3.200 948 HZ2 TRP 123 HZ2 TRP 123 249.093 2.964 0.779 949 HZ3 TRP 123 HZ3 TRP 123 249.964 3.588 -3.343 950 HH2 TRP 123 HH2 TRP 123 248.543 3.943 -1.398 951 H PHE 124 HN PHE 124 255.084 3.750 -0.535 952 HA PHE 124 HA PHE 124 253.630 4.947 -2.689 953 1HB PHE 124 HB2 PHE 124 253.881 5.584 -0.064 954 2HB PHE 124 HB1 PHE 124 255.001 6.736 -0.777 955 HD1 PHE 124 HD1 PHE 124 252.852 7.866 0.643 956 HD2 PHE 124 HD2 PHE 124 252.832 6.401 -3.351 957 HE1 PHE 124 HE1 PHE 124 250.977 9.343 0.118 958 HE2 PHE 124 HE2 PHE 124 250.945 7.878 -3.880 959 HZ PHE 124 HZ PHE 124 250.014 9.355 -2.143 960 HA PRO 125 HA PRO 125 258.088 7.188 -3.132 961 1HB PRO 125 HB2 PRO 125 259.525 4.606 -2.674 962 2HB PRO 125 HB1 PRO 125 260.056 6.262 -2.353 963 1HG PRO 125 HG2 PRO 125 259.217 4.711 -0.368 964 2HG PRO 125 HG1 PRO 125 258.796 6.432 -0.413 965 1HD PRO 125 HD2 PRO 125 257.102 4.052 -0.983 966 2HD PRO 125 HD1 PRO 125 256.649 5.623 -0.292 967 H LEU 126 HN LEU 126 257.437 3.804 -4.012 968 HA LEU 126 HA LEU 126 258.715 4.059 -6.570 969 1HB LEU 126 HB2 LEU 126 257.462 1.845 -7.002 970 2HB LEU 126 HB1 LEU 126 258.759 1.867 -5.823 971 HG LEU 126 HG LEU 126 256.258 2.427 -4.520 972 1HD1 LEU 126 HD11 LEU 126 256.119 -0.348 -5.427 973 2HD1 LEU 126 HD12 LEU 126 255.788 0.841 -6.687 974 3HD1 LEU 126 HD13 LEU 126 254.837 0.841 -5.203 975 1HD2 LEU 126 HD21 LEU 126 257.784 1.601 -3.071 976 2HD2 LEU 126 HD22 LEU 126 258.557 0.591 -4.293 977 3HD2 LEU 126 HD23 LEU 126 257.053 0.064 -3.537 978 H LEU 127 HN LEU 127 255.501 4.428 -5.285 979 HA LEU 127 HA LEU 127 254.060 4.383 -7.704 980 1HB LEU 127 HB2 LEU 127 253.510 5.888 -5.144 981 2HB LEU 127 HB1 LEU 127 252.363 5.705 -6.453 982 HG LEU 127 HG LEU 127 252.898 3.962 -4.243 983 1HD1 LEU 127 HD11 LEU 127 250.689 4.631 -4.862 984 2HD1 LEU 127 HD12 LEU 127 250.817 2.886 -5.083 985 3HD1 LEU 127 HD13 LEU 127 250.885 3.958 -6.480 986 1HD2 LEU 127 HD21 LEU 127 253.242 2.742 -6.977 987 2HD2 LEU 127 HD22 LEU 127 252.844 1.818 -5.529 988 3HD2 LEU 127 HD23 LEU 127 254.373 2.690 -5.625 989 H LEU 128 HN LEU 128 255.384 7.049 -5.796 990 HA LEU 128 HA LEU 128 254.719 9.113 -7.594 991 1HB LEU 128 HB2 LEU 128 256.584 8.806 -5.301 992 2HB LEU 128 HB1 LEU 128 256.857 10.160 -6.381 993 HG LEU 128 HG LEU 128 254.122 9.717 -5.258 994 1HD1 LEU 128 HD11 LEU 128 255.188 9.673 -3.223 995 2HD1 LEU 128 HD12 LEU 128 254.965 11.407 -3.454 996 3HD1 LEU 128 HD13 LEU 128 256.533 10.669 -3.783 997 1HD2 LEU 128 HD21 LEU 128 253.753 11.887 -5.842 998 2HD2 LEU 128 HD22 LEU 128 254.986 11.482 -7.038 999 3HD2 LEU 128 HD23 LEU 128 255.431 12.361 -5.575 1000 H GLN 129 HN GLN 129 257.252 6.764 -7.580 1001 HA GLN 129 HA GLN 129 258.911 8.188 -9.473 1002 1HB GLN 129 HB2 GLN 129 259.186 5.892 -7.737 1003 2HB GLN 129 HB1 GLN 129 259.748 5.516 -9.358 1004 1HG GLN 129 HG2 GLN 129 261.645 6.294 -8.286 1005 2HG GLN 129 HG1 GLN 129 261.080 7.696 -9.193 1006 1HE2 GLN 129 HE21 GLN 129 261.807 6.412 -6.125 1007 2HE2 GLN 129 HE22 GLN 129 261.373 7.793 -5.182 1008 H LYS 130 HN LYS 130 256.045 6.698 -9.822 1009 HA LYS 130 HA LYS 130 254.883 5.847 -11.563 1010 1HB LYS 130 HB2 LYS 130 255.281 6.793 -13.583 1011 2HB LYS 130 HB1 LYS 130 256.415 7.761 -12.657 1012 1HG LYS 130 HG2 LYS 130 258.009 5.697 -13.349 1013 2HG LYS 130 HG1 LYS 130 256.903 5.721 -14.720 1014 1HD LYS 130 HD2 LYS 130 258.617 7.159 -15.373 1015 2HD LYS 130 HD1 LYS 130 257.363 8.251 -14.781 1016 1HE LYS 130 HE2 LYS 130 258.540 8.265 -12.572 1017 2HE LYS 130 HE1 LYS 130 259.849 7.357 -13.329 1018 1HZ LYS 130 HZ1 LYS 130 259.808 9.298 -15.018 1019 2HZ LYS 130 HZ2 LYS 130 260.569 9.516 -13.524 1020 3HZ LYS 130 HZ3 LYS 130 259.021 10.143 -13.783 1021 H LYS 131 HN LYS 131 256.951 4.234 -10.101 1022 HA LYS 131 HA LYS 131 257.244 2.089 -12.101 1023 1HB LYS 131 HB2 LYS 131 259.050 2.899 -9.832 1024 2HB LYS 131 HB1 LYS 131 259.137 1.299 -10.557 1025 1HG LYS 131 HG2 LYS 131 259.239 3.622 -12.389 1026 2HG LYS 131 HG1 LYS 131 260.647 3.326 -11.367 1027 1HD LYS 131 HD2 LYS 131 261.132 1.327 -12.381 1028 2HD LYS 131 HD1 LYS 131 259.454 1.030 -12.840 1029 1HE LYS 131 HE2 LYS 131 259.647 2.168 -14.781 1030 2HE LYS 131 HE1 LYS 131 260.721 3.379 -14.085 1031 1HZ LYS 131 HZ1 LYS 131 261.816 0.700 -14.385 1032 2HZ LYS 131 HZ2 LYS 131 262.549 2.203 -14.636 1033 3HZ LYS 131 HZ3 LYS 131 261.532 1.551 -15.818 1034 H LYS 132 HN LYS 132 257.131 -0.109 -11.249 1035 HA LYS 132 HA LYS 132 255.294 -0.275 -8.952 1036 1HB LYS 132 HB2 LYS 132 255.591 -2.307 -11.164 1037 2HB LYS 132 HB1 LYS 132 254.325 -2.227 -9.946 1038 1HG LYS 132 HG2 LYS 132 253.169 -0.629 -11.052 1039 2HG LYS 132 HG1 LYS 132 254.623 0.133 -11.699 1040 1HD LYS 132 HD2 LYS 132 254.042 -2.582 -12.694 1041 2HD LYS 132 HD1 LYS 132 252.903 -1.325 -13.181 1042 1HE LYS 132 HE2 LYS 132 255.825 -0.792 -13.416 1043 2HE LYS 132 HE1 LYS 132 255.055 -1.842 -14.604 1044 1HZ LYS 132 HZ1 LYS 132 253.709 0.675 -14.029 1045 2HZ LYS 132 HZ2 LYS 132 253.907 -0.135 -15.501 1046 3HZ LYS 132 HZ3 LYS 132 255.176 0.786 -14.867 1047 H PHE 133 HN PHE 133 256.003 -1.278 -7.186 1048 HA PHE 133 HA PHE 133 258.196 -3.226 -7.454 1049 1HB PHE 133 HB2 PHE 133 257.943 -0.901 -5.578 1050 2HB PHE 133 HB1 PHE 133 258.826 -2.335 -5.071 1051 HD1 PHE 133 HD1 PHE 133 261.090 -2.208 -5.308 1052 HD2 PHE 133 HD2 PHE 133 258.621 -0.186 -8.123 1053 HE1 PHE 133 HE1 PHE 133 263.096 -1.381 -6.468 1054 HE2 PHE 133 HE2 PHE 133 260.622 0.642 -9.290 1055 HZ PHE 133 HZ PHE 133 262.864 0.045 -8.462 1056 H HIS 134 HN HIS 134 258.416 -4.562 -5.396 1057 HA HIS 134 HA HIS 134 255.766 -5.176 -4.269 1058 1HB HIS 134 HB2 HIS 134 256.977 -6.789 -6.055 1059 2HB HIS 134 HB1 HIS 134 257.723 -7.389 -4.579 1060 HD1 HIS 134 HD1 HIS 134 255.317 -7.277 -2.677 1061 HD2 HIS 134 HD2 HIS 134 255.138 -8.721 -6.569 1062 HE1 HIS 134 HE1 HIS 134 253.323 -8.808 -2.736 1063 HE2 HIS 134 HE2 HIS 134 253.291 -9.742 -5.075 1064 H GLY 135 HN GLY 135 255.721 -5.156 -2.062 1065 1HA GLY 135 HA2 GLY 135 258.334 -5.428 -0.706 1066 2HA GLY 135 HA1 GLY 135 257.122 -4.270 -0.187 1067 H TYR 136 HN TYR 136 258.508 -6.992 0.721 1068 HA TYR 136 HA TYR 136 256.048 -8.191 1.818 1069 1HB TYR 136 HB2 TYR 136 257.526 -9.621 0.340 1070 2HB TYR 136 HB1 TYR 136 258.762 -9.502 1.584 1071 HD1 TYR 136 HD1 TYR 136 256.208 -11.488 0.331 1072 HD2 TYR 136 HD2 TYR 136 257.857 -10.174 4.025 1073 HE1 TYR 136 HE1 TYR 136 255.247 -13.454 1.448 1074 HE2 TYR 136 HE2 TYR 136 256.900 -12.136 5.156 1075 HH TYR 136 HH TYR 136 254.526 -13.918 4.061 1076 H PHE 137 HN PHE 137 255.701 -7.493 3.841 1077 HA PHE 137 HA PHE 137 258.049 -7.062 5.568 1078 1HB PHE 137 HB2 PHE 137 255.420 -5.769 6.153 1079 2HB PHE 137 HB1 PHE 137 257.047 -5.220 6.535 1080 HD1 PHE 137 HD1 PHE 137 254.521 -3.901 5.077 1081 HD2 PHE 137 HD2 PHE 137 258.274 -5.454 3.816 1082 HE1 PHE 137 HE1 PHE 137 254.473 -2.419 3.114 1083 HE2 PHE 137 HE2 PHE 137 258.235 -3.974 1.853 1084 HZ PHE 137 HZ PHE 137 256.330 -2.453 1.500 1085 H LYS 138 HN LYS 138 258.128 -8.002 7.542 1086 HA LYS 138 HA LYS 138 256.107 -9.991 8.188 1087 1HB LYS 138 HB2 LYS 138 258.871 -9.908 8.460 1088 2HB LYS 138 HB1 LYS 138 258.285 -9.688 10.103 1089 1HG LYS 138 HG2 LYS 138 256.744 -11.738 9.408 1090 2HG LYS 138 HG1 LYS 138 258.095 -12.036 8.313 1091 1HD LYS 138 HD2 LYS 138 259.450 -12.683 9.981 1092 2HD LYS 138 HD1 LYS 138 258.916 -11.377 11.041 1093 1HE LYS 138 HE2 LYS 138 257.371 -12.663 12.057 1094 2HE LYS 138 HE1 LYS 138 256.927 -13.486 10.562 1095 1HZ LYS 138 HZ1 LYS 138 257.955 -15.202 11.560 1096 2HZ LYS 138 HZ2 LYS 138 258.894 -14.220 12.568 1097 3HZ LYS 138 HZ3 LYS 138 259.361 -14.474 10.963 1098 H PHE 139 HN PHE 139 254.733 -9.848 9.942 1099 HA PHE 139 HA PHE 139 254.734 -7.251 11.313 1100 1HB PHE 139 HB2 PHE 139 252.631 -9.161 10.461 1101 2HB PHE 139 HB1 PHE 139 252.354 -8.371 12.003 1102 HD1 PHE 139 HD1 PHE 139 250.500 -8.078 9.796 1103 HD2 PHE 139 HD2 PHE 139 253.996 -5.820 10.699 1104 HE1 PHE 139 HE1 PHE 139 249.549 -6.140 8.623 1105 HE2 PHE 139 HE2 PHE 139 253.044 -3.880 9.528 1106 HZ PHE 139 HZ PHE 139 250.821 -4.037 8.488 1107 H GLN 140 HN GLN 140 253.961 -7.243 13.572 1108 HA GLN 140 HA GLN 140 255.095 -9.510 15.072 1109 1HB GLN 140 HB2 GLN 140 256.403 -7.639 15.596 1110 2HB GLN 140 HB1 GLN 140 255.026 -6.555 15.592 1111 1HG GLN 140 HG2 GLN 140 255.925 -6.914 17.833 1112 2HG GLN 140 HG1 GLN 140 254.256 -7.463 17.690 1113 1HE2 GLN 140 HE21 GLN 140 254.141 -9.045 19.153 1114 2HE2 GLN 140 HE22 GLN 140 255.159 -10.440 19.190 1115 H GLY 141 HN GLY 141 252.221 -8.238 14.134 1116 1HA GLY 141 HA2 GLY 141 250.644 -9.793 15.821 1117 2HA GLY 141 HA1 GLY 141 250.702 -8.180 16.515 1118 H GLN 142 HN GLN 142 250.723 -6.624 14.209 1119 HA GLN 142 HA GLN 142 248.893 -7.266 12.230 1120 1HB GLN 142 HB2 GLN 142 247.593 -6.967 14.702 1121 2HB GLN 142 HB1 GLN 142 247.243 -5.496 13.805 1122 1HG GLN 142 HG2 GLN 142 246.892 -7.573 11.976 1123 2HG GLN 142 HG1 GLN 142 246.172 -8.143 13.480 1124 1HE2 GLN 142 HE21 GLN 142 244.140 -7.609 13.799 1125 2HE2 GLN 142 HE22 GLN 142 243.312 -6.271 13.085 1126 H ASP 143 HN ASP 143 250.145 -4.745 14.348 1127 HA ASP 143 HA ASP 143 250.076 -2.896 12.051 1128 1HB ASP 143 HB2 ASP 143 249.906 -2.261 15.001 1129 2HB ASP 143 HB1 ASP 143 250.047 -1.053 13.728 1130 H THR 144 HN THR 144 252.069 -4.406 14.450 1131 HA THR 144 HA THR 144 254.282 -2.579 13.983 1132 HB THR 144 HB THR 144 253.958 -5.008 15.739 1133 HG1 THR 144 HG1 THR 144 253.730 -3.580 17.279 1134 1HG2 THR 144 HG21 THR 144 256.434 -3.341 15.365 1135 2HG2 THR 144 HG22 THR 144 256.247 -5.055 14.995 1136 3HG2 THR 144 HG23 THR 144 256.174 -4.501 16.667 1137 H ILE 145 HN ILE 145 256.062 -2.984 12.772 1138 HA ILE 145 HA ILE 145 256.064 -5.510 11.273 1139 HB ILE 145 HB ILE 145 257.363 -2.905 10.471 1140 1HG1 ILE 145 HG12 ILE 145 254.954 -4.283 9.266 1141 2HG1 ILE 145 HG11 ILE 145 254.854 -2.924 10.380 1142 1HG2 ILE 145 HG21 ILE 145 258.561 -4.896 9.683 1143 2HG2 ILE 145 HG22 ILE 145 257.810 -4.023 8.348 1144 3HG2 ILE 145 HG23 ILE 145 257.071 -5.503 8.961 1145 1HD1 ILE 145 HD11 ILE 145 254.597 -2.076 8.183 1146 2HD1 ILE 145 HD12 ILE 145 256.020 -2.945 7.611 1147 3HD1 ILE 145 HD13 ILE 145 256.201 -1.601 8.739 1148 H LEU 146 HN LEU 146 257.915 -6.713 11.115 1149 HA LEU 146 HA LEU 146 260.166 -5.858 12.810 1150 1HB LEU 146 HB2 LEU 146 259.375 -8.726 12.409 1151 2HB LEU 146 HB1 LEU 146 260.419 -8.044 13.643 1152 HG LEU 146 HG LEU 146 257.498 -7.343 13.515 1153 1HD1 LEU 146 HD11 LEU 146 257.763 -9.188 15.547 1154 2HD1 LEU 146 HD12 LEU 146 258.679 -9.901 14.219 1155 3HD1 LEU 146 HD13 LEU 146 256.988 -9.456 13.987 1156 1HD2 LEU 146 HD21 LEU 146 258.244 -5.947 15.100 1157 2HD2 LEU 146 HD22 LEU 146 259.763 -6.823 15.295 1158 3HD2 LEU 146 HD23 LEU 146 258.311 -7.380 16.127 1159 H ASP 147 HN ASP 147 259.177 -6.785 9.719 1160 HA ASP 147 HA ASP 147 261.911 -6.821 8.796 1161 1HB ASP 147 HB2 ASP 147 260.613 -9.264 9.284 1162 2HB ASP 147 HB1 ASP 147 260.541 -9.042 7.539 1163 H TYR 148 HN TYR 148 262.091 -5.991 6.737 1164 HA TYR 148 HA TYR 148 259.648 -5.829 5.144 1165 1HB TYR 148 HB2 TYR 148 259.897 -3.474 4.714 1166 2HB TYR 148 HB1 TYR 148 259.801 -3.747 6.451 1167 HD1 TYR 148 HD1 TYR 148 261.525 -3.017 7.885 1168 HD2 TYR 148 HD2 TYR 148 262.171 -3.056 3.680 1169 HE1 TYR 148 HE1 TYR 148 263.622 -1.773 8.202 1170 HE2 TYR 148 HE2 TYR 148 264.271 -1.813 3.985 1171 HH TYR 148 HH TYR 148 265.712 -1.361 7.054 1172 H THR 149 HN THR 149 259.925 -6.062 2.999 1173 HA THR 149 HA THR 149 262.663 -5.884 1.941 1174 HB THR 149 HB THR 149 261.473 -7.794 0.356 1175 HG1 THR 149 HG1 THR 149 259.821 -7.884 2.079 1176 1HG2 THR 149 HG21 THR 149 262.904 -9.421 1.438 1177 2HG2 THR 149 HG22 THR 149 263.168 -8.311 2.783 1178 3HG2 THR 149 HG23 THR 149 263.759 -7.902 1.172 1179 H LEU 150 HN LEU 150 262.843 -5.115 -0.159 1180 HA LEU 150 HA LEU 150 260.355 -4.282 -1.473 1181 1HB LEU 150 HB2 LEU 150 262.737 -2.555 -0.846 1182 2HB LEU 150 HB1 LEU 150 261.593 -2.142 -2.111 1183 HG LEU 150 HG LEU 150 259.998 -2.653 0.121 1184 1HD1 LEU 150 HD11 LEU 150 262.617 -1.514 0.898 1185 2HD1 LEU 150 HD12 LEU 150 261.492 -2.512 1.818 1186 3HD1 LEU 150 HD13 LEU 150 261.172 -0.791 1.604 1187 1HD2 LEU 150 HD21 LEU 150 260.977 -0.029 -0.999 1188 2HD2 LEU 150 HD22 LEU 150 259.576 -0.236 0.051 1189 3HD2 LEU 150 HD23 LEU 150 259.582 -0.952 -1.560 1190 H ARG 151 HN ARG 151 260.270 -4.983 -3.482 1191 HA ARG 151 HA ARG 151 262.783 -5.319 -4.980 1192 1HB ARG 151 HB2 ARG 151 260.389 -7.166 -4.969 1193 2HB ARG 151 HB1 ARG 151 261.747 -7.301 -6.077 1194 1HG ARG 151 HG2 ARG 151 261.851 -7.584 -3.081 1195 2HG ARG 151 HG1 ARG 151 261.975 -8.885 -4.268 1196 1HD ARG 151 HD2 ARG 151 263.938 -7.262 -5.140 1197 2HD ARG 151 HD1 ARG 151 263.975 -6.886 -3.418 1198 HE ARG 151 HE ARG 151 263.933 -9.639 -3.605 1199 1HH1 ARG 151 HH11 ARG 151 266.030 -7.048 -4.637 1200 2HH1 ARG 151 HH12 ARG 151 267.466 -8.012 -4.558 1201 1HH2 ARG 151 HH21 ARG 151 265.821 -10.908 -3.500 1202 2HH2 ARG 151 HH22 ARG 151 267.348 -10.203 -3.913 1203 H GLU 152 HN GLU 152 262.505 -5.260 -7.344 1204 HA GLU 152 HA GLU 152 260.452 -3.295 -8.053 1205 1HB GLU 152 HB2 GLU 152 261.806 -2.820 -10.011 1206 2HB GLU 152 HB1 GLU 152 262.801 -2.748 -8.565 1207 1HG GLU 152 HG2 GLU 152 264.103 -4.445 -9.221 1208 2HG GLU 152 HG1 GLU 152 262.747 -5.370 -9.864 1209 H VAL 153 HN VAL 153 259.088 -3.550 -9.831 1210 HA VAL 153 HA VAL 153 259.063 -6.133 -11.193 1211 HB VAL 153 HB VAL 153 256.607 -6.368 -10.809 1212 1HG1 VAL 153 HG11 VAL 153 256.945 -7.694 -9.004 1213 2HG1 VAL 153 HG12 VAL 153 257.777 -6.434 -8.094 1214 3HG1 VAL 153 HG13 VAL 153 258.634 -7.327 -9.351 1215 1HG2 VAL 153 HG21 VAL 153 255.513 -5.150 -9.068 1216 2HG2 VAL 153 HG22 VAL 153 256.260 -3.980 -10.155 1217 3HG2 VAL 153 HG23 VAL 153 257.017 -4.352 -8.607 1218 H ASP 154 HN ASP 154 258.309 -6.037 -13.256 1219 HA ASP 154 HA ASP 154 257.467 -3.386 -14.211 1220 1HB ASP 154 HB2 ASP 154 259.566 -4.388 -15.164 1221 2HB ASP 154 HB1 ASP 154 258.575 -5.670 -15.853 1222 H THR 155 HN THR 155 256.823 -6.854 -14.665 1223 HA THR 155 HA THR 155 254.242 -6.188 -15.882 1224 HB THR 155 HB THR 155 255.574 -8.892 -15.651 1225 HG1 THR 155 HG1 THR 155 256.881 -7.814 -16.987 1226 1HG2 THR 155 HG21 THR 155 253.669 -8.238 -17.813 1227 2HG2 THR 155 HG22 THR 155 253.007 -8.531 -16.204 1228 3HG2 THR 155 HG23 THR 155 253.984 -9.769 -16.995 1229 H VAL 156 HN VAL 156 255.507 -8.528 -13.501 1230 HA VAL 156 HA VAL 156 253.641 -7.876 -11.502 1231 HB VAL 156 HB VAL 156 252.021 -8.889 -13.053 1232 1HG1 VAL 156 HG11 VAL 156 253.805 -10.502 -13.981 1233 2HG1 VAL 156 HG12 VAL 156 252.141 -11.071 -13.842 1234 3HG1 VAL 156 HG13 VAL 156 253.338 -11.545 -12.636 1235 1HG2 VAL 156 HG21 VAL 156 251.117 -9.205 -11.014 1236 2HG2 VAL 156 HG22 VAL 156 252.584 -9.935 -10.361 1237 3HG2 VAL 156 HG23 VAL 156 251.474 -10.902 -11.333 Start of MODEL 25 1 1H MET 1 HT1 MET 1 247.636 -18.313 -2.735 2 2H MET 1 HT2 MET 1 248.977 -18.753 -3.712 3 3H MET 1 HT3 MET 1 248.862 -19.328 -2.100 4 HA MET 1 HA MET 1 247.273 -20.070 -4.448 5 1HB MET 1 HB2 MET 1 249.545 -21.107 -3.584 6 2HB MET 1 HB1 MET 1 248.492 -21.907 -2.426 7 1HG MET 1 HG2 MET 1 247.206 -22.878 -4.252 8 2HG MET 1 HG1 MET 1 248.241 -22.060 -5.421 9 1HE MET 1 HE1 MET 1 248.321 -24.475 -6.472 10 2HE MET 1 HE2 MET 1 249.830 -25.354 -6.226 11 3HE MET 1 HE3 MET 1 249.866 -23.659 -6.711 12 H GLY 2 HN GLY 2 247.489 -20.483 -0.908 13 1HA GLY 2 HA2 GLY 2 244.551 -20.679 -0.855 14 2HA GLY 2 HA1 GLY 2 245.520 -21.892 -0.033 15 H ALA 3 HN ALA 3 246.560 -21.379 1.889 16 HA ALA 3 HA ALA 3 245.294 -19.520 3.553 17 1HB ALA 3 HB1 ALA 3 246.278 -21.182 4.770 18 2HB ALA 3 HB2 ALA 3 247.503 -19.924 4.947 19 3HB ALA 3 HB3 ALA 3 247.727 -21.214 3.765 20 H SER 4 HN SER 4 245.300 -17.434 2.822 21 HA SER 4 HA SER 4 247.485 -15.795 3.430 22 1HB SER 4 HB2 SER 4 248.752 -16.242 1.592 23 2HB SER 4 HB1 SER 4 247.371 -16.795 0.647 24 HG SER 4 HG SER 4 248.412 -14.229 0.958 25 H ARG 5 HN ARG 5 246.138 -14.436 4.392 26 HA ARG 5 HA ARG 5 243.644 -13.613 3.424 27 1HB ARG 5 HB2 ARG 5 245.572 -12.433 5.408 28 2HB ARG 5 HB1 ARG 5 244.076 -11.607 4.998 29 1HG ARG 5 HG2 ARG 5 243.989 -14.464 5.844 30 2HG ARG 5 HG1 ARG 5 244.185 -13.196 7.056 31 1HD ARG 5 HD2 ARG 5 241.850 -13.672 6.850 32 2HD ARG 5 HD1 ARG 5 242.153 -12.092 6.128 33 HE ARG 5 HE ARG 5 241.526 -12.935 4.091 34 1HH1 ARG 5 HH11 ARG 5 242.063 -15.582 6.301 35 2HH1 ARG 5 HH12 ARG 5 241.419 -16.775 5.225 36 1HH2 ARG 5 HH21 ARG 5 240.677 -14.503 2.674 37 2HH2 ARG 5 HH22 ARG 5 240.633 -16.164 3.166 38 H LEU 6 HN LEU 6 243.708 -12.989 1.317 39 HA LEU 6 HA LEU 6 245.569 -10.942 0.443 40 1HB LEU 6 HB2 LEU 6 244.566 -13.000 -0.890 41 2HB LEU 6 HB1 LEU 6 243.290 -11.852 -1.252 42 HG LEU 6 HG LEU 6 246.148 -11.104 -1.757 43 1HD1 LEU 6 HD11 LEU 6 244.550 -12.334 -3.939 44 2HD1 LEU 6 HD12 LEU 6 245.366 -13.397 -2.792 45 3HD1 LEU 6 HD13 LEU 6 246.299 -12.234 -3.734 46 1HD2 LEU 6 HD21 LEU 6 245.200 -9.634 -3.386 47 2HD2 LEU 6 HD22 LEU 6 244.284 -9.436 -1.893 48 3HD2 LEU 6 HD23 LEU 6 243.614 -10.384 -3.219 49 H TYR 7 HN TYR 7 245.204 -8.882 0.685 50 HA TYR 7 HA TYR 7 242.434 -7.884 0.669 51 1HB TYR 7 HB2 TYR 7 244.751 -7.142 2.433 52 2HB TYR 7 HB1 TYR 7 243.452 -5.996 2.133 53 HD1 TYR 7 HD1 TYR 7 243.655 -9.651 2.934 54 HD2 TYR 7 HD2 TYR 7 241.947 -5.866 3.862 55 HE1 TYR 7 HE1 TYR 7 242.332 -10.693 4.725 56 HE2 TYR 7 HE2 TYR 7 240.621 -6.898 5.656 57 HH TYR 7 HH TYR 7 241.222 -10.004 6.833 58 H THR 8 HN THR 8 242.648 -5.306 0.431 59 HA THR 8 HA THR 8 244.434 -4.806 -1.865 60 HB THR 8 HB THR 8 242.616 -3.413 -2.808 61 HG1 THR 8 HG1 THR 8 240.959 -4.638 -0.872 62 1HG2 THR 8 HG21 THR 8 240.981 -5.384 -3.219 63 2HG2 THR 8 HG22 THR 8 242.217 -6.331 -2.394 64 3HG2 THR 8 HG23 THR 8 242.620 -5.444 -3.863 65 H LEU 9 HN LEU 9 244.592 -2.420 -2.346 66 HA LEU 9 HA LEU 9 244.304 -0.658 -0.063 67 1HB LEU 9 HB2 LEU 9 246.543 -1.962 0.062 68 2HB LEU 9 HB1 LEU 9 247.035 -0.949 -1.280 69 HG LEU 9 HG LEU 9 246.277 -0.044 1.484 70 1HD1 LEU 9 HD11 LEU 9 248.538 -1.022 1.167 71 2HD1 LEU 9 HD12 LEU 9 248.551 0.669 1.667 72 3HD1 LEU 9 HD13 LEU 9 248.867 0.244 -0.015 73 1HD2 LEU 9 HD21 LEU 9 245.406 1.627 0.088 74 2HD2 LEU 9 HD22 LEU 9 246.773 1.524 -1.022 75 3HD2 LEU 9 HD23 LEU 9 246.990 2.220 0.584 76 H VAL 10 HN VAL 10 243.256 0.970 -1.086 77 HA VAL 10 HA VAL 10 244.312 1.855 -3.673 78 HB VAL 10 HB VAL 10 242.114 1.174 -4.034 79 1HG1 VAL 10 HG11 VAL 10 241.032 0.733 -2.141 80 2HG1 VAL 10 HG12 VAL 10 240.286 2.291 -2.487 81 3HG1 VAL 10 HG13 VAL 10 241.620 2.190 -1.339 82 1HG2 VAL 10 HG21 VAL 10 240.955 3.119 -4.724 83 2HG2 VAL 10 HG22 VAL 10 242.673 3.487 -4.859 84 3HG2 VAL 10 HG23 VAL 10 241.744 4.101 -3.492 85 H LEU 11 HN LEU 11 245.205 3.716 -3.823 86 HA LEU 11 HA LEU 11 244.622 5.795 -1.826 87 1HB LEU 11 HB2 LEU 11 247.106 4.470 -2.475 88 2HB LEU 11 HB1 LEU 11 247.232 6.186 -2.807 89 HG LEU 11 HG LEU 11 246.685 4.837 -0.168 90 1HD1 LEU 11 HD11 LEU 11 248.616 7.015 -0.262 91 2HD1 LEU 11 HD12 LEU 11 249.030 5.685 -1.345 92 3HD1 LEU 11 HD13 LEU 11 248.781 5.378 0.374 93 1HD2 LEU 11 HD21 LEU 11 245.940 7.556 -1.054 94 2HD2 LEU 11 HD22 LEU 11 246.686 7.407 0.536 95 3HD2 LEU 11 HD23 LEU 11 245.210 6.516 0.169 96 H VAL 12 HN VAL 12 243.578 7.375 -2.895 97 HA VAL 12 HA VAL 12 244.064 7.729 -5.740 98 HB VAL 12 HB VAL 12 242.127 9.338 -4.094 99 1HG1 VAL 12 HG11 VAL 12 242.048 10.318 -6.128 100 2HG1 VAL 12 HG12 VAL 12 240.968 8.970 -6.485 101 3HG1 VAL 12 HG13 VAL 12 242.664 8.891 -6.960 102 1HG2 VAL 12 HG21 VAL 12 242.010 6.495 -4.826 103 2HG2 VAL 12 HG22 VAL 12 240.573 7.432 -5.234 104 3HG2 VAL 12 HG23 VAL 12 241.148 7.380 -3.569 105 H LEU 13 HN LEU 13 245.978 8.751 -6.000 106 HA LEU 13 HA LEU 13 246.401 11.306 -4.598 107 1HB LEU 13 HB2 LEU 13 248.122 9.314 -4.756 108 2HB LEU 13 HB1 LEU 13 248.502 10.073 -6.295 109 HG LEU 13 HG LEU 13 248.314 12.017 -4.166 110 1HD1 LEU 13 HD11 LEU 13 249.733 9.554 -3.589 111 2HD1 LEU 13 HD12 LEU 13 249.271 10.880 -2.523 112 3HD1 LEU 13 HD13 LEU 13 250.754 10.988 -3.473 113 1HD2 LEU 13 HD21 LEU 13 249.753 11.558 -6.559 114 2HD2 LEU 13 HD22 LEU 13 250.909 11.841 -5.258 115 3HD2 LEU 13 HD23 LEU 13 249.648 13.027 -5.590 116 H GLN 14 HN GLN 14 247.254 13.092 -5.832 117 HA GLN 14 HA GLN 14 246.615 13.039 -8.698 118 1HB GLN 14 HB2 GLN 14 245.176 14.453 -6.692 119 2HB GLN 14 HB1 GLN 14 246.055 15.642 -7.644 120 1HG GLN 14 HG2 GLN 14 244.369 15.545 -9.080 121 2HG GLN 14 HG1 GLN 14 244.986 13.961 -9.547 122 1HE2 GLN 14 HE21 GLN 14 244.302 12.265 -7.715 123 2HE2 GLN 14 HE22 GLN 14 242.600 12.241 -7.420 124 HA PRO 15 HA PRO 15 250.518 15.001 -9.246 125 1HB PRO 15 HB2 PRO 15 250.043 16.759 -11.272 126 2HB PRO 15 HB1 PRO 15 250.185 15.013 -11.509 127 1HG PRO 15 HG2 PRO 15 247.724 16.698 -11.272 128 2HG PRO 15 HG1 PRO 15 248.067 15.368 -12.394 129 1HD PRO 15 HD2 PRO 15 246.540 15.036 -10.193 130 2HD PRO 15 HD1 PRO 15 247.592 13.749 -10.817 131 H GLN 16 HN GLN 16 248.477 16.319 -7.392 132 HA GLN 16 HA GLN 16 250.040 18.643 -6.835 133 1HB GLN 16 HB2 GLN 16 247.233 18.920 -7.893 134 2HB GLN 16 HB1 GLN 16 247.951 20.145 -6.856 135 1HG GLN 16 HG2 GLN 16 249.869 20.173 -8.560 136 2HG GLN 16 HG1 GLN 16 248.745 19.326 -9.621 137 1HE2 GLN 16 HE21 GLN 16 248.994 21.212 -10.984 138 2HE2 GLN 16 HE22 GLN 16 248.034 22.615 -10.674 139 H ARG 17 HN ARG 17 247.095 16.811 -6.214 140 HA ARG 17 HA ARG 17 247.580 17.137 -3.338 141 1HB ARG 17 HB2 ARG 17 245.044 17.142 -3.064 142 2HB ARG 17 HB1 ARG 17 245.771 18.617 -3.687 143 1HG ARG 17 HG2 ARG 17 245.219 17.324 -5.995 144 2HG ARG 17 HG1 ARG 17 243.915 16.734 -4.964 145 1HD ARG 17 HD2 ARG 17 243.479 19.144 -4.352 146 2HD ARG 17 HD1 ARG 17 244.592 19.586 -5.646 147 HE ARG 17 HE ARG 17 241.890 18.731 -5.931 148 1HH1 ARG 17 HH11 ARG 17 245.018 18.652 -7.477 149 2HH1 ARG 17 HH12 ARG 17 244.365 18.483 -9.072 150 1HH2 ARG 17 HH21 ARG 17 241.029 18.505 -8.028 151 2HH2 ARG 17 HH22 ARG 17 242.100 18.399 -9.385 152 H VAL 18 HN VAL 18 246.533 15.424 -2.031 153 HA VAL 18 HA VAL 18 246.147 12.939 -3.570 154 HB VAL 18 HB VAL 18 248.244 12.558 -2.696 155 1HG1 VAL 18 HG11 VAL 18 249.143 13.328 -0.681 156 2HG1 VAL 18 HG12 VAL 18 247.551 13.597 0.029 157 3HG1 VAL 18 HG13 VAL 18 248.140 14.662 -1.246 158 1HG2 VAL 18 HG21 VAL 18 246.679 10.763 -2.069 159 2HG2 VAL 18 HG22 VAL 18 246.457 11.535 -0.498 160 3HG2 VAL 18 HG23 VAL 18 248.037 10.899 -0.954 161 H LEU 19 HN LEU 19 244.818 11.331 -2.495 162 HA LEU 19 HA LEU 19 242.958 12.526 -0.547 163 1HB LEU 19 HB2 LEU 19 242.007 11.990 -2.787 164 2HB LEU 19 HB1 LEU 19 242.400 10.305 -2.506 165 HG LEU 19 HG LEU 19 240.843 10.192 -0.659 166 1HD1 LEU 19 HD11 LEU 19 240.896 13.120 -0.942 167 2HD1 LEU 19 HD12 LEU 19 240.660 12.118 0.490 168 3HD1 LEU 19 HD13 LEU 19 239.315 12.411 -0.612 169 1HD2 LEU 19 HD21 LEU 19 239.331 11.609 -2.815 170 2HD2 LEU 19 HD22 LEU 19 238.885 10.173 -1.892 171 3HD2 LEU 19 HD23 LEU 19 240.122 10.068 -3.145 172 H LEU 20 HN LEU 20 243.206 11.746 1.434 173 HA LEU 20 HA LEU 20 243.990 8.922 1.737 174 1HB LEU 20 HB2 LEU 20 244.932 11.384 3.078 175 2HB LEU 20 HB1 LEU 20 244.707 9.985 4.111 176 HG LEU 20 HG LEU 20 246.415 9.983 1.627 177 1HD1 LEU 20 HD11 LEU 20 248.332 10.056 3.145 178 2HD1 LEU 20 HD12 LEU 20 247.241 10.259 4.513 179 3HD1 LEU 20 HD13 LEU 20 247.346 11.514 3.279 180 1HD2 LEU 20 HD21 LEU 20 245.477 7.804 2.356 181 2HD2 LEU 20 HD22 LEU 20 246.282 8.024 3.910 182 3HD2 LEU 20 HD23 LEU 20 247.238 7.880 2.436 183 H GLY 21 HN GLY 21 242.763 7.636 2.994 184 1HA GLY 21 HA2 GLY 21 240.238 8.706 3.934 185 2HA GLY 21 HA1 GLY 21 240.715 7.014 3.915 186 H MET 22 HN MET 22 239.889 9.429 5.923 187 HA MET 22 HA MET 22 241.670 8.483 8.063 188 1HB MET 22 HB2 MET 22 242.050 10.800 7.827 189 2HB MET 22 HB1 MET 22 240.341 11.144 7.610 190 1HG MET 22 HG2 MET 22 239.879 10.881 9.889 191 2HG MET 22 HG1 MET 22 241.410 10.063 10.193 192 1HE MET 22 HE1 MET 22 243.540 11.561 8.868 193 2HE MET 22 HE2 MET 22 243.769 11.420 10.610 194 3HE MET 22 HE3 MET 22 243.977 12.980 9.818 195 H LYS 23 HN LYS 23 240.790 7.791 10.000 196 HA LYS 23 HA LYS 23 237.967 7.106 9.884 197 1HB LYS 23 HB2 LYS 23 240.339 6.137 11.350 198 2HB LYS 23 HB1 LYS 23 238.838 6.111 12.265 199 1HG LYS 23 HG2 LYS 23 237.817 4.851 10.340 200 2HG LYS 23 HG1 LYS 23 239.448 4.705 9.680 201 1HD LYS 23 HD2 LYS 23 239.065 2.712 10.885 202 2HD LYS 23 HD1 LYS 23 240.104 3.696 11.915 203 1HE LYS 23 HE2 LYS 23 238.538 3.887 13.510 204 2HE LYS 23 HE1 LYS 23 237.244 4.139 12.341 205 1HZ LYS 23 HZ1 LYS 23 238.442 1.487 12.924 206 2HZ LYS 23 HZ2 LYS 23 237.060 1.806 12.002 207 3HZ LYS 23 HZ3 LYS 23 237.040 2.071 13.672 208 H LYS 24 HN LYS 24 236.454 7.746 11.449 209 HA LYS 24 HA LYS 24 237.124 10.279 12.703 210 1HB LYS 24 HB2 LYS 24 234.585 8.859 12.032 211 2HB LYS 24 HB1 LYS 24 234.556 10.039 13.335 212 1HG LYS 24 HG2 LYS 24 234.487 11.717 11.894 213 2HG LYS 24 HG1 LYS 24 235.926 11.124 11.060 214 1HD LYS 24 HD2 LYS 24 234.676 9.846 9.561 215 2HD LYS 24 HD1 LYS 24 233.246 9.865 10.594 216 1HE LYS 24 HE2 LYS 24 234.391 12.232 9.115 217 2HE LYS 24 HE1 LYS 24 232.966 11.309 8.639 218 1HZ LYS 24 HZ1 LYS 24 232.321 11.971 11.134 219 2HZ LYS 24 HZ2 LYS 24 231.913 12.910 9.788 220 3HZ LYS 24 HZ3 LYS 24 233.268 13.310 10.719 221 H ARG 25 HN ARG 25 236.363 6.989 13.553 222 HA ARG 25 HA ARG 25 237.414 7.356 16.168 223 1HB ARG 25 HB2 ARG 25 235.288 6.507 17.312 224 2HB ARG 25 HB1 ARG 25 235.321 8.196 16.822 225 1HG ARG 25 HG2 ARG 25 234.121 6.079 15.075 226 2HG ARG 25 HG1 ARG 25 233.200 6.860 16.362 227 1HD ARG 25 HD2 ARG 25 234.291 9.009 15.121 228 2HD ARG 25 HD1 ARG 25 234.086 7.903 13.763 229 HE ARG 25 HE ARG 25 231.820 8.189 13.915 230 1HH1 ARG 25 HH11 ARG 25 233.305 9.363 16.847 231 2HH1 ARG 25 HH12 ARG 25 231.840 10.055 17.460 232 1HH2 ARG 25 HH21 ARG 25 229.892 9.098 14.720 233 2HH2 ARG 25 HH22 ARG 25 229.903 9.904 16.253 234 H GLY 26 HN GLY 26 237.473 5.327 17.408 235 1HA GLY 26 HA2 GLY 26 237.219 2.947 17.504 236 2HA GLY 26 HA1 GLY 26 237.030 2.935 15.757 237 H PHE 27 HN PHE 27 238.667 1.843 14.899 238 HA PHE 27 HA PHE 27 241.336 2.112 16.083 239 1HB PHE 27 HB2 PHE 27 239.921 -0.007 14.595 240 2HB PHE 27 HB1 PHE 27 241.617 0.195 14.169 241 HD1 PHE 27 HD1 PHE 27 239.346 -1.309 16.409 242 HD2 PHE 27 HD2 PHE 27 243.288 0.273 16.152 243 HE1 PHE 27 HE1 PHE 27 239.994 -2.611 18.394 244 HE2 PHE 27 HE2 PHE 27 243.944 -1.027 18.136 245 HZ PHE 27 HZ PHE 27 242.296 -2.471 19.260 246 H GLY 28 HN GLY 28 241.657 4.247 15.179 247 1HA GLY 28 HA2 GLY 28 243.357 4.675 13.263 248 2HA GLY 28 HA1 GLY 28 241.967 4.310 12.257 249 H ALA 29 HN ALA 29 240.551 5.770 14.764 250 HA ALA 29 HA ALA 29 239.766 8.062 13.523 251 1HB ALA 29 HB1 ALA 29 239.285 6.984 15.932 252 2HB ALA 29 HB2 ALA 29 238.745 8.586 15.429 253 3HB ALA 29 HB3 ALA 29 240.211 8.412 16.392 254 H GLY 30 HN GLY 30 240.487 10.161 13.310 255 1HA GLY 30 HA2 GLY 30 241.958 11.923 13.260 256 2HA GLY 30 HA1 GLY 30 242.660 11.271 14.731 257 H ARG 31 HN ARG 31 242.582 9.212 11.964 258 HA ARG 31 HA ARG 31 245.369 9.883 11.319 259 1HB ARG 31 HB2 ARG 31 244.360 7.050 11.613 260 2HB ARG 31 HB1 ARG 31 246.010 7.559 11.284 261 1HG ARG 31 HG2 ARG 31 246.194 8.530 13.485 262 2HG ARG 31 HG1 ARG 31 244.502 8.155 13.821 263 1HD ARG 31 HD2 ARG 31 246.058 6.540 14.847 264 2HD ARG 31 HD1 ARG 31 244.960 5.787 13.691 265 HE ARG 31 HE ARG 31 247.306 6.466 12.339 266 1HH1 ARG 31 HH11 ARG 31 246.255 4.290 14.858 267 2HH1 ARG 31 HH12 ARG 31 247.463 3.101 14.508 268 1HH2 ARG 31 HH21 ARG 31 248.896 4.902 11.877 269 2HH2 ARG 31 HH22 ARG 31 248.963 3.448 12.816 270 H TRP 32 HN TRP 32 246.015 9.375 9.187 271 HA TRP 32 HA TRP 32 243.763 8.925 7.345 272 1HB TRP 32 HB2 TRP 32 246.111 10.012 6.041 273 2HB TRP 32 HB1 TRP 32 244.465 10.624 6.064 274 HD1 TRP 32 HD1 TRP 32 247.359 10.591 8.681 275 HE1 TRP 32 HE1 TRP 32 247.490 12.938 9.719 276 HE3 TRP 32 HE3 TRP 32 243.579 12.854 6.084 277 HZ2 TRP 32 HZ2 TRP 32 246.192 15.425 9.463 278 HZ3 TRP 32 HZ3 TRP 32 243.096 15.224 6.538 279 HH2 TRP 32 HH2 TRP 32 244.375 16.481 8.192 280 H ASN 33 HN ASN 33 244.137 7.636 5.448 281 HA ASN 33 HA ASN 33 246.529 6.285 4.901 282 1HB ASN 33 HB2 ASN 33 245.983 4.023 5.728 283 2HB ASN 33 HB1 ASN 33 246.190 5.175 7.043 284 1HD2 ASN 33 HD21 ASN 33 244.451 5.738 8.301 285 2HD2 ASN 33 HD22 ASN 33 242.939 4.905 8.239 286 H GLY 34 HN GLY 34 246.028 4.162 3.596 287 1HA GLY 34 HA2 GLY 34 244.267 4.948 1.479 288 2HA GLY 34 HA1 GLY 34 245.206 3.466 1.556 289 H PHE 35 HN PHE 35 242.778 3.231 0.497 290 HA PHE 35 HA PHE 35 241.025 2.256 2.644 291 1HB PHE 35 HB2 PHE 35 240.087 2.365 -0.182 292 2HB PHE 35 HB1 PHE 35 239.203 2.662 1.304 293 HD1 PHE 35 HD1 PHE 35 239.537 4.838 2.507 294 HD2 PHE 35 HD2 PHE 35 241.026 4.130 -1.415 295 HE1 PHE 35 HE1 PHE 35 239.756 7.263 2.158 296 HE2 PHE 35 HE2 PHE 35 241.249 6.553 -1.772 297 HZ PHE 35 HZ PHE 35 240.615 8.124 0.016 298 H GLY 36 HN GLY 36 241.797 0.232 3.091 299 1HA GLY 36 HA2 GLY 36 242.328 -1.575 0.859 300 2HA GLY 36 HA1 GLY 36 242.729 -1.870 2.543 301 H GLY 37 HN GLY 37 241.497 -3.729 0.807 302 1HA GLY 37 HA2 GLY 37 239.151 -4.344 2.400 303 2HA GLY 37 HA1 GLY 37 238.836 -4.059 0.695 304 H LYS 38 HN LYS 38 238.555 -6.510 2.340 305 HA LYS 38 HA LYS 38 240.615 -8.293 1.372 306 1HB LYS 38 HB2 LYS 38 239.453 -10.018 2.603 307 2HB LYS 38 HB1 LYS 38 239.589 -8.582 3.608 308 1HG LYS 38 HG2 LYS 38 237.263 -7.997 3.027 309 2HG LYS 38 HG1 LYS 38 237.142 -9.504 2.117 310 1HD LYS 38 HD2 LYS 38 238.120 -9.798 4.872 311 2HD LYS 38 HD1 LYS 38 236.458 -9.220 4.732 312 1HE LYS 38 HE2 LYS 38 235.712 -11.170 3.831 313 2HE LYS 38 HE1 LYS 38 237.239 -11.505 3.017 314 1HZ LYS 38 HZ1 LYS 38 236.836 -11.748 5.947 315 2HZ LYS 38 HZ2 LYS 38 238.192 -12.236 5.061 316 3HZ LYS 38 HZ3 LYS 38 236.720 -13.044 4.865 317 H VAL 39 HN VAL 39 240.379 -9.923 -0.139 318 HA VAL 39 HA VAL 39 238.481 -9.423 -2.231 319 HB VAL 39 HB VAL 39 240.268 -11.849 -2.039 320 1HG1 VAL 39 HG11 VAL 39 238.598 -11.830 -3.835 321 2HG1 VAL 39 HG12 VAL 39 240.238 -11.715 -4.474 322 3HG1 VAL 39 HG13 VAL 39 239.223 -10.277 -4.393 323 1HG2 VAL 39 HG21 VAL 39 241.959 -10.384 -1.854 324 2HG2 VAL 39 HG22 VAL 39 240.985 -9.025 -2.414 325 3HG2 VAL 39 HG23 VAL 39 241.680 -10.152 -3.580 326 H GLN 40 HN GLN 40 236.428 -10.007 -2.002 327 HA GLN 40 HA GLN 40 235.290 -11.721 -0.218 328 1HB GLN 40 HB2 GLN 40 234.332 -10.181 -2.219 329 2HB GLN 40 HB1 GLN 40 234.061 -11.774 -2.909 330 1HG GLN 40 HG2 GLN 40 232.376 -12.225 -1.516 331 2HG GLN 40 HG1 GLN 40 233.208 -11.530 -0.127 332 1HE2 GLN 40 HE21 GLN 40 230.417 -11.291 -1.104 333 2HE2 GLN 40 HE22 GLN 40 230.129 -9.593 -1.236 334 H GLU 41 HN GLU 41 234.072 -13.802 -0.770 335 HA GLU 41 HA GLU 41 235.977 -15.813 -1.335 336 1HB GLU 41 HB2 GLU 41 233.040 -15.765 -0.789 337 2HB GLU 41 HB1 GLU 41 233.755 -17.239 -1.428 338 1HG GLU 41 HG2 GLU 41 233.807 -17.562 0.861 339 2HG GLU 41 HG1 GLU 41 235.441 -17.014 0.491 340 H GLY 42 HN GLY 42 236.600 -14.854 -3.484 341 1HA GLY 42 HA2 GLY 42 236.699 -15.970 -5.654 342 2HA GLY 42 HA1 GLY 42 234.948 -16.098 -5.591 343 H GLU 43 HN GLU 43 237.067 -13.299 -4.944 344 HA GLU 43 HA GLU 43 235.859 -11.977 -7.255 345 1HB GLU 43 HB2 GLU 43 235.240 -10.115 -6.099 346 2HB GLU 43 HB1 GLU 43 235.100 -11.271 -4.787 347 1HG GLU 43 HG2 GLU 43 237.121 -10.565 -3.814 348 2HG GLU 43 HG1 GLU 43 237.598 -9.677 -5.259 349 H THR 44 HN THR 44 237.232 -9.922 -7.736 350 HA THR 44 HA THR 44 239.995 -10.871 -7.796 351 HB THR 44 HB THR 44 240.250 -9.272 -9.653 352 HG1 THR 44 HG1 THR 44 237.455 -8.889 -9.465 353 1HG2 THR 44 HG21 THR 44 239.732 -11.318 -10.525 354 2HG2 THR 44 HG22 THR 44 238.354 -10.379 -11.102 355 3HG2 THR 44 HG23 THR 44 238.189 -11.405 -9.677 356 H ILE 45 HN ILE 45 241.697 -9.657 -7.144 357 HA ILE 45 HA ILE 45 241.431 -8.089 -4.910 358 HB ILE 45 HB ILE 45 243.719 -7.626 -6.799 359 1HG1 ILE 45 HG12 ILE 45 243.312 -10.029 -5.008 360 2HG1 ILE 45 HG11 ILE 45 243.364 -10.047 -6.765 361 1HG2 ILE 45 HG21 ILE 45 244.035 -6.299 -4.972 362 2HG2 ILE 45 HG22 ILE 45 244.853 -7.770 -4.446 363 3HG2 ILE 45 HG23 ILE 45 243.219 -7.420 -3.881 364 1HD1 ILE 45 HD11 ILE 45 245.448 -10.745 -5.418 365 2HD1 ILE 45 HD12 ILE 45 245.690 -9.009 -5.220 366 3HD1 ILE 45 HD13 ILE 45 245.636 -9.713 -6.836 367 H GLU 46 HN GLU 46 241.349 -7.114 -8.278 368 HA GLU 46 HA GLU 46 241.466 -4.292 -7.747 369 1HB GLU 46 HB2 GLU 46 241.926 -5.690 -9.969 370 2HB GLU 46 HB1 GLU 46 240.220 -5.359 -10.241 371 1HG GLU 46 HG2 GLU 46 240.563 -3.047 -10.315 372 2HG GLU 46 HG1 GLU 46 242.159 -3.174 -9.577 373 H ASP 47 HN ASP 47 239.031 -6.747 -7.855 374 HA ASP 47 HA ASP 47 236.826 -4.896 -8.025 375 1HB ASP 47 HB2 ASP 47 237.128 -7.853 -7.813 376 2HB ASP 47 HB1 ASP 47 235.621 -7.152 -7.231 377 H GLY 48 HN GLY 48 238.532 -6.747 -5.583 378 1HA GLY 48 HA2 GLY 48 236.773 -6.113 -3.424 379 2HA GLY 48 HA1 GLY 48 238.421 -6.711 -3.277 380 H ALA 49 HN ALA 49 239.626 -4.596 -4.794 381 HA ALA 49 HA ALA 49 239.904 -2.638 -2.710 382 1HB ALA 49 HB1 ALA 49 241.059 -2.150 -5.399 383 2HB ALA 49 HB2 ALA 49 241.630 -3.567 -4.519 384 3HB ALA 49 HB3 ALA 49 241.782 -1.963 -3.801 385 H ARG 50 HN ARG 50 238.315 -2.884 -5.821 386 HA ARG 50 HA ARG 50 237.650 -0.110 -6.000 387 1HB ARG 50 HB2 ARG 50 236.905 -2.584 -7.500 388 2HB ARG 50 HB1 ARG 50 235.925 -1.140 -7.709 389 1HG ARG 50 HG2 ARG 50 238.023 0.089 -8.301 390 2HG ARG 50 HG1 ARG 50 238.854 -1.467 -8.299 391 1HD ARG 50 HD2 ARG 50 236.773 -2.067 -9.883 392 2HD ARG 50 HD1 ARG 50 236.916 -0.344 -10.228 393 HE ARG 50 HE ARG 50 239.456 -1.229 -10.481 394 1HH1 ARG 50 HH11 ARG 50 236.422 -2.294 -11.837 395 2HH1 ARG 50 HH12 ARG 50 237.141 -2.890 -13.296 396 1HH2 ARG 50 HH21 ARG 50 240.402 -2.010 -12.398 397 2HH2 ARG 50 HH22 ARG 50 239.401 -2.729 -13.614 398 H ARG 51 HN ARG 51 235.736 -3.038 -5.331 399 HA ARG 51 HA ARG 51 233.334 -1.723 -4.730 400 1HB ARG 51 HB2 ARG 51 234.020 -4.302 -5.052 401 2HB ARG 51 HB1 ARG 51 233.923 -4.250 -3.298 402 1HG ARG 51 HG2 ARG 51 231.622 -3.020 -3.904 403 2HG ARG 51 HG1 ARG 51 231.791 -4.053 -5.325 404 1HD ARG 51 HD2 ARG 51 232.297 -5.319 -2.703 405 2HD ARG 51 HD1 ARG 51 230.630 -4.855 -3.040 406 HE ARG 51 HE ARG 51 231.871 -6.316 -5.179 407 1HH1 ARG 51 HH11 ARG 51 230.132 -6.590 -2.166 408 2HH1 ARG 51 HH12 ARG 51 229.519 -8.170 -2.520 409 1HH2 ARG 51 HH21 ARG 51 231.065 -8.394 -5.646 410 2HH2 ARG 51 HH22 ARG 51 230.048 -9.196 -4.495 411 H GLU 52 HN GLU 52 236.109 -2.495 -2.729 412 HA GLU 52 HA GLU 52 234.777 -1.688 -0.289 413 1HB GLU 52 HB2 GLU 52 237.653 -2.440 -0.842 414 2HB GLU 52 HB1 GLU 52 237.010 -2.070 0.751 415 1HG GLU 52 HG2 GLU 52 235.532 -4.130 -0.719 416 2HG GLU 52 HG1 GLU 52 237.190 -4.555 -0.303 417 H LEU 53 HN LEU 53 236.605 -0.246 -2.791 418 HA LEU 53 HA LEU 53 237.707 1.926 -1.330 419 1HB LEU 53 HB2 LEU 53 238.740 1.439 -3.378 420 2HB LEU 53 HB1 LEU 53 237.211 1.363 -4.237 421 HG LEU 53 HG LEU 53 236.971 3.803 -3.972 422 1HD1 LEU 53 HD11 LEU 53 239.770 4.206 -3.251 423 2HD1 LEU 53 HD12 LEU 53 238.790 3.508 -1.962 424 3HD1 LEU 53 HD13 LEU 53 238.321 5.042 -2.695 425 1HD2 LEU 53 HD21 LEU 53 239.217 2.530 -5.428 426 2HD2 LEU 53 HD22 LEU 53 239.184 4.292 -5.362 427 3HD2 LEU 53 HD23 LEU 53 237.819 3.409 -6.044 428 H GLN 54 HN GLN 54 234.850 1.553 -3.391 429 HA GLN 54 HA GLN 54 233.911 4.193 -3.192 430 1HB GLN 54 HB2 GLN 54 232.868 3.012 -4.871 431 2HB GLN 54 HB1 GLN 54 232.701 1.560 -3.897 432 1HG GLN 54 HG2 GLN 54 230.886 2.581 -2.646 433 2HG GLN 54 HG1 GLN 54 231.075 4.073 -3.567 434 1HE2 GLN 54 HE21 GLN 54 229.555 4.305 -5.027 435 2HE2 GLN 54 HE22 GLN 54 228.830 3.047 -5.963 436 H GLU 55 HN GLU 55 233.745 1.513 -1.014 437 HA GLU 55 HA GLU 55 231.618 2.608 0.588 438 1HB GLU 55 HB2 GLU 55 233.460 0.307 1.230 439 2HB GLU 55 HB1 GLU 55 231.922 0.674 2.001 440 1HG GLU 55 HG2 GLU 55 231.753 0.354 -0.898 441 2HG GLU 55 HG1 GLU 55 232.287 -1.091 -0.039 442 H GLU 56 HN GLU 56 235.068 2.865 0.562 443 HA GLU 56 HA GLU 56 235.279 3.501 3.347 444 1HB GLU 56 HB2 GLU 56 237.118 3.179 1.092 445 2HB GLU 56 HB1 GLU 56 237.615 4.400 2.256 446 1HG GLU 56 HG2 GLU 56 236.716 2.047 3.626 447 2HG GLU 56 HG1 GLU 56 237.941 1.626 2.430 448 H SER 57 HN SER 57 235.341 5.455 0.361 449 HA SER 57 HA SER 57 234.834 7.797 2.070 450 1HB SER 57 HB2 SER 57 236.850 7.578 -0.164 451 2HB SER 57 HB1 SER 57 236.279 9.125 0.458 452 HG SER 57 HG SER 57 236.964 8.260 2.580 453 H GLY 58 HN GLY 58 233.135 6.053 0.293 454 1HA GLY 58 HA2 GLY 58 231.416 6.324 -1.202 455 2HA GLY 58 HA1 GLY 58 231.431 8.010 -0.710 456 H LEU 59 HN LEU 59 234.387 6.926 -2.012 457 HA LEU 59 HA LEU 59 233.801 8.335 -4.522 458 1HB LEU 59 HB2 LEU 59 236.392 7.778 -3.091 459 2HB LEU 59 HB1 LEU 59 236.301 8.463 -4.701 460 HG LEU 59 HG LEU 59 235.624 9.706 -2.073 461 1HD1 LEU 59 HD11 LEU 59 236.732 11.217 -4.346 462 2HD1 LEU 59 HD12 LEU 59 237.740 9.905 -3.738 463 3HD1 LEU 59 HD13 LEU 59 237.219 11.192 -2.652 464 1HD2 LEU 59 HD21 LEU 59 234.403 11.498 -3.209 465 2HD2 LEU 59 HD22 LEU 59 233.568 9.953 -3.369 466 3HD2 LEU 59 HD23 LEU 59 234.489 10.601 -4.725 467 H THR 60 HN THR 60 233.208 6.967 -6.020 468 HA THR 60 HA THR 60 234.358 4.305 -6.166 469 HB THR 60 HB THR 60 232.574 5.129 -8.339 470 HG1 THR 60 HG1 THR 60 230.969 5.853 -7.207 471 1HG2 THR 60 HG21 THR 60 232.177 2.954 -8.282 472 2HG2 THR 60 HG22 THR 60 231.425 3.144 -6.699 473 3HG2 THR 60 HG23 THR 60 233.149 2.797 -6.819 474 H VAL 61 HN VAL 61 235.351 3.519 -8.146 475 HA VAL 61 HA VAL 61 236.481 5.678 -9.797 476 HB VAL 61 HB VAL 61 238.642 4.636 -9.820 477 1HG1 VAL 61 HG11 VAL 61 237.456 5.050 -7.094 478 2HG1 VAL 61 HG12 VAL 61 238.460 6.148 -8.039 479 3HG1 VAL 61 HG13 VAL 61 239.170 4.702 -7.322 480 1HG2 VAL 61 HG21 VAL 61 238.736 2.677 -7.924 481 2HG2 VAL 61 HG22 VAL 61 238.645 2.399 -9.663 482 3HG2 VAL 61 HG23 VAL 61 237.177 2.367 -8.688 483 H ASP 62 HN ASP 62 236.647 5.310 -11.938 484 HA ASP 62 HA ASP 62 235.209 3.056 -13.004 485 1HB ASP 62 HB2 ASP 62 235.180 5.475 -13.891 486 2HB ASP 62 HB1 ASP 62 236.730 5.083 -14.631 487 H ALA 63 HN ALA 63 238.476 3.788 -12.286 488 HA ALA 63 HA ALA 63 239.430 1.249 -12.915 489 1HB ALA 63 HB1 ALA 63 239.223 1.591 -15.207 490 2HB ALA 63 HB2 ALA 63 240.917 1.969 -14.890 491 3HB ALA 63 HB3 ALA 63 239.747 3.271 -15.102 492 H LEU 64 HN LEU 64 240.684 1.332 -11.098 493 HA LEU 64 HA LEU 64 242.283 3.577 -10.372 494 1HB LEU 64 HB2 LEU 64 242.645 0.706 -9.503 495 2HB LEU 64 HB1 LEU 64 243.257 2.133 -8.692 496 HG LEU 64 HG LEU 64 240.468 2.465 -8.870 497 1HD1 LEU 64 HD11 LEU 64 239.901 0.375 -7.456 498 2HD1 LEU 64 HD12 LEU 64 241.317 -0.327 -8.239 499 3HD1 LEU 64 HD13 LEU 64 239.959 0.237 -9.213 500 1HD2 LEU 64 HD21 LEU 64 242.423 2.885 -7.054 501 2HD2 LEU 64 HD22 LEU 64 241.606 1.497 -6.336 502 3HD2 LEU 64 HD23 LEU 64 240.700 2.969 -6.687 503 H HIS 65 HN HIS 65 244.766 2.580 -9.771 504 HA HIS 65 HA HIS 65 245.858 1.574 -12.299 505 1HB HIS 65 HB2 HIS 65 247.154 3.832 -10.769 506 2HB HIS 65 HB1 HIS 65 247.590 3.218 -12.360 507 HD1 HIS 65 HD1 HIS 65 245.109 3.338 -13.947 508 HD2 HIS 65 HD2 HIS 65 246.035 6.254 -11.137 509 HE1 HIS 65 HE1 HIS 65 243.785 5.367 -14.623 510 HE2 HIS 65 HE2 HIS 65 244.434 7.147 -12.962 511 H LYS 66 HN LYS 66 246.490 -0.399 -11.591 512 HA LYS 66 HA LYS 66 247.484 -1.009 -9.036 513 1HB LYS 66 HB2 LYS 66 248.494 -3.035 -10.247 514 2HB LYS 66 HB1 LYS 66 246.749 -2.843 -10.315 515 1HG LYS 66 HG2 LYS 66 246.802 -2.130 -12.548 516 2HG LYS 66 HG1 LYS 66 248.541 -1.833 -12.496 517 1HD LYS 66 HD2 LYS 66 249.058 -4.012 -12.830 518 2HD LYS 66 HD1 LYS 66 247.674 -4.591 -11.901 519 1HE LYS 66 HE2 LYS 66 246.884 -5.181 -13.925 520 2HE LYS 66 HE1 LYS 66 246.414 -3.485 -14.015 521 1HZ LYS 66 HZ1 LYS 66 247.558 -3.632 -15.942 522 2HZ LYS 66 HZ2 LYS 66 248.547 -4.898 -15.411 523 3HZ LYS 66 HZ3 LYS 66 248.877 -3.309 -14.935 524 H VAL 67 HN VAL 67 249.460 -0.837 -8.116 525 HA VAL 67 HA VAL 67 251.644 0.066 -9.891 526 HB VAL 67 HB VAL 67 252.557 1.329 -7.947 527 1HG1 VAL 67 HG11 VAL 67 249.819 2.107 -8.936 528 2HG1 VAL 67 HG12 VAL 67 251.365 2.492 -9.690 529 3HG1 VAL 67 HG13 VAL 67 250.946 3.194 -8.127 530 1HG2 VAL 67 HG21 VAL 67 251.671 0.548 -5.999 531 2HG2 VAL 67 HG22 VAL 67 250.076 0.279 -6.700 532 3HG2 VAL 67 HG23 VAL 67 250.590 1.910 -6.281 533 H GLY 68 HN GLY 68 251.008 -1.519 -6.749 534 1HA GLY 68 HA2 GLY 68 253.105 -3.432 -7.377 535 2HA GLY 68 HA1 GLY 68 253.429 -2.394 -6.001 536 H GLN 69 HN GLN 69 253.490 -4.914 -5.418 537 HA GLN 69 HA GLN 69 250.954 -5.408 -4.015 538 1HB GLN 69 HB2 GLN 69 252.477 -7.227 -5.810 539 2HB GLN 69 HB1 GLN 69 251.766 -7.932 -4.364 540 1HG GLN 69 HG2 GLN 69 249.580 -6.905 -5.082 541 2HG GLN 69 HG1 GLN 69 250.361 -6.535 -6.619 542 1HE2 GLN 69 HE21 GLN 69 250.015 -7.964 -8.146 543 2HE2 GLN 69 HE22 GLN 69 249.710 -9.650 -7.923 544 H ILE 70 HN ILE 70 251.272 -5.420 -1.903 545 HA ILE 70 HA ILE 70 253.950 -6.047 -0.864 546 HB ILE 70 HB ILE 70 251.658 -4.692 0.557 547 1HG1 ILE 70 HG12 ILE 70 254.164 -3.397 -0.512 548 2HG1 ILE 70 HG11 ILE 70 252.656 -3.444 -1.420 549 1HG2 ILE 70 HG21 ILE 70 252.906 -5.393 2.311 550 2HG2 ILE 70 HG22 ILE 70 253.836 -3.948 1.914 551 3HG2 ILE 70 HG23 ILE 70 254.378 -5.528 1.349 552 1HD1 ILE 70 HD11 ILE 70 252.489 -1.398 -0.432 553 2HD1 ILE 70 HD12 ILE 70 253.358 -1.903 1.017 554 3HD1 ILE 70 HD13 ILE 70 251.680 -2.395 0.779 555 H VAL 71 HN VAL 71 254.204 -7.456 0.892 556 HA VAL 71 HA VAL 71 251.933 -9.261 1.405 557 HB VAL 71 HB VAL 71 254.779 -10.219 1.417 558 1HG1 VAL 71 HG11 VAL 71 252.138 -11.609 0.997 559 2HG1 VAL 71 HG12 VAL 71 253.086 -11.607 2.485 560 3HG1 VAL 71 HG13 VAL 71 253.721 -12.385 1.034 561 1HG2 VAL 71 HG21 VAL 71 252.930 -10.223 -0.970 562 2HG2 VAL 71 HG22 VAL 71 254.512 -10.998 -0.879 563 3HG2 VAL 71 HG23 VAL 71 254.386 -9.241 -0.798 564 H PHE 72 HN PHE 72 251.809 -10.185 3.482 565 HA PHE 72 HA PHE 72 253.635 -9.061 5.485 566 1HB PHE 72 HB2 PHE 72 250.623 -9.081 5.568 567 2HB PHE 72 HB1 PHE 72 251.611 -8.857 7.007 568 HD1 PHE 72 HD1 PHE 72 253.623 -7.046 6.461 569 HD2 PHE 72 HD2 PHE 72 249.724 -7.144 4.760 570 HE1 PHE 72 HE1 PHE 72 253.776 -4.638 5.983 571 HE2 PHE 72 HE2 PHE 72 249.870 -4.735 4.277 572 HZ PHE 72 HZ PHE 72 251.898 -3.479 4.888 573 H GLU 73 HN GLU 73 254.598 -10.644 6.547 574 HA GLU 73 HA GLU 73 253.264 -13.252 6.726 575 1HB GLU 73 HB2 GLU 73 256.147 -12.451 7.152 576 2HB GLU 73 HB1 GLU 73 255.530 -14.076 7.413 577 1HG GLU 73 HG2 GLU 73 255.284 -12.655 4.782 578 2HG GLU 73 HG1 GLU 73 256.683 -13.637 5.212 579 H PHE 74 HN PHE 74 252.397 -13.914 8.584 580 HA PHE 74 HA PHE 74 252.831 -12.291 10.966 581 1HB PHE 74 HB2 PHE 74 250.588 -13.517 9.917 582 2HB PHE 74 HB1 PHE 74 251.034 -14.583 11.245 583 HD1 PHE 74 HD1 PHE 74 250.121 -11.120 10.366 584 HD2 PHE 74 HD2 PHE 74 250.695 -13.947 13.494 585 HE1 PHE 74 HE1 PHE 74 249.061 -9.570 11.956 586 HE2 PHE 74 HE2 PHE 74 249.635 -12.402 15.090 587 HZ PHE 74 HZ PHE 74 248.817 -10.210 14.321 588 H VAL 75 HN VAL 75 253.976 -12.831 12.631 589 HA VAL 75 HA VAL 75 255.581 -15.201 12.547 590 HB VAL 75 HB VAL 75 255.585 -13.718 15.075 591 1HG1 VAL 75 HG11 VAL 75 257.535 -14.731 13.064 592 2HG1 VAL 75 HG12 VAL 75 257.391 -15.111 14.780 593 3HG1 VAL 75 HG13 VAL 75 258.057 -13.558 14.272 594 1HG2 VAL 75 HG21 VAL 75 255.937 -12.276 12.481 595 2HG2 VAL 75 HG22 VAL 75 256.911 -11.824 13.880 596 3HG2 VAL 75 HG23 VAL 75 255.152 -11.739 13.966 597 H GLY 76 HN GLY 76 254.787 -17.110 13.113 598 1HA GLY 76 HA2 GLY 76 254.137 -18.613 14.855 599 2HA GLY 76 HA1 GLY 76 253.263 -17.293 15.620 600 H GLU 77 HN GLU 77 252.221 -16.583 12.829 601 HA GLU 77 HA GLU 77 250.034 -18.547 12.859 602 1HB GLU 77 HB2 GLU 77 250.122 -15.666 12.652 603 2HB GLU 77 HB1 GLU 77 249.273 -16.358 11.276 604 1HG GLU 77 HG2 GLU 77 248.510 -17.501 13.859 605 2HG GLU 77 HG1 GLU 77 248.156 -15.782 13.686 606 HA PRO 78 HA PRO 78 251.944 -20.189 9.107 607 1HB PRO 78 HB2 PRO 78 249.168 -21.284 8.926 608 2HB PRO 78 HB1 PRO 78 250.716 -22.101 8.684 609 1HG PRO 78 HG2 PRO 78 249.350 -22.436 10.942 610 2HG PRO 78 HG1 PRO 78 251.118 -22.301 10.960 611 1HD PRO 78 HD2 PRO 78 249.058 -20.313 11.773 612 2HD PRO 78 HD1 PRO 78 250.690 -20.578 12.416 613 H GLU 79 HN GLU 79 248.777 -18.638 9.305 614 HA GLU 79 HA GLU 79 248.457 -18.212 6.524 615 1HB GLU 79 HB2 GLU 79 246.933 -17.791 8.839 616 2HB GLU 79 HB1 GLU 79 247.143 -16.197 8.130 617 1HG GLU 79 HG2 GLU 79 246.271 -17.029 6.005 618 2HG GLU 79 HG1 GLU 79 246.050 -18.622 6.726 619 H LEU 80 HN LEU 80 248.200 -15.899 5.665 620 HA LEU 80 HA LEU 80 250.236 -14.072 6.692 621 1HB LEU 80 HB2 LEU 80 250.219 -14.508 3.751 622 2HB LEU 80 HB1 LEU 80 251.530 -14.001 4.799 623 HG LEU 80 HG LEU 80 250.502 -16.812 4.919 624 1HD1 LEU 80 HD11 LEU 80 250.948 -16.719 2.643 625 2HD1 LEU 80 HD12 LEU 80 252.469 -17.287 3.330 626 3HD1 LEU 80 HD13 LEU 80 252.294 -15.600 2.852 627 1HD2 LEU 80 HD21 LEU 80 253.235 -16.776 5.244 628 2HD2 LEU 80 HD22 LEU 80 252.038 -16.825 6.538 629 3HD2 LEU 80 HD23 LEU 80 252.717 -15.281 6.023 630 H MET 81 HN MET 81 250.216 -12.214 4.659 631 HA MET 81 HA MET 81 247.428 -11.602 4.083 632 1HB MET 81 HB2 MET 81 248.718 -10.483 6.305 633 2HB MET 81 HB1 MET 81 248.733 -9.220 5.082 634 1HG MET 81 HG2 MET 81 246.163 -10.572 5.333 635 2HG MET 81 HG1 MET 81 246.682 -9.752 6.803 636 1HE MET 81 HE1 MET 81 248.054 -8.117 3.460 637 2HE MET 81 HE2 MET 81 246.528 -7.592 2.751 638 3HE MET 81 HE3 MET 81 246.839 -9.307 2.997 639 H ASP 82 HN ASP 82 247.473 -11.284 1.949 640 HA ASP 82 HA ASP 82 249.776 -9.861 0.791 641 1HB ASP 82 HB2 ASP 82 249.282 -12.136 -0.098 642 2HB ASP 82 HB1 ASP 82 247.703 -11.559 -0.621 643 H VAL 83 HN VAL 83 249.293 -7.722 0.830 644 HA VAL 83 HA VAL 83 246.617 -6.889 -0.053 645 HB VAL 83 HB VAL 83 247.377 -6.056 2.159 646 1HG1 VAL 83 HG11 VAL 83 249.319 -4.309 0.685 647 2HG1 VAL 83 HG12 VAL 83 249.800 -5.854 1.388 648 3HG1 VAL 83 HG13 VAL 83 249.169 -4.572 2.422 649 1HG2 VAL 83 HG21 VAL 83 245.706 -4.814 0.950 650 2HG2 VAL 83 HG22 VAL 83 246.949 -3.985 0.013 651 3HG2 VAL 83 HG23 VAL 83 246.804 -3.684 1.745 652 H HIS 84 HN HIS 84 246.421 -6.262 -2.082 653 HA HIS 84 HA HIS 84 248.704 -5.568 -3.687 654 1HB HIS 84 HB2 HIS 84 246.599 -6.793 -4.487 655 2HB HIS 84 HB1 HIS 84 245.804 -5.223 -4.459 656 HD1 HIS 84 HD1 HIS 84 247.075 -3.346 -6.020 657 HD2 HIS 84 HD2 HIS 84 247.835 -7.350 -6.831 658 HE1 HIS 84 HE1 HIS 84 248.013 -3.393 -8.351 659 HE2 HIS 84 HE2 HIS 84 248.546 -5.816 -8.788 660 H VAL 85 HN VAL 85 248.951 -3.500 -4.801 661 HA VAL 85 HA VAL 85 247.805 -1.292 -3.213 662 HB VAL 85 HB VAL 85 250.443 -1.365 -4.702 663 1HG1 VAL 85 HG11 VAL 85 249.271 0.860 -4.626 664 2HG1 VAL 85 HG12 VAL 85 250.862 0.822 -3.869 665 3HG1 VAL 85 HG13 VAL 85 249.411 0.789 -2.869 666 1HG2 VAL 85 HG21 VAL 85 250.205 -2.699 -2.542 667 2HG2 VAL 85 HG22 VAL 85 250.040 -1.140 -1.734 668 3HG2 VAL 85 HG23 VAL 85 251.517 -1.522 -2.619 669 H PHE 86 HN PHE 86 246.711 0.246 -4.244 670 HA PHE 86 HA PHE 86 246.847 0.427 -7.165 671 1HB PHE 86 HB2 PHE 86 244.497 -0.296 -5.480 672 2HB PHE 86 HB1 PHE 86 244.205 0.798 -6.826 673 HD1 PHE 86 HD1 PHE 86 244.484 0.049 -9.121 674 HD2 PHE 86 HD2 PHE 86 245.095 -2.595 -5.844 675 HE1 PHE 86 HE1 PHE 86 244.358 -1.873 -10.653 676 HE2 PHE 86 HE2 PHE 86 244.975 -4.522 -7.368 677 HZ PHE 86 HZ PHE 86 244.606 -4.162 -9.777 678 H CYS 87 HN CYS 87 246.388 2.438 -7.998 679 HA CYS 87 HA CYS 87 245.644 4.582 -6.135 680 1HB CYS 87 HB2 CYS 87 247.334 6.060 -7.304 681 2HB CYS 87 HB1 CYS 87 248.029 4.819 -6.267 682 HG CYS 87 HG CYS 87 249.406 4.648 -8.371 683 H THR 88 HN THR 88 243.843 5.471 -6.964 684 HA THR 88 HA THR 88 243.350 5.181 -9.828 685 HB THR 88 HB THR 88 241.646 4.425 -8.178 686 HG1 THR 88 HG1 THR 88 239.985 5.996 -9.311 687 1HG2 THR 88 HG21 THR 88 240.736 5.714 -6.631 688 2HG2 THR 88 HG22 THR 88 240.507 7.048 -7.762 689 3HG2 THR 88 HG23 THR 88 242.055 6.842 -6.944 690 H ASP 89 HN ASP 89 241.613 7.141 -10.369 691 HA ASP 89 HA ASP 89 242.547 9.738 -9.590 692 1HB ASP 89 HB2 ASP 89 243.244 8.608 -12.297 693 2HB ASP 89 HB1 ASP 89 243.078 10.342 -12.040 694 H SER 90 HN SER 90 240.757 7.789 -11.917 695 HA SER 90 HA SER 90 238.795 9.891 -12.327 696 1HB SER 90 HB2 SER 90 239.737 7.850 -13.933 697 2HB SER 90 HB1 SER 90 238.171 7.233 -13.410 698 HG SER 90 HG SER 90 238.534 9.838 -14.466 699 H ILE 91 HN ILE 91 237.608 10.145 -10.471 700 HA ILE 91 HA ILE 91 236.428 7.734 -9.288 701 HB ILE 91 HB ILE 91 235.864 9.094 -7.332 702 1HG1 ILE 91 HG12 ILE 91 237.378 11.359 -8.648 703 2HG1 ILE 91 HG11 ILE 91 235.621 11.242 -8.667 704 1HG2 ILE 91 HG21 ILE 91 237.951 8.007 -7.192 705 2HG2 ILE 91 HG22 ILE 91 238.238 9.660 -6.647 706 3HG2 ILE 91 HG23 ILE 91 238.721 9.169 -8.271 707 1HD1 ILE 91 HD11 ILE 91 237.364 11.458 -6.223 708 2HD1 ILE 91 HD12 ILE 91 235.608 11.296 -6.216 709 3HD1 ILE 91 HD13 ILE 91 236.358 12.732 -6.913 710 H GLN 92 HN GLN 92 234.171 8.368 -8.202 711 HA GLN 92 HA GLN 92 232.551 9.833 -10.158 712 1HB GLN 92 HB2 GLN 92 231.990 7.034 -9.177 713 2HB GLN 92 HB1 GLN 92 230.853 8.015 -10.090 714 1HG GLN 92 HG2 GLN 92 233.022 8.122 -11.702 715 2HG GLN 92 HG1 GLN 92 233.211 6.521 -10.988 716 1HE2 GLN 92 HE21 GLN 92 232.262 4.943 -12.042 717 2HE2 GLN 92 HE22 GLN 92 230.883 5.085 -13.073 718 H GLY 93 HN GLY 93 232.016 7.842 -7.256 719 1HA GLY 93 HA2 GLY 93 229.891 9.301 -6.230 720 2HA GLY 93 HA1 GLY 93 230.979 8.317 -5.266 721 H THR 94 HN THR 94 230.284 10.162 -3.760 722 HA THR 94 HA THR 94 232.158 12.404 -4.050 723 HB THR 94 HB THR 94 229.925 12.732 -2.177 724 HG1 THR 94 HG1 THR 94 229.480 12.387 -4.944 725 1HG2 THR 94 HG21 THR 94 231.538 14.388 -3.910 726 2HG2 THR 94 HG22 THR 94 230.592 14.822 -2.485 727 3HG2 THR 94 HG23 THR 94 229.818 14.742 -4.068 728 HA PRO 95 HA PRO 95 234.137 11.333 -0.295 729 1HB PRO 95 HB2 PRO 95 234.053 14.111 0.657 730 2HB PRO 95 HB1 PRO 95 235.448 13.137 0.183 731 1HG PRO 95 HG2 PRO 95 234.575 15.195 -1.303 732 2HG PRO 95 HG1 PRO 95 235.286 13.740 -2.026 733 1HD PRO 95 HD2 PRO 95 232.403 14.508 -1.759 734 2HD PRO 95 HD1 PRO 95 233.253 13.794 -3.147 735 H VAL 96 HN VAL 96 231.756 10.562 -0.051 736 HA VAL 96 HA VAL 96 230.151 11.950 1.873 737 HB VAL 96 HB VAL 96 229.880 9.034 1.173 738 1HG1 VAL 96 HG11 VAL 96 228.529 10.343 3.003 739 2HG1 VAL 96 HG12 VAL 96 227.727 9.186 1.940 740 3HG1 VAL 96 HG13 VAL 96 227.613 10.915 1.608 741 1HG2 VAL 96 HG21 VAL 96 228.162 10.146 -0.535 742 2HG2 VAL 96 HG22 VAL 96 229.830 9.776 -0.972 743 3HG2 VAL 96 HG23 VAL 96 229.384 11.419 -0.511 744 H GLU 97 HN GLU 97 232.291 12.020 3.204 745 HA GLU 97 HA GLU 97 233.351 9.977 4.666 746 1HB GLU 97 HB2 GLU 97 233.802 11.604 6.441 747 2HB GLU 97 HB1 GLU 97 234.095 12.304 4.856 748 1HG GLU 97 HG2 GLU 97 232.780 13.989 5.396 749 2HG GLU 97 HG1 GLU 97 231.420 12.870 5.466 750 H SER 98 HN SER 98 232.440 8.399 5.804 751 HA SER 98 HA SER 98 229.777 8.729 6.904 752 1HB SER 98 HB2 SER 98 229.870 6.335 7.349 753 2HB SER 98 HB1 SER 98 230.403 6.652 5.698 754 HG SER 98 HG SER 98 231.787 5.188 6.790 755 H ASP 99 HN ASP 99 229.608 7.353 9.126 756 HA ASP 99 HA ASP 99 230.777 9.038 11.081 757 1HB ASP 99 HB2 ASP 99 229.245 6.446 11.314 758 2HB ASP 99 HB1 ASP 99 229.756 7.399 12.703 759 H GLU 100 HN GLU 100 232.031 6.352 9.453 760 HA GLU 100 HA GLU 100 233.965 5.877 11.623 761 1HB GLU 100 HB2 GLU 100 232.391 4.044 10.158 762 2HB GLU 100 HB1 GLU 100 234.052 3.818 9.624 763 1HG GLU 100 HG2 GLU 100 234.745 3.545 11.967 764 2HG GLU 100 HG1 GLU 100 233.062 3.708 12.464 765 H MET 101 HN MET 101 233.558 6.541 8.201 766 HA MET 101 HA MET 101 236.481 6.788 7.950 767 1HB MET 101 HB2 MET 101 234.629 5.431 6.333 768 2HB MET 101 HB1 MET 101 235.098 6.858 5.419 769 1HG MET 101 HG2 MET 101 236.490 4.898 4.919 770 2HG MET 101 HG1 MET 101 237.419 6.249 5.563 771 1HE MET 101 HE1 MET 101 239.680 4.276 7.515 772 2HE MET 101 HE2 MET 101 239.018 5.831 8.022 773 3HE MET 101 HE3 MET 101 239.312 5.512 6.312 774 H ARG 102 HN ARG 102 237.261 8.506 6.503 775 HA ARG 102 HA ARG 102 235.599 10.711 5.816 776 1HB ARG 102 HB2 ARG 102 235.721 10.976 8.303 777 2HB ARG 102 HB1 ARG 102 237.467 11.123 8.166 778 1HG ARG 102 HG2 ARG 102 236.927 13.065 6.537 779 2HG ARG 102 HG1 ARG 102 235.336 13.029 7.299 780 1HD ARG 102 HD2 ARG 102 236.863 12.991 9.494 781 2HD ARG 102 HD1 ARG 102 237.961 13.836 8.405 782 HE ARG 102 HE ARG 102 235.355 14.956 8.301 783 1HH1 ARG 102 HH11 ARG 102 238.235 14.837 10.268 784 2HH1 ARG 102 HH12 ARG 102 237.954 16.384 10.993 785 1HH2 ARG 102 HH21 ARG 102 234.985 16.992 9.252 786 2HH2 ARG 102 HH22 ARG 102 236.109 17.607 10.417 787 HA PRO 103 HA PRO 103 239.462 10.561 3.393 788 1HB PRO 103 HB2 PRO 103 238.475 11.783 1.196 789 2HB PRO 103 HB1 PRO 103 238.179 10.074 1.539 790 1HG PRO 103 HG2 PRO 103 236.412 12.440 2.056 791 2HG PRO 103 HG1 PRO 103 235.993 10.873 1.337 792 1HD PRO 103 HD2 PRO 103 235.489 11.431 3.930 793 2HD PRO 103 HD1 PRO 103 235.940 9.800 3.394 794 H CYS 104 HN CYS 104 240.998 12.101 2.938 795 HA CYS 104 HA CYS 104 240.268 14.912 3.356 796 1HB CYS 104 HB2 CYS 104 242.785 13.712 4.506 797 2HB CYS 104 HB1 CYS 104 242.101 15.303 4.821 798 HG CYS 104 HG CYS 104 240.248 14.167 6.247 799 H TRP 105 HN TRP 105 240.848 16.049 1.651 800 HA TRP 105 HA TRP 105 242.762 14.994 -0.240 801 1HB TRP 105 HB2 TRP 105 241.146 17.555 -0.273 802 2HB TRP 105 HB1 TRP 105 242.116 16.948 -1.613 803 HD1 TRP 105 HD1 TRP 105 239.549 15.024 0.592 804 HE1 TRP 105 HE1 TRP 105 237.814 13.937 -0.972 805 HE3 TRP 105 HE3 TRP 105 241.229 16.866 -3.874 806 HZ2 TRP 105 HZ2 TRP 105 237.238 13.879 -3.736 807 HZ3 TRP 105 HZ3 TRP 105 240.028 16.246 -5.930 808 HH2 TRP 105 HH2 TRP 105 238.074 14.784 -5.861 809 H PHE 106 HN PHE 106 244.843 15.215 0.240 810 HA PHE 106 HA PHE 106 245.760 17.745 1.429 811 1HB PHE 106 HB2 PHE 106 246.052 15.258 2.456 812 2HB PHE 106 HB1 PHE 106 247.521 15.362 1.496 813 HD1 PHE 106 HD1 PHE 106 248.982 15.261 3.371 814 HD2 PHE 106 HD2 PHE 106 246.022 18.311 3.120 815 HE1 PHE 106 HE1 PHE 106 250.090 16.488 5.195 816 HE2 PHE 106 HE2 PHE 106 247.126 19.540 4.939 817 HZ PHE 106 HZ PHE 106 249.162 18.629 5.980 818 H GLN 107 HN GLN 107 248.526 17.280 0.962 819 HA GLN 107 HA GLN 107 248.617 17.865 -1.908 820 1HB GLN 107 HB2 GLN 107 249.510 19.569 -0.363 821 2HB GLN 107 HB1 GLN 107 250.681 18.401 0.231 822 1HG GLN 107 HG2 GLN 107 252.077 18.858 -1.423 823 2HG GLN 107 HG1 GLN 107 250.822 18.584 -2.630 824 1HE2 GLN 107 HE21 GLN 107 249.850 20.292 -3.586 825 2HE2 GLN 107 HE22 GLN 107 250.263 21.941 -3.278 826 H LEU 108 HN LEU 108 250.048 16.843 -3.289 827 HA LEU 108 HA LEU 108 250.631 14.128 -2.690 828 1HB LEU 108 HB2 LEU 108 251.276 13.925 -4.917 829 2HB LEU 108 HB1 LEU 108 250.084 15.209 -4.961 830 HG LEU 108 HG LEU 108 253.081 15.569 -5.054 831 1HD1 LEU 108 HD11 LEU 108 250.928 15.502 -7.108 832 2HD1 LEU 108 HD12 LEU 108 252.575 14.873 -7.173 833 3HD1 LEU 108 HD13 LEU 108 252.286 16.605 -7.331 834 1HD2 LEU 108 HD21 LEU 108 252.659 17.912 -5.344 835 2HD2 LEU 108 HD22 LEU 108 251.873 17.384 -3.858 836 3HD2 LEU 108 HD23 LEU 108 250.917 17.648 -5.316 837 H ASP 109 HN ASP 109 252.296 16.957 -1.977 838 HA ASP 109 HA ASP 109 254.819 15.470 -1.680 839 1HB ASP 109 HB2 ASP 109 254.644 17.581 -3.246 840 2HB ASP 109 HB1 ASP 109 254.742 18.464 -1.725 841 H GLN 110 HN GLN 110 252.387 15.847 0.099 842 HA GLN 110 HA GLN 110 253.902 16.451 2.496 843 1HB GLN 110 HB2 GLN 110 251.245 17.799 2.043 844 2HB GLN 110 HB1 GLN 110 252.380 18.067 3.360 845 1HG GLN 110 HG2 GLN 110 254.008 18.866 1.571 846 2HG GLN 110 HG1 GLN 110 252.611 18.914 0.495 847 1HE2 GLN 110 HE21 GLN 110 253.769 20.076 3.627 848 2HE2 GLN 110 HE22 GLN 110 252.923 21.581 3.580 849 H ILE 111 HN ILE 111 252.497 14.116 1.160 850 HA ILE 111 HA ILE 111 250.268 13.503 2.858 851 HB ILE 111 HB ILE 111 251.523 11.099 1.865 852 1HG1 ILE 111 HG12 ILE 111 250.879 11.708 -0.590 853 2HG1 ILE 111 HG11 ILE 111 251.212 13.361 -0.076 854 1HG2 ILE 111 HG21 ILE 111 249.016 12.007 2.403 855 2HG2 ILE 111 HG22 ILE 111 249.416 10.494 1.589 856 3HG2 ILE 111 HG23 ILE 111 249.024 11.927 0.642 857 1HD1 ILE 111 HD11 ILE 111 253.214 12.609 -0.999 858 2HD1 ILE 111 HD12 ILE 111 253.075 11.024 -0.238 859 3HD1 ILE 111 HD13 ILE 111 253.455 12.442 0.740 860 HA PRO 112 HA PRO 112 252.846 12.029 6.175 861 1HB PRO 112 HB2 PRO 112 250.983 11.930 8.075 862 2HB PRO 112 HB1 PRO 112 251.487 13.483 7.394 863 1HG PRO 112 HG2 PRO 112 249.015 11.901 6.878 864 2HG PRO 112 HG1 PRO 112 249.232 13.657 6.938 865 1HD PRO 112 HD2 PRO 112 249.151 12.045 4.621 866 2HD PRO 112 HD1 PRO 112 249.635 13.750 4.710 867 H PHE 113 HN PHE 113 253.445 9.995 5.527 868 HA PHE 113 HA PHE 113 251.600 7.808 5.523 869 1HB PHE 113 HB2 PHE 113 254.501 7.235 5.632 870 2HB PHE 113 HB1 PHE 113 253.254 6.534 4.616 871 HD1 PHE 113 HD1 PHE 113 252.328 9.442 3.635 872 HD2 PHE 113 HD2 PHE 113 256.026 7.338 3.819 873 HE1 PHE 113 HE1 PHE 113 253.188 10.753 1.745 874 HE2 PHE 113 HE2 PHE 113 256.878 8.640 1.930 875 HZ PHE 113 HZ PHE 113 255.460 10.364 0.888 876 H LYS 114 HN LYS 114 253.486 9.335 7.924 877 HA LYS 114 HA LYS 114 253.887 7.094 9.628 878 1HB LYS 114 HB2 LYS 114 254.441 8.774 11.342 879 2HB LYS 114 HB1 LYS 114 255.285 9.081 9.830 880 1HG LYS 114 HG2 LYS 114 253.151 10.622 9.421 881 2HG LYS 114 HG1 LYS 114 253.182 10.655 11.186 882 1HD LYS 114 HD2 LYS 114 255.787 11.052 9.875 883 2HD LYS 114 HD1 LYS 114 254.604 12.332 9.600 884 1HE LYS 114 HE2 LYS 114 255.266 11.266 12.336 885 2HE LYS 114 HE1 LYS 114 256.117 12.625 11.604 886 1HZ LYS 114 HZ1 LYS 114 253.190 12.709 11.710 887 2HZ LYS 114 HZ2 LYS 114 254.307 13.977 11.781 888 3HZ LYS 114 HZ3 LYS 114 254.051 12.999 13.137 889 H ASP 115 HN ASP 115 251.275 9.250 8.981 890 HA ASP 115 HA ASP 115 249.851 8.384 11.369 891 1HB ASP 115 HB2 ASP 115 249.367 10.571 9.362 892 2HB ASP 115 HB1 ASP 115 248.108 10.065 10.485 893 H MET 116 HN MET 116 250.420 6.655 9.010 894 HA MET 116 HA MET 116 247.641 5.870 8.472 895 1HB MET 116 HB2 MET 116 249.633 5.362 6.330 896 2HB MET 116 HB1 MET 116 247.918 5.719 6.205 897 1HG MET 116 HG2 MET 116 248.555 8.088 6.933 898 2HG MET 116 HG1 MET 116 250.205 7.615 6.552 899 1HE MET 116 HE1 MET 116 250.878 7.667 3.322 900 2HE MET 116 HE2 MET 116 249.839 6.269 3.046 901 3HE MET 116 HE3 MET 116 250.782 6.387 4.531 902 H TRP 117 HN TRP 117 250.875 4.606 7.648 903 HA TRP 117 HA TRP 117 250.568 2.365 9.423 904 1HB TRP 117 HB2 TRP 117 250.280 2.021 6.443 905 2HB TRP 117 HB1 TRP 117 250.803 0.703 7.483 906 HD1 TRP 117 HD1 TRP 117 247.761 2.138 6.047 907 HE1 TRP 117 HE1 TRP 117 245.663 1.240 7.235 908 HE3 TRP 117 HE3 TRP 117 249.980 0.064 10.159 909 HZ2 TRP 117 HZ2 TRP 117 245.031 -0.162 9.602 910 HZ3 TRP 117 HZ3 TRP 117 248.557 -1.036 11.839 911 HH2 TRP 117 HH2 TRP 117 246.133 -1.144 11.565 912 HA PRO 118 HA PRO 118 254.968 2.359 9.018 913 1HB PRO 118 HB2 PRO 118 255.635 -0.104 9.781 914 2HB PRO 118 HB1 PRO 118 254.845 1.015 10.896 915 1HG PRO 118 HG2 PRO 118 253.662 -1.245 9.330 916 2HG PRO 118 HG1 PRO 118 253.367 -0.775 11.014 917 1HD PRO 118 HD2 PRO 118 251.727 -0.116 8.906 918 2HD PRO 118 HD1 PRO 118 251.819 0.795 10.424 919 H ASP 119 HN ASP 119 253.245 1.206 6.599 920 HA ASP 119 HA ASP 119 255.587 0.101 5.206 921 1HB ASP 119 HB2 ASP 119 253.903 -1.248 3.850 922 2HB ASP 119 HB1 ASP 119 254.175 -1.771 5.509 923 H ASP 120 HN ASP 120 252.994 2.355 5.207 924 HA ASP 120 HA ASP 120 252.502 2.843 2.547 925 1HB ASP 120 HB2 ASP 120 252.498 4.562 4.977 926 2HB ASP 120 HB1 ASP 120 252.309 5.326 3.400 927 H SER 121 HN SER 121 255.092 4.316 4.494 928 HA SER 121 HA SER 121 256.203 5.909 2.484 929 1HB SER 121 HB2 SER 121 258.069 6.169 3.908 930 2HB SER 121 HB1 SER 121 256.716 5.879 5.001 931 HG SER 121 HG SER 121 258.394 4.568 5.638 932 H TYR 122 HN TYR 122 256.283 2.489 2.844 933 HA TYR 122 HA TYR 122 258.712 2.143 1.332 934 1HB TYR 122 HB2 TYR 122 256.776 0.320 2.682 935 2HB TYR 122 HB1 TYR 122 257.843 -0.337 1.446 936 HD1 TYR 122 HD1 TYR 122 257.519 0.420 4.876 937 HD2 TYR 122 HD2 TYR 122 260.385 0.248 1.737 938 HE1 TYR 122 HE1 TYR 122 259.321 0.241 6.539 939 HE2 TYR 122 HE2 TYR 122 262.196 0.067 3.391 940 HH TYR 122 HH TYR 122 261.635 -0.600 6.664 941 H TRP 123 HN TRP 123 255.275 2.201 0.645 942 HA TRP 123 HA TRP 123 255.935 1.334 -2.081 943 1HB TRP 123 HB2 TRP 123 253.638 0.536 -2.331 944 2HB TRP 123 HB1 TRP 123 254.458 -0.253 -0.989 945 HD1 TRP 123 HD1 TRP 123 253.546 0.226 1.462 946 HE1 TRP 123 HE1 TRP 123 251.321 1.199 2.318 947 HE3 TRP 123 HE3 TRP 123 251.827 2.289 -2.891 948 HZ2 TRP 123 HZ2 TRP 123 249.125 2.663 1.282 949 HZ3 TRP 123 HZ3 TRP 123 249.654 3.447 -2.866 950 HH2 TRP 123 HH2 TRP 123 248.337 3.620 -0.828 951 H PHE 124 HN PHE 124 254.920 4.029 -0.318 952 HA PHE 124 HA PHE 124 253.243 5.161 -2.341 953 1HB PHE 124 HB2 PHE 124 253.542 5.694 0.288 954 2HB PHE 124 HB1 PHE 124 254.534 6.975 -0.391 955 HD1 PHE 124 HD1 PHE 124 251.778 5.968 -2.495 956 HD2 PHE 124 HD2 PHE 124 252.878 8.468 0.764 957 HE1 PHE 124 HE1 PHE 124 249.767 7.328 -2.858 958 HE2 PHE 124 HE2 PHE 124 250.876 9.825 0.412 959 HZ PHE 124 HZ PHE 124 249.309 9.261 -1.404 960 HA PRO 125 HA PRO 125 257.341 7.884 -3.002 961 1HB PRO 125 HB2 PRO 125 259.193 5.575 -2.635 962 2HB PRO 125 HB1 PRO 125 259.442 7.287 -2.275 963 1HG PRO 125 HG2 PRO 125 258.961 5.554 -0.320 964 2HG PRO 125 HG1 PRO 125 258.252 7.179 -0.286 965 1HD PRO 125 HD2 PRO 125 256.967 4.564 -0.929 966 2HD PRO 125 HD1 PRO 125 256.292 5.982 -0.102 967 H LEU 126 HN LEU 126 257.101 4.438 -3.856 968 HA LEU 126 HA LEU 126 258.227 4.877 -6.465 969 1HB LEU 126 HB2 LEU 126 257.422 2.512 -6.887 970 2HB LEU 126 HB1 LEU 126 258.625 2.725 -5.631 971 HG LEU 126 HG LEU 126 256.124 2.872 -4.342 972 1HD1 LEU 126 HD11 LEU 126 255.229 1.822 -6.427 973 2HD1 LEU 126 HD12 LEU 126 254.996 0.868 -4.961 974 3HD1 LEU 126 HD13 LEU 126 256.270 0.436 -6.102 975 1HD2 LEU 126 HD21 LEU 126 256.962 0.532 -3.548 976 2HD2 LEU 126 HD22 LEU 126 257.868 1.984 -3.127 977 3HD2 LEU 126 HD23 LEU 126 258.412 0.959 -4.456 978 H LEU 127 HN LEU 127 255.039 4.725 -5.042 979 HA LEU 127 HA LEU 127 253.472 4.441 -7.340 980 1HB LEU 127 HB2 LEU 127 252.979 6.042 -4.827 981 2HB LEU 127 HB1 LEU 127 251.767 5.786 -6.063 982 HG LEU 127 HG LEU 127 252.482 4.124 -3.849 983 1HD1 LEU 127 HD11 LEU 127 250.358 4.038 -5.975 984 2HD1 LEU 127 HD12 LEU 127 250.225 4.666 -4.332 985 3HD1 LEU 127 HD13 LEU 127 250.408 2.932 -4.602 986 1HD2 LEU 127 HD21 LEU 127 252.622 2.772 -6.542 987 2HD2 LEU 127 HD22 LEU 127 252.548 1.954 -4.981 988 3HD2 LEU 127 HD23 LEU 127 253.948 2.940 -5.393 989 H LEU 128 HN LEU 128 254.616 7.331 -5.679 990 HA LEU 128 HA LEU 128 253.679 9.258 -7.474 991 1HB LEU 128 HB2 LEU 128 255.790 9.140 -5.384 992 2HB LEU 128 HB1 LEU 128 255.856 10.480 -6.514 993 HG LEU 128 HG LEU 128 253.229 9.965 -5.248 994 1HD1 LEU 128 HD11 LEU 128 254.200 9.775 -3.213 995 2HD1 LEU 128 HD12 LEU 128 254.248 11.533 -3.346 996 3HD1 LEU 128 HD13 LEU 128 255.685 10.580 -3.720 997 1HD2 LEU 128 HD21 LEU 128 253.611 12.564 -5.013 998 2HD2 LEU 128 HD22 LEU 128 253.142 11.838 -6.551 999 3HD2 LEU 128 HD23 LEU 128 254.829 12.260 -6.252 1000 H GLN 129 HN GLN 129 256.406 7.121 -7.638 1001 HA GLN 129 HA GLN 129 257.694 8.589 -9.777 1002 1HB GLN 129 HB2 GLN 129 258.396 6.409 -7.981 1003 2HB GLN 129 HB1 GLN 129 258.891 6.087 -9.638 1004 1HG GLN 129 HG2 GLN 129 260.016 8.308 -9.658 1005 2HG GLN 129 HG1 GLN 129 259.643 8.453 -7.942 1006 1HE2 GLN 129 HE21 GLN 129 262.076 7.854 -9.902 1007 2HE2 GLN 129 HE22 GLN 129 262.987 6.714 -8.977 1008 H LYS 130 HN LYS 130 255.004 6.776 -9.719 1009 HA LYS 130 HA LYS 130 253.797 5.603 -11.228 1010 1HB LYS 130 HB2 LYS 130 253.753 6.470 -13.334 1011 2HB LYS 130 HB1 LYS 130 254.716 7.713 -12.556 1012 1HG LYS 130 HG2 LYS 130 256.628 5.940 -13.407 1013 2HG LYS 130 HG1 LYS 130 255.416 5.846 -14.683 1014 1HD LYS 130 HD2 LYS 130 256.964 7.560 -15.280 1015 2HD LYS 130 HD1 LYS 130 255.461 8.345 -14.796 1016 1HE LYS 130 HE2 LYS 130 256.537 8.520 -12.471 1017 2HE LYS 130 HE1 LYS 130 258.053 8.154 -13.294 1018 1HZ LYS 130 HZ1 LYS 130 257.158 10.615 -12.962 1019 2HZ LYS 130 HZ2 LYS 130 256.421 10.273 -14.445 1020 3HZ LYS 130 HZ3 LYS 130 258.102 10.162 -14.292 1021 H LYS 131 HN LYS 131 256.228 4.391 -10.036 1022 HA LYS 131 HA LYS 131 256.863 2.398 -12.103 1023 1HB LYS 131 HB2 LYS 131 258.309 3.208 -9.582 1024 2HB LYS 131 HB1 LYS 131 258.727 1.763 -10.493 1025 1HG LYS 131 HG2 LYS 131 258.830 3.509 -12.486 1026 2HG LYS 131 HG1 LYS 131 259.159 4.617 -11.152 1027 1HD LYS 131 HD2 LYS 131 260.667 2.062 -11.699 1028 2HD LYS 131 HD1 LYS 131 261.217 3.680 -12.142 1029 1HE LYS 131 HE2 LYS 131 261.338 4.333 -9.839 1030 2HE LYS 131 HE1 LYS 131 260.581 2.827 -9.323 1031 1HZ LYS 131 HZ1 LYS 131 262.490 1.666 -9.591 1032 2HZ LYS 131 HZ2 LYS 131 263.186 3.179 -9.291 1033 3HZ LYS 131 HZ3 LYS 131 263.041 2.617 -10.879 1034 H LYS 132 HN LYS 132 257.001 0.134 -11.412 1035 HA LYS 132 HA LYS 132 254.961 -0.455 -9.380 1036 1HB LYS 132 HB2 LYS 132 255.884 -2.066 -11.763 1037 2HB LYS 132 HB1 LYS 132 254.754 -2.660 -10.552 1038 1HG LYS 132 HG2 LYS 132 253.221 -1.910 -12.011 1039 2HG LYS 132 HG1 LYS 132 253.541 -0.358 -11.232 1040 1HD LYS 132 HD2 LYS 132 254.934 0.357 -12.978 1041 2HD LYS 132 HD1 LYS 132 255.121 -1.278 -13.614 1042 1HE LYS 132 HE2 LYS 132 252.386 -0.120 -13.513 1043 2HE LYS 132 HE1 LYS 132 253.497 0.492 -14.737 1044 1HZ LYS 132 HZ1 LYS 132 251.962 -1.625 -15.116 1045 2HZ LYS 132 HZ2 LYS 132 253.320 -2.401 -14.471 1046 3HZ LYS 132 HZ3 LYS 132 253.473 -1.449 -15.861 1047 H PHE 133 HN PHE 133 255.352 -1.929 -7.751 1048 HA PHE 133 HA PHE 133 257.893 -3.333 -7.695 1049 1HB PHE 133 HB2 PHE 133 258.922 -2.143 -6.076 1050 2HB PHE 133 HB1 PHE 133 257.839 -0.850 -6.575 1051 HD1 PHE 133 HD1 PHE 133 259.174 -2.251 -3.809 1052 HD2 PHE 133 HD2 PHE 133 255.341 -1.307 -5.402 1053 HE1 PHE 133 HE1 PHE 133 258.253 -2.164 -1.530 1054 HE2 PHE 133 HE2 PHE 133 254.414 -1.216 -3.124 1055 HZ PHE 133 HZ PHE 133 255.870 -1.644 -1.185 1056 H HIS 134 HN HIS 134 258.090 -4.605 -5.603 1057 HA HIS 134 HA HIS 134 255.521 -5.432 -4.484 1058 1HB HIS 134 HB2 HIS 134 256.253 -6.899 -6.498 1059 2HB HIS 134 HB1 HIS 134 257.492 -7.514 -5.410 1060 HD1 HIS 134 HD1 HIS 134 254.189 -8.240 -6.518 1061 HD2 HIS 134 HD2 HIS 134 256.183 -8.540 -2.886 1062 HE1 HIS 134 HE1 HIS 134 252.851 -9.871 -5.149 1063 HE2 HIS 134 HE2 HIS 134 254.139 -10.122 -3.000 1064 H GLY 135 HN GLY 135 255.720 -5.547 -2.303 1065 1HA GLY 135 HA2 GLY 135 258.440 -6.040 -1.251 1066 2HA GLY 135 HA1 GLY 135 257.392 -4.803 -0.578 1067 H TYR 136 HN TYR 136 258.660 -7.089 0.682 1068 HA TYR 136 HA TYR 136 256.262 -8.446 1.715 1069 1HB TYR 136 HB2 TYR 136 257.342 -10.260 0.810 1070 2HB TYR 136 HB1 TYR 136 258.929 -9.514 0.932 1071 HD1 TYR 136 HD1 TYR 136 260.198 -11.194 1.960 1072 HD2 TYR 136 HD2 TYR 136 256.464 -10.076 3.665 1073 HE1 TYR 136 HE1 TYR 136 260.698 -12.564 3.939 1074 HE2 TYR 136 HE2 TYR 136 256.956 -11.439 5.650 1075 HH TYR 136 HH TYR 136 258.337 -13.310 6.303 1076 H PHE 137 HN PHE 137 255.821 -7.810 3.734 1077 HA PHE 137 HA PHE 137 258.081 -6.997 5.448 1078 1HB PHE 137 HB2 PHE 137 255.270 -5.904 5.581 1079 2HB PHE 137 HB1 PHE 137 256.683 -5.325 6.459 1080 HD1 PHE 137 HD1 PHE 137 255.395 -5.805 3.003 1081 HD2 PHE 137 HD2 PHE 137 257.937 -3.588 5.597 1082 HE1 PHE 137 HE1 PHE 137 255.879 -4.230 1.175 1083 HE2 PHE 137 HE2 PHE 137 258.425 -2.011 3.774 1084 HZ PHE 137 HZ PHE 137 257.396 -2.328 1.560 1085 H LYS 138 HN LYS 138 258.254 -7.932 7.406 1086 HA LYS 138 HA LYS 138 256.307 -9.951 8.176 1087 1HB LYS 138 HB2 LYS 138 259.095 -9.706 8.432 1088 2HB LYS 138 HB1 LYS 138 258.462 -9.584 10.067 1089 1HG LYS 138 HG2 LYS 138 257.055 -11.697 9.144 1090 2HG LYS 138 HG1 LYS 138 258.557 -11.877 8.236 1091 1HD LYS 138 HD2 LYS 138 259.720 -12.479 10.058 1092 2HD LYS 138 HD1 LYS 138 258.958 -11.245 11.063 1093 1HE LYS 138 HE2 LYS 138 257.880 -12.918 12.067 1094 2HE LYS 138 HE1 LYS 138 256.919 -13.044 10.595 1095 1HZ LYS 138 HZ1 LYS 138 257.685 -15.173 10.822 1096 2HZ LYS 138 HZ2 LYS 138 259.167 -14.705 11.493 1097 3HZ LYS 138 HZ3 LYS 138 258.898 -14.528 9.832 1098 H PHE 139 HN PHE 139 254.911 -9.708 9.919 1099 HA PHE 139 HA PHE 139 255.037 -7.075 11.237 1100 1HB PHE 139 HB2 PHE 139 252.888 -8.550 10.017 1101 2HB PHE 139 HB1 PHE 139 252.510 -8.250 11.711 1102 HD1 PHE 139 HD1 PHE 139 252.490 -6.914 8.441 1103 HD2 PHE 139 HD2 PHE 139 252.811 -5.818 12.540 1104 HE1 PHE 139 HE1 PHE 139 251.818 -4.615 7.876 1105 HE2 PHE 139 HE2 PHE 139 252.141 -3.518 11.981 1106 HZ PHE 139 HZ PHE 139 251.643 -2.914 9.648 1107 H GLN 140 HN GLN 140 254.161 -6.963 13.441 1108 HA GLN 140 HA GLN 140 254.522 -9.394 15.036 1109 1HB GLN 140 HB2 GLN 140 256.666 -8.329 15.186 1110 2HB GLN 140 HB1 GLN 140 255.935 -6.758 15.447 1111 1HG GLN 140 HG2 GLN 140 256.944 -7.815 17.466 1112 2HG GLN 140 HG1 GLN 140 255.256 -7.338 17.639 1113 1HE2 GLN 140 HE21 GLN 140 257.358 -10.088 16.968 1114 2HE2 GLN 140 HE22 GLN 140 256.304 -11.287 17.628 1115 H GLY 141 HN GLY 141 252.158 -9.200 15.027 1116 1HA GLY 141 HA2 GLY 141 250.556 -8.870 16.825 1117 2HA GLY 141 HA1 GLY 141 251.269 -7.285 17.090 1118 H GLN 142 HN GLN 142 251.151 -5.812 15.079 1119 HA GLN 142 HA GLN 142 249.202 -6.185 13.113 1120 1HB GLN 142 HB2 GLN 142 248.185 -5.311 15.722 1121 2HB GLN 142 HB1 GLN 142 247.690 -4.282 14.384 1122 1HG GLN 142 HG2 GLN 142 247.224 -6.755 13.361 1123 2HG GLN 142 HG1 GLN 142 246.876 -7.006 15.071 1124 1HE2 GLN 142 HE21 GLN 142 245.219 -5.796 16.049 1125 2HE2 GLN 142 HE22 GLN 142 243.973 -5.055 15.111 1126 H ASP 143 HN ASP 143 250.840 -3.867 15.217 1127 HA ASP 143 HA ASP 143 251.062 -2.064 12.893 1128 1HB ASP 143 HB2 ASP 143 251.065 -1.196 15.784 1129 2HB ASP 143 HB1 ASP 143 251.007 -0.164 14.357 1130 H THR 144 HN THR 144 252.866 -4.252 14.175 1131 HA THR 144 HA THR 144 255.271 -2.550 14.339 1132 HB THR 144 HB THR 144 254.737 -5.192 15.705 1133 HG1 THR 144 HG1 THR 144 253.908 -3.189 16.654 1134 1HG2 THR 144 HG21 THR 144 257.249 -3.537 15.709 1135 2HG2 THR 144 HG22 THR 144 257.044 -5.129 14.978 1136 3HG2 THR 144 HG23 THR 144 256.934 -4.941 16.728 1137 H ILE 145 HN ILE 145 256.929 -2.979 12.986 1138 HA ILE 145 HA ILE 145 256.633 -5.361 11.298 1139 HB ILE 145 HB ILE 145 258.171 -2.872 10.571 1140 1HG1 ILE 145 HG12 ILE 145 255.425 -3.788 9.680 1141 2HG1 ILE 145 HG11 ILE 145 255.769 -2.386 10.689 1142 1HG2 ILE 145 HG21 ILE 145 257.334 -5.250 8.911 1143 2HG2 ILE 145 HG22 ILE 145 258.954 -4.975 9.551 1144 3HG2 ILE 145 HG23 ILE 145 258.278 -3.866 8.358 1145 1HD1 ILE 145 HD11 ILE 145 256.917 -1.313 8.857 1146 2HD1 ILE 145 HD12 ILE 145 255.292 -1.788 8.363 1147 3HD1 ILE 145 HD13 ILE 145 256.685 -2.738 7.845 1148 H LEU 146 HN LEU 146 258.300 -6.743 11.034 1149 HA LEU 146 HA LEU 146 260.695 -6.222 12.667 1150 1HB LEU 146 HB2 LEU 146 259.765 -8.982 11.971 1151 2HB LEU 146 HB1 LEU 146 260.776 -8.460 13.306 1152 HG LEU 146 HG LEU 146 257.910 -7.596 13.196 1153 1HD1 LEU 146 HD11 LEU 146 258.541 -10.254 13.051 1154 2HD1 LEU 146 HD12 LEU 146 257.058 -9.585 13.731 1155 3HD1 LEU 146 HD13 LEU 146 258.410 -9.986 14.790 1156 1HD2 LEU 146 HD21 LEU 146 259.290 -8.385 15.685 1157 2HD2 LEU 146 HD22 LEU 146 258.205 -7.032 15.365 1158 3HD2 LEU 146 HD23 LEU 146 259.896 -6.941 14.873 1159 H ASP 147 HN ASP 147 259.487 -6.912 9.541 1160 HA ASP 147 HA ASP 147 262.168 -6.886 8.467 1161 1HB ASP 147 HB2 ASP 147 260.981 -9.355 8.940 1162 2HB ASP 147 HB1 ASP 147 260.672 -9.066 7.231 1163 H TYR 148 HN TYR 148 262.249 -6.006 6.423 1164 HA TYR 148 HA TYR 148 259.731 -5.771 4.964 1165 1HB TYR 148 HB2 TYR 148 259.959 -3.413 4.594 1166 2HB TYR 148 HB1 TYR 148 259.975 -3.726 6.325 1167 HD1 TYR 148 HD1 TYR 148 262.016 -3.412 7.629 1168 HD2 TYR 148 HD2 TYR 148 261.933 -2.583 3.458 1169 HE1 TYR 148 HE1 TYR 148 264.131 -2.173 7.839 1170 HE2 TYR 148 HE2 TYR 148 264.047 -1.343 3.655 1171 HH TYR 148 HH TYR 148 266.113 -1.509 5.497 1172 H THR 149 HN THR 149 259.917 -6.047 2.834 1173 HA THR 149 HA THR 149 262.591 -5.820 1.629 1174 HB THR 149 HB THR 149 261.289 -7.784 0.154 1175 HG1 THR 149 HG1 THR 149 260.732 -9.315 1.770 1176 1HG2 THR 149 HG21 THR 149 262.925 -9.324 1.028 1177 2HG2 THR 149 HG22 THR 149 263.284 -8.225 2.360 1178 3HG2 THR 149 HG23 THR 149 263.674 -7.761 0.703 1179 H LEU 150 HN LEU 150 262.673 -5.084 -0.460 1180 HA LEU 150 HA LEU 150 260.145 -4.329 -1.733 1181 1HB LEU 150 HB2 LEU 150 262.498 -2.526 -1.203 1182 2HB LEU 150 HB1 LEU 150 261.280 -2.160 -2.411 1183 HG LEU 150 HG LEU 150 259.723 -2.629 -0.221 1184 1HD1 LEU 150 HD11 LEU 150 262.106 -2.660 0.958 1185 2HD1 LEU 150 HD12 LEU 150 260.669 -1.998 1.737 1186 3HD1 LEU 150 HD13 LEU 150 261.829 -0.919 0.961 1187 1HD2 LEU 150 HD21 LEU 150 260.922 0.059 -0.846 1188 2HD2 LEU 150 HD22 LEU 150 259.319 -0.296 -0.200 1189 3HD2 LEU 150 HD23 LEU 150 259.712 -0.719 -1.866 1190 H ARG 151 HN ARG 151 260.054 -4.956 -3.779 1191 HA ARG 151 HA ARG 151 262.568 -5.286 -5.274 1192 1HB ARG 151 HB2 ARG 151 260.188 -7.150 -5.355 1193 2HB ARG 151 HB1 ARG 151 261.634 -7.292 -6.344 1194 1HG ARG 151 HG2 ARG 151 261.917 -7.253 -3.382 1195 2HG ARG 151 HG1 ARG 151 261.339 -8.721 -4.174 1196 1HD ARG 151 HD2 ARG 151 263.740 -7.402 -5.312 1197 2HD ARG 151 HD1 ARG 151 263.926 -8.235 -3.768 1198 HE ARG 151 HE ARG 151 262.647 -10.058 -5.302 1199 1HH1 ARG 151 HH11 ARG 151 265.540 -8.160 -5.765 1200 2HH1 ARG 151 HH12 ARG 151 266.308 -9.348 -6.764 1201 1HH2 ARG 151 HH21 ARG 151 263.657 -11.621 -6.615 1202 2HH2 ARG 151 HH22 ARG 151 265.240 -11.312 -7.247 1203 H GLU 152 HN GLU 152 262.595 -4.028 -7.014 1204 HA GLU 152 HA GLU 152 260.163 -2.820 -7.988 1205 1HB GLU 152 HB2 GLU 152 261.734 -1.693 -9.610 1206 2HB GLU 152 HB1 GLU 152 262.051 -1.384 -7.909 1207 1HG GLU 152 HG2 GLU 152 263.984 -2.630 -7.901 1208 2HG GLU 152 HG1 GLU 152 263.490 -3.600 -9.288 1209 H VAL 153 HN VAL 153 259.159 -3.167 -9.925 1210 HA VAL 153 HA VAL 153 260.273 -5.196 -11.724 1211 HB VAL 153 HB VAL 153 258.012 -6.233 -11.950 1212 1HG1 VAL 153 HG11 VAL 153 259.736 -6.403 -9.560 1213 2HG1 VAL 153 HG12 VAL 153 259.275 -7.648 -10.720 1214 3HG1 VAL 153 HG13 VAL 153 258.157 -7.176 -9.441 1215 1HG2 VAL 153 HG21 VAL 153 256.235 -5.717 -10.586 1216 2HG2 VAL 153 HG22 VAL 153 256.962 -4.125 -10.803 1217 3HG2 VAL 153 HG23 VAL 153 257.260 -5.036 -9.323 1218 H ASP 154 HN ASP 154 259.072 -5.284 -13.818 1219 HA ASP 154 HA ASP 154 257.288 -3.278 -14.630 1220 1HB ASP 154 HB2 ASP 154 260.090 -2.490 -14.553 1221 2HB ASP 154 HB1 ASP 154 259.412 -2.348 -16.172 1222 H THR 155 HN THR 155 260.009 -5.310 -15.617 1223 HA THR 155 HA THR 155 259.004 -5.683 -18.282 1224 HB THR 155 HB THR 155 261.134 -7.242 -16.808 1225 HG1 THR 155 HG1 THR 155 262.365 -5.592 -17.122 1226 1HG2 THR 155 HG21 THR 155 260.014 -7.724 -19.316 1227 2HG2 THR 155 HG22 THR 155 261.502 -8.400 -18.652 1228 3HG2 THR 155 HG23 THR 155 261.559 -6.931 -19.626 1229 H VAL 156 HN VAL 156 257.009 -6.614 -18.278 1230 HA VAL 156 HA VAL 156 256.657 -9.132 -16.811 1231 HB VAL 156 HB VAL 156 254.539 -7.493 -18.208 1232 1HG1 VAL 156 HG11 VAL 156 253.206 -8.870 -16.362 1233 2HG1 VAL 156 HG12 VAL 156 254.540 -9.995 -16.618 1234 3HG1 VAL 156 HG13 VAL 156 253.521 -9.511 -17.974 1235 1HG2 VAL 156 HG21 VAL 156 254.586 -7.542 -15.272 1236 2HG2 VAL 156 HG22 VAL 156 254.255 -6.211 -16.381 1237 3HG2 VAL 156 HG23 VAL 156 255.920 -6.663 -16.018 Start of MODEL 26 1 1H MET 1 HT1 MET 1 245.631 -24.074 -0.640 2 2H MET 1 HT2 MET 1 245.172 -23.339 0.842 3 3H MET 1 HT3 MET 1 245.828 -22.385 -0.424 4 HA MET 1 HA MET 1 243.968 -22.600 -1.727 5 1HB MET 1 HB2 MET 1 243.361 -24.870 0.147 6 2HB MET 1 HB1 MET 1 242.084 -24.138 -0.813 7 1HG MET 1 HG2 MET 1 243.271 -24.688 -2.855 8 2HG MET 1 HG1 MET 1 244.600 -25.367 -1.917 9 1HE MET 1 HE1 MET 1 244.129 -27.005 -3.815 10 2HE MET 1 HE2 MET 1 242.437 -27.252 -4.245 11 3HE MET 1 HE3 MET 1 243.335 -28.532 -3.429 12 H GLY 2 HN GLY 2 243.071 -23.281 1.660 13 1HA GLY 2 HA2 GLY 2 241.508 -20.804 1.677 14 2HA GLY 2 HA1 GLY 2 241.390 -22.109 2.848 15 H ALA 3 HN ALA 3 243.994 -19.982 1.654 16 HA ALA 3 HA ALA 3 244.398 -18.984 4.363 17 1HB ALA 3 HB1 ALA 3 245.887 -21.105 3.615 18 2HB ALA 3 HB2 ALA 3 246.435 -19.866 4.744 19 3HB ALA 3 HB3 ALA 3 246.906 -19.784 3.046 20 H SER 4 HN SER 4 246.751 -17.629 4.006 21 HA SER 4 HA SER 4 247.536 -15.627 3.262 22 1HB SER 4 HB2 SER 4 247.934 -15.416 0.939 23 2HB SER 4 HB1 SER 4 247.965 -17.150 1.260 24 HG SER 4 HG SER 4 246.091 -15.624 -0.130 25 H ARG 5 HN ARG 5 246.092 -14.390 4.418 26 HA ARG 5 HA ARG 5 243.530 -13.665 3.499 27 1HB ARG 5 HB2 ARG 5 245.264 -12.994 5.710 28 2HB ARG 5 HB1 ARG 5 244.501 -11.545 5.071 29 1HG ARG 5 HG2 ARG 5 243.112 -12.377 6.801 30 2HG ARG 5 HG1 ARG 5 242.301 -12.714 5.271 31 1HD ARG 5 HD2 ARG 5 244.095 -14.830 6.272 32 2HD ARG 5 HD1 ARG 5 242.643 -14.537 7.228 33 HE ARG 5 HE ARG 5 242.160 -14.806 4.401 34 1HH1 ARG 5 HH11 ARG 5 242.467 -16.496 7.440 35 2HH1 ARG 5 HH12 ARG 5 241.536 -17.860 6.918 36 1HH2 ARG 5 HH21 ARG 5 240.935 -16.598 3.715 37 2HH2 ARG 5 HH22 ARG 5 240.667 -17.918 4.803 38 H LEU 6 HN LEU 6 243.508 -12.967 1.428 39 HA LEU 6 HA LEU 6 245.341 -10.905 0.543 40 1HB LEU 6 HB2 LEU 6 244.317 -12.923 -0.813 41 2HB LEU 6 HB1 LEU 6 243.005 -11.794 -1.091 42 HG LEU 6 HG LEU 6 245.787 -10.884 -1.667 43 1HD1 LEU 6 HD11 LEU 6 245.902 -11.931 -3.759 44 2HD1 LEU 6 HD12 LEU 6 244.225 -12.468 -3.680 45 3HD1 LEU 6 HD13 LEU 6 245.438 -13.213 -2.640 46 1HD2 LEU 6 HD21 LEU 6 243.696 -9.450 -1.827 47 2HD2 LEU 6 HD22 LEU 6 243.248 -10.442 -3.213 48 3HD2 LEU 6 HD23 LEU 6 244.733 -9.493 -3.252 49 H TYR 7 HN TYR 7 244.988 -8.842 0.789 50 HA TYR 7 HA TYR 7 242.223 -7.846 0.946 51 1HB TYR 7 HB2 TYR 7 244.636 -7.159 2.593 52 2HB TYR 7 HB1 TYR 7 243.352 -5.976 2.371 53 HD1 TYR 7 HD1 TYR 7 243.561 -9.633 3.150 54 HD2 TYR 7 HD2 TYR 7 241.867 -5.853 4.121 55 HE1 TYR 7 HE1 TYR 7 242.292 -10.678 4.978 56 HE2 TYR 7 HE2 TYR 7 240.594 -6.887 5.953 57 HH TYR 7 HH TYR 7 241.100 -9.261 7.435 58 H THR 8 HN THR 8 242.417 -5.261 0.733 59 HA THR 8 HA THR 8 244.074 -4.718 -1.648 60 HB THR 8 HB THR 8 242.169 -3.304 -2.448 61 HG1 THR 8 HG1 THR 8 240.095 -3.971 -1.479 62 1HG2 THR 8 HG21 THR 8 242.266 -5.301 -3.600 63 2HG2 THR 8 HG22 THR 8 240.620 -5.288 -2.970 64 3HG2 THR 8 HG23 THR 8 241.861 -6.259 -2.178 65 H LEU 9 HN LEU 9 244.286 -2.373 -2.100 66 HA LEU 9 HA LEU 9 243.951 -0.546 0.110 67 1HB LEU 9 HB2 LEU 9 246.152 -1.918 0.398 68 2HB LEU 9 HB1 LEU 9 246.749 -0.910 -0.906 69 HG LEU 9 HG LEU 9 245.862 -0.036 1.827 70 1HD1 LEU 9 HD11 LEU 9 248.455 -0.204 0.373 71 2HD1 LEU 9 HD12 LEU 9 248.058 -0.675 2.026 72 3HD1 LEU 9 HD13 LEU 9 248.227 1.031 1.611 73 1HD2 LEU 9 HD21 LEU 9 246.414 1.612 -0.623 74 2HD2 LEU 9 HD22 LEU 9 246.494 2.266 1.013 75 3HD2 LEU 9 HD23 LEU 9 244.973 1.620 0.395 76 H VAL 10 HN VAL 10 243.019 1.074 -1.038 77 HA VAL 10 HA VAL 10 244.234 1.808 -3.595 78 HB VAL 10 HB VAL 10 242.037 1.273 -4.059 79 1HG1 VAL 10 HG11 VAL 10 241.463 2.298 -1.377 80 2HG1 VAL 10 HG12 VAL 10 240.881 0.851 -2.200 81 3HG1 VAL 10 HG13 VAL 10 240.184 2.422 -2.582 82 1HG2 VAL 10 HG21 VAL 10 242.634 3.496 -4.934 83 2HG2 VAL 10 HG22 VAL 10 241.890 4.224 -3.510 84 3HG2 VAL 10 HG23 VAL 10 240.904 3.319 -4.654 85 H LEU 11 HN LEU 11 245.266 3.603 -3.777 86 HA LEU 11 HA LEU 11 244.714 5.812 -1.918 87 1HB LEU 11 HB2 LEU 11 247.112 4.302 -2.262 88 2HB LEU 11 HB1 LEU 11 247.403 5.922 -2.863 89 HG LEU 11 HG LEU 11 246.691 5.058 -0.073 90 1HD1 LEU 11 HD11 LEU 11 248.643 7.052 -0.046 91 2HD1 LEU 11 HD12 LEU 11 249.059 6.022 -1.417 92 3HD1 LEU 11 HD13 LEU 11 248.886 5.321 0.190 93 1HD2 LEU 11 HD21 LEU 11 246.024 7.600 -1.405 94 2HD2 LEU 11 HD22 LEU 11 246.783 7.732 0.182 95 3HD2 LEU 11 HD23 LEU 11 245.286 6.818 -0.007 96 H VAL 12 HN VAL 12 243.825 7.395 -3.103 97 HA VAL 12 HA VAL 12 244.337 7.561 -5.937 98 HB VAL 12 HB VAL 12 242.742 9.544 -4.332 99 1HG1 VAL 12 HG11 VAL 12 241.453 9.325 -6.645 100 2HG1 VAL 12 HG12 VAL 12 243.060 8.849 -7.195 101 3HG1 VAL 12 HG13 VAL 12 242.819 10.419 -6.430 102 1HG2 VAL 12 HG21 VAL 12 240.837 7.917 -5.272 103 2HG2 VAL 12 HG22 VAL 12 241.555 7.728 -3.671 104 3HG2 VAL 12 HG23 VAL 12 242.120 6.735 -5.015 105 H LEU 13 HN LEU 13 246.494 8.119 -6.087 106 HA LEU 13 HA LEU 13 247.380 10.634 -4.903 107 1HB LEU 13 HB2 LEU 13 248.755 8.361 -6.253 108 2HB LEU 13 HB1 LEU 13 249.554 9.912 -6.088 109 HG LEU 13 HG LEU 13 249.799 7.949 -4.310 110 1HD1 LEU 13 HD11 LEU 13 251.239 9.600 -3.856 111 2HD1 LEU 13 HD12 LEU 13 250.046 10.044 -2.637 112 3HD1 LEU 13 HD13 LEU 13 250.057 10.862 -4.199 113 1HD2 LEU 13 HD21 LEU 13 247.527 7.797 -3.618 114 2HD2 LEU 13 HD22 LEU 13 247.438 9.536 -3.349 115 3HD2 LEU 13 HD23 LEU 13 248.441 8.534 -2.304 116 H GLN 14 HN GLN 14 248.471 12.220 -6.234 117 HA GLN 14 HA GLN 14 247.822 12.171 -9.083 118 1HB GLN 14 HB2 GLN 14 246.367 13.694 -7.201 119 2HB GLN 14 HB1 GLN 14 247.400 14.831 -8.055 120 1HG GLN 14 HG2 GLN 14 245.950 14.850 -9.718 121 2HG GLN 14 HG1 GLN 14 246.299 13.148 -10.013 122 1HE2 GLN 14 HE21 GLN 14 243.900 15.301 -9.423 123 2HE2 GLN 14 HE22 GLN 14 242.699 14.236 -8.784 124 HA PRO 15 HA PRO 15 251.855 13.852 -9.558 125 1HB PRO 15 HB2 PRO 15 250.900 15.739 -11.604 126 2HB PRO 15 HB1 PRO 15 252.026 14.389 -11.764 127 1HG PRO 15 HG2 PRO 15 249.542 14.291 -12.786 128 2HG PRO 15 HG1 PRO 15 250.344 12.853 -12.127 129 1HD PRO 15 HD2 PRO 15 248.245 14.593 -10.887 130 2HD PRO 15 HD1 PRO 15 248.409 12.824 -10.851 131 H GLN 16 HN GLN 16 249.770 15.365 -7.851 132 HA GLN 16 HA GLN 16 251.495 17.545 -7.186 133 1HB GLN 16 HB2 GLN 16 248.699 18.181 -8.154 134 2HB GLN 16 HB1 GLN 16 249.855 19.331 -7.495 135 1HG GLN 16 HG2 GLN 16 251.366 18.777 -9.407 136 2HG GLN 16 HG1 GLN 16 250.046 17.829 -10.092 137 1HE2 GLN 16 HE21 GLN 16 251.546 20.537 -10.600 138 2HE2 GLN 16 HE22 GLN 16 250.253 21.590 -11.052 139 H ARG 17 HN ARG 17 248.340 15.995 -6.759 140 HA ARG 17 HA ARG 17 248.600 16.455 -3.866 141 1HB ARG 17 HB2 ARG 17 246.060 16.565 -3.832 142 2HB ARG 17 HB1 ARG 17 246.900 17.958 -4.498 143 1HG ARG 17 HG2 ARG 17 245.717 17.777 -6.356 144 2HG ARG 17 HG1 ARG 17 246.397 16.174 -6.635 145 1HD ARG 17 HD2 ARG 17 244.559 15.107 -5.849 146 2HD ARG 17 HD1 ARG 17 244.218 16.352 -4.649 147 HE ARG 17 HE ARG 17 243.176 16.187 -7.315 148 1HH1 ARG 17 HH11 ARG 17 243.963 18.363 -4.703 149 2HH1 ARG 17 HH12 ARG 17 242.835 19.576 -5.206 150 1HH2 ARG 17 HH21 ARG 17 241.691 17.782 -7.979 151 2HH2 ARG 17 HH22 ARG 17 241.545 19.246 -7.066 152 H VAL 18 HN VAL 18 247.378 14.943 -2.525 153 HA VAL 18 HA VAL 18 246.875 12.328 -3.789 154 HB VAL 18 HB VAL 18 248.972 11.879 -2.907 155 1HG1 VAL 18 HG11 VAL 18 249.209 12.718 -0.301 156 2HG1 VAL 18 HG12 VAL 18 248.332 14.044 -1.062 157 3HG1 VAL 18 HG13 VAL 18 249.889 13.530 -1.711 158 1HG2 VAL 18 HG21 VAL 18 246.968 10.528 -1.845 159 2HG2 VAL 18 HG22 VAL 18 247.552 11.275 -0.360 160 3HG2 VAL 18 HG23 VAL 18 248.629 10.263 -1.320 161 H LEU 19 HN LEU 19 245.297 11.060 -2.720 162 HA LEU 19 HA LEU 19 243.726 12.528 -0.704 163 1HB LEU 19 HB2 LEU 19 242.570 12.221 -2.847 164 2HB LEU 19 HB1 LEU 19 242.786 10.487 -2.712 165 HG LEU 19 HG LEU 19 241.320 10.393 -0.794 166 1HD1 LEU 19 HD11 LEU 19 241.710 13.307 -0.836 167 2HD1 LEU 19 HD12 LEU 19 241.413 12.216 0.518 168 3HD1 LEU 19 HD13 LEU 19 240.070 12.766 -0.484 169 1HD2 LEU 19 HD21 LEU 19 239.448 10.434 -2.027 170 2HD2 LEU 19 HD22 LEU 19 240.531 10.861 -3.352 171 3HD2 LEU 19 HD23 LEU 19 239.662 12.124 -2.480 172 H LEU 20 HN LEU 20 243.863 11.709 1.268 173 HA LEU 20 HA LEU 20 244.236 8.799 1.562 174 1HB LEU 20 HB2 LEU 20 245.668 11.023 2.703 175 2HB LEU 20 HB1 LEU 20 244.938 10.067 3.979 176 HG LEU 20 HG LEU 20 246.655 8.857 1.818 177 1HD1 LEU 20 HD11 LEU 20 247.572 9.545 4.595 178 2HD1 LEU 20 HD12 LEU 20 247.837 10.608 3.214 179 3HD1 LEU 20 HD13 LEU 20 248.540 8.989 3.229 180 1HD2 LEU 20 HD21 LEU 20 246.416 6.899 2.895 181 2HD2 LEU 20 HD22 LEU 20 244.950 7.645 3.529 182 3HD2 LEU 20 HD23 LEU 20 246.430 7.652 4.489 183 H GLY 21 HN GLY 21 242.999 7.707 3.099 184 1HA GLY 21 HA2 GLY 21 240.546 9.118 3.851 185 2HA GLY 21 HA1 GLY 21 240.767 7.376 3.816 186 H MET 22 HN MET 22 240.045 9.680 5.862 187 HA MET 22 HA MET 22 241.720 8.623 8.039 188 1HB MET 22 HB2 MET 22 242.084 10.974 7.869 189 2HB MET 22 HB1 MET 22 240.365 11.298 7.712 190 1HG MET 22 HG2 MET 22 239.964 10.819 9.986 191 2HG MET 22 HG1 MET 22 241.562 10.106 10.193 192 1HE MET 22 HE1 MET 22 243.839 11.750 10.776 193 2HE MET 22 HE2 MET 22 243.870 13.208 9.788 194 3HE MET 22 HE3 MET 22 243.539 11.645 9.042 195 H LYS 23 HN LYS 23 240.736 7.848 9.903 196 HA LYS 23 HA LYS 23 237.958 7.107 9.587 197 1HB LYS 23 HB2 LYS 23 240.232 6.242 11.261 198 2HB LYS 23 HB1 LYS 23 238.653 6.141 12.028 199 1HG LYS 23 HG2 LYS 23 238.806 5.054 9.299 200 2HG LYS 23 HG1 LYS 23 239.737 4.188 10.522 201 1HD LYS 23 HD2 LYS 23 236.834 4.921 10.854 202 2HD LYS 23 HD1 LYS 23 237.378 3.379 10.189 203 1HE LYS 23 HE2 LYS 23 238.760 3.154 12.328 204 2HE LYS 23 HE1 LYS 23 237.775 4.473 12.958 205 1HZ LYS 23 HZ1 LYS 23 237.129 1.889 13.165 206 2HZ LYS 23 HZ2 LYS 23 236.294 2.296 11.753 207 3HZ LYS 23 HZ3 LYS 23 235.997 3.146 13.185 208 H LYS 24 HN LYS 24 236.302 7.675 11.007 209 HA LYS 24 HA LYS 24 236.750 10.219 12.346 210 1HB LYS 24 HB2 LYS 24 234.598 9.094 10.896 211 2HB LYS 24 HB1 LYS 24 234.036 9.283 12.549 212 1HG LYS 24 HG2 LYS 24 233.535 11.367 11.941 213 2HG LYS 24 HG1 LYS 24 235.266 11.675 12.099 214 1HD LYS 24 HD2 LYS 24 235.407 10.882 9.652 215 2HD LYS 24 HD1 LYS 24 233.662 11.143 9.622 216 1HE LYS 24 HE2 LYS 24 234.467 13.462 10.729 217 2HE LYS 24 HE1 LYS 24 235.874 13.093 9.733 218 1HZ LYS 24 HZ1 LYS 24 233.082 13.541 8.877 219 2HZ LYS 24 HZ2 LYS 24 234.184 12.730 7.881 220 3HZ LYS 24 HZ3 LYS 24 234.487 14.325 8.353 221 H ARG 25 HN ARG 25 235.991 6.891 13.027 222 HA ARG 25 HA ARG 25 236.742 7.213 15.743 223 1HB ARG 25 HB2 ARG 25 234.346 6.044 16.328 224 2HB ARG 25 HB1 ARG 25 234.717 7.744 16.568 225 1HG ARG 25 HG2 ARG 25 233.776 7.134 13.873 226 2HG ARG 25 HG1 ARG 25 232.610 6.749 15.140 227 1HD ARG 25 HD2 ARG 25 233.312 9.122 16.033 228 2HD ARG 25 HD1 ARG 25 233.764 9.377 14.351 229 HE ARG 25 HE ARG 25 231.541 9.439 13.793 230 1HH1 ARG 25 HH11 ARG 25 231.872 8.154 17.021 231 2HH1 ARG 25 HH12 ARG 25 230.171 8.198 17.347 232 1HH2 ARG 25 HH21 ARG 25 229.303 9.500 14.222 233 2HH2 ARG 25 HH22 ARG 25 228.714 8.962 15.759 234 H GLY 26 HN GLY 26 237.350 5.299 16.676 235 1HA GLY 26 HA2 GLY 26 236.999 2.852 16.798 236 2HA GLY 26 HA1 GLY 26 236.902 2.875 15.044 237 H PHE 27 HN PHE 27 238.614 1.649 14.475 238 HA PHE 27 HA PHE 27 241.192 2.050 15.749 239 1HB PHE 27 HB2 PHE 27 240.012 0.035 13.907 240 2HB PHE 27 HB1 PHE 27 241.753 0.275 13.824 241 HD1 PHE 27 HD1 PHE 27 243.155 -0.778 15.344 242 HD2 PHE 27 HD2 PHE 27 239.001 -0.451 16.210 243 HE1 PHE 27 HE1 PHE 27 243.452 -2.241 17.300 244 HE2 PHE 27 HE2 PHE 27 239.291 -1.912 18.169 245 HZ PHE 27 HZ PHE 27 241.518 -2.810 18.715 246 H GLY 28 HN GLY 28 241.320 4.305 14.973 247 1HA GLY 28 HA2 GLY 28 243.197 4.924 13.237 248 2HA GLY 28 HA1 GLY 28 241.887 4.588 12.116 249 H ALA 29 HN ALA 29 240.091 5.718 14.419 250 HA ALA 29 HA ALA 29 239.389 8.114 13.374 251 1HB ALA 29 HB1 ALA 29 238.111 8.427 15.180 252 2HB ALA 29 HB2 ALA 29 239.405 8.029 16.310 253 3HB ALA 29 HB3 ALA 29 238.548 6.742 15.460 254 H GLY 30 HN GLY 30 241.069 9.451 12.667 255 1HA GLY 30 HA2 GLY 30 242.005 11.594 13.573 256 2HA GLY 30 HA1 GLY 30 242.756 10.597 14.808 257 H ARG 31 HN ARG 31 243.011 8.656 12.277 258 HA ARG 31 HA ARG 31 245.533 9.866 11.350 259 1HB ARG 31 HB2 ARG 31 244.960 6.907 11.528 260 2HB ARG 31 HB1 ARG 31 246.505 7.680 11.203 261 1HG ARG 31 HG2 ARG 31 246.778 8.349 13.415 262 2HG ARG 31 HG1 ARG 31 245.064 8.147 13.784 263 1HD ARG 31 HD2 ARG 31 245.358 5.693 13.428 264 2HD ARG 31 HD1 ARG 31 247.091 5.976 13.275 265 HE ARG 31 HE ARG 31 245.563 5.901 15.693 266 1HH1 ARG 31 HH11 ARG 31 248.400 7.266 14.187 267 2HH1 ARG 31 HH12 ARG 31 249.232 7.508 15.686 268 1HH2 ARG 31 HH21 ARG 31 246.655 6.220 17.665 269 2HH2 ARG 31 HH22 ARG 31 248.242 6.915 17.661 270 H TRP 32 HN TRP 32 246.229 9.066 9.168 271 HA TRP 32 HA TRP 32 243.870 8.773 7.429 272 1HB TRP 32 HB2 TRP 32 246.376 9.640 6.154 273 2HB TRP 32 HB1 TRP 32 244.741 10.255 5.957 274 HD1 TRP 32 HD1 TRP 32 247.538 10.475 8.656 275 HE1 TRP 32 HE1 TRP 32 247.511 12.861 9.616 276 HE3 TRP 32 HE3 TRP 32 243.589 12.374 6.021 277 HZ2 TRP 32 HZ2 TRP 32 246.025 15.236 9.297 278 HZ3 TRP 32 HZ3 TRP 32 242.931 14.711 6.409 279 HH2 TRP 32 HH2 TRP 32 244.124 16.113 8.012 280 H ASN 33 HN ASN 33 243.935 7.288 5.719 281 HA ASN 33 HA ASN 33 246.227 5.725 5.131 282 1HB ASN 33 HB2 ASN 33 245.418 3.562 6.003 283 2HB ASN 33 HB1 ASN 33 245.745 4.713 7.296 284 1HD2 ASN 33 HD21 ASN 33 244.262 4.845 8.804 285 2HD2 ASN 33 HD22 ASN 33 242.590 4.443 8.633 286 H GLY 34 HN GLY 34 245.871 4.191 3.449 287 1HA GLY 34 HA2 GLY 34 244.014 4.992 1.519 288 2HA GLY 34 HA1 GLY 34 244.897 3.472 1.501 289 H PHE 35 HN PHE 35 242.464 3.377 0.458 290 HA PHE 35 HA PHE 35 240.636 2.442 2.549 291 1HB PHE 35 HB2 PHE 35 239.831 2.522 -0.323 292 2HB PHE 35 HB1 PHE 35 238.880 2.856 1.114 293 HD1 PHE 35 HD1 PHE 35 240.710 4.262 -1.589 294 HD2 PHE 35 HD2 PHE 35 239.368 5.027 2.376 295 HE1 PHE 35 HE1 PHE 35 241.011 6.676 -1.957 296 HE2 PHE 35 HE2 PHE 35 239.665 7.441 2.016 297 HZ PHE 35 HZ PHE 35 240.487 8.270 -0.154 298 H GLY 36 HN GLY 36 241.200 0.397 3.086 299 1HA GLY 36 HA2 GLY 36 241.931 -1.487 0.990 300 2HA GLY 36 HA1 GLY 36 242.015 -1.775 2.720 301 H GLY 37 HN GLY 37 241.068 -3.769 1.242 302 1HA GLY 37 HA2 GLY 37 238.475 -4.199 2.299 303 2HA GLY 37 HA1 GLY 37 238.369 -3.826 0.585 304 H LYS 38 HN LYS 38 238.656 -6.277 2.801 305 HA LYS 38 HA LYS 38 240.399 -8.100 1.610 306 1HB LYS 38 HB2 LYS 38 239.231 -9.817 2.862 307 2HB LYS 38 HB1 LYS 38 239.419 -8.380 3.858 308 1HG LYS 38 HG2 LYS 38 237.044 -7.783 3.064 309 2HG LYS 38 HG1 LYS 38 236.945 -9.479 2.588 310 1HD LYS 38 HD2 LYS 38 237.951 -9.678 5.111 311 2HD LYS 38 HD1 LYS 38 236.914 -8.259 5.258 312 1HE LYS 38 HE2 LYS 38 235.261 -9.880 3.906 313 2HE LYS 38 HE1 LYS 38 236.212 -11.090 4.766 314 1HZ LYS 38 HZ1 LYS 38 234.638 -10.692 6.323 315 2HZ LYS 38 HZ2 LYS 38 234.344 -9.107 5.811 316 3HZ LYS 38 HZ3 LYS 38 235.702 -9.450 6.759 317 H VAL 39 HN VAL 39 240.163 -9.709 0.088 318 HA VAL 39 HA VAL 39 238.222 -9.229 -1.967 319 HB VAL 39 HB VAL 39 240.011 -11.653 -1.841 320 1HG1 VAL 39 HG11 VAL 39 238.368 -11.574 -3.644 321 2HG1 VAL 39 HG12 VAL 39 240.005 -11.405 -4.278 322 3HG1 VAL 39 HG13 VAL 39 238.967 -9.988 -4.129 323 1HG2 VAL 39 HG21 VAL 39 240.790 -8.852 -1.991 324 2HG2 VAL 39 HG22 VAL 39 241.382 -9.816 -3.344 325 3HG2 VAL 39 HG23 VAL 39 241.767 -10.290 -1.689 326 H GLN 40 HN GLN 40 236.189 -9.882 -1.786 327 HA GLN 40 HA GLN 40 235.080 -11.591 0.028 328 1HB GLN 40 HB2 GLN 40 234.094 -10.098 -1.991 329 2HB GLN 40 HB1 GLN 40 233.872 -11.702 -2.674 330 1HG GLN 40 HG2 GLN 40 232.918 -12.008 -0.126 331 2HG GLN 40 HG1 GLN 40 232.433 -10.361 -0.527 332 1HE2 GLN 40 HE21 GLN 40 230.297 -10.639 -0.822 333 2HE2 GLN 40 HE22 GLN 40 229.601 -11.667 -2.023 334 H GLU 41 HN GLU 41 233.885 -13.702 -0.553 335 HA GLU 41 HA GLU 41 235.851 -15.675 -1.073 336 1HB GLU 41 HB2 GLU 41 233.958 -17.274 -0.895 337 2HB GLU 41 HB1 GLU 41 234.047 -16.149 0.454 338 1HG GLU 41 HG2 GLU 41 232.133 -15.058 -0.143 339 2HG GLU 41 HG1 GLU 41 232.308 -15.456 -1.852 340 H GLY 42 HN GLY 42 236.352 -14.566 -3.254 341 1HA GLY 42 HA2 GLY 42 236.494 -15.780 -5.408 342 2HA GLY 42 HA1 GLY 42 234.744 -15.908 -5.340 343 H GLU 43 HN GLU 43 236.847 -13.093 -4.699 344 HA GLU 43 HA GLU 43 235.651 -11.799 -7.034 345 1HB GLU 43 HB2 GLU 43 235.019 -9.922 -5.900 346 2HB GLU 43 HB1 GLU 43 234.844 -11.078 -4.592 347 1HG GLU 43 HG2 GLU 43 236.861 -10.384 -3.585 348 2HG GLU 43 HG1 GLU 43 237.346 -9.471 -5.012 349 H THR 44 HN THR 44 237.018 -9.735 -7.522 350 HA THR 44 HA THR 44 239.788 -10.671 -7.532 351 HB THR 44 HB THR 44 240.059 -9.101 -9.419 352 HG1 THR 44 HG1 THR 44 237.255 -8.766 -9.291 353 1HG2 THR 44 HG21 THR 44 238.812 -10.360 -11.024 354 2HG2 THR 44 HG22 THR 44 237.679 -10.901 -9.784 355 3HG2 THR 44 HG23 THR 44 239.351 -11.460 -9.755 356 H ILE 45 HN ILE 45 241.481 -9.419 -6.916 357 HA ILE 45 HA ILE 45 241.198 -7.814 -4.708 358 HB ILE 45 HB ILE 45 243.484 -7.287 -6.568 359 1HG1 ILE 45 HG12 ILE 45 243.099 -9.795 -4.925 360 2HG1 ILE 45 HG11 ILE 45 243.192 -9.707 -6.678 361 1HG2 ILE 45 HG21 ILE 45 244.611 -7.536 -4.221 362 2HG2 ILE 45 HG22 ILE 45 242.968 -7.250 -3.647 363 3HG2 ILE 45 HG23 ILE 45 243.765 -6.055 -4.670 364 1HD1 ILE 45 HD11 ILE 45 245.266 -10.269 -5.016 365 2HD1 ILE 45 HD12 ILE 45 245.499 -8.549 -5.328 366 3HD1 ILE 45 HD13 ILE 45 245.413 -9.686 -6.674 367 H GLU 46 HN GLU 46 241.107 -6.897 -8.092 368 HA GLU 46 HA GLU 46 241.176 -4.063 -7.585 369 1HB GLU 46 HB2 GLU 46 241.827 -5.360 -9.755 370 2HB GLU 46 HB1 GLU 46 240.105 -5.296 -10.105 371 1HG GLU 46 HG2 GLU 46 240.164 -2.861 -9.976 372 2HG GLU 46 HG1 GLU 46 241.888 -2.921 -9.612 373 H ASP 47 HN ASP 47 238.798 -6.548 -7.629 374 HA ASP 47 HA ASP 47 236.569 -4.724 -7.947 375 1HB ASP 47 HB2 ASP 47 236.890 -7.677 -7.683 376 2HB ASP 47 HB1 ASP 47 235.354 -6.977 -7.179 377 H GLY 48 HN GLY 48 238.171 -6.582 -5.427 378 1HA GLY 48 HA2 GLY 48 236.345 -5.910 -3.341 379 2HA GLY 48 HA1 GLY 48 237.982 -6.520 -3.128 380 H ALA 49 HN ALA 49 239.294 -4.455 -4.582 381 HA ALA 49 HA ALA 49 239.484 -2.459 -2.528 382 1HB ALA 49 HB1 ALA 49 241.286 -3.443 -4.237 383 2HB ALA 49 HB2 ALA 49 241.426 -1.833 -3.532 384 3HB ALA 49 HB3 ALA 49 240.779 -2.031 -5.161 385 H ARG 50 HN ARG 50 238.228 -2.680 -5.804 386 HA ARG 50 HA ARG 50 237.572 0.054 -6.086 387 1HB ARG 50 HB2 ARG 50 237.805 -1.290 -8.051 388 2HB ARG 50 HB1 ARG 50 236.593 -2.431 -7.488 389 1HG ARG 50 HG2 ARG 50 234.868 -1.150 -8.174 390 2HG ARG 50 HG1 ARG 50 235.701 0.363 -7.808 391 1HD ARG 50 HD2 ARG 50 237.125 0.010 -9.801 392 2HD ARG 50 HD1 ARG 50 236.187 -1.434 -10.181 393 HE ARG 50 HE ARG 50 235.439 1.279 -10.670 394 1HH1 ARG 50 HH11 ARG 50 234.188 -1.906 -9.985 395 2HH1 ARG 50 HH12 ARG 50 232.655 -1.600 -10.730 396 1HH2 ARG 50 HH21 ARG 50 233.423 1.683 -11.649 397 2HH2 ARG 50 HH22 ARG 50 232.220 0.436 -11.675 398 H ARG 51 HN ARG 51 235.513 -2.782 -5.432 399 HA ARG 51 HA ARG 51 233.137 -1.361 -5.006 400 1HB ARG 51 HB2 ARG 51 234.101 -4.078 -4.175 401 2HB ARG 51 HB1 ARG 51 232.548 -3.477 -3.610 402 1HG ARG 51 HG2 ARG 51 233.058 -3.282 -6.511 403 2HG ARG 51 HG1 ARG 51 232.845 -4.903 -5.847 404 1HD ARG 51 HD2 ARG 51 230.678 -4.454 -5.122 405 2HD ARG 51 HD1 ARG 51 230.922 -2.708 -5.174 406 HE ARG 51 HE ARG 51 230.069 -4.393 -7.322 407 1HH1 ARG 51 HH11 ARG 51 231.756 -1.437 -6.553 408 2HH1 ARG 51 HH12 ARG 51 231.423 -0.701 -8.085 409 1HH2 ARG 51 HH21 ARG 51 229.629 -3.428 -9.337 410 2HH2 ARG 51 HH22 ARG 51 230.216 -1.831 -9.665 411 H GLU 52 HN GLU 52 235.748 -2.197 -2.806 412 HA GLU 52 HA GLU 52 234.315 -1.201 -0.498 413 1HB GLU 52 HB2 GLU 52 237.159 -2.173 -0.830 414 2HB GLU 52 HB1 GLU 52 236.456 -1.671 0.702 415 1HG GLU 52 HG2 GLU 52 235.458 -3.941 -1.006 416 2HG GLU 52 HG1 GLU 52 236.471 -4.106 0.427 417 H LEU 53 HN LEU 53 236.372 0.025 -2.933 418 HA LEU 53 HA LEU 53 237.544 2.174 -1.508 419 1HB LEU 53 HB2 LEU 53 238.609 1.591 -3.510 420 2HB LEU 53 HB1 LEU 53 237.103 1.549 -4.410 421 HG LEU 53 HG LEU 53 236.958 3.997 -4.259 422 1HD1 LEU 53 HD11 LEU 53 238.667 3.717 -2.149 423 2HD1 LEU 53 HD12 LEU 53 238.278 5.236 -2.955 424 3HD1 LEU 53 HD13 LEU 53 239.727 4.341 -3.410 425 1HD2 LEU 53 HD21 LEU 53 239.257 2.612 -5.533 426 2HD2 LEU 53 HD22 LEU 53 239.232 4.375 -5.558 427 3HD2 LEU 53 HD23 LEU 53 237.900 3.463 -6.268 428 H GLN 54 HN GLN 54 234.701 1.886 -3.592 429 HA GLN 54 HA GLN 54 233.918 4.592 -3.490 430 1HB GLN 54 HB2 GLN 54 232.869 3.442 -5.184 431 2HB GLN 54 HB1 GLN 54 232.588 2.018 -4.196 432 1HG GLN 54 HG2 GLN 54 230.793 3.162 -3.024 433 2HG GLN 54 HG1 GLN 54 231.096 4.624 -3.960 434 1HE2 GLN 54 HE21 GLN 54 230.878 1.198 -4.848 435 2HE2 GLN 54 HE22 GLN 54 229.635 1.405 -6.031 436 H GLU 55 HN GLU 55 233.536 1.960 -1.281 437 HA GLU 55 HA GLU 55 231.415 3.187 0.230 438 1HB GLU 55 HB2 GLU 55 233.060 0.700 0.583 439 2HB GLU 55 HB1 GLU 55 231.953 1.254 1.831 440 1HG GLU 55 HG2 GLU 55 230.172 1.258 0.006 441 2HG GLU 55 HG1 GLU 55 231.323 0.319 -0.944 442 H GLU 56 HN GLU 56 234.878 3.281 0.325 443 HA GLU 56 HA GLU 56 234.994 3.960 3.108 444 1HB GLU 56 HB2 GLU 56 236.919 3.475 0.957 445 2HB GLU 56 HB1 GLU 56 237.431 4.693 2.120 446 1HG GLU 56 HG2 GLU 56 236.302 2.273 3.319 447 2HG GLU 56 HG1 GLU 56 237.786 2.014 2.404 448 H SER 57 HN SER 57 235.309 5.834 0.090 449 HA SER 57 HA SER 57 234.884 8.244 1.727 450 1HB SER 57 HB2 SER 57 236.960 7.811 -0.411 451 2HB SER 57 HB1 SER 57 236.426 9.427 0.055 452 HG SER 57 HG SER 57 237.028 8.844 2.232 453 H GLY 58 HN GLY 58 233.133 6.549 -0.060 454 1HA GLY 58 HA2 GLY 58 231.463 6.882 -1.595 455 2HA GLY 58 HA1 GLY 58 231.560 8.575 -1.137 456 H LEU 59 HN LEU 59 234.481 7.316 -2.361 457 HA LEU 59 HA LEU 59 233.992 8.677 -4.917 458 1HB LEU 59 HB2 LEU 59 236.544 8.095 -3.426 459 2HB LEU 59 HB1 LEU 59 236.497 8.737 -5.057 460 HG LEU 59 HG LEU 59 235.741 10.072 -2.485 461 1HD1 LEU 59 HD11 LEU 59 237.394 11.537 -3.005 462 2HD1 LEU 59 HD12 LEU 59 237.119 11.403 -4.743 463 3HD1 LEU 59 HD13 LEU 59 238.001 10.137 -3.890 464 1HD2 LEU 59 HD21 LEU 59 233.798 10.432 -3.862 465 2HD2 LEU 59 HD22 LEU 59 234.806 10.860 -5.244 466 3HD2 LEU 59 HD23 LEU 59 234.755 11.913 -3.831 467 H THR 60 HN THR 60 233.458 7.335 -6.446 468 HA THR 60 HA THR 60 234.487 4.607 -6.469 469 HB THR 60 HB THR 60 232.734 5.448 -8.674 470 HG1 THR 60 HG1 THR 60 231.293 6.400 -7.513 471 1HG2 THR 60 HG21 THR 60 233.238 3.116 -7.096 472 2HG2 THR 60 HG22 THR 60 232.350 3.270 -8.611 473 3HG2 THR 60 HG23 THR 60 231.517 3.496 -7.075 474 H VAL 61 HN VAL 61 235.758 3.772 -8.132 475 HA VAL 61 HA VAL 61 236.930 5.822 -9.891 476 HB VAL 61 HB VAL 61 238.950 4.479 -9.987 477 1HG1 VAL 61 HG11 VAL 61 237.897 5.185 -7.267 478 2HG1 VAL 61 HG12 VAL 61 239.015 6.088 -8.289 479 3HG1 VAL 61 HG13 VAL 61 239.543 4.598 -7.505 480 1HG2 VAL 61 HG21 VAL 61 238.786 2.621 -7.967 481 2HG2 VAL 61 HG22 VAL 61 238.707 2.274 -9.694 482 3HG2 VAL 61 HG23 VAL 61 237.220 2.472 -8.766 483 H ASP 62 HN ASP 62 237.112 5.488 -12.040 484 HA ASP 62 HA ASP 62 235.449 3.438 -13.192 485 1HB ASP 62 HB2 ASP 62 236.892 5.846 -14.189 486 2HB ASP 62 HB1 ASP 62 236.544 4.570 -15.352 487 H ALA 63 HN ALA 63 238.751 3.802 -12.377 488 HA ALA 63 HA ALA 63 239.463 1.194 -12.979 489 1HB ALA 63 HB1 ALA 63 240.027 3.139 -15.192 490 2HB ALA 63 HB2 ALA 63 239.305 1.532 -15.284 491 3HB ALA 63 HB3 ALA 63 241.028 1.707 -14.949 492 H LEU 64 HN LEU 64 240.565 1.345 -11.031 493 HA LEU 64 HA LEU 64 242.390 3.369 -10.314 494 1HB LEU 64 HB2 LEU 64 242.342 0.459 -9.492 495 2HB LEU 64 HB1 LEU 64 243.296 1.706 -8.715 496 HG LEU 64 HG LEU 64 240.630 2.627 -8.717 497 1HD1 LEU 64 HD11 LEU 64 239.517 0.822 -7.468 498 2HD1 LEU 64 HD12 LEU 64 240.885 -0.234 -7.816 499 3HD1 LEU 64 HD13 LEU 64 239.881 0.371 -9.134 500 1HD2 LEU 64 HD21 LEU 64 241.637 1.433 -6.240 501 2HD2 LEU 64 HD22 LEU 64 241.137 3.089 -6.584 502 3HD2 LEU 64 HD23 LEU 64 242.758 2.552 -7.019 503 H HIS 65 HN HIS 65 244.794 2.462 -9.760 504 HA HIS 65 HA HIS 65 245.871 1.183 -12.170 505 1HB HIS 65 HB2 HIS 65 246.058 3.725 -12.250 506 2HB HIS 65 HB1 HIS 65 247.194 3.584 -10.913 507 HD1 HIS 65 HD1 HIS 65 249.340 4.193 -12.047 508 HD2 HIS 65 HD2 HIS 65 247.211 1.292 -14.125 509 HE1 HIS 65 HE1 HIS 65 250.872 3.425 -13.888 510 HE2 HIS 65 HE2 HIS 65 249.592 1.612 -15.082 511 H LYS 66 HN LYS 66 246.524 -0.703 -11.248 512 HA LYS 66 HA LYS 66 247.570 -0.982 -8.648 513 1HB LYS 66 HB2 LYS 66 248.561 -3.151 -9.626 514 2HB LYS 66 HB1 LYS 66 246.813 -2.978 -9.619 515 1HG LYS 66 HG2 LYS 66 247.882 -1.924 -12.061 516 2HG LYS 66 HG1 LYS 66 248.481 -3.561 -11.795 517 1HD LYS 66 HD2 LYS 66 246.068 -4.202 -11.318 518 2HD LYS 66 HD1 LYS 66 245.628 -2.625 -11.975 519 1HE LYS 66 HE2 LYS 66 246.762 -3.200 -14.075 520 2HE LYS 66 HE1 LYS 66 247.166 -4.784 -13.415 521 1HZ LYS 66 HZ1 LYS 66 244.548 -4.789 -13.046 522 2HZ LYS 66 HZ2 LYS 66 245.269 -5.340 -14.473 523 3HZ LYS 66 HZ3 LYS 66 244.620 -3.780 -14.403 524 H VAL 67 HN VAL 67 249.580 -0.665 -7.816 525 HA VAL 67 HA VAL 67 251.752 -0.222 -9.766 526 HB VAL 67 HB VAL 67 252.622 1.620 -8.325 527 1HG1 VAL 67 HG11 VAL 67 251.461 2.109 -10.393 528 2HG1 VAL 67 HG12 VAL 67 251.034 3.306 -9.169 529 3HG1 VAL 67 HG13 VAL 67 249.903 2.014 -9.571 530 1HG2 VAL 67 HG21 VAL 67 251.652 1.443 -6.247 531 2HG2 VAL 67 HG22 VAL 67 250.058 1.070 -6.902 532 3HG2 VAL 67 HG23 VAL 67 250.676 2.720 -6.969 533 H GLY 68 HN GLY 68 251.058 -0.734 -6.296 534 1HA GLY 68 HA2 GLY 68 253.534 -2.343 -6.225 535 2HA GLY 68 HA1 GLY 68 253.154 -1.206 -4.945 536 H GLN 69 HN GLN 69 253.436 -4.273 -5.294 537 HA GLN 69 HA GLN 69 250.947 -4.990 -3.892 538 1HB GLN 69 HB2 GLN 69 252.682 -6.455 -5.813 539 2HB GLN 69 HB1 GLN 69 251.957 -7.393 -4.514 540 1HG GLN 69 HG2 GLN 69 249.752 -6.275 -5.253 541 2HG GLN 69 HG1 GLN 69 250.627 -5.910 -6.738 542 1HE2 GLN 69 HE21 GLN 69 251.405 -7.649 -8.010 543 2HE2 GLN 69 HE22 GLN 69 250.678 -9.214 -7.911 544 H ILE 70 HN ILE 70 251.225 -5.089 -1.757 545 HA ILE 70 HA ILE 70 253.870 -5.869 -0.728 546 HB ILE 70 HB ILE 70 251.662 -4.421 0.729 547 1HG1 ILE 70 HG12 ILE 70 254.258 -3.238 -0.235 548 2HG1 ILE 70 HG11 ILE 70 252.797 -3.203 -1.218 549 1HG2 ILE 70 HG21 ILE 70 254.332 -5.435 1.502 550 2HG2 ILE 70 HG22 ILE 70 252.856 -5.291 2.454 551 3HG2 ILE 70 HG23 ILE 70 253.846 -3.865 2.140 552 1HD1 ILE 70 HD11 ILE 70 253.580 -1.516 0.979 553 2HD1 ILE 70 HD12 ILE 70 251.997 -2.241 1.259 554 3HD1 ILE 70 HD13 ILE 70 252.291 -1.303 -0.204 555 H VAL 71 HN VAL 71 254.043 -7.330 0.975 556 HA VAL 71 HA VAL 71 251.684 -9.027 1.445 557 HB VAL 71 HB VAL 71 254.523 -10.028 1.245 558 1HG1 VAL 71 HG11 VAL 71 251.914 -11.526 1.188 559 2HG1 VAL 71 HG12 VAL 71 252.929 -11.339 2.617 560 3HG1 VAL 71 HG13 VAL 71 253.536 -12.214 1.211 561 1HG2 VAL 71 HG21 VAL 71 252.364 -10.302 -0.838 562 2HG2 VAL 71 HG22 VAL 71 254.042 -10.830 -0.953 563 3HG2 VAL 71 HG23 VAL 71 253.661 -9.109 -0.915 564 H PHE 72 HN PHE 72 251.522 -9.993 3.489 565 HA PHE 72 HA PHE 72 253.321 -8.891 5.543 566 1HB PHE 72 HB2 PHE 72 250.400 -8.789 5.300 567 2HB PHE 72 HB1 PHE 72 250.960 -9.342 6.874 568 HD1 PHE 72 HD1 PHE 72 252.531 -6.856 4.607 569 HD2 PHE 72 HD2 PHE 72 250.491 -7.557 8.276 570 HE1 PHE 72 HE1 PHE 72 252.943 -4.525 5.276 571 HE2 PHE 72 HE2 PHE 72 250.899 -5.225 8.951 572 HZ PHE 72 HZ PHE 72 252.127 -3.706 7.450 573 H GLU 73 HN GLU 73 254.367 -10.386 6.666 574 HA GLU 73 HA GLU 73 253.305 -13.127 6.706 575 1HB GLU 73 HB2 GLU 73 255.539 -12.949 5.763 576 2HB GLU 73 HB1 GLU 73 256.106 -12.090 7.187 577 1HG GLU 73 HG2 GLU 73 256.371 -13.971 8.376 578 2HG GLU 73 HG1 GLU 73 254.914 -14.716 7.721 579 H PHE 74 HN PHE 74 252.372 -13.799 8.526 580 HA PHE 74 HA PHE 74 252.721 -12.248 10.958 581 1HB PHE 74 HB2 PHE 74 250.550 -13.512 9.883 582 2HB PHE 74 HB1 PHE 74 251.071 -14.685 11.085 583 HD1 PHE 74 HD1 PHE 74 249.839 -11.269 10.555 584 HD2 PHE 74 HD2 PHE 74 250.866 -14.239 13.424 585 HE1 PHE 74 HE1 PHE 74 248.728 -9.952 12.311 586 HE2 PHE 74 HE2 PHE 74 249.755 -12.929 15.185 587 HZ PHE 74 HZ PHE 74 248.684 -10.781 14.629 588 H VAL 75 HN VAL 75 253.745 -12.833 12.728 589 HA VAL 75 HA VAL 75 255.557 -15.063 12.553 590 HB VAL 75 HB VAL 75 255.416 -13.698 15.138 591 1HG1 VAL 75 HG11 VAL 75 257.890 -13.296 14.269 592 2HG1 VAL 75 HG12 VAL 75 257.427 -14.585 13.157 593 3HG1 VAL 75 HG13 VAL 75 257.356 -14.855 14.898 594 1HG2 VAL 75 HG21 VAL 75 256.627 -11.664 14.038 595 2HG2 VAL 75 HG22 VAL 75 254.866 -11.700 14.134 596 3HG2 VAL 75 HG23 VAL 75 255.676 -12.114 12.623 597 H GLY 76 HN GLY 76 254.801 -17.035 12.961 598 1HA GLY 76 HA2 GLY 76 254.236 -18.664 14.621 599 2HA GLY 76 HA1 GLY 76 253.298 -17.435 15.457 600 H GLU 77 HN GLU 77 252.252 -16.648 12.662 601 HA GLU 77 HA GLU 77 250.151 -18.707 12.603 602 1HB GLU 77 HB2 GLU 77 250.128 -15.797 12.430 603 2HB GLU 77 HB1 GLU 77 249.224 -16.551 11.124 604 1HG GLU 77 HG2 GLU 77 248.806 -17.252 14.013 605 2HG GLU 77 HG1 GLU 77 247.922 -15.963 13.197 606 HA PRO 78 HA PRO 78 252.117 -20.103 8.790 607 1HB PRO 78 HB2 PRO 78 249.384 -21.282 8.526 608 2HB PRO 78 HB1 PRO 78 250.963 -22.036 8.275 609 1HG PRO 78 HG2 PRO 78 249.574 -22.512 10.493 610 2HG PRO 78 HG1 PRO 78 251.336 -22.321 10.547 611 1HD PRO 78 HD2 PRO 78 249.196 -20.435 11.402 612 2HD PRO 78 HD1 PRO 78 250.822 -20.680 12.070 613 H GLU 79 HN GLU 79 248.848 -18.753 8.991 614 HA GLU 79 HA GLU 79 248.542 -18.189 6.248 615 1HB GLU 79 HB2 GLU 79 247.012 -17.888 8.587 616 2HB GLU 79 HB1 GLU 79 247.157 -16.273 7.905 617 1HG GLU 79 HG2 GLU 79 246.205 -16.979 5.841 618 2HG GLU 79 HG1 GLU 79 246.263 -18.671 6.330 619 H LEU 80 HN LEU 80 248.165 -15.810 5.537 620 HA LEU 80 HA LEU 80 250.125 -13.958 6.635 621 1HB LEU 80 HB2 LEU 80 250.245 -14.296 3.688 622 2HB LEU 80 HB1 LEU 80 251.497 -13.801 4.810 623 HG LEU 80 HG LEU 80 250.548 -16.639 4.788 624 1HD1 LEU 80 HD11 LEU 80 252.661 -16.901 3.246 625 2HD1 LEU 80 HD12 LEU 80 252.219 -15.267 2.749 626 3HD1 LEU 80 HD13 LEU 80 251.066 -16.589 2.565 627 1HD2 LEU 80 HD21 LEU 80 253.366 -15.812 5.175 628 2HD2 LEU 80 HD22 LEU 80 252.433 -17.077 5.977 629 3HD2 LEU 80 HD23 LEU 80 252.217 -15.390 6.446 630 H MET 81 HN MET 81 250.117 -12.037 4.717 631 HA MET 81 HA MET 81 247.303 -11.493 4.119 632 1HB MET 81 HB2 MET 81 248.859 -10.168 6.131 633 2HB MET 81 HB1 MET 81 248.482 -9.023 4.854 634 1HG MET 81 HG2 MET 81 246.427 -8.788 5.619 635 2HG MET 81 HG1 MET 81 246.136 -10.518 5.450 636 1HE MET 81 HE1 MET 81 247.441 -12.144 7.144 637 2HE MET 81 HE2 MET 81 247.497 -11.845 8.880 638 3HE MET 81 HE3 MET 81 248.752 -11.184 7.831 639 H ASP 82 HN ASP 82 247.255 -11.286 1.974 640 HA ASP 82 HA ASP 82 249.517 -9.953 0.641 641 1HB ASP 82 HB2 ASP 82 247.933 -12.257 -0.012 642 2HB ASP 82 HB1 ASP 82 247.714 -11.043 -1.270 643 H VAL 83 HN VAL 83 249.082 -7.798 0.654 644 HA VAL 83 HA VAL 83 246.399 -6.964 -0.228 645 HB VAL 83 HB VAL 83 246.964 -6.263 2.063 646 1HG1 VAL 83 HG11 VAL 83 249.485 -5.891 1.166 647 2HG1 VAL 83 HG12 VAL 83 248.850 -5.183 2.651 648 3HG1 VAL 83 HG13 VAL 83 248.892 -4.230 1.168 649 1HG2 VAL 83 HG21 VAL 83 246.677 -4.102 -0.013 650 2HG2 VAL 83 HG22 VAL 83 246.518 -3.812 1.719 651 3HG2 VAL 83 HG23 VAL 83 245.400 -4.904 0.902 652 H HIS 84 HN HIS 84 246.272 -6.160 -2.181 653 HA HIS 84 HA HIS 84 248.627 -5.288 -3.611 654 1HB HIS 84 HB2 HIS 84 246.409 -6.519 -4.469 655 2HB HIS 84 HB1 HIS 84 245.888 -4.854 -4.709 656 HD1 HIS 84 HD1 HIS 84 247.253 -7.451 -6.582 657 HD2 HIS 84 HD2 HIS 84 248.237 -3.435 -6.179 658 HE1 HIS 84 HE1 HIS 84 248.571 -6.873 -8.642 659 HE2 HIS 84 HE2 HIS 84 249.257 -4.470 -8.318 660 H VAL 85 HN VAL 85 248.983 -3.142 -4.368 661 HA VAL 85 HA VAL 85 247.424 -1.130 -2.877 662 HB VAL 85 HB VAL 85 250.226 -0.683 -3.898 663 1HG1 VAL 85 HG11 VAL 85 248.334 0.714 -2.065 664 2HG1 VAL 85 HG12 VAL 85 249.331 1.367 -3.365 665 3HG1 VAL 85 HG13 VAL 85 250.071 0.906 -1.832 666 1HG2 VAL 85 HG21 VAL 85 250.253 -1.070 -1.090 667 2HG2 VAL 85 HG22 VAL 85 251.078 -2.012 -2.330 668 3HG2 VAL 85 HG23 VAL 85 249.456 -2.468 -1.810 669 H PHE 86 HN PHE 86 245.971 -0.428 -4.276 670 HA PHE 86 HA PHE 86 246.715 0.138 -7.046 671 1HB PHE 86 HB2 PHE 86 244.274 -0.628 -5.618 672 2HB PHE 86 HB1 PHE 86 244.007 0.709 -6.728 673 HD1 PHE 86 HD1 PHE 86 244.742 0.398 -9.151 674 HD2 PHE 86 HD2 PHE 86 244.365 -2.817 -6.390 675 HE1 PHE 86 HE1 PHE 86 244.579 -1.186 -11.026 676 HE2 PHE 86 HE2 PHE 86 244.205 -4.409 -8.259 677 HZ PHE 86 HZ PHE 86 244.311 -3.594 -10.581 678 H CYS 87 HN CYS 87 246.626 2.168 -7.921 679 HA CYS 87 HA CYS 87 245.857 4.379 -6.126 680 1HB CYS 87 HB2 CYS 87 247.617 5.759 -7.156 681 2HB CYS 87 HB1 CYS 87 248.308 4.339 -6.378 682 HG CYS 87 HG CYS 87 248.707 5.074 -9.221 683 H THR 88 HN THR 88 244.094 5.341 -6.948 684 HA THR 88 HA THR 88 243.557 5.036 -9.806 685 HB THR 88 HB THR 88 241.907 4.399 -7.945 686 HG1 THR 88 HG1 THR 88 240.482 6.008 -9.629 687 1HG2 THR 88 HG21 THR 88 240.785 5.913 -6.761 688 2HG2 THR 88 HG22 THR 88 240.752 7.079 -8.084 689 3HG2 THR 88 HG23 THR 88 242.191 6.931 -7.075 690 H ASP 89 HN ASP 89 241.923 7.030 -10.410 691 HA ASP 89 HA ASP 89 242.901 9.607 -9.620 692 1HB ASP 89 HB2 ASP 89 244.476 8.465 -11.482 693 2HB ASP 89 HB1 ASP 89 243.253 9.165 -12.537 694 H SER 90 HN SER 90 241.161 7.708 -12.033 695 HA SER 90 HA SER 90 239.282 9.849 -12.548 696 1HB SER 90 HB2 SER 90 240.188 7.701 -14.039 697 2HB SER 90 HB1 SER 90 238.572 7.188 -13.557 698 HG SER 90 HG SER 90 237.778 8.570 -14.915 699 H ILE 91 HN ILE 91 238.051 10.223 -10.749 700 HA ILE 91 HA ILE 91 236.727 7.920 -9.506 701 HB ILE 91 HB ILE 91 236.166 9.396 -7.635 702 1HG1 ILE 91 HG12 ILE 91 237.816 11.521 -9.019 703 2HG1 ILE 91 HG11 ILE 91 236.056 11.488 -9.057 704 1HG2 ILE 91 HG21 ILE 91 238.557 8.283 -8.143 705 2HG2 ILE 91 HG22 ILE 91 238.183 9.148 -6.653 706 3HG2 ILE 91 HG23 ILE 91 239.044 9.968 -7.956 707 1HD1 ILE 91 HD11 ILE 91 237.776 11.735 -6.601 708 2HD1 ILE 91 HD12 ILE 91 236.014 11.663 -6.615 709 3HD1 ILE 91 HD13 ILE 91 236.848 13.023 -7.367 710 H GLN 92 HN GLN 92 234.466 8.698 -8.525 711 HA GLN 92 HA GLN 92 232.968 10.119 -10.609 712 1HB GLN 92 HB2 GLN 92 232.429 7.365 -9.534 713 2HB GLN 92 HB1 GLN 92 231.145 8.341 -10.233 714 1HG GLN 92 HG2 GLN 92 233.564 8.132 -11.876 715 2HG GLN 92 HG1 GLN 92 232.706 6.614 -11.615 716 1HE2 GLN 92 HE21 GLN 92 231.382 9.873 -11.852 717 2HE2 GLN 92 HE22 GLN 92 230.430 9.580 -13.263 718 H GLY 93 HN GLY 93 232.256 8.373 -7.588 719 1HA GLY 93 HA2 GLY 93 230.212 10.058 -6.729 720 2HA GLY 93 HA1 GLY 93 231.172 9.029 -5.679 721 H THR 94 HN THR 94 230.728 10.883 -4.194 722 HA THR 94 HA THR 94 232.755 12.977 -4.539 723 HB THR 94 HB THR 94 230.503 13.565 -2.755 724 HG1 THR 94 HG1 THR 94 229.362 12.523 -4.384 725 1HG2 THR 94 HG21 THR 94 232.312 15.017 -4.472 726 2HG2 THR 94 HG22 THR 94 231.350 15.582 -3.105 727 3HG2 THR 94 HG23 THR 94 230.636 15.510 -4.716 728 HA PRO 95 HA PRO 95 234.536 11.889 -0.690 729 1HB PRO 95 HB2 PRO 95 234.568 14.699 0.190 730 2HB PRO 95 HB1 PRO 95 235.924 13.624 -0.166 731 1HG PRO 95 HG2 PRO 95 235.292 15.667 -1.775 732 2HG PRO 95 HG1 PRO 95 235.907 14.129 -2.412 733 1HD PRO 95 HD2 PRO 95 233.086 15.136 -2.291 734 2HD PRO 95 HD1 PRO 95 233.931 14.318 -3.624 735 H VAL 96 HN VAL 96 232.115 11.254 -0.512 736 HA VAL 96 HA VAL 96 230.522 12.764 1.332 737 HB VAL 96 HB VAL 96 230.109 9.852 0.695 738 1HG1 VAL 96 HG11 VAL 96 228.473 10.336 2.177 739 2HG1 VAL 96 HG12 VAL 96 227.669 10.946 0.731 740 3HG1 VAL 96 HG13 VAL 96 228.501 12.061 1.815 741 1HG2 VAL 96 HG21 VAL 96 229.894 12.180 -1.104 742 2HG2 VAL 96 HG22 VAL 96 228.531 11.059 -1.117 743 3HG2 VAL 96 HG23 VAL 96 230.157 10.476 -1.475 744 H GLU 97 HN GLU 97 232.659 12.712 2.716 745 HA GLU 97 HA GLU 97 233.479 10.598 4.250 746 1HB GLU 97 HB2 GLU 97 234.168 12.197 5.930 747 2HB GLU 97 HB1 GLU 97 234.436 12.888 4.336 748 1HG GLU 97 HG2 GLU 97 231.939 13.790 4.885 749 2HG GLU 97 HG1 GLU 97 232.657 13.752 6.494 750 H SER 98 HN SER 98 232.403 9.191 5.454 751 HA SER 98 HA SER 98 229.762 9.839 6.464 752 1HB SER 98 HB2 SER 98 231.280 7.390 5.895 753 2HB SER 98 HB1 SER 98 230.303 7.297 7.360 754 HG SER 98 HG SER 98 228.575 7.230 6.173 755 H ASP 99 HN ASP 99 229.483 8.461 8.743 756 HA ASP 99 HA ASP 99 230.725 10.162 10.659 757 1HB ASP 99 HB2 ASP 99 229.205 7.627 11.258 758 2HB ASP 99 HB1 ASP 99 229.409 9.035 12.295 759 H GLU 100 HN GLU 100 231.909 7.462 9.099 760 HA GLU 100 HA GLU 100 233.740 6.907 11.336 761 1HB GLU 100 HB2 GLU 100 231.998 5.105 10.065 762 2HB GLU 100 HB1 GLU 100 233.603 4.713 9.464 763 1HG GLU 100 HG2 GLU 100 234.298 4.771 11.946 764 2HG GLU 100 HG1 GLU 100 232.570 4.637 12.267 765 H MET 101 HN MET 101 233.383 7.587 7.946 766 HA MET 101 HA MET 101 236.304 7.393 7.623 767 1HB MET 101 HB2 MET 101 234.111 6.548 5.939 768 2HB MET 101 HB1 MET 101 235.151 7.676 5.080 769 1HG MET 101 HG2 MET 101 236.333 5.376 6.572 770 2HG MET 101 HG1 MET 101 235.638 5.141 4.970 771 1HE MET 101 HE1 MET 101 239.778 6.444 5.900 772 2HE MET 101 HE2 MET 101 238.764 5.137 6.512 773 3HE MET 101 HE3 MET 101 238.507 6.789 7.072 774 H ARG 102 HN ARG 102 237.319 9.030 6.251 775 HA ARG 102 HA ARG 102 235.968 11.428 5.558 776 1HB ARG 102 HB2 ARG 102 235.949 11.748 7.984 777 2HB ARG 102 HB1 ARG 102 237.690 11.501 8.046 778 1HG ARG 102 HG2 ARG 102 237.500 13.529 6.246 779 2HG ARG 102 HG1 ARG 102 236.146 13.880 7.321 780 1HD ARG 102 HD2 ARG 102 237.540 14.057 9.200 781 2HD ARG 102 HD1 ARG 102 238.883 13.257 8.383 782 HE ARG 102 HE ARG 102 239.486 15.269 7.467 783 1HH1 ARG 102 HH11 ARG 102 236.263 15.537 8.781 784 2HH1 ARG 102 HH12 ARG 102 236.184 17.254 8.567 785 1HH2 ARG 102 HH21 ARG 102 239.382 17.527 7.185 786 2HH2 ARG 102 HH22 ARG 102 237.954 18.383 7.660 787 HA PRO 103 HA PRO 103 239.954 10.950 3.395 788 1HB PRO 103 HB2 PRO 103 239.151 11.811 0.998 789 2HB PRO 103 HB1 PRO 103 238.705 10.204 1.585 790 1HG PRO 103 HG2 PRO 103 237.093 12.731 1.582 791 2HG PRO 103 HG1 PRO 103 236.598 11.094 1.112 792 1HD PRO 103 HD2 PRO 103 236.056 12.184 3.560 793 2HD PRO 103 HD1 PRO 103 236.247 10.441 3.289 794 H CYS 104 HN CYS 104 241.444 12.467 2.491 795 HA CYS 104 HA CYS 104 240.707 15.283 2.583 796 1HB CYS 104 HB2 CYS 104 242.013 14.081 4.747 797 2HB CYS 104 HB1 CYS 104 243.280 14.930 3.867 798 HG CYS 104 HG CYS 104 240.970 16.785 4.298 799 H TRP 105 HN TRP 105 241.569 16.352 0.941 800 HA TRP 105 HA TRP 105 243.547 14.998 -0.715 801 1HB TRP 105 HB2 TRP 105 241.984 17.531 -1.260 802 2HB TRP 105 HB1 TRP 105 242.956 16.637 -2.423 803 HD1 TRP 105 HD1 TRP 105 240.147 15.428 -0.003 804 HE1 TRP 105 HE1 TRP 105 238.435 14.094 -1.389 805 HE3 TRP 105 HE3 TRP 105 242.250 15.977 -4.632 806 HZ2 TRP 105 HZ2 TRP 105 238.031 13.377 -4.088 807 HZ3 TRP 105 HZ3 TRP 105 241.137 14.935 -6.563 808 HH2 TRP 105 HH2 TRP 105 239.072 13.663 -6.296 809 H PHE 106 HN PHE 106 245.624 15.392 -0.354 810 HA PHE 106 HA PHE 106 246.425 18.120 0.427 811 1HB PHE 106 HB2 PHE 106 247.695 15.514 1.302 812 2HB PHE 106 HB1 PHE 106 248.264 17.123 1.728 813 HD1 PHE 106 HD1 PHE 106 245.801 18.519 2.409 814 HD2 PHE 106 HD2 PHE 106 247.007 14.528 3.264 815 HE1 PHE 106 HE1 PHE 106 244.352 18.512 4.397 816 HE2 PHE 106 HE2 PHE 106 245.559 14.513 5.253 817 HZ PHE 106 HZ PHE 106 244.229 16.506 5.822 818 H GLN 107 HN GLN 107 249.140 17.870 0.242 819 HA GLN 107 HA GLN 107 249.499 17.627 -2.641 820 1HB GLN 107 HB2 GLN 107 251.144 18.890 -0.455 821 2HB GLN 107 HB1 GLN 107 251.753 18.695 -2.093 822 1HG GLN 107 HG2 GLN 107 249.328 19.877 -2.518 823 2HG GLN 107 HG1 GLN 107 249.850 20.622 -1.008 824 1HE2 GLN 107 HE21 GLN 107 251.604 19.546 -3.896 825 2HE2 GLN 107 HE22 GLN 107 252.355 21.068 -4.220 826 H LEU 108 HN LEU 108 251.538 16.666 -3.451 827 HA LEU 108 HA LEU 108 251.830 14.007 -2.564 828 1HB LEU 108 HB2 LEU 108 253.481 15.709 -4.416 829 2HB LEU 108 HB1 LEU 108 253.810 14.009 -4.133 830 HG LEU 108 HG LEU 108 251.369 15.214 -5.414 831 1HD1 LEU 108 HD11 LEU 108 253.714 14.607 -6.543 832 2HD1 LEU 108 HD12 LEU 108 252.168 14.436 -7.372 833 3HD1 LEU 108 HD13 LEU 108 252.931 13.030 -6.630 834 1HD2 LEU 108 HD21 LEU 108 251.041 12.531 -5.640 835 2HD2 LEU 108 HD22 LEU 108 250.255 13.535 -4.419 836 3HD2 LEU 108 HD23 LEU 108 251.731 12.654 -4.021 837 H ASP 109 HN ASP 109 253.257 16.889 -1.512 838 HA ASP 109 HA ASP 109 255.404 15.434 -0.140 839 1HB ASP 109 HB2 ASP 109 255.668 17.662 -1.648 840 2HB ASP 109 HB1 ASP 109 255.357 18.401 -0.080 841 H GLN 110 HN GLN 110 252.433 15.772 0.482 842 HA GLN 110 HA GLN 110 252.848 16.649 3.249 843 1HB GLN 110 HB2 GLN 110 250.440 17.287 1.548 844 2HB GLN 110 HB1 GLN 110 250.588 17.644 3.262 845 1HG GLN 110 HG2 GLN 110 252.416 19.163 2.824 846 2HG GLN 110 HG1 GLN 110 252.375 18.754 1.109 847 1HE2 GLN 110 HE21 GLN 110 251.917 21.279 2.711 848 2HE2 GLN 110 HE22 GLN 110 250.423 21.897 2.104 849 H ILE 111 HN ILE 111 252.456 14.033 1.605 850 HA ILE 111 HA ILE 111 250.120 12.934 2.946 851 HB ILE 111 HB ILE 111 251.825 10.866 1.889 852 1HG1 ILE 111 HG12 ILE 111 250.956 11.847 -0.552 853 2HG1 ILE 111 HG11 ILE 111 251.647 13.258 0.238 854 1HG2 ILE 111 HG21 ILE 111 249.619 10.345 2.272 855 2HG2 ILE 111 HG22 ILE 111 249.721 10.469 0.518 856 3HG2 ILE 111 HG23 ILE 111 249.027 11.792 1.457 857 1HD1 ILE 111 HD11 ILE 111 253.281 12.041 -1.118 858 2HD1 ILE 111 HD12 ILE 111 253.029 10.614 -0.121 859 3HD1 ILE 111 HD13 ILE 111 253.728 12.070 0.587 860 HA PRO 112 HA PRO 112 252.685 11.709 6.358 861 1HB PRO 112 HB2 PRO 112 250.759 11.223 8.122 862 2HB PRO 112 HB1 PRO 112 251.038 12.867 7.530 863 1HG PRO 112 HG2 PRO 112 248.917 10.908 6.757 864 2HG PRO 112 HG1 PRO 112 248.802 12.665 6.954 865 1HD PRO 112 HD2 PRO 112 249.131 11.287 4.534 866 2HD PRO 112 HD1 PRO 112 249.369 13.025 4.787 867 H PHE 113 HN PHE 113 253.638 9.846 5.614 868 HA PHE 113 HA PHE 113 252.277 7.355 5.408 869 1HB PHE 113 HB2 PHE 113 255.237 7.697 5.847 870 2HB PHE 113 HB1 PHE 113 254.413 6.394 5.012 871 HD1 PHE 113 HD1 PHE 113 252.680 9.057 3.772 872 HD2 PHE 113 HD2 PHE 113 256.628 7.425 3.709 873 HE1 PHE 113 HE1 PHE 113 253.136 10.173 1.643 874 HE2 PHE 113 HE2 PHE 113 257.065 8.552 1.573 875 HZ PHE 113 HZ PHE 113 255.314 9.936 0.536 876 H LYS 114 HN LYS 114 253.871 9.062 7.996 877 HA LYS 114 HA LYS 114 254.168 6.797 9.720 878 1HB LYS 114 HB2 LYS 114 254.789 8.434 11.424 879 2HB LYS 114 HB1 LYS 114 255.639 8.750 9.918 880 1HG LYS 114 HG2 LYS 114 253.971 10.507 9.399 881 2HG LYS 114 HG1 LYS 114 253.249 10.235 10.986 882 1HD LYS 114 HD2 LYS 114 254.655 11.871 11.634 883 2HD LYS 114 HD1 LYS 114 255.849 10.571 11.663 884 1HE LYS 114 HE2 LYS 114 256.712 12.500 10.461 885 2HE LYS 114 HE1 LYS 114 256.504 11.131 9.370 886 1HZ LYS 114 HZ1 LYS 114 255.696 13.442 8.635 887 2HZ LYS 114 HZ2 LYS 114 254.374 13.149 9.648 888 3HZ LYS 114 HZ3 LYS 114 254.693 12.110 8.353 889 H ASP 115 HN ASP 115 251.715 9.167 9.076 890 HA ASP 115 HA ASP 115 250.169 8.310 11.391 891 1HB ASP 115 HB2 ASP 115 249.413 10.413 9.359 892 2HB ASP 115 HB1 ASP 115 248.721 10.174 10.961 893 H MET 116 HN MET 116 250.698 6.547 9.131 894 HA MET 116 HA MET 116 247.927 5.899 8.467 895 1HB MET 116 HB2 MET 116 248.615 7.056 6.509 896 2HB MET 116 HB1 MET 116 250.191 6.282 6.516 897 1HG MET 116 HG2 MET 116 249.290 4.228 5.778 898 2HG MET 116 HG1 MET 116 247.641 4.762 6.085 899 1HE MET 116 HE1 MET 116 250.692 5.637 3.139 900 2HE MET 116 HE2 MET 116 250.645 6.454 4.699 901 3HE MET 116 HE3 MET 116 250.056 7.276 3.256 902 H TRP 117 HN TRP 117 250.942 4.521 7.234 903 HA TRP 117 HA TRP 117 250.626 2.181 8.958 904 1HB TRP 117 HB2 TRP 117 249.951 2.256 6.147 905 2HB TRP 117 HB1 TRP 117 251.273 1.129 6.426 906 HD1 TRP 117 HD1 TRP 117 250.651 -1.195 7.374 907 HE1 TRP 117 HE1 TRP 117 248.476 -2.296 8.198 908 HE3 TRP 117 HE3 TRP 117 247.621 2.924 7.428 909 HZ2 TRP 117 HZ2 TRP 117 245.829 -1.524 8.790 910 HZ3 TRP 117 HZ3 TRP 117 245.280 2.655 8.134 911 HH2 TRP 117 HH2 TRP 117 244.403 0.476 8.799 912 HA PRO 118 HA PRO 118 255.049 2.330 8.856 913 1HB PRO 118 HB2 PRO 118 255.700 -0.120 9.693 914 2HB PRO 118 HB1 PRO 118 254.846 1.014 10.742 915 1HG PRO 118 HG2 PRO 118 253.783 -1.318 9.210 916 2HG PRO 118 HG1 PRO 118 253.349 -0.748 10.829 917 1HD PRO 118 HD2 PRO 118 251.915 -0.230 8.506 918 2HD PRO 118 HD1 PRO 118 251.790 0.695 10.014 919 H ASP 119 HN ASP 119 253.465 1.024 6.386 920 HA ASP 119 HA ASP 119 255.911 -0.039 5.139 921 1HB ASP 119 HB2 ASP 119 253.076 -0.865 4.486 922 2HB ASP 119 HB1 ASP 119 254.555 -1.546 3.813 923 H ASP 120 HN ASP 120 253.548 2.365 5.080 924 HA ASP 120 HA ASP 120 253.049 2.920 2.435 925 1HB ASP 120 HB2 ASP 120 253.624 4.989 4.542 926 2HB ASP 120 HB1 ASP 120 252.612 5.179 3.116 927 H SER 121 HN SER 121 255.627 4.465 4.344 928 HA SER 121 HA SER 121 256.887 5.847 2.340 929 1HB SER 121 HB2 SER 121 258.627 4.539 4.375 930 2HB SER 121 HB1 SER 121 258.586 6.218 3.837 931 HG SER 121 HG SER 121 257.193 4.979 5.858 932 H TYR 122 HN TYR 122 256.802 2.427 2.665 933 HA TYR 122 HA TYR 122 259.253 1.983 1.220 934 1HB TYR 122 HB2 TYR 122 257.158 0.233 2.434 935 2HB TYR 122 HB1 TYR 122 258.252 -0.444 1.233 936 HD1 TYR 122 HD1 TYR 122 257.807 0.312 4.666 937 HD2 TYR 122 HD2 TYR 122 260.791 -0.082 1.660 938 HE1 TYR 122 HE1 TYR 122 259.511 -0.005 6.409 939 HE2 TYR 122 HE2 TYR 122 262.504 -0.403 3.395 940 HH TYR 122 HH TYR 122 261.754 -1.042 6.624 941 H TRP 123 HN TRP 123 255.827 2.181 0.455 942 HA TRP 123 HA TRP 123 256.527 1.432 -2.296 943 1HB TRP 123 HB2 TRP 123 254.211 0.770 -2.658 944 2HB TRP 123 HB1 TRP 123 254.919 -0.113 -1.314 945 HD1 TRP 123 HD1 TRP 123 253.981 0.436 1.142 946 HE1 TRP 123 HE1 TRP 123 251.746 1.455 1.918 947 HE3 TRP 123 HE3 TRP 123 252.449 2.500 -3.277 948 HZ2 TRP 123 HZ2 TRP 123 249.613 2.945 0.798 949 HZ3 TRP 123 HZ3 TRP 123 250.299 3.695 -3.334 950 HH2 TRP 123 HH2 TRP 123 248.917 3.906 -1.345 951 H PHE 124 HN PHE 124 255.855 4.105 -0.470 952 HA PHE 124 HA PHE 124 254.191 5.528 -2.320 953 1HB PHE 124 HB2 PHE 124 255.606 6.159 0.211 954 2HB PHE 124 HB1 PHE 124 255.298 7.511 -0.871 955 HD1 PHE 124 HD1 PHE 124 253.416 4.524 0.346 956 HD2 PHE 124 HD2 PHE 124 253.420 8.720 -0.361 957 HE1 PHE 124 HE1 PHE 124 251.130 4.677 1.236 958 HE2 PHE 124 HE2 PHE 124 251.136 8.877 0.525 959 HZ PHE 124 HZ PHE 124 249.988 6.853 1.326 960 HA PRO 125 HA PRO 125 258.523 7.639 -3.340 961 1HB PRO 125 HB2 PRO 125 260.288 5.323 -2.788 962 2HB PRO 125 HB1 PRO 125 260.551 7.040 -2.466 963 1HG PRO 125 HG2 PRO 125 260.007 5.339 -0.483 964 2HG PRO 125 HG1 PRO 125 259.352 6.989 -0.485 965 1HD PRO 125 HD2 PRO 125 257.998 4.409 -1.164 966 2HD PRO 125 HD1 PRO 125 257.372 5.814 -0.278 967 H LEU 126 HN LEU 126 257.761 4.259 -3.830 968 HA LEU 126 HA LEU 126 259.042 4.101 -6.406 969 1HB LEU 126 HB2 LEU 126 257.071 2.247 -5.061 970 2HB LEU 126 HB1 LEU 126 257.922 1.898 -6.554 971 HG LEU 126 HG LEU 126 259.440 2.498 -4.036 972 1HD1 LEU 126 HD11 LEU 126 257.636 0.401 -4.224 973 2HD1 LEU 126 HD12 LEU 126 258.984 0.537 -3.095 974 3HD1 LEU 126 HD13 LEU 126 259.194 -0.326 -4.618 975 1HD2 LEU 126 HD21 LEU 126 260.979 2.437 -5.708 976 2HD2 LEU 126 HD22 LEU 126 260.003 1.374 -6.721 977 3HD2 LEU 126 HD23 LEU 126 260.899 0.711 -5.354 978 H LEU 127 HN LEU 127 255.853 4.679 -5.117 979 HA LEU 127 HA LEU 127 254.333 4.477 -7.469 980 1HB LEU 127 HB2 LEU 127 254.007 6.146 -4.980 981 2HB LEU 127 HB1 LEU 127 252.811 6.110 -6.257 982 HG LEU 127 HG LEU 127 253.116 4.364 -4.044 983 1HD1 LEU 127 HD11 LEU 127 250.979 5.066 -4.598 984 2HD1 LEU 127 HD12 LEU 127 250.997 3.388 -5.139 985 3HD1 LEU 127 HD13 LEU 127 251.193 4.693 -6.308 986 1HD2 LEU 127 HD21 LEU 127 253.030 2.185 -5.119 987 2HD2 LEU 127 HD22 LEU 127 254.551 2.990 -5.489 988 3HD2 LEU 127 HD23 LEU 127 253.268 2.934 -6.697 989 H LEU 128 HN LEU 128 255.627 7.335 -5.831 990 HA LEU 128 HA LEU 128 255.015 9.201 -7.827 991 1HB LEU 128 HB2 LEU 128 256.902 9.114 -5.528 992 2HB LEU 128 HB1 LEU 128 257.135 10.375 -6.724 993 HG LEU 128 HG LEU 128 254.395 10.025 -5.625 994 1HD1 LEU 128 HD11 LEU 128 256.232 11.740 -4.061 995 2HD1 LEU 128 HD12 LEU 128 256.318 10.001 -3.785 996 3HD1 LEU 128 HD13 LEU 128 254.793 10.856 -3.554 997 1HD2 LEU 128 HD21 LEU 128 256.115 12.265 -6.626 998 2HD2 LEU 128 HD22 LEU 128 254.652 12.583 -5.693 999 3HD2 LEU 128 HD23 LEU 128 254.550 11.711 -7.222 1000 H GLN 129 HN GLN 129 257.659 6.957 -7.513 1001 HA GLN 129 HA GLN 129 259.345 8.174 -9.470 1002 1HB GLN 129 HB2 GLN 129 260.215 6.682 -7.712 1003 2HB GLN 129 HB1 GLN 129 259.334 5.338 -8.424 1004 1HG GLN 129 HG2 GLN 129 260.996 4.926 -9.819 1005 2HG GLN 129 HG1 GLN 129 260.949 6.579 -10.427 1006 1HE2 GLN 129 HE21 GLN 129 261.951 8.196 -8.827 1007 2HE2 GLN 129 HE22 GLN 129 263.475 7.733 -8.157 1008 H LYS 130 HN LYS 130 256.452 6.496 -9.731 1009 HA LYS 130 HA LYS 130 255.266 5.739 -11.515 1010 1HB LYS 130 HB2 LYS 130 257.572 6.618 -13.254 1011 2HB LYS 130 HB1 LYS 130 255.900 6.371 -13.739 1012 1HG LYS 130 HG2 LYS 130 255.223 8.375 -12.934 1013 2HG LYS 130 HG1 LYS 130 256.390 8.362 -11.610 1014 1HD LYS 130 HD2 LYS 130 257.498 8.554 -14.344 1015 2HD LYS 130 HD1 LYS 130 256.611 9.961 -13.755 1016 1HE LYS 130 HE2 LYS 130 258.537 8.780 -11.864 1017 2HE LYS 130 HE1 LYS 130 259.239 9.526 -13.301 1018 1HZ LYS 130 HZ1 LYS 130 257.181 11.059 -11.932 1019 2HZ LYS 130 HZ2 LYS 130 258.626 11.577 -12.645 1020 3HZ LYS 130 HZ3 LYS 130 258.645 10.880 -11.103 1021 H LYS 131 HN LYS 131 256.697 3.897 -10.086 1022 HA LYS 131 HA LYS 131 257.326 1.928 -12.166 1023 1HB LYS 131 HB2 LYS 131 259.001 2.435 -9.701 1024 2HB LYS 131 HB1 LYS 131 259.210 1.074 -10.793 1025 1HG LYS 131 HG2 LYS 131 259.255 3.752 -12.027 1026 2HG LYS 131 HG1 LYS 131 260.611 3.345 -10.975 1027 1HD LYS 131 HD2 LYS 131 261.414 2.513 -12.941 1028 2HD LYS 131 HD1 LYS 131 260.533 1.093 -12.375 1029 1HE LYS 131 HE2 LYS 131 259.627 1.182 -14.442 1030 2HE LYS 131 HE1 LYS 131 258.560 2.361 -13.682 1031 1HZ LYS 131 HZ1 LYS 131 261.060 3.073 -15.112 1032 2HZ LYS 131 HZ2 LYS 131 259.880 4.136 -14.534 1033 3HZ LYS 131 HZ3 LYS 131 259.526 3.100 -15.823 1034 H LYS 132 HN LYS 132 257.174 -0.306 -11.410 1035 HA LYS 132 HA LYS 132 255.222 -0.552 -9.220 1036 1HB LYS 132 HB2 LYS 132 255.653 -2.242 -11.685 1037 2HB LYS 132 HB1 LYS 132 254.603 -2.720 -10.358 1038 1HG LYS 132 HG2 LYS 132 252.980 -1.267 -10.937 1039 2HG LYS 132 HG1 LYS 132 254.122 -0.039 -11.484 1040 1HD LYS 132 HD2 LYS 132 254.120 -0.801 -13.607 1041 2HD LYS 132 HD1 LYS 132 254.050 -2.493 -13.106 1042 1HE LYS 132 HE2 LYS 132 251.594 -1.635 -12.356 1043 2HE LYS 132 HE1 LYS 132 251.880 -0.614 -13.764 1044 1HZ LYS 132 HZ1 LYS 132 250.775 -2.844 -14.157 1045 2HZ LYS 132 HZ2 LYS 132 252.284 -3.543 -13.854 1046 3HZ LYS 132 HZ3 LYS 132 252.095 -2.469 -15.147 1047 H PHE 133 HN PHE 133 255.829 -1.596 -7.444 1048 HA PHE 133 HA PHE 133 257.971 -3.598 -7.625 1049 1HB PHE 133 HB2 PHE 133 257.846 -1.202 -5.820 1050 2HB PHE 133 HB1 PHE 133 258.688 -2.657 -5.302 1051 HD1 PHE 133 HD1 PHE 133 258.508 -0.429 -8.295 1052 HD2 PHE 133 HD2 PHE 133 260.940 -2.753 -5.689 1053 HE1 PHE 133 HE1 PHE 133 260.513 0.300 -9.520 1054 HE2 PHE 133 HE2 PHE 133 262.948 -2.029 -6.910 1055 HZ PHE 133 HZ PHE 133 262.736 -0.499 -8.828 1056 H HIS 134 HN HIS 134 258.070 -5.003 -5.687 1057 HA HIS 134 HA HIS 134 255.484 -5.242 -4.309 1058 1HB HIS 134 HB2 HIS 134 255.455 -6.910 -6.060 1059 2HB HIS 134 HB1 HIS 134 257.068 -7.460 -5.625 1060 HD1 HIS 134 HD1 HIS 134 257.131 -8.383 -2.972 1061 HD2 HIS 134 HD2 HIS 134 253.527 -8.493 -5.038 1062 HE1 HIS 134 HE1 HIS 134 255.706 -10.054 -1.748 1063 HE2 HIS 134 HE2 HIS 134 253.561 -10.166 -3.067 1064 H GLY 135 HN GLY 135 255.721 -5.317 -2.139 1065 1HA GLY 135 HA2 GLY 135 258.369 -6.156 -1.124 1066 2HA GLY 135 HA1 GLY 135 257.471 -4.815 -0.435 1067 H TYR 136 HN TYR 136 258.498 -7.359 0.693 1068 HA TYR 136 HA TYR 136 255.972 -8.405 1.794 1069 1HB TYR 136 HB2 TYR 136 257.596 -9.936 0.402 1070 2HB TYR 136 HB1 TYR 136 258.537 -9.959 1.887 1071 HD1 TYR 136 HD1 TYR 136 257.197 -12.308 0.446 1072 HD2 TYR 136 HD2 TYR 136 255.955 -9.842 3.683 1073 HE1 TYR 136 HE1 TYR 136 255.790 -14.138 1.292 1074 HE2 TYR 136 HE2 TYR 136 254.548 -11.666 4.535 1075 HH TYR 136 HH TYR 136 254.847 -14.691 3.873 1076 H PHE 137 HN PHE 137 255.666 -7.601 3.782 1077 HA PHE 137 HA PHE 137 258.040 -7.139 5.473 1078 1HB PHE 137 HB2 PHE 137 255.382 -5.739 5.732 1079 2HB PHE 137 HB1 PHE 137 256.908 -5.310 6.497 1080 HD1 PHE 137 HD1 PHE 137 255.348 -5.691 3.142 1081 HD2 PHE 137 HD2 PHE 137 258.257 -3.711 5.531 1082 HE1 PHE 137 HE1 PHE 137 255.866 -4.193 1.259 1083 HE2 PHE 137 HE2 PHE 137 258.781 -2.211 3.654 1084 HZ PHE 137 HZ PHE 137 257.585 -2.448 1.515 1085 H LYS 138 HN LYS 138 258.120 -8.025 7.470 1086 HA LYS 138 HA LYS 138 256.014 -9.865 8.259 1087 1HB LYS 138 HB2 LYS 138 258.826 -9.795 8.561 1088 2HB LYS 138 HB1 LYS 138 258.144 -9.690 10.178 1089 1HG LYS 138 HG2 LYS 138 256.655 -11.686 9.258 1090 2HG LYS 138 HG1 LYS 138 258.061 -11.905 8.215 1091 1HD LYS 138 HD2 LYS 138 259.371 -12.602 9.915 1092 2HD LYS 138 HD1 LYS 138 258.668 -11.457 11.059 1093 1HE LYS 138 HE2 LYS 138 257.291 -13.000 11.883 1094 2HE LYS 138 HE1 LYS 138 256.753 -13.476 10.274 1095 1HZ LYS 138 HZ1 LYS 138 257.748 -15.363 11.225 1096 2HZ LYS 138 HZ2 LYS 138 259.088 -14.495 11.782 1097 3HZ LYS 138 HZ3 LYS 138 258.889 -14.768 10.126 1098 H PHE 139 HN PHE 139 254.792 -9.615 10.178 1099 HA PHE 139 HA PHE 139 255.043 -6.932 11.381 1100 1HB PHE 139 HB2 PHE 139 252.814 -8.220 10.170 1101 2HB PHE 139 HB1 PHE 139 252.457 -8.056 11.885 1102 HD1 PHE 139 HD1 PHE 139 254.333 -5.841 9.548 1103 HD2 PHE 139 HD2 PHE 139 250.970 -6.315 12.112 1104 HE1 PHE 139 HE1 PHE 139 253.731 -3.481 9.190 1105 HE2 PHE 139 HE2 PHE 139 250.363 -3.957 11.759 1106 HZ PHE 139 HZ PHE 139 251.745 -2.537 10.296 1107 H GLN 140 HN GLN 140 254.201 -6.739 13.600 1108 HA GLN 140 HA GLN 140 254.464 -9.159 15.231 1109 1HB GLN 140 HB2 GLN 140 256.659 -8.235 15.356 1110 2HB GLN 140 HB1 GLN 140 256.040 -6.606 15.541 1111 1HG GLN 140 HG2 GLN 140 257.004 -7.696 17.599 1112 2HG GLN 140 HG1 GLN 140 255.402 -6.982 17.765 1113 1HE2 GLN 140 HE21 GLN 140 255.005 -8.293 19.574 1114 2HE2 GLN 140 HE22 GLN 140 254.621 -9.969 19.409 1115 H GLY 141 HN GLY 141 252.102 -8.800 15.204 1116 1HA GLY 141 HA2 GLY 141 250.562 -8.360 17.056 1117 2HA GLY 141 HA1 GLY 141 251.348 -6.801 17.246 1118 H GLN 142 HN GLN 142 250.584 -5.073 16.131 1119 HA GLN 142 HA GLN 142 248.741 -5.548 13.913 1120 1HB GLN 142 HB2 GLN 142 247.868 -4.912 16.516 1121 2HB GLN 142 HB1 GLN 142 247.658 -3.456 15.554 1122 1HG GLN 142 HG2 GLN 142 246.640 -5.281 13.864 1123 2HG GLN 142 HG1 GLN 142 246.267 -6.045 15.409 1124 1HE2 GLN 142 HE21 GLN 142 246.276 -2.712 14.179 1125 2HE2 GLN 142 HE22 GLN 142 244.674 -2.334 14.702 1126 H ASP 143 HN ASP 143 251.333 -3.804 15.113 1127 HA ASP 143 HA ASP 143 251.229 -1.999 12.878 1128 1HB ASP 143 HB2 ASP 143 251.341 0.071 14.175 1129 2HB ASP 143 HB1 ASP 143 249.837 -0.789 14.493 1130 H THR 144 HN THR 144 253.010 -4.075 14.219 1131 HA THR 144 HA THR 144 255.443 -2.410 14.306 1132 HB THR 144 HB THR 144 254.866 -4.987 15.774 1133 HG1 THR 144 HG1 THR 144 255.534 -2.406 16.742 1134 1HG2 THR 144 HG21 THR 144 257.083 -4.772 16.754 1135 2HG2 THR 144 HG22 THR 144 257.424 -3.408 15.687 1136 3HG2 THR 144 HG23 THR 144 257.164 -5.015 15.009 1137 H ILE 145 HN ILE 145 257.130 -2.968 13.007 1138 HA ILE 145 HA ILE 145 256.714 -5.352 11.350 1139 HB ILE 145 HB ILE 145 258.378 -2.954 10.598 1140 1HG1 ILE 145 HG12 ILE 145 255.607 -3.761 9.683 1141 2HG1 ILE 145 HG11 ILE 145 255.986 -2.381 10.707 1142 1HG2 ILE 145 HG21 ILE 145 257.423 -5.282 8.932 1143 2HG2 ILE 145 HG22 ILE 145 259.037 -5.145 9.629 1144 3HG2 ILE 145 HG23 ILE 145 258.499 -3.981 8.420 1145 1HD1 ILE 145 HD11 ILE 145 256.931 -2.742 7.875 1146 2HD1 ILE 145 HD12 ILE 145 257.198 -1.334 8.903 1147 3HD1 ILE 145 HD13 ILE 145 255.565 -1.747 8.381 1148 H LEU 146 HN LEU 146 258.317 -6.816 11.077 1149 HA LEU 146 HA LEU 146 260.747 -6.404 12.693 1150 1HB LEU 146 HB2 LEU 146 259.645 -9.122 12.095 1151 2HB LEU 146 HB1 LEU 146 260.713 -8.625 13.394 1152 HG LEU 146 HG LEU 146 257.895 -7.608 13.312 1153 1HD1 LEU 146 HD11 LEU 146 256.959 -9.536 13.923 1154 2HD1 LEU 146 HD12 LEU 146 258.302 -9.960 14.983 1155 3HD1 LEU 146 HD13 LEU 146 258.399 -10.301 13.256 1156 1HD2 LEU 146 HD21 LEU 146 258.799 -6.557 15.077 1157 2HD2 LEU 146 HD22 LEU 146 260.138 -7.698 15.202 1158 3HD2 LEU 146 HD23 LEU 146 258.569 -8.102 15.897 1159 H ASP 147 HN ASP 147 259.465 -7.073 9.600 1160 HA ASP 147 HA ASP 147 262.129 -7.290 8.507 1161 1HB ASP 147 HB2 ASP 147 260.743 -9.638 9.036 1162 2HB ASP 147 HB1 ASP 147 260.439 -9.356 7.325 1163 H TYR 148 HN TYR 148 262.268 -6.417 6.470 1164 HA TYR 148 HA TYR 148 259.776 -6.031 5.000 1165 1HB TYR 148 HB2 TYR 148 260.194 -3.693 4.592 1166 2HB TYR 148 HB1 TYR 148 260.122 -3.993 6.325 1167 HD1 TYR 148 HD1 TYR 148 262.234 -2.960 3.537 1168 HD2 TYR 148 HD2 TYR 148 262.162 -3.877 7.691 1169 HE1 TYR 148 HE1 TYR 148 264.425 -1.876 3.808 1170 HE2 TYR 148 HE2 TYR 148 264.352 -2.796 7.974 1171 HH TYR 148 HH TYR 148 265.762 -0.842 5.568 1172 H THR 149 HN THR 149 259.951 -6.374 2.883 1173 HA THR 149 HA THR 149 262.631 -6.294 1.673 1174 HB THR 149 HB THR 149 261.344 -8.226 0.210 1175 HG1 THR 149 HG1 THR 149 260.703 -8.651 2.939 1176 1HG2 THR 149 HG21 THR 149 263.410 -8.246 2.297 1177 2HG2 THR 149 HG22 THR 149 263.427 -8.916 0.666 1178 3HG2 THR 149 HG23 THR 149 262.630 -9.794 1.971 1179 H LEU 150 HN LEU 150 262.728 -5.612 -0.467 1180 HA LEU 150 HA LEU 150 260.208 -4.719 -1.676 1181 1HB LEU 150 HB2 LEU 150 262.706 -3.088 -1.269 1182 2HB LEU 150 HB1 LEU 150 261.488 -2.662 -2.457 1183 HG LEU 150 HG LEU 150 259.986 -2.972 -0.175 1184 1HD1 LEU 150 HD11 LEU 150 262.452 -3.010 0.862 1185 2HD1 LEU 150 HD12 LEU 150 261.064 -2.308 1.693 1186 3HD1 LEU 150 HD13 LEU 150 262.184 -1.268 0.813 1187 1HD2 LEU 150 HD21 LEU 150 261.076 -0.274 -0.594 1188 2HD2 LEU 150 HD22 LEU 150 259.406 -0.840 -0.598 1189 3HD2 LEU 150 HD23 LEU 150 260.411 -1.048 -2.033 1190 H ARG 151 HN ARG 151 259.986 -5.427 -3.675 1191 HA ARG 151 HA ARG 151 262.404 -6.003 -5.257 1192 1HB ARG 151 HB2 ARG 151 259.829 -7.583 -5.333 1193 2HB ARG 151 HB1 ARG 151 261.305 -7.935 -6.221 1194 1HG ARG 151 HG2 ARG 151 261.595 -7.774 -3.298 1195 2HG ARG 151 HG1 ARG 151 260.617 -9.113 -3.900 1196 1HD ARG 151 HD2 ARG 151 262.861 -9.015 -5.567 1197 2HD ARG 151 HD1 ARG 151 263.478 -8.765 -3.936 1198 HE ARG 151 HE ARG 151 263.074 -10.965 -3.524 1199 1HH1 ARG 151 HH11 ARG 151 261.030 -9.966 -6.170 1200 2HH1 ARG 151 HH12 ARG 151 260.401 -11.555 -6.448 1201 1HH2 ARG 151 HH21 ARG 151 262.246 -13.055 -3.887 1202 2HH2 ARG 151 HH22 ARG 151 261.090 -13.309 -5.151 1203 H GLU 152 HN GLU 152 262.063 -5.938 -7.605 1204 HA GLU 152 HA GLU 152 260.169 -3.809 -8.291 1205 1HB GLU 152 HB2 GLU 152 261.527 -3.454 -10.274 1206 2HB GLU 152 HB1 GLU 152 262.549 -3.456 -8.843 1207 1HG GLU 152 HG2 GLU 152 262.273 -6.078 -10.095 1208 2HG GLU 152 HG1 GLU 152 263.017 -4.862 -11.131 1209 H VAL 153 HN VAL 153 258.788 -3.966 -10.084 1210 HA VAL 153 HA VAL 153 258.525 -6.571 -11.380 1211 HB VAL 153 HB VAL 153 256.049 -6.545 -11.006 1212 1HG1 VAL 153 HG11 VAL 153 256.152 -7.554 -8.825 1213 2HG1 VAL 153 HG12 VAL 153 257.671 -6.731 -8.471 1214 3HG1 VAL 153 HG13 VAL 153 257.613 -7.978 -9.717 1215 1HG2 VAL 153 HG21 VAL 153 255.034 -5.149 -9.431 1216 2HG2 VAL 153 HG22 VAL 153 256.104 -4.071 -10.328 1217 3HG2 VAL 153 HG23 VAL 153 256.578 -4.658 -8.734 1218 H ASP 154 HN ASP 154 257.791 -6.461 -13.448 1219 HA ASP 154 HA ASP 154 256.710 -3.907 -14.408 1220 1HB ASP 154 HB2 ASP 154 259.304 -4.489 -14.841 1221 2HB ASP 154 HB1 ASP 154 258.587 -5.306 -16.226 1222 H THR 155 HN THR 155 257.400 -7.293 -15.238 1223 HA THR 155 HA THR 155 255.630 -7.498 -17.399 1224 HB THR 155 HB THR 155 257.265 -9.206 -17.091 1225 HG1 THR 155 HG1 THR 155 254.774 -10.376 -16.423 1226 1HG2 THR 155 HG21 THR 155 256.236 -10.662 -14.859 1227 2HG2 THR 155 HG22 THR 155 256.666 -9.025 -14.364 1228 3HG2 THR 155 HG23 THR 155 257.866 -10.054 -15.144 1229 H VAL 156 HN VAL 156 253.496 -7.341 -17.458 1230 HA VAL 156 HA VAL 156 251.971 -7.789 -14.989 1231 HB VAL 156 HB VAL 156 251.689 -5.586 -16.036 1232 1HG1 VAL 156 HG11 VAL 156 252.066 -5.992 -18.330 1233 2HG1 VAL 156 HG12 VAL 156 250.375 -5.509 -18.201 1234 3HG1 VAL 156 HG13 VAL 156 250.794 -7.211 -18.403 1235 1HG2 VAL 156 HG21 VAL 156 249.257 -7.367 -16.153 1236 2HG2 VAL 156 HG22 VAL 156 249.212 -5.604 -16.170 1237 3HG2 VAL 156 HG23 VAL 156 249.841 -6.456 -14.760 Start of MODEL 27 1 1H MET 1 HT1 MET 1 251.600 -24.572 2.709 2 2H MET 1 HT2 MET 1 251.793 -26.236 2.332 3 3H MET 1 HT3 MET 1 251.955 -25.696 3.954 4 HA MET 1 HA MET 1 249.518 -25.734 2.305 5 1HB MET 1 HB2 MET 1 250.556 -27.287 4.666 6 2HB MET 1 HB1 MET 1 248.835 -27.198 4.323 7 1HG MET 1 HG2 MET 1 248.980 -28.540 2.514 8 2HG MET 1 HG1 MET 1 250.589 -27.966 2.078 9 1HE MET 1 HE1 MET 1 253.011 -30.249 3.481 10 2HE MET 1 HE2 MET 1 252.587 -28.790 2.585 11 3HE MET 1 HE3 MET 1 252.216 -30.378 1.912 12 H GLY 2 HN GLY 2 248.453 -23.876 2.624 13 1HA GLY 2 HA2 GLY 2 247.479 -23.175 5.187 14 2HA GLY 2 HA1 GLY 2 248.789 -22.094 4.738 15 H ALA 3 HN ALA 3 247.795 -20.220 4.294 16 HA ALA 3 HA ALA 3 246.033 -20.141 1.987 17 1HB ALA 3 HB1 ALA 3 244.944 -18.519 4.162 18 2HB ALA 3 HB2 ALA 3 244.849 -20.257 4.447 19 3HB ALA 3 HB3 ALA 3 244.122 -19.560 3.000 20 H SER 4 HN SER 4 245.206 -17.534 2.114 21 HA SER 4 HA SER 4 247.319 -15.748 2.816 22 1HB SER 4 HB2 SER 4 248.563 -16.220 0.964 23 2HB SER 4 HB1 SER 4 247.175 -16.823 0.058 24 HG SER 4 HG SER 4 247.668 -14.929 -0.901 25 H ARG 5 HN ARG 5 245.849 -14.508 3.806 26 HA ARG 5 HA ARG 5 243.350 -13.771 2.771 27 1HB ARG 5 HB2 ARG 5 245.086 -12.913 4.995 28 2HB ARG 5 HB1 ARG 5 243.980 -11.680 4.405 29 1HG ARG 5 HG2 ARG 5 243.009 -12.918 6.253 30 2HG ARG 5 HG1 ARG 5 242.095 -13.181 4.767 31 1HD ARG 5 HD2 ARG 5 243.910 -15.211 4.667 32 2HD ARG 5 HD1 ARG 5 243.631 -15.070 6.403 33 HE ARG 5 HE ARG 5 241.871 -16.198 4.513 34 1HH1 ARG 5 HH11 ARG 5 241.858 -14.151 7.340 35 2HH1 ARG 5 HH12 ARG 5 240.254 -14.601 7.811 36 1HH2 ARG 5 HH21 ARG 5 239.760 -16.791 5.132 37 2HH2 ARG 5 HH22 ARG 5 239.062 -16.099 6.559 38 H LEU 6 HN LEU 6 243.451 -13.059 0.690 39 HA LEU 6 HA LEU 6 245.261 -10.912 -0.033 40 1HB LEU 6 HB2 LEU 6 244.334 -12.959 -1.473 41 2HB LEU 6 HB1 LEU 6 243.093 -11.785 -1.871 42 HG LEU 6 HG LEU 6 245.955 -10.990 -2.163 43 1HD1 LEU 6 HD11 LEU 6 246.254 -12.870 -3.401 44 2HD1 LEU 6 HD12 LEU 6 245.516 -11.845 -4.632 45 3HD1 LEU 6 HD13 LEU 6 244.538 -13.035 -3.773 46 1HD2 LEU 6 HD21 LEU 6 243.861 -10.367 -4.156 47 2HD2 LEU 6 HD22 LEU 6 245.145 -9.351 -3.502 48 3HD2 LEU 6 HD23 LEU 6 243.681 -9.634 -2.562 49 H TYR 7 HN TYR 7 244.817 -8.883 0.279 50 HA TYR 7 HA TYR 7 242.015 -7.983 0.267 51 1HB TYR 7 HB2 TYR 7 244.296 -7.233 2.081 52 2HB TYR 7 HB1 TYR 7 242.929 -6.149 1.848 53 HD1 TYR 7 HD1 TYR 7 241.407 -6.218 3.569 54 HD2 TYR 7 HD2 TYR 7 243.362 -9.823 2.441 55 HE1 TYR 7 HE1 TYR 7 240.143 -7.434 5.291 56 HE2 TYR 7 HE2 TYR 7 242.102 -11.051 4.159 57 HH TYR 7 HH TYR 7 240.953 -10.397 6.417 58 H THR 8 HN THR 8 242.134 -5.388 0.166 59 HA THR 8 HA THR 8 243.934 -4.705 -2.068 60 HB THR 8 HB THR 8 242.153 -3.547 -3.165 61 HG1 THR 8 HG1 THR 8 240.970 -2.673 -1.554 62 1HG2 THR 8 HG21 THR 8 241.877 -5.687 -3.899 63 2HG2 THR 8 HG22 THR 8 240.298 -5.393 -3.174 64 3HG2 THR 8 HG23 THR 8 241.517 -6.311 -2.291 65 H LEU 9 HN LEU 9 244.104 -2.322 -2.408 66 HA LEU 9 HA LEU 9 243.562 -0.609 -0.146 67 1HB LEU 9 HB2 LEU 9 245.698 -1.852 0.396 68 2HB LEU 9 HB1 LEU 9 246.425 -1.054 -0.984 69 HG LEU 9 HG LEU 9 245.334 0.320 1.471 70 1HD1 LEU 9 HD11 LEU 9 248.180 0.452 0.671 71 2HD1 LEU 9 HD12 LEU 9 247.606 -1.056 1.384 72 3HD1 LEU 9 HD13 LEU 9 247.451 0.457 2.277 73 1HD2 LEU 9 HD21 LEU 9 246.464 1.353 -1.098 74 2HD2 LEU 9 HD22 LEU 9 246.627 2.271 0.398 75 3HD2 LEU 9 HD23 LEU 9 245.025 1.874 -0.223 76 H VAL 10 HN VAL 10 242.670 1.051 -1.265 77 HA VAL 10 HA VAL 10 244.011 1.928 -3.719 78 HB VAL 10 HB VAL 10 241.823 1.403 -4.285 79 1HG1 VAL 10 HG11 VAL 10 239.920 2.507 -2.864 80 2HG1 VAL 10 HG12 VAL 10 241.152 2.382 -1.609 81 3HG1 VAL 10 HG13 VAL 10 240.615 0.938 -2.469 82 1HG2 VAL 10 HG21 VAL 10 242.571 3.762 -4.903 83 2HG2 VAL 10 HG22 VAL 10 241.456 4.304 -3.651 84 3HG2 VAL 10 HG23 VAL 10 240.851 3.397 -5.036 85 H LEU 11 HN LEU 11 245.021 3.743 -3.787 86 HA LEU 11 HA LEU 11 244.381 5.854 -1.846 87 1HB LEU 11 HB2 LEU 11 246.818 4.396 -2.187 88 2HB LEU 11 HB1 LEU 11 247.097 6.056 -2.671 89 HG LEU 11 HG LEU 11 246.345 4.982 0.026 90 1HD1 LEU 11 HD11 LEU 11 248.720 5.949 -1.136 91 2HD1 LEU 11 HD12 LEU 11 248.442 5.517 0.551 92 3HD1 LEU 11 HD13 LEU 11 248.195 7.178 0.016 93 1HD2 LEU 11 HD21 LEU 11 246.211 7.559 0.566 94 2HD2 LEU 11 HD22 LEU 11 244.790 6.638 0.076 95 3HD2 LEU 11 HD23 LEU 11 245.646 7.633 -1.102 96 H VAL 12 HN VAL 12 243.517 7.469 -2.978 97 HA VAL 12 HA VAL 12 244.045 7.756 -5.786 98 HB VAL 12 HB VAL 12 242.449 9.592 -4.003 99 1HG1 VAL 12 HG11 VAL 12 241.268 9.663 -6.427 100 2HG1 VAL 12 HG12 VAL 12 242.948 9.410 -6.903 101 3HG1 VAL 12 HG13 VAL 12 242.513 10.801 -5.911 102 1HG2 VAL 12 HG21 VAL 12 241.908 6.900 -5.052 103 2HG2 VAL 12 HG22 VAL 12 240.627 8.080 -5.332 104 3HG2 VAL 12 HG23 VAL 12 241.183 7.755 -3.692 105 H LEU 13 HN LEU 13 246.350 8.110 -5.514 106 HA LEU 13 HA LEU 13 247.098 10.798 -4.623 107 1HB LEU 13 HB2 LEU 13 248.317 8.703 -3.879 108 2HB LEU 13 HB1 LEU 13 248.941 8.612 -5.513 109 HG LEU 13 HG LEU 13 250.621 9.896 -4.877 110 1HD1 LEU 13 HD11 LEU 13 248.488 11.958 -4.474 111 2HD1 LEU 13 HD12 LEU 13 249.552 11.739 -5.861 112 3HD1 LEU 13 HD13 LEU 13 250.207 12.308 -4.328 113 1HD2 LEU 13 HD21 LEU 13 249.172 9.694 -2.369 114 2HD2 LEU 13 HD22 LEU 13 250.180 11.136 -2.478 115 3HD2 LEU 13 HD23 LEU 13 250.897 9.541 -2.697 116 H GLN 14 HN GLN 14 247.166 12.344 -6.082 117 HA GLN 14 HA GLN 14 247.610 11.649 -8.901 118 1HB GLN 14 HB2 GLN 14 246.110 13.821 -7.513 119 2HB GLN 14 HB1 GLN 14 246.819 14.182 -9.081 120 1HG GLN 14 HG2 GLN 14 245.558 12.446 -10.128 121 2HG GLN 14 HG1 GLN 14 244.979 11.860 -8.569 122 1HE2 GLN 14 HE21 GLN 14 243.045 12.512 -7.968 123 2HE2 GLN 14 HE22 GLN 14 242.211 13.904 -8.557 124 HA PRO 15 HA PRO 15 251.558 13.603 -9.007 125 1HB PRO 15 HB2 PRO 15 251.480 14.977 -11.366 126 2HB PRO 15 HB1 PRO 15 251.703 13.229 -11.255 127 1HG PRO 15 HG2 PRO 15 249.214 14.791 -11.820 128 2HG PRO 15 HG1 PRO 15 249.806 13.309 -12.594 129 1HD PRO 15 HD2 PRO 15 247.864 13.261 -10.733 130 2HD PRO 15 HD1 PRO 15 249.066 11.960 -10.867 131 H GLN 16 HN GLN 16 249.343 15.112 -7.675 132 HA GLN 16 HA GLN 16 250.700 17.617 -7.450 133 1HB GLN 16 HB2 GLN 16 248.547 18.923 -7.911 134 2HB GLN 16 HB1 GLN 16 249.437 18.321 -9.303 135 1HG GLN 16 HG2 GLN 16 247.894 16.517 -9.591 136 2HG GLN 16 HG1 GLN 16 247.072 16.920 -8.085 137 1HE2 GLN 16 HE21 GLN 16 245.886 16.697 -10.667 138 2HE2 GLN 16 HE22 GLN 16 245.229 18.244 -11.069 139 H ARG 17 HN ARG 17 247.833 15.687 -6.690 140 HA ARG 17 HA ARG 17 248.120 16.474 -3.892 141 1HB ARG 17 HB2 ARG 17 245.571 16.653 -3.776 142 2HB ARG 17 HB1 ARG 17 246.435 17.989 -4.523 143 1HG ARG 17 HG2 ARG 17 245.078 17.783 -6.260 144 2HG ARG 17 HG1 ARG 17 245.877 16.253 -6.622 145 1HD ARG 17 HD2 ARG 17 244.169 15.009 -5.800 146 2HD ARG 17 HD1 ARG 17 243.771 16.187 -4.550 147 HE ARG 17 HE ARG 17 242.525 15.934 -7.064 148 1HH1 ARG 17 HH11 ARG 17 243.672 18.373 -4.847 149 2HH1 ARG 17 HH12 ARG 17 242.530 19.565 -5.373 150 1HH2 ARG 17 HH21 ARG 17 241.024 17.500 -7.756 151 2HH2 ARG 17 HH22 ARG 17 241.027 19.070 -7.023 152 H VAL 18 HN VAL 18 246.897 15.059 -2.407 153 HA VAL 18 HA VAL 18 246.332 12.397 -3.541 154 HB VAL 18 HB VAL 18 248.517 12.187 -2.603 155 1HG1 VAL 18 HG11 VAL 18 249.221 12.981 -0.527 156 2HG1 VAL 18 HG12 VAL 18 247.570 13.183 0.059 157 3HG1 VAL 18 HG13 VAL 18 248.214 14.283 -1.159 158 1HG2 VAL 18 HG21 VAL 18 246.548 11.119 -0.584 159 2HG2 VAL 18 HG22 VAL 18 248.181 10.521 -0.874 160 3HG2 VAL 18 HG23 VAL 18 246.945 10.354 -2.122 161 H LEU 19 HN LEU 19 244.944 11.069 -2.209 162 HA LEU 19 HA LEU 19 243.282 12.624 -0.336 163 1HB LEU 19 HB2 LEU 19 242.150 12.160 -2.494 164 2HB LEU 19 HB1 LEU 19 242.361 10.442 -2.209 165 HG LEU 19 HG LEU 19 240.884 10.514 -0.303 166 1HD1 LEU 19 HD11 LEU 19 241.303 13.412 -0.565 167 2HD1 LEU 19 HD12 LEU 19 240.986 12.431 0.866 168 3HD1 LEU 19 HD13 LEU 19 239.654 12.917 -0.182 169 1HD2 LEU 19 HD21 LEU 19 239.787 11.930 -2.725 170 2HD2 LEU 19 HD22 LEU 19 238.792 11.272 -1.427 171 3HD2 LEU 19 HD23 LEU 19 239.789 10.196 -2.407 172 H LEU 20 HN LEU 20 243.453 11.876 1.676 173 HA LEU 20 HA LEU 20 243.994 8.997 2.041 174 1HB LEU 20 HB2 LEU 20 245.226 11.371 3.177 175 2HB LEU 20 HB1 LEU 20 244.684 10.255 4.416 176 HG LEU 20 HG LEU 20 246.439 9.419 2.113 177 1HD1 LEU 20 HD11 LEU 20 247.559 11.151 3.453 178 2HD1 LEU 20 HD12 LEU 20 248.326 9.572 3.619 179 3HD1 LEU 20 HD13 LEU 20 247.285 10.186 4.903 180 1HD2 LEU 20 HD21 LEU 20 246.755 7.421 3.273 181 2HD2 LEU 20 HD22 LEU 20 245.033 7.749 3.461 182 3HD2 LEU 20 HD23 LEU 20 246.145 8.093 4.786 183 H GLY 21 HN GLY 21 243.137 8.005 3.993 184 1HA GLY 21 HA2 GLY 21 240.492 9.118 4.653 185 2HA GLY 21 HA1 GLY 21 240.928 7.418 4.741 186 H MET 22 HN MET 22 240.536 10.270 6.464 187 HA MET 22 HA MET 22 242.197 9.393 8.710 188 1HB MET 22 HB2 MET 22 242.561 11.674 8.294 189 2HB MET 22 HB1 MET 22 240.861 11.985 7.977 190 1HG MET 22 HG2 MET 22 240.344 12.215 10.174 191 2HG MET 22 HG1 MET 22 241.592 11.086 10.702 192 1HE MET 22 HE1 MET 22 244.805 13.181 10.732 193 2HE MET 22 HE2 MET 22 244.193 11.834 9.772 194 3HE MET 22 HE3 MET 22 243.987 11.834 11.521 195 H LYS 23 HN LYS 23 241.300 8.884 10.741 196 HA LYS 23 HA LYS 23 238.529 8.065 10.669 197 1HB LYS 23 HB2 LYS 23 240.660 7.858 12.799 198 2HB LYS 23 HB1 LYS 23 239.035 7.209 12.972 199 1HG LYS 23 HG2 LYS 23 240.807 6.397 10.697 200 2HG LYS 23 HG1 LYS 23 240.912 5.617 12.275 201 1HD LYS 23 HD2 LYS 23 238.433 5.810 10.565 202 2HD LYS 23 HD1 LYS 23 239.445 4.378 10.755 203 1HE LYS 23 HE2 LYS 23 238.880 5.078 13.351 204 2HE LYS 23 HE1 LYS 23 237.382 5.467 12.508 205 1HZ LYS 23 HZ1 LYS 23 237.060 3.276 13.024 206 2HZ LYS 23 HZ2 LYS 23 238.692 2.864 12.860 207 3HZ LYS 23 HZ3 LYS 23 237.742 3.118 11.484 208 H LYS 24 HN LYS 24 236.871 8.942 11.896 209 HA LYS 24 HA LYS 24 237.407 11.637 12.855 210 1HB LYS 24 HB2 LYS 24 234.678 10.382 12.737 211 2HB LYS 24 HB1 LYS 24 235.109 12.082 12.643 212 1HG LYS 24 HG2 LYS 24 235.869 11.875 10.426 213 2HG LYS 24 HG1 LYS 24 235.882 10.113 10.515 214 1HD LYS 24 HD2 LYS 24 233.842 10.144 9.618 215 2HD LYS 24 HD1 LYS 24 233.264 10.835 11.134 216 1HE LYS 24 HE2 LYS 24 234.480 12.692 9.170 217 2HE LYS 24 HE1 LYS 24 232.896 12.024 8.776 218 1HZ LYS 24 HZ1 LYS 24 232.329 13.892 9.945 219 2HZ LYS 24 HZ2 LYS 24 233.665 13.807 10.978 220 3HZ LYS 24 HZ3 LYS 24 232.358 12.756 11.199 221 H ARG 25 HN ARG 25 236.357 8.511 14.036 222 HA ARG 25 HA ARG 25 237.084 9.198 16.685 223 1HB ARG 25 HB2 ARG 25 234.684 8.701 17.577 224 2HB ARG 25 HB1 ARG 25 235.092 10.320 17.029 225 1HG ARG 25 HG2 ARG 25 232.876 9.506 16.262 226 2HG ARG 25 HG1 ARG 25 233.962 9.980 14.954 227 1HD ARG 25 HD2 ARG 25 234.316 7.795 14.282 228 2HD ARG 25 HD1 ARG 25 233.870 7.133 15.854 229 HE ARG 25 HE ARG 25 232.108 7.753 13.667 230 1HH1 ARG 25 HH11 ARG 25 232.337 7.299 17.119 231 2HH1 ARG 25 HH12 ARG 25 230.663 6.898 17.303 232 1HH2 ARG 25 HH21 ARG 25 229.905 7.225 13.907 233 2HH2 ARG 25 HH22 ARG 25 229.282 6.856 15.481 234 H GLY 26 HN GLY 26 236.017 7.397 18.245 235 1HA GLY 26 HA2 GLY 26 235.612 5.127 18.625 236 2HA GLY 26 HA1 GLY 26 235.809 4.827 16.904 237 H PHE 27 HN PHE 27 237.314 3.252 16.868 238 HA PHE 27 HA PHE 27 239.758 3.615 18.446 239 1HB PHE 27 HB2 PHE 27 238.238 1.401 18.169 240 2HB PHE 27 HB1 PHE 27 239.376 1.147 16.850 241 HD1 PHE 27 HD1 PHE 27 241.874 2.157 17.879 242 HD2 PHE 27 HD2 PHE 27 238.815 -0.026 19.878 243 HE1 PHE 27 HE1 PHE 27 243.536 1.298 19.477 244 HE2 PHE 27 HE2 PHE 27 240.473 -0.888 21.480 245 HZ PHE 27 HZ PHE 27 242.836 -0.226 21.281 246 H GLY 28 HN GLY 28 239.944 5.437 16.642 247 1HA GLY 28 HA2 GLY 28 242.151 4.744 15.053 248 2HA GLY 28 HA1 GLY 28 240.719 4.718 14.039 249 H ALA 29 HN ALA 29 239.425 6.911 15.519 250 HA ALA 29 HA ALA 29 239.602 9.089 14.125 251 1HB ALA 29 HB1 ALA 29 240.091 9.999 16.808 252 2HB ALA 29 HB2 ALA 29 238.956 8.649 16.766 253 3HB ALA 29 HB3 ALA 29 238.637 10.101 15.816 254 H GLY 30 HN GLY 30 240.989 10.607 13.392 255 1HA GLY 30 HA2 GLY 30 242.904 11.872 13.169 256 2HA GLY 30 HA1 GLY 30 243.361 11.367 14.788 257 H ARG 31 HN ARG 31 242.745 9.389 11.916 258 HA ARG 31 HA ARG 31 245.581 8.768 11.691 259 1HB ARG 31 HB2 ARG 31 243.451 6.762 12.395 260 2HB ARG 31 HB1 ARG 31 244.937 6.280 11.588 261 1HG ARG 31 HG2 ARG 31 246.053 7.601 13.569 262 2HG ARG 31 HG1 ARG 31 244.514 7.257 14.361 263 1HD ARG 31 HD2 ARG 31 246.532 5.309 13.280 264 2HD ARG 31 HD1 ARG 31 245.963 5.483 14.937 265 HE ARG 31 HE ARG 31 243.981 4.376 14.361 266 1HH1 ARG 31 HH11 ARG 31 246.124 4.677 11.613 267 2HH1 ARG 31 HH12 ARG 31 245.298 3.471 10.687 268 1HH2 ARG 31 HH21 ARG 31 242.902 2.797 13.136 269 2HH2 ARG 31 HH22 ARG 31 243.472 2.407 11.547 270 H TRP 32 HN TRP 32 245.963 9.203 9.630 271 HA TRP 32 HA TRP 32 243.970 9.023 7.589 272 1HB TRP 32 HB2 TRP 32 246.879 9.183 6.928 273 2HB TRP 32 HB1 TRP 32 245.515 9.979 6.158 274 HD1 TRP 32 HD1 TRP 32 247.922 10.352 9.110 275 HE1 TRP 32 HE1 TRP 32 247.801 12.777 9.963 276 HE3 TRP 32 HE3 TRP 32 243.985 12.005 6.300 277 HZ2 TRP 32 HZ2 TRP 32 246.244 15.086 9.505 278 HZ3 TRP 32 HZ3 TRP 32 243.243 14.334 6.568 279 HH2 TRP 32 HH2 TRP 32 244.350 15.843 8.136 280 H ASN 33 HN ASN 33 244.040 7.643 5.707 281 HA ASN 33 HA ASN 33 245.799 5.524 5.321 282 1HB ASN 33 HB2 ASN 33 244.230 3.632 6.068 283 2HB ASN 33 HB1 ASN 33 245.146 4.466 7.320 284 1HD2 ASN 33 HD21 ASN 33 243.929 4.526 9.064 285 2HD2 ASN 33 HD22 ASN 33 242.271 5.007 9.129 286 H GLY 34 HN GLY 34 245.268 4.212 3.561 287 1HA GLY 34 HA2 GLY 34 243.520 5.394 1.666 288 2HA GLY 34 HA1 GLY 34 244.359 3.862 1.481 289 H PHE 35 HN PHE 35 242.316 3.275 0.373 290 HA PHE 35 HA PHE 35 240.272 2.446 2.330 291 1HB PHE 35 HB2 PHE 35 239.587 2.646 -0.562 292 2HB PHE 35 HB1 PHE 35 238.578 2.908 0.849 293 HD1 PHE 35 HD1 PHE 35 239.192 5.009 2.288 294 HD2 PHE 35 HD2 PHE 35 240.286 4.464 -1.787 295 HE1 PHE 35 HE1 PHE 35 239.469 7.441 2.041 296 HE2 PHE 35 HE2 PHE 35 240.566 6.895 -2.041 297 HZ PHE 35 HZ PHE 35 240.158 8.387 -0.126 298 H GLY 36 HN GLY 36 241.251 0.457 2.769 299 1HA GLY 36 HA2 GLY 36 241.851 -1.326 0.562 300 2HA GLY 36 HA1 GLY 36 242.101 -1.660 2.267 301 H GLY 37 HN GLY 37 241.009 -3.465 0.375 302 1HA GLY 37 HA2 GLY 37 238.363 -3.869 1.600 303 2HA GLY 37 HA1 GLY 37 238.540 -3.979 -0.146 304 H LYS 38 HN LYS 38 237.931 -6.139 -0.261 305 HA LYS 38 HA LYS 38 240.044 -8.010 0.378 306 1HB LYS 38 HB2 LYS 38 238.733 -9.512 1.695 307 2HB LYS 38 HB1 LYS 38 238.597 -7.919 2.427 308 1HG LYS 38 HG2 LYS 38 236.439 -7.771 0.936 309 2HG LYS 38 HG1 LYS 38 236.551 -9.531 0.993 310 1HD LYS 38 HD2 LYS 38 236.947 -8.878 3.606 311 2HD LYS 38 HD1 LYS 38 235.829 -7.612 3.095 312 1HE LYS 38 HE2 LYS 38 234.444 -9.513 2.079 313 2HE LYS 38 HE1 LYS 38 235.441 -10.588 3.059 314 1HZ LYS 38 HZ1 LYS 38 234.458 -9.915 4.956 315 2HZ LYS 38 HZ2 LYS 38 233.179 -9.515 3.923 316 3HZ LYS 38 HZ3 LYS 38 234.257 -8.317 4.436 317 H VAL 39 HN VAL 39 240.069 -9.792 -0.951 318 HA VAL 39 HA VAL 39 238.273 -9.664 -3.244 319 HB VAL 39 HB VAL 39 240.364 -11.779 -3.043 320 1HG1 VAL 39 HG11 VAL 39 240.665 -11.147 -5.427 321 2HG1 VAL 39 HG12 VAL 39 239.381 -9.954 -5.230 322 3HG1 VAL 39 HG13 VAL 39 239.027 -11.671 -5.035 323 1HG2 VAL 39 HG21 VAL 39 240.909 -8.855 -3.071 324 2HG2 VAL 39 HG22 VAL 39 241.926 -9.920 -4.042 325 3HG2 VAL 39 HG23 VAL 39 241.803 -10.164 -2.299 326 H GLN 40 HN GLN 40 236.331 -10.535 -2.707 327 HA GLN 40 HA GLN 40 235.827 -12.653 -0.996 328 1HB GLN 40 HB2 GLN 40 234.192 -11.025 -2.159 329 2HB GLN 40 HB1 GLN 40 234.182 -12.196 -3.470 330 1HG GLN 40 HG2 GLN 40 233.019 -13.738 -2.274 331 2HG GLN 40 HG1 GLN 40 233.679 -13.202 -0.730 332 1HE2 GLN 40 HE21 GLN 40 230.936 -13.754 -1.368 333 2HE2 GLN 40 HE22 GLN 40 230.054 -12.290 -1.117 334 H GLU 41 HN GLU 41 234.837 -14.805 -1.714 335 HA GLU 41 HA GLU 41 236.799 -16.409 -2.845 336 1HB GLU 41 HB2 GLU 41 233.893 -16.776 -2.264 337 2HB GLU 41 HB1 GLU 41 234.719 -17.996 -3.222 338 1HG GLU 41 HG2 GLU 41 236.426 -18.103 -1.356 339 2HG GLU 41 HG1 GLU 41 235.290 -17.151 -0.402 340 H GLY 42 HN GLY 42 237.528 -15.596 -4.808 341 1HA GLY 42 HA2 GLY 42 237.545 -16.040 -7.135 342 2HA GLY 42 HA1 GLY 42 235.802 -16.251 -7.082 343 H GLU 43 HN GLU 43 237.912 -13.586 -6.001 344 HA GLU 43 HA GLU 43 236.482 -11.818 -7.865 345 1HB GLU 43 HB2 GLU 43 236.424 -11.719 -5.042 346 2HB GLU 43 HB1 GLU 43 237.458 -10.394 -5.556 347 1HG GLU 43 HG2 GLU 43 235.746 -9.203 -6.319 348 2HG GLU 43 HG1 GLU 43 235.011 -10.595 -7.112 349 H THR 44 HN THR 44 237.773 -9.687 -8.066 350 HA THR 44 HA THR 44 240.607 -10.412 -8.362 351 HB THR 44 HB THR 44 240.687 -8.706 -10.144 352 HG1 THR 44 HG1 THR 44 238.958 -7.574 -10.698 353 1HG2 THR 44 HG21 THR 44 238.422 -10.586 -10.714 354 2HG2 THR 44 HG22 THR 44 240.102 -11.116 -10.615 355 3HG2 THR 44 HG23 THR 44 239.618 -9.938 -11.838 356 H ILE 45 HN ILE 45 242.153 -9.081 -7.535 357 HA ILE 45 HA ILE 45 241.578 -7.583 -5.295 358 HB ILE 45 HB ILE 45 243.973 -6.906 -6.965 359 1HG1 ILE 45 HG12 ILE 45 244.833 -8.938 -5.358 360 2HG1 ILE 45 HG11 ILE 45 243.238 -9.514 -5.833 361 1HG2 ILE 45 HG21 ILE 45 243.855 -5.613 -5.020 362 2HG2 ILE 45 HG22 ILE 45 244.982 -6.912 -4.630 363 3HG2 ILE 45 HG23 ILE 45 243.321 -6.981 -4.044 364 1HD1 ILE 45 HD11 ILE 45 244.097 -8.829 -8.229 365 2HD1 ILE 45 HD12 ILE 45 244.494 -10.390 -7.509 366 3HD1 ILE 45 HD13 ILE 45 245.670 -9.077 -7.469 367 H GLU 46 HN GLU 46 241.644 -6.566 -8.643 368 HA GLU 46 HA GLU 46 241.519 -3.753 -8.065 369 1HB GLU 46 HB2 GLU 46 242.288 -4.955 -10.256 370 2HB GLU 46 HB1 GLU 46 240.572 -4.977 -10.640 371 1HG GLU 46 HG2 GLU 46 240.465 -2.578 -10.532 372 2HG GLU 46 HG1 GLU 46 242.137 -2.495 -9.983 373 H ASP 47 HN ASP 47 239.292 -6.383 -8.286 374 HA ASP 47 HA ASP 47 236.971 -4.682 -8.566 375 1HB ASP 47 HB2 ASP 47 237.429 -7.633 -8.346 376 2HB ASP 47 HB1 ASP 47 235.834 -6.993 -7.965 377 H GLY 48 HN GLY 48 238.640 -6.531 -6.071 378 1HA GLY 48 HA2 GLY 48 236.715 -6.072 -4.018 379 2HA GLY 48 HA1 GLY 48 238.390 -6.558 -3.778 380 H ALA 49 HN ALA 49 239.554 -4.336 -5.140 381 HA ALA 49 HA ALA 49 239.555 -2.427 -3.006 382 1HB ALA 49 HB1 ALA 49 241.369 -3.173 -4.931 383 2HB ALA 49 HB2 ALA 49 241.516 -1.777 -3.866 384 3HB ALA 49 HB3 ALA 49 240.845 -1.585 -5.485 385 H ARG 50 HN ARG 50 238.357 -2.575 -6.319 386 HA ARG 50 HA ARG 50 237.470 0.103 -6.446 387 1HB ARG 50 HB2 ARG 50 237.009 -2.367 -8.043 388 2HB ARG 50 HB1 ARG 50 235.890 -1.029 -8.260 389 1HG ARG 50 HG2 ARG 50 238.062 0.377 -8.557 390 2HG ARG 50 HG1 ARG 50 238.795 -1.190 -8.905 391 1HD ARG 50 HD2 ARG 50 236.788 -1.482 -10.523 392 2HD ARG 50 HD1 ARG 50 236.649 0.272 -10.394 393 HE ARG 50 HE ARG 50 239.258 -0.090 -10.993 394 1HH1 ARG 50 HH11 ARG 50 236.303 -1.245 -12.446 395 2HH1 ARG 50 HH12 ARG 50 236.969 -1.314 -14.043 396 1HH2 ARG 50 HH21 ARG 50 240.135 -0.179 -13.093 397 2HH2 ARG 50 HH22 ARG 50 239.144 -0.710 -14.411 398 H ARG 51 HN ARG 51 235.665 -2.931 -5.969 399 HA ARG 51 HA ARG 51 233.164 -1.781 -5.509 400 1HB ARG 51 HB2 ARG 51 233.925 -4.282 -5.818 401 2HB ARG 51 HB1 ARG 51 233.961 -4.271 -4.059 402 1HG ARG 51 HG2 ARG 51 231.573 -3.347 -4.217 403 2HG ARG 51 HG1 ARG 51 231.625 -3.896 -5.893 404 1HD ARG 51 HD2 ARG 51 232.510 -6.114 -4.727 405 2HD ARG 51 HD1 ARG 51 231.587 -5.464 -3.373 406 HE ARG 51 HE ARG 51 229.651 -5.943 -4.502 407 1HH1 ARG 51 HH11 ARG 51 232.339 -6.137 -6.720 408 2HH1 ARG 51 HH12 ARG 51 231.393 -6.814 -8.002 409 1HH2 ARG 51 HH21 ARG 51 228.405 -6.833 -6.188 410 2HH2 ARG 51 HH22 ARG 51 229.159 -7.209 -7.702 411 H GLU 52 HN GLU 52 235.837 -2.397 -3.313 412 HA GLU 52 HA GLU 52 234.313 -1.578 -0.991 413 1HB GLU 52 HB2 GLU 52 237.211 -2.342 -1.366 414 2HB GLU 52 HB1 GLU 52 236.541 -1.829 0.175 415 1HG GLU 52 HG2 GLU 52 235.787 -4.263 -1.419 416 2HG GLU 52 HG1 GLU 52 236.615 -4.211 0.136 417 H LEU 53 HN LEU 53 236.346 -0.157 -3.368 418 HA LEU 53 HA LEU 53 237.253 2.075 -1.885 419 1HB LEU 53 HB2 LEU 53 238.454 1.568 -3.840 420 2HB LEU 53 HB1 LEU 53 236.998 1.461 -4.813 421 HG LEU 53 HG LEU 53 236.700 3.884 -4.625 422 1HD1 LEU 53 HD11 LEU 53 237.919 5.205 -3.279 423 2HD1 LEU 53 HD12 LEU 53 239.407 4.303 -3.566 424 3HD1 LEU 53 HD13 LEU 53 238.221 3.703 -2.408 425 1HD2 LEU 53 HD21 LEU 53 239.010 4.444 -5.786 426 2HD2 LEU 53 HD22 LEU 53 237.789 3.456 -6.588 427 3HD2 LEU 53 HD23 LEU 53 239.160 2.686 -5.789 428 H GLN 54 HN GLN 54 234.603 1.628 -4.199 429 HA GLN 54 HA GLN 54 233.586 4.248 -4.066 430 1HB GLN 54 HB2 GLN 54 232.744 3.064 -5.852 431 2HB GLN 54 HB1 GLN 54 232.504 1.601 -4.910 432 1HG GLN 54 HG2 GLN 54 230.555 2.571 -3.847 433 2HG GLN 54 HG1 GLN 54 230.817 4.087 -4.709 434 1HE2 GLN 54 HE21 GLN 54 229.115 4.225 -6.020 435 2HE2 GLN 54 HE22 GLN 54 228.638 3.025 -7.168 436 H GLU 55 HN GLU 55 233.235 1.492 -2.005 437 HA GLU 55 HA GLU 55 230.977 2.543 -0.553 438 1HB GLU 55 HB2 GLU 55 232.696 0.099 -0.291 439 2HB GLU 55 HB1 GLU 55 231.576 0.547 0.989 440 1HG GLU 55 HG2 GLU 55 229.891 0.681 -1.052 441 2HG GLU 55 HG1 GLU 55 231.038 -0.468 -1.739 442 H GLU 56 HN GLU 56 234.421 2.738 -0.285 443 HA GLU 56 HA GLU 56 234.441 3.283 2.523 444 1HB GLU 56 HB2 GLU 56 236.449 3.226 0.344 445 2HB GLU 56 HB1 GLU 56 236.837 4.180 1.770 446 1HG GLU 56 HG2 GLU 56 235.793 1.521 2.376 447 2HG GLU 56 HG1 GLU 56 237.307 1.511 1.472 448 H SER 57 HN SER 57 234.684 5.335 -0.385 449 HA SER 57 HA SER 57 233.984 7.607 1.336 450 1HB SER 57 HB2 SER 57 236.540 7.271 0.447 451 2HB SER 57 HB1 SER 57 235.858 8.274 -0.833 452 HG SER 57 HG SER 57 235.064 9.618 0.996 453 H GLY 58 HN GLY 58 232.418 6.006 -0.574 454 1HA GLY 58 HA2 GLY 58 230.907 6.306 -2.271 455 2HA GLY 58 HA1 GLY 58 230.894 7.984 -1.749 456 H LEU 59 HN LEU 59 233.937 6.814 -2.804 457 HA LEU 59 HA LEU 59 233.624 8.336 -5.290 458 1HB LEU 59 HB2 LEU 59 236.026 7.633 -3.623 459 2HB LEU 59 HB1 LEU 59 236.174 8.246 -5.260 460 HG LEU 59 HG LEU 59 234.961 9.669 -2.901 461 1HD1 LEU 59 HD11 LEU 59 237.360 9.695 -2.859 462 2HD1 LEU 59 HD12 LEU 59 236.794 11.282 -3.383 463 3HD1 LEU 59 HD13 LEU 59 237.430 10.137 -4.565 464 1HD2 LEU 59 HD21 LEU 59 234.727 11.578 -4.485 465 2HD2 LEU 59 HD22 LEU 59 233.652 10.225 -4.833 466 3HD2 LEU 59 HD23 LEU 59 235.102 10.469 -5.804 467 H THR 60 HN THR 60 233.381 7.220 -7.066 468 HA THR 60 HA THR 60 234.376 4.464 -7.165 469 HB THR 60 HB THR 60 232.669 5.342 -9.367 470 HG1 THR 60 HG1 THR 60 230.790 5.480 -8.076 471 1HG2 THR 60 HG21 THR 60 232.293 3.159 -9.340 472 2HG2 THR 60 HG22 THR 60 231.409 3.367 -7.829 473 3HG2 THR 60 HG23 THR 60 233.133 2.997 -7.798 474 H VAL 61 HN VAL 61 235.877 3.860 -8.655 475 HA VAL 61 HA VAL 61 236.964 6.026 -10.309 476 HB VAL 61 HB VAL 61 239.062 4.851 -10.341 477 1HG1 VAL 61 HG11 VAL 61 238.843 6.281 -8.482 478 2HG1 VAL 61 HG12 VAL 61 239.517 4.779 -7.849 479 3HG1 VAL 61 HG13 VAL 61 237.805 5.142 -7.627 480 1HG2 VAL 61 HG21 VAL 61 237.434 2.593 -9.605 481 2HG2 VAL 61 HG22 VAL 61 238.779 2.777 -8.479 482 3HG2 VAL 61 HG23 VAL 61 239.091 2.631 -10.209 483 H ASP 62 HN ASP 62 237.193 5.851 -12.456 484 HA ASP 62 HA ASP 62 235.739 3.748 -13.786 485 1HB ASP 62 HB2 ASP 62 236.079 6.346 -14.390 486 2HB ASP 62 HB1 ASP 62 237.384 5.663 -15.355 487 H ALA 63 HN ALA 63 238.932 4.233 -12.748 488 HA ALA 63 HA ALA 63 239.842 1.758 -13.644 489 1HB ALA 63 HB1 ALA 63 240.852 2.065 -15.629 490 2HB ALA 63 HB2 ALA 63 241.397 3.691 -15.216 491 3HB ALA 63 HB3 ALA 63 239.744 3.430 -15.774 492 H LEU 64 HN LEU 64 240.645 1.705 -11.525 493 HA LEU 64 HA LEU 64 242.308 3.617 -10.312 494 1HB LEU 64 HB2 LEU 64 241.842 0.687 -9.957 495 2HB LEU 64 HB1 LEU 64 243.241 1.397 -9.176 496 HG LEU 64 HG LEU 64 240.742 2.862 -8.708 497 1HD1 LEU 64 HD11 LEU 64 239.619 1.299 -7.434 498 2HD1 LEU 64 HD12 LEU 64 241.039 0.268 -7.262 499 3HD1 LEU 64 HD13 LEU 64 240.177 0.331 -8.799 500 1HD2 LEU 64 HD21 LEU 64 242.307 1.768 -6.482 501 2HD2 LEU 64 HD22 LEU 64 241.782 3.419 -6.797 502 3HD2 LEU 64 HD23 LEU 64 243.221 2.786 -7.594 503 H HIS 65 HN HIS 65 244.700 2.814 -9.675 504 HA HIS 65 HA HIS 65 246.062 1.847 -12.085 505 1HB HIS 65 HB2 HIS 65 246.035 4.485 -11.583 506 2HB HIS 65 HB1 HIS 65 247.414 4.025 -10.591 507 HD1 HIS 65 HD1 HIS 65 246.237 3.603 -14.183 508 HD2 HIS 65 HD2 HIS 65 249.742 3.889 -11.970 509 HE1 HIS 65 HE1 HIS 65 248.098 3.642 -15.873 510 HE2 HIS 65 HE2 HIS 65 250.202 3.905 -14.515 511 H LYS 66 HN LYS 66 246.764 -0.076 -11.292 512 HA LYS 66 HA LYS 66 247.660 -0.499 -8.639 513 1HB LYS 66 HB2 LYS 66 248.795 -2.560 -9.730 514 2HB LYS 66 HB1 LYS 66 247.041 -2.470 -9.732 515 1HG LYS 66 HG2 LYS 66 246.958 -1.938 -12.011 516 2HG LYS 66 HG1 LYS 66 248.671 -1.514 -12.059 517 1HD LYS 66 HD2 LYS 66 248.856 -4.072 -11.257 518 2HD LYS 66 HD1 LYS 66 247.361 -4.160 -12.192 519 1HE LYS 66 HE2 LYS 66 248.768 -4.487 -13.922 520 2HE LYS 66 HE1 LYS 66 248.904 -2.729 -13.878 521 1HZ LYS 66 HZ1 LYS 66 251.088 -3.276 -13.811 522 2HZ LYS 66 HZ2 LYS 66 250.828 -4.764 -13.048 523 3HZ LYS 66 HZ3 LYS 66 250.782 -3.332 -12.147 524 H VAL 67 HN VAL 67 249.646 -0.251 -7.706 525 HA VAL 67 HA VAL 67 251.858 0.462 -9.524 526 HB VAL 67 HB VAL 67 252.613 2.197 -7.943 527 1HG1 VAL 67 HG11 VAL 67 249.893 2.445 -9.197 528 2HG1 VAL 67 HG12 VAL 67 251.445 3.004 -9.817 529 3HG1 VAL 67 HG13 VAL 67 250.705 3.813 -8.435 530 1HG2 VAL 67 HG21 VAL 67 250.039 1.508 -6.551 531 2HG2 VAL 67 HG22 VAL 67 250.871 3.045 -6.318 532 3HG2 VAL 67 HG23 VAL 67 251.671 1.535 -5.884 533 H GLY 68 HN GLY 68 251.069 -0.452 -6.158 534 1HA GLY 68 HA2 GLY 68 253.564 -2.027 -6.188 535 2HA GLY 68 HA1 GLY 68 253.185 -0.990 -4.824 536 H GLN 69 HN GLN 69 253.473 -4.014 -5.383 537 HA GLN 69 HA GLN 69 250.940 -4.866 -4.149 538 1HB GLN 69 HB2 GLN 69 251.502 -6.023 -6.239 539 2HB GLN 69 HB1 GLN 69 253.054 -6.504 -5.566 540 1HG GLN 69 HG2 GLN 69 252.169 -8.201 -4.406 541 2HG GLN 69 HG1 GLN 69 250.730 -7.284 -3.961 542 1HE2 GLN 69 HE21 GLN 69 251.152 -10.046 -5.026 543 2HE2 GLN 69 HE22 GLN 69 250.110 -10.151 -6.401 544 H ILE 70 HN ILE 70 251.040 -5.032 -2.001 545 HA ILE 70 HA ILE 70 253.628 -5.704 -0.776 546 HB ILE 70 HB ILE 70 251.214 -4.438 0.518 547 1HG1 ILE 70 HG12 ILE 70 253.792 -3.002 0.063 548 2HG1 ILE 70 HG11 ILE 70 252.674 -3.172 -1.288 549 1HG2 ILE 70 HG21 ILE 70 254.019 -4.826 1.552 550 2HG2 ILE 70 HG22 ILE 70 252.590 -5.717 2.079 551 3HG2 ILE 70 HG23 ILE 70 252.712 -3.985 2.388 552 1HD1 ILE 70 HD11 ILE 70 252.057 -1.148 -0.407 553 2HD1 ILE 70 HD12 ILE 70 252.355 -1.658 1.255 554 3HD1 ILE 70 HD13 ILE 70 250.929 -2.240 0.397 555 H VAL 71 HN VAL 71 253.759 -7.206 0.880 556 HA VAL 71 HA VAL 71 251.475 -9.042 1.148 557 HB VAL 71 HB VAL 71 254.367 -9.899 1.073 558 1HG1 VAL 71 HG11 VAL 71 251.838 -11.516 0.855 559 2HG1 VAL 71 HG12 VAL 71 252.783 -11.325 2.332 560 3HG1 VAL 71 HG13 VAL 71 253.489 -12.130 0.931 561 1HG2 VAL 71 HG21 VAL 71 253.688 -9.005 -1.108 562 2HG2 VAL 71 HG22 VAL 71 252.307 -10.102 -1.119 563 3HG2 VAL 71 HG23 VAL 71 253.947 -10.749 -1.166 564 H PHE 72 HN PHE 72 251.226 -10.026 3.178 565 HA PHE 72 HA PHE 72 252.945 -8.962 5.313 566 1HB PHE 72 HB2 PHE 72 249.936 -9.211 5.320 567 2HB PHE 72 HB1 PHE 72 250.898 -8.849 6.748 568 HD1 PHE 72 HD1 PHE 72 250.588 -7.614 3.235 569 HD2 PHE 72 HD2 PHE 72 250.998 -6.650 7.359 570 HE1 PHE 72 HE1 PHE 72 250.510 -5.220 2.679 571 HE2 PHE 72 HE2 PHE 72 250.918 -4.254 6.811 572 HZ PHE 72 HZ PHE 72 250.673 -3.535 4.469 573 H GLU 73 HN GLU 73 253.938 -10.532 6.358 574 HA GLU 73 HA GLU 73 252.754 -13.214 6.386 575 1HB GLU 73 HB2 GLU 73 255.044 -13.077 5.552 576 2HB GLU 73 HB1 GLU 73 255.559 -12.282 7.034 577 1HG GLU 73 HG2 GLU 73 255.704 -14.207 8.166 578 2HG GLU 73 HG1 GLU 73 254.244 -14.868 7.432 579 H PHE 74 HN PHE 74 251.898 -14.036 8.194 580 HA PHE 74 HA PHE 74 251.892 -12.420 10.589 581 1HB PHE 74 HB2 PHE 74 250.614 -15.104 10.040 582 2HB PHE 74 HB1 PHE 74 250.321 -14.100 11.456 583 HD1 PHE 74 HD1 PHE 74 248.908 -15.092 8.523 584 HD2 PHE 74 HD2 PHE 74 249.778 -11.518 10.664 585 HE1 PHE 74 HE1 PHE 74 247.098 -13.937 7.322 586 HE2 PHE 74 HE2 PHE 74 247.969 -10.356 9.468 587 HZ PHE 74 HZ PHE 74 246.626 -11.566 7.794 588 H VAL 75 HN VAL 75 252.994 -12.757 12.421 589 HA VAL 75 HA VAL 75 255.232 -14.493 12.400 590 HB VAL 75 HB VAL 75 254.457 -12.269 13.881 591 1HG1 VAL 75 HG11 VAL 75 254.705 -12.893 16.215 592 2HG1 VAL 75 HG12 VAL 75 254.810 -14.596 15.766 593 3HG1 VAL 75 HG13 VAL 75 253.311 -13.704 15.502 594 1HG2 VAL 75 HG21 VAL 75 256.676 -12.422 13.308 595 2HG2 VAL 75 HG22 VAL 75 256.819 -14.088 13.867 596 3HG2 VAL 75 HG23 VAL 75 256.739 -12.769 15.036 597 H GLY 76 HN GLY 76 255.420 -16.548 12.994 598 1HA GLY 76 HA2 GLY 76 254.939 -18.604 13.892 599 2HA GLY 76 HA1 GLY 76 254.043 -17.750 15.138 600 H GLU 77 HN GLU 77 253.107 -17.244 11.851 601 HA GLU 77 HA GLU 77 250.913 -19.176 12.148 602 1HB GLU 77 HB2 GLU 77 250.754 -16.239 11.664 603 2HB GLU 77 HB1 GLU 77 249.599 -17.272 10.834 604 1HG GLU 77 HG2 GLU 77 249.122 -18.264 13.149 605 2HG GLU 77 HG1 GLU 77 249.960 -16.845 13.774 606 HA PRO 78 HA PRO 78 252.098 -20.311 8.034 607 1HB PRO 78 HB2 PRO 78 249.905 -21.702 7.292 608 2HB PRO 78 HB1 PRO 78 251.059 -22.319 8.480 609 1HG PRO 78 HG2 PRO 78 248.414 -20.989 8.923 610 2HG PRO 78 HG1 PRO 78 249.098 -22.412 9.728 611 1HD PRO 78 HD2 PRO 78 249.128 -19.927 10.832 612 2HD PRO 78 HD1 PRO 78 250.380 -21.143 11.155 613 H GLU 79 HN GLU 79 248.775 -19.086 8.420 614 HA GLU 79 HA GLU 79 248.343 -18.367 5.760 615 1HB GLU 79 HB2 GLU 79 246.893 -18.266 8.110 616 2HB GLU 79 HB1 GLU 79 247.081 -16.569 7.685 617 1HG GLU 79 HG2 GLU 79 246.177 -17.064 5.448 618 2HG GLU 79 HG1 GLU 79 245.917 -18.734 5.952 619 H LEU 80 HN LEU 80 247.976 -16.044 5.053 620 HA LEU 80 HA LEU 80 249.864 -14.124 6.152 621 1HB LEU 80 HB2 LEU 80 250.053 -14.437 3.215 622 2HB LEU 80 HB1 LEU 80 251.281 -13.973 4.375 623 HG LEU 80 HG LEU 80 250.338 -16.808 4.291 624 1HD1 LEU 80 HD11 LEU 80 251.893 -15.393 2.217 625 2HD1 LEU 80 HD12 LEU 80 250.869 -16.823 2.094 626 3HD1 LEU 80 HD13 LEU 80 252.505 -16.962 2.736 627 1HD2 LEU 80 HD21 LEU 80 251.990 -15.626 5.978 628 2HD2 LEU 80 HD22 LEU 80 253.150 -15.921 4.683 629 3HD2 LEU 80 HD23 LEU 80 252.279 -17.271 5.409 630 H MET 81 HN MET 81 249.811 -12.255 4.138 631 HA MET 81 HA MET 81 247.033 -11.845 3.397 632 1HB MET 81 HB2 MET 81 248.020 -10.698 5.731 633 2HB MET 81 HB1 MET 81 248.120 -9.402 4.547 634 1HG MET 81 HG2 MET 81 245.731 -9.791 4.005 635 2HG MET 81 HG1 MET 81 245.669 -10.963 5.320 636 1HE MET 81 HE1 MET 81 246.998 -7.652 4.371 637 2HE MET 81 HE2 MET 81 247.633 -7.204 5.954 638 3HE MET 81 HE3 MET 81 246.125 -6.495 5.376 639 H ASP 82 HN ASP 82 247.192 -11.477 1.278 640 HA ASP 82 HA ASP 82 249.462 -9.894 0.287 641 1HB ASP 82 HB2 ASP 82 249.176 -12.102 -0.750 642 2HB ASP 82 HB1 ASP 82 247.528 -11.683 -1.211 643 H VAL 83 HN VAL 83 248.898 -7.777 0.391 644 HA VAL 83 HA VAL 83 246.256 -7.023 -0.679 645 HB VAL 83 HB VAL 83 246.598 -6.411 1.679 646 1HG1 VAL 83 HG11 VAL 83 248.509 -4.265 1.082 647 2HG1 VAL 83 HG12 VAL 83 249.175 -5.897 1.000 648 3HG1 VAL 83 HG13 VAL 83 248.399 -5.335 2.480 649 1HG2 VAL 83 HG21 VAL 83 246.664 -3.782 0.327 650 2HG2 VAL 83 HG22 VAL 83 245.491 -4.445 1.465 651 3HG2 VAL 83 HG23 VAL 83 245.448 -4.931 -0.230 652 H HIS 84 HN HIS 84 246.289 -6.205 -2.628 653 HA HIS 84 HA HIS 84 248.699 -5.154 -3.807 654 1HB HIS 84 HB2 HIS 84 246.826 -6.460 -5.006 655 2HB HIS 84 HB1 HIS 84 245.927 -4.947 -4.981 656 HD1 HIS 84 HD1 HIS 84 249.548 -4.558 -5.500 657 HD2 HIS 84 HD2 HIS 84 246.158 -5.056 -7.848 658 HE1 HIS 84 HE1 HIS 84 250.250 -3.935 -7.832 659 HE2 HIS 84 HE2 HIS 84 248.219 -4.381 -9.255 660 H VAL 85 HN VAL 85 249.028 -2.963 -4.447 661 HA VAL 85 HA VAL 85 247.325 -1.083 -2.946 662 HB VAL 85 HB VAL 85 250.169 -0.570 -3.814 663 1HG1 VAL 85 HG11 VAL 85 249.475 1.502 -3.298 664 2HG1 VAL 85 HG12 VAL 85 249.670 0.960 -1.631 665 3HG1 VAL 85 HG13 VAL 85 248.079 0.920 -2.391 666 1HG2 VAL 85 HG21 VAL 85 250.195 -0.878 -1.072 667 2HG2 VAL 85 HG22 VAL 85 250.789 -2.047 -2.252 668 3HG2 VAL 85 HG23 VAL 85 249.150 -2.191 -1.618 669 H PHE 86 HN PHE 86 245.906 -0.321 -4.335 670 HA PHE 86 HA PHE 86 246.725 0.417 -7.044 671 1HB PHE 86 HB2 PHE 86 244.208 -0.388 -5.718 672 2HB PHE 86 HB1 PHE 86 244.028 0.914 -6.886 673 HD1 PHE 86 HD1 PHE 86 244.288 -2.593 -6.419 674 HD2 PHE 86 HD2 PHE 86 244.988 0.518 -9.236 675 HE1 PHE 86 HE1 PHE 86 244.258 -4.245 -8.243 676 HE2 PHE 86 HE2 PHE 86 244.959 -1.126 -11.066 677 HZ PHE 86 HZ PHE 86 244.593 -3.512 -10.570 678 H CYS 87 HN CYS 87 246.267 2.480 -7.886 679 HA CYS 87 HA CYS 87 245.508 4.568 -5.972 680 1HB CYS 87 HB2 CYS 87 248.029 4.457 -7.616 681 2HB CYS 87 HB1 CYS 87 247.323 6.005 -7.163 682 HG CYS 87 HG CYS 87 248.872 4.147 -5.327 683 H THR 88 HN THR 88 243.785 5.566 -6.857 684 HA THR 88 HA THR 88 243.465 5.447 -9.758 685 HB THR 88 HB THR 88 241.639 4.686 -8.199 686 HG1 THR 88 HG1 THR 88 241.037 5.119 -10.266 687 1HG2 THR 88 HG21 THR 88 240.735 5.982 -6.685 688 2HG2 THR 88 HG22 THR 88 240.439 7.248 -7.879 689 3HG2 THR 88 HG23 THR 88 241.984 7.179 -7.030 690 H ASP 89 HN ASP 89 241.843 7.502 -10.298 691 HA ASP 89 HA ASP 89 242.807 10.013 -9.311 692 1HB ASP 89 HB2 ASP 89 244.634 9.367 -10.880 693 2HB ASP 89 HB1 ASP 89 243.446 9.266 -12.177 694 H SER 90 HN SER 90 241.145 8.269 -11.878 695 HA SER 90 HA SER 90 239.275 10.444 -12.298 696 1HB SER 90 HB2 SER 90 240.257 8.489 -13.957 697 2HB SER 90 HB1 SER 90 238.679 7.830 -13.528 698 HG SER 90 HG SER 90 237.915 9.172 -14.941 699 H ILE 91 HN ILE 91 237.957 10.664 -10.548 700 HA ILE 91 HA ILE 91 236.661 8.250 -9.487 701 HB ILE 91 HB ILE 91 236.002 9.583 -7.559 702 1HG1 ILE 91 HG12 ILE 91 237.554 11.881 -8.764 703 2HG1 ILE 91 HG11 ILE 91 235.800 11.749 -8.854 704 1HG2 ILE 91 HG21 ILE 91 238.463 8.641 -8.063 705 2HG2 ILE 91 HG22 ILE 91 238.005 9.397 -6.537 706 3HG2 ILE 91 HG23 ILE 91 238.847 10.337 -7.769 707 1HD1 ILE 91 HD11 ILE 91 237.098 11.575 -6.186 708 2HD1 ILE 91 HD12 ILE 91 235.514 12.208 -6.637 709 3HD1 ILE 91 HD13 ILE 91 236.967 13.149 -6.971 710 H GLN 92 HN GLN 92 234.326 8.755 -8.653 711 HA GLN 92 HA GLN 92 232.894 10.190 -10.791 712 1HB GLN 92 HB2 GLN 92 232.327 7.499 -9.580 713 2HB GLN 92 HB1 GLN 92 231.083 8.417 -10.418 714 1HG GLN 92 HG2 GLN 92 232.814 8.519 -12.344 715 2HG GLN 92 HG1 GLN 92 233.562 7.161 -11.506 716 1HE2 GLN 92 HE21 GLN 92 232.643 5.179 -11.619 717 2HE2 GLN 92 HE22 GLN 92 231.233 4.818 -12.549 718 H GLY 93 HN GLY 93 231.963 8.570 -7.766 719 1HA GLY 93 HA2 GLY 93 229.990 10.521 -7.160 720 2HA GLY 93 HA1 GLY 93 230.555 9.253 -6.085 721 H THR 94 HN THR 94 230.336 10.827 -4.399 722 HA THR 94 HA THR 94 232.294 12.983 -4.365 723 HB THR 94 HB THR 94 230.683 12.696 -1.980 724 HG1 THR 94 HG1 THR 94 228.908 12.099 -2.895 725 1HG2 THR 94 HG21 THR 94 231.576 14.789 -3.715 726 2HG2 THR 94 HG22 THR 94 230.972 14.887 -2.061 727 3HG2 THR 94 HG23 THR 94 229.846 14.944 -3.416 728 HA PRO 95 HA PRO 95 234.764 10.848 -1.386 729 1HB PRO 95 HB2 PRO 95 235.579 12.865 0.272 730 2HB PRO 95 HB1 PRO 95 236.192 12.649 -1.366 731 1HG PRO 95 HG2 PRO 95 234.484 14.741 -0.319 732 2HG PRO 95 HG1 PRO 95 235.278 14.639 -1.897 733 1HD PRO 95 HD2 PRO 95 232.515 14.048 -1.172 734 2HD PRO 95 HD1 PRO 95 233.232 14.253 -2.781 735 H VAL 96 HN VAL 96 232.198 10.372 -0.847 736 HA VAL 96 HA VAL 96 231.459 11.192 1.796 737 HB VAL 96 HB VAL 96 230.311 8.981 0.094 738 1HG1 VAL 96 HG11 VAL 96 229.550 8.331 2.132 739 2HG1 VAL 96 HG12 VAL 96 228.350 9.586 1.821 740 3HG1 VAL 96 HG13 VAL 96 229.746 9.934 2.840 741 1HG2 VAL 96 HG21 VAL 96 229.879 11.883 0.225 742 2HG2 VAL 96 HG22 VAL 96 228.411 10.906 0.243 743 3HG2 VAL 96 HG23 VAL 96 229.562 10.744 -1.082 744 H GLU 97 HN GLU 97 233.266 10.576 2.990 745 HA GLU 97 HA GLU 97 234.196 7.925 3.217 746 1HB GLU 97 HB2 GLU 97 234.487 10.441 4.716 747 2HB GLU 97 HB1 GLU 97 234.717 8.993 5.674 748 1HG GLU 97 HG2 GLU 97 236.230 9.790 3.208 749 2HG GLU 97 HG1 GLU 97 236.839 9.705 4.860 750 H SER 98 HN SER 98 233.740 8.102 6.280 751 HA SER 98 HA SER 98 230.995 7.089 6.340 752 1HB SER 98 HB2 SER 98 232.637 5.195 6.229 753 2HB SER 98 HB1 SER 98 233.309 5.752 7.761 754 HG SER 98 HG SER 98 231.823 4.255 8.318 755 H ASP 99 HN ASP 99 230.558 6.540 8.864 756 HA ASP 99 HA ASP 99 230.444 9.059 10.138 757 1HB ASP 99 HB2 ASP 99 230.050 6.339 11.403 758 2HB ASP 99 HB1 ASP 99 229.449 7.880 12.009 759 H GLU 100 HN GLU 100 232.831 6.583 10.096 760 HA GLU 100 HA GLU 100 234.283 7.952 12.265 761 1HB GLU 100 HB2 GLU 100 234.617 5.048 11.517 762 2HB GLU 100 HB1 GLU 100 235.270 5.876 12.924 763 1HG GLU 100 HG2 GLU 100 233.395 5.608 14.101 764 2HG GLU 100 HG1 GLU 100 232.361 6.010 12.730 765 H MET 101 HN MET 101 234.235 8.224 9.228 766 HA MET 101 HA MET 101 237.141 8.204 8.906 767 1HB MET 101 HB2 MET 101 235.719 6.229 7.757 768 2HB MET 101 HB1 MET 101 235.565 7.454 6.508 769 1HG MET 101 HG2 MET 101 237.451 6.435 5.788 770 2HG MET 101 HG1 MET 101 238.173 7.635 6.859 771 1HE MET 101 HE1 MET 101 240.209 6.886 7.716 772 2HE MET 101 HE2 MET 101 240.388 5.617 8.927 773 3HE MET 101 HE3 MET 101 239.336 6.997 9.244 774 H ARG 102 HN ARG 102 237.944 9.779 7.493 775 HA ARG 102 HA ARG 102 236.065 11.612 6.233 776 1HB ARG 102 HB2 ARG 102 236.353 12.490 8.520 777 2HB ARG 102 HB1 ARG 102 238.096 12.520 8.288 778 1HG ARG 102 HG2 ARG 102 237.721 14.669 7.762 779 2HG ARG 102 HG1 ARG 102 237.314 14.002 6.179 780 1HD ARG 102 HD2 ARG 102 234.945 13.896 6.878 781 2HD ARG 102 HD1 ARG 102 235.387 14.663 8.404 782 HE ARG 102 HE ARG 102 236.241 16.204 6.168 783 1HH1 ARG 102 HH11 ARG 102 233.443 15.409 8.097 784 2HH1 ARG 102 HH12 ARG 102 232.626 16.897 7.751 785 1HH2 ARG 102 HH21 ARG 102 235.168 18.161 5.712 786 2HH2 ARG 102 HH22 ARG 102 233.605 18.459 6.395 787 HA PRO 103 HA PRO 103 239.565 11.431 3.459 788 1HB PRO 103 HB2 PRO 103 238.442 12.543 1.325 789 2HB PRO 103 HB1 PRO 103 237.891 10.969 1.913 790 1HG PRO 103 HG2 PRO 103 236.654 13.666 2.265 791 2HG PRO 103 HG1 PRO 103 235.878 12.107 1.943 792 1HD PRO 103 HD2 PRO 103 236.104 13.298 4.450 793 2HD PRO 103 HD1 PRO 103 235.776 11.584 4.157 794 H CYS 104 HN CYS 104 241.198 12.766 2.825 795 HA CYS 104 HA CYS 104 240.773 15.658 3.019 796 1HB CYS 104 HB2 CYS 104 242.370 14.045 4.806 797 2HB CYS 104 HB1 CYS 104 243.383 15.211 3.961 798 HG CYS 104 HG CYS 104 241.033 16.664 5.069 799 H TRP 105 HN TRP 105 241.350 16.576 1.197 800 HA TRP 105 HA TRP 105 243.159 15.196 -0.623 801 1HB TRP 105 HB2 TRP 105 241.511 17.706 -1.014 802 2HB TRP 105 HB1 TRP 105 242.441 16.890 -2.266 803 HD1 TRP 105 HD1 TRP 105 239.772 15.594 0.266 804 HE1 TRP 105 HE1 TRP 105 238.033 14.215 -1.060 805 HE3 TRP 105 HE3 TRP 105 241.728 16.134 -4.425 806 HZ2 TRP 105 HZ2 TRP 105 237.575 13.461 -3.740 807 HZ3 TRP 105 HZ3 TRP 105 240.582 15.053 -6.314 808 HH2 TRP 105 HH2 TRP 105 238.551 13.743 -5.977 809 H PHE 106 HN PHE 106 245.260 15.540 -0.136 810 HA PHE 106 HA PHE 106 246.101 18.317 0.394 811 1HB PHE 106 HB2 PHE 106 247.277 15.727 1.425 812 2HB PHE 106 HB1 PHE 106 248.026 17.303 1.642 813 HD1 PHE 106 HD1 PHE 106 245.643 18.960 2.233 814 HD2 PHE 106 HD2 PHE 106 246.740 15.078 3.587 815 HE1 PHE 106 HE1 PHE 106 244.329 19.309 4.282 816 HE2 PHE 106 HE2 PHE 106 245.426 15.419 5.640 817 HZ PHE 106 HZ PHE 106 244.218 17.537 5.989 818 H GLN 107 HN GLN 107 248.852 17.929 0.173 819 HA GLN 107 HA GLN 107 249.098 17.740 -2.713 820 1HB GLN 107 HB2 GLN 107 251.033 18.620 -0.567 821 2HB GLN 107 HB1 GLN 107 251.419 18.590 -2.283 822 1HG GLN 107 HG2 GLN 107 250.832 20.786 -1.957 823 2HG GLN 107 HG1 GLN 107 249.318 20.083 -2.527 824 1HE2 GLN 107 HE21 GLN 107 248.383 21.982 -1.499 825 2HE2 GLN 107 HE22 GLN 107 248.039 21.935 0.193 826 H LEU 108 HN LEU 108 250.639 16.450 -3.772 827 HA LEU 108 HA LEU 108 250.891 13.817 -2.733 828 1HB LEU 108 HB2 LEU 108 251.830 13.238 -4.807 829 2HB LEU 108 HB1 LEU 108 250.669 14.501 -5.168 830 HG LEU 108 HG LEU 108 253.666 14.837 -5.002 831 1HD1 LEU 108 HD11 LEU 108 252.964 15.573 -7.493 832 2HD1 LEU 108 HD12 LEU 108 251.767 14.313 -7.189 833 3HD1 LEU 108 HD13 LEU 108 253.486 13.944 -7.061 834 1HD2 LEU 108 HD21 LEU 108 253.234 17.116 -5.817 835 2HD2 LEU 108 HD22 LEU 108 252.537 16.839 -4.221 836 3HD2 LEU 108 HD23 LEU 108 251.502 16.836 -5.649 837 H ASP 109 HN ASP 109 252.690 16.546 -2.098 838 HA ASP 109 HA ASP 109 255.072 14.944 -1.454 839 1HB ASP 109 HB2 ASP 109 254.747 17.725 -2.470 840 2HB ASP 109 HB1 ASP 109 256.056 17.425 -1.331 841 H GLN 110 HN GLN 110 252.480 15.576 0.037 842 HA GLN 110 HA GLN 110 253.797 16.301 2.536 843 1HB GLN 110 HB2 GLN 110 251.355 17.639 1.392 844 2HB GLN 110 HB1 GLN 110 251.716 17.671 3.113 845 1HG GLN 110 HG2 GLN 110 254.081 18.486 2.077 846 2HG GLN 110 HG1 GLN 110 252.948 19.137 0.893 847 1HE2 GLN 110 HE21 GLN 110 251.981 20.993 1.341 848 2HE2 GLN 110 HE22 GLN 110 251.950 21.766 2.885 849 H ILE 111 HN ILE 111 252.559 13.855 1.189 850 HA ILE 111 HA ILE 111 250.267 13.220 2.804 851 HB ILE 111 HB ILE 111 251.658 10.842 1.918 852 1HG1 ILE 111 HG12 ILE 111 250.884 11.527 -0.576 853 2HG1 ILE 111 HG11 ILE 111 251.498 13.076 -0.007 854 1HG2 ILE 111 HG21 ILE 111 249.534 10.344 0.880 855 2HG2 ILE 111 HG22 ILE 111 248.989 11.995 1.183 856 3HG2 ILE 111 HG23 ILE 111 249.330 10.918 2.534 857 1HD1 ILE 111 HD11 ILE 111 252.968 10.461 -0.081 858 2HD1 ILE 111 HD12 ILE 111 253.598 11.940 0.641 859 3HD1 ILE 111 HD13 ILE 111 253.262 11.874 -1.090 860 HA PRO 112 HA PRO 112 252.780 11.922 6.245 861 1HB PRO 112 HB2 PRO 112 250.888 11.947 8.105 862 2HB PRO 112 HB1 PRO 112 251.377 13.455 7.320 863 1HG PRO 112 HG2 PRO 112 248.946 11.784 6.865 864 2HG PRO 112 HG1 PRO 112 249.119 13.547 6.823 865 1HD PRO 112 HD2 PRO 112 249.132 11.793 4.610 866 2HD PRO 112 HD1 PRO 112 249.569 13.513 4.603 867 H PHE 113 HN PHE 113 253.374 9.823 5.692 868 HA PHE 113 HA PHE 113 251.450 7.686 5.959 869 1HB PHE 113 HB2 PHE 113 254.209 6.783 5.849 870 2HB PHE 113 HB1 PHE 113 252.864 6.424 4.785 871 HD1 PHE 113 HD1 PHE 113 255.918 7.014 4.335 872 HD2 PHE 113 HD2 PHE 113 252.329 9.239 3.786 873 HE1 PHE 113 HE1 PHE 113 257.001 8.299 2.551 874 HE2 PHE 113 HE2 PHE 113 253.413 10.532 2.007 875 HZ PHE 113 HZ PHE 113 255.750 10.073 1.379 876 H LYS 114 HN LYS 114 253.617 9.332 8.021 877 HA LYS 114 HA LYS 114 254.232 7.266 9.842 878 1HB LYS 114 HB2 LYS 114 255.106 9.788 9.572 879 2HB LYS 114 HB1 LYS 114 253.914 10.053 10.837 880 1HG LYS 114 HG2 LYS 114 255.609 9.564 12.213 881 2HG LYS 114 HG1 LYS 114 255.218 7.891 11.813 882 1HD LYS 114 HD2 LYS 114 256.981 9.155 9.862 883 2HD LYS 114 HD1 LYS 114 257.669 9.099 11.487 884 1HE LYS 114 HE2 LYS 114 258.355 7.081 10.584 885 2HE LYS 114 HE1 LYS 114 256.895 6.629 11.464 886 1HZ LYS 114 HZ1 LYS 114 257.377 6.018 8.896 887 2HZ LYS 114 HZ2 LYS 114 256.450 7.421 8.722 888 3HZ LYS 114 HZ3 LYS 114 255.832 6.102 9.582 889 H ASP 115 HN ASP 115 251.539 9.414 9.380 890 HA ASP 115 HA ASP 115 250.232 8.329 11.750 891 1HB ASP 115 HB2 ASP 115 249.831 10.812 10.127 892 2HB ASP 115 HB1 ASP 115 248.481 10.165 11.055 893 H MET 116 HN MET 116 250.653 6.817 9.317 894 HA MET 116 HA MET 116 247.851 6.324 8.590 895 1HB MET 116 HB2 MET 116 249.704 7.302 6.851 896 2HB MET 116 HB1 MET 116 249.874 5.575 6.585 897 1HG MET 116 HG2 MET 116 247.178 5.865 6.561 898 2HG MET 116 HG1 MET 116 247.702 7.391 5.858 899 1HE MET 116 HE1 MET 116 249.408 7.234 3.284 900 2HE MET 116 HE2 MET 116 250.259 5.692 3.236 901 3HE MET 116 HE3 MET 116 250.306 6.677 4.695 902 H TRP 117 HN TRP 117 250.962 4.683 7.979 903 HA TRP 117 HA TRP 117 250.312 2.497 9.705 904 1HB TRP 117 HB2 TRP 117 249.281 2.381 7.079 905 2HB TRP 117 HB1 TRP 117 250.649 1.277 7.113 906 HD1 TRP 117 HD1 TRP 117 249.283 1.178 10.490 907 HE1 TRP 117 HE1 TRP 117 247.682 -0.810 10.797 908 HE3 TRP 117 HE3 TRP 117 248.562 -0.051 5.578 909 HZ2 TRP 117 HZ2 TRP 117 246.295 -2.656 9.175 910 HZ3 TRP 117 HZ3 TRP 117 247.083 -1.943 5.043 911 HH2 TRP 117 HH2 TRP 117 245.974 -3.217 6.805 912 HA PRO 118 HA PRO 118 254.668 1.866 9.323 913 1HB PRO 118 HB2 PRO 118 254.985 -0.686 10.031 914 2HB PRO 118 HB1 PRO 118 254.336 0.508 11.159 915 1HG PRO 118 HG2 PRO 118 252.912 -1.594 9.598 916 2HG PRO 118 HG1 PRO 118 252.596 -1.002 11.236 917 1HD PRO 118 HD2 PRO 118 251.230 -0.235 8.923 918 2HD PRO 118 HD1 PRO 118 251.204 0.620 10.478 919 H ASP 119 HN ASP 119 252.855 0.946 6.849 920 HA ASP 119 HA ASP 119 255.087 -0.406 5.481 921 1HB ASP 119 HB2 ASP 119 253.231 -1.433 4.020 922 2HB ASP 119 HB1 ASP 119 253.466 -2.096 5.633 923 H ASP 120 HN ASP 120 252.705 2.084 5.443 924 HA ASP 120 HA ASP 120 252.421 2.758 2.803 925 1HB ASP 120 HB2 ASP 120 252.666 4.572 5.186 926 2HB ASP 120 HB1 ASP 120 252.049 5.062 3.609 927 H SER 121 HN SER 121 254.954 4.012 4.972 928 HA SER 121 HA SER 121 256.293 5.582 3.103 929 1HB SER 121 HB2 SER 121 256.643 5.528 5.611 930 2HB SER 121 HB1 SER 121 257.640 4.094 5.361 931 HG SER 121 HG SER 121 258.078 6.708 4.357 932 H TYR 122 HN TYR 122 256.144 2.155 3.280 933 HA TYR 122 HA TYR 122 258.668 1.723 1.956 934 1HB TYR 122 HB2 TYR 122 256.457 -0.067 2.906 935 2HB TYR 122 HB1 TYR 122 257.689 -0.682 1.811 936 HD1 TYR 122 HD1 TYR 122 256.879 -1.071 4.958 937 HD2 TYR 122 HD2 TYR 122 260.113 0.648 2.794 938 HE1 TYR 122 HE1 TYR 122 258.367 -1.469 6.876 939 HE2 TYR 122 HE2 TYR 122 261.610 0.254 4.704 940 HH TYR 122 HH TYR 122 260.675 -1.678 7.406 941 H TRP 123 HN TRP 123 255.264 1.911 1.043 942 HA TRP 123 HA TRP 123 256.081 1.284 -1.702 943 1HB TRP 123 HB2 TRP 123 253.742 0.765 -2.188 944 2HB TRP 123 HB1 TRP 123 254.373 -0.220 -0.877 945 HD1 TRP 123 HD1 TRP 123 253.377 0.225 1.581 946 HE1 TRP 123 HE1 TRP 123 251.153 1.280 2.340 947 HE3 TRP 123 HE3 TRP 123 252.074 2.598 -2.759 948 HZ2 TRP 123 HZ2 TRP 123 249.112 2.916 1.241 949 HZ3 TRP 123 HZ3 TRP 123 249.968 3.873 -2.814 950 HH2 TRP 123 HH2 TRP 123 248.528 4.015 -0.864 951 H PHE 124 HN PHE 124 255.462 3.931 0.166 952 HA PHE 124 HA PHE 124 253.953 5.483 -1.715 953 1HB PHE 124 HB2 PHE 124 255.135 5.890 0.944 954 2HB PHE 124 HB1 PHE 124 255.173 7.320 -0.081 955 HD1 PHE 124 HD1 PHE 124 253.456 8.770 0.352 956 HD2 PHE 124 HD2 PHE 124 252.705 4.590 0.577 957 HE1 PHE 124 HE1 PHE 124 251.124 9.233 0.924 958 HE2 PHE 124 HE2 PHE 124 250.356 5.050 1.147 959 HZ PHE 124 HZ PHE 124 249.563 7.372 1.323 960 HA PRO 125 HA PRO 125 258.485 7.490 -2.253 961 1HB PRO 125 HB2 PRO 125 259.887 4.868 -1.973 962 2HB PRO 125 HB1 PRO 125 260.443 6.493 -1.554 963 1HG PRO 125 HG2 PRO 125 259.627 4.819 0.342 964 2HG PRO 125 HG1 PRO 125 259.224 6.544 0.420 965 1HD PRO 125 HD2 PRO 125 257.499 4.224 -0.306 966 2HD PRO 125 HD1 PRO 125 257.078 5.723 0.544 967 H LEU 126 HN LEU 126 257.639 4.203 -3.281 968 HA LEU 126 HA LEU 126 258.890 4.514 -5.851 969 1HB LEU 126 HB2 LEU 126 257.396 2.398 -6.319 970 2HB LEU 126 HB1 LEU 126 258.858 2.286 -5.361 971 HG LEU 126 HG LEU 126 256.472 2.844 -3.761 972 1HD1 LEU 126 HD11 LEU 126 256.049 0.195 -4.062 973 2HD1 LEU 126 HD12 LEU 126 256.447 0.654 -5.718 974 3HD1 LEU 126 HD13 LEU 126 255.114 1.447 -4.879 975 1HD2 LEU 126 HD21 LEU 126 257.572 0.567 -2.809 976 2HD2 LEU 126 HD22 LEU 126 258.134 2.186 -2.393 977 3HD2 LEU 126 HD23 LEU 126 258.951 1.265 -3.657 978 H LEU 127 HN LEU 127 255.703 4.905 -4.490 979 HA LEU 127 HA LEU 127 254.191 5.055 -6.843 980 1HB LEU 127 HB2 LEU 127 253.863 6.485 -4.205 981 2HB LEU 127 HB1 LEU 127 252.664 6.508 -5.480 982 HG LEU 127 HG LEU 127 253.061 4.593 -3.403 983 1HD1 LEU 127 HD11 LEU 127 250.904 5.332 -3.790 984 2HD1 LEU 127 HD12 LEU 127 250.898 3.715 -4.494 985 3HD1 LEU 127 HD13 LEU 127 251.041 5.130 -5.536 986 1HD2 LEU 127 HD21 LEU 127 254.414 3.316 -4.959 987 2HD2 LEU 127 HD22 LEU 127 253.165 3.455 -6.196 988 3HD2 LEU 127 HD23 LEU 127 252.856 2.528 -4.728 989 H LEU 128 HN LEU 128 255.694 7.599 -4.902 990 HA LEU 128 HA LEU 128 255.102 9.765 -6.575 991 1HB LEU 128 HB2 LEU 128 257.039 9.222 -4.398 992 2HB LEU 128 HB1 LEU 128 257.403 10.580 -5.445 993 HG LEU 128 HG LEU 128 254.696 10.337 -4.182 994 1HD1 LEU 128 HD11 LEU 128 255.642 11.858 -2.381 995 2HD1 LEU 128 HD12 LEU 128 257.234 11.301 -2.898 996 3HD1 LEU 128 HD13 LEU 128 256.055 10.147 -2.274 997 1HD2 LEU 128 HD21 LEU 128 255.610 12.049 -6.019 998 2HD2 LEU 128 HD22 LEU 128 256.123 12.899 -4.562 999 3HD2 LEU 128 HD23 LEU 128 254.421 12.499 -4.798 1000 H GLN 129 HN GLN 129 257.574 7.326 -6.761 1001 HA GLN 129 HA GLN 129 259.116 8.748 -8.754 1002 1HB GLN 129 HB2 GLN 129 260.048 7.145 -6.987 1003 2HB GLN 129 HB1 GLN 129 259.426 5.850 -8.002 1004 1HG GLN 129 HG2 GLN 129 261.771 6.214 -8.439 1005 2HG GLN 129 HG1 GLN 129 260.812 6.643 -9.854 1006 1HE2 GLN 129 HE21 GLN 129 263.005 7.729 -7.468 1007 2HE2 GLN 129 HE22 GLN 129 263.149 9.362 -8.016 1008 H LYS 130 HN LYS 130 256.223 7.281 -8.916 1009 HA LYS 130 HA LYS 130 254.945 6.405 -10.561 1010 1HB LYS 130 HB2 LYS 130 255.142 7.401 -12.590 1011 2HB LYS 130 HB1 LYS 130 256.296 8.400 -11.724 1012 1HG LYS 130 HG2 LYS 130 257.903 6.391 -12.601 1013 2HG LYS 130 HG1 LYS 130 256.712 6.480 -13.899 1014 1HD LYS 130 HD2 LYS 130 258.489 7.953 -14.474 1015 2HD LYS 130 HD1 LYS 130 257.125 8.955 -13.974 1016 1HE LYS 130 HE2 LYS 130 258.231 8.890 -11.641 1017 2HE LYS 130 HE1 LYS 130 259.673 8.364 -12.511 1018 1HZ LYS 130 HZ1 LYS 130 258.297 10.954 -12.592 1019 2HZ LYS 130 HZ2 LYS 130 259.131 10.435 -13.970 1020 3HZ LYS 130 HZ3 LYS 130 259.953 10.618 -12.503 1021 H LYS 131 HN LYS 131 257.180 4.817 -9.335 1022 HA LYS 131 HA LYS 131 257.518 2.807 -11.459 1023 1HB LYS 131 HB2 LYS 131 259.073 2.934 -8.879 1024 2HB LYS 131 HB1 LYS 131 259.458 2.019 -10.330 1025 1HG LYS 131 HG2 LYS 131 259.460 4.498 -11.353 1026 2HG LYS 131 HG1 LYS 131 259.936 4.856 -9.692 1027 1HD LYS 131 HD2 LYS 131 261.993 4.462 -10.614 1028 2HD LYS 131 HD1 LYS 131 261.577 2.828 -10.094 1029 1HE LYS 131 HE2 LYS 131 260.469 2.847 -12.551 1030 2HE LYS 131 HE1 LYS 131 261.815 3.956 -12.808 1031 1HZ LYS 131 HZ1 LYS 131 262.135 1.268 -11.600 1032 2HZ LYS 131 HZ2 LYS 131 263.354 2.300 -12.155 1033 3HZ LYS 131 HZ3 LYS 131 262.303 1.565 -13.257 1034 H LYS 132 HN LYS 132 257.375 0.541 -10.812 1035 HA LYS 132 HA LYS 132 255.369 0.167 -8.690 1036 1HB LYS 132 HB2 LYS 132 255.899 -1.546 -11.124 1037 2HB LYS 132 HB1 LYS 132 254.658 -1.842 -9.914 1038 1HG LYS 132 HG2 LYS 132 253.285 -0.245 -10.731 1039 2HG LYS 132 HG1 LYS 132 254.616 0.805 -11.221 1040 1HD LYS 132 HD2 LYS 132 254.746 -0.107 -13.282 1041 2HD LYS 132 HD1 LYS 132 254.405 -1.734 -12.694 1042 1HE LYS 132 HE2 LYS 132 252.472 -1.370 -13.830 1043 2HE LYS 132 HE1 LYS 132 252.008 -0.660 -12.285 1044 1HZ LYS 132 HZ1 LYS 132 251.711 0.622 -14.553 1045 2HZ LYS 132 HZ2 LYS 132 253.307 1.085 -14.235 1046 3HZ LYS 132 HZ3 LYS 132 252.087 1.434 -13.116 1047 H PHE 133 HN PHE 133 255.924 -0.980 -6.957 1048 HA PHE 133 HA PHE 133 258.121 -2.920 -7.177 1049 1HB PHE 133 HB2 PHE 133 257.845 -0.673 -5.197 1050 2HB PHE 133 HB1 PHE 133 258.754 -2.124 -4.796 1051 HD1 PHE 133 HD1 PHE 133 258.499 0.348 -7.586 1052 HD2 PHE 133 HD2 PHE 133 261.012 -2.065 -5.141 1053 HE1 PHE 133 HE1 PHE 133 260.479 1.283 -8.706 1054 HE2 PHE 133 HE2 PHE 133 262.997 -1.133 -6.257 1055 HZ PHE 133 HZ PHE 133 262.732 0.544 -8.040 1056 H HIS 134 HN HIS 134 258.196 -4.421 -5.310 1057 HA HIS 134 HA HIS 134 255.530 -4.876 -4.144 1058 1HB HIS 134 HB2 HIS 134 255.821 -6.518 -5.886 1059 2HB HIS 134 HB1 HIS 134 257.439 -6.909 -5.316 1060 HD1 HIS 134 HD1 HIS 134 254.110 -8.156 -5.208 1061 HD2 HIS 134 HD2 HIS 134 257.261 -8.012 -2.503 1062 HE1 HIS 134 HE1 HIS 134 253.595 -9.909 -3.481 1063 HE2 HIS 134 HE2 HIS 134 255.566 -9.874 -1.913 1064 H GLY 135 HN GLY 135 255.549 -4.957 -1.967 1065 1HA GLY 135 HA2 GLY 135 258.141 -5.549 -0.677 1066 2HA GLY 135 HA1 GLY 135 257.041 -4.320 -0.078 1067 H TYR 136 HN TYR 136 258.221 -7.028 0.867 1068 HA TYR 136 HA TYR 136 255.685 -8.196 1.809 1069 1HB TYR 136 HB2 TYR 136 257.433 -9.576 0.429 1070 2HB TYR 136 HB1 TYR 136 258.320 -9.630 1.945 1071 HD1 TYR 136 HD1 TYR 136 255.659 -9.738 3.638 1072 HD2 TYR 136 HD2 TYR 136 257.169 -11.969 0.346 1073 HE1 TYR 136 HE1 TYR 136 254.322 -11.674 4.340 1074 HE2 TYR 136 HE2 TYR 136 255.832 -13.910 1.041 1075 HH TYR 136 HH TYR 136 254.807 -14.621 3.591 1076 H PHE 137 HN PHE 137 255.230 -7.454 3.786 1077 HA PHE 137 HA PHE 137 257.459 -6.999 5.656 1078 1HB PHE 137 HB2 PHE 137 254.694 -5.853 5.964 1079 2HB PHE 137 HB1 PHE 137 256.197 -5.303 6.696 1080 HD1 PHE 137 HD1 PHE 137 253.846 -4.266 4.552 1081 HD2 PHE 137 HD2 PHE 137 258.044 -4.959 4.584 1082 HE1 PHE 137 HE1 PHE 137 254.127 -2.635 2.731 1083 HE2 PHE 137 HE2 PHE 137 258.333 -3.331 2.764 1084 HZ PHE 137 HZ PHE 137 256.372 -2.166 1.835 1085 H LYS 138 HN LYS 138 257.624 -8.273 7.379 1086 HA LYS 138 HA LYS 138 255.509 -10.167 8.002 1087 1HB LYS 138 HB2 LYS 138 258.224 -10.408 7.987 1088 2HB LYS 138 HB1 LYS 138 257.926 -10.104 9.693 1089 1HG LYS 138 HG2 LYS 138 256.038 -11.986 9.129 1090 2HG LYS 138 HG1 LYS 138 257.366 -12.473 8.073 1091 1HD LYS 138 HD2 LYS 138 258.724 -13.019 9.809 1092 2HD LYS 138 HD1 LYS 138 258.076 -11.753 10.853 1093 1HE LYS 138 HE2 LYS 138 256.224 -13.047 11.465 1094 2HE LYS 138 HE1 LYS 138 256.446 -14.160 10.115 1095 1HZ LYS 138 HZ1 LYS 138 258.462 -14.977 11.168 1096 2HZ LYS 138 HZ2 LYS 138 257.135 -15.155 12.202 1097 3HZ LYS 138 HZ3 LYS 138 258.248 -13.909 12.463 1098 H PHE 139 HN PHE 139 254.126 -9.920 9.692 1099 HA PHE 139 HA PHE 139 254.684 -7.681 11.528 1100 1HB PHE 139 HB2 PHE 139 252.145 -8.742 10.341 1101 2HB PHE 139 HB1 PHE 139 252.092 -7.901 11.886 1102 HD1 PHE 139 HD1 PHE 139 251.926 -5.598 11.933 1103 HD2 PHE 139 HD2 PHE 139 253.317 -7.509 8.395 1104 HE1 PHE 139 HE1 PHE 139 251.874 -3.440 10.752 1105 HE2 PHE 139 HE2 PHE 139 253.270 -5.353 7.208 1106 HZ PHE 139 HZ PHE 139 252.549 -3.315 8.387 1107 H GLN 140 HN GLN 140 253.736 -7.881 13.713 1108 HA GLN 140 HA GLN 140 254.352 -10.480 14.843 1109 1HB GLN 140 HB2 GLN 140 253.747 -7.764 15.982 1110 2HB GLN 140 HB1 GLN 140 253.715 -9.187 17.013 1111 1HG GLN 140 HG2 GLN 140 256.086 -8.426 15.339 1112 2HG GLN 140 HG1 GLN 140 255.856 -7.879 16.997 1113 1HE2 GLN 140 HE21 GLN 140 257.280 -8.954 18.177 1114 2HE2 GLN 140 HE22 GLN 140 257.509 -10.667 18.169 1115 H GLY 141 HN GLY 141 251.606 -8.356 14.369 1116 1HA GLY 141 HA2 GLY 141 249.794 -10.604 14.791 1117 2HA GLY 141 HA1 GLY 141 249.574 -9.202 15.831 1118 H GLN 142 HN GLN 142 249.823 -7.069 14.314 1119 HA GLN 142 HA GLN 142 248.787 -7.138 11.719 1120 1HB GLN 142 HB2 GLN 142 246.791 -7.289 13.875 1121 2HB GLN 142 HB1 GLN 142 246.485 -6.030 12.687 1122 1HG GLN 142 HG2 GLN 142 247.091 -8.163 11.102 1123 2HG GLN 142 HG1 GLN 142 246.263 -8.931 12.456 1124 1HE2 GLN 142 HE21 GLN 142 244.133 -8.174 12.992 1125 2HE2 GLN 142 HE22 GLN 142 243.123 -7.505 11.762 1126 H ASP 143 HN ASP 143 250.663 -5.675 13.480 1127 HA ASP 143 HA ASP 143 250.131 -3.047 12.452 1128 1HB ASP 143 HB2 ASP 143 250.020 -3.562 15.421 1129 2HB ASP 143 HB1 ASP 143 250.358 -1.971 14.746 1130 H THR 144 HN THR 144 252.076 -4.907 14.777 1131 HA THR 144 HA THR 144 254.393 -3.246 14.336 1132 HB THR 144 HB THR 144 253.913 -5.755 15.936 1133 HG1 THR 144 HG1 THR 144 253.633 -4.379 17.480 1134 1HG2 THR 144 HG21 THR 144 256.174 -5.449 16.882 1135 2HG2 THR 144 HG22 THR 144 256.514 -4.280 15.605 1136 3HG2 THR 144 HG23 THR 144 256.180 -5.963 15.196 1137 H ILE 145 HN ILE 145 256.156 -3.677 13.103 1138 HA ILE 145 HA ILE 145 255.999 -6.079 11.421 1139 HB ILE 145 HB ILE 145 257.437 -3.500 10.802 1140 1HG1 ILE 145 HG12 ILE 145 254.931 -4.631 9.545 1141 2HG1 ILE 145 HG11 ILE 145 254.926 -3.377 10.779 1142 1HG2 ILE 145 HG21 ILE 145 258.512 -5.456 9.816 1143 2HG2 ILE 145 HG22 ILE 145 257.740 -4.474 8.571 1144 3HG2 ILE 145 HG23 ILE 145 256.973 -5.965 9.121 1145 1HD1 ILE 145 HD11 ILE 145 256.339 -2.000 9.224 1146 2HD1 ILE 145 HD12 ILE 145 254.682 -2.298 8.698 1147 3HD1 ILE 145 HD13 ILE 145 256.011 -3.213 7.987 1148 H LEU 146 HN LEU 146 257.689 -7.446 11.270 1149 HA LEU 146 HA LEU 146 260.059 -6.836 12.914 1150 1HB LEU 146 HB2 LEU 146 259.115 -9.624 12.332 1151 2HB LEU 146 HB1 LEU 146 260.186 -9.072 13.607 1152 HG LEU 146 HG LEU 146 257.421 -8.021 13.691 1153 1HD1 LEU 146 HD11 LEU 146 257.609 -10.663 13.137 1154 2HD1 LEU 146 HD12 LEU 146 256.315 -9.932 14.086 1155 3HD1 LEU 146 HD13 LEU 146 257.688 -10.683 14.898 1156 1HD2 LEU 146 HD21 LEU 146 259.575 -7.962 15.352 1157 2HD2 LEU 146 HD22 LEU 146 258.647 -9.303 16.023 1158 3HD2 LEU 146 HD23 LEU 146 257.904 -7.713 15.858 1159 H ASP 147 HN ASP 147 258.932 -7.411 9.807 1160 HA ASP 147 HA ASP 147 261.627 -7.634 8.787 1161 1HB ASP 147 HB2 ASP 147 260.056 -9.958 9.090 1162 2HB ASP 147 HB1 ASP 147 260.026 -9.575 7.371 1163 H TYR 148 HN TYR 148 261.839 -6.568 6.864 1164 HA TYR 148 HA TYR 148 259.413 -6.072 5.313 1165 1HB TYR 148 HB2 TYR 148 259.821 -3.710 5.122 1166 2HB TYR 148 HB1 TYR 148 259.744 -4.139 6.828 1167 HD1 TYR 148 HD1 TYR 148 261.980 -4.489 8.052 1168 HD2 TYR 148 HD2 TYR 148 261.661 -2.538 4.285 1169 HE1 TYR 148 HE1 TYR 148 264.169 -3.431 8.422 1170 HE2 TYR 148 HE2 TYR 148 263.849 -1.475 4.644 1171 HH TYR 148 HH TYR 148 265.244 -0.946 7.187 1172 H THR 149 HN THR 149 259.687 -6.288 3.185 1173 HA THR 149 HA THR 149 262.424 -6.119 2.115 1174 HB THR 149 HB THR 149 261.232 -7.940 0.461 1175 HG1 THR 149 HG1 THR 149 260.291 -9.482 1.904 1176 1HG2 THR 149 HG21 THR 149 262.988 -9.160 1.013 1177 2HG2 THR 149 HG22 THR 149 262.414 -9.347 2.669 1178 3HG2 THR 149 HG23 THR 149 263.377 -7.938 2.223 1179 H LEU 150 HN LEU 150 262.621 -5.278 0.042 1180 HA LEU 150 HA LEU 150 260.156 -4.305 -1.222 1181 1HB LEU 150 HB2 LEU 150 262.604 -2.710 -0.521 1182 2HB LEU 150 HB1 LEU 150 261.518 -2.207 -1.804 1183 HG LEU 150 HG LEU 150 259.818 -2.674 0.340 1184 1HD1 LEU 150 HD11 LEU 150 261.926 -2.800 1.731 1185 2HD1 LEU 150 HD12 LEU 150 260.713 -1.630 2.251 1186 3HD1 LEU 150 HD13 LEU 150 262.146 -1.085 1.379 1187 1HD2 LEU 150 HD21 LEU 150 260.647 -0.513 -1.333 1188 2HD2 LEU 150 HD22 LEU 150 260.474 0.071 0.322 1189 3HD2 LEU 150 HD23 LEU 150 259.123 -0.733 -0.475 1190 H ARG 151 HN ARG 151 260.031 -4.932 -3.256 1191 HA ARG 151 HA ARG 151 262.525 -5.347 -4.768 1192 1HB ARG 151 HB2 ARG 151 259.999 -7.006 -4.873 1193 2HB ARG 151 HB1 ARG 151 261.363 -7.191 -5.967 1194 1HG ARG 151 HG2 ARG 151 262.013 -7.314 -3.100 1195 2HG ARG 151 HG1 ARG 151 261.018 -8.634 -3.722 1196 1HD ARG 151 HD2 ARG 151 262.693 -9.479 -4.978 1197 2HD ARG 151 HD1 ARG 151 263.332 -7.886 -5.384 1198 HE ARG 151 HE ARG 151 263.823 -8.435 -2.667 1199 1HH1 ARG 151 HH11 ARG 151 264.866 -9.415 -5.849 1200 2HH1 ARG 151 HH12 ARG 151 266.455 -9.862 -5.328 1201 1HH2 ARG 151 HH21 ARG 151 265.914 -9.023 -1.978 1202 2HH2 ARG 151 HH22 ARG 151 267.050 -9.641 -3.130 1203 H GLU 152 HN GLU 152 262.280 -5.147 -7.121 1204 HA GLU 152 HA GLU 152 260.353 -3.033 -7.761 1205 1HB GLU 152 HB2 GLU 152 261.797 -2.496 -9.640 1206 2HB GLU 152 HB1 GLU 152 262.739 -2.554 -8.156 1207 1HG GLU 152 HG2 GLU 152 262.984 -5.109 -9.061 1208 2HG GLU 152 HG1 GLU 152 262.914 -4.197 -10.568 1209 H VAL 153 HN VAL 153 259.053 -3.122 -9.610 1210 HA VAL 153 HA VAL 153 258.968 -5.634 -11.102 1211 HB VAL 153 HB VAL 153 256.453 -5.673 -10.861 1212 1HG1 VAL 153 HG11 VAL 153 256.559 -6.716 -8.555 1213 2HG1 VAL 153 HG12 VAL 153 258.256 -6.238 -8.522 1214 3HG1 VAL 153 HG13 VAL 153 257.680 -7.359 -9.755 1215 1HG2 VAL 153 HG21 VAL 153 256.319 -3.340 -9.951 1216 2HG2 VAL 153 HG22 VAL 153 256.970 -3.963 -8.435 1217 3HG2 VAL 153 HG23 VAL 153 255.416 -4.545 -9.033 1218 H ASP 154 HN ASP 154 258.322 -5.409 -13.191 1219 HA ASP 154 HA ASP 154 256.772 -3.245 -14.164 1220 1HB ASP 154 HB2 ASP 154 259.230 -2.349 -13.660 1221 2HB ASP 154 HB1 ASP 154 259.544 -3.057 -15.242 1222 H THR 155 HN THR 155 256.817 -6.086 -14.376 1223 HA THR 155 HA THR 155 257.735 -6.699 -17.060 1224 HB THR 155 HB THR 155 256.031 -8.595 -15.517 1225 HG1 THR 155 HG1 THR 155 258.713 -7.990 -14.823 1226 1HG2 THR 155 HG21 THR 155 258.231 -8.744 -17.468 1227 2HG2 THR 155 HG22 THR 155 256.812 -9.771 -17.266 1228 3HG2 THR 155 HG23 THR 155 258.209 -9.979 -16.210 1229 H VAL 156 HN VAL 156 256.547 -6.192 -18.766 1230 HA VAL 156 HA VAL 156 253.705 -5.685 -18.501 1231 HB VAL 156 HB VAL 156 255.369 -5.580 -21.017 1232 1HG1 VAL 156 HG11 VAL 156 253.093 -5.579 -21.600 1233 2HG1 VAL 156 HG12 VAL 156 253.570 -3.881 -21.617 1234 3HG1 VAL 156 HG13 VAL 156 252.661 -4.528 -20.251 1235 1HG2 VAL 156 HG21 VAL 156 256.228 -4.142 -19.123 1236 2HG2 VAL 156 HG22 VAL 156 254.710 -3.252 -19.228 1237 3HG2 VAL 156 HG23 VAL 156 255.806 -3.289 -20.608 Start of MODEL 28 1 1H MET 1 HT1 MET 1 239.196 -23.228 1.447 2 2H MET 1 HT2 MET 1 239.875 -22.881 2.984 3 3H MET 1 HT3 MET 1 239.265 -24.450 2.646 4 HA MET 1 HA MET 1 241.515 -24.687 2.478 5 1HB MET 1 HB2 MET 1 239.880 -25.147 0.380 6 2HB MET 1 HB1 MET 1 241.040 -24.069 -0.383 7 1HG MET 1 HG2 MET 1 242.732 -25.571 -0.262 8 2HG MET 1 HG1 MET 1 242.125 -26.303 1.223 9 1HE MET 1 HE1 MET 1 242.726 -27.548 -2.458 10 2HE MET 1 HE2 MET 1 242.497 -29.039 -1.544 11 3HE MET 1 HE3 MET 1 243.464 -27.729 -0.866 12 H GLY 2 HN GLY 2 243.394 -23.971 0.740 13 1HA GLY 2 HA2 GLY 2 244.932 -22.357 0.186 14 2HA GLY 2 HA1 GLY 2 243.615 -21.194 0.212 15 H ALA 3 HN ALA 3 245.808 -20.123 1.043 16 HA ALA 3 HA ALA 3 245.342 -19.551 3.802 17 1HB ALA 3 HB1 ALA 3 246.591 -21.287 4.551 18 2HB ALA 3 HB2 ALA 3 247.909 -20.155 4.241 19 3HB ALA 3 HB3 ALA 3 247.523 -21.405 3.058 20 H SER 4 HN SER 4 245.081 -17.538 2.566 21 HA SER 4 HA SER 4 247.271 -15.821 2.887 22 1HB SER 4 HB2 SER 4 248.397 -16.531 1.006 23 2HB SER 4 HB1 SER 4 246.916 -16.993 0.167 24 HG SER 4 HG SER 4 247.687 -14.312 0.687 25 H ARG 5 HN ARG 5 245.855 -14.514 3.870 26 HA ARG 5 HA ARG 5 243.343 -13.766 2.877 27 1HB ARG 5 HB2 ARG 5 245.210 -12.688 4.941 28 2HB ARG 5 HB1 ARG 5 243.871 -11.676 4.418 29 1HG ARG 5 HG2 ARG 5 243.571 -14.477 5.478 30 2HG ARG 5 HG1 ARG 5 243.391 -13.012 6.446 31 1HD ARG 5 HD2 ARG 5 241.365 -12.536 5.581 32 2HD ARG 5 HD1 ARG 5 241.815 -13.075 3.965 33 HE ARG 5 HE ARG 5 240.962 -15.146 4.448 34 1HH1 ARG 5 HH11 ARG 5 241.301 -13.334 7.412 35 2HH1 ARG 5 HH12 ARG 5 240.446 -14.498 8.368 36 1HH2 ARG 5 HH21 ARG 5 239.837 -16.678 5.704 37 2HH2 ARG 5 HH22 ARG 5 239.615 -16.397 7.399 38 H LEU 6 HN LEU 6 243.363 -13.110 0.788 39 HA LEU 6 HA LEU 6 245.214 -11.061 -0.089 40 1HB LEU 6 HB2 LEU 6 244.234 -13.084 -1.452 41 2HB LEU 6 HB1 LEU 6 242.901 -11.983 -1.743 42 HG LEU 6 HG LEU 6 245.709 -11.115 -2.334 43 1HD1 LEU 6 HD11 LEU 6 243.988 -12.503 -4.361 44 2HD1 LEU 6 HD12 LEU 6 245.181 -13.372 -3.396 45 3HD1 LEU 6 HD13 LEU 6 245.694 -12.071 -4.470 46 1HD2 LEU 6 HD21 LEU 6 243.662 -9.579 -2.352 47 2HD2 LEU 6 HD22 LEU 6 243.175 -10.454 -3.801 48 3HD2 LEU 6 HD23 LEU 6 244.699 -9.569 -3.777 49 H TYR 7 HN TYR 7 244.859 -9.000 0.201 50 HA TYR 7 HA TYR 7 242.092 -7.997 0.277 51 1HB TYR 7 HB2 TYR 7 244.453 -7.346 2.014 52 2HB TYR 7 HB1 TYR 7 243.172 -6.161 1.778 53 HD1 TYR 7 HD1 TYR 7 241.662 -6.073 3.507 54 HD2 TYR 7 HD2 TYR 7 243.347 -9.840 2.471 55 HE1 TYR 7 HE1 TYR 7 240.343 -7.145 5.282 56 HE2 TYR 7 HE2 TYR 7 242.030 -10.923 4.242 57 HH TYR 7 HH TYR 7 240.531 -9.256 6.697 58 H THR 8 HN THR 8 242.298 -5.416 0.148 59 HA THR 8 HA THR 8 244.026 -4.787 -2.164 60 HB THR 8 HB THR 8 242.252 -3.562 -3.179 61 HG1 THR 8 HG1 THR 8 240.584 -4.166 -0.980 62 1HG2 THR 8 HG21 THR 8 240.350 -5.229 -3.286 63 2HG2 THR 8 HG22 THR 8 241.301 -6.219 -2.177 64 3HG2 THR 8 HG23 THR 8 241.945 -5.806 -3.764 65 H LEU 9 HN LEU 9 244.239 -2.388 -2.485 66 HA LEU 9 HA LEU 9 243.879 -0.732 -0.142 67 1HB LEU 9 HB2 LEU 9 246.048 -2.076 0.132 68 2HB LEU 9 HB1 LEU 9 246.674 -1.117 -1.194 69 HG LEU 9 HG LEU 9 245.734 -0.056 1.461 70 1HD1 LEU 9 HD11 LEU 9 247.906 0.104 2.122 71 2HD1 LEU 9 HD12 LEU 9 248.514 0.226 0.471 72 3HD1 LEU 9 HD13 LEU 9 248.012 -1.338 1.112 73 1HD2 LEU 9 HD21 LEU 9 246.796 2.069 0.592 74 2HD2 LEU 9 HD22 LEU 9 245.246 1.616 -0.117 75 3HD2 LEU 9 HD23 LEU 9 246.740 1.322 -1.005 76 H VAL 10 HN VAL 10 242.940 0.970 -1.155 77 HA VAL 10 HA VAL 10 244.166 1.925 -3.643 78 HB VAL 10 HB VAL 10 241.934 1.396 -4.101 79 1HG1 VAL 10 HG11 VAL 10 240.723 0.991 -2.292 80 2HG1 VAL 10 HG12 VAL 10 240.171 2.645 -2.542 81 3HG1 VAL 10 HG13 VAL 10 241.455 2.311 -1.382 82 1HG2 VAL 10 HG21 VAL 10 241.913 4.340 -3.488 83 2HG2 VAL 10 HG22 VAL 10 240.868 3.502 -4.633 84 3HG2 VAL 10 HG23 VAL 10 242.600 3.611 -4.938 85 H LEU 11 HN LEU 11 245.211 3.714 -3.648 86 HA LEU 11 HA LEU 11 244.628 5.756 -1.615 87 1HB LEU 11 HB2 LEU 11 247.046 4.278 -2.096 88 2HB LEU 11 HB1 LEU 11 247.328 5.977 -2.417 89 HG LEU 11 HG LEU 11 246.519 4.674 0.174 90 1HD1 LEU 11 HD11 LEU 11 248.600 5.100 0.846 91 2HD1 LEU 11 HD12 LEU 11 248.541 6.758 0.248 92 3HD1 LEU 11 HD13 LEU 11 248.971 5.440 -0.843 93 1HD2 LEU 11 HD21 LEU 11 246.482 7.124 1.007 94 2HD2 LEU 11 HD22 LEU 11 245.047 6.448 0.236 95 3HD2 LEU 11 HD23 LEU 11 246.122 7.508 -0.676 96 H VAL 12 HN VAL 12 243.780 7.442 -2.675 97 HA VAL 12 HA VAL 12 244.339 7.839 -5.475 98 HB VAL 12 HB VAL 12 242.736 9.672 -3.702 99 1HG1 VAL 12 HG11 VAL 12 242.920 9.195 -6.656 100 2HG1 VAL 12 HG12 VAL 12 243.080 10.709 -5.766 101 3HG1 VAL 12 HG13 VAL 12 241.498 9.946 -5.932 102 1HG2 VAL 12 HG21 VAL 12 241.481 7.837 -3.297 103 2HG2 VAL 12 HG22 VAL 12 242.129 6.959 -4.681 104 3HG2 VAL 12 HG23 VAL 12 240.861 8.162 -4.916 105 H LEU 13 HN LEU 13 246.407 8.495 -5.747 106 HA LEU 13 HA LEU 13 247.165 11.068 -4.526 107 1HB LEU 13 HB2 LEU 13 248.441 9.025 -3.777 108 2HB LEU 13 HB1 LEU 13 249.077 8.937 -5.407 109 HG LEU 13 HG LEU 13 250.720 10.272 -4.784 110 1HD1 LEU 13 HD11 LEU 13 250.243 12.669 -4.200 111 2HD1 LEU 13 HD12 LEU 13 248.535 12.272 -4.352 112 3HD1 LEU 13 HD13 LEU 13 249.606 12.098 -5.739 113 1HD2 LEU 13 HD21 LEU 13 250.332 11.471 -2.385 114 2HD2 LEU 13 HD22 LEU 13 250.976 9.843 -2.604 115 3HD2 LEU 13 HD23 LEU 13 249.262 10.075 -2.263 116 H GLN 14 HN GLN 14 247.213 12.645 -5.950 117 HA GLN 14 HA GLN 14 247.681 12.028 -8.781 118 1HB GLN 14 HB2 GLN 14 246.396 14.369 -7.380 119 2HB GLN 14 HB1 GLN 14 246.848 14.432 -9.078 120 1HG GLN 14 HG2 GLN 14 245.146 13.112 -9.721 121 2HG GLN 14 HG1 GLN 14 245.240 12.103 -8.278 122 1HE2 GLN 14 HE21 GLN 14 244.213 15.280 -9.425 123 2HE2 GLN 14 HE22 GLN 14 242.914 15.464 -8.301 124 HA PRO 15 HA PRO 15 251.667 13.902 -8.835 125 1HB PRO 15 HB2 PRO 15 251.610 15.367 -11.145 126 2HB PRO 15 HB1 PRO 15 251.808 13.612 -11.094 127 1HG PRO 15 HG2 PRO 15 249.341 15.226 -11.603 128 2HG PRO 15 HG1 PRO 15 249.911 13.762 -12.425 129 1HD PRO 15 HD2 PRO 15 247.969 13.679 -10.566 130 2HD PRO 15 HD1 PRO 15 249.156 12.369 -10.739 131 H GLN 16 HN GLN 16 249.470 15.429 -7.463 132 HA GLN 16 HA GLN 16 250.914 17.869 -7.129 133 1HB GLN 16 HB2 GLN 16 248.373 17.807 -8.673 134 2HB GLN 16 HB1 GLN 16 248.583 19.121 -7.524 135 1HG GLN 16 HG2 GLN 16 250.970 19.155 -8.817 136 2HG GLN 16 HG1 GLN 16 249.879 18.641 -10.104 137 1HE2 GLN 16 HE21 GLN 16 249.945 21.000 -7.448 138 2HE2 GLN 16 HE22 GLN 16 249.303 22.312 -8.372 139 H ARG 17 HN ARG 17 247.993 15.998 -6.460 140 HA ARG 17 HA ARG 17 248.261 16.721 -3.644 141 1HB ARG 17 HB2 ARG 17 245.707 16.924 -3.559 142 2HB ARG 17 HB1 ARG 17 246.609 18.276 -4.230 143 1HG ARG 17 HG2 ARG 17 246.137 16.890 -6.479 144 2HG ARG 17 HG1 ARG 17 244.727 16.418 -5.528 145 1HD ARG 17 HD2 ARG 17 244.236 18.798 -5.126 146 2HD ARG 17 HD1 ARG 17 245.610 19.236 -6.139 147 HE ARG 17 HE ARG 17 243.019 18.352 -7.016 148 1HH1 ARG 17 HH11 ARG 17 246.395 18.600 -7.868 149 2HH1 ARG 17 HH12 ARG 17 246.095 18.563 -9.574 150 1HH2 ARG 17 HH21 ARG 17 242.625 18.301 -9.259 151 2HH2 ARG 17 HH22 ARG 17 243.956 18.393 -10.364 152 H VAL 18 HN VAL 18 247.002 15.298 -2.206 153 HA VAL 18 HA VAL 18 246.392 12.675 -3.404 154 HB VAL 18 HB VAL 18 248.566 12.395 -2.451 155 1HG1 VAL 18 HG11 VAL 18 247.650 13.276 0.253 156 2HG1 VAL 18 HG12 VAL 18 248.221 14.461 -0.921 157 3HG1 VAL 18 HG13 VAL 18 249.287 13.160 -0.392 158 1HG2 VAL 18 HG21 VAL 18 246.515 11.312 -0.522 159 2HG2 VAL 18 HG22 VAL 18 248.157 10.705 -0.738 160 3HG2 VAL 18 HG23 VAL 18 246.987 10.570 -2.051 161 H LEU 19 HN LEU 19 244.905 11.385 -2.193 162 HA LEU 19 HA LEU 19 243.278 12.934 -0.285 163 1HB LEU 19 HB2 LEU 19 242.126 12.541 -2.419 164 2HB LEU 19 HB1 LEU 19 242.369 10.816 -2.233 165 HG LEU 19 HG LEU 19 240.885 10.738 -0.342 166 1HD1 LEU 19 HD11 LEU 19 239.625 13.078 0.000 167 2HD1 LEU 19 HD12 LEU 19 241.234 13.667 -0.416 168 3HD1 LEU 19 HD13 LEU 19 241.020 12.580 0.956 169 1HD2 LEU 19 HD21 LEU 19 240.089 11.127 -2.879 170 2HD2 LEU 19 HD22 LEU 19 239.279 12.481 -2.093 171 3HD2 LEU 19 HD23 LEU 19 238.977 10.834 -1.542 172 H LEU 20 HN LEU 20 243.578 12.193 1.709 173 HA LEU 20 HA LEU 20 244.022 9.307 2.077 174 1HB LEU 20 HB2 LEU 20 245.354 11.608 3.119 175 2HB LEU 20 HB1 LEU 20 244.618 10.743 4.455 176 HG LEU 20 HG LEU 20 246.375 9.383 2.423 177 1HD1 LEU 20 HD11 LEU 20 247.402 11.337 3.843 178 2HD1 LEU 20 HD12 LEU 20 248.270 9.815 3.636 179 3HD1 LEU 20 HD13 LEU 20 247.378 10.126 5.126 180 1HD2 LEU 20 HD21 LEU 20 246.038 7.523 3.606 181 2HD2 LEU 20 HD22 LEU 20 244.680 8.373 4.342 182 3HD2 LEU 20 HD23 LEU 20 246.251 8.358 5.144 183 H GLY 21 HN GLY 21 242.792 8.143 3.501 184 1HA GLY 21 HA2 GLY 21 240.304 9.436 4.339 185 2HA GLY 21 HA1 GLY 21 240.578 7.706 4.213 186 H MET 22 HN MET 22 239.858 9.934 6.370 187 HA MET 22 HA MET 22 241.551 8.782 8.482 188 1HB MET 22 HB2 MET 22 241.955 11.109 8.457 189 2HB MET 22 HB1 MET 22 240.253 11.486 8.231 190 1HG MET 22 HG2 MET 22 239.737 10.916 10.474 191 2HG MET 22 HG1 MET 22 241.330 10.206 10.726 192 1HE MET 22 HE1 MET 22 243.392 11.413 10.256 193 2HE MET 22 HE2 MET 22 243.732 12.885 11.167 194 3HE MET 22 HE3 MET 22 243.304 12.983 9.462 195 H LYS 23 HN LYS 23 240.586 7.950 10.337 196 HA LYS 23 HA LYS 23 237.785 7.261 10.050 197 1HB LYS 23 HB2 LYS 23 240.076 6.101 11.319 198 2HB LYS 23 HB1 LYS 23 238.816 6.325 12.524 199 1HG LYS 23 HG2 LYS 23 237.258 5.176 10.873 200 2HG LYS 23 HG1 LYS 23 238.719 4.712 9.997 201 1HD LYS 23 HD2 LYS 23 238.551 2.891 11.345 202 2HD LYS 23 HD1 LYS 23 239.443 3.941 12.448 203 1HE LYS 23 HE2 LYS 23 237.768 3.926 13.907 204 2HE LYS 23 HE1 LYS 23 236.622 4.439 12.669 205 1HZ LYS 23 HZ1 LYS 23 236.020 2.306 13.665 206 2HZ LYS 23 HZ2 LYS 23 237.481 1.634 13.140 207 3HZ LYS 23 HZ3 LYS 23 236.334 2.149 12.009 208 H LYS 24 HN LYS 24 236.170 7.802 11.554 209 HA LYS 24 HA LYS 24 236.690 10.306 12.925 210 1HB LYS 24 HB2 LYS 24 234.379 9.022 11.755 211 2HB LYS 24 HB1 LYS 24 234.027 9.530 13.401 212 1HG LYS 24 HG2 LYS 24 233.496 11.467 12.411 213 2HG LYS 24 HG1 LYS 24 235.238 11.746 12.466 214 1HD LYS 24 HD2 LYS 24 235.520 11.199 10.226 215 2HD LYS 24 HD1 LYS 24 233.990 10.327 10.145 216 1HE LYS 24 HE2 LYS 24 234.423 13.303 10.266 217 2HE LYS 24 HE1 LYS 24 233.683 12.367 8.967 218 1HZ LYS 24 HZ1 LYS 24 232.535 13.306 11.460 219 2HZ LYS 24 HZ2 LYS 24 232.097 11.735 11.010 220 3HZ LYS 24 HZ3 LYS 24 231.797 13.029 9.963 221 H ARG 25 HN ARG 25 235.916 6.978 13.643 222 HA ARG 25 HA ARG 25 236.923 7.193 16.270 223 1HB ARG 25 HB2 ARG 25 234.621 6.383 17.271 224 2HB ARG 25 HB1 ARG 25 234.994 8.095 17.120 225 1HG ARG 25 HG2 ARG 25 232.719 7.568 16.390 226 2HG ARG 25 HG1 ARG 25 233.700 8.231 15.081 227 1HD ARG 25 HD2 ARG 25 233.854 6.203 13.992 228 2HD ARG 25 HD1 ARG 25 233.537 5.280 15.459 229 HE ARG 25 HE ARG 25 231.354 6.907 14.425 230 1HH1 ARG 25 HH11 ARG 25 232.797 3.735 14.704 231 2HH1 ARG 25 HH12 ARG 25 231.330 2.902 14.321 232 1HH2 ARG 25 HH21 ARG 25 229.430 5.805 13.920 233 2HH2 ARG 25 HH22 ARG 25 229.422 4.073 13.875 234 H GLY 26 HN GLY 26 237.481 5.240 17.085 235 1HA GLY 26 HA2 GLY 26 236.647 2.805 17.116 236 2HA GLY 26 HA1 GLY 26 236.846 2.932 15.374 237 H PHE 27 HN PHE 27 238.613 1.890 14.747 238 HA PHE 27 HA PHE 27 240.937 1.842 16.529 239 1HB PHE 27 HB2 PHE 27 240.032 0.091 14.264 240 2HB PHE 27 HB1 PHE 27 241.711 0.073 14.793 241 HD1 PHE 27 HD1 PHE 27 238.238 -0.589 15.824 242 HD2 PHE 27 HD2 PHE 27 242.359 -1.011 16.796 243 HE1 PHE 27 HE1 PHE 27 237.650 -2.172 17.614 244 HE2 PHE 27 HE2 PHE 27 241.780 -2.595 18.588 245 HZ PHE 27 HZ PHE 27 239.422 -3.178 18.998 246 H GLY 28 HN GLY 28 240.130 4.122 14.721 247 1HA GLY 28 HA2 GLY 28 242.775 4.700 13.779 248 2HA GLY 28 HA1 GLY 28 241.670 4.365 12.459 249 H ALA 29 HN ALA 29 240.252 5.861 15.220 250 HA ALA 29 HA ALA 29 239.356 8.099 13.811 251 1HB ALA 29 HB1 ALA 29 238.849 7.029 16.255 252 2HB ALA 29 HB2 ALA 29 238.223 8.564 15.658 253 3HB ALA 29 HB3 ALA 29 239.665 8.535 16.671 254 H GLY 30 HN GLY 30 240.388 9.889 13.155 255 1HA GLY 30 HA2 GLY 30 241.755 11.779 13.394 256 2HA GLY 30 HA1 GLY 30 242.499 11.035 14.801 257 H ARG 31 HN ARG 31 242.714 8.550 12.885 258 HA ARG 31 HA ARG 31 245.343 9.336 11.866 259 1HB ARG 31 HB2 ARG 31 244.081 6.766 12.683 260 2HB ARG 31 HB1 ARG 31 245.308 6.701 11.426 261 1HG ARG 31 HG2 ARG 31 246.814 7.977 12.995 262 2HG ARG 31 HG1 ARG 31 245.606 7.683 14.248 263 1HD ARG 31 HD2 ARG 31 246.043 5.438 14.334 264 2HD ARG 31 HD1 ARG 31 246.568 5.365 12.654 265 HE ARG 31 HE ARG 31 248.340 6.866 14.343 266 1HH1 ARG 31 HH11 ARG 31 247.512 3.675 13.197 267 2HH1 ARG 31 HH12 ARG 31 249.092 3.026 13.484 268 1HH2 ARG 31 HH21 ARG 31 250.419 6.014 14.719 269 2HH2 ARG 31 HH22 ARG 31 250.742 4.353 14.347 270 H TRP 32 HN TRP 32 245.994 8.734 9.720 271 HA TRP 32 HA TRP 32 243.725 8.633 7.846 272 1HB TRP 32 HB2 TRP 32 246.369 9.429 6.795 273 2HB TRP 32 HB1 TRP 32 244.775 10.087 6.452 274 HD1 TRP 32 HD1 TRP 32 247.269 10.181 9.442 275 HE1 TRP 32 HE1 TRP 32 247.217 12.558 10.425 276 HE3 TRP 32 HE3 TRP 32 243.716 12.242 6.399 277 HZ2 TRP 32 HZ2 TRP 32 245.855 14.986 9.970 278 HZ3 TRP 32 HZ3 TRP 32 243.098 14.599 6.739 279 HH2 TRP 32 HH2 TRP 32 244.145 15.942 8.487 280 H ASN 33 HN ASN 33 243.955 7.332 5.923 281 HA ASN 33 HA ASN 33 246.157 5.660 5.418 282 1HB ASN 33 HB2 ASN 33 244.940 4.774 7.656 283 2HB ASN 33 HB1 ASN 33 243.988 3.915 6.447 284 1HD2 ASN 33 HD21 ASN 33 245.834 2.864 8.422 285 2HD2 ASN 33 HD22 ASN 33 247.045 2.001 7.543 286 H GLY 34 HN GLY 34 245.694 4.002 3.774 287 1HA GLY 34 HA2 GLY 34 243.972 5.017 1.765 288 2HA GLY 34 HA1 GLY 34 244.829 3.484 1.710 289 H PHE 35 HN PHE 35 242.604 3.165 0.553 290 HA PHE 35 HA PHE 35 240.646 2.240 2.552 291 1HB PHE 35 HB2 PHE 35 239.889 2.538 -0.316 292 2HB PHE 35 HB1 PHE 35 238.915 2.766 1.123 293 HD1 PHE 35 HD1 PHE 35 239.446 4.831 2.572 294 HD2 PHE 35 HD2 PHE 35 240.734 4.369 -1.457 295 HE1 PHE 35 HE1 PHE 35 239.755 7.265 2.396 296 HE2 PHE 35 HE2 PHE 35 241.046 6.801 -1.641 297 HZ PHE 35 HZ PHE 35 240.556 8.254 0.287 298 H GLY 36 HN GLY 36 241.530 0.209 2.917 299 1HA GLY 36 HA2 GLY 36 241.995 -1.524 0.616 300 2HA GLY 36 HA1 GLY 36 242.399 -1.888 2.287 301 H GLY 37 HN GLY 37 241.278 -3.849 0.856 302 1HA GLY 37 HA2 GLY 37 238.922 -4.446 2.336 303 2HA GLY 37 HA1 GLY 37 238.523 -4.041 0.673 304 H LYS 38 HN LYS 38 238.350 -6.595 2.222 305 HA LYS 38 HA LYS 38 240.314 -8.347 1.078 306 1HB LYS 38 HB2 LYS 38 239.121 -10.126 2.171 307 2HB LYS 38 HB1 LYS 38 239.214 -8.761 3.276 308 1HG LYS 38 HG2 LYS 38 236.908 -8.142 2.657 309 2HG LYS 38 HG1 LYS 38 236.825 -9.581 1.638 310 1HD LYS 38 HD2 LYS 38 237.735 -10.461 4.142 311 2HD LYS 38 HD1 LYS 38 236.426 -9.327 4.476 312 1HE LYS 38 HE2 LYS 38 236.301 -11.738 2.667 313 2HE LYS 38 HE1 LYS 38 235.552 -11.579 4.256 314 1HZ LYS 38 HZ1 LYS 38 233.821 -11.109 2.837 315 2HZ LYS 38 HZ2 LYS 38 234.795 -10.302 1.715 316 3HZ LYS 38 HZ3 LYS 38 234.394 -9.554 3.178 317 H VAL 39 HN VAL 39 240.083 -9.808 -0.584 318 HA VAL 39 HA VAL 39 238.209 -9.103 -2.638 319 HB VAL 39 HB VAL 39 240.031 -11.516 -2.606 320 1HG1 VAL 39 HG11 VAL 39 238.947 -9.888 -4.903 321 2HG1 VAL 39 HG12 VAL 39 238.285 -11.432 -4.363 322 3HG1 VAL 39 HG13 VAL 39 239.923 -11.352 -5.013 323 1HG2 VAL 39 HG21 VAL 39 241.359 -9.724 -4.101 324 2HG2 VAL 39 HG22 VAL 39 241.661 -9.981 -2.383 325 3HG2 VAL 39 HG23 VAL 39 240.631 -8.650 -2.907 326 H GLN 40 HN GLN 40 236.158 -9.722 -2.564 327 HA GLN 40 HA GLN 40 234.956 -11.537 -0.931 328 1HB GLN 40 HB2 GLN 40 234.259 -10.402 -3.589 329 2HB GLN 40 HB1 GLN 40 233.308 -11.768 -3.023 330 1HG GLN 40 HG2 GLN 40 233.391 -10.121 -0.825 331 2HG GLN 40 HG1 GLN 40 233.281 -8.990 -2.173 332 1HE2 GLN 40 HE21 GLN 40 231.191 -8.454 -1.319 333 2HE2 GLN 40 HE22 GLN 40 229.828 -9.450 -1.684 334 H GLU 41 HN GLU 41 233.779 -13.591 -1.640 335 HA GLU 41 HA GLU 41 235.730 -15.542 -2.286 336 1HB GLU 41 HB2 GLU 41 232.822 -15.546 -1.667 337 2HB GLU 41 HB1 GLU 41 233.473 -16.958 -2.487 338 1HG GLU 41 HG2 GLU 41 233.938 -17.705 -0.444 339 2HG GLU 41 HG1 GLU 41 235.291 -16.575 -0.492 340 H GLY 42 HN GLY 42 236.234 -14.295 -4.394 341 1HA GLY 42 HA2 GLY 42 236.355 -15.398 -6.617 342 2HA GLY 42 HA1 GLY 42 234.602 -15.468 -6.558 343 H GLU 43 HN GLU 43 236.768 -12.759 -5.718 344 HA GLU 43 HA GLU 43 235.652 -11.296 -7.990 345 1HB GLU 43 HB2 GLU 43 235.076 -9.457 -6.756 346 2HB GLU 43 HB1 GLU 43 234.795 -10.697 -5.547 347 1HG GLU 43 HG2 GLU 43 236.806 -10.182 -4.420 348 2HG GLU 43 HG1 GLU 43 237.376 -9.174 -5.749 349 H THR 44 HN THR 44 237.078 -9.244 -8.325 350 HA THR 44 HA THR 44 239.818 -10.248 -8.364 351 HB THR 44 HB THR 44 240.180 -8.600 -10.121 352 HG1 THR 44 HG1 THR 44 238.617 -7.215 -10.742 353 1HG2 THR 44 HG21 THR 44 239.475 -10.537 -11.117 354 2HG2 THR 44 HG22 THR 44 238.223 -9.419 -11.660 355 3HG2 THR 44 HG23 THR 44 237.909 -10.505 -10.307 356 H ILE 45 HN ILE 45 241.520 -9.152 -7.556 357 HA ILE 45 HA ILE 45 241.218 -7.715 -5.241 358 HB ILE 45 HB ILE 45 243.592 -7.156 -6.982 359 1HG1 ILE 45 HG12 ILE 45 243.047 -9.741 -5.509 360 2HG1 ILE 45 HG11 ILE 45 243.200 -9.552 -7.250 361 1HG2 ILE 45 HG21 ILE 45 243.045 -7.415 -4.057 362 2HG2 ILE 45 HG22 ILE 45 243.698 -6.040 -4.948 363 3HG2 ILE 45 HG23 ILE 45 244.685 -7.481 -4.701 364 1HD1 ILE 45 HD11 ILE 45 245.195 -10.313 -5.586 365 2HD1 ILE 45 HD12 ILE 45 245.503 -8.583 -5.742 366 3HD1 ILE 45 HD13 ILE 45 245.423 -9.598 -7.182 367 H GLU 46 HN GLU 46 241.298 -6.537 -8.541 368 HA GLU 46 HA GLU 46 241.451 -3.749 -7.814 369 1HB GLU 46 HB2 GLU 46 242.291 -4.632 -9.988 370 2HB GLU 46 HB1 GLU 46 240.635 -5.005 -10.445 371 1HG GLU 46 HG2 GLU 46 240.052 -2.659 -10.364 372 2HG GLU 46 HG1 GLU 46 241.676 -2.253 -9.812 373 H ASP 47 HN ASP 47 238.993 -6.135 -8.216 374 HA ASP 47 HA ASP 47 236.836 -4.230 -8.496 375 1HB ASP 47 HB2 ASP 47 237.039 -7.208 -8.322 376 2HB ASP 47 HB1 ASP 47 235.501 -6.452 -7.921 377 H GLY 48 HN GLY 48 238.338 -6.187 -6.017 378 1HA GLY 48 HA2 GLY 48 236.420 -5.561 -3.974 379 2HA GLY 48 HA1 GLY 48 238.004 -6.286 -3.729 380 H ALA 49 HN ALA 49 239.371 -4.102 -5.144 381 HA ALA 49 HA ALA 49 239.716 -2.345 -2.905 382 1HB ALA 49 HB1 ALA 49 240.939 -1.566 -5.459 383 2HB ALA 49 HB2 ALA 49 241.361 -3.183 -4.898 384 3HB ALA 49 HB3 ALA 49 241.668 -1.785 -3.868 385 H ARG 50 HN ARG 50 238.352 -2.115 -6.163 386 HA ARG 50 HA ARG 50 237.735 0.655 -5.895 387 1HB ARG 50 HB2 ARG 50 236.458 0.359 -7.992 388 2HB ARG 50 HB1 ARG 50 238.099 -0.256 -8.101 389 1HG ARG 50 HG2 ARG 50 237.116 -2.042 -9.016 390 2HG ARG 50 HG1 ARG 50 236.779 -2.489 -7.343 391 1HD ARG 50 HD2 ARG 50 234.675 -0.910 -7.789 392 2HD ARG 50 HD1 ARG 50 234.968 -1.450 -9.442 393 HE ARG 50 HE ARG 50 234.939 -3.623 -7.594 394 1HH1 ARG 50 HH11 ARG 50 232.884 -1.468 -9.414 395 2HH1 ARG 50 HH12 ARG 50 231.553 -2.575 -9.461 396 1HH2 ARG 50 HH21 ARG 50 233.190 -5.081 -7.655 397 2HH2 ARG 50 HH22 ARG 50 231.726 -4.626 -8.461 398 H ARG 51 HN ARG 51 235.826 -2.337 -5.702 399 HA ARG 51 HA ARG 51 233.335 -1.119 -5.238 400 1HB ARG 51 HB2 ARG 51 233.812 -3.560 -5.809 401 2HB ARG 51 HB1 ARG 51 234.180 -3.784 -4.104 402 1HG ARG 51 HG2 ARG 51 231.968 -3.311 -3.458 403 2HG ARG 51 HG1 ARG 51 231.561 -2.660 -5.048 404 1HD ARG 51 HD2 ARG 51 231.820 -4.880 -6.030 405 2HD ARG 51 HD1 ARG 51 232.256 -5.535 -4.452 406 HE ARG 51 HE ARG 51 229.628 -5.006 -5.420 407 1HH1 ARG 51 HH11 ARG 51 231.579 -5.087 -2.528 408 2HH1 ARG 51 HH12 ARG 51 230.234 -5.389 -1.479 409 1HH2 ARG 51 HH21 ARG 51 227.858 -5.403 -4.042 410 2HH2 ARG 51 HH22 ARG 51 228.121 -5.569 -2.339 411 H GLU 52 HN GLU 52 235.953 -2.024 -3.083 412 HA GLU 52 HA GLU 52 234.466 -1.282 -0.711 413 1HB GLU 52 HB2 GLU 52 237.352 -2.102 -1.099 414 2HB GLU 52 HB1 GLU 52 236.619 -1.761 0.462 415 1HG GLU 52 HG2 GLU 52 235.398 -3.809 -1.329 416 2HG GLU 52 HG1 GLU 52 236.829 -4.209 -0.380 417 H LEU 53 HN LEU 53 236.482 0.188 -3.039 418 HA LEU 53 HA LEU 53 237.579 2.275 -1.473 419 1HB LEU 53 HB2 LEU 53 238.653 1.849 -3.514 420 2HB LEU 53 HB1 LEU 53 237.146 1.832 -4.409 421 HG LEU 53 HG LEU 53 236.945 4.270 -4.055 422 1HD1 LEU 53 HD11 LEU 53 238.644 3.923 -2.008 423 2HD1 LEU 53 HD12 LEU 53 238.379 5.473 -2.806 424 3HD1 LEU 53 HD13 LEU 53 239.767 4.480 -3.247 425 1HD2 LEU 53 HD21 LEU 53 239.184 4.755 -5.405 426 2HD2 LEU 53 HD22 LEU 53 237.808 3.925 -6.132 427 3HD2 LEU 53 HD23 LEU 53 239.180 2.995 -5.530 428 H GLN 54 HN GLN 54 234.769 2.060 -3.618 429 HA GLN 54 HA GLN 54 233.879 4.709 -3.321 430 1HB GLN 54 HB2 GLN 54 232.844 3.636 -5.071 431 2HB GLN 54 HB1 GLN 54 232.640 2.137 -4.178 432 1HG GLN 54 HG2 GLN 54 230.817 3.120 -2.907 433 2HG GLN 54 HG1 GLN 54 231.039 4.652 -3.750 434 1HE2 GLN 54 HE21 GLN 54 229.615 4.985 -5.285 435 2HE2 GLN 54 HE22 GLN 54 228.865 3.779 -6.268 436 H GLU 55 HN GLU 55 233.638 1.941 -1.270 437 HA GLU 55 HA GLU 55 231.486 2.977 0.336 438 1HB GLU 55 HB2 GLU 55 233.232 0.545 0.473 439 2HB GLU 55 HB1 GLU 55 232.199 0.982 1.827 440 1HG GLU 55 HG2 GLU 55 230.334 0.320 0.784 441 2HG GLU 55 HG1 GLU 55 230.850 0.972 -0.772 442 H GLU 56 HN GLU 56 234.943 3.229 0.391 443 HA GLU 56 HA GLU 56 235.114 3.726 3.200 444 1HB GLU 56 HB2 GLU 56 236.938 3.260 1.092 445 2HB GLU 56 HB1 GLU 56 237.374 4.801 1.821 446 1HG GLU 56 HG2 GLU 56 237.129 2.137 3.194 447 2HG GLU 56 HG1 GLU 56 238.598 3.072 2.918 448 H SER 57 HN SER 57 235.143 5.853 0.335 449 HA SER 57 HA SER 57 234.465 8.061 2.146 450 1HB SER 57 HB2 SER 57 236.954 7.766 0.743 451 2HB SER 57 HB1 SER 57 236.100 9.180 0.128 452 HG SER 57 HG SER 57 237.195 8.710 2.628 453 H GLY 58 HN GLY 58 232.899 6.453 0.235 454 1HA GLY 58 HA2 GLY 58 231.316 6.761 -1.394 455 2HA GLY 58 HA1 GLY 58 231.293 8.432 -0.852 456 H LEU 59 HN LEU 59 234.325 7.325 -2.000 457 HA LEU 59 HA LEU 59 233.931 8.869 -4.464 458 1HB LEU 59 HB2 LEU 59 236.424 8.128 -2.944 459 2HB LEU 59 HB1 LEU 59 236.437 8.906 -4.515 460 HG LEU 59 HG LEU 59 235.742 10.025 -1.851 461 1HD1 LEU 59 HD11 LEU 59 237.890 10.295 -3.340 462 2HD1 LEU 59 HD12 LEU 59 237.243 11.662 -2.433 463 3HD1 LEU 59 HD13 LEU 59 236.908 11.509 -4.158 464 1HD2 LEU 59 HD21 LEU 59 234.542 11.894 -2.885 465 2HD2 LEU 59 HD22 LEU 59 233.681 10.370 -3.107 466 3HD2 LEU 59 HD23 LEU 59 234.596 11.070 -4.443 467 H THR 60 HN THR 60 233.298 7.569 -6.010 468 HA THR 60 HA THR 60 234.375 4.891 -6.269 469 HB THR 60 HB THR 60 232.690 5.879 -8.450 470 HG1 THR 60 HG1 THR 60 230.848 6.151 -7.224 471 1HG2 THR 60 HG21 THR 60 232.197 3.724 -8.493 472 2HG2 THR 60 HG22 THR 60 231.417 3.877 -6.919 473 3HG2 THR 60 HG23 THR 60 233.129 3.465 -7.019 474 H VAL 61 HN VAL 61 235.353 4.175 -8.306 475 HA VAL 61 HA VAL 61 236.653 6.380 -9.761 476 HB VAL 61 HB VAL 61 238.726 5.124 -9.879 477 1HG1 VAL 61 HG11 VAL 61 237.603 5.621 -7.140 478 2HG1 VAL 61 HG12 VAL 61 238.687 6.637 -8.088 479 3HG1 VAL 61 HG13 VAL 61 239.278 5.130 -7.390 480 1HG2 VAL 61 HG21 VAL 61 238.547 2.898 -9.725 481 2HG2 VAL 61 HG22 VAL 61 237.056 2.990 -8.788 482 3HG2 VAL 61 HG23 VAL 61 238.615 3.150 -7.980 483 H ASP 62 HN ASP 62 236.956 6.131 -11.923 484 HA ASP 62 HA ASP 62 235.350 4.122 -13.218 485 1HB ASP 62 HB2 ASP 62 236.853 6.552 -14.090 486 2HB ASP 62 HB1 ASP 62 236.462 5.333 -15.300 487 H ALA 63 HN ALA 63 238.660 4.549 -12.363 488 HA ALA 63 HA ALA 63 239.403 1.943 -13.016 489 1HB ALA 63 HB1 ALA 63 239.190 3.359 -15.323 490 2HB ALA 63 HB2 ALA 63 240.242 1.962 -15.100 491 3HB ALA 63 HB3 ALA 63 240.894 3.593 -14.933 492 H LEU 64 HN LEU 64 240.537 1.917 -11.113 493 HA LEU 64 HA LEU 64 242.265 3.957 -10.200 494 1HB LEU 64 HB2 LEU 64 242.378 0.995 -9.597 495 2HB LEU 64 HB1 LEU 64 243.170 2.259 -8.678 496 HG LEU 64 HG LEU 64 240.441 2.946 -8.755 497 1HD1 LEU 64 HD11 LEU 64 240.925 0.026 -8.538 498 2HD1 LEU 64 HD12 LEU 64 239.559 0.899 -9.231 499 3HD1 LEU 64 HD13 LEU 64 239.719 0.757 -7.481 500 1HD2 LEU 64 HD21 LEU 64 240.833 3.292 -6.586 501 2HD2 LEU 64 HD22 LEU 64 242.495 2.816 -6.931 502 3HD2 LEU 64 HD23 LEU 64 241.346 1.625 -6.323 503 H HIS 65 HN HIS 65 244.691 3.005 -9.659 504 HA HIS 65 HA HIS 65 245.843 2.024 -12.172 505 1HB HIS 65 HB2 HIS 65 247.113 4.274 -10.614 506 2HB HIS 65 HB1 HIS 65 247.527 3.698 -12.225 507 HD1 HIS 65 HD1 HIS 65 245.392 4.032 -14.005 508 HD2 HIS 65 HD2 HIS 65 245.599 6.505 -10.672 509 HE1 HIS 65 HE1 HIS 65 243.954 6.020 -14.553 510 HE2 HIS 65 HE2 HIS 65 244.162 7.543 -12.557 511 H LYS 66 HN LYS 66 246.499 0.056 -11.454 512 HA LYS 66 HA LYS 66 247.500 -0.481 -8.871 513 1HB LYS 66 HB2 LYS 66 248.468 -2.564 -10.034 514 2HB LYS 66 HB1 LYS 66 246.722 -2.364 -10.036 515 1HG LYS 66 HG2 LYS 66 246.680 -1.760 -12.297 516 2HG LYS 66 HG1 LYS 66 248.416 -1.440 -12.331 517 1HD LYS 66 HD2 LYS 66 248.909 -3.782 -12.126 518 2HD LYS 66 HD1 LYS 66 247.204 -4.163 -11.874 519 1HE LYS 66 HE2 LYS 66 248.386 -2.979 -14.385 520 2HE LYS 66 HE1 LYS 66 247.947 -4.673 -14.162 521 1HZ LYS 66 HZ1 LYS 66 246.222 -2.335 -14.517 522 2HZ LYS 66 HZ2 LYS 66 245.651 -3.593 -13.542 523 3HZ LYS 66 HZ3 LYS 66 246.069 -3.896 -15.152 524 H VAL 67 HN VAL 67 249.532 -0.378 -8.013 525 HA VAL 67 HA VAL 67 251.683 0.411 -9.881 526 HB VAL 67 HB VAL 67 252.639 1.862 -8.145 527 1HG1 VAL 67 HG11 VAL 67 249.878 2.892 -8.388 528 2HG1 VAL 67 HG12 VAL 67 250.701 2.467 -9.889 529 3HG1 VAL 67 HG13 VAL 67 251.416 3.654 -8.797 530 1HG2 VAL 67 HG21 VAL 67 250.850 2.517 -6.335 531 2HG2 VAL 67 HG22 VAL 67 251.951 1.165 -6.078 532 3HG2 VAL 67 HG23 VAL 67 250.295 0.868 -6.607 533 H GLY 68 HN GLY 68 251.040 -0.949 -6.646 534 1HA GLY 68 HA2 GLY 68 253.293 -2.768 -7.105 535 2HA GLY 68 HA1 GLY 68 253.306 -1.786 -5.651 536 H GLN 69 HN GLN 69 253.460 -4.415 -5.312 537 HA GLN 69 HA GLN 69 250.809 -5.101 -4.246 538 1HB GLN 69 HB2 GLN 69 252.687 -7.169 -5.378 539 2HB GLN 69 HB1 GLN 69 250.997 -7.364 -4.934 540 1HG GLN 69 HG2 GLN 69 250.554 -5.623 -6.789 541 2HG GLN 69 HG1 GLN 69 252.177 -6.042 -7.338 542 1HE2 GLN 69 HE21 GLN 69 251.547 -7.004 -9.224 543 2HE2 GLN 69 HE22 GLN 69 250.670 -8.491 -9.286 544 H ILE 70 HN ILE 70 250.972 -5.133 -2.110 545 HA ILE 70 HA ILE 70 253.531 -5.871 -0.884 546 HB ILE 70 HB ILE 70 251.126 -4.579 0.401 547 1HG1 ILE 70 HG12 ILE 70 253.706 -3.158 -0.106 548 2HG1 ILE 70 HG11 ILE 70 252.558 -3.332 -1.430 549 1HG2 ILE 70 HG21 ILE 70 253.775 -5.463 1.404 550 2HG2 ILE 70 HG22 ILE 70 252.202 -5.464 2.203 551 3HG2 ILE 70 HG23 ILE 70 253.109 -3.960 2.044 552 1HD1 ILE 70 HD11 ILE 70 250.848 -2.352 0.226 553 2HD1 ILE 70 HD12 ILE 70 252.027 -1.275 -0.522 554 3HD1 ILE 70 HD13 ILE 70 252.267 -1.830 1.135 555 H VAL 71 HN VAL 71 253.688 -7.453 0.682 556 HA VAL 71 HA VAL 71 251.337 -9.182 1.051 557 HB VAL 71 HB VAL 71 254.172 -10.134 0.611 558 1HG1 VAL 71 HG11 VAL 71 251.651 -11.477 1.410 559 2HG1 VAL 71 HG12 VAL 71 253.317 -11.815 1.882 560 3HG1 VAL 71 HG13 VAL 71 252.726 -12.332 0.303 561 1HG2 VAL 71 HG21 VAL 71 252.916 -11.199 -1.441 562 2HG2 VAL 71 HG22 VAL 71 253.555 -9.557 -1.520 563 3HG2 VAL 71 HG23 VAL 71 251.839 -9.821 -1.213 564 H PHE 72 HN PHE 72 251.172 -10.239 3.027 565 HA PHE 72 HA PHE 72 253.066 -9.360 5.106 566 1HB PHE 72 HB2 PHE 72 250.072 -9.691 5.265 567 2HB PHE 72 HB1 PHE 72 251.096 -9.542 6.686 568 HD1 PHE 72 HD1 PHE 72 248.800 -7.781 5.215 569 HD2 PHE 72 HD2 PHE 72 252.995 -7.478 5.856 570 HE1 PHE 72 HE1 PHE 72 248.644 -5.327 5.050 571 HE2 PHE 72 HE2 PHE 72 252.849 -5.028 5.692 572 HZ PHE 72 HZ PHE 72 250.672 -3.948 5.289 573 H GLU 73 HN GLU 73 254.059 -10.954 6.159 574 HA GLU 73 HA GLU 73 252.819 -13.629 6.129 575 1HB GLU 73 HB2 GLU 73 254.802 -13.537 4.669 576 2HB GLU 73 HB1 GLU 73 255.770 -12.967 6.021 577 1HG GLU 73 HG2 GLU 73 255.998 -15.017 6.889 578 2HG GLU 73 HG1 GLU 73 254.332 -15.467 6.527 579 H PHE 74 HN PHE 74 252.306 -14.348 8.107 580 HA PHE 74 HA PHE 74 253.315 -12.924 10.428 581 1HB PHE 74 HB2 PHE 74 250.947 -13.666 10.342 582 2HB PHE 74 HB1 PHE 74 251.482 -15.339 10.316 583 HD1 PHE 74 HD1 PHE 74 251.348 -12.265 12.363 584 HD2 PHE 74 HD2 PHE 74 252.139 -16.446 12.294 585 HE1 PHE 74 HE1 PHE 74 251.379 -12.309 14.823 586 HE2 PHE 74 HE2 PHE 74 252.169 -16.490 14.749 587 HZ PHE 74 HZ PHE 74 251.789 -14.417 16.019 588 H VAL 75 HN VAL 75 254.688 -13.653 11.931 589 HA VAL 75 HA VAL 75 256.419 -15.827 11.163 590 HB VAL 75 HB VAL 75 256.868 -14.674 13.812 591 1HG1 VAL 75 HG11 VAL 75 258.352 -15.993 12.023 592 2HG1 VAL 75 HG12 VAL 75 259.042 -14.899 13.222 593 3HG1 VAL 75 HG13 VAL 75 258.764 -14.338 11.574 594 1HG2 VAL 75 HG21 VAL 75 256.505 -12.905 11.442 595 2HG2 VAL 75 HG22 VAL 75 257.764 -12.530 12.618 596 3HG2 VAL 75 HG23 VAL 75 256.080 -12.627 13.131 597 H GLY 76 HN GLY 76 255.964 -17.849 11.658 598 1HA GLY 76 HA2 GLY 76 255.800 -19.531 13.384 599 2HA GLY 76 HA1 GLY 76 254.800 -18.416 14.305 600 H GLU 77 HN GLU 77 253.426 -17.728 11.642 601 HA GLU 77 HA GLU 77 251.705 -20.133 11.581 602 1HB GLU 77 HB2 GLU 77 250.847 -17.269 11.133 603 2HB GLU 77 HB1 GLU 77 249.802 -18.681 11.109 604 1HG GLU 77 HG2 GLU 77 251.392 -18.212 13.561 605 2HG GLU 77 HG1 GLU 77 250.048 -17.119 13.237 606 HA PRO 78 HA PRO 78 252.424 -20.330 7.238 607 1HB PRO 78 HB2 PRO 78 250.268 -21.701 6.409 608 2HB PRO 78 HB1 PRO 78 251.511 -22.444 7.423 609 1HG PRO 78 HG2 PRO 78 248.836 -21.351 8.200 610 2HG PRO 78 HG1 PRO 78 249.633 -22.843 8.732 611 1HD PRO 78 HD2 PRO 78 249.604 -20.530 10.197 612 2HD PRO 78 HD1 PRO 78 250.882 -21.754 10.315 613 H GLU 79 HN GLU 79 249.088 -19.375 8.085 614 HA GLU 79 HA GLU 79 248.276 -18.311 5.694 615 1HB GLU 79 HB2 GLU 79 247.232 -18.423 8.212 616 2HB GLU 79 HB1 GLU 79 247.497 -16.694 8.021 617 1HG GLU 79 HG2 GLU 79 246.211 -16.743 5.937 618 2HG GLU 79 HG1 GLU 79 245.917 -18.465 6.173 619 H LEU 80 HN LEU 80 248.107 -16.138 4.922 620 HA LEU 80 HA LEU 80 250.045 -14.208 5.939 621 1HB LEU 80 HB2 LEU 80 250.089 -14.561 3.002 622 2HB LEU 80 HB1 LEU 80 251.384 -14.125 4.097 623 HG LEU 80 HG LEU 80 250.389 -16.922 4.183 624 1HD1 LEU 80 HD11 LEU 80 250.538 -16.686 1.834 625 2HD1 LEU 80 HD12 LEU 80 252.030 -17.472 2.353 626 3HD1 LEU 80 HD13 LEU 80 252.030 -15.754 1.952 627 1HD2 LEU 80 HD21 LEU 80 252.876 -15.415 4.775 628 2HD2 LEU 80 HD22 LEU 80 253.031 -17.098 4.275 629 3HD2 LEU 80 HD23 LEU 80 252.076 -16.685 5.698 630 H MET 81 HN MET 81 249.927 -12.375 3.893 631 HA MET 81 HA MET 81 247.109 -11.911 3.326 632 1HB MET 81 HB2 MET 81 248.361 -10.650 5.483 633 2HB MET 81 HB1 MET 81 248.343 -9.442 4.210 634 1HG MET 81 HG2 MET 81 246.180 -9.060 4.484 635 2HG MET 81 HG1 MET 81 245.797 -10.777 4.391 636 1HE MET 81 HE1 MET 81 246.504 -11.908 8.060 637 2HE MET 81 HE2 MET 81 247.971 -11.296 7.295 638 3HE MET 81 HE3 MET 81 246.838 -12.280 6.368 639 H ASP 82 HN ASP 82 247.098 -11.656 1.196 640 HA ASP 82 HA ASP 82 249.341 -10.242 -0.072 641 1HB ASP 82 HB2 ASP 82 248.819 -12.456 -0.996 642 2HB ASP 82 HB1 ASP 82 247.161 -11.951 -1.301 643 H VAL 83 HN VAL 83 248.910 -8.097 0.041 644 HA VAL 83 HA VAL 83 246.249 -7.215 -0.858 645 HB VAL 83 HB VAL 83 246.716 -6.647 1.486 646 1HG1 VAL 83 HG11 VAL 83 248.871 -4.798 0.510 647 2HG1 VAL 83 HG12 VAL 83 249.221 -6.430 1.080 648 3HG1 VAL 83 HG13 VAL 83 248.480 -5.255 2.167 649 1HG2 VAL 83 HG21 VAL 83 245.217 -5.191 0.389 650 2HG2 VAL 83 HG22 VAL 83 246.519 -4.388 -0.490 651 3HG2 VAL 83 HG23 VAL 83 246.351 -4.150 1.250 652 H HIS 84 HN HIS 84 246.229 -6.371 -2.802 653 HA HIS 84 HA HIS 84 248.620 -5.442 -4.096 654 1HB HIS 84 HB2 HIS 84 246.324 -6.476 -5.059 655 2HB HIS 84 HB1 HIS 84 245.960 -4.763 -5.236 656 HD1 HIS 84 HD1 HIS 84 247.945 -3.395 -6.593 657 HD2 HIS 84 HD2 HIS 84 247.697 -7.506 -7.148 658 HE1 HIS 84 HE1 HIS 84 249.197 -3.862 -8.723 659 HE2 HIS 84 HE2 HIS 84 248.959 -6.344 -9.084 660 H VAL 85 HN VAL 85 248.936 -3.237 -4.872 661 HA VAL 85 HA VAL 85 247.570 -1.287 -3.126 662 HB VAL 85 HB VAL 85 250.383 -1.119 -4.234 663 1HG1 VAL 85 HG11 VAL 85 249.698 0.635 -2.030 664 2HG1 VAL 85 HG12 VAL 85 248.696 0.931 -3.451 665 3HG1 VAL 85 HG13 VAL 85 250.453 1.009 -3.580 666 1HG2 VAL 85 HG21 VAL 85 249.857 -1.270 -1.328 667 2HG2 VAL 85 HG22 VAL 85 251.192 -1.925 -2.276 668 3HG2 VAL 85 HG23 VAL 85 249.636 -2.755 -2.254 669 H PHE 86 HN PHE 86 246.102 -0.334 -4.331 670 HA PHE 86 HA PHE 86 246.725 0.432 -7.092 671 1HB PHE 86 HB2 PHE 86 244.342 -0.511 -5.699 672 2HB PHE 86 HB1 PHE 86 244.023 0.975 -6.586 673 HD1 PHE 86 HD1 PHE 86 244.359 -2.555 -6.793 674 HD2 PHE 86 HD2 PHE 86 244.698 1.032 -9.058 675 HE1 PHE 86 HE1 PHE 86 244.127 -3.851 -8.871 676 HE2 PHE 86 HE2 PHE 86 244.466 -0.258 -11.141 677 HZ PHE 86 HZ PHE 86 244.179 -2.702 -11.049 678 H CYS 87 HN CYS 87 246.271 2.522 -7.820 679 HA CYS 87 HA CYS 87 245.662 4.575 -5.809 680 1HB CYS 87 HB2 CYS 87 248.096 4.425 -7.573 681 2HB CYS 87 HB1 CYS 87 247.429 5.994 -7.136 682 HG CYS 87 HG CYS 87 249.168 5.501 -5.346 683 H THR 88 HN THR 88 243.890 5.588 -6.593 684 HA THR 88 HA THR 88 243.428 5.510 -9.477 685 HB THR 88 HB THR 88 241.706 4.735 -7.761 686 HG1 THR 88 HG1 THR 88 240.659 4.913 -9.559 687 1HG2 THR 88 HG21 THR 88 240.741 6.111 -6.340 688 2HG2 THR 88 HG22 THR 88 240.476 7.325 -7.592 689 3HG2 THR 88 HG23 THR 88 242.010 7.275 -6.723 690 H ASP 89 HN ASP 89 241.825 7.543 -9.985 691 HA ASP 89 HA ASP 89 242.788 10.058 -8.996 692 1HB ASP 89 HB2 ASP 89 244.572 9.325 -10.640 693 2HB ASP 89 HB1 ASP 89 243.345 9.417 -11.900 694 H SER 90 HN SER 90 241.125 8.342 -11.595 695 HA SER 90 HA SER 90 239.246 10.504 -12.002 696 1HB SER 90 HB2 SER 90 240.189 8.426 -13.595 697 2HB SER 90 HB1 SER 90 238.538 7.937 -13.211 698 HG SER 90 HG SER 90 238.175 9.227 -14.870 699 H ILE 91 HN ILE 91 237.971 10.753 -10.213 700 HA ILE 91 HA ILE 91 236.657 8.362 -9.142 701 HB ILE 91 HB ILE 91 236.043 9.717 -7.193 702 1HG1 ILE 91 HG12 ILE 91 237.709 11.926 -8.419 703 2HG1 ILE 91 HG11 ILE 91 235.949 11.891 -8.485 704 1HG2 ILE 91 HG21 ILE 91 238.005 8.634 -6.739 705 2HG2 ILE 91 HG22 ILE 91 238.531 10.307 -6.552 706 3HG2 ILE 91 HG23 ILE 91 238.881 9.434 -8.044 707 1HD1 ILE 91 HD11 ILE 91 236.710 13.324 -6.695 708 2HD1 ILE 91 HD12 ILE 91 237.633 11.994 -5.994 709 3HD1 ILE 91 HD13 ILE 91 235.871 11.919 -6.038 710 H GLN 92 HN GLN 92 234.376 9.046 -8.140 711 HA GLN 92 HA GLN 92 232.885 10.663 -10.064 712 1HB GLN 92 HB2 GLN 92 232.221 7.790 -9.419 713 2HB GLN 92 HB1 GLN 92 231.186 8.881 -10.330 714 1HG GLN 92 HG2 GLN 92 232.963 9.098 -12.026 715 2HG GLN 92 HG1 GLN 92 233.925 7.924 -11.128 716 1HE2 GLN 92 HE21 GLN 92 232.303 8.127 -13.808 717 2HE2 GLN 92 HE22 GLN 92 231.552 6.574 -13.895 718 H GLY 93 HN GLY 93 232.354 8.455 -7.327 719 1HA GLY 93 HA2 GLY 93 230.080 9.667 -6.300 720 2HA GLY 93 HA1 GLY 93 231.225 8.733 -5.353 721 H THR 94 HN THR 94 230.446 10.341 -3.704 722 HA THR 94 HA THR 94 232.042 12.804 -3.842 723 HB THR 94 HB THR 94 229.762 12.775 -2.004 724 HG1 THR 94 HG1 THR 94 229.360 12.693 -4.805 725 1HG2 THR 94 HG21 THR 94 230.395 14.917 -2.164 726 2HG2 THR 94 HG22 THR 94 229.379 14.905 -3.605 727 3HG2 THR 94 HG23 THR 94 231.122 14.693 -3.754 728 HA PRO 95 HA PRO 95 234.028 11.483 -0.169 729 1HB PRO 95 HB2 PRO 95 234.840 13.869 0.847 730 2HB PRO 95 HB1 PRO 95 235.627 13.100 -0.533 731 1HG PRO 95 HG2 PRO 95 233.729 15.378 -0.463 732 2HG PRO 95 HG1 PRO 95 235.075 15.064 -1.570 733 1HD PRO 95 HD2 PRO 95 232.400 14.639 -2.136 734 2HD PRO 95 HD1 PRO 95 233.755 13.897 -3.001 735 H VAL 96 HN VAL 96 231.598 11.085 0.234 736 HA VAL 96 HA VAL 96 230.271 12.862 2.047 737 HB VAL 96 HB VAL 96 229.558 9.958 1.791 738 1HG1 VAL 96 HG11 VAL 96 228.061 12.510 2.296 739 2HG1 VAL 96 HG12 VAL 96 228.201 11.087 3.330 740 3HG1 VAL 96 HG13 VAL 96 227.242 11.013 1.851 741 1HG2 VAL 96 HG21 VAL 96 229.261 12.080 -0.300 742 2HG2 VAL 96 HG22 VAL 96 228.104 10.755 -0.183 743 3HG2 VAL 96 HG23 VAL 96 229.809 10.414 -0.474 744 H GLU 97 HN GLU 97 232.376 12.849 3.353 745 HA GLU 97 HA GLU 97 233.294 10.861 4.976 746 1HB GLU 97 HB2 GLU 97 233.986 12.560 6.548 747 2HB GLU 97 HB1 GLU 97 234.166 13.187 4.916 748 1HG GLU 97 HG2 GLU 97 231.675 14.043 5.496 749 2HG GLU 97 HG1 GLU 97 232.410 14.066 7.099 750 H SER 98 HN SER 98 232.170 9.418 6.104 751 HA SER 98 HA SER 98 229.624 10.120 7.302 752 1HB SER 98 HB2 SER 98 231.009 7.644 6.546 753 2HB SER 98 HB1 SER 98 230.125 7.527 8.066 754 HG SER 98 HG SER 98 228.445 7.277 6.840 755 H ASP 99 HN ASP 99 229.432 8.663 9.538 756 HA ASP 99 HA ASP 99 230.858 10.236 11.439 757 1HB ASP 99 HB2 ASP 99 229.110 7.803 11.852 758 2HB ASP 99 HB1 ASP 99 229.664 8.888 13.122 759 H GLU 100 HN GLU 100 231.775 7.502 9.731 760 HA GLU 100 HA GLU 100 233.649 6.714 11.861 761 1HB GLU 100 HB2 GLU 100 231.830 5.119 10.504 762 2HB GLU 100 HB1 GLU 100 233.357 4.783 9.700 763 1HG GLU 100 HG2 GLU 100 233.869 4.772 12.471 764 2HG GLU 100 HG1 GLU 100 232.395 3.842 12.212 765 H MET 101 HN MET 101 233.326 7.799 8.583 766 HA MET 101 HA MET 101 236.252 7.651 8.307 767 1HB MET 101 HB2 MET 101 234.331 6.464 6.654 768 2HB MET 101 HB1 MET 101 234.887 7.876 5.764 769 1HG MET 101 HG2 MET 101 236.150 5.834 5.237 770 2HG MET 101 HG1 MET 101 237.161 7.124 5.880 771 1HE MET 101 HE1 MET 101 238.809 6.778 6.979 772 2HE MET 101 HE2 MET 101 239.370 5.145 7.342 773 3HE MET 101 HE3 MET 101 238.808 6.195 8.644 774 H ARG 102 HN ARG 102 237.167 9.297 6.827 775 HA ARG 102 HA ARG 102 235.734 11.659 6.193 776 1HB ARG 102 HB2 ARG 102 235.743 12.054 8.573 777 2HB ARG 102 HB1 ARG 102 237.461 11.701 8.677 778 1HG ARG 102 HG2 ARG 102 237.894 13.695 7.255 779 2HG ARG 102 HG1 ARG 102 236.172 14.072 7.342 780 1HD ARG 102 HD2 ARG 102 236.277 14.396 9.694 781 2HD ARG 102 HD1 ARG 102 237.906 13.725 9.777 782 HE ARG 102 HE ARG 102 238.030 15.919 8.091 783 1HH1 ARG 102 HH11 ARG 102 237.263 15.287 11.436 784 2HH1 ARG 102 HH12 ARG 102 237.796 16.841 11.982 785 1HH2 ARG 102 HH21 ARG 102 238.731 17.964 8.807 786 2HH2 ARG 102 HH22 ARG 102 238.629 18.361 10.490 787 HA PRO 103 HA PRO 103 239.641 11.204 3.865 788 1HB PRO 103 HB2 PRO 103 238.734 12.217 1.545 789 2HB PRO 103 HB1 PRO 103 238.368 10.561 2.047 790 1HG PRO 103 HG2 PRO 103 236.674 13.025 2.269 791 2HG PRO 103 HG1 PRO 103 236.217 11.402 1.717 792 1HD PRO 103 HD2 PRO 103 235.707 12.293 4.231 793 2HD PRO 103 HD1 PRO 103 236.028 10.587 3.868 794 H CYS 104 HN CYS 104 241.105 12.738 2.934 795 HA CYS 104 HA CYS 104 240.436 15.561 3.220 796 1HB CYS 104 HB2 CYS 104 242.077 14.102 5.099 797 2HB CYS 104 HB1 CYS 104 243.019 15.363 4.310 798 HG CYS 104 HG CYS 104 241.878 16.347 6.439 799 H TRP 105 HN TRP 105 241.185 16.670 1.545 800 HA TRP 105 HA TRP 105 243.093 15.385 -0.247 801 1HB TRP 105 HB2 TRP 105 241.480 17.914 -0.650 802 2HB TRP 105 HB1 TRP 105 242.409 17.063 -1.880 803 HD1 TRP 105 HD1 TRP 105 239.713 15.774 0.622 804 HE1 TRP 105 HE1 TRP 105 237.954 14.459 -0.725 805 HE3 TRP 105 HE3 TRP 105 241.634 16.432 -4.072 806 HZ2 TRP 105 HZ2 TRP 105 237.452 13.794 -3.422 807 HZ3 TRP 105 HZ3 TRP 105 240.453 15.424 -5.980 808 HH2 TRP 105 HH2 TRP 105 238.406 14.132 -5.661 809 H PHE 106 HN PHE 106 245.188 15.855 -0.112 810 HA PHE 106 HA PHE 106 245.979 18.582 0.655 811 1HB PHE 106 HB2 PHE 106 247.252 16.037 1.686 812 2HB PHE 106 HB1 PHE 106 247.808 17.671 2.025 813 HD1 PHE 106 HD1 PHE 106 246.751 15.277 3.835 814 HD2 PHE 106 HD2 PHE 106 245.137 18.971 2.471 815 HE1 PHE 106 HE1 PHE 106 245.292 15.365 5.811 816 HE2 PHE 106 HE2 PHE 106 243.672 19.065 4.446 817 HZ PHE 106 HZ PHE 106 243.749 17.260 6.121 818 H GLN 107 HN GLN 107 248.714 18.274 0.509 819 HA GLN 107 HA GLN 107 249.081 18.078 -2.353 820 1HB GLN 107 HB2 GLN 107 251.175 18.701 -0.271 821 2HB GLN 107 HB1 GLN 107 251.225 19.078 -1.987 822 1HG GLN 107 HG2 GLN 107 248.999 20.400 -1.322 823 2HG GLN 107 HG1 GLN 107 249.846 20.462 0.222 824 1HE2 GLN 107 HE21 GLN 107 249.550 22.817 -0.599 825 2HE2 GLN 107 HE22 GLN 107 250.918 23.476 -1.423 826 H LEU 108 HN LEU 108 251.040 16.965 -3.208 827 HA LEU 108 HA LEU 108 251.116 14.251 -2.164 828 1HB LEU 108 HB2 LEU 108 251.922 13.590 -4.251 829 2HB LEU 108 HB1 LEU 108 250.816 14.895 -4.632 830 HG LEU 108 HG LEU 108 253.819 15.177 -4.479 831 1HD1 LEU 108 HD11 LEU 108 251.967 14.477 -6.684 832 2HD1 LEU 108 HD12 LEU 108 253.640 13.993 -6.409 833 3HD1 LEU 108 HD13 LEU 108 253.280 15.598 -7.045 834 1HD2 LEU 108 HD21 LEU 108 252.837 17.273 -3.999 835 2HD2 LEU 108 HD22 LEU 108 251.604 17.061 -5.239 836 3HD2 LEU 108 HD23 LEU 108 253.284 17.324 -5.704 837 H ASP 109 HN ASP 109 252.678 16.829 -1.208 838 HA ASP 109 HA ASP 109 255.218 15.388 -0.844 839 1HB ASP 109 HB2 ASP 109 254.710 18.195 -1.688 840 2HB ASP 109 HB1 ASP 109 256.041 17.927 -0.566 841 H GLN 110 HN GLN 110 252.708 15.600 0.780 842 HA GLN 110 HA GLN 110 254.026 16.184 3.286 843 1HB GLN 110 HB2 GLN 110 251.618 17.721 2.332 844 2HB GLN 110 HB1 GLN 110 252.052 17.606 4.031 845 1HG GLN 110 HG2 GLN 110 253.829 18.714 1.870 846 2HG GLN 110 HG1 GLN 110 252.839 19.678 2.965 847 1HE2 GLN 110 HE21 GLN 110 253.695 20.286 4.833 848 2HE2 GLN 110 HE22 GLN 110 255.160 19.675 5.513 849 H ILE 111 HN ILE 111 252.694 13.888 1.800 850 HA ILE 111 HA ILE 111 250.363 13.252 3.351 851 HB ILE 111 HB ILE 111 251.660 10.874 2.342 852 1HG1 ILE 111 HG12 ILE 111 251.096 11.622 -0.121 853 2HG1 ILE 111 HG11 ILE 111 251.506 13.218 0.503 854 1HG2 ILE 111 HG21 ILE 111 249.171 11.924 1.154 855 2HG2 ILE 111 HG22 ILE 111 249.176 11.563 2.881 856 3HG2 ILE 111 HG23 ILE 111 249.581 10.302 1.714 857 1HD1 ILE 111 HD11 ILE 111 253.475 12.319 -0.433 858 2HD1 ILE 111 HD12 ILE 111 253.238 10.771 0.380 859 3HD1 ILE 111 HD13 ILE 111 253.661 12.205 1.317 860 HA PRO 112 HA PRO 112 252.756 11.626 6.740 861 1HB PRO 112 HB2 PRO 112 250.816 11.555 8.553 862 2HB PRO 112 HB1 PRO 112 251.372 13.106 7.909 863 1HG PRO 112 HG2 PRO 112 248.899 11.566 7.270 864 2HG PRO 112 HG1 PRO 112 249.138 13.319 7.362 865 1HD PRO 112 HD2 PRO 112 249.143 11.727 5.026 866 2HD PRO 112 HD1 PRO 112 249.629 13.429 5.153 867 H PHE 113 HN PHE 113 253.315 9.563 6.069 868 HA PHE 113 HA PHE 113 251.340 7.458 6.055 869 1HB PHE 113 HB2 PHE 113 254.123 6.571 6.021 870 2HB PHE 113 HB1 PHE 113 252.815 6.222 4.909 871 HD1 PHE 113 HD1 PHE 113 252.280 9.155 4.091 872 HD2 PHE 113 HD2 PHE 113 255.821 6.823 4.479 873 HE1 PHE 113 HE1 PHE 113 253.393 10.541 2.394 874 HE2 PHE 113 HE2 PHE 113 256.932 8.200 2.785 875 HZ PHE 113 HZ PHE 113 255.719 10.076 1.740 876 H LYS 114 HN LYS 114 253.416 8.866 8.372 877 HA LYS 114 HA LYS 114 253.916 6.645 10.026 878 1HB LYS 114 HB2 LYS 114 253.706 9.593 10.676 879 2HB LYS 114 HB1 LYS 114 254.260 8.372 11.814 880 1HG LYS 114 HG2 LYS 114 256.033 7.797 10.075 881 2HG LYS 114 HG1 LYS 114 255.585 9.315 9.295 882 1HD LYS 114 HD2 LYS 114 256.434 9.080 12.179 883 2HD LYS 114 HD1 LYS 114 257.526 9.495 10.856 884 1HE LYS 114 HE2 LYS 114 255.861 11.373 10.332 885 2HE LYS 114 HE1 LYS 114 255.202 11.058 11.936 886 1HZ LYS 114 HZ1 LYS 114 257.264 11.612 12.931 887 2HZ LYS 114 HZ2 LYS 114 256.917 12.846 11.828 888 3HZ LYS 114 HZ3 LYS 114 258.062 11.663 11.440 889 H ASP 115 HN ASP 115 251.180 8.685 9.494 890 HA ASP 115 HA ASP 115 249.807 7.542 11.791 891 1HB ASP 115 HB2 ASP 115 249.257 9.927 10.050 892 2HB ASP 115 HB1 ASP 115 247.995 9.244 11.070 893 H MET 116 HN MET 116 250.447 6.055 9.345 894 HA MET 116 HA MET 116 247.708 5.359 8.525 895 1HB MET 116 HB2 MET 116 250.201 5.285 6.817 896 2HB MET 116 HB1 MET 116 248.616 4.715 6.319 897 1HG MET 116 HG2 MET 116 247.943 7.192 6.978 898 2HG MET 116 HG1 MET 116 249.639 7.474 6.617 899 1HE MET 116 HE1 MET 116 250.459 7.434 3.602 900 2HE MET 116 HE2 MET 116 249.917 5.819 3.146 901 3HE MET 116 HE3 MET 116 250.667 6.087 4.720 902 H TRP 117 HN TRP 117 250.871 3.864 7.908 903 HA TRP 117 HA TRP 117 250.359 1.683 9.700 904 1HB TRP 117 HB2 TRP 117 249.571 1.497 6.900 905 2HB TRP 117 HB1 TRP 117 250.718 0.240 7.347 906 HD1 TRP 117 HD1 TRP 117 249.454 0.086 10.438 907 HE1 TRP 117 HE1 TRP 117 247.283 -1.266 10.721 908 HE3 TRP 117 HE3 TRP 117 247.858 0.090 5.581 909 HZ2 TRP 117 HZ2 TRP 117 245.173 -2.206 9.099 910 HZ3 TRP 117 HZ3 TRP 117 245.753 -1.058 5.032 911 HH2 TRP 117 HH2 TRP 117 244.440 -2.182 6.755 912 HA PRO 118 HA PRO 118 254.735 1.174 9.293 913 1HB PRO 118 HB2 PRO 118 255.143 -1.401 9.802 914 2HB PRO 118 HB1 PRO 118 254.402 -0.349 11.013 915 1HG PRO 118 HG2 PRO 118 253.096 -2.291 9.143 916 2HG PRO 118 HG1 PRO 118 252.780 -2.013 10.864 917 1HD PRO 118 HD2 PRO 118 251.283 -0.946 8.815 918 2HD PRO 118 HD1 PRO 118 251.398 -0.245 10.441 919 H ASP 119 HN ASP 119 253.014 0.546 6.724 920 HA ASP 119 HA ASP 119 255.259 -0.673 5.269 921 1HB ASP 119 HB2 ASP 119 252.356 -1.145 4.584 922 2HB ASP 119 HB1 ASP 119 253.766 -1.942 3.893 923 H ASP 120 HN ASP 120 252.673 1.661 5.344 924 HA ASP 120 HA ASP 120 252.404 2.557 2.803 925 1HB ASP 120 HB2 ASP 120 252.612 4.183 5.328 926 2HB ASP 120 HB1 ASP 120 252.101 4.852 3.780 927 H SER 121 HN SER 121 254.920 3.787 5.012 928 HA SER 121 HA SER 121 256.201 5.451 3.170 929 1HB SER 121 HB2 SER 121 256.527 5.329 5.698 930 2HB SER 121 HB1 SER 121 257.629 3.988 5.389 931 HG SER 121 HG SER 121 258.186 6.544 5.310 932 H TYR 122 HN TYR 122 256.202 2.015 3.313 933 HA TYR 122 HA TYR 122 258.749 1.724 2.000 934 1HB TYR 122 HB2 TYR 122 256.627 -0.261 2.796 935 2HB TYR 122 HB1 TYR 122 258.096 -0.713 1.940 936 HD1 TYR 122 HD1 TYR 122 260.204 -0.825 3.072 937 HD2 TYR 122 HD2 TYR 122 256.756 0.614 5.106 938 HE1 TYR 122 HE1 TYR 122 261.406 -0.983 5.211 939 HE2 TYR 122 HE2 TYR 122 257.948 0.460 7.250 940 HH TYR 122 HH TYR 122 261.318 -0.038 7.448 941 H TRP 123 HN TRP 123 255.393 1.925 1.017 942 HA TRP 123 HA TRP 123 256.270 1.203 -1.691 943 1HB TRP 123 HB2 TRP 123 253.922 0.619 -2.194 944 2HB TRP 123 HB1 TRP 123 254.627 -0.371 -0.926 945 HD1 TRP 123 HD1 TRP 123 253.669 -0.028 1.567 946 HE1 TRP 123 HE1 TRP 123 251.413 0.893 2.399 947 HE3 TRP 123 HE3 TRP 123 252.145 2.361 -2.689 948 HZ2 TRP 123 HZ2 TRP 123 249.267 2.444 1.384 949 HZ3 TRP 123 HZ3 TRP 123 249.975 3.525 -2.671 950 HH2 TRP 123 HH2 TRP 123 248.574 3.552 -0.684 951 H PHE 124 HN PHE 124 254.981 3.773 0.181 952 HA PHE 124 HA PHE 124 253.662 5.161 -1.902 953 1HB PHE 124 HB2 PHE 124 253.940 5.528 0.818 954 2HB PHE 124 HB1 PHE 124 254.849 6.877 0.150 955 HD1 PHE 124 HD1 PHE 124 253.290 8.483 1.074 956 HD2 PHE 124 HD2 PHE 124 251.962 5.513 -1.664 957 HE1 PHE 124 HE1 PHE 124 251.213 9.722 0.757 958 HE2 PHE 124 HE2 PHE 124 249.872 6.761 -1.996 959 HZ PHE 124 HZ PHE 124 249.491 8.868 -0.783 960 HA PRO 125 HA PRO 125 257.937 7.633 -2.156 961 1HB PRO 125 HB2 PRO 125 259.663 5.254 -1.673 962 2HB PRO 125 HB1 PRO 125 259.925 6.945 -1.230 963 1HG PRO 125 HG2 PRO 125 259.213 5.157 0.604 964 2HG PRO 125 HG1 PRO 125 258.559 6.804 0.637 965 1HD PRO 125 HD2 PRO 125 257.255 4.264 -0.240 966 2HD PRO 125 HD1 PRO 125 256.555 5.661 0.603 967 H LEU 126 HN LEU 126 257.553 4.227 -3.040 968 HA LEU 126 HA LEU 126 258.946 4.501 -5.531 969 1HB LEU 126 HB2 LEU 126 257.335 2.347 -4.219 970 2HB LEU 126 HB1 LEU 126 257.699 2.228 -5.931 971 HG LEU 126 HG LEU 126 259.975 2.763 -4.102 972 1HD1 LEU 126 HD11 LEU 126 258.231 0.726 -3.441 973 2HD1 LEU 126 HD12 LEU 126 259.920 0.858 -2.955 974 3HD1 LEU 126 HD13 LEU 126 259.485 -0.081 -4.383 975 1HD2 LEU 126 HD21 LEU 126 259.787 0.789 -6.353 976 2HD2 LEU 126 HD22 LEU 126 261.211 1.611 -5.717 977 3HD2 LEU 126 HD23 LEU 126 260.018 2.511 -6.654 978 H LEU 127 HN LEU 127 255.658 4.751 -4.410 979 HA LEU 127 HA LEU 127 254.328 4.598 -6.885 980 1HB LEU 127 HB2 LEU 127 253.603 6.147 -4.397 981 2HB LEU 127 HB1 LEU 127 252.522 5.853 -5.742 982 HG LEU 127 HG LEU 127 253.185 4.154 -3.480 983 1HD1 LEU 127 HD11 LEU 127 251.008 4.307 -5.534 984 2HD1 LEU 127 HD12 LEU 127 250.949 4.767 -3.833 985 3HD1 LEU 127 HD13 LEU 127 251.049 3.065 -4.285 986 1HD2 LEU 127 HD21 LEU 127 253.073 2.027 -4.737 987 2HD2 LEU 127 HD22 LEU 127 254.555 2.929 -5.047 988 3HD2 LEU 127 HD23 LEU 127 253.255 2.935 -6.238 989 H LEU 128 HN LEU 128 255.496 7.354 -4.993 990 HA LEU 128 HA LEU 128 254.788 9.387 -6.787 991 1HB LEU 128 HB2 LEU 128 256.730 9.115 -4.549 992 2HB LEU 128 HB1 LEU 128 256.921 10.486 -5.626 993 HG LEU 128 HG LEU 128 254.196 10.027 -4.560 994 1HD1 LEU 128 HD11 LEU 128 256.056 11.474 -2.761 995 2HD1 LEU 128 HD12 LEU 128 256.080 9.711 -2.717 996 3HD1 LEU 128 HD13 LEU 128 254.581 10.580 -2.389 997 1HD2 LEU 128 HD21 LEU 128 254.036 12.351 -4.695 998 2HD2 LEU 128 HD22 LEU 128 255.030 11.915 -6.085 999 3HD2 LEU 128 HD23 LEU 128 255.785 12.570 -4.632 1000 H GLN 129 HN GLN 129 257.400 7.116 -6.806 1001 HA GLN 129 HA GLN 129 258.974 8.563 -8.747 1002 1HB GLN 129 HB2 GLN 129 259.316 6.228 -7.048 1003 2HB GLN 129 HB1 GLN 129 259.901 5.938 -8.681 1004 1HG GLN 129 HG2 GLN 129 261.649 6.770 -7.174 1005 2HG GLN 129 HG1 GLN 129 261.368 7.838 -8.548 1006 1HE2 GLN 129 HE21 GLN 129 260.864 9.906 -8.182 1007 2HE2 GLN 129 HE22 GLN 129 260.572 10.596 -6.625 1008 H LYS 130 HN LYS 130 256.128 7.042 -9.033 1009 HA LYS 130 HA LYS 130 254.952 6.049 -10.685 1010 1HB LYS 130 HB2 LYS 130 255.223 6.893 -12.849 1011 2HB LYS 130 HB1 LYS 130 255.835 8.169 -11.812 1012 1HG LYS 130 HG2 LYS 130 257.919 6.321 -12.661 1013 2HG LYS 130 HG1 LYS 130 257.098 7.106 -14.008 1014 1HD LYS 130 HD2 LYS 130 257.834 9.186 -13.428 1015 2HD LYS 130 HD1 LYS 130 257.900 8.802 -11.707 1016 1HE LYS 130 HE2 LYS 130 260.120 8.738 -12.029 1017 2HE LYS 130 HE1 LYS 130 259.805 7.137 -12.697 1018 1HZ LYS 130 HZ1 LYS 130 261.153 8.361 -14.221 1019 2HZ LYS 130 HZ2 LYS 130 260.086 9.673 -14.214 1020 3HZ LYS 130 HZ3 LYS 130 259.612 8.203 -14.904 1021 H LYS 131 HN LYS 131 256.886 4.438 -9.399 1022 HA LYS 131 HA LYS 131 257.617 2.597 -11.584 1023 1HB LYS 131 HB2 LYS 131 258.996 3.246 -8.996 1024 2HB LYS 131 HB1 LYS 131 259.257 1.693 -9.778 1025 1HG LYS 131 HG2 LYS 131 259.696 3.300 -11.867 1026 2HG LYS 131 HG1 LYS 131 260.165 4.389 -10.561 1027 1HD LYS 131 HD2 LYS 131 261.202 1.574 -10.758 1028 2HD LYS 131 HD1 LYS 131 261.997 2.929 -11.560 1029 1HE LYS 131 HE2 LYS 131 262.131 4.065 -9.340 1030 2HE LYS 131 HE1 LYS 131 261.512 2.587 -8.604 1031 1HZ LYS 131 HZ1 LYS 131 263.441 1.451 -9.049 1032 2HZ LYS 131 HZ2 LYS 131 264.051 2.997 -8.738 1033 3HZ LYS 131 HZ3 LYS 131 263.888 2.458 -10.333 1034 H LYS 132 HN LYS 132 257.370 0.331 -11.169 1035 HA LYS 132 HA LYS 132 255.269 -0.217 -9.185 1036 1HB LYS 132 HB2 LYS 132 255.983 -1.708 -11.718 1037 2HB LYS 132 HB1 LYS 132 254.720 -2.184 -10.591 1038 1HG LYS 132 HG2 LYS 132 253.993 0.369 -11.108 1039 2HG LYS 132 HG1 LYS 132 254.730 -0.088 -12.645 1040 1HD LYS 132 HD2 LYS 132 252.692 -1.820 -11.271 1041 2HD LYS 132 HD1 LYS 132 252.229 -0.521 -12.373 1042 1HE LYS 132 HE2 LYS 132 253.664 -1.571 -14.112 1043 2HE LYS 132 HE1 LYS 132 253.946 -2.916 -13.008 1044 1HZ LYS 132 HZ1 LYS 132 251.191 -2.129 -13.680 1045 2HZ LYS 132 HZ2 LYS 132 251.783 -3.637 -13.194 1046 3HZ LYS 132 HZ3 LYS 132 252.079 -3.079 -14.764 1047 H PHE 133 HN PHE 133 255.630 -1.614 -7.569 1048 HA PHE 133 HA PHE 133 257.766 -3.573 -7.771 1049 1HB PHE 133 HB2 PHE 133 259.147 -2.761 -6.135 1050 2HB PHE 133 HB1 PHE 133 258.536 -1.235 -6.764 1051 HD1 PHE 133 HD1 PHE 133 259.299 -2.872 -3.862 1052 HD2 PHE 133 HD2 PHE 133 256.137 -0.617 -5.598 1053 HE1 PHE 133 HE1 PHE 133 258.488 -2.288 -1.615 1054 HE2 PHE 133 HE2 PHE 133 255.322 -0.025 -3.356 1055 HZ PHE 133 HZ PHE 133 256.497 -0.861 -1.359 1056 H HIS 134 HN HIS 134 257.861 -4.900 -5.687 1057 HA HIS 134 HA HIS 134 255.210 -5.144 -4.445 1058 1HB HIS 134 HB2 HIS 134 256.809 -7.591 -5.154 1059 2HB HIS 134 HB1 HIS 134 255.091 -7.461 -4.794 1060 HD1 HIS 134 HD1 HIS 134 254.411 -5.208 -6.849 1061 HD2 HIS 134 HD2 HIS 134 256.632 -8.618 -7.686 1062 HE1 HIS 134 HE1 HIS 134 254.206 -5.551 -9.331 1063 HE2 HIS 134 HE2 HIS 134 255.488 -7.669 -9.802 1064 H GLY 135 HN GLY 135 255.354 -5.152 -2.272 1065 1HA GLY 135 HA2 GLY 135 257.997 -5.792 -1.121 1066 2HA GLY 135 HA1 GLY 135 256.890 -4.613 -0.439 1067 H TYR 136 HN TYR 136 258.192 -7.272 0.440 1068 HA TYR 136 HA TYR 136 255.716 -8.514 1.442 1069 1HB TYR 136 HB2 TYR 136 258.378 -9.714 0.714 1070 2HB TYR 136 HB1 TYR 136 257.277 -10.542 1.809 1071 HD1 TYR 136 HD1 TYR 136 256.092 -12.233 0.800 1072 HD2 TYR 136 HD2 TYR 136 256.942 -8.721 -1.446 1073 HE1 TYR 136 HE1 TYR 136 254.883 -13.176 -1.123 1074 HE2 TYR 136 HE2 TYR 136 255.736 -9.655 -3.374 1075 HH TYR 136 HH TYR 136 253.949 -11.345 -3.786 1076 H PHE 137 HN PHE 137 255.353 -7.980 3.485 1077 HA PHE 137 HA PHE 137 257.670 -7.549 5.253 1078 1HB PHE 137 HB2 PHE 137 254.870 -6.471 5.614 1079 2HB PHE 137 HB1 PHE 137 256.305 -6.040 6.540 1080 HD1 PHE 137 HD1 PHE 137 257.795 -4.383 5.785 1081 HD2 PHE 137 HD2 PHE 137 254.711 -5.800 3.219 1082 HE1 PHE 137 HE1 PHE 137 258.264 -2.549 4.215 1083 HE2 PHE 137 HE2 PHE 137 255.175 -3.968 1.643 1084 HZ PHE 137 HZ PHE 137 256.954 -2.339 2.141 1085 H LYS 138 HN LYS 138 257.929 -8.840 6.959 1086 HA LYS 138 HA LYS 138 255.948 -10.893 7.508 1087 1HB LYS 138 HB2 LYS 138 258.778 -10.716 7.678 1088 2HB LYS 138 HB1 LYS 138 258.175 -11.008 9.302 1089 1HG LYS 138 HG2 LYS 138 256.771 -12.869 8.113 1090 2HG LYS 138 HG1 LYS 138 258.018 -12.725 6.875 1091 1HD LYS 138 HD2 LYS 138 259.585 -13.695 8.168 1092 2HD LYS 138 HD1 LYS 138 259.028 -12.873 9.628 1093 1HE LYS 138 HE2 LYS 138 257.428 -14.492 10.081 1094 2HE LYS 138 HE1 LYS 138 257.398 -15.068 8.415 1095 1HZ LYS 138 HZ1 LYS 138 258.546 -16.529 10.109 1096 2HZ LYS 138 HZ2 LYS 138 259.783 -15.377 10.140 1097 3HZ LYS 138 HZ3 LYS 138 259.419 -16.188 8.701 1098 H PHE 139 HN PHE 139 254.451 -10.618 9.069 1099 HA PHE 139 HA PHE 139 254.922 -8.473 11.007 1100 1HB PHE 139 HB2 PHE 139 252.478 -8.533 11.400 1101 2HB PHE 139 HB1 PHE 139 252.916 -8.139 9.746 1102 HD1 PHE 139 HD1 PHE 139 252.881 -10.199 8.087 1103 HD2 PHE 139 HD2 PHE 139 250.827 -10.015 11.807 1104 HE1 PHE 139 HE1 PHE 139 251.293 -11.907 7.299 1105 HE2 PHE 139 HE2 PHE 139 249.242 -11.722 11.024 1106 HZ PHE 139 HZ PHE 139 249.474 -12.668 8.763 1107 H GLN 140 HN GLN 140 254.209 -8.706 13.189 1108 HA GLN 140 HA GLN 140 254.601 -11.439 14.198 1109 1HB GLN 140 HB2 GLN 140 256.055 -10.556 15.650 1110 2HB GLN 140 HB1 GLN 140 255.862 -9.011 14.842 1111 1HG GLN 140 HG2 GLN 140 253.929 -8.569 16.391 1112 2HG GLN 140 HG1 GLN 140 254.422 -10.008 17.283 1113 1HE2 GLN 140 HE21 GLN 140 254.315 -7.379 18.323 1114 2HE2 GLN 140 HE22 GLN 140 255.922 -6.920 18.762 1115 H GLY 141 HN GLY 141 252.116 -9.596 13.427 1116 1HA GLY 141 HA2 GLY 141 250.250 -10.914 15.068 1117 2HA GLY 141 HA1 GLY 141 250.542 -9.316 15.732 1118 H GLN 142 HN GLN 142 250.734 -7.695 13.623 1119 HA GLN 142 HA GLN 142 249.113 -7.987 11.432 1120 1HB GLN 142 HB2 GLN 142 247.572 -7.658 13.897 1121 2HB GLN 142 HB1 GLN 142 247.175 -6.457 12.675 1122 1HG GLN 142 HG2 GLN 142 247.345 -9.233 11.721 1123 2HG GLN 142 HG1 GLN 142 246.029 -8.882 12.839 1124 1HE2 GLN 142 HE21 GLN 142 245.626 -9.636 10.191 1125 2HE2 GLN 142 HE22 GLN 142 244.921 -8.310 9.337 1126 H ASP 143 HN ASP 143 250.155 -5.883 14.028 1127 HA ASP 143 HA ASP 143 250.313 -3.653 12.110 1128 1HB ASP 143 HB2 ASP 143 249.898 -3.680 15.093 1129 2HB ASP 143 HB1 ASP 143 250.438 -2.234 14.246 1130 H THR 144 HN THR 144 252.113 -5.767 14.139 1131 HA THR 144 HA THR 144 254.466 -4.042 14.096 1132 HB THR 144 HB THR 144 253.883 -6.667 15.446 1133 HG1 THR 144 HG1 THR 144 254.374 -4.030 16.334 1134 1HG2 THR 144 HG21 THR 144 256.493 -5.341 14.996 1135 2HG2 THR 144 HG22 THR 144 256.096 -7.054 15.118 1136 3HG2 THR 144 HG23 THR 144 256.179 -6.063 16.574 1137 H ILE 145 HN ILE 145 256.131 -4.293 12.768 1138 HA ILE 145 HA ILE 145 256.125 -6.653 11.020 1139 HB ILE 145 HB ILE 145 257.415 -3.985 10.447 1140 1HG1 ILE 145 HG12 ILE 145 254.871 -5.189 9.330 1141 2HG1 ILE 145 HG11 ILE 145 254.958 -3.823 10.438 1142 1HG2 ILE 145 HG21 ILE 145 258.605 -5.692 9.317 1143 2HG2 ILE 145 HG22 ILE 145 257.532 -4.968 8.119 1144 3HG2 ILE 145 HG23 ILE 145 257.120 -6.520 8.850 1145 1HD1 ILE 145 HD11 ILE 145 254.588 -2.988 8.240 1146 2HD1 ILE 145 HD12 ILE 145 255.933 -3.930 7.597 1147 3HD1 ILE 145 HD13 ILE 145 256.242 -2.589 8.701 1148 H LEU 146 HN LEU 146 257.843 -7.956 10.968 1149 HA LEU 146 HA LEU 146 260.182 -7.175 12.575 1150 1HB LEU 146 HB2 LEU 146 259.338 -10.002 11.986 1151 2HB LEU 146 HB1 LEU 146 260.475 -9.443 13.200 1152 HG LEU 146 HG LEU 146 257.561 -8.706 13.312 1153 1HD1 LEU 146 HD11 LEU 146 257.958 -10.670 15.210 1154 2HD1 LEU 146 HD12 LEU 146 258.768 -11.301 13.777 1155 3HD1 LEU 146 HD13 LEU 146 257.068 -10.839 13.697 1156 1HD2 LEU 146 HD21 LEU 146 259.618 -7.678 14.675 1157 2HD2 LEU 146 HD22 LEU 146 259.258 -9.062 15.706 1158 3HD2 LEU 146 HD23 LEU 146 258.006 -7.868 15.367 1159 H ASP 147 HN ASP 147 259.096 -7.831 9.464 1160 HA ASP 147 HA ASP 147 261.792 -7.793 8.435 1161 1HB ASP 147 HB2 ASP 147 260.420 -10.264 8.706 1162 2HB ASP 147 HB1 ASP 147 260.439 -9.870 6.989 1163 H TYR 148 HN TYR 148 261.904 -6.826 6.431 1164 HA TYR 148 HA TYR 148 259.395 -6.461 4.970 1165 1HB TYR 148 HB2 TYR 148 259.731 -4.088 4.699 1166 2HB TYR 148 HB1 TYR 148 259.698 -4.480 6.414 1167 HD1 TYR 148 HD1 TYR 148 261.617 -4.118 7.801 1168 HD2 TYR 148 HD2 TYR 148 261.867 -3.496 3.600 1169 HE1 TYR 148 HE1 TYR 148 263.777 -2.985 8.104 1170 HE2 TYR 148 HE2 TYR 148 264.030 -2.362 3.891 1171 HH TYR 148 HH TYR 148 265.830 -2.527 6.700 1172 H THR 149 HN THR 149 259.590 -6.643 2.816 1173 HA THR 149 HA THR 149 262.287 -6.437 1.658 1174 HB THR 149 HB THR 149 260.970 -8.283 0.063 1175 HG1 THR 149 HG1 THR 149 260.567 -8.964 2.785 1176 1HG2 THR 149 HG21 THR 149 263.345 -8.162 1.481 1177 2HG2 THR 149 HG22 THR 149 262.843 -9.420 0.351 1178 3HG2 THR 149 HG23 THR 149 262.539 -9.613 2.078 1179 H LEU 150 HN LEU 150 262.414 -5.608 -0.400 1180 HA LEU 150 HA LEU 150 259.922 -4.695 -1.646 1181 1HB LEU 150 HB2 LEU 150 262.376 -2.996 -1.195 1182 2HB LEU 150 HB1 LEU 150 260.990 -2.522 -2.160 1183 HG LEU 150 HG LEU 150 259.748 -3.095 0.166 1184 1HD1 LEU 150 HD11 LEU 150 262.016 -3.591 1.171 1185 2HD1 LEU 150 HD12 LEU 150 261.001 -2.445 2.047 1186 3HD1 LEU 150 HD13 LEU 150 262.338 -1.861 1.055 1187 1HD2 LEU 150 HD21 LEU 150 260.033 -0.921 -1.350 1188 2HD2 LEU 150 HD22 LEU 150 260.992 -0.410 0.039 1189 3HD2 LEU 150 HD23 LEU 150 259.303 -0.871 0.255 1190 H ARG 151 HN ARG 151 259.816 -5.293 -3.708 1191 HA ARG 151 HA ARG 151 262.333 -5.638 -5.200 1192 1HB ARG 151 HB2 ARG 151 259.898 -7.409 -5.454 1193 2HB ARG 151 HB1 ARG 151 261.429 -7.599 -6.298 1194 1HG ARG 151 HG2 ARG 151 261.341 -7.642 -3.312 1195 2HG ARG 151 HG1 ARG 151 260.915 -9.079 -4.244 1196 1HD ARG 151 HD2 ARG 151 263.133 -9.486 -4.071 1197 2HD ARG 151 HD1 ARG 151 263.204 -8.417 -5.472 1198 HE ARG 151 HE ARG 151 263.412 -6.713 -3.382 1199 1HH1 ARG 151 HH11 ARG 151 265.125 -9.621 -4.268 1200 2HH1 ARG 151 HH12 ARG 151 266.607 -9.124 -3.522 1201 1HH2 ARG 151 HH21 ARG 151 265.360 -6.058 -2.402 1202 2HH2 ARG 151 HH22 ARG 151 266.741 -7.102 -2.463 1203 H GLU 152 HN GLU 152 262.422 -4.335 -6.900 1204 HA GLU 152 HA GLU 152 260.037 -3.032 -7.878 1205 1HB GLU 152 HB2 GLU 152 261.570 -1.765 -9.310 1206 2HB GLU 152 HB1 GLU 152 262.099 -1.748 -7.633 1207 1HG GLU 152 HG2 GLU 152 263.738 -3.497 -8.143 1208 2HG GLU 152 HG1 GLU 152 263.219 -3.477 -9.828 1209 H VAL 153 HN VAL 153 259.077 -3.289 -9.852 1210 HA VAL 153 HA VAL 153 260.089 -5.488 -11.537 1211 HB VAL 153 HB VAL 153 257.708 -5.979 -12.116 1212 1HG1 VAL 153 HG11 VAL 153 257.829 -6.356 -9.190 1213 2HG1 VAL 153 HG12 VAL 153 259.202 -6.960 -10.117 1214 3HG1 VAL 153 HG13 VAL 153 257.574 -7.533 -10.478 1215 1HG2 VAL 153 HG21 VAL 153 256.853 -3.745 -11.370 1216 2HG2 VAL 153 HG22 VAL 153 257.038 -4.299 -9.706 1217 3HG2 VAL 153 HG23 VAL 153 255.919 -5.125 -10.791 1218 H ASP 154 HN ASP 154 258.897 -5.405 -13.763 1219 HA ASP 154 HA ASP 154 258.631 -4.340 -15.755 1220 1HB ASP 154 HB2 ASP 154 256.909 -3.099 -14.138 1221 2HB ASP 154 HB1 ASP 154 257.980 -1.738 -14.461 1222 H THR 155 HN THR 155 261.211 -4.384 -14.578 1223 HA THR 155 HA THR 155 262.442 -1.809 -14.902 1224 HB THR 155 HB THR 155 263.375 -3.397 -13.316 1225 HG1 THR 155 HG1 THR 155 265.154 -3.113 -15.502 1226 1HG2 THR 155 HG21 THR 155 262.884 -5.345 -15.186 1227 2HG2 THR 155 HG22 THR 155 263.821 -5.536 -13.704 1228 3HG2 THR 155 HG23 THR 155 264.638 -5.177 -15.225 1229 H VAL 156 HN VAL 156 262.060 -1.111 -16.987 1230 HA VAL 156 HA VAL 156 263.283 -2.722 -19.133 1231 HB VAL 156 HB VAL 156 261.169 -0.597 -19.489 1232 1HG1 VAL 156 HG11 VAL 156 260.913 -1.795 -21.704 1233 2HG1 VAL 156 HG12 VAL 156 262.427 -2.618 -21.326 1234 3HG1 VAL 156 HG13 VAL 156 262.395 -0.863 -21.490 1235 1HG2 VAL 156 HG21 VAL 156 259.516 -2.274 -19.622 1236 2HG2 VAL 156 HG22 VAL 156 260.438 -2.634 -18.162 1237 3HG2 VAL 156 HG23 VAL 156 260.716 -3.566 -19.634 Start of MODEL 29 1 1H MET 1 HT1 MET 1 238.415 -25.142 3.767 2 2H MET 1 HT2 MET 1 237.905 -24.350 2.333 3 3H MET 1 HT3 MET 1 238.432 -23.431 3.683 4 HA MET 1 HA MET 1 240.605 -24.591 3.451 5 1HB MET 1 HB2 MET 1 239.174 -25.389 0.927 6 2HB MET 1 HB1 MET 1 240.928 -25.292 0.985 7 1HG MET 1 HG2 MET 1 240.765 -27.452 1.553 8 2HG MET 1 HG1 MET 1 240.473 -26.798 3.163 9 1HE MET 1 HE1 MET 1 239.095 -27.496 4.481 10 2HE MET 1 HE2 MET 1 238.377 -29.064 4.107 11 3HE MET 1 HE3 MET 1 237.349 -27.642 4.280 12 H GLY 2 HN GLY 2 242.274 -23.385 2.417 13 1HA GLY 2 HA2 GLY 2 242.572 -21.668 0.529 14 2HA GLY 2 HA1 GLY 2 241.309 -20.799 1.387 15 H ALA 3 HN ALA 3 243.883 -19.768 0.850 16 HA ALA 3 HA ALA 3 244.653 -19.042 3.532 17 1HB ALA 3 HB1 ALA 3 246.907 -19.768 3.471 18 2HB ALA 3 HB2 ALA 3 246.778 -20.253 1.781 19 3HB ALA 3 HB3 ALA 3 245.923 -21.162 3.027 20 H SER 4 HN SER 4 246.966 -17.736 3.135 21 HA SER 4 HA SER 4 247.779 -15.725 2.439 22 1HB SER 4 HB2 SER 4 248.156 -15.470 0.107 23 2HB SER 4 HB1 SER 4 248.196 -17.206 0.413 24 HG SER 4 HG SER 4 246.613 -17.395 -0.937 25 H ARG 5 HN ARG 5 246.345 -14.476 3.614 26 HA ARG 5 HA ARG 5 243.792 -13.710 2.724 27 1HB ARG 5 HB2 ARG 5 245.624 -12.954 4.866 28 2HB ARG 5 HB1 ARG 5 244.696 -11.588 4.265 29 1HG ARG 5 HG2 ARG 5 243.480 -12.512 6.067 30 2HG ARG 5 HG1 ARG 5 242.630 -12.970 4.590 31 1HD ARG 5 HD2 ARG 5 244.350 -15.059 4.910 32 2HD ARG 5 HD1 ARG 5 243.992 -14.635 6.584 33 HE ARG 5 HE ARG 5 242.276 -15.976 4.792 34 1HH1 ARG 5 HH11 ARG 5 242.224 -13.523 7.275 35 2HH1 ARG 5 HH12 ARG 5 240.580 -13.832 7.721 36 1HH2 ARG 5 HH21 ARG 5 240.114 -16.384 5.379 37 2HH2 ARG 5 HH22 ARG 5 239.382 -15.458 6.646 38 H LEU 6 HN LEU 6 243.754 -13.033 0.641 39 HA LEU 6 HA LEU 6 245.573 -10.968 -0.272 40 1HB LEU 6 HB2 LEU 6 244.521 -12.999 -1.605 41 2HB LEU 6 HB1 LEU 6 243.223 -11.853 -1.883 42 HG LEU 6 HG LEU 6 246.036 -11.039 -2.490 43 1HD1 LEU 6 HD11 LEU 6 245.896 -13.161 -3.586 44 2HD1 LEU 6 HD12 LEU 6 245.701 -11.896 -4.800 45 3HD1 LEU 6 HD13 LEU 6 244.292 -12.785 -4.218 46 1HD2 LEU 6 HD21 LEU 6 243.671 -10.401 -4.170 47 2HD2 LEU 6 HD22 LEU 6 245.076 -9.413 -3.771 48 3HD2 LEU 6 HD23 LEU 6 243.789 -9.633 -2.587 49 H TYR 7 HN TYR 7 245.212 -8.923 0.111 50 HA TYR 7 HA TYR 7 242.441 -7.936 0.221 51 1HB TYR 7 HB2 TYR 7 244.814 -7.266 1.943 52 2HB TYR 7 HB1 TYR 7 243.469 -6.143 1.773 53 HD1 TYR 7 HD1 TYR 7 241.981 -6.193 3.524 54 HD2 TYR 7 HD2 TYR 7 243.862 -9.823 2.350 55 HE1 TYR 7 HE1 TYR 7 240.759 -7.389 5.290 56 HE2 TYR 7 HE2 TYR 7 242.643 -11.031 4.111 57 HH TYR 7 HH TYR 7 240.330 -10.576 5.393 58 H THR 8 HN THR 8 242.626 -5.353 0.144 59 HA THR 8 HA THR 8 244.362 -4.651 -2.135 60 HB THR 8 HB THR 8 242.493 -3.280 -3.005 61 HG1 THR 8 HG1 THR 8 240.893 -4.652 -1.119 62 1HG2 THR 8 HG21 THR 8 242.229 -6.226 -2.777 63 2HG2 THR 8 HG22 THR 8 242.508 -5.218 -4.196 64 3HG2 THR 8 HG23 THR 8 240.901 -5.302 -3.478 65 H LEU 9 HN LEU 9 244.471 -2.243 -2.441 66 HA LEU 9 HA LEU 9 244.013 -0.606 -0.106 67 1HB LEU 9 HB2 LEU 9 246.235 -1.865 0.203 68 2HB LEU 9 HB1 LEU 9 246.842 -0.869 -1.105 69 HG LEU 9 HG LEU 9 245.795 0.136 1.534 70 1HD1 LEU 9 HD11 LEU 9 248.573 -0.136 0.421 71 2HD1 LEU 9 HD12 LEU 9 247.912 -0.879 1.878 72 3HD1 LEU 9 HD13 LEU 9 248.175 0.864 1.819 73 1HD2 LEU 9 HD21 LEU 9 245.287 1.793 -0.058 74 2HD2 LEU 9 HD22 LEU 9 246.819 1.561 -0.900 75 3HD2 LEU 9 HD23 LEU 9 246.795 2.305 0.699 76 H VAL 10 HN VAL 10 243.022 1.047 -1.151 77 HA VAL 10 HA VAL 10 244.245 2.024 -3.626 78 HB VAL 10 HB VAL 10 242.081 1.405 -4.163 79 1HG1 VAL 10 HG11 VAL 10 240.154 2.368 -2.656 80 2HG1 VAL 10 HG12 VAL 10 241.422 2.246 -1.438 81 3HG1 VAL 10 HG13 VAL 10 240.929 0.816 -2.346 82 1HG2 VAL 10 HG21 VAL 10 241.810 4.312 -3.440 83 2HG2 VAL 10 HG22 VAL 10 240.850 3.439 -4.631 84 3HG2 VAL 10 HG23 VAL 10 242.571 3.693 -4.906 85 H LEU 11 HN LEU 11 245.232 3.839 -3.617 86 HA LEU 11 HA LEU 11 244.475 5.915 -1.675 87 1HB LEU 11 HB2 LEU 11 246.958 4.519 -1.961 88 2HB LEU 11 HB1 LEU 11 247.209 6.194 -2.409 89 HG LEU 11 HG LEU 11 246.326 5.087 0.252 90 1HD1 LEU 11 HD11 LEU 11 248.778 6.137 -0.821 91 2HD1 LEU 11 HD12 LEU 11 248.477 5.371 0.736 92 3HD1 LEU 11 HD13 LEU 11 248.246 7.110 0.551 93 1HD2 LEU 11 HD21 LEU 11 245.814 7.770 -0.904 94 2HD2 LEU 11 HD22 LEU 11 246.298 7.675 0.788 95 3HD2 LEU 11 HD23 LEU 11 244.857 6.823 0.234 96 H VAL 12 HN VAL 12 243.590 7.509 -2.828 97 HA VAL 12 HA VAL 12 244.136 7.845 -5.617 98 HB VAL 12 HB VAL 12 242.644 9.774 -3.847 99 1HG1 VAL 12 HG11 VAL 12 242.657 10.876 -5.812 100 2HG1 VAL 12 HG12 VAL 12 241.375 9.742 -6.234 101 3HG1 VAL 12 HG13 VAL 12 243.034 9.427 -6.741 102 1HG2 VAL 12 HG21 VAL 12 241.359 7.971 -3.376 103 2HG2 VAL 12 HG22 VAL 12 241.932 7.065 -4.775 104 3HG2 VAL 12 HG23 VAL 12 240.692 8.302 -4.974 105 H LEU 13 HN LEU 13 246.216 8.409 -5.967 106 HA LEU 13 HA LEU 13 247.115 10.965 -4.819 107 1HB LEU 13 HB2 LEU 13 248.309 8.853 -4.110 108 2HB LEU 13 HB1 LEU 13 248.916 8.767 -5.751 109 HG LEU 13 HG LEU 13 250.632 9.982 -5.071 110 1HD1 LEU 13 HD11 LEU 13 248.564 12.128 -4.782 111 2HD1 LEU 13 HD12 LEU 13 249.630 11.815 -6.148 112 3HD1 LEU 13 HD13 LEU 13 250.294 12.420 -4.633 113 1HD2 LEU 13 HD21 LEU 13 250.852 9.707 -2.876 114 2HD2 LEU 13 HD22 LEU 13 249.122 9.895 -2.599 115 3HD2 LEU 13 HD23 LEU 13 250.155 11.319 -2.726 116 H GLN 14 HN GLN 14 247.199 12.529 -6.227 117 HA GLN 14 HA GLN 14 247.641 11.921 -9.068 118 1HB GLN 14 HB2 GLN 14 246.584 14.486 -7.866 119 2HB GLN 14 HB1 GLN 14 246.587 14.035 -9.564 120 1HG GLN 14 HG2 GLN 14 244.518 13.308 -9.269 121 2HG GLN 14 HG1 GLN 14 245.203 11.982 -8.329 122 1HE2 GLN 14 HE21 GLN 14 243.012 12.135 -7.358 123 2HE2 GLN 14 HE22 GLN 14 242.801 13.203 -6.016 124 HA PRO 15 HA PRO 15 251.621 13.810 -9.016 125 1HB PRO 15 HB2 PRO 15 251.613 15.316 -11.303 126 2HB PRO 15 HB1 PRO 15 251.826 13.562 -11.272 127 1HG PRO 15 HG2 PRO 15 249.360 15.163 -11.824 128 2HG PRO 15 HG1 PRO 15 249.964 13.713 -12.649 129 1HD PRO 15 HD2 PRO 15 247.974 13.591 -10.845 130 2HD PRO 15 HD1 PRO 15 249.176 12.293 -10.999 131 H GLN 16 HN GLN 16 249.344 15.335 -7.724 132 HA GLN 16 HA GLN 16 250.809 17.738 -7.253 133 1HB GLN 16 HB2 GLN 16 248.804 19.217 -7.816 134 2HB GLN 16 HB1 GLN 16 249.748 18.606 -9.168 135 1HG GLN 16 HG2 GLN 16 248.056 17.362 -9.965 136 2HG GLN 16 HG1 GLN 16 247.478 16.926 -8.357 137 1HE2 GLN 16 HE21 GLN 16 245.343 17.306 -9.053 138 2HE2 GLN 16 HE22 GLN 16 244.723 18.911 -9.205 139 H ARG 17 HN ARG 17 247.900 15.832 -6.747 140 HA ARG 17 HA ARG 17 247.932 16.658 -3.941 141 1HB ARG 17 HB2 ARG 17 245.321 16.415 -5.424 142 2HB ARG 17 HB1 ARG 17 245.621 17.151 -3.858 143 1HG ARG 17 HG2 ARG 17 247.161 18.721 -5.393 144 2HG ARG 17 HG1 ARG 17 245.923 18.265 -6.567 145 1HD ARG 17 HD2 ARG 17 244.217 18.931 -4.817 146 2HD ARG 17 HD1 ARG 17 245.556 19.641 -3.915 147 HE ARG 17 HE ARG 17 245.603 21.377 -5.410 148 1HH1 ARG 17 HH11 ARG 17 243.675 18.788 -6.736 149 2HH1 ARG 17 HH12 ARG 17 243.100 19.731 -8.070 150 1HH2 ARG 17 HH21 ARG 17 244.847 22.620 -7.164 151 2HH2 ARG 17 HH22 ARG 17 243.765 21.906 -8.313 152 H VAL 18 HN VAL 18 246.659 15.168 -2.539 153 HA VAL 18 HA VAL 18 246.228 12.505 -3.705 154 HB VAL 18 HB VAL 18 248.410 12.204 -2.909 155 1HG1 VAL 18 HG11 VAL 18 248.916 12.859 -0.441 156 2HG1 VAL 18 HG12 VAL 18 247.579 13.985 -0.674 157 3HG1 VAL 18 HG13 VAL 18 248.996 14.072 -1.719 158 1HG2 VAL 18 HG21 VAL 18 246.868 10.457 -2.137 159 2HG2 VAL 18 HG22 VAL 18 246.630 11.344 -0.632 160 3HG2 VAL 18 HG23 VAL 18 248.216 10.682 -1.023 161 H LEU 19 HN LEU 19 244.908 11.115 -2.376 162 HA LEU 19 HA LEU 19 243.234 12.615 -0.469 163 1HB LEU 19 HB2 LEU 19 242.222 11.770 -2.674 164 2HB LEU 19 HB1 LEU 19 242.356 10.168 -1.977 165 HG LEU 19 HG LEU 19 240.841 10.746 -0.193 166 1HD1 LEU 19 HD11 LEU 19 239.718 12.990 -0.226 167 2HD1 LEU 19 HD12 LEU 19 240.964 13.517 -1.358 168 3HD1 LEU 19 HD13 LEU 19 241.409 13.002 0.269 169 1HD2 LEU 19 HD21 LEU 19 239.998 10.126 -2.518 170 2HD2 LEU 19 HD22 LEU 19 239.598 11.835 -2.700 171 3HD2 LEU 19 HD23 LEU 19 238.846 10.884 -1.419 172 H LEU 20 HN LEU 20 243.306 11.967 1.572 173 HA LEU 20 HA LEU 20 244.217 9.222 2.139 174 1HB LEU 20 HB2 LEU 20 245.072 11.810 3.172 175 2HB LEU 20 HB1 LEU 20 244.644 10.690 4.449 176 HG LEU 20 HG LEU 20 246.599 10.022 2.256 177 1HD1 LEU 20 HD11 LEU 20 247.354 11.953 3.636 178 2HD1 LEU 20 HD12 LEU 20 248.383 10.520 3.782 179 3HD1 LEU 20 HD13 LEU 20 247.232 10.919 5.060 180 1HD2 LEU 20 HD21 LEU 20 245.294 8.294 3.788 181 2HD2 LEU 20 HD22 LEU 20 246.577 8.720 4.918 182 3HD2 LEU 20 HD23 LEU 20 246.981 8.058 3.335 183 H GLY 21 HN GLY 21 243.012 7.969 3.462 184 1HA GLY 21 HA2 GLY 21 240.398 9.000 4.230 185 2HA GLY 21 HA1 GLY 21 240.904 7.318 4.256 186 H MET 22 HN MET 22 240.106 9.901 6.150 187 HA MET 22 HA MET 22 241.811 9.067 8.385 188 1HB MET 22 HB2 MET 22 241.901 11.420 8.067 189 2HB MET 22 HB1 MET 22 240.158 11.538 7.880 190 1HG MET 22 HG2 MET 22 239.771 11.505 10.115 191 2HG MET 22 HG1 MET 22 241.178 10.502 10.458 192 1HE MET 22 HE1 MET 22 244.108 12.957 10.535 193 2HE MET 22 HE2 MET 22 243.600 11.572 9.567 194 3HE MET 22 HE3 MET 22 243.488 11.509 11.326 195 H LYS 23 HN LYS 23 240.944 8.305 10.310 196 HA LYS 23 HA LYS 23 238.222 7.291 10.139 197 1HB LYS 23 HB2 LYS 23 240.643 6.657 11.710 198 2HB LYS 23 HB1 LYS 23 239.117 6.456 12.562 199 1HG LYS 23 HG2 LYS 23 239.330 5.293 9.846 200 2HG LYS 23 HG1 LYS 23 240.228 4.510 11.148 201 1HD LYS 23 HD2 LYS 23 237.328 5.208 11.462 202 2HD LYS 23 HD1 LYS 23 237.826 3.714 10.666 203 1HE LYS 23 HE2 LYS 23 238.903 4.456 13.361 204 2HE LYS 23 HE1 LYS 23 237.330 3.677 13.202 205 1HZ LYS 23 HZ1 LYS 23 239.605 2.335 13.437 206 2HZ LYS 23 HZ2 LYS 23 239.522 2.437 11.751 207 3HZ LYS 23 HZ3 LYS 23 238.256 1.725 12.617 208 H LYS 24 HN LYS 24 236.594 7.784 11.659 209 HA LYS 24 HA LYS 24 237.013 10.384 12.912 210 1HB LYS 24 HB2 LYS 24 234.645 8.914 11.889 211 2HB LYS 24 HB1 LYS 24 234.380 9.975 13.266 212 1HG LYS 24 HG2 LYS 24 234.500 11.804 12.007 213 2HG LYS 24 HG1 LYS 24 235.954 11.242 11.183 214 1HD LYS 24 HD2 LYS 24 234.784 10.306 9.466 215 2HD LYS 24 HD1 LYS 24 233.397 9.915 10.483 216 1HE LYS 24 HE2 LYS 24 233.982 12.784 10.008 217 2HE LYS 24 HE1 LYS 24 233.336 11.852 8.657 218 1HZ LYS 24 HZ1 LYS 24 232.090 12.092 11.344 219 2HZ LYS 24 HZ2 LYS 24 231.467 11.205 10.045 220 3HZ LYS 24 HZ3 LYS 24 231.575 12.890 9.943 221 H ARG 25 HN ARG 25 235.965 7.106 13.714 222 HA ARG 25 HA ARG 25 236.641 7.679 16.485 223 1HB ARG 25 HB2 ARG 25 234.496 6.156 16.992 224 2HB ARG 25 HB1 ARG 25 234.440 7.910 16.962 225 1HG ARG 25 HG2 ARG 25 232.591 6.779 15.743 226 2HG ARG 25 HG1 ARG 25 233.520 7.923 14.772 227 1HD ARG 25 HD2 ARG 25 233.868 6.317 13.292 228 2HD ARG 25 HD1 ARG 25 234.797 5.441 14.498 229 HE ARG 25 HE ARG 25 233.121 3.917 14.523 230 1HH1 ARG 25 HH11 ARG 25 231.725 7.001 13.660 231 2HH1 ARG 25 HH12 ARG 25 230.119 6.370 13.525 232 1HH2 ARG 25 HH21 ARG 25 231.010 3.093 14.335 233 2HH2 ARG 25 HH22 ARG 25 229.712 4.155 13.901 234 H GLY 26 HN GLY 26 236.085 5.383 17.727 235 1HA GLY 26 HA2 GLY 26 236.395 3.029 17.633 236 2HA GLY 26 HA1 GLY 26 237.181 3.224 16.073 237 H PHE 27 HN PHE 27 239.055 2.140 16.569 238 HA PHE 27 HA PHE 27 240.626 3.123 18.839 239 1HB PHE 27 HB2 PHE 27 240.503 0.581 17.328 240 2HB PHE 27 HB1 PHE 27 242.094 1.073 17.896 241 HD1 PHE 27 HD1 PHE 27 238.639 0.347 19.001 242 HD2 PHE 27 HD2 PHE 27 242.713 0.803 20.139 243 HE1 PHE 27 HE1 PHE 27 238.110 -0.540 21.234 244 HE2 PHE 27 HE2 PHE 27 242.192 -0.084 22.374 245 HZ PHE 27 HZ PHE 27 239.888 -0.757 22.923 246 H GLY 28 HN GLY 28 240.282 4.556 16.218 247 1HA GLY 28 HA2 GLY 28 242.977 5.394 15.941 248 2HA GLY 28 HA1 GLY 28 242.539 4.339 14.610 249 H ALA 29 HN ALA 29 240.374 6.633 16.207 250 HA ALA 29 HA ALA 29 239.169 7.722 14.020 251 1HB ALA 29 HB1 ALA 29 238.931 9.834 15.365 252 2HB ALA 29 HB2 ALA 29 239.953 9.075 16.586 253 3HB ALA 29 HB3 ALA 29 238.403 8.352 16.160 254 H GLY 30 HN GLY 30 241.309 10.056 15.536 255 1HA GLY 30 HA2 GLY 30 241.994 11.319 13.139 256 2HA GLY 30 HA1 GLY 30 242.854 11.506 14.660 257 H ARG 31 HN ARG 31 242.553 9.415 11.827 258 HA ARG 31 HA ARG 31 245.413 9.138 11.660 259 1HB ARG 31 HB2 ARG 31 244.063 7.220 13.151 260 2HB ARG 31 HB1 ARG 31 244.235 6.471 11.570 261 1HG ARG 31 HG2 ARG 31 246.721 7.292 11.815 262 2HG ARG 31 HG1 ARG 31 246.320 7.265 13.533 263 1HD ARG 31 HD2 ARG 31 245.688 4.915 11.792 264 2HD ARG 31 HD1 ARG 31 247.320 5.144 12.419 265 HE ARG 31 HE ARG 31 245.776 5.370 14.626 266 1HH1 ARG 31 HH11 ARG 31 246.002 2.961 12.111 267 2HH1 ARG 31 HH12 ARG 31 245.537 1.654 13.147 268 1HH2 ARG 31 HH21 ARG 31 245.164 3.652 15.991 269 2HH2 ARG 31 HH22 ARG 31 245.061 2.046 15.350 270 H TRP 32 HN TRP 32 245.918 9.211 9.574 271 HA TRP 32 HA TRP 32 243.828 8.874 7.590 272 1HB TRP 32 HB2 TRP 32 246.625 9.425 6.756 273 2HB TRP 32 HB1 TRP 32 245.118 10.107 6.164 274 HD1 TRP 32 HD1 TRP 32 247.647 10.523 9.037 275 HE1 TRP 32 HE1 TRP 32 247.409 12.904 9.982 276 HE3 TRP 32 HE3 TRP 32 243.569 12.059 6.362 277 HZ2 TRP 32 HZ2 TRP 32 245.724 15.139 9.638 278 HZ3 TRP 32 HZ3 TRP 32 242.708 14.334 6.730 279 HH2 TRP 32 HH2 TRP 32 243.765 15.841 8.333 280 H ASN 33 HN ASN 33 244.029 7.488 5.738 281 HA ASN 33 HA ASN 33 246.076 5.628 5.349 282 1HB ASN 33 HB2 ASN 33 244.867 3.555 6.148 283 2HB ASN 33 HB1 ASN 33 245.516 4.587 7.420 284 1HD2 ASN 33 HD21 ASN 33 242.675 3.335 5.916 285 2HD2 ASN 33 HD22 ASN 33 241.542 3.924 7.080 286 H GLY 34 HN GLY 34 245.675 4.189 3.625 287 1HA GLY 34 HA2 GLY 34 243.837 5.137 1.701 288 2HA GLY 34 HA1 GLY 34 244.767 3.651 1.586 289 H PHE 35 HN PHE 35 242.542 3.221 0.487 290 HA PHE 35 HA PHE 35 240.667 2.205 2.517 291 1HB PHE 35 HB2 PHE 35 239.862 2.396 -0.346 292 2HB PHE 35 HB1 PHE 35 238.901 2.626 1.104 293 HD1 PHE 35 HD1 PHE 35 240.653 4.225 -1.540 294 HD2 PHE 35 HD2 PHE 35 239.314 4.756 2.464 295 HE1 PHE 35 HE1 PHE 35 240.851 6.663 -1.801 296 HE2 PHE 35 HE2 PHE 35 239.508 7.196 2.211 297 HZ PHE 35 HZ PHE 35 240.278 8.152 0.075 298 H GLY 36 HN GLY 36 241.608 0.220 2.919 299 1HA GLY 36 HA2 GLY 36 242.147 -1.529 0.640 300 2HA GLY 36 HA1 GLY 36 242.613 -1.831 2.306 301 H GLY 37 HN GLY 37 241.388 -3.713 0.576 302 1HA GLY 37 HA2 GLY 37 239.159 -4.472 2.257 303 2HA GLY 37 HA1 GLY 37 238.719 -4.111 0.594 304 H LYS 38 HN LYS 38 238.562 -6.649 2.055 305 HA LYS 38 HA LYS 38 240.632 -8.324 0.938 306 1HB LYS 38 HB2 LYS 38 239.497 -10.155 2.048 307 2HB LYS 38 HB1 LYS 38 239.647 -8.797 3.153 308 1HG LYS 38 HG2 LYS 38 237.310 -8.180 2.672 309 2HG LYS 38 HG1 LYS 38 237.174 -9.606 1.639 310 1HD LYS 38 HD2 LYS 38 238.199 -10.117 4.348 311 2HD LYS 38 HD1 LYS 38 236.529 -9.553 4.274 312 1HE LYS 38 HE2 LYS 38 236.781 -12.034 4.210 313 2HE LYS 38 HE1 LYS 38 235.911 -11.357 2.835 314 1HZ LYS 38 HZ1 LYS 38 238.750 -12.227 2.869 315 2HZ LYS 38 HZ2 LYS 38 237.991 -11.478 1.556 316 3HZ LYS 38 HZ3 LYS 38 237.468 -13.000 2.079 317 H VAL 39 HN VAL 39 240.375 -9.903 -0.648 318 HA VAL 39 HA VAL 39 238.495 -9.259 -2.715 319 HB VAL 39 HB VAL 39 240.230 -11.727 -2.653 320 1HG1 VAL 39 HG11 VAL 39 239.208 -9.995 -4.901 321 2HG1 VAL 39 HG12 VAL 39 238.606 -11.594 -4.462 322 3HG1 VAL 39 HG13 VAL 39 240.244 -11.409 -5.085 323 1HG2 VAL 39 HG21 VAL 39 241.012 -8.892 -2.910 324 2HG2 VAL 39 HG22 VAL 39 241.732 -10.023 -4.056 325 3HG2 VAL 39 HG23 VAL 39 241.931 -10.278 -2.322 326 H GLN 40 HN GLN 40 236.430 -9.817 -2.517 327 HA GLN 40 HA GLN 40 235.248 -11.600 -0.838 328 1HB GLN 40 HB2 GLN 40 234.466 -10.615 -3.559 329 2HB GLN 40 HB1 GLN 40 233.463 -11.800 -2.734 330 1HG GLN 40 HG2 GLN 40 234.262 -9.187 -1.489 331 2HG GLN 40 HG1 GLN 40 232.802 -9.389 -2.455 332 1HE2 GLN 40 HE21 GLN 40 231.899 -8.629 -0.343 333 2HE2 GLN 40 HE22 GLN 40 231.480 -9.839 0.818 334 H GLU 41 HN GLU 41 234.037 -13.643 -1.446 335 HA GLU 41 HA GLU 41 235.896 -15.656 -2.084 336 1HB GLU 41 HB2 GLU 41 232.879 -15.750 -1.937 337 2HB GLU 41 HB1 GLU 41 233.907 -17.169 -2.079 338 1HG GLU 41 HG2 GLU 41 233.827 -17.214 0.145 339 2HG GLU 41 HG1 GLU 41 235.006 -15.904 0.067 340 H GLY 42 HN GLY 42 236.681 -14.809 -4.156 341 1HA GLY 42 HA2 GLY 42 236.815 -15.724 -6.372 342 2HA GLY 42 HA1 GLY 42 235.068 -15.905 -6.359 343 H GLU 43 HN GLU 43 237.120 -13.083 -5.590 344 HA GLU 43 HA GLU 43 235.901 -11.710 -7.864 345 1HB GLU 43 HB2 GLU 43 235.237 -9.900 -6.655 346 2HB GLU 43 HB1 GLU 43 235.115 -11.097 -5.379 347 1HG GLU 43 HG2 GLU 43 237.108 -10.376 -4.370 348 2HG GLU 43 HG1 GLU 43 237.584 -9.443 -5.787 349 H THR 44 HN THR 44 237.230 -9.611 -8.271 350 HA THR 44 HA THR 44 240.009 -10.500 -8.384 351 HB THR 44 HB THR 44 240.229 -8.875 -10.187 352 HG1 THR 44 HG1 THR 44 238.506 -7.635 -10.814 353 1HG2 THR 44 HG21 THR 44 237.883 -10.737 -10.330 354 2HG2 THR 44 HG22 THR 44 239.521 -10.992 -10.935 355 3HG2 THR 44 HG23 THR 44 238.458 -9.826 -11.726 356 H ILE 45 HN ILE 45 241.705 -9.279 -7.673 357 HA ILE 45 HA ILE 45 241.415 -7.795 -5.380 358 HB ILE 45 HB ILE 45 243.667 -7.312 -7.317 359 1HG1 ILE 45 HG12 ILE 45 244.568 -9.266 -5.635 360 2HG1 ILE 45 HG11 ILE 45 242.900 -9.764 -5.898 361 1HG2 ILE 45 HG21 ILE 45 244.917 -7.214 -5.096 362 2HG2 ILE 45 HG22 ILE 45 243.322 -7.087 -4.355 363 3HG2 ILE 45 HG23 ILE 45 243.861 -5.862 -5.505 364 1HD1 ILE 45 HD11 ILE 45 245.194 -9.804 -7.710 365 2HD1 ILE 45 HD12 ILE 45 243.700 -9.202 -8.428 366 3HD1 ILE 45 HD13 ILE 45 243.740 -10.801 -7.688 367 H GLU 46 HN GLU 46 241.296 -6.710 -8.712 368 HA GLU 46 HA GLU 46 241.353 -3.904 -8.087 369 1HB GLU 46 HB2 GLU 46 241.851 -5.213 -10.353 370 2HB GLU 46 HB1 GLU 46 240.137 -4.924 -10.617 371 1HG GLU 46 HG2 GLU 46 240.410 -2.605 -10.629 372 2HG GLU 46 HG1 GLU 46 242.001 -2.699 -9.875 373 H ASP 47 HN ASP 47 238.975 -6.412 -8.294 374 HA ASP 47 HA ASP 47 236.730 -4.605 -8.387 375 1HB ASP 47 HB2 ASP 47 237.070 -7.577 -8.219 376 2HB ASP 47 HB1 ASP 47 235.522 -6.869 -7.768 377 H GLY 48 HN GLY 48 238.483 -6.524 -6.019 378 1HA GLY 48 HA2 GLY 48 236.692 -6.018 -3.846 379 2HA GLY 48 HA1 GLY 48 238.348 -6.599 -3.712 380 H ALA 49 HN ALA 49 239.554 -4.428 -5.106 381 HA ALA 49 HA ALA 49 239.770 -2.539 -2.956 382 1HB ALA 49 HB1 ALA 49 241.662 -1.807 -3.987 383 2HB ALA 49 HB2 ALA 49 240.975 -1.954 -5.604 384 3HB ALA 49 HB3 ALA 49 241.544 -3.390 -4.755 385 H ARG 50 HN ARG 50 238.231 -2.701 -6.094 386 HA ARG 50 HA ARG 50 237.558 0.072 -6.217 387 1HB ARG 50 HB2 ARG 50 236.864 -2.368 -7.787 388 2HB ARG 50 HB1 ARG 50 235.838 -0.951 -7.955 389 1HG ARG 50 HG2 ARG 50 237.860 0.369 -8.540 390 2HG ARG 50 HG1 ARG 50 238.787 -1.132 -8.524 391 1HD ARG 50 HD2 ARG 50 236.966 -1.967 -10.177 392 2HD ARG 50 HD1 ARG 50 236.638 -0.250 -10.410 393 HE ARG 50 HE ARG 50 239.413 -0.873 -10.674 394 1HH1 ARG 50 HH11 ARG 50 236.353 -0.899 -12.351 395 2HH1 ARG 50 HH12 ARG 50 237.070 -0.794 -13.924 396 1HH2 ARG 50 HH21 ARG 50 240.359 -0.734 -12.741 397 2HH2 ARG 50 HH22 ARG 50 239.345 -0.701 -14.145 398 H ARG 51 HN ARG 51 235.653 -2.878 -5.628 399 HA ARG 51 HA ARG 51 233.237 -1.584 -5.029 400 1HB ARG 51 HB2 ARG 51 233.904 -4.144 -5.411 401 2HB ARG 51 HB1 ARG 51 233.860 -4.145 -3.654 402 1HG ARG 51 HG2 ARG 51 231.536 -2.810 -4.537 403 2HG ARG 51 HG1 ARG 51 231.699 -4.276 -5.505 404 1HD ARG 51 HD2 ARG 51 232.212 -4.621 -2.633 405 2HD ARG 51 HD1 ARG 51 230.559 -4.164 -3.041 406 HE ARG 51 HE ARG 51 231.561 -6.318 -4.646 407 1HH1 ARG 51 HH11 ARG 51 230.060 -5.503 -1.602 408 2HH1 ARG 51 HH12 ARG 51 229.348 -7.068 -1.391 409 1HH2 ARG 51 HH21 ARG 51 230.625 -8.376 -4.370 410 2HH2 ARG 51 HH22 ARG 51 229.670 -8.699 -2.962 411 H GLU 52 HN GLU 52 235.999 -2.380 -3.029 412 HA GLU 52 HA GLU 52 234.657 -1.619 -0.579 413 1HB GLU 52 HB2 GLU 52 237.531 -2.367 -1.148 414 2HB GLU 52 HB1 GLU 52 236.897 -2.013 0.453 415 1HG GLU 52 HG2 GLU 52 235.410 -4.052 -1.042 416 2HG GLU 52 HG1 GLU 52 237.067 -4.486 -0.624 417 H LEU 53 HN LEU 53 236.498 -0.129 -3.048 418 HA LEU 53 HA LEU 53 237.589 2.017 -1.542 419 1HB LEU 53 HB2 LEU 53 238.643 1.555 -3.587 420 2HB LEU 53 HB1 LEU 53 237.124 1.503 -4.463 421 HG LEU 53 HG LEU 53 236.891 3.929 -4.191 422 1HD1 LEU 53 HD11 LEU 53 239.642 4.383 -3.371 423 2HD1 LEU 53 HD12 LEU 53 238.673 3.594 -2.128 424 3HD1 LEU 53 HD13 LEU 53 238.151 5.135 -2.807 425 1HD2 LEU 53 HD21 LEU 53 239.116 4.473 -5.500 426 2HD2 LEU 53 HD22 LEU 53 237.830 3.515 -6.234 427 3HD2 LEU 53 HD23 LEU 53 239.241 2.714 -5.548 428 H GLN 54 HN GLN 54 234.746 1.678 -3.628 429 HA GLN 54 HA GLN 54 233.827 4.329 -3.388 430 1HB GLN 54 HB2 GLN 54 232.825 3.196 -5.128 431 2HB GLN 54 HB1 GLN 54 232.609 1.727 -4.192 432 1HG GLN 54 HG2 GLN 54 230.765 2.721 -2.986 433 2HG GLN 54 HG1 GLN 54 231.019 4.256 -3.817 434 1HE2 GLN 54 HE21 GLN 54 229.439 4.573 -5.205 435 2HE2 GLN 54 HE22 GLN 54 228.769 3.395 -6.276 436 H GLU 55 HN GLU 55 233.602 1.598 -1.281 437 HA GLU 55 HA GLU 55 231.431 2.653 0.286 438 1HB GLU 55 HB2 GLU 55 233.148 0.215 0.403 439 2HB GLU 55 HB1 GLU 55 232.232 0.683 1.828 440 1HG GLU 55 HG2 GLU 55 230.199 0.748 0.298 441 2HG GLU 55 HG1 GLU 55 231.204 -0.100 -0.877 442 H GLU 56 HN GLU 56 234.883 2.927 0.363 443 HA GLU 56 HA GLU 56 235.001 3.499 3.169 444 1HB GLU 56 HB2 GLU 56 236.922 3.263 0.961 445 2HB GLU 56 HB1 GLU 56 237.377 4.404 2.221 446 1HG GLU 56 HG2 GLU 56 236.407 1.999 3.423 447 2HG GLU 56 HG1 GLU 56 237.645 1.607 2.231 448 H SER 57 HN SER 57 235.169 5.516 0.230 449 HA SER 57 HA SER 57 234.641 7.829 1.975 450 1HB SER 57 HB2 SER 57 236.953 8.029 1.436 451 2HB SER 57 HB1 SER 57 236.664 7.634 -0.257 452 HG SER 57 HG SER 57 236.779 9.784 -0.298 453 H GLY 58 HN GLY 58 232.973 6.101 0.118 454 1HA GLY 58 HA2 GLY 58 231.261 6.402 -1.375 455 2HA GLY 58 HA1 GLY 58 231.255 8.074 -0.836 456 H LEU 59 HN LEU 59 234.241 7.085 -2.130 457 HA LEU 59 HA LEU 59 233.643 8.519 -4.623 458 1HB LEU 59 HB2 LEU 59 236.232 8.050 -3.158 459 2HB LEU 59 HB1 LEU 59 236.139 8.750 -4.763 460 HG LEU 59 HG LEU 59 235.294 9.929 -2.143 461 1HD1 LEU 59 HD11 LEU 59 236.962 11.366 -2.520 462 2HD1 LEU 59 HD12 LEU 59 236.517 11.582 -4.212 463 3HD1 LEU 59 HD13 LEU 59 237.510 10.207 -3.730 464 1HD2 LEU 59 HD21 LEU 59 234.310 10.749 -4.875 465 2HD2 LEU 59 HD22 LEU 59 234.200 11.756 -3.432 466 3HD2 LEU 59 HD23 LEU 59 233.335 10.220 -3.503 467 H THR 60 HN THR 60 233.177 7.196 -6.190 468 HA THR 60 HA THR 60 234.376 4.554 -6.336 469 HB THR 60 HB THR 60 232.671 5.393 -8.568 470 HG1 THR 60 HG1 THR 60 231.146 6.264 -7.455 471 1HG2 THR 60 HG21 THR 60 233.218 3.040 -7.066 472 2HG2 THR 60 HG22 THR 60 232.313 3.211 -8.571 473 3HG2 THR 60 HG23 THR 60 231.484 3.358 -7.022 474 H VAL 61 HN VAL 61 235.445 3.825 -8.313 475 HA VAL 61 HA VAL 61 236.682 6.055 -9.790 476 HB VAL 61 HB VAL 61 238.771 4.827 -9.901 477 1HG1 VAL 61 HG11 VAL 61 238.664 6.340 -8.096 478 2HG1 VAL 61 HG12 VAL 61 239.333 4.850 -7.430 479 3HG1 VAL 61 HG13 VAL 61 237.640 5.260 -7.149 480 1HG2 VAL 61 HG21 VAL 61 238.663 2.842 -8.006 481 2HG2 VAL 61 HG22 VAL 61 238.637 2.601 -9.754 482 3HG2 VAL 61 HG23 VAL 61 237.124 2.662 -8.849 483 H ASP 62 HN ASP 62 236.968 5.838 -11.949 484 HA ASP 62 HA ASP 62 235.432 3.783 -13.263 485 1HB ASP 62 HB2 ASP 62 235.873 6.357 -13.894 486 2HB ASP 62 HB1 ASP 62 237.165 5.618 -14.837 487 H ALA 63 HN ALA 63 238.717 4.321 -12.391 488 HA ALA 63 HA ALA 63 239.562 1.754 -13.058 489 1HB ALA 63 HB1 ALA 63 239.310 3.184 -15.357 490 2HB ALA 63 HB2 ALA 63 240.400 1.815 -15.141 491 3HB ALA 63 HB3 ALA 63 241.005 3.461 -14.958 492 H LEU 64 HN LEU 64 240.625 1.824 -11.099 493 HA LEU 64 HA LEU 64 242.287 3.898 -10.178 494 1HB LEU 64 HB2 LEU 64 242.447 0.936 -9.593 495 2HB LEU 64 HB1 LEU 64 243.264 2.188 -8.680 496 HG LEU 64 HG LEU 64 240.530 2.880 -8.707 497 1HD1 LEU 64 HD11 LEU 64 239.687 0.791 -7.513 498 2HD1 LEU 64 HD12 LEU 64 241.041 -0.041 -8.278 499 3HD1 LEU 64 HD13 LEU 64 239.804 0.732 -9.271 500 1HD2 LEU 64 HD21 LEU 64 242.614 2.783 -6.928 501 2HD2 LEU 64 HD22 LEU 64 241.508 1.564 -6.295 502 3HD2 LEU 64 HD23 LEU 64 240.951 3.219 -6.541 503 H HIS 65 HN HIS 65 244.738 3.009 -9.598 504 HA HIS 65 HA HIS 65 245.953 2.103 -12.108 505 1HB HIS 65 HB2 HIS 65 246.012 4.665 -11.763 506 2HB HIS 65 HB1 HIS 65 247.200 4.324 -10.509 507 HD1 HIS 65 HD1 HIS 65 249.002 5.582 -11.916 508 HD2 HIS 65 HD2 HIS 65 247.430 2.196 -13.740 509 HE1 HIS 65 HE1 HIS 65 250.551 5.069 -13.828 510 HE2 HIS 65 HE2 HIS 65 249.629 2.966 -14.864 511 H LYS 66 HN LYS 66 246.651 0.141 -11.418 512 HA LYS 66 HA LYS 66 247.668 -0.388 -8.827 513 1HB LYS 66 HB2 LYS 66 248.373 -2.534 -9.734 514 2HB LYS 66 HB1 LYS 66 246.761 -2.145 -10.314 515 1HG LYS 66 HG2 LYS 66 248.145 -1.144 -12.344 516 2HG LYS 66 HG1 LYS 66 249.316 -2.346 -11.796 517 1HD LYS 66 HD2 LYS 66 247.231 -3.931 -11.786 518 2HD LYS 66 HD1 LYS 66 246.568 -2.733 -12.899 519 1HE LYS 66 HE2 LYS 66 248.948 -3.043 -14.036 520 2HE LYS 66 HE1 LYS 66 248.830 -4.620 -13.257 521 1HZ LYS 66 HZ1 LYS 66 247.937 -4.777 -15.449 522 2HZ LYS 66 HZ2 LYS 66 246.920 -3.447 -15.203 523 3HZ LYS 66 HZ3 LYS 66 246.647 -4.888 -14.360 524 H VAL 67 HN VAL 67 249.724 -0.246 -8.002 525 HA VAL 67 HA VAL 67 251.848 0.445 -9.932 526 HB VAL 67 HB VAL 67 252.753 2.128 -8.399 527 1HG1 VAL 67 HG11 VAL 67 251.326 2.872 -10.194 528 2HG1 VAL 67 HG12 VAL 67 251.007 3.843 -8.756 529 3HG1 VAL 67 HG13 VAL 67 249.885 2.564 -9.222 530 1HG2 VAL 67 HG21 VAL 67 252.089 1.632 -6.257 531 2HG2 VAL 67 HG22 VAL 67 250.432 1.275 -6.736 532 3HG2 VAL 67 HG23 VAL 67 250.983 2.946 -6.653 533 H GLY 68 HN GLY 68 251.211 -0.538 -6.562 534 1HA GLY 68 HA2 GLY 68 253.678 -2.150 -6.743 535 2HA GLY 68 HA1 GLY 68 253.329 -1.187 -5.318 536 H GLN 69 HN GLN 69 253.813 -3.957 -5.338 537 HA GLN 69 HA GLN 69 251.208 -4.954 -4.393 538 1HB GLN 69 HB2 GLN 69 253.362 -6.718 -5.552 539 2HB GLN 69 HB1 GLN 69 251.691 -7.138 -5.202 540 1HG GLN 69 HG2 GLN 69 250.986 -5.554 -6.979 541 2HG GLN 69 HG1 GLN 69 252.686 -5.316 -7.379 542 1HE2 GLN 69 HE21 GLN 69 252.363 -6.116 -9.463 543 2HE2 GLN 69 HE22 GLN 69 252.148 -7.802 -9.772 544 H ILE 70 HN ILE 70 251.284 -5.102 -2.247 545 HA ILE 70 HA ILE 70 253.867 -5.663 -0.971 546 HB ILE 70 HB ILE 70 251.343 -4.561 0.263 547 1HG1 ILE 70 HG12 ILE 70 253.925 -3.105 -0.309 548 2HG1 ILE 70 HG11 ILE 70 252.551 -3.085 -1.409 549 1HG2 ILE 70 HG21 ILE 70 252.757 -5.823 1.833 550 2HG2 ILE 70 HG22 ILE 70 252.701 -4.103 2.215 551 3HG2 ILE 70 HG23 ILE 70 254.119 -4.783 1.416 552 1HD1 ILE 70 HD11 ILE 70 251.297 -2.324 0.804 553 2HD1 ILE 70 HD12 ILE 70 252.114 -1.186 -0.268 554 3HD1 ILE 70 HD13 ILE 70 252.916 -1.748 1.198 555 H VAL 71 HN VAL 71 254.088 -7.226 0.603 556 HA VAL 71 HA VAL 71 251.882 -9.153 0.868 557 HB VAL 71 HB VAL 71 254.775 -9.983 0.734 558 1HG1 VAL 71 HG11 VAL 71 253.103 -11.463 1.842 559 2HG1 VAL 71 HG12 VAL 71 253.899 -12.189 0.446 560 3HG1 VAL 71 HG13 VAL 71 252.254 -11.571 0.300 561 1HG2 VAL 71 HG21 VAL 71 254.598 -9.260 -1.427 562 2HG2 VAL 71 HG22 VAL 71 252.848 -9.469 -1.471 563 3HG2 VAL 71 HG23 VAL 71 253.906 -10.874 -1.600 564 H PHE 72 HN PHE 72 251.717 -10.190 2.860 565 HA PHE 72 HA PHE 72 253.469 -9.141 4.981 566 1HB PHE 72 HB2 PHE 72 250.482 -9.594 5.059 567 2HB PHE 72 HB1 PHE 72 251.460 -9.260 6.484 568 HD1 PHE 72 HD1 PHE 72 251.053 -7.821 3.056 569 HD2 PHE 72 HD2 PHE 72 251.355 -7.109 7.240 570 HE1 PHE 72 HE1 PHE 72 250.807 -5.408 2.658 571 HE2 PHE 72 HE2 PHE 72 251.105 -4.693 6.850 572 HZ PHE 72 HZ PHE 72 250.831 -3.839 4.556 573 H GLU 73 HN GLU 73 254.608 -10.691 5.898 574 HA GLU 73 HA GLU 73 253.566 -13.437 5.870 575 1HB GLU 73 HB2 GLU 73 256.390 -12.480 6.378 576 2HB GLU 73 HB1 GLU 73 255.871 -14.153 6.224 577 1HG GLU 73 HG2 GLU 73 254.978 -13.111 3.886 578 2HG GLU 73 HG1 GLU 73 256.431 -12.150 4.162 579 H PHE 74 HN PHE 74 252.710 -14.176 7.697 580 HA PHE 74 HA PHE 74 253.152 -12.751 10.180 581 1HB PHE 74 HB2 PHE 74 251.323 -14.969 9.313 582 2HB PHE 74 HB1 PHE 74 251.561 -14.642 11.027 583 HD1 PHE 74 HD1 PHE 74 249.258 -14.206 8.675 584 HD2 PHE 74 HD2 PHE 74 251.641 -11.797 11.249 585 HE1 PHE 74 HE1 PHE 74 247.568 -12.421 8.562 586 HE2 PHE 74 HE2 PHE 74 249.956 -10.008 11.142 587 HZ PHE 74 HZ PHE 74 247.916 -10.319 9.798 588 H VAL 75 HN VAL 75 254.345 -13.336 11.832 589 HA VAL 75 HA VAL 75 256.202 -15.502 11.462 590 HB VAL 75 HB VAL 75 256.194 -14.239 14.102 591 1HG1 VAL 75 HG11 VAL 75 257.958 -15.625 12.697 592 2HG1 VAL 75 HG12 VAL 75 258.450 -14.410 13.877 593 3HG1 VAL 75 HG13 VAL 75 258.417 -14.010 12.160 594 1HG2 VAL 75 HG21 VAL 75 256.158 -12.549 11.659 595 2HG2 VAL 75 HG22 VAL 75 257.310 -12.147 12.931 596 3HG2 VAL 75 HG23 VAL 75 255.585 -12.198 13.290 597 H GLY 76 HN GLY 76 255.494 -17.501 11.812 598 1HA GLY 76 HA2 GLY 76 255.096 -19.218 13.442 599 2HA GLY 76 HA1 GLY 76 254.182 -18.051 14.389 600 H GLU 77 HN GLU 77 252.941 -17.166 11.715 601 HA GLU 77 HA GLU 77 250.881 -19.262 11.690 602 1HB GLU 77 HB2 GLU 77 250.630 -16.415 10.713 603 2HB GLU 77 HB1 GLU 77 249.330 -17.578 10.933 604 1HG GLU 77 HG2 GLU 77 250.333 -17.538 13.423 605 2HG GLU 77 HG1 GLU 77 250.731 -15.900 12.905 606 HA PRO 78 HA PRO 78 252.543 -20.495 7.699 607 1HB PRO 78 HB2 PRO 78 249.775 -21.597 7.497 608 2HB PRO 78 HB1 PRO 78 251.326 -22.379 7.163 609 1HG PRO 78 HG2 PRO 78 249.996 -22.916 9.403 610 2HG PRO 78 HG1 PRO 78 251.764 -22.767 9.409 611 1HD PRO 78 HD2 PRO 78 249.694 -20.856 10.387 612 2HD PRO 78 HD1 PRO 78 251.318 -21.188 11.023 613 H GLU 79 HN GLU 79 249.189 -19.316 7.977 614 HA GLU 79 HA GLU 79 248.861 -18.528 5.324 615 1HB GLU 79 HB2 GLU 79 247.335 -18.465 7.645 616 2HB GLU 79 HB1 GLU 79 247.496 -16.772 7.200 617 1HG GLU 79 HG2 GLU 79 246.584 -17.209 5.020 618 2HG GLU 79 HG1 GLU 79 246.542 -18.940 5.349 619 H LEU 80 HN LEU 80 248.446 -16.152 4.722 620 HA LEU 80 HA LEU 80 250.338 -14.283 5.904 621 1HB LEU 80 HB2 LEU 80 250.502 -14.452 2.953 622 2HB LEU 80 HB1 LEU 80 251.741 -14.045 4.125 623 HG LEU 80 HG LEU 80 250.793 -16.871 3.901 624 1HD1 LEU 80 HD11 LEU 80 252.546 -15.393 1.984 625 2HD1 LEU 80 HD12 LEU 80 251.276 -16.573 1.662 626 3HD1 LEU 80 HD13 LEU 80 252.827 -17.103 2.314 627 1HD2 LEU 80 HD21 LEU 80 252.448 -15.772 5.646 628 2HD2 LEU 80 HD22 LEU 80 253.607 -16.020 4.341 629 3HD2 LEU 80 HD23 LEU 80 252.723 -17.392 5.007 630 H MET 81 HN MET 81 250.260 -12.352 3.901 631 HA MET 81 HA MET 81 247.459 -11.900 3.274 632 1HB MET 81 HB2 MET 81 248.565 -10.796 5.584 633 2HB MET 81 HB1 MET 81 248.593 -9.483 4.416 634 1HG MET 81 HG2 MET 81 246.149 -10.054 3.975 635 2HG MET 81 HG1 MET 81 246.235 -11.013 5.451 636 1HE MET 81 HE1 MET 81 248.185 -7.303 5.243 637 2HE MET 81 HE2 MET 81 246.634 -6.512 4.965 638 3HE MET 81 HE3 MET 81 247.189 -7.775 3.866 639 H ASP 82 HN ASP 82 247.544 -11.495 1.155 640 HA ASP 82 HA ASP 82 249.791 -9.912 0.110 641 1HB ASP 82 HB2 ASP 82 249.371 -12.158 -0.898 642 2HB ASP 82 HB1 ASP 82 247.789 -11.589 -1.424 643 H VAL 83 HN VAL 83 249.235 -7.795 0.259 644 HA VAL 83 HA VAL 83 246.574 -7.026 -0.737 645 HB VAL 83 HB VAL 83 246.969 -6.447 1.622 646 1HG1 VAL 83 HG11 VAL 83 248.859 -4.287 0.987 647 2HG1 VAL 83 HG12 VAL 83 249.523 -5.918 0.900 648 3HG1 VAL 83 HG13 VAL 83 248.775 -5.349 2.392 649 1HG2 VAL 83 HG21 VAL 83 245.416 -5.066 0.511 650 2HG2 VAL 83 HG22 VAL 83 246.684 -4.205 -0.362 651 3HG2 VAL 83 HG23 VAL 83 246.490 -3.965 1.375 652 H HIS 84 HN HIS 84 246.562 -6.168 -2.681 653 HA HIS 84 HA HIS 84 248.933 -5.167 -3.941 654 1HB HIS 84 HB2 HIS 84 246.643 -6.235 -4.908 655 2HB HIS 84 HB1 HIS 84 246.278 -4.525 -5.103 656 HD1 HIS 84 HD1 HIS 84 248.277 -3.166 -6.454 657 HD2 HIS 84 HD2 HIS 84 248.018 -7.279 -6.987 658 HE1 HIS 84 HE1 HIS 84 249.533 -3.650 -8.579 659 HE2 HIS 84 HE2 HIS 84 249.288 -6.133 -8.927 660 H VAL 85 HN VAL 85 249.216 -2.957 -4.712 661 HA VAL 85 HA VAL 85 247.790 -1.027 -2.994 662 HB VAL 85 HB VAL 85 250.622 -0.826 -4.047 663 1HG1 VAL 85 HG11 VAL 85 249.999 1.005 -1.938 664 2HG1 VAL 85 HG12 VAL 85 248.831 1.196 -3.247 665 3HG1 VAL 85 HG13 VAL 85 250.557 1.342 -3.577 666 1HG2 VAL 85 HG21 VAL 85 249.802 -2.380 -1.996 667 2HG2 VAL 85 HG22 VAL 85 250.083 -0.857 -1.152 668 3HG2 VAL 85 HG23 VAL 85 251.386 -1.609 -2.073 669 H PHE 86 HN PHE 86 246.295 -0.187 -4.255 670 HA PHE 86 HA PHE 86 246.958 0.602 -6.999 671 1HB PHE 86 HB2 PHE 86 244.421 -0.081 -5.549 672 2HB PHE 86 HB1 PHE 86 244.339 0.966 -6.961 673 HD1 PHE 86 HD1 PHE 86 244.050 -0.006 -9.023 674 HD2 PHE 86 HD2 PHE 86 245.814 -2.292 -5.898 675 HE1 PHE 86 HE1 PHE 86 244.059 -1.985 -10.484 676 HE2 PHE 86 HE2 PHE 86 245.831 -4.275 -7.354 677 HZ PHE 86 HZ PHE 86 244.952 -4.124 -9.649 678 H CYS 87 HN CYS 87 246.407 2.663 -7.753 679 HA CYS 87 HA CYS 87 245.662 4.683 -5.765 680 1HB CYS 87 HB2 CYS 87 247.366 6.237 -6.739 681 2HB CYS 87 HB1 CYS 87 248.078 4.871 -5.889 682 HG CYS 87 HG CYS 87 249.411 4.974 -8.025 683 H THR 88 HN THR 88 243.865 5.626 -6.571 684 HA THR 88 HA THR 88 243.424 5.503 -9.455 685 HB THR 88 HB THR 88 241.736 4.697 -7.686 686 HG1 THR 88 HG1 THR 88 240.656 4.709 -9.466 687 1HG2 THR 88 HG21 THR 88 240.623 6.100 -6.397 688 2HG2 THR 88 HG22 THR 88 240.394 7.253 -7.712 689 3HG2 THR 88 HG23 THR 88 241.884 7.276 -6.767 690 H ASP 89 HN ASP 89 241.742 7.465 -9.999 691 HA ASP 89 HA ASP 89 242.595 10.027 -9.029 692 1HB ASP 89 HB2 ASP 89 243.879 8.869 -11.370 693 2HB ASP 89 HB1 ASP 89 243.060 10.378 -11.764 694 H SER 90 HN SER 90 241.019 8.224 -11.626 695 HA SER 90 HA SER 90 239.063 10.314 -12.060 696 1HB SER 90 HB2 SER 90 240.109 8.305 -13.656 697 2HB SER 90 HB1 SER 90 238.496 7.706 -13.270 698 HG SER 90 HG SER 90 237.639 9.249 -14.434 699 H ILE 91 HN ILE 91 237.758 10.511 -10.285 700 HA ILE 91 HA ILE 91 236.520 8.071 -9.235 701 HB ILE 91 HB ILE 91 235.821 9.410 -7.297 702 1HG1 ILE 91 HG12 ILE 91 237.451 11.658 -8.499 703 2HG1 ILE 91 HG11 ILE 91 235.695 11.579 -8.591 704 1HG2 ILE 91 HG21 ILE 91 238.734 9.974 -7.643 705 2HG2 ILE 91 HG22 ILE 91 238.159 8.307 -7.625 706 3HG2 ILE 91 HG23 ILE 91 237.867 9.356 -6.237 707 1HD1 ILE 91 HD11 ILE 91 235.563 11.638 -6.159 708 2HD1 ILE 91 HD12 ILE 91 236.429 13.037 -6.793 709 3HD1 ILE 91 HD13 ILE 91 237.321 11.703 -6.062 710 H GLN 92 HN GLN 92 234.208 8.658 -8.264 711 HA GLN 92 HA GLN 92 232.679 10.133 -10.290 712 1HB GLN 92 HB2 GLN 92 232.182 7.317 -9.342 713 2HB GLN 92 HB1 GLN 92 230.945 8.283 -10.134 714 1HG GLN 92 HG2 GLN 92 233.617 7.778 -11.396 715 2HG GLN 92 HG1 GLN 92 232.267 6.658 -11.570 716 1HE2 GLN 92 HE21 GLN 92 231.322 6.898 -13.454 717 2HE2 GLN 92 HE22 GLN 92 231.017 8.393 -14.264 718 H GLY 93 HN GLY 93 232.022 8.192 -7.376 719 1HA GLY 93 HA2 GLY 93 229.865 9.677 -6.455 720 2HA GLY 93 HA1 GLY 93 230.911 8.703 -5.435 721 H THR 94 HN THR 94 230.183 10.555 -3.971 722 HA THR 94 HA THR 94 232.044 12.811 -4.232 723 HB THR 94 HB THR 94 229.794 13.122 -2.383 724 HG1 THR 94 HG1 THR 94 229.362 12.734 -5.145 725 1HG2 THR 94 HG21 THR 94 231.394 14.783 -4.111 726 2HG2 THR 94 HG22 THR 94 230.407 15.222 -2.717 727 3HG2 THR 94 HG23 THR 94 229.672 15.102 -4.315 728 HA PRO 95 HA PRO 95 234.029 11.801 -0.469 729 1HB PRO 95 HB2 PRO 95 233.730 14.565 0.516 730 2HB PRO 95 HB1 PRO 95 235.202 13.669 0.125 731 1HG PRO 95 HG2 PRO 95 234.337 15.665 -1.424 732 2HG PRO 95 HG1 PRO 95 235.100 14.218 -2.112 733 1HD PRO 95 HD2 PRO 95 232.191 14.916 -1.926 734 2HD PRO 95 HD1 PRO 95 233.097 14.235 -3.295 735 H VAL 96 HN VAL 96 231.725 10.853 -0.266 736 HA VAL 96 HA VAL 96 230.001 12.068 1.678 737 HB VAL 96 HB VAL 96 229.976 9.162 0.876 738 1HG1 VAL 96 HG11 VAL 96 228.513 10.406 2.749 739 2HG1 VAL 96 HG12 VAL 96 227.920 9.046 1.796 740 3HG1 VAL 96 HG13 VAL 96 227.499 10.696 1.335 741 1HG2 VAL 96 HG21 VAL 96 228.118 10.247 -0.739 742 2HG2 VAL 96 HG22 VAL 96 229.782 9.939 -1.233 743 3HG2 VAL 96 HG23 VAL 96 229.302 11.553 -0.710 744 H GLU 97 HN GLU 97 232.169 12.247 2.993 745 HA GLU 97 HA GLU 97 233.337 10.226 4.406 746 1HB GLU 97 HB2 GLU 97 233.925 11.827 6.067 747 2HB GLU 97 HB1 GLU 97 233.846 12.695 4.540 748 1HG GLU 97 HG2 GLU 97 231.359 13.126 5.357 749 2HG GLU 97 HG1 GLU 97 232.117 12.898 6.932 750 H SER 98 HN SER 98 232.558 8.626 5.606 751 HA SER 98 HA SER 98 229.878 8.799 6.700 752 1HB SER 98 HB2 SER 98 230.238 6.404 7.287 753 2HB SER 98 HB1 SER 98 230.496 6.736 5.575 754 HG SER 98 HG SER 98 232.136 5.485 7.036 755 H ASP 99 HN ASP 99 229.767 7.506 8.950 756 HA ASP 99 HA ASP 99 230.894 9.283 10.852 757 1HB ASP 99 HB2 ASP 99 229.634 6.606 11.444 758 2HB ASP 99 HB1 ASP 99 229.734 8.009 12.505 759 H GLU 100 HN GLU 100 232.211 6.595 9.291 760 HA GLU 100 HA GLU 100 234.141 6.201 11.480 761 1HB GLU 100 HB2 GLU 100 232.608 4.300 10.094 762 2HB GLU 100 HB1 GLU 100 234.250 4.115 9.492 763 1HG GLU 100 HG2 GLU 100 234.885 4.145 12.016 764 2HG GLU 100 HG1 GLU 100 233.189 3.726 12.252 765 H MET 101 HN MET 101 233.732 6.896 8.086 766 HA MET 101 HA MET 101 236.654 7.105 7.814 767 1HB MET 101 HB2 MET 101 234.613 6.047 6.076 768 2HB MET 101 HB1 MET 101 235.474 7.351 5.270 769 1HG MET 101 HG2 MET 101 236.685 4.881 6.489 770 2HG MET 101 HG1 MET 101 236.517 5.239 4.770 771 1HE MET 101 HE1 MET 101 240.075 6.048 7.264 772 2HE MET 101 HE2 MET 101 239.152 4.590 6.902 773 3HE MET 101 HE3 MET 101 238.507 5.786 8.026 774 H ARG 102 HN ARG 102 237.517 8.905 6.648 775 HA ARG 102 HA ARG 102 235.833 11.195 6.143 776 1HB ARG 102 HB2 ARG 102 236.177 11.405 8.554 777 2HB ARG 102 HB1 ARG 102 237.915 11.250 8.343 778 1HG ARG 102 HG2 ARG 102 238.166 13.391 7.681 779 2HG ARG 102 HG1 ARG 102 236.619 13.426 6.832 780 1HD ARG 102 HD2 ARG 102 235.423 13.700 8.887 781 2HD ARG 102 HD1 ARG 102 236.888 13.439 9.833 782 HE ARG 102 HE ARG 102 236.052 15.878 8.568 783 1HH1 ARG 102 HH11 ARG 102 238.796 14.067 9.736 784 2HH1 ARG 102 HH12 ARG 102 239.783 15.471 9.967 785 1HH2 ARG 102 HH21 ARG 102 237.348 17.726 8.872 786 2HH2 ARG 102 HH22 ARG 102 238.961 17.548 9.477 787 HA PRO 103 HA PRO 103 239.395 10.980 3.276 788 1HB PRO 103 HB2 PRO 103 238.144 12.158 1.195 789 2HB PRO 103 HB1 PRO 103 237.907 10.452 1.594 790 1HG PRO 103 HG2 PRO 103 236.190 12.812 2.286 791 2HG PRO 103 HG1 PRO 103 235.704 11.234 1.637 792 1HD PRO 103 HD2 PRO 103 235.503 11.818 4.265 793 2HD PRO 103 HD1 PRO 103 235.901 10.185 3.696 794 H CYS 104 HN CYS 104 240.923 12.485 2.924 795 HA CYS 104 HA CYS 104 240.189 15.316 3.219 796 1HB CYS 104 HB2 CYS 104 241.541 13.963 5.156 797 2HB CYS 104 HB1 CYS 104 242.877 14.565 4.181 798 HG CYS 104 HG CYS 104 240.987 16.280 5.890 799 H TRP 105 HN TRP 105 240.719 16.424 1.474 800 HA TRP 105 HA TRP 105 242.612 15.311 -0.430 801 1HB TRP 105 HB2 TRP 105 240.891 17.796 -0.620 802 2HB TRP 105 HB1 TRP 105 241.812 17.073 -1.936 803 HD1 TRP 105 HD1 TRP 105 239.260 15.519 0.570 804 HE1 TRP 105 HE1 TRP 105 237.522 14.193 -0.795 805 HE3 TRP 105 HE3 TRP 105 241.008 16.506 -4.134 806 HZ2 TRP 105 HZ2 TRP 105 236.972 13.644 -3.510 807 HZ3 TRP 105 HZ3 TRP 105 239.818 15.542 -6.059 808 HH2 TRP 105 HH2 TRP 105 237.843 14.140 -5.752 809 H PHE 106 HN PHE 106 244.670 15.974 -0.634 810 HA PHE 106 HA PHE 106 245.445 18.647 0.218 811 1HB PHE 106 HB2 PHE 106 247.273 17.751 1.663 812 2HB PHE 106 HB1 PHE 106 245.663 17.407 2.291 813 HD1 PHE 106 HD1 PHE 106 244.677 15.087 1.398 814 HD2 PHE 106 HD2 PHE 106 248.800 16.044 1.730 815 HE1 PHE 106 HE1 PHE 106 245.217 12.699 1.445 816 HE2 PHE 106 HE2 PHE 106 249.352 13.662 1.776 817 HZ PHE 106 HZ PHE 106 247.555 11.977 1.635 818 H GLN 107 HN GLN 107 248.114 18.547 0.063 819 HA GLN 107 HA GLN 107 248.541 18.023 -2.740 820 1HB GLN 107 HB2 GLN 107 249.480 19.925 -1.041 821 2HB GLN 107 HB1 GLN 107 250.851 18.826 -1.103 822 1HG GLN 107 HG2 GLN 107 251.232 19.203 -3.335 823 2HG GLN 107 HG1 GLN 107 249.566 19.690 -3.646 824 1HE2 GLN 107 HE21 GLN 107 249.070 21.790 -3.636 825 2HE2 GLN 107 HE22 GLN 107 250.151 23.063 -3.194 826 H LEU 108 HN LEU 108 250.633 17.016 -3.433 827 HA LEU 108 HA LEU 108 250.904 14.416 -2.126 828 1HB LEU 108 HB2 LEU 108 251.664 13.592 -4.158 829 2HB LEU 108 HB1 LEU 108 250.502 14.810 -4.651 830 HG LEU 108 HG LEU 108 253.508 15.081 -4.664 831 1HD1 LEU 108 HD11 LEU 108 252.898 13.811 -6.523 832 2HD1 LEU 108 HD12 LEU 108 252.999 15.462 -7.134 833 3HD1 LEU 108 HD13 LEU 108 251.426 14.742 -6.791 834 1HD2 LEU 108 HD21 LEU 108 252.511 17.193 -4.028 835 2HD2 LEU 108 HD22 LEU 108 251.374 17.087 -5.369 836 3HD2 LEU 108 HD23 LEU 108 253.096 17.281 -5.688 837 H ASP 109 HN ASP 109 252.215 17.054 -1.274 838 HA ASP 109 HA ASP 109 254.937 15.958 -1.069 839 1HB ASP 109 HB2 ASP 109 255.713 18.374 -0.989 840 2HB ASP 109 HB1 ASP 109 255.151 17.802 -2.556 841 H GLN 110 HN GLN 110 252.571 15.785 0.703 842 HA GLN 110 HA GLN 110 253.924 16.479 3.135 843 1HB GLN 110 HB2 GLN 110 252.205 17.933 4.043 844 2HB GLN 110 HB1 GLN 110 252.862 18.621 2.564 845 1HG GLN 110 HG2 GLN 110 250.910 17.757 1.332 846 2HG GLN 110 HG1 GLN 110 250.245 17.164 2.853 847 1HE2 GLN 110 HE21 GLN 110 250.926 19.952 0.912 848 2HE2 GLN 110 HE22 GLN 110 250.011 21.082 1.844 849 H ILE 111 HN ILE 111 252.704 14.105 1.733 850 HA ILE 111 HA ILE 111 250.420 13.376 3.310 851 HB ILE 111 HB ILE 111 251.840 11.041 2.375 852 1HG1 ILE 111 HG12 ILE 111 251.130 11.735 -0.111 853 2HG1 ILE 111 HG11 ILE 111 251.646 13.312 0.482 854 1HG2 ILE 111 HG21 ILE 111 249.784 10.327 2.181 855 2HG2 ILE 111 HG22 ILE 111 249.393 11.578 1.001 856 3HG2 ILE 111 HG23 ILE 111 249.236 11.911 2.725 857 1HD1 ILE 111 HD11 ILE 111 253.788 12.270 1.175 858 2HD1 ILE 111 HD12 ILE 111 253.499 12.231 -0.565 859 3HD1 ILE 111 HD13 ILE 111 253.254 10.777 0.405 860 HA PRO 112 HA PRO 112 252.899 11.960 6.726 861 1HB PRO 112 HB2 PRO 112 250.993 11.979 8.572 862 2HB PRO 112 HB1 PRO 112 251.519 13.500 7.837 863 1HG PRO 112 HG2 PRO 112 249.058 11.896 7.312 864 2HG PRO 112 HG1 PRO 112 249.269 13.655 7.323 865 1HD PRO 112 HD2 PRO 112 249.269 11.964 5.063 866 2HD PRO 112 HD1 PRO 112 249.734 13.676 5.108 867 H PHE 113 HN PHE 113 253.432 9.871 6.108 868 HA PHE 113 HA PHE 113 251.443 7.791 6.219 869 1HB PHE 113 HB2 PHE 113 254.207 6.865 6.138 870 2HB PHE 113 HB1 PHE 113 252.868 6.516 5.064 871 HD1 PHE 113 HD1 PHE 113 255.901 7.110 4.599 872 HD2 PHE 113 HD2 PHE 113 252.321 9.394 4.140 873 HE1 PHE 113 HE1 PHE 113 256.992 8.449 2.859 874 HE2 PHE 113 HE2 PHE 113 253.432 10.737 2.406 875 HZ PHE 113 HZ PHE 113 255.756 10.273 1.758 876 H LYS 114 HN LYS 114 253.570 9.262 8.437 877 HA LYS 114 HA LYS 114 254.040 7.091 10.177 878 1HB LYS 114 HB2 LYS 114 254.949 9.635 10.083 879 2HB LYS 114 HB1 LYS 114 253.733 9.803 11.343 880 1HG LYS 114 HG2 LYS 114 255.676 9.329 12.516 881 2HG LYS 114 HG1 LYS 114 254.863 7.766 12.422 882 1HD LYS 114 HD2 LYS 114 256.328 7.669 10.165 883 2HD LYS 114 HD1 LYS 114 257.372 8.684 11.164 884 1HE LYS 114 HE2 LYS 114 257.106 6.920 12.971 885 2HE LYS 114 HE1 LYS 114 256.396 5.895 11.724 886 1HZ LYS 114 HZ1 LYS 114 258.424 6.013 10.470 887 2HZ LYS 114 HZ2 LYS 114 258.790 5.514 12.043 888 3HZ LYS 114 HZ3 LYS 114 259.103 7.107 11.568 889 H ASP 115 HN ASP 115 251.352 9.132 9.522 890 HA ASP 115 HA ASP 115 249.918 8.073 11.836 891 1HB ASP 115 HB2 ASP 115 249.555 10.546 10.176 892 2HB ASP 115 HB1 ASP 115 248.210 9.901 11.112 893 H MET 116 HN MET 116 250.496 6.614 9.367 894 HA MET 116 HA MET 116 247.735 6.063 8.543 895 1HB MET 116 HB2 MET 116 250.168 6.433 6.845 896 2HB MET 116 HB1 MET 116 248.926 5.306 6.321 897 1HG MET 116 HG2 MET 116 247.410 6.943 5.900 898 2HG MET 116 HG1 MET 116 248.067 8.024 7.125 899 1HE MET 116 HE1 MET 116 250.569 7.334 3.313 900 2HE MET 116 HE2 MET 116 249.391 6.162 3.903 901 3HE MET 116 HE3 MET 116 250.834 6.515 4.851 902 H TRP 117 HN TRP 117 250.765 4.472 7.642 903 HA TRP 117 HA TRP 117 250.189 2.215 9.370 904 1HB TRP 117 HB2 TRP 117 250.057 2.051 6.361 905 2HB TRP 117 HB1 TRP 117 250.392 0.639 7.354 906 HD1 TRP 117 HD1 TRP 117 247.591 2.372 5.798 907 HE1 TRP 117 HE1 TRP 117 245.348 1.639 6.827 908 HE3 TRP 117 HE3 TRP 117 249.347 0.022 9.985 909 HZ2 TRP 117 HZ2 TRP 117 244.443 0.250 9.110 910 HZ3 TRP 117 HZ3 TRP 117 247.726 -0.983 11.541 911 HH2 TRP 117 HH2 TRP 117 245.325 -0.870 11.112 912 HA PRO 118 HA PRO 118 254.584 1.846 9.239 913 1HB PRO 118 HB2 PRO 118 254.993 -0.715 9.884 914 2HB PRO 118 HB1 PRO 118 254.260 0.417 11.024 915 1HG PRO 118 HG2 PRO 118 252.950 -1.645 9.297 916 2HG PRO 118 HG1 PRO 118 252.613 -1.221 10.985 917 1HD PRO 118 HD2 PRO 118 251.149 -0.320 8.835 918 2HD PRO 118 HD1 PRO 118 251.249 0.515 10.397 919 H ASP 119 HN ASP 119 252.885 0.902 6.685 920 HA ASP 119 HA ASP 119 255.212 -0.309 5.351 921 1HB ASP 119 HB2 ASP 119 253.483 -1.380 3.807 922 2HB ASP 119 HB1 ASP 119 253.605 -2.038 5.436 923 H ASP 120 HN ASP 120 252.791 2.148 5.325 924 HA ASP 120 HA ASP 120 252.502 2.905 2.726 925 1HB ASP 120 HB2 ASP 120 252.791 4.574 5.204 926 2HB ASP 120 HB1 ASP 120 252.417 5.280 3.633 927 H SER 121 HN SER 121 255.051 4.206 4.850 928 HA SER 121 HA SER 121 256.421 5.669 2.935 929 1HB SER 121 HB2 SER 121 258.076 4.359 5.013 930 2HB SER 121 HB1 SER 121 257.947 6.062 4.575 931 HG SER 121 HG SER 121 256.511 4.587 6.422 932 H TYR 122 HN TYR 122 256.279 2.245 3.239 933 HA TYR 122 HA TYR 122 258.813 1.781 1.948 934 1HB TYR 122 HB2 TYR 122 256.628 0.030 3.003 935 2HB TYR 122 HB1 TYR 122 257.818 -0.638 1.892 936 HD1 TYR 122 HD1 TYR 122 257.110 -0.867 5.089 937 HD2 TYR 122 HD2 TYR 122 260.289 0.682 2.724 938 HE1 TYR 122 HE1 TYR 122 258.662 -1.205 6.967 939 HE2 TYR 122 HE2 TYR 122 261.851 0.349 4.594 940 HH TYR 122 HH TYR 122 261.108 0.071 7.583 941 H TRP 123 HN TRP 123 255.508 2.202 0.949 942 HA TRP 123 HA TRP 123 256.327 1.368 -1.744 943 1HB TRP 123 HB2 TRP 123 254.010 0.750 -2.223 944 2HB TRP 123 HB1 TRP 123 254.664 -0.164 -0.871 945 HD1 TRP 123 HD1 TRP 123 253.557 0.203 1.510 946 HE1 TRP 123 HE1 TRP 123 251.342 1.294 2.245 947 HE3 TRP 123 HE3 TRP 123 252.419 2.711 -2.796 948 HZ2 TRP 123 HZ2 TRP 123 249.370 3.004 1.142 949 HZ3 TRP 123 HZ3 TRP 123 250.349 4.040 -2.870 950 HH2 TRP 123 HH2 TRP 123 248.863 4.173 -0.951 951 H PHE 124 HN PHE 124 255.304 4.000 0.106 952 HA PHE 124 HA PHE 124 253.926 5.399 -1.972 953 1HB PHE 124 HB2 PHE 124 254.152 5.702 0.768 954 2HB PHE 124 HB1 PHE 124 255.036 7.084 0.135 955 HD1 PHE 124 HD1 PHE 124 252.212 5.687 -1.749 956 HD2 PHE 124 HD2 PHE 124 253.427 8.628 1.074 957 HE1 PHE 124 HE1 PHE 124 250.098 6.890 -2.088 958 HE2 PHE 124 HE2 PHE 124 251.321 9.823 0.751 959 HZ PHE 124 HZ PHE 124 249.645 8.962 -0.838 960 HA PRO 125 HA PRO 125 258.176 7.833 -2.155 961 1HB PRO 125 HB2 PRO 125 260.330 6.111 -1.959 962 2HB PRO 125 HB1 PRO 125 259.766 7.182 -0.673 963 1HG PRO 125 HG2 PRO 125 259.256 4.271 -1.079 964 2HG PRO 125 HG1 PRO 125 259.549 5.162 0.424 965 1HD PRO 125 HD2 PRO 125 257.092 4.371 -0.304 966 2HD PRO 125 HD1 PRO 125 257.358 5.895 0.563 967 H LEU 126 HN LEU 126 257.829 4.475 -3.232 968 HA LEU 126 HA LEU 126 259.237 4.986 -5.696 969 1HB LEU 126 HB2 LEU 126 258.562 2.719 -6.333 970 2HB LEU 126 HB1 LEU 126 259.333 2.760 -4.759 971 HG LEU 126 HG LEU 126 256.621 2.985 -4.187 972 1HD1 LEU 126 HD11 LEU 126 255.696 0.970 -5.347 973 2HD1 LEU 126 HD12 LEU 126 257.085 1.035 -6.433 974 3HD1 LEU 126 HD13 LEU 126 255.940 2.375 -6.386 975 1HD2 LEU 126 HD21 LEU 126 258.629 0.767 -4.075 976 2HD2 LEU 126 HD22 LEU 126 256.970 0.516 -3.533 977 3HD2 LEU 126 HD23 LEU 126 257.975 1.744 -2.761 978 H LEU 127 HN LEU 127 255.944 5.001 -4.553 979 HA LEU 127 HA LEU 127 254.549 4.942 -6.984 980 1HB LEU 127 HB2 LEU 127 253.973 6.420 -4.415 981 2HB LEU 127 HB1 LEU 127 252.850 6.348 -5.755 982 HG LEU 127 HG LEU 127 253.243 4.496 -3.614 983 1HD1 LEU 127 HD11 LEU 127 251.153 3.530 -4.620 984 2HD1 LEU 127 HD12 LEU 127 251.307 4.735 -5.899 985 3HD1 LEU 127 HD13 LEU 127 251.085 5.248 -4.227 986 1HD2 LEU 127 HD21 LEU 127 253.238 2.401 -4.877 987 2HD2 LEU 127 HD22 LEU 127 254.739 3.293 -5.120 988 3HD2 LEU 127 HD23 LEU 127 253.498 3.299 -6.372 989 H LEU 128 HN LEU 128 255.715 7.657 -5.056 990 HA LEU 128 HA LEU 128 255.048 9.752 -6.751 991 1HB LEU 128 HB2 LEU 128 257.066 9.322 -4.616 992 2HB LEU 128 HB1 LEU 128 257.298 10.714 -5.657 993 HG LEU 128 HG LEU 128 254.583 10.393 -4.538 994 1HD1 LEU 128 HD11 LEU 128 256.907 11.210 -2.799 995 2HD1 LEU 128 HD12 LEU 128 255.963 9.729 -2.628 996 3HD1 LEU 128 HD13 LEU 128 255.199 11.298 -2.367 997 1HD2 LEU 128 HD21 LEU 128 254.958 12.862 -4.177 998 2HD2 LEU 128 HD22 LEU 128 255.008 12.315 -5.853 999 3HD2 LEU 128 HD23 LEU 128 256.508 12.660 -4.992 1000 H GLN 129 HN GLN 129 257.574 7.400 -7.016 1001 HA GLN 129 HA GLN 129 259.029 8.898 -9.033 1002 1HB GLN 129 HB2 GLN 129 260.175 7.464 -7.326 1003 2HB GLN 129 HB1 GLN 129 259.470 6.056 -8.107 1004 1HG GLN 129 HG2 GLN 129 261.811 6.493 -8.757 1005 2HG GLN 129 HG1 GLN 129 260.690 6.476 -10.117 1006 1HE2 GLN 129 HE21 GLN 129 262.641 8.492 -8.035 1007 2HE2 GLN 129 HE22 GLN 129 262.679 9.870 -9.078 1008 H LYS 130 HN LYS 130 256.218 7.277 -9.104 1009 HA LYS 130 HA LYS 130 254.948 6.291 -10.690 1010 1HB LYS 130 HB2 LYS 130 255.013 7.257 -12.749 1011 2HB LYS 130 HB1 LYS 130 256.073 8.371 -11.904 1012 1HG LYS 130 HG2 LYS 130 257.842 6.495 -12.809 1013 2HG LYS 130 HG1 LYS 130 256.638 6.523 -14.096 1014 1HD LYS 130 HD2 LYS 130 258.301 8.137 -14.645 1015 2HD LYS 130 HD1 LYS 130 256.865 9.021 -14.125 1016 1HE LYS 130 HE2 LYS 130 257.901 9.159 -11.842 1017 2HE LYS 130 HE1 LYS 130 259.375 8.498 -12.544 1018 1HZ LYS 130 HZ1 LYS 130 258.141 11.129 -12.956 1019 2HZ LYS 130 HZ2 LYS 130 259.064 10.458 -14.204 1020 3HZ LYS 130 HZ3 LYS 130 259.765 10.734 -12.690 1021 H LYS 131 HN LYS 131 257.183 4.793 -9.497 1022 HA LYS 131 HA LYS 131 257.652 2.835 -11.649 1023 1HB LYS 131 HB2 LYS 131 259.221 3.218 -9.093 1024 2HB LYS 131 HB1 LYS 131 259.586 2.066 -10.370 1025 1HG LYS 131 HG2 LYS 131 259.389 4.883 -11.206 1026 2HG LYS 131 HG1 LYS 131 260.744 4.478 -10.149 1027 1HD LYS 131 HD2 LYS 131 261.426 2.711 -11.688 1028 2HD LYS 131 HD1 LYS 131 260.056 3.081 -12.734 1029 1HE LYS 131 HE2 LYS 131 261.802 5.357 -12.071 1030 2HE LYS 131 HE1 LYS 131 262.539 4.099 -13.062 1031 1HZ LYS 131 HZ1 LYS 131 261.137 4.508 -14.791 1032 2HZ LYS 131 HZ2 LYS 131 261.206 6.064 -14.133 1033 3HZ LYS 131 HZ3 LYS 131 259.878 5.067 -13.808 1034 H LYS 132 HN LYS 132 257.484 0.592 -11.137 1035 HA LYS 132 HA LYS 132 255.518 0.076 -9.021 1036 1HB LYS 132 HB2 LYS 132 256.298 -1.659 -11.370 1037 2HB LYS 132 HB1 LYS 132 254.990 -1.976 -10.238 1038 1HG LYS 132 HG2 LYS 132 253.603 -0.482 -11.208 1039 2HG LYS 132 HG1 LYS 132 254.911 0.620 -11.642 1040 1HD LYS 132 HD2 LYS 132 254.502 -0.126 -13.730 1041 2HD LYS 132 HD1 LYS 132 255.499 -1.491 -13.224 1042 1HE LYS 132 HE2 LYS 132 253.089 -2.287 -12.312 1043 2HE LYS 132 HE1 LYS 132 252.594 -1.333 -13.709 1044 1HZ LYS 132 HZ1 LYS 132 254.718 -3.368 -13.943 1045 2HZ LYS 132 HZ2 LYS 132 253.740 -2.714 -15.157 1046 3HZ LYS 132 HZ3 LYS 132 253.086 -3.806 -14.042 1047 H PHE 133 HN PHE 133 256.087 -0.972 -7.238 1048 HA PHE 133 HA PHE 133 258.400 -2.783 -7.306 1049 1HB PHE 133 HB2 PHE 133 257.955 -0.449 -5.472 1050 2HB PHE 133 HB1 PHE 133 258.875 -1.841 -4.922 1051 HD1 PHE 133 HD1 PHE 133 258.735 0.411 -7.904 1052 HD2 PHE 133 HD2 PHE 133 261.142 -1.699 -5.099 1053 HE1 PHE 133 HE1 PHE 133 260.759 1.344 -8.945 1054 HE2 PHE 133 HE2 PHE 133 263.169 -0.769 -6.136 1055 HZ PHE 133 HZ PHE 133 262.980 0.755 -8.061 1056 H HIS 134 HN HIS 134 258.443 -4.316 -5.532 1057 HA HIS 134 HA HIS 134 255.778 -4.796 -4.362 1058 1HB HIS 134 HB2 HIS 134 257.831 -6.858 -5.202 1059 2HB HIS 134 HB1 HIS 134 256.274 -7.206 -4.459 1060 HD1 HIS 134 HD1 HIS 134 255.153 -4.742 -6.507 1061 HD2 HIS 134 HD2 HIS 134 256.764 -8.473 -7.366 1062 HE1 HIS 134 HE1 HIS 134 254.332 -5.312 -8.814 1063 HE2 HIS 134 HE2 HIS 134 255.245 -7.614 -9.275 1064 H GLY 135 HN GLY 135 255.729 -4.770 -2.180 1065 1HA GLY 135 HA2 GLY 135 258.313 -5.104 -0.787 1066 2HA GLY 135 HA1 GLY 135 257.050 -4.016 -0.240 1067 H TYR 136 HN TYR 136 258.517 -6.647 0.683 1068 HA TYR 136 HA TYR 136 256.073 -8.007 1.608 1069 1HB TYR 136 HB2 TYR 136 258.860 -9.161 1.344 1070 2HB TYR 136 HB1 TYR 136 257.419 -10.034 1.852 1071 HD1 TYR 136 HD1 TYR 136 256.403 -11.359 0.266 1072 HD2 TYR 136 HD2 TYR 136 258.538 -7.912 -1.021 1073 HE1 TYR 136 HE1 TYR 136 255.936 -11.952 -2.074 1074 HE2 TYR 136 HE2 TYR 136 258.075 -8.493 -3.365 1075 HH TYR 136 HH TYR 136 257.546 -10.715 -4.640 1076 H PHE 137 HN PHE 137 255.603 -7.376 3.613 1077 HA PHE 137 HA PHE 137 257.825 -6.846 5.472 1078 1HB PHE 137 HB2 PHE 137 254.978 -5.946 5.867 1079 2HB PHE 137 HB1 PHE 137 256.440 -5.321 6.622 1080 HD1 PHE 137 HD1 PHE 137 254.001 -4.566 4.337 1081 HD2 PHE 137 HD2 PHE 137 258.236 -4.508 4.738 1082 HE1 PHE 137 HE1 PHE 137 254.139 -2.820 2.608 1083 HE2 PHE 137 HE2 PHE 137 258.381 -2.763 3.011 1084 HZ PHE 137 HZ PHE 137 256.329 -1.917 1.944 1085 H LYS 138 HN LYS 138 258.110 -8.123 7.173 1086 HA LYS 138 HA LYS 138 256.199 -10.242 7.743 1087 1HB LYS 138 HB2 LYS 138 258.669 -10.687 7.597 1088 2HB LYS 138 HB1 LYS 138 258.877 -9.700 9.035 1089 1HG LYS 138 HG2 LYS 138 258.122 -11.308 10.415 1090 2HG LYS 138 HG1 LYS 138 256.911 -11.876 9.265 1091 1HD LYS 138 HD2 LYS 138 259.202 -12.586 7.999 1092 2HD LYS 138 HD1 LYS 138 259.686 -12.757 9.688 1093 1HE LYS 138 HE2 LYS 138 258.120 -14.407 10.104 1094 2HE LYS 138 HE1 LYS 138 257.089 -13.909 8.763 1095 1HZ LYS 138 HZ1 LYS 138 259.699 -15.311 8.555 1096 2HZ LYS 138 HZ2 LYS 138 258.805 -14.749 7.235 1097 3HZ LYS 138 HZ3 LYS 138 258.173 -15.965 8.226 1098 H PHE 139 HN PHE 139 254.673 -9.968 9.280 1099 HA PHE 139 HA PHE 139 255.056 -7.762 11.175 1100 1HB PHE 139 HB2 PHE 139 252.674 -9.019 9.913 1101 2HB PHE 139 HB1 PHE 139 252.479 -8.338 11.524 1102 HD1 PHE 139 HD1 PHE 139 253.709 -7.498 8.120 1103 HD2 PHE 139 HD2 PHE 139 252.097 -6.069 11.790 1104 HE1 PHE 139 HE1 PHE 139 253.468 -5.257 7.136 1105 HE2 PHE 139 HE2 PHE 139 251.849 -3.825 10.812 1106 HZ PHE 139 HZ PHE 139 252.536 -3.417 8.481 1107 H GLN 140 HN GLN 140 254.731 -7.973 13.348 1108 HA GLN 140 HA GLN 140 255.296 -10.568 14.459 1109 1HB GLN 140 HB2 GLN 140 256.464 -8.947 15.604 1110 2HB GLN 140 HB1 GLN 140 255.182 -7.760 15.446 1111 1HG GLN 140 HG2 GLN 140 255.433 -8.347 17.747 1112 2HG GLN 140 HG1 GLN 140 253.893 -8.973 17.164 1113 1HE2 GLN 140 HE21 GLN 140 257.247 -10.133 17.050 1114 2HE2 GLN 140 HE22 GLN 140 256.915 -11.685 17.732 1115 H GLY 141 HN GLY 141 252.491 -9.003 13.551 1116 1HA GLY 141 HA2 GLY 141 250.800 -10.956 14.680 1117 2HA GLY 141 HA1 GLY 141 250.705 -9.487 15.640 1118 H GLN 142 HN GLN 142 250.914 -7.553 13.654 1119 HA GLN 142 HA GLN 142 249.356 -7.879 11.388 1120 1HB GLN 142 HB2 GLN 142 247.215 -6.768 12.225 1121 2HB GLN 142 HB1 GLN 142 247.449 -8.461 12.637 1122 1HG GLN 142 HG2 GLN 142 247.780 -8.021 14.858 1123 2HG GLN 142 HG1 GLN 142 248.357 -6.382 14.560 1124 1HE2 GLN 142 HE21 GLN 142 247.002 -5.333 15.929 1125 2HE2 GLN 142 HE22 GLN 142 245.288 -5.262 15.721 1126 H ASP 143 HN ASP 143 250.287 -5.772 14.038 1127 HA ASP 143 HA ASP 143 250.291 -3.500 12.160 1128 1HB ASP 143 HB2 ASP 143 250.084 -3.484 15.178 1129 2HB ASP 143 HB1 ASP 143 250.184 -2.046 14.167 1130 H THR 144 HN THR 144 252.179 -5.324 14.481 1131 HA THR 144 HA THR 144 254.426 -3.511 14.324 1132 HB THR 144 HB THR 144 254.006 -6.165 15.680 1133 HG1 THR 144 HG1 THR 144 253.472 -4.903 17.247 1134 1HG2 THR 144 HG21 THR 144 256.201 -5.868 16.738 1135 2HG2 THR 144 HG22 THR 144 256.531 -4.531 15.636 1136 3HG2 THR 144 HG23 THR 144 256.319 -6.163 15.003 1137 H ILE 145 HN ILE 145 256.190 -3.701 13.059 1138 HA ILE 145 HA ILE 145 256.262 -6.012 11.248 1139 HB ILE 145 HB ILE 145 257.497 -3.297 10.781 1140 1HG1 ILE 145 HG12 ILE 145 255.032 -4.558 9.557 1141 2HG1 ILE 145 HG11 ILE 145 255.037 -3.218 10.699 1142 1HG2 ILE 145 HG21 ILE 145 257.380 -4.504 8.361 1143 2HG2 ILE 145 HG22 ILE 145 257.667 -5.893 9.408 1144 3HG2 ILE 145 HG23 ILE 145 258.793 -4.536 9.416 1145 1HD1 ILE 145 HD11 ILE 145 256.343 -1.908 9.018 1146 2HD1 ILE 145 HD12 ILE 145 254.700 -2.322 8.528 1147 3HD1 ILE 145 HD13 ILE 145 256.068 -3.224 7.875 1148 H LEU 146 HN LEU 146 257.980 -7.306 11.222 1149 HA LEU 146 HA LEU 146 260.298 -6.535 12.867 1150 1HB LEU 146 HB2 LEU 146 259.570 -9.368 12.192 1151 2HB LEU 146 HB1 LEU 146 260.596 -8.781 13.488 1152 HG LEU 146 HG LEU 146 257.679 -8.101 13.475 1153 1HD1 LEU 146 HD11 LEU 146 258.832 -10.759 13.752 1154 2HD1 LEU 146 HD12 LEU 146 257.150 -10.264 13.559 1155 3HD1 LEU 146 HD13 LEU 146 257.891 -10.263 15.158 1156 1HD2 LEU 146 HD21 LEU 146 258.555 -6.969 15.222 1157 2HD2 LEU 146 HD22 LEU 146 259.946 -8.045 15.363 1158 3HD2 LEU 146 HD23 LEU 146 258.386 -8.527 16.030 1159 H ASP 147 HN ASP 147 259.250 -7.168 9.725 1160 HA ASP 147 HA ASP 147 261.963 -7.083 8.735 1161 1HB ASP 147 HB2 ASP 147 260.841 -9.575 9.072 1162 2HB ASP 147 HB1 ASP 147 260.453 -9.214 7.392 1163 H TYR 148 HN TYR 148 262.101 -6.109 6.741 1164 HA TYR 148 HA TYR 148 259.624 -5.775 5.227 1165 1HB TYR 148 HB2 TYR 148 259.917 -3.398 4.968 1166 2HB TYR 148 HB1 TYR 148 259.865 -3.790 6.683 1167 HD1 TYR 148 HD1 TYR 148 261.893 -3.630 8.056 1168 HD2 TYR 148 HD2 TYR 148 261.923 -2.528 3.947 1169 HE1 TYR 148 HE1 TYR 148 264.028 -2.457 8.393 1170 HE2 TYR 148 HE2 TYR 148 264.058 -1.353 4.271 1171 HH TYR 148 HH TYR 148 266.023 -1.794 6.869 1172 H THR 149 HN THR 149 259.877 -6.001 3.091 1173 HA THR 149 HA THR 149 262.602 -5.774 2.002 1174 HB THR 149 HB THR 149 261.194 -7.603 0.394 1175 HG1 THR 149 HG1 THR 149 259.873 -7.850 2.346 1176 1HG2 THR 149 HG21 THR 149 262.865 -9.188 1.030 1177 2HG2 THR 149 HG22 THR 149 263.281 -8.241 2.458 1178 3HG2 THR 149 HG23 THR 149 263.618 -7.604 0.849 1179 H LEU 150 HN LEU 150 262.790 -4.985 -0.074 1180 HA LEU 150 HA LEU 150 260.343 -3.995 -1.350 1181 1HB LEU 150 HB2 LEU 150 262.809 -2.404 -0.690 1182 2HB LEU 150 HB1 LEU 150 261.676 -1.899 -1.930 1183 HG LEU 150 HG LEU 150 260.011 -2.332 0.203 1184 1HD1 LEU 150 HD11 LEU 150 262.193 -0.770 1.458 1185 2HD1 LEU 150 HD12 LEU 150 262.344 -2.527 1.450 1186 3HD1 LEU 150 HD13 LEU 150 260.939 -1.766 2.196 1187 1HD2 LEU 150 HD21 LEU 150 259.895 -0.429 -1.274 1188 2HD2 LEU 150 HD22 LEU 150 261.403 0.211 -0.624 1189 3HD2 LEU 150 HD23 LEU 150 259.968 0.131 0.397 1190 H ARG 151 HN ARG 151 260.225 -4.604 -3.391 1191 HA ARG 151 HA ARG 151 262.724 -5.078 -4.876 1192 1HB ARG 151 HB2 ARG 151 260.164 -6.678 -5.060 1193 2HB ARG 151 HB1 ARG 151 261.597 -6.925 -6.050 1194 1HG ARG 151 HG2 ARG 151 261.934 -7.024 -3.108 1195 2HG ARG 151 HG1 ARG 151 261.098 -8.370 -3.887 1196 1HD ARG 151 HD2 ARG 151 263.371 -8.985 -3.835 1197 2HD ARG 151 HD1 ARG 151 263.058 -8.470 -5.492 1198 HE ARG 151 HE ARG 151 264.051 -6.359 -3.828 1199 1HH1 ARG 151 HH11 ARG 151 264.968 -9.083 -5.806 1200 2HH1 ARG 151 HH12 ARG 151 266.553 -8.470 -6.136 1201 1HH2 ARG 151 HH21 ARG 151 266.135 -5.549 -4.261 1202 2HH2 ARG 151 HH22 ARG 151 267.216 -6.463 -5.259 1203 H GLU 152 HN GLU 152 262.506 -4.890 -7.229 1204 HA GLU 152 HA GLU 152 260.532 -2.819 -7.921 1205 1HB GLU 152 HB2 GLU 152 262.065 -2.059 -9.612 1206 2HB GLU 152 HB1 GLU 152 262.950 -2.219 -8.103 1207 1HG GLU 152 HG2 GLU 152 263.529 -4.589 -9.041 1208 2HG GLU 152 HG1 GLU 152 263.134 -3.842 -10.589 1209 H VAL 153 HN VAL 153 259.423 -2.928 -9.907 1210 HA VAL 153 HA VAL 153 259.639 -5.385 -11.466 1211 HB VAL 153 HB VAL 153 257.158 -5.694 -11.423 1212 1HG1 VAL 153 HG11 VAL 153 259.057 -6.681 -9.744 1213 2HG1 VAL 153 HG12 VAL 153 257.385 -7.235 -9.808 1214 3HG1 VAL 153 HG13 VAL 153 257.874 -6.045 -8.601 1215 1HG2 VAL 153 HG21 VAL 153 256.976 -3.263 -10.370 1216 2HG2 VAL 153 HG22 VAL 153 257.003 -4.190 -8.870 1217 3HG2 VAL 153 HG23 VAL 153 255.758 -4.504 -10.078 1218 H ASP 154 HN ASP 154 259.061 -5.154 -13.589 1219 HA ASP 154 HA ASP 154 257.641 -2.781 -14.467 1220 1HB ASP 154 HB2 ASP 154 260.307 -2.492 -14.303 1221 2HB ASP 154 HB1 ASP 154 260.205 -3.230 -15.899 1222 H THR 155 HN THR 155 259.638 -5.492 -15.643 1223 HA THR 155 HA THR 155 257.513 -6.070 -17.604 1224 HB THR 155 HB THR 155 260.338 -6.938 -18.064 1225 HG1 THR 155 HG1 THR 155 260.958 -5.002 -18.715 1226 1HG2 THR 155 HG21 THR 155 258.782 -7.737 -19.668 1227 2HG2 THR 155 HG22 THR 155 259.714 -6.447 -20.426 1228 3HG2 THR 155 HG23 THR 155 258.071 -6.136 -19.865 1229 H VAL 156 HN VAL 156 256.886 -8.188 -17.885 1230 HA VAL 156 HA VAL 156 257.816 -10.048 -15.809 1231 HB VAL 156 HB VAL 156 255.410 -9.532 -15.781 1232 1HG1 VAL 156 HG11 VAL 156 253.963 -10.359 -17.594 1233 2HG1 VAL 156 HG12 VAL 156 255.400 -10.762 -18.534 1234 3HG1 VAL 156 HG13 VAL 156 255.053 -9.080 -18.131 1235 1HG2 VAL 156 HG21 VAL 156 255.552 -11.572 -14.836 1236 2HG2 VAL 156 HG22 VAL 156 256.497 -12.239 -16.166 1237 3HG2 VAL 156 HG23 VAL 156 254.745 -12.099 -16.313 Start of MODEL 30 1 1H MET 1 HT1 MET 1 250.358 -22.967 -1.188 2 2H MET 1 HT2 MET 1 249.445 -23.004 0.264 3 3H MET 1 HT3 MET 1 249.146 -21.789 -0.910 4 HA MET 1 HA MET 1 248.609 -23.648 -2.468 5 1HB MET 1 HB2 MET 1 249.617 -25.183 -0.493 6 2HB MET 1 HB1 MET 1 247.913 -25.239 -0.064 7 1HG MET 1 HG2 MET 1 247.321 -26.336 -2.005 8 2HG MET 1 HG1 MET 1 248.761 -25.798 -2.870 9 1HE MET 1 HE1 MET 1 250.988 -27.655 -3.092 10 2HE MET 1 HE2 MET 1 249.414 -27.675 -3.886 11 3HE MET 1 HE3 MET 1 250.068 -29.158 -3.192 12 H GLY 2 HN GLY 2 247.560 -22.466 0.661 13 1HA GLY 2 HA2 GLY 2 245.168 -21.374 -0.364 14 2HA GLY 2 HA1 GLY 2 244.807 -22.895 0.438 15 H ALA 3 HN ALA 3 247.142 -20.340 1.245 16 HA ALA 3 HA ALA 3 245.582 -19.552 3.558 17 1HB ALA 3 HB1 ALA 3 247.895 -19.920 4.877 18 2HB ALA 3 HB2 ALA 3 247.969 -21.276 3.750 19 3HB ALA 3 HB3 ALA 3 246.593 -21.110 4.843 20 H SER 4 HN SER 4 245.540 -17.468 2.805 21 HA SER 4 HA SER 4 247.668 -15.769 3.437 22 1HB SER 4 HB2 SER 4 248.966 -16.266 1.612 23 2HB SER 4 HB1 SER 4 247.584 -16.731 0.623 24 HG SER 4 HG SER 4 248.810 -14.301 0.889 25 H ARG 5 HN ARG 5 246.267 -14.428 4.358 26 HA ARG 5 HA ARG 5 243.761 -13.697 3.385 27 1HB ARG 5 HB2 ARG 5 245.677 -12.477 5.332 28 2HB ARG 5 HB1 ARG 5 244.272 -11.550 4.825 29 1HG ARG 5 HG2 ARG 5 243.468 -12.577 6.704 30 2HG ARG 5 HG1 ARG 5 242.971 -13.723 5.459 31 1HD ARG 5 HD2 ARG 5 244.091 -15.320 6.518 32 2HD ARG 5 HD1 ARG 5 245.588 -14.435 6.232 33 HE ARG 5 HE ARG 5 245.619 -13.915 8.445 34 1HH1 ARG 5 HH11 ARG 5 242.327 -14.654 7.553 35 2HH1 ARG 5 HH12 ARG 5 241.725 -14.509 9.171 36 1HH2 ARG 5 HH21 ARG 5 244.828 -13.725 10.573 37 2HH2 ARG 5 HH22 ARG 5 243.144 -13.981 10.885 38 H LEU 6 HN LEU 6 243.780 -13.183 1.244 39 HA LEU 6 HA LEU 6 245.543 -11.103 0.256 40 1HB LEU 6 HB2 LEU 6 244.569 -13.278 -0.950 41 2HB LEU 6 HB1 LEU 6 243.304 -12.150 -1.397 42 HG LEU 6 HG LEU 6 246.197 -11.520 -1.919 43 1HD1 LEU 6 HD11 LEU 6 245.134 -13.769 -2.924 44 2HD1 LEU 6 HD12 LEU 6 246.292 -12.765 -3.798 45 3HD1 LEU 6 HD13 LEU 6 244.566 -12.607 -4.122 46 1HD2 LEU 6 HD21 LEU 6 244.137 -9.881 -2.080 47 2HD2 LEU 6 HD22 LEU 6 243.904 -10.692 -3.628 48 3HD2 LEU 6 HD23 LEU 6 245.420 -9.857 -3.290 49 H TYR 7 HN TYR 7 245.073 -9.069 0.593 50 HA TYR 7 HA TYR 7 242.263 -8.197 0.482 51 1HB TYR 7 HB2 TYR 7 244.475 -7.049 2.198 52 2HB TYR 7 HB1 TYR 7 242.821 -6.456 2.123 53 HD1 TYR 7 HD1 TYR 7 244.335 -7.362 4.606 54 HD2 TYR 7 HD2 TYR 7 241.692 -9.417 1.982 55 HE1 TYR 7 HE1 TYR 7 243.714 -8.886 6.433 56 HE2 TYR 7 HE2 TYR 7 241.063 -10.945 3.800 57 HH TYR 7 HH TYR 7 241.849 -11.741 5.894 58 H THR 8 HN THR 8 242.358 -5.606 0.319 59 HA THR 8 HA THR 8 244.138 -4.985 -1.956 60 HB THR 8 HB THR 8 242.372 -3.803 -3.007 61 HG1 THR 8 HG1 THR 8 241.278 -2.773 -1.467 62 1HG2 THR 8 HG21 THR 8 242.221 -6.336 -3.077 63 2HG2 THR 8 HG22 THR 8 240.764 -5.432 -3.487 64 3HG2 THR 8 HG23 THR 8 240.922 -6.175 -1.897 65 H LEU 9 HN LEU 9 244.378 -2.637 -2.343 66 HA LEU 9 HA LEU 9 244.065 -0.900 -0.038 67 1HB LEU 9 HB2 LEU 9 246.277 -2.212 0.129 68 2HB LEU 9 HB1 LEU 9 246.803 -1.244 -1.234 69 HG LEU 9 HG LEU 9 246.028 -0.238 1.492 70 1HD1 LEU 9 HD11 LEU 9 248.245 0.093 1.916 71 2HD1 LEU 9 HD12 LEU 9 248.661 0.242 0.208 72 3HD1 LEU 9 HD13 LEU 9 248.338 -1.347 0.903 73 1HD2 LEU 9 HD21 LEU 9 245.258 1.413 0.006 74 2HD2 LEU 9 HD22 LEU 9 246.666 1.237 -1.040 75 3HD2 LEU 9 HD23 LEU 9 246.838 1.970 0.555 76 H VAL 10 HN VAL 10 243.046 0.761 -1.049 77 HA VAL 10 HA VAL 10 244.136 1.654 -3.622 78 HB VAL 10 HB VAL 10 241.917 0.981 -3.975 79 1HG1 VAL 10 HG11 VAL 10 240.160 2.282 -2.427 80 2HG1 VAL 10 HG12 VAL 10 241.486 2.020 -1.297 81 3HG1 VAL 10 HG13 VAL 10 240.747 0.650 -2.126 82 1HG2 VAL 10 HG21 VAL 10 241.641 3.934 -3.521 83 2HG2 VAL 10 HG22 VAL 10 240.828 2.944 -4.732 84 3HG2 VAL 10 HG23 VAL 10 242.560 3.251 -4.862 85 H LEU 11 HN LEU 11 244.999 3.535 -3.794 86 HA LEU 11 HA LEU 11 244.390 5.621 -1.815 87 1HB LEU 11 HB2 LEU 11 246.889 4.317 -2.369 88 2HB LEU 11 HB1 LEU 11 247.009 6.004 -2.830 89 HG LEU 11 HG LEU 11 246.484 4.847 -0.100 90 1HD1 LEU 11 HD11 LEU 11 248.347 7.091 -0.466 91 2HD1 LEU 11 HD12 LEU 11 248.813 5.593 -1.272 92 3HD1 LEU 11 HD13 LEU 11 248.522 5.606 0.468 93 1HD2 LEU 11 HD21 LEU 11 246.339 7.393 0.502 94 2HD2 LEU 11 HD22 LEU 11 244.903 6.491 0.018 95 3HD2 LEU 11 HD23 LEU 11 245.729 7.526 -1.147 96 H VAL 12 HN VAL 12 243.328 7.166 -2.907 97 HA VAL 12 HA VAL 12 243.725 7.454 -5.756 98 HB VAL 12 HB VAL 12 241.964 9.177 -4.024 99 1HG1 VAL 12 HG11 VAL 12 241.849 10.193 -6.043 100 2HG1 VAL 12 HG12 VAL 12 240.681 8.911 -6.363 101 3HG1 VAL 12 HG13 VAL 12 242.346 8.746 -6.920 102 1HG2 VAL 12 HG21 VAL 12 240.851 7.306 -3.502 103 2HG2 VAL 12 HG22 VAL 12 241.713 6.351 -4.707 104 3HG2 VAL 12 HG23 VAL 12 240.313 7.312 -5.181 105 H LEU 13 HN LEU 13 245.727 8.293 -6.069 106 HA LEU 13 HA LEU 13 246.374 10.871 -4.817 107 1HB LEU 13 HB2 LEU 13 247.902 8.658 -5.095 108 2HB LEU 13 HB1 LEU 13 248.374 9.561 -6.526 109 HG LEU 13 HG LEU 13 248.279 11.290 -4.236 110 1HD1 LEU 13 HD11 LEU 13 249.615 10.326 -2.700 111 2HD1 LEU 13 HD12 LEU 13 250.478 9.357 -3.896 112 3HD1 LEU 13 HD13 LEU 13 248.878 8.859 -3.345 113 1HD2 LEU 13 HD21 LEU 13 249.450 11.936 -6.168 114 2HD2 LEU 13 HD22 LEU 13 250.396 10.448 -6.180 115 3HD2 LEU 13 HD23 LEU 13 250.660 11.652 -4.918 116 H GLN 14 HN GLN 14 246.028 12.645 -5.946 117 HA GLN 14 HA GLN 14 245.574 12.545 -8.812 118 1HB GLN 14 HB2 GLN 14 244.884 14.340 -6.621 119 2HB GLN 14 HB1 GLN 14 245.495 15.215 -8.018 120 1HG GLN 14 HG2 GLN 14 243.737 13.403 -9.120 121 2HG GLN 14 HG1 GLN 14 242.951 13.883 -7.617 122 1HE2 GLN 14 HE21 GLN 14 241.346 14.821 -9.035 123 2HE2 GLN 14 HE22 GLN 14 241.612 16.395 -9.696 124 HA PRO 15 HA PRO 15 249.563 13.849 -10.109 125 1HB PRO 15 HB2 PRO 15 249.016 15.826 -11.935 126 2HB PRO 15 HB1 PRO 15 248.886 14.096 -12.268 127 1HG PRO 15 HG2 PRO 15 246.745 16.052 -11.535 128 2HG PRO 15 HG1 PRO 15 246.709 14.749 -12.736 129 1HD PRO 15 HD2 PRO 15 245.544 14.482 -10.330 130 2HD PRO 15 HD1 PRO 15 246.338 13.114 -11.137 131 H GLN 16 HN GLN 16 248.085 15.494 -7.923 132 HA GLN 16 HA GLN 16 250.222 17.340 -7.513 133 1HB GLN 16 HB2 GLN 16 247.543 18.307 -8.421 134 2HB GLN 16 HB1 GLN 16 248.402 19.248 -7.209 135 1HG GLN 16 HG2 GLN 16 250.379 19.204 -8.810 136 2HG GLN 16 HG1 GLN 16 249.235 18.624 -10.020 137 1HE2 GLN 16 HE21 GLN 16 247.179 19.987 -10.124 138 2HE2 GLN 16 HE22 GLN 16 247.408 21.700 -10.122 139 H ARG 17 HN ARG 17 246.996 16.263 -6.574 140 HA ARG 17 HA ARG 17 247.800 16.552 -3.756 141 1HB ARG 17 HB2 ARG 17 245.319 16.726 -3.282 142 2HB ARG 17 HB1 ARG 17 246.037 18.106 -4.100 143 1HG ARG 17 HG2 ARG 17 245.089 16.244 -6.049 144 2HG ARG 17 HG1 ARG 17 243.807 16.584 -4.885 145 1HD ARG 17 HD2 ARG 17 244.173 18.998 -5.235 146 2HD ARG 17 HD1 ARG 17 245.392 18.618 -6.450 147 HE ARG 17 HE ARG 17 243.176 17.298 -7.309 148 1HH1 ARG 17 HH11 ARG 17 243.848 20.612 -6.448 149 2HH1 ARG 17 HH12 ARG 17 242.676 21.266 -7.543 150 1HH2 ARG 17 HH21 ARG 17 241.635 18.155 -8.751 151 2HH2 ARG 17 HH22 ARG 17 241.420 19.871 -8.851 152 H VAL 18 HN VAL 18 246.780 14.952 -2.286 153 HA VAL 18 HA VAL 18 246.206 12.415 -3.676 154 HB VAL 18 HB VAL 18 248.293 11.952 -2.857 155 1HG1 VAL 18 HG11 VAL 18 247.757 13.301 -0.223 156 2HG1 VAL 18 HG12 VAL 18 248.452 14.144 -1.607 157 3HG1 VAL 18 HG13 VAL 18 249.305 12.780 -0.888 158 1HG2 VAL 18 HG21 VAL 18 246.611 10.337 -2.000 159 2HG2 VAL 18 HG22 VAL 18 246.604 11.220 -0.473 160 3HG2 VAL 18 HG23 VAL 18 248.078 10.422 -1.024 161 H LEU 19 HN LEU 19 244.797 10.956 -2.565 162 HA LEU 19 HA LEU 19 243.080 12.293 -0.578 163 1HB LEU 19 HB2 LEU 19 242.086 11.714 -2.830 164 2HB LEU 19 HB1 LEU 19 242.292 10.028 -2.398 165 HG LEU 19 HG LEU 19 240.740 10.236 -0.568 166 1HD1 LEU 19 HD11 LEU 19 241.124 13.120 -1.062 167 2HD1 LEU 19 HD12 LEU 19 240.848 12.250 0.447 168 3HD1 LEU 19 HD13 LEU 19 239.494 12.608 -0.625 169 1HD2 LEU 19 HD21 LEU 19 238.834 10.256 -1.818 170 2HD2 LEU 19 HD22 LEU 19 240.023 10.160 -3.116 171 3HD2 LEU 19 HD23 LEU 19 239.294 11.712 -2.701 172 H LEU 20 HN LEU 20 243.294 11.536 1.408 173 HA LEU 20 HA LEU 20 243.910 8.676 1.771 174 1HB LEU 20 HB2 LEU 20 245.068 11.101 3.004 175 2HB LEU 20 HB1 LEU 20 244.754 9.766 4.094 176 HG LEU 20 HG LEU 20 246.337 9.387 1.570 177 1HD1 LEU 20 HD11 LEU 20 248.366 9.730 2.825 178 2HD1 LEU 20 HD12 LEU 20 247.443 10.067 4.291 179 3HD1 LEU 20 HD13 LEU 20 247.369 11.182 2.926 180 1HD2 LEU 20 HD21 LEU 20 245.590 7.344 2.533 181 2HD2 LEU 20 HD22 LEU 20 246.051 7.868 4.153 182 3HD2 LEU 20 HD23 LEU 20 247.294 7.522 2.951 183 H GLY 21 HN GLY 21 242.589 7.526 3.069 184 1HA GLY 21 HA2 GLY 21 240.196 8.831 4.050 185 2HA GLY 21 HA1 GLY 21 240.528 7.104 4.067 186 H MET 22 HN MET 22 240.026 9.690 6.010 187 HA MET 22 HA MET 22 241.725 8.596 8.144 188 1HB MET 22 HB2 MET 22 242.316 10.890 7.680 189 2HB MET 22 HB1 MET 22 240.633 11.388 7.776 190 1HG MET 22 HG2 MET 22 240.566 11.081 10.108 191 2HG MET 22 HG1 MET 22 242.083 10.184 10.111 192 1HE MET 22 HE1 MET 22 244.079 11.464 8.603 193 2HE MET 22 HE2 MET 22 244.543 11.458 10.304 194 3HE MET 22 HE3 MET 22 244.708 12.931 9.352 195 H LYS 23 HN LYS 23 240.812 8.081 10.121 196 HA LYS 23 HA LYS 23 237.929 7.737 10.085 197 1HB LYS 23 HB2 LYS 23 240.187 6.471 11.419 198 2HB LYS 23 HB1 LYS 23 238.879 6.820 12.539 199 1HG LYS 23 HG2 LYS 23 237.387 5.706 10.726 200 2HG LYS 23 HG1 LYS 23 238.909 5.014 10.166 201 1HD LYS 23 HD2 LYS 23 238.159 3.400 11.642 202 2HD LYS 23 HD1 LYS 23 239.225 4.365 12.665 203 1HE LYS 23 HE2 LYS 23 237.535 5.078 13.957 204 2HE LYS 23 HE1 LYS 23 236.459 5.318 12.582 205 1HZ LYS 23 HZ1 LYS 23 235.715 3.575 14.148 206 2HZ LYS 23 HZ2 LYS 23 237.085 2.666 13.756 207 3HZ LYS 23 HZ3 LYS 23 235.928 3.004 12.570 208 H LYS 24 HN LYS 24 236.529 8.613 11.641 209 HA LYS 24 HA LYS 24 237.502 11.108 12.762 210 1HB LYS 24 HB2 LYS 24 234.823 9.963 12.150 211 2HB LYS 24 HB1 LYS 24 234.920 11.152 13.442 212 1HG LYS 24 HG2 LYS 24 235.053 12.822 11.995 213 2HG LYS 24 HG1 LYS 24 236.382 12.047 11.131 214 1HD LYS 24 HD2 LYS 24 234.914 10.870 9.716 215 2HD LYS 24 HD1 LYS 24 233.524 11.198 10.753 216 1HE LYS 24 HE2 LYS 24 234.918 13.571 9.703 217 2HE LYS 24 HE1 LYS 24 234.100 12.576 8.498 218 1HZ LYS 24 HZ1 LYS 24 232.188 12.716 10.291 219 2HZ LYS 24 HZ2 LYS 24 232.388 13.905 9.107 220 3HZ LYS 24 HZ3 LYS 24 232.972 14.165 10.672 221 H ARG 25 HN ARG 25 236.416 7.963 13.785 222 HA ARG 25 HA ARG 25 237.601 8.247 16.326 223 1HB ARG 25 HB2 ARG 25 235.483 7.931 17.670 224 2HB ARG 25 HB1 ARG 25 235.732 9.536 16.997 225 1HG ARG 25 HG2 ARG 25 234.081 7.502 15.553 226 2HG ARG 25 HG1 ARG 25 233.397 8.486 16.850 227 1HD ARG 25 HD2 ARG 25 234.550 10.426 15.468 228 2HD ARG 25 HD1 ARG 25 234.336 9.277 14.150 229 HE ARG 25 HE ARG 25 231.899 9.261 15.024 230 1HH1 ARG 25 HH11 ARG 25 234.000 12.055 14.911 231 2HH1 ARG 25 HH12 ARG 25 232.695 13.176 14.738 232 1HH2 ARG 25 HH21 ARG 25 230.193 10.742 14.796 233 2HH2 ARG 25 HH22 ARG 25 230.538 12.434 14.673 234 H GLY 26 HN GLY 26 238.227 6.287 16.958 235 1HA GLY 26 HA2 GLY 26 236.982 3.977 17.319 236 2HA GLY 26 HA1 GLY 26 237.120 3.973 15.567 237 H PHE 27 HN PHE 27 238.738 2.740 14.904 238 HA PHE 27 HA PHE 27 241.087 2.435 16.629 239 1HB PHE 27 HB2 PHE 27 239.808 0.750 14.528 240 2HB PHE 27 HB1 PHE 27 241.543 0.590 14.776 241 HD1 PHE 27 HD1 PHE 27 242.093 -1.227 16.048 242 HD2 PHE 27 HD2 PHE 27 238.570 0.959 17.006 243 HE1 PHE 27 HE1 PHE 27 241.683 -2.730 17.952 244 HE2 PHE 27 HE2 PHE 27 238.153 -0.540 18.913 245 HZ PHE 27 HZ PHE 27 239.712 -2.387 19.387 246 H GLY 28 HN GLY 28 240.516 4.762 14.803 247 1HA GLY 28 HA2 GLY 28 243.163 5.118 13.862 248 2HA GLY 28 HA1 GLY 28 242.111 4.702 12.520 249 H ALA 29 HN ALA 29 240.884 6.548 15.219 250 HA ALA 29 HA ALA 29 239.897 8.621 13.630 251 1HB ALA 29 HB1 ALA 29 239.018 9.430 15.519 252 2HB ALA 29 HB2 ALA 29 240.543 9.334 16.400 253 3HB ALA 29 HB3 ALA 29 239.551 7.890 16.194 254 H GLY 30 HN GLY 30 240.631 10.690 13.161 255 1HA GLY 30 HA2 GLY 30 242.172 12.323 12.688 256 2HA GLY 30 HA1 GLY 30 242.895 11.926 14.238 257 H ARG 31 HN ARG 31 242.692 9.387 11.920 258 HA ARG 31 HA ARG 31 245.509 9.807 11.169 259 1HB ARG 31 HB2 ARG 31 244.181 7.315 12.204 260 2HB ARG 31 HB1 ARG 31 245.617 7.221 11.194 261 1HG ARG 31 HG2 ARG 31 246.443 9.016 13.024 262 2HG ARG 31 HG1 ARG 31 245.322 8.062 13.997 263 1HD ARG 31 HD2 ARG 31 246.659 6.093 12.725 264 2HD ARG 31 HD1 ARG 31 247.921 7.321 12.819 265 HE ARG 31 HE ARG 31 248.033 6.992 15.084 266 1HH1 ARG 31 HH11 ARG 31 245.126 5.499 13.860 267 2HH1 ARG 31 HH12 ARG 31 244.757 4.703 15.353 268 1HH2 ARG 31 HH21 ARG 31 247.550 5.944 17.048 269 2HH2 ARG 31 HH22 ARG 31 246.133 4.956 17.164 270 H TRP 32 HN TRP 32 245.981 9.509 9.055 271 HA TRP 32 HA TRP 32 243.747 8.892 7.277 272 1HB TRP 32 HB2 TRP 32 246.129 9.539 5.809 273 2HB TRP 32 HB1 TRP 32 244.610 10.417 5.893 274 HD1 TRP 32 HD1 TRP 32 247.682 10.097 8.274 275 HE1 TRP 32 HE1 TRP 32 248.260 12.455 9.112 276 HE3 TRP 32 HE3 TRP 32 244.070 12.754 5.815 277 HZ2 TRP 32 HZ2 TRP 32 247.338 15.093 8.765 278 HZ3 TRP 32 HZ3 TRP 32 243.997 15.196 6.120 279 HH2 TRP 32 HH2 TRP 32 245.596 16.339 7.564 280 H ASN 33 HN ASN 33 243.974 7.384 5.513 281 HA ASN 33 HA ASN 33 246.200 5.690 5.204 282 1HB ASN 33 HB2 ASN 33 245.299 3.614 6.199 283 2HB ASN 33 HB1 ASN 33 245.618 4.849 7.413 284 1HD2 ASN 33 HD21 ASN 33 243.829 6.018 8.279 285 2HD2 ASN 33 HD22 ASN 33 242.256 5.307 8.307 286 H GLY 34 HN GLY 34 245.922 4.132 3.575 287 1HA GLY 34 HA2 GLY 34 244.105 4.782 1.555 288 2HA GLY 34 HA1 GLY 34 245.022 3.284 1.643 289 H PHE 35 HN PHE 35 242.636 3.044 0.533 290 HA PHE 35 HA PHE 35 240.820 2.113 2.648 291 1HB PHE 35 HB2 PHE 35 239.958 2.247 -0.206 292 2HB PHE 35 HB1 PHE 35 239.025 2.515 1.255 293 HD1 PHE 35 HD1 PHE 35 240.818 4.041 -1.421 294 HD2 PHE 35 HD2 PHE 35 239.445 4.661 2.559 295 HE1 PHE 35 HE1 PHE 35 241.062 6.470 -1.720 296 HE2 PHE 35 HE2 PHE 35 239.683 7.092 2.266 297 HZ PHE 35 HZ PHE 35 240.492 7.999 0.125 298 H GLY 36 HN GLY 36 241.670 0.120 3.112 299 1HA GLY 36 HA2 GLY 36 241.688 -1.815 0.878 300 2HA GLY 36 HA1 GLY 36 242.807 -1.895 2.230 301 H GLY 37 HN GLY 37 240.436 -3.569 1.034 302 1HA GLY 37 HA2 GLY 37 239.184 -4.112 3.657 303 2HA GLY 37 HA1 GLY 37 238.321 -4.261 2.133 304 H LYS 38 HN LYS 38 238.398 -6.148 1.038 305 HA LYS 38 HA LYS 38 240.488 -8.049 1.346 306 1HB LYS 38 HB2 LYS 38 239.417 -9.753 2.577 307 2HB LYS 38 HB1 LYS 38 239.157 -8.281 3.500 308 1HG LYS 38 HG2 LYS 38 237.170 -9.671 1.718 309 2HG LYS 38 HG1 LYS 38 237.136 -9.570 3.478 310 1HD LYS 38 HD2 LYS 38 236.904 -7.118 3.303 311 2HD LYS 38 HD1 LYS 38 236.857 -7.271 1.545 312 1HE LYS 38 HE2 LYS 38 234.734 -8.029 1.536 313 2HE LYS 38 HE1 LYS 38 234.956 -8.973 3.008 314 1HZ LYS 38 HZ1 LYS 38 234.807 -6.904 4.283 315 2HZ LYS 38 HZ2 LYS 38 233.402 -7.190 3.386 316 3HZ LYS 38 HZ3 LYS 38 234.523 -6.038 2.857 317 H VAL 39 HN VAL 39 240.303 -9.818 -0.088 318 HA VAL 39 HA VAL 39 238.535 -9.280 -2.325 319 HB VAL 39 HB VAL 39 240.466 -11.587 -2.155 320 1HG1 VAL 39 HG11 VAL 39 239.429 -9.927 -4.450 321 2HG1 VAL 39 HG12 VAL 39 238.952 -11.579 -4.055 322 3HG1 VAL 39 HG13 VAL 39 240.598 -11.239 -4.586 323 1HG2 VAL 39 HG21 VAL 39 242.186 -10.199 -2.008 324 2HG2 VAL 39 HG22 VAL 39 241.110 -8.801 -2.015 325 3HG2 VAL 39 HG23 VAL 39 241.691 -9.474 -3.537 326 H GLN 40 HN GLN 40 236.557 -10.089 -2.359 327 HA GLN 40 HA GLN 40 235.403 -11.877 -0.658 328 1HB GLN 40 HB2 GLN 40 234.552 -10.474 -2.836 329 2HB GLN 40 HB1 GLN 40 234.425 -12.125 -3.425 330 1HG GLN 40 HG2 GLN 40 233.221 -12.494 -1.112 331 2HG GLN 40 HG1 GLN 40 232.933 -10.761 -1.251 332 1HE2 GLN 40 HE21 GLN 40 230.919 -12.719 -1.244 333 2HE2 GLN 40 HE22 GLN 40 230.135 -12.694 -2.783 334 H GLU 41 HN GLU 41 234.431 -14.068 -1.310 335 HA GLU 41 HA GLU 41 236.569 -15.896 -1.641 336 1HB GLU 41 HB2 GLU 41 233.622 -16.093 -1.288 337 2HB GLU 41 HB1 GLU 41 234.455 -17.500 -1.934 338 1HG GLU 41 HG2 GLU 41 235.557 -16.210 0.501 339 2HG GLU 41 HG1 GLU 41 234.086 -17.171 0.649 340 H GLY 42 HN GLY 42 237.188 -14.771 -3.780 341 1HA GLY 42 HA2 GLY 42 237.610 -15.971 -5.899 342 2HA GLY 42 HA1 GLY 42 235.878 -16.239 -5.984 343 H GLU 43 HN GLU 43 237.665 -13.254 -5.186 344 HA GLU 43 HA GLU 43 236.593 -12.081 -7.641 345 1HB GLU 43 HB2 GLU 43 235.702 -10.255 -6.603 346 2HB GLU 43 HB1 GLU 43 235.487 -11.421 -5.309 347 1HG GLU 43 HG2 GLU 43 237.339 -10.565 -4.114 348 2HG GLU 43 HG1 GLU 43 237.867 -9.596 -5.489 349 H THR 44 HN THR 44 237.802 -9.901 -8.022 350 HA THR 44 HA THR 44 240.638 -10.575 -7.792 351 HB THR 44 HB THR 44 240.935 -9.051 -9.679 352 HG1 THR 44 HG1 THR 44 239.463 -7.598 -9.965 353 1HG2 THR 44 HG21 THR 44 240.580 -11.041 -10.668 354 2HG2 THR 44 HG22 THR 44 239.068 -10.284 -11.172 355 3HG2 THR 44 HG23 THR 44 239.097 -11.342 -9.763 356 H ILE 45 HN ILE 45 242.152 -9.190 -6.981 357 HA ILE 45 HA ILE 45 241.535 -7.577 -4.860 358 HB ILE 45 HB ILE 45 243.906 -7.433 -6.713 359 1HG1 ILE 45 HG12 ILE 45 244.369 -8.315 -4.001 360 2HG1 ILE 45 HG11 ILE 45 243.147 -9.299 -4.802 361 1HG2 ILE 45 HG21 ILE 45 244.678 -6.371 -4.262 362 2HG2 ILE 45 HG22 ILE 45 243.138 -5.594 -4.627 363 3HG2 ILE 45 HG23 ILE 45 244.470 -5.495 -5.778 364 1HD1 ILE 45 HD11 ILE 45 246.019 -9.183 -5.217 365 2HD1 ILE 45 HD12 ILE 45 245.093 -9.091 -6.715 366 3HD1 ILE 45 HD13 ILE 45 244.863 -10.452 -5.618 367 H GLU 46 HN GLU 46 241.586 -6.735 -8.265 368 HA GLU 46 HA GLU 46 241.382 -3.901 -7.840 369 1HB GLU 46 HB2 GLU 46 242.249 -5.086 -9.944 370 2HB GLU 46 HB1 GLU 46 240.561 -5.380 -10.338 371 1HG GLU 46 HG2 GLU 46 240.127 -2.994 -10.371 372 2HG GLU 46 HG1 GLU 46 241.798 -2.670 -9.908 373 H ASP 47 HN ASP 47 239.191 -6.590 -8.260 374 HA ASP 47 HA ASP 47 236.851 -4.965 -8.541 375 1HB ASP 47 HB2 ASP 47 237.409 -7.881 -8.239 376 2HB ASP 47 HB1 ASP 47 235.788 -7.307 -7.856 377 H GLY 48 HN GLY 48 238.604 -6.502 -5.948 378 1HA GLY 48 HA2 GLY 48 236.562 -5.957 -3.964 379 2HA GLY 48 HA1 GLY 48 238.151 -6.645 -3.669 380 H ALA 49 HN ALA 49 239.538 -4.472 -5.073 381 HA ALA 49 HA ALA 49 239.786 -2.678 -2.858 382 1HB ALA 49 HB1 ALA 49 241.018 -2.088 -5.509 383 2HB ALA 49 HB2 ALA 49 241.586 -3.479 -4.590 384 3HB ALA 49 HB3 ALA 49 241.673 -1.867 -3.887 385 H ARG 50 HN ARG 50 238.283 -2.603 -6.030 386 HA ARG 50 HA ARG 50 237.699 0.197 -5.882 387 1HB ARG 50 HB2 ARG 50 236.548 -0.076 -7.967 388 2HB ARG 50 HB1 ARG 50 238.036 -1.010 -8.036 389 1HG ARG 50 HG2 ARG 50 236.723 -3.042 -7.498 390 2HG ARG 50 HG1 ARG 50 235.254 -2.068 -7.592 391 1HD ARG 50 HD2 ARG 50 235.986 -1.435 -9.930 392 2HD ARG 50 HD1 ARG 50 237.209 -2.696 -9.791 393 HE ARG 50 HE ARG 50 235.578 -4.256 -10.137 394 1HH1 ARG 50 HH11 ARG 50 234.063 -1.250 -9.213 395 2HH1 ARG 50 HH12 ARG 50 232.456 -1.825 -9.507 396 1HH2 ARG 50 HH21 ARG 50 233.465 -5.013 -10.524 397 2HH2 ARG 50 HH22 ARG 50 232.116 -3.961 -10.250 398 H ARG 51 HN ARG 51 235.760 -2.781 -5.616 399 HA ARG 51 HA ARG 51 233.307 -1.516 -5.088 400 1HB ARG 51 HB2 ARG 51 234.406 -4.257 -4.633 401 2HB ARG 51 HB1 ARG 51 232.892 -3.818 -3.853 402 1HG ARG 51 HG2 ARG 51 233.097 -3.208 -6.732 403 2HG ARG 51 HG1 ARG 51 233.040 -4.916 -6.289 404 1HD ARG 51 HD2 ARG 51 231.033 -2.777 -5.597 405 2HD ARG 51 HD1 ARG 51 230.799 -4.152 -6.675 406 HE ARG 51 HE ARG 51 230.551 -4.141 -3.837 407 1HH1 ARG 51 HH11 ARG 51 231.461 -6.135 -6.554 408 2HH1 ARG 51 HH12 ARG 51 231.086 -7.621 -5.748 409 1HH2 ARG 51 HH21 ARG 51 230.055 -6.095 -2.776 410 2HH2 ARG 51 HH22 ARG 51 230.287 -7.600 -3.605 411 H GLU 52 HN GLU 52 235.973 -2.423 -3.012 412 HA GLU 52 HA GLU 52 234.539 -1.739 -0.590 413 1HB GLU 52 HB2 GLU 52 237.432 -2.485 -1.064 414 2HB GLU 52 HB1 GLU 52 236.726 -2.198 0.520 415 1HG GLU 52 HG2 GLU 52 235.687 -4.290 -1.366 416 2HG GLU 52 HG1 GLU 52 236.961 -4.605 -0.190 417 H LEU 53 HN LEU 53 236.506 -0.215 -2.935 418 HA LEU 53 HA LEU 53 237.565 1.889 -1.363 419 1HB LEU 53 HB2 LEU 53 238.656 1.490 -3.394 420 2HB LEU 53 HB1 LEU 53 237.155 1.427 -4.298 421 HG LEU 53 HG LEU 53 236.899 3.874 -3.930 422 1HD1 LEU 53 HD11 LEU 53 238.702 3.538 -1.948 423 2HD1 LEU 53 HD12 LEU 53 238.331 5.088 -2.701 424 3HD1 LEU 53 HD13 LEU 53 239.733 4.162 -3.234 425 1HD2 LEU 53 HD21 LEU 53 239.127 4.353 -5.336 426 2HD2 LEU 53 HD22 LEU 53 237.701 3.579 -6.026 427 3HD2 LEU 53 HD23 LEU 53 239.061 2.597 -5.487 428 H GLN 54 HN GLN 54 234.780 1.647 -3.539 429 HA GLN 54 HA GLN 54 233.835 4.262 -3.278 430 1HB GLN 54 HB2 GLN 54 232.800 3.111 -4.980 431 2HB GLN 54 HB1 GLN 54 232.616 1.646 -4.028 432 1HG GLN 54 HG2 GLN 54 230.795 2.655 -2.781 433 2HG GLN 54 HG1 GLN 54 231.004 4.164 -3.667 434 1HE2 GLN 54 HE21 GLN 54 229.645 4.456 -5.271 435 2HE2 GLN 54 HE22 GLN 54 228.863 3.218 -6.188 436 H GLU 55 HN GLU 55 233.659 1.561 -1.131 437 HA GLU 55 HA GLU 55 231.509 2.625 0.463 438 1HB GLU 55 HB2 GLU 55 233.368 0.300 0.962 439 2HB GLU 55 HB1 GLU 55 231.956 0.694 1.933 440 1HG GLU 55 HG2 GLU 55 231.912 -0.027 -0.988 441 2HG GLU 55 HG1 GLU 55 231.529 -1.118 0.343 442 H GLU 56 HN GLU 56 234.967 2.895 0.484 443 HA GLU 56 HA GLU 56 235.150 3.515 3.268 444 1HB GLU 56 HB2 GLU 56 236.965 2.955 1.172 445 2HB GLU 56 HB1 GLU 56 237.414 4.513 1.849 446 1HG GLU 56 HG2 GLU 56 237.174 1.887 3.289 447 2HG GLU 56 HG1 GLU 56 238.630 2.842 3.017 448 H SER 57 HN SER 57 235.183 5.513 0.312 449 HA SER 57 HA SER 57 234.603 7.819 2.043 450 1HB SER 57 HB2 SER 57 236.792 7.530 0.034 451 2HB SER 57 HB1 SER 57 236.028 9.107 0.221 452 HG SER 57 HG SER 57 236.453 8.719 2.572 453 H GLY 58 HN GLY 58 232.962 6.076 0.234 454 1HA GLY 58 HA2 GLY 58 231.250 6.330 -1.269 455 2HA GLY 58 HA1 GLY 58 231.255 8.022 -0.796 456 H LEU 59 HN LEU 59 234.237 6.970 -2.053 457 HA LEU 59 HA LEU 59 233.649 8.331 -4.585 458 1HB LEU 59 HB2 LEU 59 236.237 7.837 -3.129 459 2HB LEU 59 HB1 LEU 59 236.154 8.488 -4.753 460 HG LEU 59 HG LEU 59 235.355 9.774 -2.167 461 1HD1 LEU 59 HD11 LEU 59 237.598 9.925 -3.677 462 2HD1 LEU 59 HD12 LEU 59 237.022 11.212 -2.618 463 3HD1 LEU 59 HD13 LEU 59 236.656 11.258 -4.342 464 1HD2 LEU 59 HD21 LEU 59 234.355 10.475 -4.923 465 2HD2 LEU 59 HD22 LEU 59 234.360 11.611 -3.573 466 3HD2 LEU 59 HD23 LEU 59 233.403 10.133 -3.477 467 H THR 60 HN THR 60 233.187 7.012 -6.164 468 HA THR 60 HA THR 60 234.351 4.337 -6.251 469 HB THR 60 HB THR 60 232.528 5.122 -8.417 470 HG1 THR 60 HG1 THR 60 230.730 5.330 -7.144 471 1HG2 THR 60 HG21 THR 60 232.258 2.928 -8.392 472 2HG2 THR 60 HG22 THR 60 231.438 3.078 -6.839 473 3HG2 THR 60 HG23 THR 60 233.178 2.793 -6.893 474 H VAL 61 HN VAL 61 235.474 3.569 -8.121 475 HA VAL 61 HA VAL 61 236.589 5.754 -9.757 476 HB VAL 61 HB VAL 61 238.652 4.496 -9.964 477 1HG1 VAL 61 HG11 VAL 61 238.796 5.988 -8.208 478 2HG1 VAL 61 HG12 VAL 61 239.245 4.466 -7.439 479 3HG1 VAL 61 HG13 VAL 61 237.618 5.115 -7.230 480 1HG2 VAL 61 HG21 VAL 61 237.037 2.342 -8.919 481 2HG2 VAL 61 HG22 VAL 61 238.516 2.537 -7.979 482 3HG2 VAL 61 HG23 VAL 61 238.605 2.282 -9.722 483 H ASP 62 HN ASP 62 236.729 5.528 -11.921 484 HA ASP 62 HA ASP 62 235.114 3.473 -13.132 485 1HB ASP 62 HB2 ASP 62 235.531 6.043 -13.800 486 2HB ASP 62 HB1 ASP 62 236.754 5.289 -14.820 487 H ALA 63 HN ALA 63 238.416 3.924 -12.370 488 HA ALA 63 HA ALA 63 239.193 1.371 -13.147 489 1HB ALA 63 HB1 ALA 63 239.011 1.918 -15.421 490 2HB ALA 63 HB2 ALA 63 240.735 2.042 -15.065 491 3HB ALA 63 HB3 ALA 63 239.751 3.501 -15.189 492 H LEU 64 HN LEU 64 240.279 1.380 -11.205 493 HA LEU 64 HA LEU 64 242.033 3.374 -10.272 494 1HB LEU 64 HB2 LEU 64 241.771 0.428 -9.731 495 2HB LEU 64 HB1 LEU 64 243.060 1.362 -9.001 496 HG LEU 64 HG LEU 64 240.516 2.666 -8.592 497 1HD1 LEU 64 HD11 LEU 64 239.559 0.461 -8.757 498 2HD1 LEU 64 HD12 LEU 64 239.573 0.974 -7.069 499 3HD1 LEU 64 HD13 LEU 64 240.771 -0.182 -7.650 500 1HD2 LEU 64 HD21 LEU 64 242.927 2.499 -7.337 501 2HD2 LEU 64 HD22 LEU 64 241.922 1.474 -6.313 502 3HD2 LEU 64 HD23 LEU 64 241.455 3.148 -6.614 503 H HIS 65 HN HIS 65 244.459 2.516 -9.782 504 HA HIS 65 HA HIS 65 245.612 1.503 -12.281 505 1HB HIS 65 HB2 HIS 65 245.675 4.107 -11.955 506 2HB HIS 65 HB1 HIS 65 246.985 3.742 -10.837 507 HD1 HIS 65 HD1 HIS 65 247.481 1.232 -13.164 508 HD2 HIS 65 HD2 HIS 65 247.984 5.353 -13.340 509 HE1 HIS 65 HE1 HIS 65 249.096 1.633 -15.050 510 HE2 HIS 65 HE2 HIS 65 249.452 4.126 -15.081 511 H LYS 66 HN LYS 66 246.329 -0.427 -11.529 512 HA LYS 66 HA LYS 66 247.335 -0.926 -8.957 513 1HB LYS 66 HB2 LYS 66 248.434 -2.941 -10.107 514 2HB LYS 66 HB1 LYS 66 246.682 -2.825 -10.182 515 1HG LYS 66 HG2 LYS 66 246.711 -2.169 -12.435 516 2HG LYS 66 HG1 LYS 66 248.438 -1.804 -12.389 517 1HD LYS 66 HD2 LYS 66 247.259 -4.561 -12.049 518 2HD LYS 66 HD1 LYS 66 247.899 -3.925 -13.567 519 1HE LYS 66 HE2 LYS 66 250.071 -3.531 -12.351 520 2HE LYS 66 HE1 LYS 66 249.394 -4.447 -11.005 521 1HZ LYS 66 HZ1 LYS 66 248.948 -6.158 -12.950 522 2HZ LYS 66 HZ2 LYS 66 250.415 -6.122 -12.108 523 3HZ LYS 66 HZ3 LYS 66 250.290 -5.377 -13.621 524 H VAL 67 HN VAL 67 249.289 -0.601 -8.031 525 HA VAL 67 HA VAL 67 251.445 0.331 -9.824 526 HB VAL 67 HB VAL 67 252.289 1.699 -7.928 527 1HG1 VAL 67 HG11 VAL 67 250.181 3.300 -8.027 528 2HG1 VAL 67 HG12 VAL 67 249.700 2.178 -9.300 529 3HG1 VAL 67 HG13 VAL 67 251.228 3.051 -9.424 530 1HG2 VAL 67 HG21 VAL 67 250.500 2.245 -6.179 531 2HG2 VAL 67 HG22 VAL 67 251.388 0.733 -6.002 532 3HG2 VAL 67 HG23 VAL 67 249.752 0.724 -6.660 533 H GLY 68 HN GLY 68 250.854 -1.189 -6.645 534 1HA GLY 68 HA2 GLY 68 253.145 -2.928 -7.179 535 2HA GLY 68 HA1 GLY 68 253.216 -1.930 -5.738 536 H GLN 69 HN GLN 69 253.467 -4.493 -5.300 537 HA GLN 69 HA GLN 69 250.875 -5.270 -4.149 538 1HB GLN 69 HB2 GLN 69 251.432 -6.622 -6.197 539 2HB GLN 69 HB1 GLN 69 252.849 -7.218 -5.346 540 1HG GLN 69 HG2 GLN 69 250.986 -7.807 -3.528 541 2HG GLN 69 HG1 GLN 69 249.998 -7.885 -4.987 542 1HE2 GLN 69 HE21 GLN 69 252.047 -9.571 -2.981 543 2HE2 GLN 69 HE22 GLN 69 252.412 -10.900 -4.021 544 H ILE 70 HN ILE 70 251.060 -5.285 -2.016 545 HA ILE 70 HA ILE 70 253.692 -5.813 -0.828 546 HB ILE 70 HB ILE 70 251.255 -4.586 0.461 547 1HG1 ILE 70 HG12 ILE 70 253.745 -3.052 -0.127 548 2HG1 ILE 70 HG11 ILE 70 252.627 -3.362 -1.452 549 1HG2 ILE 70 HG21 ILE 70 252.774 -3.966 2.264 550 2HG2 ILE 70 HG22 ILE 70 254.099 -4.785 1.437 551 3HG2 ILE 70 HG23 ILE 70 252.730 -5.715 2.047 552 1HD1 ILE 70 HD11 ILE 70 250.851 -2.424 0.204 553 2HD1 ILE 70 HD12 ILE 70 251.902 -1.327 -0.692 554 3HD1 ILE 70 HD13 ILE 70 252.256 -1.707 0.993 555 H VAL 71 HN VAL 71 253.926 -7.235 0.896 556 HA VAL 71 HA VAL 71 251.717 -9.128 1.335 557 HB VAL 71 HB VAL 71 254.620 -9.920 1.122 558 1HG1 VAL 71 HG11 VAL 71 252.135 -11.614 1.067 559 2HG1 VAL 71 HG12 VAL 71 253.117 -11.334 2.506 560 3HG1 VAL 71 HG13 VAL 71 253.808 -12.168 1.114 561 1HG2 VAL 71 HG21 VAL 71 254.180 -10.771 -1.071 562 2HG2 VAL 71 HG22 VAL 71 253.699 -9.075 -1.037 563 3HG2 VAL 71 HG23 VAL 71 252.474 -10.340 -0.949 564 H PHE 72 HN PHE 72 251.639 -10.097 3.403 565 HA PHE 72 HA PHE 72 253.439 -8.911 5.405 566 1HB PHE 72 HB2 PHE 72 250.446 -9.267 5.598 567 2HB PHE 72 HB1 PHE 72 251.477 -8.853 6.964 568 HD1 PHE 72 HD1 PHE 72 251.544 -6.644 7.541 569 HD2 PHE 72 HD2 PHE 72 250.914 -7.679 3.462 570 HE1 PHE 72 HE1 PHE 72 251.347 -4.259 6.970 571 HE2 PHE 72 HE2 PHE 72 250.719 -5.297 2.882 572 HZ PHE 72 HZ PHE 72 250.935 -3.582 4.637 573 H GLU 73 HN GLU 73 254.528 -10.401 6.474 574 HA GLU 73 HA GLU 73 253.444 -13.128 6.612 575 1HB GLU 73 HB2 GLU 73 255.646 -12.966 5.589 576 2HB GLU 73 HB1 GLU 73 256.264 -12.102 6.989 577 1HG GLU 73 HG2 GLU 73 256.562 -13.977 8.177 578 2HG GLU 73 HG1 GLU 73 255.074 -14.713 7.586 579 H PHE 74 HN PHE 74 252.354 -13.514 8.428 580 HA PHE 74 HA PHE 74 252.967 -12.062 10.861 581 1HB PHE 74 HB2 PHE 74 250.881 -14.144 10.195 582 2HB PHE 74 HB1 PHE 74 251.068 -13.450 11.802 583 HD1 PHE 74 HD1 PHE 74 251.544 -10.643 11.273 584 HD2 PHE 74 HD2 PHE 74 248.895 -13.354 9.339 585 HE1 PHE 74 HE1 PHE 74 250.096 -8.761 10.629 586 HE2 PHE 74 HE2 PHE 74 247.441 -11.478 8.691 587 HZ PHE 74 HZ PHE 74 248.041 -9.178 9.335 588 H VAL 75 HN VAL 75 254.157 -12.623 12.406 589 HA VAL 75 HA VAL 75 255.471 -15.191 12.318 590 HB VAL 75 HB VAL 75 255.989 -13.004 14.295 591 1HG1 VAL 75 HG11 VAL 75 258.325 -14.042 13.906 592 2HG1 VAL 75 HG12 VAL 75 257.404 -15.404 13.268 593 3HG1 VAL 75 HG13 VAL 75 257.152 -14.868 14.930 594 1HG2 VAL 75 HG21 VAL 75 256.312 -12.922 11.436 595 2HG2 VAL 75 HG22 VAL 75 257.878 -12.832 12.242 596 3HG2 VAL 75 HG23 VAL 75 256.616 -11.665 12.635 597 H GLY 76 HN GLY 76 252.711 -14.235 13.529 598 1HA GLY 76 HA2 GLY 76 252.930 -15.985 15.893 599 2HA GLY 76 HA1 GLY 76 251.892 -14.562 15.857 600 H GLU 77 HN GLU 77 251.820 -15.775 12.827 601 HA GLU 77 HA GLU 77 249.686 -17.721 13.362 602 1HB GLU 77 HB2 GLU 77 249.459 -15.176 11.799 603 2HB GLU 77 HB1 GLU 77 248.499 -16.571 11.329 604 1HG GLU 77 HG2 GLU 77 247.753 -16.624 13.787 605 2HG GLU 77 HG1 GLU 77 248.389 -14.982 13.859 606 HA PRO 78 HA PRO 78 251.651 -19.963 10.106 607 1HB PRO 78 HB2 PRO 78 249.632 -21.533 9.249 608 2HB PRO 78 HB1 PRO 78 250.397 -21.760 10.826 609 1HG PRO 78 HG2 PRO 78 247.824 -20.387 10.149 610 2HG PRO 78 HG1 PRO 78 248.180 -21.500 11.482 611 1HD PRO 78 HD2 PRO 78 248.098 -18.793 11.780 612 2HD PRO 78 HD1 PRO 78 249.124 -19.849 12.772 613 H GLU 79 HN GLU 79 248.681 -18.231 9.412 614 HA GLU 79 HA GLU 79 249.016 -18.418 6.551 615 1HB GLU 79 HB2 GLU 79 246.911 -17.716 8.357 616 2HB GLU 79 HB1 GLU 79 247.141 -16.395 7.220 617 1HG GLU 79 HG2 GLU 79 246.790 -17.844 5.359 618 2HG GLU 79 HG1 GLU 79 246.784 -19.264 6.403 619 H LEU 80 HN LEU 80 248.351 -15.961 5.625 620 HA LEU 80 HA LEU 80 250.236 -14.011 6.693 621 1HB LEU 80 HB2 LEU 80 250.392 -14.409 3.760 622 2HB LEU 80 HB1 LEU 80 251.628 -13.890 4.887 623 HG LEU 80 HG LEU 80 250.713 -16.734 4.920 624 1HD1 LEU 80 HD11 LEU 80 252.614 -15.497 2.944 625 2HD1 LEU 80 HD12 LEU 80 251.151 -16.419 2.604 626 3HD1 LEU 80 HD13 LEU 80 252.557 -17.223 3.301 627 1HD2 LEU 80 HD21 LEU 80 252.647 -17.134 6.057 628 2HD2 LEU 80 HD22 LEU 80 252.383 -15.456 6.532 629 3HD2 LEU 80 HD23 LEU 80 253.524 -15.838 5.243 630 H MET 81 HN MET 81 250.162 -12.195 4.596 631 HA MET 81 HA MET 81 247.363 -11.794 3.916 632 1HB MET 81 HB2 MET 81 248.338 -10.612 6.197 633 2HB MET 81 HB1 MET 81 248.573 -9.350 4.997 634 1HG MET 81 HG2 MET 81 246.121 -9.806 4.360 635 2HG MET 81 HG1 MET 81 246.031 -10.621 5.920 636 1HE MET 81 HE1 MET 81 248.325 -7.286 5.384 637 2HE MET 81 HE2 MET 81 246.962 -6.174 5.249 638 3HE MET 81 HE3 MET 81 247.149 -7.486 4.085 639 H ASP 82 HN ASP 82 247.469 -11.499 1.777 640 HA ASP 82 HA ASP 82 249.715 -9.946 0.685 641 1HB ASP 82 HB2 ASP 82 249.416 -12.221 -0.230 642 2HB ASP 82 HB1 ASP 82 247.784 -11.795 -0.740 643 H VAL 83 HN VAL 83 249.119 -7.837 0.707 644 HA VAL 83 HA VAL 83 246.461 -7.159 -0.367 645 HB VAL 83 HB VAL 83 246.861 -6.392 1.940 646 1HG1 VAL 83 HG11 VAL 83 249.414 -5.916 1.164 647 2HG1 VAL 83 HG12 VAL 83 248.671 -5.245 2.617 648 3HG1 VAL 83 HG13 VAL 83 248.743 -4.285 1.140 649 1HG2 VAL 83 HG21 VAL 83 246.256 -4.019 1.573 650 2HG2 VAL 83 HG22 VAL 83 245.334 -5.132 0.562 651 3HG2 VAL 83 HG23 VAL 83 246.666 -4.208 -0.132 652 H HIS 84 HN HIS 84 246.455 -6.467 -2.377 653 HA HIS 84 HA HIS 84 248.849 -5.520 -3.663 654 1HB HIS 84 HB2 HIS 84 246.605 -6.784 -4.573 655 2HB HIS 84 HB1 HIS 84 246.269 -5.120 -5.041 656 HD1 HIS 84 HD1 HIS 84 248.069 -8.085 -6.104 657 HD2 HIS 84 HD2 HIS 84 248.404 -3.989 -6.719 658 HE1 HIS 84 HE1 HIS 84 249.535 -7.828 -8.130 659 HE2 HIS 84 HE2 HIS 84 249.795 -5.339 -8.431 660 H VAL 85 HN VAL 85 248.853 -3.415 -4.862 661 HA VAL 85 HA VAL 85 247.448 -1.369 -3.265 662 HB VAL 85 HB VAL 85 250.104 -1.050 -4.688 663 1HG1 VAL 85 HG11 VAL 85 248.434 0.926 -4.162 664 2HG1 VAL 85 HG12 VAL 85 250.172 1.104 -3.928 665 3HG1 VAL 85 HG13 VAL 85 249.125 0.767 -2.548 666 1HG2 VAL 85 HG21 VAL 85 251.167 -1.190 -2.547 667 2HG2 VAL 85 HG22 VAL 85 250.167 -2.628 -2.753 668 3HG2 VAL 85 HG23 VAL 85 249.611 -1.308 -1.724 669 H PHE 86 HN PHE 86 246.303 0.139 -4.317 670 HA PHE 86 HA PHE 86 246.501 0.301 -7.242 671 1HB PHE 86 HB2 PHE 86 244.227 -0.604 -5.620 672 2HB PHE 86 HB1 PHE 86 243.808 0.682 -6.747 673 HD1 PHE 86 HD1 PHE 86 244.089 -2.771 -6.348 674 HD2 PHE 86 HD2 PHE 86 244.750 0.320 -9.197 675 HE1 PHE 86 HE1 PHE 86 243.941 -4.422 -8.166 676 HE2 PHE 86 HE2 PHE 86 244.604 -1.325 -11.021 677 HZ PHE 86 HZ PHE 86 244.199 -3.699 -10.506 678 H CYS 87 HN CYS 87 246.399 2.326 -8.035 679 HA CYS 87 HA CYS 87 245.576 4.485 -6.196 680 1HB CYS 87 HB2 CYS 87 247.995 4.566 -6.480 681 2HB CYS 87 HB1 CYS 87 247.827 4.489 -8.230 682 HG CYS 87 HG CYS 87 247.980 6.988 -6.750 683 H THR 88 HN THR 88 243.761 5.419 -6.963 684 HA THR 88 HA THR 88 243.186 5.182 -9.822 685 HB THR 88 HB THR 88 241.519 4.383 -8.139 686 HG1 THR 88 HG1 THR 88 240.635 4.790 -10.069 687 1HG2 THR 88 HG21 THR 88 240.413 7.020 -7.685 688 2HG2 THR 88 HG22 THR 88 241.944 6.746 -6.852 689 3HG2 THR 88 HG23 THR 88 240.587 5.649 -6.589 690 H ASP 89 HN ASP 89 241.482 7.168 -10.314 691 HA ASP 89 HA ASP 89 242.427 9.731 -9.442 692 1HB ASP 89 HB2 ASP 89 243.096 10.475 -11.748 693 2HB ASP 89 HB1 ASP 89 244.201 9.312 -11.020 694 H SER 90 HN SER 90 240.683 7.907 -11.906 695 HA SER 90 HA SER 90 238.732 10.020 -12.253 696 1HB SER 90 HB2 SER 90 239.665 8.012 -13.902 697 2HB SER 90 HB1 SER 90 238.093 7.390 -13.399 698 HG SER 90 HG SER 90 238.550 9.973 -14.489 699 H ILE 91 HN ILE 91 237.519 10.250 -10.426 700 HA ILE 91 HA ILE 91 236.339 7.832 -9.263 701 HB ILE 91 HB ILE 91 235.743 9.200 -7.318 702 1HG1 ILE 91 HG12 ILE 91 237.231 11.445 -8.702 703 2HG1 ILE 91 HG11 ILE 91 235.478 11.347 -8.576 704 1HG2 ILE 91 HG21 ILE 91 237.789 9.003 -6.384 705 2HG2 ILE 91 HG22 ILE 91 238.588 9.908 -7.669 706 3HG2 ILE 91 HG23 ILE 91 238.167 8.213 -7.914 707 1HD1 ILE 91 HD11 ILE 91 236.466 12.848 -6.909 708 2HD1 ILE 91 HD12 ILE 91 237.375 11.492 -6.244 709 3HD1 ILE 91 HD13 ILE 91 235.613 11.495 -6.168 710 H GLN 92 HN GLN 92 234.062 8.446 -8.200 711 HA GLN 92 HA GLN 92 232.454 9.833 -10.232 712 1HB GLN 92 HB2 GLN 92 231.791 7.162 -8.988 713 2HB GLN 92 HB1 GLN 92 230.758 8.062 -10.091 714 1HG GLN 92 HG2 GLN 92 233.449 7.564 -11.117 715 2HG GLN 92 HG1 GLN 92 232.507 6.106 -10.810 716 1HE2 GLN 92 HE21 GLN 92 231.791 9.353 -12.061 717 2HE2 GLN 92 HE22 GLN 92 230.981 8.809 -13.488 718 H GLY 93 HN GLY 93 231.919 8.105 -7.163 719 1HA GLY 93 HA2 GLY 93 229.815 9.706 -6.279 720 2HA GLY 93 HA1 GLY 93 230.845 8.737 -5.240 721 H THR 94 HN THR 94 230.468 10.514 -3.710 722 HA THR 94 HA THR 94 232.354 12.712 -4.167 723 HB THR 94 HB THR 94 230.099 13.202 -2.338 724 HG1 THR 94 HG1 THR 94 228.593 12.913 -3.743 725 1HG2 THR 94 HG21 THR 94 231.853 14.752 -4.062 726 2HG2 THR 94 HG22 THR 94 230.974 15.228 -2.608 727 3HG2 THR 94 HG23 THR 94 230.160 15.232 -4.172 728 HA PRO 95 HA PRO 95 234.316 11.703 -0.395 729 1HB PRO 95 HB2 PRO 95 234.463 14.551 0.336 730 2HB PRO 95 HB1 PRO 95 235.772 13.426 -0.038 731 1HG PRO 95 HG2 PRO 95 235.099 15.403 -1.711 732 2HG PRO 95 HG1 PRO 95 235.646 13.822 -2.300 733 1HD PRO 95 HD2 PRO 95 232.859 14.902 -2.085 734 2HD PRO 95 HD1 PRO 95 233.614 14.000 -3.418 735 H VAL 96 HN VAL 96 231.937 11.107 -0.037 736 HA VAL 96 HA VAL 96 230.423 12.751 1.757 737 HB VAL 96 HB VAL 96 229.958 9.801 1.477 738 1HG1 VAL 96 HG11 VAL 96 227.549 10.881 1.344 739 2HG1 VAL 96 HG12 VAL 96 228.370 12.214 2.156 740 3HG1 VAL 96 HG13 VAL 96 228.363 10.609 2.885 741 1HG2 VAL 96 HG21 VAL 96 230.042 10.079 -0.763 742 2HG2 VAL 96 HG22 VAL 96 229.813 11.826 -0.666 743 3HG2 VAL 96 HG23 VAL 96 228.427 10.745 -0.518 744 H GLU 97 HN GLU 97 232.580 12.854 3.061 745 HA GLU 97 HA GLU 97 233.502 10.871 4.722 746 1HB GLU 97 HB2 GLU 97 234.285 12.607 6.198 747 2HB GLU 97 HB1 GLU 97 234.431 13.177 4.542 748 1HG GLU 97 HG2 GLU 97 231.966 14.095 5.194 749 2HG GLU 97 HG1 GLU 97 232.793 14.186 6.748 750 H SER 98 HN SER 98 232.396 9.529 5.987 751 HA SER 98 HA SER 98 229.867 10.346 7.151 752 1HB SER 98 HB2 SER 98 230.068 8.113 6.130 753 2HB SER 98 HB1 SER 98 231.322 7.693 7.297 754 HG SER 98 HG SER 98 228.579 8.195 7.767 755 H ASP 99 HN ASP 99 229.625 9.178 9.494 756 HA ASP 99 HA ASP 99 231.137 10.827 11.241 757 1HB ASP 99 HB2 ASP 99 229.234 8.543 11.771 758 2HB ASP 99 HB1 ASP 99 229.957 9.521 13.045 759 H GLU 100 HN GLU 100 231.851 7.855 9.805 760 HA GLU 100 HA GLU 100 233.752 7.177 11.945 761 1HB GLU 100 HB2 GLU 100 231.920 5.577 10.519 762 2HB GLU 100 HB1 GLU 100 233.517 5.121 9.941 763 1HG GLU 100 HG2 GLU 100 234.158 4.937 12.406 764 2HG GLU 100 HG1 GLU 100 232.426 4.985 12.727 765 H MET 101 HN MET 101 233.417 7.668 8.464 766 HA MET 101 HA MET 101 236.350 7.614 8.228 767 1HB MET 101 HB2 MET 101 234.374 6.376 6.681 768 2HB MET 101 HB1 MET 101 234.952 7.711 5.694 769 1HG MET 101 HG2 MET 101 236.159 5.622 5.271 770 2HG MET 101 HG1 MET 101 237.213 6.910 5.846 771 1HE MET 101 HE1 MET 101 239.344 4.808 7.626 772 2HE MET 101 HE2 MET 101 238.839 6.276 8.463 773 3HE MET 101 HE3 MET 101 238.971 6.264 6.705 774 H ARG 102 HN ARG 102 237.317 9.162 6.697 775 HA ARG 102 HA ARG 102 235.910 11.500 5.902 776 1HB ARG 102 HB2 ARG 102 236.102 11.804 8.411 777 2HB ARG 102 HB1 ARG 102 237.845 11.885 8.192 778 1HG ARG 102 HG2 ARG 102 237.069 13.738 6.405 779 2HG ARG 102 HG1 ARG 102 235.761 13.874 7.583 780 1HD ARG 102 HD2 ARG 102 237.292 14.340 9.345 781 2HD ARG 102 HD1 ARG 102 238.677 13.929 8.332 782 HE ARG 102 HE ARG 102 237.100 16.103 7.308 783 1HH1 ARG 102 HH11 ARG 102 239.709 15.224 9.452 784 2HH1 ARG 102 HH12 ARG 102 240.443 16.791 9.405 785 1HH2 ARG 102 HH21 ARG 102 238.063 18.166 7.244 786 2HH2 ARG 102 HH22 ARG 102 239.509 18.462 8.152 787 HA PRO 103 HA PRO 103 239.744 10.836 3.522 788 1HB PRO 103 HB2 PRO 103 238.878 12.014 1.250 789 2HB PRO 103 HB1 PRO 103 238.428 10.361 1.688 790 1HG PRO 103 HG2 PRO 103 236.878 12.902 2.042 791 2HG PRO 103 HG1 PRO 103 236.323 11.332 1.429 792 1HD PRO 103 HD2 PRO 103 235.877 12.120 3.978 793 2HD PRO 103 HD1 PRO 103 236.153 10.420 3.552 794 H CYS 104 HN CYS 104 241.358 12.258 2.743 795 HA CYS 104 HA CYS 104 240.891 15.118 3.167 796 1HB CYS 104 HB2 CYS 104 243.339 13.711 4.232 797 2HB CYS 104 HB1 CYS 104 242.872 15.388 4.485 798 HG CYS 104 HG CYS 104 240.770 13.625 5.661 799 H TRP 105 HN TRP 105 241.459 16.173 1.404 800 HA TRP 105 HA TRP 105 243.177 14.936 -0.562 801 1HB TRP 105 HB2 TRP 105 241.739 17.598 -0.562 802 2HB TRP 105 HB1 TRP 105 242.618 16.928 -1.934 803 HD1 TRP 105 HD1 TRP 105 240.026 15.185 0.385 804 HE1 TRP 105 HE1 TRP 105 238.170 14.193 -1.104 805 HE3 TRP 105 HE3 TRP 105 241.650 16.874 -4.160 806 HZ2 TRP 105 HZ2 TRP 105 237.490 14.144 -3.842 807 HZ3 TRP 105 HZ3 TRP 105 240.339 16.311 -6.164 808 HH2 TRP 105 HH2 TRP 105 238.302 14.973 -6.007 809 H PHE 106 HN PHE 106 245.264 14.935 0.100 810 HA PHE 106 HA PHE 106 246.436 17.451 1.056 811 1HB PHE 106 HB2 PHE 106 246.688 14.800 1.930 812 2HB PHE 106 HB1 PHE 106 248.219 15.169 1.147 813 HD1 PHE 106 HD1 PHE 106 247.297 14.732 4.176 814 HD2 PHE 106 HD2 PHE 106 248.398 18.083 1.797 815 HE1 PHE 106 HE1 PHE 106 248.033 15.922 6.201 816 HE2 PHE 106 HE2 PHE 106 249.138 19.280 3.816 817 HZ PHE 106 HZ PHE 106 248.956 18.199 6.022 818 H GLN 107 HN GLN 107 249.130 16.799 0.464 819 HA GLN 107 HA GLN 107 249.120 17.221 -2.444 820 1HB GLN 107 HB2 GLN 107 251.382 17.865 -0.559 821 2HB GLN 107 HB1 GLN 107 251.141 18.450 -2.199 822 1HG GLN 107 HG2 GLN 107 249.061 19.600 -1.345 823 2HG GLN 107 HG1 GLN 107 249.627 19.210 0.278 824 1HE2 GLN 107 HE21 GLN 107 249.730 21.459 0.699 825 2HE2 GLN 107 HE22 GLN 107 251.055 22.408 0.125 826 H LEU 108 HN LEU 108 251.160 16.461 -3.558 827 HA LEU 108 HA LEU 108 251.507 13.652 -2.988 828 1HB LEU 108 HB2 LEU 108 252.916 15.246 -5.118 829 2HB LEU 108 HB1 LEU 108 252.593 13.524 -5.099 830 HG LEU 108 HG LEU 108 250.794 15.782 -5.795 831 1HD1 LEU 108 HD11 LEU 108 250.903 13.011 -6.924 832 2HD1 LEU 108 HD12 LEU 108 252.047 14.262 -7.404 833 3HD1 LEU 108 HD13 LEU 108 250.323 14.493 -7.681 834 1HD2 LEU 108 HD21 LEU 108 249.248 14.988 -4.343 835 2HD2 LEU 108 HD22 LEU 108 250.007 13.400 -4.236 836 3HD2 LEU 108 HD23 LEU 108 248.994 13.799 -5.620 837 H ASP 109 HN ASP 109 253.173 16.540 -2.300 838 HA ASP 109 HA ASP 109 255.589 15.025 -1.579 839 1HB ASP 109 HB2 ASP 109 255.350 18.003 -2.070 840 2HB ASP 109 HB1 ASP 109 256.834 17.109 -1.753 841 H GLN 110 HN GLN 110 252.972 15.536 -0.105 842 HA GLN 110 HA GLN 110 254.246 16.286 2.396 843 1HB GLN 110 HB2 GLN 110 251.732 17.624 1.394 844 2HB GLN 110 HB1 GLN 110 252.412 17.821 3.003 845 1HG GLN 110 HG2 GLN 110 254.549 18.515 1.585 846 2HG GLN 110 HG1 GLN 110 253.302 18.936 0.411 847 1HE2 GLN 110 HE21 GLN 110 251.293 19.725 2.182 848 2HE2 GLN 110 HE22 GLN 110 251.784 21.192 2.952 849 H ILE 111 HN ILE 111 252.898 13.887 1.022 850 HA ILE 111 HA ILE 111 250.604 13.361 2.676 851 HB ILE 111 HB ILE 111 251.820 10.908 1.760 852 1HG1 ILE 111 HG12 ILE 111 251.095 11.615 -0.726 853 2HG1 ILE 111 HG11 ILE 111 251.752 13.153 -0.173 854 1HG2 ILE 111 HG21 ILE 111 249.489 11.262 2.429 855 2HG2 ILE 111 HG22 ILE 111 249.663 10.502 0.847 856 3HG2 ILE 111 HG23 ILE 111 249.241 12.212 0.965 857 1HD1 ILE 111 HD11 ILE 111 253.157 10.498 -0.237 858 2HD1 ILE 111 HD12 ILE 111 253.827 11.963 0.475 859 3HD1 ILE 111 HD13 ILE 111 253.482 11.899 -1.253 860 HA PRO 112 HA PRO 112 253.113 11.932 6.055 861 1HB PRO 112 HB2 PRO 112 251.273 12.071 7.961 862 2HB PRO 112 HB1 PRO 112 251.831 13.545 7.159 863 1HG PRO 112 HG2 PRO 112 249.296 12.019 6.765 864 2HG PRO 112 HG1 PRO 112 249.570 13.768 6.717 865 1HD PRO 112 HD2 PRO 112 249.427 12.021 4.505 866 2HD PRO 112 HD1 PRO 112 249.971 13.709 4.488 867 H PHE 113 HN PHE 113 253.592 9.833 5.520 868 HA PHE 113 HA PHE 113 251.634 7.748 5.738 869 1HB PHE 113 HB2 PHE 113 254.482 6.984 5.801 870 2HB PHE 113 HB1 PHE 113 253.169 6.355 4.821 871 HD1 PHE 113 HD1 PHE 113 256.056 7.023 4.057 872 HD2 PHE 113 HD2 PHE 113 252.392 9.176 3.667 873 HE1 PHE 113 HE1 PHE 113 256.974 8.215 2.119 874 HE2 PHE 113 HE2 PHE 113 253.325 10.368 1.731 875 HZ PHE 113 HZ PHE 113 255.605 9.895 0.951 876 H LYS 114 HN LYS 114 253.666 9.378 7.939 877 HA LYS 114 HA LYS 114 254.080 7.313 9.825 878 1HB LYS 114 HB2 LYS 114 254.294 10.279 9.807 879 2HB LYS 114 HB1 LYS 114 254.129 9.505 11.377 880 1HG LYS 114 HG2 LYS 114 256.177 8.529 11.271 881 2HG LYS 114 HG1 LYS 114 256.149 8.400 9.511 882 1HD LYS 114 HD2 LYS 114 256.179 11.145 10.572 883 2HD LYS 114 HD1 LYS 114 257.635 10.200 10.887 884 1HE LYS 114 HE2 LYS 114 257.705 9.648 8.451 885 2HE LYS 114 HE1 LYS 114 256.372 10.776 8.211 886 1HZ LYS 114 HZ1 LYS 114 258.746 11.743 9.621 887 2HZ LYS 114 HZ2 LYS 114 257.700 12.567 8.577 888 3HZ LYS 114 HZ3 LYS 114 258.865 11.514 7.949 889 H ASP 115 HN ASP 115 251.469 9.461 9.065 890 HA ASP 115 HA ASP 115 249.981 8.575 11.408 891 1HB ASP 115 HB2 ASP 115 249.789 10.921 9.589 892 2HB ASP 115 HB1 ASP 115 248.293 10.327 10.301 893 H MET 116 HN MET 116 250.585 6.864 9.128 894 HA MET 116 HA MET 116 247.838 6.206 8.342 895 1HB MET 116 HB2 MET 116 250.266 6.471 6.606 896 2HB MET 116 HB1 MET 116 249.000 5.335 6.166 897 1HG MET 116 HG2 MET 116 247.532 6.960 5.615 898 2HG MET 116 HG1 MET 116 248.149 8.084 6.821 899 1HE MET 116 HE1 MET 116 249.531 6.337 3.353 900 2HE MET 116 HE2 MET 116 250.656 6.259 4.708 901 3HE MET 116 HE3 MET 116 251.002 7.310 3.340 902 H TRP 117 HN TRP 117 250.917 4.643 7.549 903 HA TRP 117 HA TRP 117 250.467 2.519 9.455 904 1HB TRP 117 HB2 TRP 117 250.127 2.096 6.491 905 2HB TRP 117 HB1 TRP 117 250.557 0.777 7.571 906 HD1 TRP 117 HD1 TRP 117 247.654 1.850 5.914 907 HE1 TRP 117 HE1 TRP 117 245.490 1.370 7.224 908 HE3 TRP 117 HE3 TRP 117 249.667 1.049 10.545 909 HZ2 TRP 117 HZ2 TRP 117 244.737 0.736 9.869 910 HZ3 TRP 117 HZ3 TRP 117 248.156 0.512 12.411 911 HH2 TRP 117 HH2 TRP 117 245.743 0.359 12.078 912 HA PRO 118 HA PRO 118 254.852 2.162 9.083 913 1HB PRO 118 HB2 PRO 118 255.317 -0.372 9.823 914 2HB PRO 118 HB1 PRO 118 254.689 0.829 10.955 915 1HG PRO 118 HG2 PRO 118 253.231 -1.318 9.470 916 2HG PRO 118 HG1 PRO 118 253.038 -0.789 11.150 917 1HD PRO 118 HD2 PRO 118 251.393 -0.015 9.095 918 2HD PRO 118 HD1 PRO 118 251.648 0.929 10.574 919 H ASP 119 HN ASP 119 252.985 1.025 6.711 920 HA ASP 119 HA ASP 119 255.242 -0.220 5.294 921 1HB ASP 119 HB2 ASP 119 253.409 -1.385 3.929 922 2HB ASP 119 HB1 ASP 119 253.696 -1.972 5.564 923 H ASP 120 HN ASP 120 252.766 2.188 5.270 924 HA ASP 120 HA ASP 120 252.394 2.741 2.607 925 1HB ASP 120 HB2 ASP 120 252.445 4.475 5.040 926 2HB ASP 120 HB1 ASP 120 252.224 5.195 3.446 927 H SER 121 HN SER 121 255.026 3.924 4.668 928 HA SER 121 HA SER 121 256.271 5.550 2.759 929 1HB SER 121 HB2 SER 121 257.862 4.063 4.824 930 2HB SER 121 HB1 SER 121 258.044 5.724 4.260 931 HG SER 121 HG SER 121 256.796 6.302 5.831 932 H TYR 122 HN TYR 122 256.088 2.132 2.929 933 HA TYR 122 HA TYR 122 258.538 1.669 1.482 934 1HB TYR 122 HB2 TYR 122 256.308 -0.189 2.316 935 2HB TYR 122 HB1 TYR 122 257.760 -0.711 1.471 936 HD1 TYR 122 HD1 TYR 122 259.747 1.068 2.910 937 HD2 TYR 122 HD2 TYR 122 256.561 -1.357 4.350 938 HE1 TYR 122 HE1 TYR 122 260.911 0.825 5.061 939 HE2 TYR 122 HE2 TYR 122 257.717 -1.605 6.505 940 HH TYR 122 HH TYR 122 260.435 0.295 7.364 941 H TRP 123 HN TRP 123 255.053 1.648 0.765 942 HA TRP 123 HA TRP 123 255.735 1.087 -2.018 943 1HB TRP 123 HB2 TRP 123 253.357 0.596 -2.367 944 2HB TRP 123 HB1 TRP 123 254.059 -0.391 -1.094 945 HD1 TRP 123 HD1 TRP 123 253.309 0.211 1.459 946 HE1 TRP 123 HE1 TRP 123 251.123 1.249 2.340 947 HE3 TRP 123 HE3 TRP 123 251.563 2.254 -2.890 948 HZ2 TRP 123 HZ2 TRP 123 248.945 2.751 1.325 949 HZ3 TRP 123 HZ3 TRP 123 249.419 3.463 -2.846 950 HH2 TRP 123 HH2 TRP 123 248.143 3.694 -0.787 951 H PHE 124 HN PHE 124 255.274 3.771 -0.178 952 HA PHE 124 HA PHE 124 253.645 5.303 -1.964 953 1HB PHE 124 HB2 PHE 124 255.034 5.757 0.580 954 2HB PHE 124 HB1 PHE 124 254.993 7.166 -0.475 955 HD1 PHE 124 HD1 PHE 124 253.307 8.628 0.063 956 HD2 PHE 124 HD2 PHE 124 252.591 4.447 0.407 957 HE1 PHE 124 HE1 PHE 124 251.006 9.087 0.773 958 HE2 PHE 124 HE2 PHE 124 250.281 4.903 1.117 959 HZ PHE 124 HZ PHE 124 249.486 7.225 1.302 960 HA PRO 125 HA PRO 125 258.029 7.311 -3.026 961 1HB PRO 125 HB2 PRO 125 259.973 5.306 -3.078 962 2HB PRO 125 HB1 PRO 125 259.820 6.576 -1.862 963 1HG PRO 125 HG2 PRO 125 258.906 3.743 -1.774 964 2HG PRO 125 HG1 PRO 125 259.555 4.759 -0.474 965 1HD PRO 125 HD2 PRO 125 256.946 4.215 -0.655 966 2HD PRO 125 HD1 PRO 125 257.516 5.801 -0.102 967 H LEU 126 HN LEU 126 257.141 3.987 -3.840 968 HA LEU 126 HA LEU 126 258.186 4.219 -6.519 969 1HB LEU 126 HB2 LEU 126 256.811 2.049 -6.835 970 2HB LEU 126 HB1 LEU 126 258.257 2.016 -5.846 971 HG LEU 126 HG LEU 126 256.001 2.598 -4.173 972 1HD1 LEU 126 HD11 LEU 126 254.613 0.720 -4.475 973 2HD1 LEU 126 HD12 LEU 126 255.716 -0.005 -5.644 974 3HD1 LEU 126 HD13 LEU 126 254.800 1.440 -6.075 975 1HD2 LEU 126 HD21 LEU 126 256.800 0.169 -3.410 976 2HD2 LEU 126 HD22 LEU 126 257.708 1.634 -3.033 977 3HD2 LEU 126 HD23 LEU 126 258.192 0.622 -4.394 978 H LEU 127 HN LEU 127 255.115 4.583 -4.901 979 HA LEU 127 HA LEU 127 253.413 4.636 -7.134 980 1HB LEU 127 HB2 LEU 127 253.266 6.071 -4.484 981 2HB LEU 127 HB1 LEU 127 251.974 6.102 -5.665 982 HG LEU 127 HG LEU 127 252.471 4.207 -3.619 983 1HD1 LEU 127 HD11 LEU 127 250.289 4.952 -4.035 984 2HD1 LEU 127 HD12 LEU 127 250.303 3.266 -4.549 985 3HD1 LEU 127 HD13 LEU 127 250.390 4.555 -5.750 986 1HD2 LEU 127 HD21 LEU 127 252.549 3.014 -6.389 987 2HD2 LEU 127 HD22 LEU 127 252.297 2.109 -4.897 988 3HD2 LEU 127 HD23 LEU 127 253.828 2.936 -5.176 989 H LEU 128 HN LEU 128 254.915 7.276 -5.325 990 HA LEU 128 HA LEU 128 254.158 9.361 -7.048 991 1HB LEU 128 HB2 LEU 128 256.189 9.001 -4.908 992 2HB LEU 128 HB1 LEU 128 256.388 10.374 -5.981 993 HG LEU 128 HG LEU 128 253.718 9.962 -4.729 994 1HD1 LEU 128 HD11 LEU 128 254.923 9.685 -2.764 995 2HD1 LEU 128 HD12 LEU 128 254.633 11.423 -2.813 996 3HD1 LEU 128 HD13 LEU 128 256.206 10.779 -3.281 997 1HD2 LEU 128 HD21 LEU 128 254.266 12.575 -4.552 998 2HD2 LEU 128 HD22 LEU 128 253.592 11.830 -6.001 999 3HD2 LEU 128 HD23 LEU 128 255.323 12.150 -5.899 1000 H GLN 129 HN GLN 129 256.752 7.053 -7.208 1001 HA GLN 129 HA GLN 129 258.210 8.510 -9.237 1002 1HB GLN 129 HB2 GLN 129 259.236 6.979 -7.471 1003 2HB GLN 129 HB1 GLN 129 258.636 5.637 -8.436 1004 1HG GLN 129 HG2 GLN 129 260.675 5.759 -9.363 1005 2HG GLN 129 HG1 GLN 129 259.920 7.017 -10.341 1006 1HE2 GLN 129 HE21 GLN 129 260.896 8.909 -10.401 1007 2HE2 GLN 129 HE22 GLN 129 262.065 9.487 -9.267 1008 H LYS 130 HN LYS 130 255.377 6.922 -9.365 1009 HA LYS 130 HA LYS 130 254.131 5.957 -10.987 1010 1HB LYS 130 HB2 LYS 130 254.243 6.969 -13.013 1011 2HB LYS 130 HB1 LYS 130 255.358 8.027 -12.166 1012 1HG LYS 130 HG2 LYS 130 257.054 6.109 -13.070 1013 2HG LYS 130 HG1 LYS 130 255.838 6.124 -14.347 1014 1HD LYS 130 HD2 LYS 130 257.453 7.703 -15.007 1015 2HD LYS 130 HD1 LYS 130 256.111 8.652 -14.363 1016 1HE LYS 130 HE2 LYS 130 258.007 9.639 -13.423 1017 2HE LYS 130 HE1 LYS 130 257.383 8.599 -12.143 1018 1HZ LYS 130 HZ1 LYS 130 259.011 6.885 -13.052 1019 2HZ LYS 130 HZ2 LYS 130 259.658 8.183 -12.182 1020 3HZ LYS 130 HZ3 LYS 130 259.741 8.172 -13.871 1021 H LYS 131 HN LYS 131 256.521 4.529 -9.810 1022 HA LYS 131 HA LYS 131 256.896 2.515 -11.923 1023 1HB LYS 131 HB2 LYS 131 258.569 2.969 -9.446 1024 2HB LYS 131 HB1 LYS 131 258.899 1.808 -10.724 1025 1HG LYS 131 HG2 LYS 131 258.605 4.560 -11.668 1026 2HG LYS 131 HG1 LYS 131 259.953 4.314 -10.557 1027 1HD LYS 131 HD2 LYS 131 260.664 3.993 -12.865 1028 2HD LYS 131 HD1 LYS 131 260.772 2.480 -11.962 1029 1HE LYS 131 HE2 LYS 131 259.823 1.966 -14.080 1030 2HE LYS 131 HE1 LYS 131 258.524 1.874 -12.891 1031 1HZ LYS 131 HZ1 LYS 131 259.000 4.357 -14.412 1032 2HZ LYS 131 HZ2 LYS 131 257.584 3.836 -13.647 1033 3HZ LYS 131 HZ3 LYS 131 258.090 3.097 -15.082 1034 H LYS 132 HN LYS 132 256.939 0.251 -11.229 1035 HA LYS 132 HA LYS 132 255.016 -0.202 -9.052 1036 1HB LYS 132 HB2 LYS 132 255.682 -1.934 -11.439 1037 2HB LYS 132 HB1 LYS 132 254.515 -2.343 -10.187 1038 1HG LYS 132 HG2 LYS 132 253.270 -0.253 -10.808 1039 2HG LYS 132 HG1 LYS 132 254.354 -0.111 -12.193 1040 1HD LYS 132 HD2 LYS 132 253.629 -2.581 -12.643 1041 2HD LYS 132 HD1 LYS 132 252.248 -2.153 -11.631 1042 1HE LYS 132 HE2 LYS 132 251.752 -0.268 -13.115 1043 2HE LYS 132 HE1 LYS 132 253.129 -0.705 -14.127 1044 1HZ LYS 132 HZ1 LYS 132 251.279 -1.627 -15.180 1045 2HZ LYS 132 HZ2 LYS 132 250.602 -2.188 -13.736 1046 3HZ LYS 132 HZ3 LYS 132 251.980 -2.937 -14.368 1047 H PHE 133 HN PHE 133 255.526 -1.451 -7.347 1048 HA PHE 133 HA PHE 133 257.894 -3.159 -7.457 1049 1HB PHE 133 HB2 PHE 133 257.512 -0.850 -5.561 1050 2HB PHE 133 HB1 PHE 133 258.545 -2.214 -5.154 1051 HD1 PHE 133 HD1 PHE 133 260.772 -2.130 -5.708 1052 HD2 PHE 133 HD2 PHE 133 258.017 0.292 -7.863 1053 HE1 PHE 133 HE1 PHE 133 262.643 -1.074 -6.903 1054 HE2 PHE 133 HE2 PHE 133 259.884 1.350 -9.065 1055 HZ PHE 133 HZ PHE 133 262.200 0.668 -8.585 1056 H HIS 134 HN HIS 134 258.039 -4.640 -5.638 1057 HA HIS 134 HA HIS 134 255.436 -5.145 -4.346 1058 1HB HIS 134 HB2 HIS 134 257.422 -7.108 -5.504 1059 2HB HIS 134 HB1 HIS 134 256.141 -7.590 -4.398 1060 HD1 HIS 134 HD1 HIS 134 254.626 -8.880 -5.901 1061 HD2 HIS 134 HD2 HIS 134 255.691 -5.204 -7.519 1062 HE1 HIS 134 HE1 HIS 134 253.231 -8.629 -7.978 1063 HE2 HIS 134 HE2 HIS 134 253.831 -6.359 -8.893 1064 H GLY 135 HN GLY 135 255.516 -5.122 -2.160 1065 1HA GLY 135 HA2 GLY 135 258.176 -5.519 -0.928 1066 2HA GLY 135 HA1 GLY 135 257.031 -4.325 -0.346 1067 H TYR 136 HN TYR 136 258.383 -6.935 0.666 1068 HA TYR 136 HA TYR 136 255.936 -8.158 1.764 1069 1HB TYR 136 HB2 TYR 136 257.639 -9.532 0.325 1070 2HB TYR 136 HB1 TYR 136 258.611 -9.523 1.788 1071 HD1 TYR 136 HD1 TYR 136 257.509 -11.957 0.369 1072 HD2 TYR 136 HD2 TYR 136 255.980 -9.623 3.581 1073 HE1 TYR 136 HE1 TYR 136 256.268 -13.913 1.190 1074 HE2 TYR 136 HE2 TYR 136 254.736 -11.574 4.407 1075 HH TYR 136 HH TYR 136 253.788 -13.788 3.239 1076 H PHE 137 HN PHE 137 255.572 -7.369 3.740 1077 HA PHE 137 HA PHE 137 257.886 -6.794 5.469 1078 1HB PHE 137 HB2 PHE 137 255.112 -5.728 5.922 1079 2HB PHE 137 HB1 PHE 137 256.643 -5.096 6.515 1080 HD1 PHE 137 HD1 PHE 137 254.110 -4.197 4.541 1081 HD2 PHE 137 HD2 PHE 137 258.308 -4.812 4.231 1082 HE1 PHE 137 HE1 PHE 137 254.195 -2.638 2.638 1083 HE2 PHE 137 HE2 PHE 137 258.402 -3.256 2.329 1084 HZ PHE 137 HZ PHE 137 256.343 -2.166 1.531 1085 H LYS 138 HN LYS 138 258.206 -8.047 7.177 1086 HA LYS 138 HA LYS 138 256.180 -9.967 7.988 1087 1HB LYS 138 HB2 LYS 138 258.736 -10.401 7.680 1088 2HB LYS 138 HB1 LYS 138 258.870 -9.687 9.281 1089 1HG LYS 138 HG2 LYS 138 257.030 -11.429 9.900 1090 2HG LYS 138 HG1 LYS 138 257.607 -12.254 8.450 1091 1HD LYS 138 HD2 LYS 138 258.762 -13.085 10.422 1092 2HD LYS 138 HD1 LYS 138 259.886 -12.236 9.359 1093 1HE LYS 138 HE2 LYS 138 260.004 -10.380 10.775 1094 2HE LYS 138 HE1 LYS 138 258.532 -10.830 11.635 1095 1HZ LYS 138 HZ1 LYS 138 259.891 -12.882 12.330 1096 2HZ LYS 138 HZ2 LYS 138 260.204 -11.408 13.100 1097 3HZ LYS 138 HZ3 LYS 138 261.241 -11.964 11.886 1098 H PHE 139 HN PHE 139 254.800 -9.533 9.599 1099 HA PHE 139 HA PHE 139 255.465 -7.345 11.440 1100 1HB PHE 139 HB2 PHE 139 252.885 -8.520 10.464 1101 2HB PHE 139 HB1 PHE 139 252.921 -7.647 11.991 1102 HD1 PHE 139 HD1 PHE 139 253.956 -7.271 8.431 1103 HD2 PHE 139 HD2 PHE 139 252.583 -5.371 11.983 1104 HE1 PHE 139 HE1 PHE 139 253.752 -5.144 7.211 1105 HE2 PHE 139 HE2 PHE 139 252.377 -3.242 10.769 1106 HZ PHE 139 HZ PHE 139 252.962 -3.126 8.380 1107 H GLN 140 HN GLN 140 255.040 -7.556 13.696 1108 HA GLN 140 HA GLN 140 255.679 -10.175 14.712 1109 1HB GLN 140 HB2 GLN 140 256.301 -9.125 16.643 1110 2HB GLN 140 HB1 GLN 140 256.400 -7.751 15.554 1111 1HG GLN 140 HG2 GLN 140 254.089 -7.127 16.247 1112 2HG GLN 140 HG1 GLN 140 254.160 -8.415 17.448 1113 1HE2 GLN 140 HE21 GLN 140 253.716 -6.448 18.803 1114 2HE2 GLN 140 HE22 GLN 140 255.086 -5.603 19.429 1115 H GLY 141 HN GLY 141 252.870 -8.190 14.356 1116 1HA GLY 141 HA2 GLY 141 251.190 -10.380 15.266 1117 2HA GLY 141 HA1 GLY 141 251.054 -8.884 16.181 1118 H GLN 142 HN GLN 142 250.799 -6.885 14.693 1119 HA GLN 142 HA GLN 142 249.558 -7.211 12.168 1120 1HB GLN 142 HB2 GLN 142 247.860 -7.464 14.509 1121 2HB GLN 142 HB1 GLN 142 247.351 -6.129 13.485 1122 1HG GLN 142 HG2 GLN 142 246.872 -7.506 11.698 1123 2HG GLN 142 HG1 GLN 142 247.919 -8.798 12.280 1124 1HE2 GLN 142 HE21 GLN 142 245.252 -6.950 13.718 1125 2HE2 GLN 142 HE22 GLN 142 244.321 -8.328 14.184 1126 H ASP 143 HN ASP 143 251.489 -5.509 13.733 1127 HA ASP 143 HA ASP 143 250.756 -3.011 12.520 1128 1HB ASP 143 HB2 ASP 143 250.743 -3.311 15.516 1129 2HB ASP 143 HB1 ASP 143 251.047 -1.758 14.742 1130 H THR 144 HN THR 144 252.912 -4.646 14.813 1131 HA THR 144 HA THR 144 255.105 -2.868 14.227 1132 HB THR 144 HB THR 144 254.840 -5.365 15.893 1133 HG1 THR 144 HG1 THR 144 255.310 -3.860 17.555 1134 1HG2 THR 144 HG21 THR 144 257.022 -5.720 15.624 1135 2HG2 THR 144 HG22 THR 144 257.224 -4.302 16.653 1136 3HG2 THR 144 HG23 THR 144 257.294 -4.136 14.898 1137 H ILE 145 HN ILE 145 256.825 -3.226 12.916 1138 HA ILE 145 HA ILE 145 256.719 -5.668 11.288 1139 HB ILE 145 HB ILE 145 257.993 -3.036 10.554 1140 1HG1 ILE 145 HG12 ILE 145 255.479 -4.302 9.452 1141 2HG1 ILE 145 HG11 ILE 145 255.485 -3.020 10.660 1142 1HG2 ILE 145 HG21 ILE 145 257.987 -4.158 8.254 1143 2HG2 ILE 145 HG22 ILE 145 257.723 -5.667 9.128 1144 3HG2 ILE 145 HG23 ILE 145 259.179 -4.719 9.427 1145 1HD1 ILE 145 HD11 ILE 145 255.095 -1.986 8.586 1146 2HD1 ILE 145 HD12 ILE 145 256.402 -2.881 7.808 1147 3HD1 ILE 145 HD13 ILE 145 256.773 -1.634 8.999 1148 H LEU 146 HN LEU 146 258.423 -6.989 11.180 1149 HA LEU 146 HA LEU 146 260.866 -6.182 12.616 1150 1HB LEU 146 HB2 LEU 146 259.996 -9.034 12.259 1151 2HB LEU 146 HB1 LEU 146 261.142 -8.376 13.412 1152 HG LEU 146 HG LEU 146 258.243 -7.619 13.553 1153 1HD1 LEU 146 HD11 LEU 146 257.662 -9.487 14.777 1154 2HD1 LEU 146 HD12 LEU 146 259.337 -9.906 15.132 1155 3HD1 LEU 146 HD13 LEU 146 258.685 -10.175 13.516 1156 1HD2 LEU 146 HD21 LEU 146 259.768 -6.316 14.891 1157 2HD2 LEU 146 HD22 LEU 146 260.483 -7.781 15.564 1158 3HD2 LEU 146 HD23 LEU 146 258.814 -7.360 15.945 1159 H ASP 147 HN ASP 147 259.575 -6.937 9.622 1160 HA ASP 147 HA ASP 147 262.208 -7.120 8.447 1161 1HB ASP 147 HB2 ASP 147 260.825 -9.490 8.976 1162 2HB ASP 147 HB1 ASP 147 260.539 -9.187 7.265 1163 H TYR 148 HN TYR 148 262.267 -6.130 6.478 1164 HA TYR 148 HA TYR 148 259.741 -5.793 5.047 1165 1HB TYR 148 HB2 TYR 148 260.058 -3.427 4.727 1166 2HB TYR 148 HB1 TYR 148 260.069 -3.782 6.451 1167 HD1 TYR 148 HD1 TYR 148 262.129 -3.585 7.749 1168 HD2 TYR 148 HD2 TYR 148 262.055 -2.649 3.599 1169 HE1 TYR 148 HE1 TYR 148 264.292 -2.439 7.976 1170 HE2 TYR 148 HE2 TYR 148 264.219 -1.501 3.814 1171 HH TYR 148 HH TYR 148 266.259 -1.718 5.508 1172 H THR 149 HN THR 149 259.907 -6.063 2.905 1173 HA THR 149 HA THR 149 262.584 -5.867 1.695 1174 HB THR 149 HB THR 149 261.391 -7.774 0.163 1175 HG1 THR 149 HG1 THR 149 260.635 -8.329 2.838 1176 1HG2 THR 149 HG21 THR 149 263.631 -7.681 1.638 1177 2HG2 THR 149 HG22 THR 149 263.042 -9.133 0.827 1178 3HG2 THR 149 HG23 THR 149 262.708 -8.882 2.541 1179 H LEU 150 HN LEU 150 262.665 -5.080 -0.398 1180 HA LEU 150 HA LEU 150 260.121 -4.240 -1.596 1181 1HB LEU 150 HB2 LEU 150 262.525 -2.532 -1.028 1182 2HB LEU 150 HB1 LEU 150 261.387 -2.112 -2.295 1183 HG LEU 150 HG LEU 150 259.775 -2.580 -0.076 1184 1HD1 LEU 150 HD11 LEU 150 261.263 -2.492 1.635 1185 2HD1 LEU 150 HD12 LEU 150 260.983 -0.763 1.434 1186 3HD1 LEU 150 HD13 LEU 150 262.418 -1.512 0.731 1187 1HD2 LEU 150 HD21 LEU 150 260.050 -0.675 -1.965 1188 2HD2 LEU 150 HD22 LEU 150 260.623 0.201 -0.545 1189 3HD2 LEU 150 HD23 LEU 150 259.011 -0.515 -0.548 1190 H ARG 151 HN ARG 151 259.948 -4.936 -3.607 1191 HA ARG 151 HA ARG 151 262.404 -5.320 -5.189 1192 1HB ARG 151 HB2 ARG 151 259.910 -7.026 -5.291 1193 2HB ARG 151 HB1 ARG 151 261.364 -7.255 -6.254 1194 1HG ARG 151 HG2 ARG 151 261.202 -7.476 -3.255 1195 2HG ARG 151 HG1 ARG 151 261.238 -8.828 -4.389 1196 1HD ARG 151 HD2 ARG 151 263.423 -7.440 -5.180 1197 2HD ARG 151 HD1 ARG 151 263.410 -7.071 -3.457 1198 HE ARG 151 HE ARG 151 263.990 -9.244 -3.016 1199 1HH1 ARG 151 HH11 ARG 151 262.933 -8.999 -6.334 1200 2HH1 ARG 151 HH12 ARG 151 263.428 -10.608 -6.742 1201 1HH2 ARG 151 HH21 ARG 151 264.641 -11.361 -3.551 1202 2HH2 ARG 151 HH22 ARG 151 264.397 -11.949 -5.161 1203 H GLU 152 HN GLU 152 262.106 -5.161 -7.524 1204 HA GLU 152 HA GLU 152 260.062 -3.157 -8.171 1205 1HB GLU 152 HB2 GLU 152 261.462 -2.531 -10.042 1206 2HB GLU 152 HB1 GLU 152 262.439 -2.572 -8.581 1207 1HG GLU 152 HG2 GLU 152 263.795 -4.120 -9.411 1208 2HG GLU 152 HG1 GLU 152 262.451 -5.115 -9.967 1209 H VAL 153 HN VAL 153 258.786 -3.342 -10.046 1210 HA VAL 153 HA VAL 153 258.844 -5.882 -11.486 1211 HB VAL 153 HB VAL 153 256.406 -6.193 -11.226 1212 1HG1 VAL 153 HG11 VAL 153 258.208 -7.243 -9.723 1213 2HG1 VAL 153 HG12 VAL 153 256.528 -7.321 -9.190 1214 3HG1 VAL 153 HG13 VAL 153 257.621 -6.129 -8.488 1215 1HG2 VAL 153 HG21 VAL 153 256.606 -4.080 -9.084 1216 2HG2 VAL 153 HG22 VAL 153 255.167 -4.992 -9.541 1217 3HG2 VAL 153 HG23 VAL 153 255.877 -3.840 -10.672 1218 H ASP 154 HN ASP 154 258.091 -5.764 -13.567 1219 HA ASP 154 HA ASP 154 256.428 -3.754 -14.601 1220 1HB ASP 154 HB2 ASP 154 258.539 -2.420 -14.052 1221 2HB ASP 154 HB1 ASP 154 259.314 -3.310 -15.358 1222 H THR 155 HN THR 155 259.363 -5.544 -15.558 1223 HA THR 155 HA THR 155 258.447 -6.122 -18.170 1224 HB THR 155 HB THR 155 260.512 -7.611 -16.538 1225 HG1 THR 155 HG1 THR 155 260.990 -5.392 -16.712 1226 1HG2 THR 155 HG21 THR 155 259.539 -8.290 -19.009 1227 2HG2 THR 155 HG22 THR 155 261.106 -8.751 -18.345 1228 3HG2 THR 155 HG23 THR 155 260.972 -7.336 -19.389 1229 H VAL 156 HN VAL 156 256.373 -6.984 -18.051 1230 HA VAL 156 HA VAL 156 255.874 -9.378 -16.507 1231 HB VAL 156 HB VAL 156 254.067 -8.059 -18.536 1232 1HG1 VAL 156 HG11 VAL 156 252.318 -9.173 -17.030 1233 2HG1 VAL 156 HG12 VAL 156 253.657 -10.145 -16.419 1234 3HG1 VAL 156 HG13 VAL 156 253.232 -10.205 -18.129 1235 1HG2 VAL 156 HG21 VAL 156 253.425 -6.516 -17.036 1236 2HG2 VAL 156 HG22 VAL 156 254.976 -6.856 -16.269 1237 3HG2 VAL 156 HG23 VAL 156 253.513 -7.648 -15.687
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