NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
543822 | 2lfo | 17767 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 ALA 1 HT1 ALA 1 -13.573 -10.482 1.753 2 H2 ALA 1 HT2 ALA 1 -13.130 -10.423 0.122 3 H3 ALA 1 HT3 ALA 1 -14.762 -10.370 0.557 4 HA ALA 1 HA ALA 1 -13.964 -8.195 -0.078 5 HB1 ALA 1 HB1 ALA 1 -15.730 -8.506 1.668 6 HB2 ALA 1 HB2 ALA 1 -14.835 -6.993 1.792 7 HB3 ALA 1 HB3 ALA 1 -14.471 -8.323 2.888 8 H PHE 2 HN PHE 2 -12.840 -6.235 1.117 9 HA PHE 2 HA PHE 2 -10.059 -6.879 1.170 10 HB2 PHE 2 HB2 PHE 2 -11.667 -4.378 1.386 11 HB3 PHE 2 HB1 PHE 2 -9.968 -4.343 1.846 12 HD1 PHE 2 HD1 PHE 2 -12.236 -5.305 -0.945 13 HD2 PHE 2 HD2 PHE 2 -8.339 -4.058 0.234 14 HE1 PHE 2 HE1 PHE 2 -11.599 -5.067 -3.312 15 HE2 PHE 2 HE2 PHE 2 -7.699 -3.820 -2.129 16 HZ PHE 2 HZ PHE 2 -9.328 -4.329 -3.904 17 H SER 3 HN SER 3 -12.484 -6.394 3.626 18 HA SER 3 HA SER 3 -10.844 -5.717 5.797 19 HB2 SER 3 HB2 SER 3 -12.971 -7.314 6.744 20 HB3 SER 3 HB1 SER 3 -12.909 -5.553 6.648 21 HG SER 3 HG SER 3 -14.210 -5.607 4.977 22 H GLY 4 HN GLY 4 -9.023 -6.890 6.166 23 HA2 GLY 4 HA2 GLY 4 -9.058 -9.302 7.511 24 HA3 GLY 4 HA1 GLY 4 -8.835 -9.704 5.813 25 H THR 5 HN THR 5 -6.741 -10.534 6.346 26 HA THR 5 HA THR 5 -4.764 -8.376 6.621 27 HB THR 5 HB THR 5 -3.298 -10.075 7.768 28 HG1 THR 5 HG1 THR 5 -4.569 -11.770 8.859 29 HG21 THR 5 HG21 THR 5 -4.590 -8.241 8.918 30 HG22 THR 5 HG22 THR 5 -4.155 -9.615 9.931 31 HG23 THR 5 HG23 THR 5 -5.800 -9.459 9.318 32 H TRP 6 HN TRP 6 -3.536 -8.245 4.872 33 HA TRP 6 HA TRP 6 -3.146 -10.666 3.228 34 HB2 TRP 6 HB2 TRP 6 -2.917 -7.867 2.188 35 HB3 TRP 6 HB1 TRP 6 -3.166 -9.359 1.292 36 HD1 TRP 6 HD1 TRP 6 -5.052 -6.853 3.496 37 HE1 TRP 6 HE1 TRP 6 -7.566 -7.038 2.960 38 HE3 TRP 6 HE3 TRP 6 -4.922 -10.969 0.461 39 HZ2 TRP 6 HZ2 TRP 6 -9.269 -8.742 1.455 40 HZ3 TRP 6 HZ3 TRP 6 -7.032 -11.815 -0.470 41 HH2 TRP 6 HH2 TRP 6 -9.156 -10.726 0.019 42 H GLN 7 HN GLN 7 -1.171 -11.424 3.049 43 HA GLN 7 HA GLN 7 1.078 -9.805 3.975 44 HB2 GLN 7 HB2 GLN 7 0.671 -12.236 4.697 45 HB3 GLN 7 HB1 GLN 7 1.155 -12.687 3.068 46 HG2 GLN 7 HG2 GLN 7 3.160 -12.888 4.077 47 HG3 GLN 7 HG1 GLN 7 3.242 -11.171 3.694 48 HE21 GLN 7 HE21 GLN 7 1.313 -12.702 6.220 49 HE22 GLN 7 HE22 GLN 7 2.129 -11.942 7.543 50 H VAL 8 HN VAL 8 2.406 -8.837 2.576 51 HA VAL 8 HA VAL 8 1.973 -9.259 -0.272 52 HB VAL 8 HB VAL 8 3.520 -7.151 1.224 53 HG11 VAL 8 HG11 VAL 8 4.588 -7.609 -0.936 54 HG12 VAL 8 HG12 VAL 8 3.828 -6.019 -0.906 55 HG13 VAL 8 HG13 VAL 8 3.042 -7.356 -1.746 56 HG21 VAL 8 HG21 VAL 8 1.769 -5.681 0.762 57 HG22 VAL 8 HG22 VAL 8 0.953 -7.180 1.214 58 HG23 VAL 8 HG23 VAL 8 1.097 -6.732 -0.485 59 H TYR 9 HN TYR 9 3.445 -10.041 -1.710 60 HA TYR 9 HA TYR 9 6.211 -10.399 -0.896 61 HB2 TYR 9 HB2 TYR 9 6.289 -12.780 -1.346 62 HB3 TYR 9 HB1 TYR 9 5.069 -12.472 -0.119 63 HD1 TYR 9 HD1 TYR 9 2.610 -12.221 -1.044 64 HD2 TYR 9 HD2 TYR 9 5.771 -14.161 -3.120 65 HE1 TYR 9 HE1 TYR 9 0.965 -13.426 -2.413 66 HE2 TYR 9 HE2 TYR 9 4.138 -15.377 -4.491 67 HH TYR 9 HH TYR 9 0.818 -14.547 -4.554 68 H ALA 10 HN ALA 10 7.347 -9.583 -2.527 69 HA ALA 10 HA ALA 10 7.220 -10.459 -5.194 70 HB1 ALA 10 HB1 ALA 10 6.376 -8.382 -6.279 71 HB2 ALA 10 HB2 ALA 10 5.872 -7.802 -4.690 72 HB3 ALA 10 HB3 ALA 10 5.135 -9.249 -5.375 73 H GLN 11 HN GLN 11 8.845 -9.431 -6.519 74 HA GLN 11 HA GLN 11 10.563 -7.564 -5.043 75 HB2 GLN 11 HB2 GLN 11 11.221 -10.221 -6.059 76 HB3 GLN 11 HB1 GLN 11 12.324 -8.981 -6.638 77 HG2 GLN 11 HG2 GLN 11 13.307 -9.796 -4.686 78 HG3 GLN 11 HG1 GLN 11 12.552 -8.281 -4.204 79 HE21 GLN 11 HE21 GLN 11 12.346 -8.797 -2.079 80 HE22 GLN 11 HE22 GLN 11 11.268 -10.011 -1.494 81 H GLU 12 HN GLU 12 8.592 -7.044 -7.117 82 HA GLU 12 HA GLU 12 10.308 -6.250 -9.367 83 HB2 GLU 12 HB2 GLU 12 7.326 -6.317 -9.086 84 HB3 GLU 12 HB1 GLU 12 8.120 -5.503 -10.414 85 HG2 GLU 12 HG2 GLU 12 8.362 -8.424 -9.764 86 HG3 GLU 12 HG1 GLU 12 7.358 -7.724 -11.031 87 H ASN 13 HN ASN 13 10.605 -4.244 -9.925 88 HA ASN 13 HA ASN 13 11.401 -2.144 -9.228 89 HB2 ASN 13 HB2 ASN 13 8.439 -1.650 -9.564 90 HB3 ASN 13 HB1 ASN 13 9.760 -0.535 -9.909 91 HD21 ASN 13 HD21 ASN 13 7.530 -2.112 -11.404 92 HD22 ASN 13 HD22 ASN 13 8.343 -2.633 -12.845 93 H TYR 14 HN TYR 14 11.283 -3.397 -6.859 94 HA TYR 14 HA TYR 14 9.656 -1.777 -5.056 95 HB2 TYR 14 HB2 TYR 14 9.635 -4.227 -4.794 96 HB3 TYR 14 HB1 TYR 14 11.374 -4.217 -4.532 97 HD1 TYR 14 HD1 TYR 14 12.298 -3.213 -2.465 98 HD2 TYR 14 HD2 TYR 14 8.115 -3.718 -3.030 99 HE1 TYR 14 HE1 TYR 14 11.952 -2.945 -0.056 100 HE2 TYR 14 HE2 TYR 14 7.753 -3.452 -0.613 101 HH TYR 14 HH TYR 14 9.913 -3.858 1.617 102 H GLU 15 HN GLU 15 13.001 -2.940 -5.210 103 HA GLU 15 HA GLU 15 14.074 -1.234 -3.282 104 HB2 GLU 15 HB2 GLU 15 16.257 -1.778 -4.246 105 HB3 GLU 15 HB1 GLU 15 15.251 -3.211 -4.087 106 HG2 GLU 15 HG2 GLU 15 14.869 -3.327 -6.403 107 HG3 GLU 15 HG1 GLU 15 15.463 -1.690 -6.664 108 H GLU 16 HN GLU 16 13.252 -0.600 -6.582 109 HA GLU 16 HA GLU 16 14.862 1.817 -6.672 110 HB2 GLU 16 HB2 GLU 16 13.322 0.219 -8.641 111 HB3 GLU 16 HB1 GLU 16 13.490 1.941 -8.962 112 HG2 GLU 16 HG2 GLU 16 15.816 0.160 -8.331 113 HG3 GLU 16 HG1 GLU 16 15.245 0.453 -9.975 114 H PHE 17 HN PHE 17 11.521 0.861 -6.215 115 HA PHE 17 HA PHE 17 10.412 3.442 -6.624 116 HB2 PHE 17 HB2 PHE 17 8.939 1.532 -6.678 117 HB3 PHE 17 HB1 PHE 17 9.389 1.073 -5.038 118 HD1 PHE 17 HD1 PHE 17 8.367 4.325 -6.568 119 HD2 PHE 17 HD2 PHE 17 7.575 1.316 -3.667 120 HE1 PHE 17 HE1 PHE 17 6.491 5.645 -5.708 121 HE2 PHE 17 HE2 PHE 17 5.695 2.637 -2.805 122 HZ PHE 17 HZ PHE 17 5.147 4.806 -3.825 123 H LEU 18 HN LEU 18 11.798 1.750 -3.899 124 HA LEU 18 HA LEU 18 11.084 3.486 -1.835 125 HB2 LEU 18 HB2 LEU 18 13.686 1.985 -2.082 126 HB3 LEU 18 HB1 LEU 18 12.940 2.567 -0.604 127 HG LEU 18 HG LEU 18 11.963 0.330 -2.377 128 HD11 LEU 18 HD11 LEU 18 12.140 -0.800 -0.025 129 HD12 LEU 18 HD12 LEU 18 13.307 0.489 0.272 130 HD13 LEU 18 HD13 LEU 18 13.553 -0.637 -1.063 131 HD21 LEU 18 HD21 LEU 18 10.146 0.060 -0.750 132 HD22 LEU 18 HD22 LEU 18 10.048 1.593 -1.615 133 HD23 LEU 18 HD23 LEU 18 10.647 1.553 0.044 134 H LYS 19 HN LYS 19 13.600 3.686 -4.266 135 HA LYS 19 HA LYS 19 15.022 5.849 -3.068 136 HB2 LYS 19 HB2 LYS 19 14.984 5.413 -6.028 137 HB3 LYS 19 HB1 LYS 19 16.320 5.893 -4.992 138 HG2 LYS 19 HG2 LYS 19 15.232 3.200 -4.518 139 HG3 LYS 19 HG1 LYS 19 16.052 3.453 -6.059 140 HD2 LYS 19 HD2 LYS 19 17.959 4.436 -4.761 141 HD3 LYS 19 HD1 LYS 19 17.156 3.875 -3.296 142 HE2 LYS 19 HE2 LYS 19 18.768 2.231 -3.909 143 HE3 LYS 19 HE1 LYS 19 17.168 1.580 -4.257 144 HZ1 LYS 19 HZ1 LYS 19 19.091 2.700 -6.218 145 HZ2 LYS 19 HZ2 LYS 19 17.504 2.259 -6.604 146 HZ3 LYS 19 HZ3 LYS 19 18.608 1.087 -6.075 147 H ALA 20 HN ALA 20 12.072 5.642 -4.836 148 HA ALA 20 HA ALA 20 12.204 8.358 -5.815 149 HB1 ALA 20 HB1 ALA 20 9.817 6.529 -5.826 150 HB2 ALA 20 HB2 ALA 20 11.068 6.521 -7.069 151 HB3 ALA 20 HB3 ALA 20 10.083 7.961 -6.818 152 H LEU 21 HN LEU 21 11.025 6.709 -3.043 153 HA LEU 21 HA LEU 21 9.276 8.862 -2.217 154 HB2 LEU 21 HB2 LEU 21 10.283 6.462 -0.695 155 HB3 LEU 21 HB1 LEU 21 9.005 7.542 -0.172 156 HG LEU 21 HG LEU 21 8.301 6.578 -2.748 157 HD11 LEU 21 HD11 LEU 21 9.186 4.436 -0.830 158 HD12 LEU 21 HD12 LEU 21 9.790 4.732 -2.461 159 HD13 LEU 21 HD13 LEU 21 8.138 4.163 -2.222 160 HD21 LEU 21 HD21 LEU 21 7.188 5.750 -0.083 161 HD22 LEU 21 HD22 LEU 21 6.352 5.834 -1.633 162 HD23 LEU 21 HD23 LEU 21 6.863 7.315 -0.823 163 H ALA 22 HN ALA 22 12.487 8.525 -2.405 164 HA ALA 22 HA ALA 22 14.267 9.677 -1.613 165 HB1 ALA 22 HB1 ALA 22 12.367 11.295 0.075 166 HB2 ALA 22 HB2 ALA 22 12.664 11.612 -1.632 167 HB3 ALA 22 HB3 ALA 22 13.982 11.743 -0.472 168 H LEU 23 HN LEU 23 13.338 7.276 -0.429 169 HA LEU 23 HA LEU 23 13.707 7.553 2.422 170 HB2 LEU 23 HB2 LEU 23 13.221 5.228 0.575 171 HB3 LEU 23 HB1 LEU 23 13.552 4.999 2.287 172 HG LEU 23 HG LEU 23 11.352 6.844 1.421 173 HD11 LEU 23 HD11 LEU 23 10.955 3.902 1.878 174 HD12 LEU 23 HD12 LEU 23 10.997 4.660 0.285 175 HD13 LEU 23 HD13 LEU 23 9.739 5.107 1.444 176 HD21 LEU 23 HD21 LEU 23 11.678 5.107 3.857 177 HD22 LEU 23 HD22 LEU 23 10.429 6.317 3.572 178 HD23 LEU 23 HD23 LEU 23 12.108 6.815 3.767 179 HA PRO 24 HA PRO 24 18.046 6.883 2.665 180 HB2 PRO 24 HB2 PRO 24 17.825 4.795 4.700 181 HB3 PRO 24 HB1 PRO 24 18.400 6.462 4.869 182 HG2 PRO 24 HG2 PRO 24 16.086 5.615 5.956 183 HG3 PRO 24 HG1 PRO 24 16.336 7.279 5.389 184 HD2 PRO 24 HD2 PRO 24 14.886 5.032 4.058 185 HD3 PRO 24 HD1 PRO 24 14.465 6.750 4.149 186 H GLU 25 HN GLU 25 19.406 5.845 1.404 187 HA GLU 25 HA GLU 25 18.800 3.567 -0.052 188 HB2 GLU 25 HB2 GLU 25 21.438 4.838 0.631 189 HB3 GLU 25 HB1 GLU 25 21.327 3.431 -0.415 190 HG2 GLU 25 HG2 GLU 25 21.390 5.192 -1.903 191 HG3 GLU 25 HG1 GLU 25 19.669 4.841 -1.779 192 H ASP 26 HN ASP 26 20.158 3.841 3.133 193 HA ASP 26 HA ASP 26 21.231 1.228 3.319 194 HB2 ASP 26 HB2 ASP 26 21.897 2.992 4.875 195 HB3 ASP 26 HB1 ASP 26 20.249 3.105 5.484 196 H LEU 27 HN LEU 27 18.168 2.603 4.579 197 HA LEU 27 HA LEU 27 17.135 0.178 5.542 198 HB2 LEU 27 HB2 LEU 27 16.338 2.717 5.741 199 HB3 LEU 27 HB1 LEU 27 15.255 2.206 4.461 200 HG LEU 27 HG LEU 27 14.774 0.213 6.146 201 HD11 LEU 27 HD11 LEU 27 14.884 0.830 8.433 202 HD12 LEU 27 HD12 LEU 27 15.450 2.450 8.036 203 HD13 LEU 27 HD13 LEU 27 16.492 1.057 7.747 204 HD21 LEU 27 HD21 LEU 27 13.599 2.959 6.514 205 HD22 LEU 27 HD22 LEU 27 12.842 1.419 6.915 206 HD23 LEU 27 HD23 LEU 27 13.157 1.833 5.230 207 H ILE 28 HN ILE 28 17.143 1.598 2.366 208 HA ILE 28 HA ILE 28 15.151 0.061 1.133 209 HB ILE 28 HB ILE 28 17.632 1.355 0.004 210 HG12 ILE 28 HG12 ILE 28 14.742 2.238 -0.045 211 HG13 ILE 28 HG11 ILE 28 15.939 2.824 1.104 212 HG21 ILE 28 HG21 ILE 28 16.948 -0.348 -1.555 213 HG22 ILE 28 HG22 ILE 28 16.500 1.237 -2.188 214 HG23 ILE 28 HG23 ILE 28 15.272 0.199 -1.467 215 HD11 ILE 28 HD11 ILE 28 15.547 3.482 -1.734 216 HD12 ILE 28 HD12 ILE 28 17.215 3.363 -1.179 217 HD13 ILE 28 HD13 ILE 28 16.102 4.487 -0.395 218 H LYS 29 HN LYS 29 18.341 -0.811 2.173 219 HA LYS 29 HA LYS 29 18.565 -3.048 0.348 220 HB2 LYS 29 HB2 LYS 29 20.271 -2.163 2.676 221 HB3 LYS 29 HB1 LYS 29 20.639 -3.548 1.653 222 HG2 LYS 29 HG2 LYS 29 20.886 -2.137 -0.268 223 HG3 LYS 29 HG1 LYS 29 20.328 -0.731 0.639 224 HD2 LYS 29 HD2 LYS 29 22.647 -0.481 0.607 225 HD3 LYS 29 HD1 LYS 29 22.333 -1.199 2.187 226 HE2 LYS 29 HE2 LYS 29 24.233 -2.269 1.110 227 HE3 LYS 29 HE1 LYS 29 22.902 -3.407 1.301 228 HZ1 LYS 29 HZ1 LYS 29 24.011 -3.502 -0.888 229 HZ2 LYS 29 HZ2 LYS 29 23.475 -1.932 -1.207 230 HZ3 LYS 29 HZ3 LYS 29 22.356 -3.180 -0.992 231 H MET 30 HN MET 30 17.390 -2.419 3.551 232 HA MET 30 HA MET 30 17.291 -5.260 4.177 233 HB2 MET 30 HB2 MET 30 16.341 -2.870 5.767 234 HB3 MET 30 HB1 MET 30 16.410 -4.530 6.348 235 HG2 MET 30 HG2 MET 30 18.383 -3.865 7.175 236 HG3 MET 30 HG1 MET 30 18.943 -4.238 5.549 237 HE1 MET 30 HE1 MET 30 18.546 -0.087 7.427 238 HE2 MET 30 HE2 MET 30 18.658 -1.622 8.291 239 HE3 MET 30 HE3 MET 30 17.172 -1.194 7.440 240 H ALA 31 HN ALA 31 15.184 -2.630 3.245 241 HA ALA 31 HA ALA 31 12.700 -3.813 3.783 242 HB1 ALA 31 HB1 ALA 31 13.059 -1.424 3.157 243 HB2 ALA 31 HB2 ALA 31 11.759 -2.205 2.263 244 HB3 ALA 31 HB3 ALA 31 13.325 -1.946 1.497 245 H ARG 32 HN ARG 32 14.973 -4.351 1.216 246 HA ARG 32 HA ARG 32 13.267 -5.537 -0.678 247 HB2 ARG 32 HB2 ARG 32 15.216 -6.281 -1.772 248 HB3 ARG 32 HB1 ARG 32 15.724 -4.815 -0.946 249 HG2 ARG 32 HG2 ARG 32 16.704 -6.139 0.837 250 HG3 ARG 32 HG1 ARG 32 16.170 -7.622 0.044 251 HD2 ARG 32 HD2 ARG 32 17.527 -6.807 -1.967 252 HD3 ARG 32 HD1 ARG 32 18.257 -5.652 -0.849 253 HE ARG 32 HE ARG 32 18.744 -7.804 0.502 254 HH11 ARG 32 HH11 ARG 32 18.825 -7.512 -2.986 255 HH12 ARG 32 HH12 ARG 32 20.001 -8.770 -3.187 256 HH21 ARG 32 HH21 ARG 32 20.270 -9.474 0.235 257 HH22 ARG 32 HH22 ARG 32 20.812 -9.896 -1.357 258 H ASP 33 HN ASP 33 14.398 -6.633 2.354 259 HA ASP 33 HA ASP 33 13.552 -9.383 1.743 260 HB2 ASP 33 HB2 ASP 33 15.822 -9.306 2.548 261 HB3 ASP 33 HB1 ASP 33 15.351 -8.306 3.915 262 H ILE 34 HN ILE 34 13.135 -6.637 3.859 263 HA ILE 34 HA ILE 34 11.312 -7.930 5.642 264 HB ILE 34 HB ILE 34 11.615 -4.958 5.200 265 HG12 ILE 34 HG12 ILE 34 13.242 -6.923 6.760 266 HG13 ILE 34 HG11 ILE 34 13.783 -5.609 5.732 267 HG21 ILE 34 HG21 ILE 34 9.642 -5.437 6.443 268 HG22 ILE 34 HG22 ILE 34 10.854 -4.891 7.606 269 HG23 ILE 34 HG23 ILE 34 10.483 -6.610 7.449 270 HD11 ILE 34 HD11 ILE 34 13.286 -3.994 7.395 271 HD12 ILE 34 HD12 ILE 34 14.185 -5.292 8.177 272 HD13 ILE 34 HD13 ILE 34 12.438 -5.178 8.385 273 H LYS 35 HN LYS 35 9.475 -8.687 4.867 274 HA LYS 35 HA LYS 35 7.873 -6.944 3.125 275 HB2 LYS 35 HB2 LYS 35 6.670 -9.176 2.589 276 HB3 LYS 35 HB1 LYS 35 8.228 -8.851 1.839 277 HG2 LYS 35 HG2 LYS 35 9.335 -10.283 3.456 278 HG3 LYS 35 HG1 LYS 35 7.803 -10.557 4.283 279 HD2 LYS 35 HD2 LYS 35 6.903 -11.611 2.260 280 HD3 LYS 35 HD1 LYS 35 8.444 -11.345 1.443 281 HE2 LYS 35 HE2 LYS 35 8.335 -13.620 2.222 282 HE3 LYS 35 HE1 LYS 35 9.551 -12.744 3.144 283 HZ1 LYS 35 HZ1 LYS 35 7.879 -12.470 4.921 284 HZ2 LYS 35 HZ2 LYS 35 8.267 -14.086 4.621 285 HZ3 LYS 35 HZ3 LYS 35 6.813 -13.447 4.042 286 HA PRO 36 HA PRO 36 5.716 -6.967 7.168 287 HB2 PRO 36 HB2 PRO 36 4.550 -4.526 6.770 288 HB3 PRO 36 HB1 PRO 36 6.184 -4.727 7.431 289 HG2 PRO 36 HG2 PRO 36 5.343 -4.049 4.660 290 HG3 PRO 36 HG1 PRO 36 6.683 -3.399 5.625 291 HD2 PRO 36 HD2 PRO 36 7.063 -5.251 3.708 292 HD3 PRO 36 HD1 PRO 36 8.061 -5.175 5.170 293 H ILE 37 HN ILE 37 3.549 -7.205 7.673 294 HA ILE 37 HA ILE 37 1.872 -7.929 5.417 295 HB ILE 37 HB ILE 37 2.141 -9.477 7.335 296 HG12 ILE 37 HG12 ILE 37 -0.004 -9.143 5.807 297 HG13 ILE 37 HG11 ILE 37 0.031 -10.328 7.110 298 HG21 ILE 37 HG21 ILE 37 2.239 -7.733 9.090 299 HG22 ILE 37 HG22 ILE 37 1.130 -9.048 9.464 300 HG23 ILE 37 HG23 ILE 37 0.502 -7.498 8.905 301 HD11 ILE 37 HD11 ILE 37 -2.046 -8.923 6.920 302 HD12 ILE 37 HD12 ILE 37 -1.074 -7.557 7.460 303 HD13 ILE 37 HD13 ILE 37 -1.285 -8.958 8.510 304 H VAL 38 HN VAL 38 -0.096 -6.988 4.943 305 HA VAL 38 HA VAL 38 -0.442 -4.300 6.067 306 HB VAL 38 HB VAL 38 -1.795 -5.537 3.657 307 HG11 VAL 38 HG11 VAL 38 -1.904 -2.832 4.935 308 HG12 VAL 38 HG12 VAL 38 -3.207 -3.818 4.263 309 HG13 VAL 38 HG13 VAL 38 -2.091 -2.979 3.188 310 HG21 VAL 38 HG21 VAL 38 0.568 -3.661 3.815 311 HG22 VAL 38 HG22 VAL 38 -0.263 -4.131 2.329 312 HG23 VAL 38 HG23 VAL 38 0.595 -5.342 3.282 313 H GLU 39 HN GLU 39 -1.636 -4.364 7.877 314 HA GLU 39 HA GLU 39 -3.915 -6.170 8.070 315 HB2 GLU 39 HB2 GLU 39 -2.262 -4.626 9.941 316 HB3 GLU 39 HB1 GLU 39 -3.978 -4.581 10.316 317 HG2 GLU 39 HG2 GLU 39 -4.110 -6.855 10.662 318 HG3 GLU 39 HG1 GLU 39 -2.648 -7.178 9.740 319 H ILE 40 HN ILE 40 -5.862 -5.583 7.418 320 HA ILE 40 HA ILE 40 -6.554 -2.731 7.514 321 HB ILE 40 HB ILE 40 -5.997 -3.197 5.212 322 HG12 ILE 40 HG12 ILE 40 -8.152 -1.852 5.913 323 HG13 ILE 40 HG11 ILE 40 -7.818 -2.189 4.220 324 HG21 ILE 40 HG21 ILE 40 -6.222 -5.555 5.098 325 HG22 ILE 40 HG22 ILE 40 -7.294 -4.848 3.888 326 HG23 ILE 40 HG23 ILE 40 -7.957 -5.464 5.401 327 HD11 ILE 40 HD11 ILE 40 -9.404 -4.021 4.238 328 HD12 ILE 40 HD12 ILE 40 -10.175 -2.546 4.815 329 HD13 ILE 40 HD13 ILE 40 -9.683 -3.788 5.962 330 H GLN 41 HN GLN 41 -8.430 -2.295 8.434 331 HA GLN 41 HA GLN 41 -10.348 -4.500 8.813 332 HB2 GLN 41 HB2 GLN 41 -11.001 -3.451 10.950 333 HB3 GLN 41 HB1 GLN 41 -9.303 -3.912 10.944 334 HG2 GLN 41 HG2 GLN 41 -8.640 -1.633 10.570 335 HG3 GLN 41 HG1 GLN 41 -10.323 -1.132 10.428 336 HE21 GLN 41 HE21 GLN 41 -7.815 -2.187 12.585 337 HE22 GLN 41 HE22 GLN 41 -8.600 -1.714 14.052 338 H GLN 42 HN GLN 42 -12.517 -4.016 8.422 339 HA GLN 42 HA GLN 42 -13.013 -1.301 7.412 340 HB2 GLN 42 HB2 GLN 42 -13.173 -2.206 5.369 341 HB3 GLN 42 HB1 GLN 42 -13.216 -3.838 6.006 342 HG2 GLN 42 HG2 GLN 42 -15.571 -3.727 6.337 343 HG3 GLN 42 HG1 GLN 42 -15.596 -2.008 5.937 344 HE21 GLN 42 HE21 GLN 42 -16.912 -2.104 4.195 345 HE22 GLN 42 HE22 GLN 42 -16.501 -2.918 2.730 346 H LYS 43 HN LYS 43 -15.104 -0.511 7.589 347 HA LYS 43 HA LYS 43 -17.054 -2.005 9.156 348 HB2 LYS 43 HB2 LYS 43 -15.638 -0.749 10.802 349 HB3 LYS 43 HB1 LYS 43 -16.109 0.745 10.002 350 HG2 LYS 43 HG2 LYS 43 -18.290 0.624 10.767 351 HG3 LYS 43 HG1 LYS 43 -18.200 -1.114 11.043 352 HD2 LYS 43 HD2 LYS 43 -16.755 -0.781 12.954 353 HD3 LYS 43 HD1 LYS 43 -16.704 0.954 12.643 354 HE2 LYS 43 HE2 LYS 43 -19.241 -0.550 13.218 355 HE3 LYS 43 HE1 LYS 43 -18.265 0.223 14.467 356 HZ1 LYS 43 HZ1 LYS 43 -19.537 1.593 12.157 357 HZ2 LYS 43 HZ2 LYS 43 -18.558 2.337 13.312 358 HZ3 LYS 43 HZ3 LYS 43 -20.042 1.678 13.769 359 H GLY 44 HN GLY 44 -18.305 -2.022 7.316 360 HA2 GLY 44 HA2 GLY 44 -20.045 -1.180 6.039 361 HA3 GLY 44 HA1 GLY 44 -19.814 0.379 6.820 362 H ASP 45 HN ASP 45 -18.638 1.923 5.827 363 HA ASP 45 HA ASP 45 -17.426 1.219 3.233 364 HB2 ASP 45 HB2 ASP 45 -18.923 3.694 4.093 365 HB3 ASP 45 HB1 ASP 45 -17.876 3.682 2.679 366 H ASP 46 HN ASP 46 -16.819 2.156 6.348 367 HA ASP 46 HA ASP 46 -14.574 3.915 5.716 368 HB2 ASP 46 HB2 ASP 46 -15.842 3.059 8.317 369 HB3 ASP 46 HB1 ASP 46 -14.333 3.964 8.252 370 H PHE 47 HN PHE 47 -12.523 3.271 5.621 371 HA PHE 47 HA PHE 47 -11.888 0.545 6.567 372 HB2 PHE 47 HB2 PHE 47 -10.837 2.072 4.187 373 HB3 PHE 47 HB1 PHE 47 -10.034 0.647 4.823 374 HD1 PHE 47 HD2 PHE 47 -13.587 1.512 4.099 375 HD2 PHE 47 HD1 PHE 47 -10.338 -1.150 3.469 376 HE1 PHE 47 HE2 PHE 47 -15.030 0.079 2.707 377 HE2 PHE 47 HE1 PHE 47 -11.770 -2.582 2.078 378 HZ PHE 47 HZ PHE 47 -14.122 -1.970 1.696 379 H VAL 48 HN VAL 48 -9.919 0.200 7.546 380 HA VAL 48 HA VAL 48 -8.286 2.539 8.211 381 HB VAL 48 HB VAL 48 -9.282 0.474 10.187 382 HG11 VAL 48 HG11 VAL 48 -7.969 1.597 11.861 383 HG12 VAL 48 HG12 VAL 48 -7.428 2.792 10.682 384 HG13 VAL 48 HG13 VAL 48 -6.911 1.113 10.533 385 HG21 VAL 48 HG21 VAL 48 -10.918 2.208 9.673 386 HG22 VAL 48 HG22 VAL 48 -9.728 3.451 10.057 387 HG23 VAL 48 HG23 VAL 48 -10.316 2.371 11.323 388 H VAL 49 HN VAL 49 -6.484 2.047 7.150 389 HA VAL 49 HA VAL 49 -5.508 -0.722 7.146 390 HB VAL 49 HB VAL 49 -4.498 1.621 5.536 391 HG11 VAL 49 HG11 VAL 49 -2.812 -0.063 5.782 392 HG12 VAL 49 HG12 VAL 49 -3.466 -0.148 4.147 393 HG13 VAL 49 HG13 VAL 49 -3.955 -1.337 5.354 394 HG21 VAL 49 HG21 VAL 49 -5.701 0.575 3.649 395 HG22 VAL 49 HG22 VAL 49 -6.785 1.139 4.919 396 HG23 VAL 49 HG23 VAL 49 -6.414 -0.579 4.776 397 H THR 50 HN THR 50 -3.910 -1.316 8.393 398 HA THR 50 HA THR 50 -2.262 0.745 9.699 399 HB THR 50 HB THR 50 -3.022 -2.046 10.592 400 HG1 THR 50 HG1 THR 50 -3.666 0.579 11.507 401 HG21 THR 50 HG21 THR 50 -1.141 -0.058 11.881 402 HG22 THR 50 HG22 THR 50 -0.739 -1.658 11.257 403 HG23 THR 50 HG23 THR 50 -1.774 -1.503 12.676 404 H SER 51 HN SER 51 -0.217 0.858 9.026 405 HA SER 51 HA SER 51 0.933 -1.455 7.626 406 HB2 SER 51 HB2 SER 51 2.015 1.363 7.660 407 HB3 SER 51 HB1 SER 51 2.390 0.071 6.519 408 HG SER 51 HG SER 51 -0.248 0.472 6.535 409 H LYS 52 HN LYS 52 2.466 -2.621 8.590 410 HA LYS 52 HA LYS 52 3.557 -1.696 11.127 411 HB2 LYS 52 HB2 LYS 52 3.140 -4.337 9.856 412 HB3 LYS 52 HB1 LYS 52 4.542 -4.187 10.904 413 HG2 LYS 52 HG2 LYS 52 2.957 -4.911 12.386 414 HG3 LYS 52 HG1 LYS 52 2.821 -3.162 12.582 415 HD2 LYS 52 HD2 LYS 52 0.919 -3.121 11.064 416 HD3 LYS 52 HD1 LYS 52 1.073 -4.863 10.807 417 HE2 LYS 52 HE2 LYS 52 0.620 -3.620 13.513 418 HE3 LYS 52 HE1 LYS 52 -0.690 -4.155 12.462 419 HZ1 LYS 52 HZ1 LYS 52 0.102 -5.773 14.207 420 HZ2 LYS 52 HZ2 LYS 52 1.501 -5.970 13.277 421 HZ3 LYS 52 HZ3 LYS 52 -0.015 -6.376 12.626 422 H THR 53 HN THR 53 5.547 -0.929 11.318 423 HA THR 53 HA THR 53 7.596 -1.760 9.421 424 HB THR 53 HB THR 53 8.268 0.362 8.759 425 HG1 THR 53 HG1 THR 53 6.601 1.825 10.470 426 HG21 THR 53 HG21 THR 53 6.076 -0.195 7.781 427 HG22 THR 53 HG22 THR 53 6.331 1.545 7.931 428 HG23 THR 53 HG23 THR 53 5.289 0.702 9.083 429 HA PRO 54 HA PRO 54 10.217 -2.019 12.958 430 HB2 PRO 54 HB2 PRO 54 12.317 -0.913 11.149 431 HB3 PRO 54 HB1 PRO 54 12.312 -2.421 12.088 432 HG2 PRO 54 HG2 PRO 54 11.977 -2.505 9.492 433 HG3 PRO 54 HG1 PRO 54 10.993 -3.535 10.552 434 HD2 PRO 54 HD2 PRO 54 10.227 -0.978 9.187 435 HD3 PRO 54 HD1 PRO 54 9.306 -2.485 9.375 436 H ARG 55 HN ARG 55 9.469 0.973 11.506 437 HA ARG 55 HA ARG 55 11.032 2.408 13.541 438 HB2 ARG 55 HB2 ARG 55 10.776 4.428 12.137 439 HB3 ARG 55 HB1 ARG 55 11.643 3.135 11.332 440 HG2 ARG 55 HG2 ARG 55 9.656 2.573 10.055 441 HG3 ARG 55 HG1 ARG 55 8.751 3.834 10.891 442 HD2 ARG 55 HD2 ARG 55 11.275 4.565 9.477 443 HD3 ARG 55 HD1 ARG 55 9.825 4.262 8.522 444 HE ARG 55 HE ARG 55 9.332 6.076 10.677 445 HH11 ARG 55 HH11 ARG 55 10.671 5.885 7.441 446 HH12 ARG 55 HH12 ARG 55 10.351 7.548 7.077 447 HH21 ARG 55 HH21 ARG 55 8.945 8.276 10.195 448 HH22 ARG 55 HH22 ARG 55 9.384 8.908 8.639 449 H GLN 56 HN GLN 56 7.816 2.285 12.025 450 HA GLN 56 HA GLN 56 6.496 2.898 14.462 451 HB2 GLN 56 HB2 GLN 56 7.496 5.138 13.712 452 HB3 GLN 56 HB1 GLN 56 6.327 5.087 12.402 453 HG2 GLN 56 HG2 GLN 56 4.500 5.172 13.924 454 HG3 GLN 56 HG1 GLN 56 5.569 4.933 15.306 455 HE21 GLN 56 HE21 GLN 56 3.681 7.111 14.636 456 HE22 GLN 56 HE22 GLN 56 4.622 8.558 14.709 457 H THR 57 HN THR 57 4.349 2.410 14.331 458 HA THR 57 HA THR 57 3.440 1.291 11.805 459 HB THR 57 HB THR 57 1.389 0.917 13.591 460 HG1 THR 57 HG1 THR 57 2.312 1.616 15.420 461 HG21 THR 57 HG21 THR 57 3.826 -0.774 13.071 462 HG22 THR 57 HG22 THR 57 2.253 -0.863 12.277 463 HG23 THR 57 HG23 THR 57 2.416 -1.350 13.963 464 H VAL 58 HN VAL 58 2.402 2.628 10.422 465 HA VAL 58 HA VAL 58 0.947 4.915 11.539 466 HB VAL 58 HB VAL 58 0.862 5.843 9.303 467 HG11 VAL 58 HG11 VAL 58 2.880 6.126 10.781 468 HG12 VAL 58 HG12 VAL 58 3.143 6.413 9.063 469 HG13 VAL 58 HG13 VAL 58 3.676 4.899 9.796 470 HG21 VAL 58 HG21 VAL 58 2.334 3.363 8.417 471 HG22 VAL 58 HG22 VAL 58 1.964 4.764 7.415 472 HG23 VAL 58 HG23 VAL 58 0.659 3.760 8.042 473 H THR 59 HN THR 59 -1.152 5.467 10.725 474 HA THR 59 HA THR 59 -2.677 3.159 9.741 475 HB THR 59 HB THR 59 -3.632 5.066 11.878 476 HG1 THR 59 HG1 THR 59 -2.438 3.810 13.098 477 HG21 THR 59 HG21 THR 59 -5.458 4.194 10.562 478 HG22 THR 59 HG22 THR 59 -5.455 3.412 12.143 479 HG23 THR 59 HG23 THR 59 -4.843 2.549 10.729 480 H ASN 60 HN ASN 60 -3.960 3.566 8.096 481 HA ASN 60 HA ASN 60 -4.459 6.385 7.344 482 HB2 ASN 60 HB2 ASN 60 -4.134 3.895 5.650 483 HB3 ASN 60 HB1 ASN 60 -4.703 5.434 5.016 484 HD21 ASN 60 HD21 ASN 60 -1.976 3.711 6.335 485 HD22 ASN 60 HD22 ASN 60 -0.775 4.849 5.834 486 H SER 61 HN SER 61 -6.605 6.973 7.164 487 HA SER 61 HA SER 61 -8.600 4.805 7.194 488 HB2 SER 61 HB2 SER 61 -9.914 6.751 8.548 489 HB3 SER 61 HB1 SER 61 -9.016 5.448 9.328 490 HG SER 61 HG SER 61 -7.376 7.504 8.668 491 H PHE 62 HN PHE 62 -10.473 5.138 6.020 492 HA PHE 62 HA PHE 62 -11.086 7.664 4.817 493 HB2 PHE 62 HB2 PHE 62 -10.799 6.811 2.452 494 HB3 PHE 62 HB1 PHE 62 -9.308 7.165 3.315 495 HD1 PHE 62 HD1 PHE 62 -11.502 4.460 2.120 496 HD2 PHE 62 HD2 PHE 62 -7.711 5.478 3.764 497 HE1 PHE 62 HE1 PHE 62 -10.680 2.200 1.614 498 HE2 PHE 62 HE2 PHE 62 -6.881 3.225 3.256 499 HZ PHE 62 HZ PHE 62 -8.363 1.576 2.179 500 H THR 63 HN THR 63 -12.951 7.486 3.314 501 HA THR 63 HA THR 63 -14.614 5.149 3.955 502 HB THR 63 HB THR 63 -15.701 7.882 3.299 503 HG1 THR 63 HG1 THR 63 -15.253 6.830 5.934 504 HG21 THR 63 HG21 THR 63 -17.697 7.031 4.457 505 HG22 THR 63 HG22 THR 63 -16.867 5.503 4.747 506 HG23 THR 63 HG23 THR 63 -17.249 6.002 3.097 507 H LEU 64 HN LEU 64 -15.531 4.083 2.276 508 HA LEU 64 HA LEU 64 -14.537 4.332 -0.305 509 HB2 LEU 64 HB2 LEU 64 -17.094 3.053 0.656 510 HB3 LEU 64 HB1 LEU 64 -16.451 2.858 -0.962 511 HG LEU 64 HG LEU 64 -15.233 1.896 1.614 512 HD11 LEU 64 HD11 LEU 64 -16.358 0.519 -0.813 513 HD12 LEU 64 HD12 LEU 64 -16.953 0.442 0.843 514 HD13 LEU 64 HD13 LEU 64 -15.412 -0.304 0.424 515 HD21 LEU 64 HD21 LEU 64 -14.065 2.041 -1.152 516 HD22 LEU 64 HD22 LEU 64 -13.483 0.921 0.075 517 HD23 LEU 64 HD23 LEU 64 -13.389 2.657 0.357 518 H GLY 65 HN GLY 65 -14.855 5.813 -1.803 519 HA2 GLY 65 HA2 GLY 65 -16.188 7.002 -3.354 520 HA3 GLY 65 HA1 GLY 65 -17.559 6.844 -2.265 521 H LYS 66 HN LYS 66 -14.836 7.751 -0.558 522 HA LYS 66 HA LYS 66 -15.431 10.606 -0.891 523 HB2 LYS 66 HB2 LYS 66 -15.571 8.965 1.584 524 HB3 LYS 66 HB1 LYS 66 -14.919 10.591 1.724 525 HG2 LYS 66 HG2 LYS 66 -16.944 11.542 0.870 526 HG3 LYS 66 HG1 LYS 66 -17.590 9.946 0.496 527 HD2 LYS 66 HD2 LYS 66 -18.588 10.789 2.533 528 HD3 LYS 66 HD1 LYS 66 -17.573 9.392 2.890 529 HE2 LYS 66 HE2 LYS 66 -17.268 11.160 4.550 530 HE3 LYS 66 HE1 LYS 66 -15.784 10.874 3.645 531 HZ1 LYS 66 HZ1 LYS 66 -16.242 12.815 2.319 532 HZ2 LYS 66 HZ2 LYS 66 -16.242 13.235 3.956 533 HZ3 LYS 66 HZ3 LYS 66 -17.705 13.075 3.122 534 H GLU 67 HN GLU 67 -13.744 11.961 -0.774 535 HA GLU 67 HA GLU 67 -11.093 10.847 -0.930 536 HB2 GLU 67 HB2 GLU 67 -11.980 12.803 -2.299 537 HB3 GLU 67 HB1 GLU 67 -11.888 13.762 -0.833 538 HG2 GLU 67 HG2 GLU 67 -9.490 13.458 -0.745 539 HG3 GLU 67 HG1 GLU 67 -9.554 12.396 -2.150 540 H ALA 68 HN ALA 68 -9.808 10.501 0.816 541 HA ALA 68 HA ALA 68 -10.311 12.166 3.193 542 HB1 ALA 68 HB1 ALA 68 -11.314 10.014 3.597 543 HB2 ALA 68 HB2 ALA 68 -9.883 10.195 4.610 544 HB3 ALA 68 HB3 ALA 68 -9.817 9.195 3.159 545 H ASP 69 HN ASP 69 -8.594 12.796 4.363 546 HA ASP 69 HA ASP 69 -6.039 12.722 3.072 547 HB2 ASP 69 HB2 ASP 69 -5.306 14.161 4.950 548 HB3 ASP 69 HB1 ASP 69 -6.779 14.761 4.199 549 H ILE 70 HN ILE 70 -4.396 11.413 3.473 550 HA ILE 70 HA ILE 70 -4.444 9.765 5.901 551 HB ILE 70 HB ILE 70 -3.484 7.888 4.444 552 HG12 ILE 70 HG12 ILE 70 -4.627 8.038 2.095 553 HG13 ILE 70 HG11 ILE 70 -4.499 9.776 2.348 554 HG21 ILE 70 HG21 ILE 70 -5.835 7.251 3.664 555 HG22 ILE 70 HG22 ILE 70 -6.344 8.775 4.398 556 HG23 ILE 70 HG23 ILE 70 -5.583 7.528 5.390 557 HD11 ILE 70 HD11 ILE 70 -2.107 9.612 2.535 558 HD12 ILE 70 HD12 ILE 70 -2.631 8.817 1.048 559 HD13 ILE 70 HD13 ILE 70 -2.184 7.851 2.457 560 H THR 71 HN THR 71 -2.198 8.647 6.167 561 HA THR 71 HA THR 71 -0.143 10.579 5.298 562 HB THR 71 HB THR 71 -0.132 9.304 8.021 563 HG1 THR 71 HG1 THR 71 -1.980 10.626 7.881 564 HG21 THR 71 HG21 THR 71 2.014 10.185 7.077 565 HG22 THR 71 HG22 THR 71 1.494 11.019 8.543 566 HG23 THR 71 HG23 THR 71 1.258 11.777 6.967 567 H THR 72 HN THR 72 1.694 9.777 4.517 568 HA THR 72 HA THR 72 1.985 6.885 4.385 569 HB THR 72 HB THR 72 2.261 8.220 2.309 570 HG1 THR 72 HG1 THR 72 4.791 7.357 2.289 571 HG21 THR 72 HG21 THR 72 4.683 9.340 3.712 572 HG22 THR 72 HG22 THR 72 3.239 10.228 3.233 573 HG23 THR 72 HG23 THR 72 4.308 9.554 2.004 574 H MET 73 HN MET 73 4.327 6.089 4.565 575 HA MET 73 HA MET 73 5.200 6.464 7.226 576 HB2 MET 73 HB2 MET 73 5.655 4.622 5.202 577 HB3 MET 73 HB1 MET 73 7.225 5.378 5.431 578 HG2 MET 73 HG2 MET 73 7.177 3.499 6.829 579 HG3 MET 73 HG1 MET 73 6.971 4.897 7.886 580 HE1 MET 73 HE1 MET 73 3.989 3.347 5.586 581 HE2 MET 73 HE2 MET 73 3.670 1.953 6.623 582 HE3 MET 73 HE3 MET 73 5.253 2.148 5.870 583 H ASP 74 HN ASP 74 6.072 7.914 4.220 584 HA ASP 74 HA ASP 74 8.575 8.989 5.023 585 HB2 ASP 74 HB2 ASP 74 6.870 10.078 2.803 586 HB3 ASP 74 HB1 ASP 74 8.623 9.993 2.894 587 H GLY 75 HN GLY 75 5.501 9.797 5.987 588 HA2 GLY 75 HA2 GLY 75 4.858 11.522 7.404 589 HA3 GLY 75 HA1 GLY 75 6.441 12.253 7.171 590 H LYS 76 HN LYS 76 4.656 11.403 4.372 591 HA LYS 76 HA LYS 76 4.267 14.242 3.791 592 HB2 LYS 76 HB2 LYS 76 4.330 11.779 2.047 593 HB3 LYS 76 HB1 LYS 76 3.804 13.344 1.446 594 HG2 LYS 76 HG2 LYS 76 6.490 12.940 2.721 595 HG3 LYS 76 HG1 LYS 76 6.207 12.679 0.997 596 HD2 LYS 76 HD2 LYS 76 5.456 14.987 0.755 597 HD3 LYS 76 HD1 LYS 76 5.667 15.254 2.488 598 HE2 LYS 76 HE2 LYS 76 7.553 16.175 1.302 599 HE3 LYS 76 HE1 LYS 76 8.075 14.773 2.228 600 HZ1 LYS 76 HZ1 LYS 76 7.557 14.866 -0.692 601 HZ2 LYS 76 HZ2 LYS 76 7.935 13.459 0.165 602 HZ3 LYS 76 HZ3 LYS 76 9.062 14.713 0.063 603 H LYS 77 HN LYS 77 2.291 15.119 3.658 604 HA LYS 77 HA LYS 77 0.017 13.476 4.363 605 HB2 LYS 77 HB2 LYS 77 0.430 16.435 4.005 606 HB3 LYS 77 HB1 LYS 77 -1.184 15.753 4.164 607 HG2 LYS 77 HG2 LYS 77 1.046 15.519 6.174 608 HG3 LYS 77 HG1 LYS 77 -0.368 16.567 6.296 609 HD2 LYS 77 HD2 LYS 77 -1.789 14.494 6.178 610 HD3 LYS 77 HD1 LYS 77 -0.302 13.555 6.317 611 HE2 LYS 77 HE2 LYS 77 0.174 14.509 8.463 612 HE3 LYS 77 HE1 LYS 77 -1.182 15.627 8.312 613 HZ1 LYS 77 HZ1 LYS 77 -1.637 13.671 9.740 614 HZ2 LYS 77 HZ2 LYS 77 -1.472 12.670 8.382 615 HZ3 LYS 77 HZ3 LYS 77 -2.713 13.822 8.443 616 H LEU 78 HN LEU 78 -1.071 12.420 2.884 617 HA LEU 78 HA LEU 78 -1.441 13.663 0.238 618 HB2 LEU 78 HB2 LEU 78 -1.160 10.698 0.732 619 HB3 LEU 78 HB1 LEU 78 -1.277 11.501 -0.819 620 HG LEU 78 HG LEU 78 1.023 11.946 1.070 621 HD11 LEU 78 HD11 LEU 78 0.731 9.540 0.348 622 HD12 LEU 78 HD12 LEU 78 2.272 10.298 -0.047 623 HD13 LEU 78 HD13 LEU 78 1.043 10.099 -1.297 624 HD21 LEU 78 HD21 LEU 78 0.816 12.368 -1.909 625 HD22 LEU 78 HD22 LEU 78 2.144 12.843 -0.847 626 HD23 LEU 78 HD23 LEU 78 0.576 13.638 -0.708 627 H LYS 79 HN LYS 79 -3.385 12.997 -0.883 628 HA LYS 79 HA LYS 79 -5.464 11.993 0.934 629 HB2 LYS 79 HB2 LYS 79 -7.052 13.509 -0.366 630 HB3 LYS 79 HB1 LYS 79 -5.961 14.292 0.770 631 HG2 LYS 79 HG2 LYS 79 -4.770 15.323 -0.865 632 HG3 LYS 79 HG1 LYS 79 -5.052 14.036 -2.039 633 HD2 LYS 79 HD2 LYS 79 -7.488 14.819 -2.031 634 HD3 LYS 79 HD1 LYS 79 -6.889 16.266 -1.225 635 HE2 LYS 79 HE2 LYS 79 -5.723 16.980 -3.068 636 HE3 LYS 79 HE1 LYS 79 -5.542 15.351 -3.710 637 HZ1 LYS 79 HZ1 LYS 79 -7.835 17.170 -3.907 638 HZ2 LYS 79 HZ2 LYS 79 -8.097 15.499 -3.978 639 HZ3 LYS 79 HZ3 LYS 79 -7.086 16.251 -5.120 640 H CYS 80 HN CYS 80 -6.295 10.161 0.213 641 HA CYS 80 HA CYS 80 -6.169 9.663 -2.687 642 HB2 CYS 80 HB2 CYS 80 -4.817 8.204 -0.972 643 HB3 CYS 80 HB1 CYS 80 -6.377 7.439 -0.695 644 H THR 81 HN THR 81 -8.041 9.488 -3.713 645 HA THR 81 HA THR 81 -10.512 9.354 -2.199 646 HB THR 81 HB THR 81 -10.321 9.433 -5.198 647 HG1 THR 81 HG1 THR 81 -10.458 11.866 -4.664 648 HG21 THR 81 HG21 THR 81 -12.523 9.157 -4.110 649 HG22 THR 81 HG22 THR 81 -12.407 10.666 -5.018 650 HG23 THR 81 HG23 THR 81 -12.272 10.680 -3.258 651 H VAL 82 HN VAL 82 -10.531 7.246 -1.446 652 HA VAL 82 HA VAL 82 -10.222 5.049 -3.326 653 HB VAL 82 HB VAL 82 -11.095 4.469 -0.565 654 HG11 VAL 82 HG11 VAL 82 -10.505 2.734 -2.187 655 HG12 VAL 82 HG12 VAL 82 -9.430 2.712 -0.786 656 HG13 VAL 82 HG13 VAL 82 -8.877 3.405 -2.310 657 HG21 VAL 82 HG21 VAL 82 -9.641 6.298 -0.044 658 HG22 VAL 82 HG22 VAL 82 -8.414 5.706 -1.165 659 HG23 VAL 82 HG23 VAL 82 -8.778 4.800 0.303 660 H HIS 83 HN HIS 83 -11.764 3.640 -3.918 661 HA HIS 83 HA HIS 83 -14.409 3.692 -2.801 662 HB2 HIS 83 HB2 HIS 83 -15.535 4.118 -4.986 663 HB3 HIS 83 HB1 HIS 83 -14.722 5.531 -4.324 664 HD1 HIS 83 HD1 HIS 83 -15.002 3.530 -7.347 665 HD2 HIS 83 HD2 HIS 83 -12.177 6.078 -5.672 666 HE1 HIS 83 HE1 HIS 83 -13.453 4.138 -9.223 667 HE2 HIS 83 HE2 HIS 83 -11.892 5.849 -8.233 668 H LEU 84 HN LEU 84 -15.569 1.878 -3.271 669 HA LEU 84 HA LEU 84 -14.035 -0.267 -4.461 670 HB2 LEU 84 HB2 LEU 84 -15.368 -0.467 -2.307 671 HB3 LEU 84 HB1 LEU 84 -16.816 -0.422 -3.300 672 HG LEU 84 HG LEU 84 -16.043 -2.699 -2.574 673 HD11 LEU 84 HD11 LEU 84 -17.559 -2.351 -4.480 674 HD12 LEU 84 HD12 LEU 84 -16.573 -3.807 -4.598 675 HD13 LEU 84 HD13 LEU 84 -16.152 -2.378 -5.539 676 HD21 LEU 84 HD21 LEU 84 -13.858 -2.258 -4.571 677 HD22 LEU 84 HD22 LEU 84 -14.204 -3.752 -3.702 678 HD23 LEU 84 HD23 LEU 84 -13.646 -2.329 -2.822 679 H ALA 85 HN ALA 85 -14.562 -1.301 -6.270 680 HA ALA 85 HA ALA 85 -16.919 -0.601 -7.802 681 HB1 ALA 85 HB1 ALA 85 -14.158 0.068 -8.816 682 HB2 ALA 85 HB2 ALA 85 -15.428 1.214 -8.399 683 HB3 ALA 85 HB3 ALA 85 -15.635 0.133 -9.778 684 H ASN 86 HN ASN 86 -17.643 -2.537 -8.333 685 HA ASN 86 HA ASN 86 -17.793 -4.665 -9.096 686 HB2 ASN 86 HB2 ASN 86 -15.338 -3.790 -10.614 687 HB3 ASN 86 HB1 ASN 86 -16.113 -5.350 -10.867 688 HD21 ASN 86 HD21 ASN 86 -16.169 -2.009 -11.528 689 HD22 ASN 86 HD22 ASN 86 -17.589 -1.990 -12.516 690 H GLY 87 HN GLY 87 -16.405 -4.213 -6.610 691 HA2 GLY 87 HA2 GLY 87 -15.544 -5.722 -5.061 692 HA3 GLY 87 HA1 GLY 87 -15.183 -6.826 -6.378 693 H LYS 88 HN LYS 88 -14.013 -3.818 -7.169 694 HA LYS 88 HA LYS 88 -11.336 -4.513 -6.141 695 HB2 LYS 88 HB2 LYS 88 -11.867 -2.870 -8.618 696 HB3 LYS 88 HB1 LYS 88 -10.357 -3.621 -8.121 697 HG2 LYS 88 HG2 LYS 88 -12.839 -5.077 -9.004 698 HG3 LYS 88 HG1 LYS 88 -11.399 -4.804 -9.984 699 HD2 LYS 88 HD2 LYS 88 -10.086 -6.218 -8.633 700 HD3 LYS 88 HD1 LYS 88 -11.287 -6.230 -7.343 701 HE2 LYS 88 HE2 LYS 88 -11.318 -8.339 -8.554 702 HE3 LYS 88 HE1 LYS 88 -12.832 -7.463 -8.780 703 HZ1 LYS 88 HZ1 LYS 88 -12.037 -6.720 -10.936 704 HZ2 LYS 88 HZ2 LYS 88 -12.025 -8.405 -10.852 705 HZ3 LYS 88 HZ3 LYS 88 -10.572 -7.546 -10.720 706 H LEU 89 HN LEU 89 -10.186 -2.963 -5.091 707 HA LEU 89 HA LEU 89 -11.631 -0.537 -4.411 708 HB2 LEU 89 HB2 LEU 89 -10.368 -2.125 -2.774 709 HB3 LEU 89 HB1 LEU 89 -8.933 -1.293 -3.337 710 HG LEU 89 HG LEU 89 -9.568 0.734 -2.375 711 HD11 LEU 89 HD11 LEU 89 -12.344 -0.416 -2.237 712 HD12 LEU 89 HD12 LEU 89 -11.792 0.975 -3.166 713 HD13 LEU 89 HD13 LEU 89 -11.869 1.063 -1.406 714 HD21 LEU 89 HD21 LEU 89 -10.601 -1.404 -0.517 715 HD22 LEU 89 HD22 LEU 89 -10.109 0.226 -0.056 716 HD23 LEU 89 HD23 LEU 89 -8.913 -0.907 -0.689 717 H VAL 90 HN VAL 90 -11.277 1.293 -5.442 718 HA VAL 90 HA VAL 90 -8.797 1.540 -7.011 719 HB VAL 90 HB VAL 90 -11.319 3.138 -7.420 720 HG11 VAL 90 HG11 VAL 90 -10.418 3.662 -9.558 721 HG12 VAL 90 HG12 VAL 90 -9.122 2.483 -9.373 722 HG13 VAL 90 HG13 VAL 90 -9.137 3.938 -8.376 723 HG21 VAL 90 HG21 VAL 90 -11.867 1.576 -9.261 724 HG22 VAL 90 HG22 VAL 90 -11.947 0.819 -7.672 725 HG23 VAL 90 HG23 VAL 90 -10.562 0.521 -8.723 726 H CYS 91 HN CYS 91 -7.359 2.942 -6.333 727 HA CYS 91 HA CYS 91 -8.250 5.304 -4.813 728 HB2 CYS 91 HB2 CYS 91 -6.795 3.275 -3.716 729 HB3 CYS 91 HB1 CYS 91 -5.513 4.327 -4.303 730 H LYS 92 HN LYS 92 -8.298 6.129 -7.058 731 HA LYS 92 HA LYS 92 -5.683 6.610 -8.211 732 HB2 LYS 92 HB2 LYS 92 -7.557 5.872 -9.668 733 HB3 LYS 92 HB1 LYS 92 -8.410 7.359 -9.278 734 HG2 LYS 92 HG2 LYS 92 -6.943 8.675 -10.500 735 HG3 LYS 92 HG1 LYS 92 -5.669 7.457 -10.471 736 HD2 LYS 92 HD2 LYS 92 -6.502 7.404 -12.667 737 HD3 LYS 92 HD1 LYS 92 -7.251 6.020 -11.870 738 HE2 LYS 92 HE2 LYS 92 -9.285 7.282 -11.530 739 HE3 LYS 92 HE1 LYS 92 -8.545 8.714 -12.242 740 HZ1 LYS 92 HZ1 LYS 92 -8.369 7.527 -14.332 741 HZ2 LYS 92 HZ2 LYS 92 -9.977 7.570 -13.813 742 HZ3 LYS 92 HZ3 LYS 92 -9.070 6.154 -13.646 743 H SER 93 HN SER 93 -4.784 8.570 -8.504 744 HA SER 93 HA SER 93 -5.933 10.769 -6.937 745 HB2 SER 93 HB2 SER 93 -3.048 10.422 -7.778 746 HB3 SER 93 HB1 SER 93 -3.692 11.505 -6.548 747 HG SER 93 HG SER 93 -4.412 8.999 -5.966 748 H GLU 94 HN GLU 94 -4.562 12.892 -7.957 749 HA GLU 94 HA GLU 94 -5.852 13.213 -10.517 750 HB2 GLU 94 HB2 GLU 94 -4.172 15.096 -8.861 751 HB3 GLU 94 HB1 GLU 94 -5.051 15.546 -10.320 752 HG2 GLU 94 HG2 GLU 94 -7.103 15.383 -9.302 753 HG3 GLU 94 HG1 GLU 94 -6.521 14.277 -8.056 754 H LYS 95 HN LYS 95 -2.712 12.420 -9.391 755 HA LYS 95 HA LYS 95 -1.641 12.753 -12.119 756 HB2 LYS 95 HB2 LYS 95 -0.769 14.294 -10.211 757 HB3 LYS 95 HB1 LYS 95 0.102 12.861 -9.680 758 HG2 LYS 95 HG2 LYS 95 1.257 12.730 -11.788 759 HG3 LYS 95 HG1 LYS 95 0.327 14.086 -12.422 760 HD2 LYS 95 HD2 LYS 95 1.265 15.432 -10.473 761 HD3 LYS 95 HD1 LYS 95 2.395 14.096 -10.237 762 HE2 LYS 95 HE2 LYS 95 2.070 15.609 -12.829 763 HE3 LYS 95 HE1 LYS 95 3.292 15.978 -11.614 764 HZ1 LYS 95 HZ1 LYS 95 4.217 14.600 -13.332 765 HZ2 LYS 95 HZ2 LYS 95 3.019 13.430 -13.110 766 HZ3 LYS 95 HZ3 LYS 95 4.154 13.720 -11.892 767 H PHE 96 HN PHE 96 -2.134 10.659 -9.436 768 HA PHE 96 HA PHE 96 -0.588 8.545 -10.783 769 HB2 PHE 96 HB2 PHE 96 -0.848 8.688 -7.785 770 HB3 PHE 96 HB1 PHE 96 0.257 7.708 -8.740 771 HD1 PHE 96 HD2 PHE 96 -0.413 11.041 -7.394 772 HD2 PHE 96 HD1 PHE 96 2.305 8.638 -9.617 773 HE1 PHE 96 HE2 PHE 96 1.312 12.766 -7.135 774 HE2 PHE 96 HE1 PHE 96 4.039 10.357 -9.358 775 HZ PHE 96 HZ PHE 96 3.547 12.431 -8.121 776 H SER 97 HN SER 97 -1.237 6.333 -9.595 777 HA SER 97 HA SER 97 -3.985 6.218 -8.794 778 HB2 SER 97 HB2 SER 97 -4.168 6.360 -11.257 779 HB3 SER 97 HB1 SER 97 -3.179 4.907 -11.396 780 HG SER 97 HG SER 97 -5.221 4.167 -11.451 781 H HIS 98 HN HIS 98 -4.269 4.593 -7.427 782 HA HIS 98 HA HIS 98 -2.239 2.462 -7.332 783 HB2 HIS 98 HB2 HIS 98 -2.425 3.926 -5.321 784 HB3 HIS 98 HB1 HIS 98 -4.097 3.427 -5.145 785 HD2 HIS 98 HD2 HIS 98 -3.701 0.182 -5.394 786 HE1 HIS 98 HE1 HIS 98 -0.967 0.751 -2.217 787 HE2 HIS 98 HE2 HIS 98 -2.267 -0.961 -3.543 788 H GLU 99 HN GLU 99 -2.896 0.536 -7.992 789 HA GLU 99 HA GLU 99 -5.786 0.013 -8.140 790 HB2 GLU 99 HB2 GLU 99 -4.927 -0.216 -10.289 791 HB3 GLU 99 HB1 GLU 99 -3.423 -0.922 -9.714 792 HG2 GLU 99 HG2 GLU 99 -4.636 -2.967 -9.111 793 HG3 GLU 99 HG1 GLU 99 -6.118 -2.261 -9.755 794 H GLN 100 HN GLN 100 -6.694 -1.544 -6.944 795 HA GLN 100 HA GLN 100 -4.989 -3.636 -5.790 796 HB2 GLN 100 HB2 GLN 100 -6.897 -1.821 -4.353 797 HB3 GLN 100 HB1 GLN 100 -6.627 -3.453 -3.760 798 HG2 GLN 100 HG2 GLN 100 -4.129 -2.837 -3.862 799 HG3 GLN 100 HG1 GLN 100 -4.708 -1.175 -3.937 800 HE21 GLN 100 HE21 GLN 100 -3.155 -2.537 -1.868 801 HE22 GLN 100 HE22 GLN 100 -4.090 -2.394 -0.415 802 H GLU 101 HN GLU 101 -5.664 -5.462 -6.695 803 HA GLU 101 HA GLU 101 -8.559 -5.845 -7.088 804 HB2 GLU 101 HB2 GLU 101 -7.554 -5.755 -9.233 805 HB3 GLU 101 HB1 GLU 101 -6.199 -6.754 -8.725 806 HG2 GLU 101 HG2 GLU 101 -7.472 -8.703 -8.773 807 HG3 GLU 101 HG1 GLU 101 -8.997 -7.822 -8.777 808 H VAL 102 HN VAL 102 -9.462 -7.355 -5.884 809 HA VAL 102 HA VAL 102 -7.771 -9.390 -4.618 810 HB VAL 102 HB VAL 102 -10.557 -8.446 -3.918 811 HG11 VAL 102 HG11 VAL 102 -8.891 -10.514 -2.493 812 HG12 VAL 102 HG12 VAL 102 -10.267 -10.877 -3.534 813 HG13 VAL 102 HG13 VAL 102 -10.505 -9.959 -2.045 814 HG21 VAL 102 HG21 VAL 102 -8.066 -8.306 -2.246 815 HG22 VAL 102 HG22 VAL 102 -9.597 -7.469 -1.999 816 HG23 VAL 102 HG23 VAL 102 -8.548 -7.012 -3.338 817 H LYS 103 HN LYS 103 -7.855 -11.425 -5.253 818 HA LYS 103 HA LYS 103 -10.138 -12.299 -6.891 819 HB2 LYS 103 HB2 LYS 103 -7.208 -12.992 -7.168 820 HB3 LYS 103 HB1 LYS 103 -8.493 -13.837 -8.008 821 HG2 LYS 103 HG2 LYS 103 -9.139 -11.788 -9.139 822 HG3 LYS 103 HG1 LYS 103 -7.866 -10.913 -8.285 823 HD2 LYS 103 HD2 LYS 103 -6.162 -12.096 -9.412 824 HD3 LYS 103 HD1 LYS 103 -7.294 -13.306 -10.017 825 HE2 LYS 103 HE2 LYS 103 -8.373 -11.562 -11.384 826 HE3 LYS 103 HE1 LYS 103 -7.173 -10.403 -10.824 827 HZ1 LYS 103 HZ1 LYS 103 -6.656 -12.844 -12.432 828 HZ2 LYS 103 HZ2 LYS 103 -5.449 -11.845 -11.805 829 HZ3 LYS 103 HZ3 LYS 103 -6.528 -11.245 -12.960 830 H GLY 104 HN GLY 104 -10.901 -12.852 -4.638 831 HA2 GLY 104 HA2 GLY 104 -11.580 -14.711 -3.407 832 HA3 GLY 104 HA1 GLY 104 -10.294 -15.647 -4.153 833 H ASN 105 HN ASN 105 -8.476 -16.013 -3.027 834 HA ASN 105 HA ASN 105 -8.274 -14.731 -0.393 835 HB2 ASN 105 HB2 ASN 105 -7.312 -17.353 -1.490 836 HB3 ASN 105 HB1 ASN 105 -6.537 -16.656 -0.071 837 HD21 ASN 105 HD21 ASN 105 -7.906 -19.101 -0.061 838 HD22 ASN 105 HD22 ASN 105 -9.299 -18.939 0.952 839 H GLU 106 HN GLU 106 -7.144 -14.054 -3.311 840 HA GLU 106 HA GLU 106 -4.530 -13.206 -2.256 841 HB2 GLU 106 HB2 GLU 106 -5.191 -14.415 -4.922 842 HB3 GLU 106 HB1 GLU 106 -3.791 -13.364 -4.737 843 HG2 GLU 106 HG2 GLU 106 -2.928 -14.861 -2.990 844 HG3 GLU 106 HG1 GLU 106 -4.317 -15.919 -3.230 845 H MET 107 HN MET 107 -3.777 -11.185 -2.877 846 HA MET 107 HA MET 107 -5.657 -9.507 -4.390 847 HB2 MET 107 HB2 MET 107 -5.992 -9.044 -2.010 848 HB3 MET 107 HB1 MET 107 -4.271 -8.764 -1.804 849 HG2 MET 107 HG2 MET 107 -4.362 -6.799 -3.173 850 HG3 MET 107 HG1 MET 107 -6.042 -7.119 -3.594 851 HE1 MET 107 HE1 MET 107 -3.949 -5.323 -0.253 852 HE2 MET 107 HE2 MET 107 -3.654 -6.976 -0.788 853 HE3 MET 107 HE3 MET 107 -4.661 -6.675 0.633 854 H VAL 108 HN VAL 108 -4.645 -8.804 -6.126 855 HA VAL 108 HA VAL 108 -1.733 -8.383 -6.035 856 HB VAL 108 HB VAL 108 -3.561 -8.666 -8.435 857 HG11 VAL 108 HG11 VAL 108 -0.552 -8.515 -8.271 858 HG12 VAL 108 HG12 VAL 108 -1.621 -7.264 -8.909 859 HG13 VAL 108 HG13 VAL 108 -1.489 -8.819 -9.734 860 HG21 VAL 108 HG21 VAL 108 -2.462 -10.839 -8.744 861 HG22 VAL 108 HG22 VAL 108 -3.345 -10.760 -7.221 862 HG23 VAL 108 HG23 VAL 108 -1.589 -10.605 -7.231 863 H GLU 109 HN GLU 109 -1.068 -6.335 -5.853 864 HA GLU 109 HA GLU 109 -2.890 -4.228 -6.797 865 HB2 GLU 109 HB2 GLU 109 -2.506 -2.966 -4.948 866 HB3 GLU 109 HB1 GLU 109 -2.228 -4.548 -4.233 867 HG2 GLU 109 HG2 GLU 109 0.212 -4.210 -4.662 868 HG3 GLU 109 HG1 GLU 109 -0.170 -2.559 -5.156 869 H THR 110 HN THR 110 -2.083 -2.540 -7.939 870 HA THR 110 HA THR 110 0.746 -2.656 -8.736 871 HB THR 110 HB THR 110 -1.333 -1.803 -10.719 872 HG1 THR 110 HG1 THR 110 -2.124 -3.755 -10.822 873 HG21 THR 110 HG21 THR 110 0.301 -2.397 -12.321 874 HG22 THR 110 HG22 THR 110 1.238 -3.307 -11.138 875 HG23 THR 110 HG23 THR 110 1.162 -1.550 -11.039 876 H ILE 111 HN ILE 111 1.583 -0.864 -7.861 877 HA ILE 111 HA ILE 111 -0.009 1.617 -7.948 878 HB ILE 111 HB ILE 111 2.429 1.418 -6.247 879 HG12 ILE 111 HG12 ILE 111 -0.209 0.324 -5.283 880 HG13 ILE 111 HG11 ILE 111 1.046 -0.715 -5.943 881 HG21 ILE 111 HG21 ILE 111 -0.281 2.687 -5.895 882 HG22 ILE 111 HG22 ILE 111 1.210 3.501 -6.371 883 HG23 ILE 111 HG23 ILE 111 1.059 2.814 -4.755 884 HD11 ILE 111 HD11 ILE 111 1.237 1.021 -3.500 885 HD12 ILE 111 HD12 ILE 111 2.589 0.124 -4.194 886 HD13 ILE 111 HD13 ILE 111 1.187 -0.741 -3.557 887 H THR 112 HN THR 112 1.195 3.612 -8.363 888 HA THR 112 HA THR 112 3.825 3.328 -9.574 889 HB THR 112 HB THR 112 1.577 4.645 -11.107 890 HG1 THR 112 HG1 THR 112 2.408 2.030 -10.989 891 HG21 THR 112 HG21 THR 112 4.363 3.919 -12.013 892 HG22 THR 112 HG22 THR 112 3.926 5.509 -11.391 893 HG23 THR 112 HG23 THR 112 3.173 4.902 -12.871 894 H PHE 113 HN PHE 113 4.942 4.737 -8.419 895 HA PHE 113 HA PHE 113 4.001 7.499 -8.287 896 HB2 PHE 113 HB2 PHE 113 4.427 5.711 -5.955 897 HB3 PHE 113 HB1 PHE 113 5.069 7.341 -5.821 898 HD1 PHE 113 HD1 PHE 113 2.002 5.350 -6.270 899 HD2 PHE 113 HD2 PHE 113 3.639 9.201 -5.493 900 HE1 PHE 113 HE1 PHE 113 -0.228 6.160 -5.609 901 HE2 PHE 113 HE2 PHE 113 1.405 10.018 -4.838 902 HZ PHE 113 HZ PHE 113 -0.524 8.496 -4.894 903 H GLY 114 HN GLY 114 5.685 9.010 -8.234 904 HA2 GLY 114 HA2 GLY 114 7.807 9.806 -8.588 905 HA3 GLY 114 HA1 GLY 114 8.378 8.401 -7.703 906 H GLY 115 HN GLY 115 6.453 7.922 -10.536 907 HA2 GLY 115 HA2 GLY 115 7.006 7.321 -12.696 908 HA3 GLY 115 HA1 GLY 115 8.673 7.759 -12.356 909 H VAL 116 HN VAL 116 7.376 5.619 -10.052 910 HA VAL 116 HA VAL 116 8.651 3.335 -11.420 911 HB VAL 116 HB VAL 116 8.415 3.549 -8.431 912 HG11 VAL 116 HG11 VAL 116 8.887 1.360 -9.399 913 HG12 VAL 116 HG12 VAL 116 10.262 1.963 -8.467 914 HG13 VAL 116 HG13 VAL 116 10.296 2.028 -10.232 915 HG21 VAL 116 HG21 VAL 116 10.944 4.295 -9.836 916 HG22 VAL 116 HG22 VAL 116 10.416 4.683 -8.200 917 HG23 VAL 116 HG23 VAL 116 9.689 5.507 -9.578 918 H THR 117 HN THR 117 7.399 1.646 -11.813 919 HA THR 117 HA THR 117 4.704 1.596 -10.697 920 HB THR 117 HB THR 117 5.792 -0.287 -12.788 921 HG1 THR 117 HG1 THR 117 5.840 1.343 -14.121 922 HG21 THR 117 HG21 THR 117 3.629 -0.803 -11.664 923 HG22 THR 117 HG22 THR 117 3.478 -0.551 -13.402 924 HG23 THR 117 HG23 THR 117 2.992 0.718 -12.280 925 H LEU 118 HN LEU 118 5.121 0.852 -8.607 926 HA LEU 118 HA LEU 118 6.608 -1.571 -8.196 927 HB2 LEU 118 HB2 LEU 118 6.704 0.141 -6.497 928 HB3 LEU 118 HB1 LEU 118 4.960 0.107 -6.301 929 HG LEU 118 HG LEU 118 5.016 -1.999 -5.220 930 HD11 LEU 118 HD11 LEU 118 7.847 -2.198 -6.206 931 HD12 LEU 118 HD12 LEU 118 6.484 -3.241 -6.604 932 HD13 LEU 118 HD13 LEU 118 7.169 -3.267 -4.979 933 HD21 LEU 118 HD21 LEU 118 7.504 -0.649 -4.216 934 HD22 LEU 118 HD22 LEU 118 6.338 -1.606 -3.301 935 HD23 LEU 118 HD23 LEU 118 5.884 -0.014 -3.916 936 H ILE 119 HN ILE 119 5.809 -3.420 -8.752 937 HA ILE 119 HA ILE 119 2.935 -3.917 -8.573 938 HB ILE 119 HB ILE 119 5.136 -5.489 -9.934 939 HG12 ILE 119 HG12 ILE 119 3.195 -3.398 -10.809 940 HG13 ILE 119 HG11 ILE 119 4.859 -3.660 -11.308 941 HG21 ILE 119 HG21 ILE 119 3.351 -6.963 -9.159 942 HG22 ILE 119 HG22 ILE 119 3.304 -6.823 -10.916 943 HG23 ILE 119 HG23 ILE 119 2.142 -5.938 -9.929 944 HD11 ILE 119 HD11 ILE 119 4.080 -5.641 -12.599 945 HD12 ILE 119 HD12 ILE 119 3.443 -4.096 -13.164 946 HD13 ILE 119 HD13 ILE 119 2.424 -5.172 -12.209 947 H ARG 120 HN ARG 120 2.332 -4.674 -6.631 948 HA ARG 120 HA ARG 120 4.099 -6.624 -5.308 949 HB2 ARG 120 HB2 ARG 120 2.054 -4.787 -4.058 950 HB3 ARG 120 HB1 ARG 120 3.047 -5.943 -3.187 951 HG2 ARG 120 HG2 ARG 120 5.012 -4.717 -3.589 952 HG3 ARG 120 HG1 ARG 120 4.227 -3.720 -4.814 953 HD2 ARG 120 HD2 ARG 120 4.137 -2.260 -3.069 954 HD3 ARG 120 HD1 ARG 120 2.637 -3.136 -2.770 955 HE ARG 120 HE ARG 120 5.143 -3.891 -1.412 956 HH11 ARG 120 HH11 ARG 120 1.741 -3.005 -1.308 957 HH12 ARG 120 HH12 ARG 120 1.645 -3.147 0.425 958 HH21 ARG 120 HH21 ARG 120 4.996 -4.082 0.861 959 HH22 ARG 120 HH22 ARG 120 3.483 -3.793 1.650 960 H ARG 121 HN ARG 121 3.337 -8.558 -4.728 961 HA ARG 121 HA ARG 121 0.533 -9.121 -5.363 962 HB2 ARG 121 HB2 ARG 121 3.051 -10.675 -5.678 963 HB3 ARG 121 HB1 ARG 121 1.576 -11.563 -5.312 964 HG2 ARG 121 HG2 ARG 121 0.832 -11.334 -7.377 965 HG3 ARG 121 HG1 ARG 121 1.143 -9.602 -7.363 966 HD2 ARG 121 HD2 ARG 121 3.290 -11.652 -7.784 967 HD3 ARG 121 HD1 ARG 121 2.390 -10.920 -9.110 968 HE ARG 121 HE ARG 121 3.378 -8.873 -7.500 969 HH11 ARG 121 HH11 ARG 121 4.552 -11.381 -9.640 970 HH12 ARG 121 HH12 ARG 121 6.004 -10.532 -10.065 971 HH21 ARG 121 HH21 ARG 121 5.281 -7.711 -8.090 972 HH22 ARG 121 HH22 ARG 121 6.414 -8.445 -9.182 973 H SER 122 HN SER 122 -0.731 -9.616 -3.721 974 HA SER 122 HA SER 122 0.571 -10.481 -1.236 975 HB2 SER 122 HB2 SER 122 -0.295 -8.177 -1.036 976 HB3 SER 122 HB1 SER 122 -1.902 -8.751 -1.467 977 HG SER 122 HG SER 122 -0.461 -9.812 0.709 978 H LYS 123 HN LYS 123 -0.509 -11.888 0.074 979 HA LYS 123 HA LYS 123 -2.813 -13.290 -1.067 980 HB2 LYS 123 HB2 LYS 123 -1.814 -15.419 -0.221 981 HB3 LYS 123 HB1 LYS 123 -0.913 -14.693 -1.542 982 HG2 LYS 123 HG2 LYS 123 0.872 -15.001 -0.264 983 HG3 LYS 123 HG1 LYS 123 0.304 -13.610 0.659 984 HD2 LYS 123 HD2 LYS 123 -0.875 -15.070 2.192 985 HD3 LYS 123 HD1 LYS 123 -0.426 -16.479 1.235 986 HE2 LYS 123 HE2 LYS 123 1.909 -16.127 1.748 987 HE3 LYS 123 HE1 LYS 123 1.519 -14.646 2.617 988 HZ1 LYS 123 HZ1 LYS 123 0.150 -16.047 4.146 989 HZ2 LYS 123 HZ2 LYS 123 1.814 -16.358 4.211 990 HZ3 LYS 123 HZ3 LYS 123 0.793 -17.415 3.378 991 H ARG 124 HN ARG 124 -4.308 -13.972 0.487 992 HA ARG 124 HA ARG 124 -4.315 -12.483 2.896 993 HB2 ARG 124 HB2 ARG 124 -6.179 -14.029 1.483 994 HB3 ARG 124 HB1 ARG 124 -5.977 -14.816 3.045 995 HG2 ARG 124 HG2 ARG 124 -6.535 -12.785 4.202 996 HG3 ARG 124 HG1 ARG 124 -6.651 -11.914 2.672 997 HD2 ARG 124 HD2 ARG 124 -8.841 -12.596 3.629 998 HD3 ARG 124 HD1 ARG 124 -8.554 -13.202 2.004 999 HE ARG 124 HE ARG 124 -7.706 -15.218 3.642 1000 HH11 ARG 124 HH11 ARG 124 -10.697 -13.447 3.248 1001 HH12 ARG 124 HH12 ARG 124 -11.694 -14.781 3.729 1002 HH21 ARG 124 HH21 ARG 124 -9.014 -16.974 4.269 1003 HH22 ARG 124 HH22 ARG 124 -10.743 -16.794 4.296 1004 H VAL 125 HN VAL 125 -4.204 -13.220 5.014 1005 HA VAL 125 HA VAL 125 -3.331 -14.316 6.758 1006 HB VAL 125 HB VAL 125 -3.501 -16.815 5.082 1007 HG11 VAL 125 HG11 VAL 125 -3.610 -16.480 8.074 1008 HG12 VAL 125 HG12 VAL 125 -2.178 -16.973 7.172 1009 HG13 VAL 125 HG13 VAL 125 -3.612 -17.997 7.173 1010 HG21 VAL 125 HG21 VAL 125 -5.731 -17.120 5.921 1011 HG22 VAL 125 HG22 VAL 125 -5.634 -15.529 5.170 1012 HG23 VAL 125 HG23 VAL 125 -5.598 -15.677 6.924 Start of MODEL 2 1 H1 ALA 1 HT1 ALA 1 -13.464 -10.251 -0.154 2 H2 ALA 1 HT2 ALA 1 -14.983 -10.522 0.536 3 H3 ALA 1 HT3 ALA 1 -13.583 -10.913 1.400 4 HA ALA 1 HA ALA 1 -14.461 -8.198 0.622 5 HB1 ALA 1 HB1 ALA 1 -14.723 -7.848 3.046 6 HB2 ALA 1 HB2 ALA 1 -14.327 -9.545 3.320 7 HB3 ALA 1 HB3 ALA 1 -15.791 -9.113 2.439 8 H PHE 2 HN PHE 2 -13.150 -6.510 1.622 9 HA PHE 2 HA PHE 2 -10.333 -7.081 1.333 10 HB2 PHE 2 HB2 PHE 2 -11.865 -4.540 1.915 11 HB3 PHE 2 HB1 PHE 2 -10.111 -4.599 1.825 12 HD1 PHE 2 HD1 PHE 2 -13.119 -5.518 -0.197 13 HD2 PHE 2 HD2 PHE 2 -9.098 -4.118 -0.185 14 HE1 PHE 2 HE1 PHE 2 -13.242 -5.154 -2.620 15 HE2 PHE 2 HE2 PHE 2 -9.223 -3.746 -2.612 16 HZ PHE 2 HZ PHE 2 -11.294 -4.270 -3.834 17 H SER 3 HN SER 3 -12.601 -6.658 3.913 18 HA SER 3 HA SER 3 -10.884 -5.948 6.016 19 HB2 SER 3 HB2 SER 3 -12.837 -7.445 7.226 20 HB3 SER 3 HB1 SER 3 -13.005 -5.747 6.785 21 HG SER 3 HG SER 3 -14.440 -6.293 5.362 22 H GLY 4 HN GLY 4 -9.079 -7.082 6.493 23 HA2 GLY 4 HA2 GLY 4 -9.067 -9.534 7.731 24 HA3 GLY 4 HA1 GLY 4 -8.840 -9.890 6.028 25 H THR 5 HN THR 5 -6.762 -10.722 6.497 26 HA THR 5 HA THR 5 -4.750 -8.599 6.786 27 HB THR 5 HB THR 5 -3.334 -10.423 7.947 28 HG1 THR 5 HG1 THR 5 -5.384 -11.884 7.549 29 HG21 THR 5 HG21 THR 5 -5.632 -9.052 9.334 30 HG22 THR 5 HG22 THR 5 -3.993 -8.440 9.121 31 HG23 THR 5 HG23 THR 5 -4.286 -9.822 10.176 32 H TRP 6 HN TRP 6 -3.525 -8.548 5.015 33 HA TRP 6 HA TRP 6 -3.223 -11.049 3.483 34 HB2 TRP 6 HB2 TRP 6 -2.830 -8.299 2.327 35 HB3 TRP 6 HB1 TRP 6 -3.159 -9.809 1.484 36 HD1 TRP 6 HD1 TRP 6 -4.939 -7.165 3.644 37 HE1 TRP 6 HE1 TRP 6 -7.459 -7.249 3.117 38 HE3 TRP 6 HE3 TRP 6 -5.012 -11.295 0.618 39 HZ2 TRP 6 HZ2 TRP 6 -9.236 -8.862 1.649 40 HZ3 TRP 6 HZ3 TRP 6 -7.170 -12.043 -0.287 41 HH2 TRP 6 HH2 TRP 6 -9.237 -10.849 0.215 42 H GLN 7 HN GLN 7 -1.296 -11.903 3.346 43 HA GLN 7 HA GLN 7 1.030 -10.359 4.189 44 HB2 GLN 7 HB2 GLN 7 0.773 -12.623 5.110 45 HB3 GLN 7 HB1 GLN 7 0.710 -13.293 3.488 46 HG2 GLN 7 HG2 GLN 7 3.014 -12.587 3.100 47 HG3 GLN 7 HG1 GLN 7 3.078 -11.916 4.729 48 HE21 GLN 7 HE21 GLN 7 1.625 -14.002 6.015 49 HE22 GLN 7 HE22 GLN 7 2.631 -15.406 6.027 50 H VAL 8 HN VAL 8 2.018 -9.227 2.686 51 HA VAL 8 HA VAL 8 1.626 -9.814 -0.110 52 HB VAL 8 HB VAL 8 1.376 -7.537 0.563 53 HG11 VAL 8 HG11 VAL 8 3.379 -6.245 1.382 54 HG12 VAL 8 HG12 VAL 8 4.149 -7.804 1.677 55 HG13 VAL 8 HG13 VAL 8 2.663 -7.380 2.528 56 HG21 VAL 8 HG21 VAL 8 3.855 -7.999 -1.071 57 HG22 VAL 8 HG22 VAL 8 3.079 -6.427 -0.891 58 HG23 VAL 8 HG23 VAL 8 2.205 -7.760 -1.645 59 H TYR 9 HN TYR 9 3.084 -10.394 -1.600 60 HA TYR 9 HA TYR 9 5.890 -10.765 -0.840 61 HB2 TYR 9 HB2 TYR 9 5.898 -13.025 -1.886 62 HB3 TYR 9 HB1 TYR 9 4.881 -12.951 -0.453 63 HD1 TYR 9 HD2 TYR 9 2.364 -12.769 -0.770 64 HD2 TYR 9 HD1 TYR 9 5.017 -13.732 -3.958 65 HE1 TYR 9 HE2 TYR 9 0.481 -13.693 -2.054 66 HE2 TYR 9 HE1 TYR 9 3.138 -14.657 -5.247 67 HH TYR 9 HH TYR 9 -0.058 -14.075 -4.504 68 H ALA 10 HN ALA 10 7.192 -9.962 -2.417 69 HA ALA 10 HA ALA 10 6.606 -10.210 -5.190 70 HB1 ALA 10 HB1 ALA 10 4.982 -8.442 -4.527 71 HB2 ALA 10 HB2 ALA 10 6.141 -7.932 -5.757 72 HB3 ALA 10 HB3 ALA 10 6.352 -7.426 -4.080 73 H GLN 11 HN GLN 11 8.158 -8.904 -6.549 74 HA GLN 11 HA GLN 11 10.501 -7.894 -5.200 75 HB2 GLN 11 HB2 GLN 11 10.399 -10.622 -6.172 76 HB3 GLN 11 HB1 GLN 11 11.648 -9.704 -7.002 77 HG2 GLN 11 HG2 GLN 11 12.980 -9.769 -5.240 78 HG3 GLN 11 HG1 GLN 11 11.705 -9.193 -4.171 79 HE21 GLN 11 HE21 GLN 11 10.417 -10.680 -3.074 80 HE22 GLN 11 HE22 GLN 11 10.882 -12.338 -2.911 81 H GLU 12 HN GLU 12 8.621 -6.702 -6.861 82 HA GLU 12 HA GLU 12 10.282 -6.070 -9.204 83 HB2 GLU 12 HB2 GLU 12 7.292 -6.263 -9.101 84 HB3 GLU 12 HB1 GLU 12 8.161 -5.508 -10.410 85 HG2 GLU 12 HG2 GLU 12 8.016 -7.516 -11.365 86 HG3 GLU 12 HG1 GLU 12 9.390 -7.909 -10.333 87 H ASN 13 HN ASN 13 10.627 -4.088 -9.552 88 HA ASN 13 HA ASN 13 11.216 -1.967 -8.871 89 HB2 ASN 13 HB2 ASN 13 8.220 -1.655 -9.087 90 HB3 ASN 13 HB1 ASN 13 9.439 -0.408 -9.335 91 HD21 ASN 13 HD21 ASN 13 7.318 -1.962 -10.974 92 HD22 ASN 13 HD22 ASN 13 8.152 -2.281 -12.460 93 H TYR 14 HN TYR 14 11.109 -3.500 -6.590 94 HA TYR 14 HA TYR 14 9.490 -2.178 -4.594 95 HB2 TYR 14 HB2 TYR 14 9.954 -4.619 -4.526 96 HB3 TYR 14 HB1 TYR 14 11.661 -4.266 -4.284 97 HD1 TYR 14 HD1 TYR 14 12.440 -3.299 -2.153 98 HD2 TYR 14 HD2 TYR 14 8.385 -4.447 -2.730 99 HE1 TYR 14 HE1 TYR 14 12.089 -3.232 0.269 100 HE2 TYR 14 HE2 TYR 14 8.022 -4.393 -0.298 101 HH TYR 14 HH TYR 14 9.972 -4.653 1.865 102 H GLU 15 HN GLU 15 12.965 -2.799 -4.867 103 HA GLU 15 HA GLU 15 13.724 -0.942 -2.908 104 HB2 GLU 15 HB2 GLU 15 16.018 -1.169 -3.932 105 HB3 GLU 15 HB1 GLU 15 15.253 -2.671 -3.435 106 HG2 GLU 15 HG2 GLU 15 14.615 -3.105 -5.753 107 HG3 GLU 15 HG1 GLU 15 15.388 -1.596 -6.240 108 H GLU 16 HN GLU 16 13.409 -0.605 -6.405 109 HA GLU 16 HA GLU 16 14.592 1.963 -6.533 110 HB2 GLU 16 HB2 GLU 16 12.877 0.350 -8.378 111 HB3 GLU 16 HB1 GLU 16 13.228 2.037 -8.748 112 HG2 GLU 16 HG2 GLU 16 15.273 -0.097 -8.225 113 HG3 GLU 16 HG1 GLU 16 14.792 0.491 -9.817 114 H PHE 17 HN PHE 17 11.414 0.869 -5.702 115 HA PHE 17 HA PHE 17 10.218 3.453 -6.036 116 HB2 PHE 17 HB2 PHE 17 8.802 1.493 -6.192 117 HB3 PHE 17 HB1 PHE 17 9.268 0.981 -4.569 118 HD1 PHE 17 HD2 PHE 17 8.071 4.186 -6.084 119 HD2 PHE 17 HD1 PHE 17 7.551 1.225 -3.069 120 HE1 PHE 17 HE2 PHE 17 6.163 5.443 -5.171 121 HE2 PHE 17 HE1 PHE 17 5.653 2.480 -2.154 122 HZ PHE 17 HZ PHE 17 4.956 4.590 -3.205 123 H LEU 18 HN LEU 18 11.850 1.642 -3.557 124 HA LEU 18 HA LEU 18 11.206 3.288 -1.356 125 HB2 LEU 18 HB2 LEU 18 13.819 1.821 -1.717 126 HB3 LEU 18 HB1 LEU 18 13.060 2.293 -0.215 127 HG LEU 18 HG LEU 18 12.304 0.041 -2.050 128 HD11 LEU 18 HD11 LEU 18 13.771 -0.833 -0.557 129 HD12 LEU 18 HD12 LEU 18 12.284 -1.001 0.376 130 HD13 LEU 18 HD13 LEU 18 13.375 0.346 0.692 131 HD21 LEU 18 HD21 LEU 18 10.317 -0.340 -0.741 132 HD22 LEU 18 HD22 LEU 18 10.254 1.269 -1.459 133 HD23 LEU 18 HD23 LEU 18 10.661 1.080 0.245 134 H LYS 19 HN LYS 19 13.612 3.424 -3.902 135 HA LYS 19 HA LYS 19 15.098 5.597 -2.810 136 HB2 LYS 19 HB2 LYS 19 14.902 4.841 -5.728 137 HB3 LYS 19 HB1 LYS 19 16.212 5.694 -4.927 138 HG2 LYS 19 HG2 LYS 19 15.839 3.178 -3.644 139 HG3 LYS 19 HG1 LYS 19 15.944 2.934 -5.385 140 HD2 LYS 19 HD2 LYS 19 18.064 3.972 -5.502 141 HD3 LYS 19 HD1 LYS 19 17.921 4.618 -3.865 142 HE2 LYS 19 HE2 LYS 19 18.234 2.519 -2.885 143 HE3 LYS 19 HE1 LYS 19 17.902 1.665 -4.390 144 HZ1 LYS 19 HZ1 LYS 19 19.993 2.739 -5.259 145 HZ2 LYS 19 HZ2 LYS 19 20.211 1.563 -4.064 146 HZ3 LYS 19 HZ3 LYS 19 20.331 3.202 -3.664 147 H ALA 20 HN ALA 20 12.134 5.338 -4.517 148 HA ALA 20 HA ALA 20 12.146 8.080 -5.430 149 HB1 ALA 20 HB1 ALA 20 9.948 6.026 -5.569 150 HB2 ALA 20 HB2 ALA 20 11.129 6.359 -6.836 151 HB3 ALA 20 HB3 ALA 20 9.956 7.594 -6.375 152 H LEU 21 HN LEU 21 11.534 6.600 -2.550 153 HA LEU 21 HA LEU 21 9.527 8.587 -1.767 154 HB2 LEU 21 HB2 LEU 21 10.453 6.025 -0.486 155 HB3 LEU 21 HB1 LEU 21 9.376 7.157 0.314 156 HG LEU 21 HG LEU 21 8.643 6.083 -2.380 157 HD11 LEU 21 HD11 LEU 21 7.634 4.152 -1.447 158 HD12 LEU 21 HD12 LEU 21 8.026 4.661 0.196 159 HD13 LEU 21 HD13 LEU 21 9.312 4.168 -0.904 160 HD21 LEU 21 HD21 LEU 21 6.378 6.340 -1.428 161 HD22 LEU 21 HD22 LEU 21 7.281 7.852 -1.486 162 HD23 LEU 21 HD23 LEU 21 7.098 6.991 0.043 163 H ALA 22 HN ALA 22 12.605 8.696 -2.113 164 HA ALA 22 HA ALA 22 14.398 9.712 -1.163 165 HB1 ALA 22 HB1 ALA 22 13.992 11.744 0.025 166 HB2 ALA 22 HB2 ALA 22 12.370 11.225 0.481 167 HB3 ALA 22 HB3 ALA 22 12.738 11.588 -1.207 168 H LEU 23 HN LEU 23 13.524 7.262 0.001 169 HA LEU 23 HA LEU 23 13.747 7.502 2.864 170 HB2 LEU 23 HB2 LEU 23 13.733 5.083 1.051 171 HB3 LEU 23 HB1 LEU 23 13.699 5.008 2.804 172 HG LEU 23 HG LEU 23 11.573 6.328 1.119 173 HD11 LEU 23 HD11 LEU 23 10.207 4.380 1.625 174 HD12 LEU 23 HD12 LEU 23 11.566 3.635 2.466 175 HD13 LEU 23 HD13 LEU 23 11.654 3.917 0.730 176 HD21 LEU 23 HD21 LEU 23 10.271 6.336 3.161 177 HD22 LEU 23 HD22 LEU 23 11.779 7.217 3.399 178 HD23 LEU 23 HD23 LEU 23 11.602 5.582 4.038 179 HA PRO 24 HA PRO 24 18.100 7.029 3.310 180 HB2 PRO 24 HB2 PRO 24 17.919 5.009 5.398 181 HB3 PRO 24 HB1 PRO 24 18.322 6.727 5.552 182 HG2 PRO 24 HG2 PRO 24 16.030 5.652 6.517 183 HG3 PRO 24 HG1 PRO 24 16.186 7.340 5.996 184 HD2 PRO 24 HD2 PRO 24 14.972 5.025 4.544 185 HD3 PRO 24 HD1 PRO 24 14.436 6.715 4.629 186 H GLU 25 HN GLU 25 19.524 5.987 2.122 187 HA GLU 25 HA GLU 25 19.044 3.657 0.712 188 HB2 GLU 25 HB2 GLU 25 21.477 5.233 1.379 189 HB3 GLU 25 HB1 GLU 25 21.700 3.626 0.706 190 HG2 GLU 25 HG2 GLU 25 19.795 4.768 -0.937 191 HG3 GLU 25 HG1 GLU 25 20.918 6.087 -0.600 192 H ASP 26 HN ASP 26 20.551 4.087 3.855 193 HA ASP 26 HA ASP 26 21.609 1.508 4.152 194 HB2 ASP 26 HB2 ASP 26 22.155 3.489 5.573 195 HB3 ASP 26 HB1 ASP 26 20.585 3.316 6.351 196 H LEU 27 HN LEU 27 18.388 2.784 4.670 197 HA LEU 27 HA LEU 27 17.477 0.369 5.979 198 HB2 LEU 27 HB2 LEU 27 16.670 2.902 6.199 199 HB3 LEU 27 HB1 LEU 27 15.560 2.375 4.948 200 HG LEU 27 HG LEU 27 15.132 0.379 6.610 201 HD11 LEU 27 HD11 LEU 27 16.729 0.862 8.277 202 HD12 LEU 27 HD12 LEU 27 15.163 1.299 8.960 203 HD13 LEU 27 HD13 LEU 27 16.245 2.555 8.358 204 HD21 LEU 27 HD21 LEU 27 13.420 1.865 5.858 205 HD22 LEU 27 HD22 LEU 27 14.021 3.158 6.899 206 HD23 LEU 27 HD23 LEU 27 13.305 1.712 7.612 207 H ILE 28 HN ILE 28 17.350 1.871 2.828 208 HA ILE 28 HA ILE 28 15.368 0.302 1.608 209 HB ILE 28 HB ILE 28 17.808 1.638 0.416 210 HG12 ILE 28 HG12 ILE 28 14.910 2.497 0.451 211 HG13 ILE 28 HG11 ILE 28 16.123 3.075 1.585 212 HG21 ILE 28 HG21 ILE 28 17.114 -0.026 -1.151 213 HG22 ILE 28 HG22 ILE 28 16.521 1.531 -1.729 214 HG23 ILE 28 HG23 ILE 28 15.417 0.403 -0.942 215 HD11 ILE 28 HD11 ILE 28 15.790 4.719 -0.115 216 HD12 ILE 28 HD12 ILE 28 16.063 3.527 -1.389 217 HD13 ILE 28 HD13 ILE 28 17.388 4.007 -0.331 218 H LYS 29 HN LYS 29 18.777 -0.276 2.194 219 HA LYS 29 HA LYS 29 18.983 -2.597 0.564 220 HB2 LYS 29 HB2 LYS 29 20.676 -1.616 2.871 221 HB3 LYS 29 HB1 LYS 29 21.107 -2.962 1.821 222 HG2 LYS 29 HG2 LYS 29 21.401 -1.562 -0.033 223 HG3 LYS 29 HG1 LYS 29 20.545 -0.221 0.737 224 HD2 LYS 29 HD2 LYS 29 22.819 0.363 0.869 225 HD3 LYS 29 HD1 LYS 29 22.422 -0.253 2.472 226 HE2 LYS 29 HE2 LYS 29 23.362 -2.444 1.829 227 HE3 LYS 29 HE1 LYS 29 23.814 -1.762 0.268 228 HZ1 LYS 29 HZ1 LYS 29 25.723 -1.639 1.578 229 HZ2 LYS 29 HZ2 LYS 29 24.885 -1.092 2.939 230 HZ3 LYS 29 HZ3 LYS 29 25.102 -0.066 1.612 231 H MET 30 HN MET 30 17.828 -2.040 3.806 232 HA MET 30 HA MET 30 18.008 -4.880 4.461 233 HB2 MET 30 HB2 MET 30 16.695 -2.743 6.138 234 HB3 MET 30 HB1 MET 30 17.327 -4.296 6.663 235 HG2 MET 30 HG2 MET 30 18.862 -1.866 5.824 236 HG3 MET 30 HG1 MET 30 18.835 -2.640 7.406 237 HE1 MET 30 HE1 MET 30 21.566 -2.147 6.915 238 HE2 MET 30 HE2 MET 30 21.305 -1.793 5.206 239 HE3 MET 30 HE3 MET 30 22.473 -3.030 5.687 240 H ALA 31 HN ALA 31 15.667 -2.433 3.612 241 HA ALA 31 HA ALA 31 13.292 -3.768 4.174 242 HB1 ALA 31 HB1 ALA 31 13.192 -1.481 3.618 243 HB2 ALA 31 HB2 ALA 31 12.359 -2.332 2.316 244 HB3 ALA 31 HB3 ALA 31 14.003 -1.745 2.075 245 H ARG 32 HN ARG 32 15.575 -4.219 1.608 246 HA ARG 32 HA ARG 32 14.094 -5.516 -0.330 247 HB2 ARG 32 HB2 ARG 32 16.933 -5.819 0.595 248 HB3 ARG 32 HB1 ARG 32 16.294 -6.833 -0.689 249 HG2 ARG 32 HG2 ARG 32 15.910 -4.960 -2.095 250 HG3 ARG 32 HG1 ARG 32 16.231 -3.832 -0.773 251 HD2 ARG 32 HD2 ARG 32 18.526 -4.318 -0.757 252 HD3 ARG 32 HD1 ARG 32 18.308 -5.800 -1.688 253 HE ARG 32 HE ARG 32 17.563 -4.080 -3.512 254 HH11 ARG 32 HH11 ARG 32 20.201 -3.758 -1.229 255 HH12 ARG 32 HH12 ARG 32 21.147 -2.757 -2.276 256 HH21 ARG 32 HH21 ARG 32 18.808 -2.769 -4.887 257 HH22 ARG 32 HH22 ARG 32 20.364 -2.196 -4.361 258 H ASP 33 HN ASP 33 15.117 -6.694 2.796 259 HA ASP 33 HA ASP 33 14.198 -9.405 2.115 260 HB2 ASP 33 HB2 ASP 33 16.535 -9.053 3.023 261 HB3 ASP 33 HB1 ASP 33 15.796 -8.553 4.538 262 H ILE 34 HN ILE 34 13.051 -6.623 3.521 263 HA ILE 34 HA ILE 34 11.500 -8.057 5.562 264 HB ILE 34 HB ILE 34 11.738 -5.072 5.191 265 HG12 ILE 34 HG12 ILE 34 13.252 -7.033 6.892 266 HG13 ILE 34 HG11 ILE 34 13.881 -5.748 5.868 267 HG21 ILE 34 HG21 ILE 34 10.741 -4.957 7.457 268 HG22 ILE 34 HG22 ILE 34 10.546 -6.711 7.434 269 HG23 ILE 34 HG23 ILE 34 9.660 -5.713 6.283 270 HD11 ILE 34 HD11 ILE 34 12.946 -4.102 7.463 271 HD12 ILE 34 HD12 ILE 34 14.185 -5.145 8.161 272 HD13 ILE 34 HD13 ILE 34 12.482 -5.441 8.511 273 H LYS 35 HN LYS 35 9.569 -8.722 5.048 274 HA LYS 35 HA LYS 35 7.918 -7.082 3.251 275 HB2 LYS 35 HB2 LYS 35 7.907 -10.103 3.341 276 HB3 LYS 35 HB1 LYS 35 7.030 -9.069 2.216 277 HG2 LYS 35 HG2 LYS 35 8.732 -9.231 0.807 278 HG3 LYS 35 HG1 LYS 35 9.758 -8.398 1.980 279 HD2 LYS 35 HD2 LYS 35 10.241 -10.576 3.042 280 HD3 LYS 35 HD1 LYS 35 9.295 -11.369 1.784 281 HE2 LYS 35 HE2 LYS 35 10.859 -10.207 0.130 282 HE3 LYS 35 HE1 LYS 35 11.884 -9.878 1.526 283 HZ1 LYS 35 HZ1 LYS 35 11.002 -12.584 0.689 284 HZ2 LYS 35 HZ2 LYS 35 12.085 -12.219 1.933 285 HZ3 LYS 35 HZ3 LYS 35 12.506 -11.911 0.325 286 HA PRO 36 HA PRO 36 5.795 -7.611 7.315 287 HB2 PRO 36 HB2 PRO 36 4.653 -5.000 6.597 288 HB3 PRO 36 HB1 PRO 36 5.575 -5.464 8.038 289 HG2 PRO 36 HG2 PRO 36 6.595 -3.846 6.160 290 HG3 PRO 36 HG1 PRO 36 7.592 -4.993 7.077 291 HD2 PRO 36 HD2 PRO 36 6.537 -5.227 4.288 292 HD3 PRO 36 HD1 PRO 36 8.126 -5.679 4.938 293 H ILE 37 HN ILE 37 3.535 -7.670 7.850 294 HA ILE 37 HA ILE 37 1.910 -8.440 5.561 295 HB ILE 37 HB ILE 37 2.043 -9.985 7.471 296 HG12 ILE 37 HG12 ILE 37 -0.132 -9.468 6.025 297 HG13 ILE 37 HG11 ILE 37 -0.123 -10.678 7.299 298 HG21 ILE 37 HG21 ILE 37 1.009 -9.452 9.615 299 HG22 ILE 37 HG22 ILE 37 0.704 -7.808 9.060 300 HG23 ILE 37 HG23 ILE 37 2.360 -8.379 9.258 301 HD11 ILE 37 HD11 ILE 37 -1.007 -7.843 7.754 302 HD12 ILE 37 HD12 ILE 37 -1.278 -9.250 8.783 303 HD13 ILE 37 HD13 ILE 37 -2.102 -9.121 7.231 304 H VAL 38 HN VAL 38 0.025 -7.406 4.979 305 HA VAL 38 HA VAL 38 -0.280 -4.692 6.045 306 HB VAL 38 HB VAL 38 -1.760 -5.918 3.715 307 HG11 VAL 38 HG11 VAL 38 -2.078 -3.589 3.032 308 HG12 VAL 38 HG12 VAL 38 -1.209 -3.051 4.468 309 HG13 VAL 38 HG13 VAL 38 -2.752 -3.887 4.634 310 HG21 VAL 38 HG21 VAL 38 0.847 -4.402 3.707 311 HG22 VAL 38 HG22 VAL 38 -0.087 -4.828 2.272 312 HG23 VAL 38 HG23 VAL 38 0.619 -6.096 3.276 313 H GLU 39 HN GLU 39 -1.583 -4.494 7.746 314 HA GLU 39 HA GLU 39 -3.855 -6.282 8.078 315 HB2 GLU 39 HB2 GLU 39 -2.243 -4.553 9.821 316 HB3 GLU 39 HB1 GLU 39 -3.961 -4.561 10.190 317 HG2 GLU 39 HG2 GLU 39 -3.977 -6.842 10.656 318 HG3 GLU 39 HG1 GLU 39 -2.437 -7.110 9.841 319 H ILE 40 HN ILE 40 -5.913 -5.720 7.764 320 HA ILE 40 HA ILE 40 -6.616 -2.901 7.558 321 HB ILE 40 HB ILE 40 -6.059 -3.480 5.274 322 HG12 ILE 40 HG12 ILE 40 -8.165 -2.084 5.909 323 HG13 ILE 40 HG11 ILE 40 -7.904 -2.557 4.236 324 HG21 ILE 40 HG21 ILE 40 -6.240 -5.789 5.109 325 HG22 ILE 40 HG22 ILE 40 -7.521 -5.174 4.062 326 HG23 ILE 40 HG23 ILE 40 -7.913 -5.792 5.664 327 HD11 ILE 40 HD11 ILE 40 -10.247 -2.804 5.419 328 HD12 ILE 40 HD12 ILE 40 -9.553 -4.339 5.930 329 HD13 ILE 40 HD13 ILE 40 -9.686 -3.961 4.212 330 H GLN 41 HN GLN 41 -8.502 -2.457 8.447 331 HA GLN 41 HA GLN 41 -10.419 -4.641 8.907 332 HB2 GLN 41 HB2 GLN 41 -11.007 -3.347 11.048 333 HB3 GLN 41 HB1 GLN 41 -9.508 -4.272 11.053 334 HG2 GLN 41 HG2 GLN 41 -8.278 -2.460 11.387 335 HG3 GLN 41 HG1 GLN 41 -9.113 -1.553 10.127 336 HE21 GLN 41 HE21 GLN 41 -8.209 -0.570 12.634 337 HE22 GLN 41 HE22 GLN 41 -9.602 -0.012 13.496 338 H GLN 42 HN GLN 42 -12.590 -4.111 8.579 339 HA GLN 42 HA GLN 42 -13.037 -1.375 7.575 340 HB2 GLN 42 HB2 GLN 42 -13.869 -2.148 5.659 341 HB3 GLN 42 HB1 GLN 42 -13.207 -3.711 6.109 342 HG2 GLN 42 HG2 GLN 42 -15.322 -4.365 7.084 343 HG3 GLN 42 HG1 GLN 42 -15.999 -2.775 6.746 344 HE21 GLN 42 HE21 GLN 42 -16.600 -2.256 4.677 345 HE22 GLN 42 HE22 GLN 42 -16.720 -3.431 3.414 346 H LYS 43 HN LYS 43 -15.163 -0.563 7.687 347 HA LYS 43 HA LYS 43 -17.075 -1.780 9.495 348 HB2 LYS 43 HB2 LYS 43 -15.538 -0.491 10.986 349 HB3 LYS 43 HB1 LYS 43 -15.898 0.953 10.056 350 HG2 LYS 43 HG2 LYS 43 -18.301 0.670 10.706 351 HG3 LYS 43 HG1 LYS 43 -17.785 -0.623 11.796 352 HD2 LYS 43 HD2 LYS 43 -17.939 1.391 13.084 353 HD3 LYS 43 HD1 LYS 43 -16.226 1.032 12.867 354 HE2 LYS 43 HE2 LYS 43 -16.354 2.614 10.848 355 HE3 LYS 43 HE1 LYS 43 -17.894 3.137 11.523 356 HZ1 LYS 43 HZ1 LYS 43 -16.788 3.815 13.525 357 HZ2 LYS 43 HZ2 LYS 43 -16.020 4.539 12.206 358 HZ3 LYS 43 HZ3 LYS 43 -15.306 3.219 12.975 359 H GLY 44 HN GLY 44 -17.981 -1.833 7.297 360 HA2 GLY 44 HA2 GLY 44 -19.788 -1.050 6.049 361 HA3 GLY 44 HA1 GLY 44 -19.615 0.526 6.814 362 H ASP 45 HN ASP 45 -19.181 2.017 5.318 363 HA ASP 45 HA ASP 45 -17.712 1.324 2.907 364 HB2 ASP 45 HB2 ASP 45 -18.872 3.973 3.817 365 HB3 ASP 45 HB1 ASP 45 -18.114 3.695 2.257 366 H ASP 46 HN ASP 46 -17.006 2.306 6.002 367 HA ASP 46 HA ASP 46 -14.633 3.850 5.293 368 HB2 ASP 46 HB2 ASP 46 -16.288 4.434 7.198 369 HB3 ASP 46 HB1 ASP 46 -15.461 3.168 8.094 370 H PHE 47 HN PHE 47 -12.613 3.121 5.478 371 HA PHE 47 HA PHE 47 -12.205 0.437 6.623 372 HB2 PHE 47 HB2 PHE 47 -11.042 1.574 4.078 373 HB3 PHE 47 HB1 PHE 47 -10.452 0.111 4.852 374 HD1 PHE 47 HD1 PHE 47 -13.622 1.581 3.532 375 HD2 PHE 47 HD2 PHE 47 -11.278 -1.913 4.149 376 HE1 PHE 47 HE1 PHE 47 -15.275 0.257 2.281 377 HE2 PHE 47 HE2 PHE 47 -12.924 -3.239 2.899 378 HZ PHE 47 HZ PHE 47 -14.930 -2.159 1.966 379 H VAL 48 HN VAL 48 -10.263 0.102 7.657 380 HA VAL 48 HA VAL 48 -8.500 2.430 7.965 381 HB VAL 48 HB VAL 48 -9.297 0.526 10.185 382 HG11 VAL 48 HG11 VAL 48 -7.916 1.939 11.629 383 HG12 VAL 48 HG12 VAL 48 -7.443 2.916 10.239 384 HG13 VAL 48 HG13 VAL 48 -6.951 1.224 10.337 385 HG21 VAL 48 HG21 VAL 48 -9.904 3.462 9.812 386 HG22 VAL 48 HG22 VAL 48 -10.303 2.502 11.238 387 HG23 VAL 48 HG23 VAL 48 -11.061 2.137 9.689 388 H VAL 49 HN VAL 49 -6.821 1.841 6.823 389 HA VAL 49 HA VAL 49 -5.797 -0.902 6.990 390 HB VAL 49 HB VAL 49 -4.769 1.272 5.166 391 HG11 VAL 49 HG11 VAL 49 -4.049 -0.627 3.791 392 HG12 VAL 49 HG12 VAL 49 -4.702 -1.740 4.995 393 HG13 VAL 49 HG13 VAL 49 -3.347 -0.690 5.407 394 HG21 VAL 49 HG21 VAL 49 -6.293 0.578 3.467 395 HG22 VAL 49 HG22 VAL 49 -7.240 0.941 4.909 396 HG23 VAL 49 HG23 VAL 49 -6.906 -0.733 4.471 397 H THR 50 HN THR 50 -3.863 -1.391 7.878 398 HA THR 50 HA THR 50 -2.328 0.847 9.021 399 HB THR 50 HB THR 50 -2.928 -1.846 10.245 400 HG1 THR 50 HG1 THR 50 -3.862 0.751 10.589 401 HG21 THR 50 HG21 THR 50 -1.538 -1.177 12.126 402 HG22 THR 50 HG22 THR 50 -1.094 0.314 11.294 403 HG23 THR 50 HG23 THR 50 -0.585 -1.247 10.644 404 H SER 51 HN SER 51 -0.366 1.009 8.214 405 HA SER 51 HA SER 51 0.917 -1.377 7.075 406 HB2 SER 51 HB2 SER 51 1.655 1.545 6.705 407 HB3 SER 51 HB1 SER 51 2.352 0.171 5.844 408 HG SER 51 HG SER 51 -0.409 0.430 5.746 409 H LYS 52 HN LYS 52 2.116 -2.365 8.515 410 HA LYS 52 HA LYS 52 3.351 -0.904 10.707 411 HB2 LYS 52 HB2 LYS 52 3.327 -3.882 10.204 412 HB3 LYS 52 HB1 LYS 52 3.748 -3.068 11.706 413 HG2 LYS 52 HG2 LYS 52 1.563 -2.565 12.210 414 HG3 LYS 52 HG1 LYS 52 1.043 -2.648 10.528 415 HD2 LYS 52 HD2 LYS 52 0.137 -4.595 11.384 416 HD3 LYS 52 HD1 LYS 52 1.679 -5.169 10.747 417 HE2 LYS 52 HE2 LYS 52 2.673 -5.031 12.969 418 HE3 LYS 52 HE1 LYS 52 1.153 -4.421 13.622 419 HZ1 LYS 52 HZ1 LYS 52 1.070 -6.665 14.108 420 HZ2 LYS 52 HZ2 LYS 52 1.796 -7.133 12.655 421 HZ3 LYS 52 HZ3 LYS 52 0.186 -6.597 12.663 422 H THR 53 HN THR 53 5.412 -0.309 10.684 423 HA THR 53 HA THR 53 7.284 -1.784 8.971 424 HB THR 53 HB THR 53 8.320 0.185 8.160 425 HG1 THR 53 HG1 THR 53 6.775 2.103 9.348 426 HG21 THR 53 HG21 THR 53 6.611 1.322 6.967 427 HG22 THR 53 HG22 THR 53 5.399 0.917 8.188 428 HG23 THR 53 HG23 THR 53 6.080 -0.351 7.162 429 HA PRO 54 HA PRO 54 9.900 -1.735 12.560 430 HB2 PRO 54 HB2 PRO 54 12.285 -1.719 10.910 431 HB3 PRO 54 HB1 PRO 54 11.574 -3.070 11.809 432 HG2 PRO 54 HG2 PRO 54 11.638 -2.967 9.112 433 HG3 PRO 54 HG1 PRO 54 10.376 -3.811 10.031 434 HD2 PRO 54 HD2 PRO 54 10.269 -1.111 8.734 435 HD3 PRO 54 HD1 PRO 54 9.048 -2.403 8.781 436 H ARG 55 HN ARG 55 9.099 0.910 11.599 437 HA ARG 55 HA ARG 55 11.196 2.413 12.864 438 HB2 ARG 55 HB2 ARG 55 11.489 2.120 10.159 439 HB3 ARG 55 HB1 ARG 55 10.584 3.627 10.257 440 HG2 ARG 55 HG2 ARG 55 12.257 4.653 11.564 441 HG3 ARG 55 HG1 ARG 55 13.079 3.115 11.839 442 HD2 ARG 55 HD2 ARG 55 13.847 3.008 9.615 443 HD3 ARG 55 HD1 ARG 55 12.719 4.249 9.083 444 HE ARG 55 HE ARG 55 14.186 5.863 9.766 445 HH11 ARG 55 HH11 ARG 55 15.186 2.794 11.144 446 HH12 ARG 55 HH12 ARG 55 16.747 3.375 11.624 447 HH21 ARG 55 HH21 ARG 55 16.225 6.639 10.427 448 HH22 ARG 55 HH22 ARG 55 17.338 5.570 11.220 449 H GLN 56 HN GLN 56 8.300 2.709 10.808 450 HA GLN 56 HA GLN 56 7.058 4.372 12.848 451 HB2 GLN 56 HB2 GLN 56 8.342 5.821 11.144 452 HB3 GLN 56 HB1 GLN 56 7.098 5.346 9.999 453 HG2 GLN 56 HG2 GLN 56 5.390 6.320 11.441 454 HG3 GLN 56 HG1 GLN 56 6.634 6.792 12.596 455 HE21 GLN 56 HE21 GLN 56 6.215 8.967 12.431 456 HE22 GLN 56 HE22 GLN 56 6.578 9.890 11.016 457 H THR 57 HN THR 57 5.253 3.257 13.201 458 HA THR 57 HA THR 57 3.953 1.784 11.074 459 HB THR 57 HB THR 57 2.253 1.270 12.885 460 HG1 THR 57 HG1 THR 57 2.884 3.215 14.144 461 HG21 THR 57 HG21 THR 57 4.012 -0.300 12.403 462 HG22 THR 57 HG22 THR 57 3.791 -0.216 14.149 463 HG23 THR 57 HG23 THR 57 5.154 0.609 13.389 464 H VAL 58 HN VAL 58 2.584 2.780 9.704 465 HA VAL 58 HA VAL 58 1.194 5.170 10.712 466 HB VAL 58 HB VAL 58 0.936 5.792 8.263 467 HG11 VAL 58 HG11 VAL 58 3.412 6.519 8.140 468 HG12 VAL 58 HG12 VAL 58 3.541 5.770 9.732 469 HG13 VAL 58 HG13 VAL 58 2.417 7.101 9.475 470 HG21 VAL 58 HG21 VAL 58 3.109 3.722 7.939 471 HG22 VAL 58 HG22 VAL 58 2.551 4.845 6.698 472 HG23 VAL 58 HG23 VAL 58 1.465 3.599 7.315 473 H THR 59 HN THR 59 -0.943 5.374 10.562 474 HA THR 59 HA THR 59 -2.413 3.086 9.441 475 HB THR 59 HB THR 59 -2.550 3.625 11.987 476 HG1 THR 59 HG1 THR 59 -4.837 3.048 11.921 477 HG21 THR 59 HG21 THR 59 -3.982 5.308 12.727 478 HG22 THR 59 HG22 THR 59 -4.717 5.516 11.137 479 HG23 THR 59 HG23 THR 59 -3.079 6.099 11.435 480 H ASN 60 HN ASN 60 -3.974 3.448 7.953 481 HA ASN 60 HA ASN 60 -4.496 6.262 7.173 482 HB2 ASN 60 HB2 ASN 60 -3.702 3.882 5.534 483 HB3 ASN 60 HB1 ASN 60 -4.795 5.063 4.823 484 HD21 ASN 60 HD21 ASN 60 -2.324 5.952 7.131 485 HD22 ASN 60 HD22 ASN 60 -1.297 6.769 6.001 486 H SER 61 HN SER 61 -6.658 6.725 7.104 487 HA SER 61 HA SER 61 -8.521 4.446 6.961 488 HB2 SER 61 HB2 SER 61 -9.330 6.946 8.376 489 HB3 SER 61 HB1 SER 61 -9.801 5.272 8.682 490 HG SER 61 HG SER 61 -7.124 5.967 9.062 491 H PHE 62 HN PHE 62 -10.505 4.798 5.803 492 HA PHE 62 HA PHE 62 -10.927 7.324 4.509 493 HB2 PHE 62 HB2 PHE 62 -10.740 6.427 2.184 494 HB3 PHE 62 HB1 PHE 62 -9.200 6.559 3.022 495 HD1 PHE 62 HD2 PHE 62 -7.981 4.575 3.701 496 HD2 PHE 62 HD1 PHE 62 -11.665 4.271 1.593 497 HE1 PHE 62 HE2 PHE 62 -7.494 2.218 3.192 498 HE2 PHE 62 HE1 PHE 62 -11.193 1.914 1.099 499 HZ PHE 62 HZ PHE 62 -9.096 0.887 1.887 500 H THR 63 HN THR 63 -12.800 7.325 3.098 501 HA THR 63 HA THR 63 -14.679 5.145 3.716 502 HB THR 63 HB THR 63 -15.540 7.978 3.165 503 HG1 THR 63 HG1 THR 63 -14.702 6.811 5.624 504 HG21 THR 63 HG21 THR 63 -16.834 5.598 4.496 505 HG22 THR 63 HG22 THR 63 -17.297 6.354 2.972 506 HG23 THR 63 HG23 THR 63 -17.526 7.218 4.493 507 H LEU 64 HN LEU 64 -15.412 4.113 1.981 508 HA LEU 64 HA LEU 64 -14.491 4.535 -0.597 509 HB2 LEU 64 HB2 LEU 64 -16.919 3.064 0.398 510 HB3 LEU 64 HB1 LEU 64 -16.414 3.043 -1.277 511 HG LEU 64 HG LEU 64 -14.878 1.969 1.073 512 HD11 LEU 64 HD11 LEU 64 -16.315 0.688 -1.231 513 HD12 LEU 64 HD12 LEU 64 -16.631 0.490 0.493 514 HD13 LEU 64 HD13 LEU 64 -15.154 -0.167 -0.215 515 HD21 LEU 64 HD21 LEU 64 -13.348 2.988 -0.532 516 HD22 LEU 64 HD22 LEU 64 -14.105 2.079 -1.838 517 HD23 LEU 64 HD23 LEU 64 -13.217 1.229 -0.573 518 H GLY 65 HN GLY 65 -14.844 6.096 -1.966 519 HA2 GLY 65 HA2 GLY 65 -16.293 7.199 -3.508 520 HA3 GLY 65 HA1 GLY 65 -17.603 7.033 -2.355 521 H LYS 66 HN LYS 66 -15.214 8.005 -0.439 522 HA LYS 66 HA LYS 66 -15.736 10.857 -0.977 523 HB2 LYS 66 HB2 LYS 66 -15.634 9.373 1.639 524 HB3 LYS 66 HB1 LYS 66 -15.486 11.122 1.545 525 HG2 LYS 66 HG2 LYS 66 -17.678 11.350 0.683 526 HG3 LYS 66 HG1 LYS 66 -17.819 9.614 0.412 527 HD2 LYS 66 HD2 LYS 66 -17.809 9.203 2.796 528 HD3 LYS 66 HD1 LYS 66 -17.519 10.917 3.117 529 HE2 LYS 66 HE2 LYS 66 -19.682 11.461 2.104 530 HE3 LYS 66 HE1 LYS 66 -19.961 9.752 1.775 531 HZ1 LYS 66 HZ1 LYS 66 -19.710 11.004 4.457 532 HZ2 LYS 66 HZ2 LYS 66 -19.889 9.346 4.178 533 HZ3 LYS 66 HZ3 LYS 66 -21.128 10.412 3.749 534 H GLU 67 HN GLU 67 -14.091 12.333 -0.262 535 HA GLU 67 HA GLU 67 -11.436 11.323 -0.779 536 HB2 GLU 67 HB2 GLU 67 -12.135 13.486 -1.710 537 HB3 GLU 67 HB1 GLU 67 -12.383 14.113 -0.086 538 HG2 GLU 67 HG2 GLU 67 -9.957 13.707 0.350 539 HG3 GLU 67 HG1 GLU 67 -9.782 13.315 -1.358 540 H ALA 68 HN ALA 68 -10.136 10.556 0.772 541 HA ALA 68 HA ALA 68 -10.587 11.533 3.514 542 HB1 ALA 68 HB1 ALA 68 -11.266 9.204 3.247 543 HB2 ALA 68 HB2 ALA 68 -9.891 9.363 4.339 544 HB3 ALA 68 HB3 ALA 68 -9.645 8.798 2.687 545 H ASP 69 HN ASP 69 -8.957 12.473 4.486 546 HA ASP 69 HA ASP 69 -6.429 12.732 3.153 547 HB2 ASP 69 HB2 ASP 69 -5.831 14.226 4.986 548 HB3 ASP 69 HB1 ASP 69 -7.443 14.617 4.405 549 H ILE 70 HN ILE 70 -4.773 11.393 3.368 550 HA ILE 70 HA ILE 70 -4.605 9.766 5.810 551 HB ILE 70 HB ILE 70 -3.625 7.950 4.294 552 HG12 ILE 70 HG12 ILE 70 -4.896 8.060 2.000 553 HG13 ILE 70 HG11 ILE 70 -4.819 9.799 2.264 554 HG21 ILE 70 HG21 ILE 70 -5.744 7.656 5.407 555 HG22 ILE 70 HG22 ILE 70 -5.874 7.066 3.750 556 HG23 ILE 70 HG23 ILE 70 -6.560 8.631 4.182 557 HD11 ILE 70 HD11 ILE 70 -2.796 7.981 1.327 558 HD12 ILE 70 HD12 ILE 70 -2.230 8.874 2.741 559 HD13 ILE 70 HD13 ILE 70 -2.818 9.743 1.321 560 H THR 71 HN THR 71 -2.380 8.863 6.182 561 HA THR 71 HA THR 71 -0.392 10.775 5.096 562 HB THR 71 HB THR 71 -0.286 9.633 7.885 563 HG1 THR 71 HG1 THR 71 -2.121 11.100 7.415 564 HG21 THR 71 HG21 THR 71 1.866 10.378 6.926 565 HG22 THR 71 HG22 THR 71 1.356 11.395 8.273 566 HG23 THR 71 HG23 THR 71 1.163 11.964 6.615 567 H THR 72 HN THR 72 1.343 9.948 4.175 568 HA THR 72 HA THR 72 1.679 7.070 4.085 569 HB THR 72 HB THR 72 1.879 8.245 1.984 570 HG1 THR 72 HG1 THR 72 4.137 7.652 1.468 571 HG21 THR 72 HG21 THR 72 2.542 10.434 2.825 572 HG22 THR 72 HG22 THR 72 3.642 9.886 1.560 573 HG23 THR 72 HG23 THR 72 4.130 9.799 3.252 574 H MET 73 HN MET 73 3.885 6.148 4.296 575 HA MET 73 HA MET 73 4.988 6.888 6.839 576 HB2 MET 73 HB2 MET 73 6.483 4.943 6.494 577 HB3 MET 73 HB1 MET 73 4.785 4.545 6.298 578 HG2 MET 73 HG2 MET 73 5.104 4.747 3.832 579 HG3 MET 73 HG1 MET 73 6.834 4.910 4.132 580 HE1 MET 73 HE1 MET 73 4.367 1.134 5.155 581 HE2 MET 73 HE2 MET 73 3.686 2.623 4.500 582 HE3 MET 73 HE3 MET 73 4.304 2.589 6.152 583 H ASP 74 HN ASP 74 5.472 8.113 3.820 584 HA ASP 74 HA ASP 74 8.335 8.522 4.112 585 HB2 ASP 74 HB2 ASP 74 8.322 8.669 1.878 586 HB3 ASP 74 HB1 ASP 74 6.588 8.377 1.903 587 H GLY 75 HN GLY 75 5.462 9.985 5.052 588 HA2 GLY 75 HA2 GLY 75 5.323 11.783 6.539 589 HA3 GLY 75 HA1 GLY 75 6.930 12.278 6.060 590 H LYS 76 HN LYS 76 4.119 11.679 4.013 591 HA LYS 76 HA LYS 76 4.047 14.546 3.357 592 HB2 LYS 76 HB2 LYS 76 4.272 12.203 1.558 593 HB3 LYS 76 HB1 LYS 76 3.215 13.512 1.040 594 HG2 LYS 76 HG2 LYS 76 5.290 14.994 1.637 595 HG3 LYS 76 HG1 LYS 76 6.167 13.475 1.425 596 HD2 LYS 76 HD2 LYS 76 4.367 13.671 -0.723 597 HD3 LYS 76 HD1 LYS 76 5.118 15.256 -0.556 598 HE2 LYS 76 HE2 LYS 76 6.455 13.937 -2.054 599 HE3 LYS 76 HE1 LYS 76 7.341 14.146 -0.546 600 HZ1 LYS 76 HZ1 LYS 76 5.898 11.729 -1.462 601 HZ2 LYS 76 HZ2 LYS 76 6.484 11.905 0.117 602 HZ3 LYS 76 HZ3 LYS 76 7.557 11.900 -1.197 603 H LYS 77 HN LYS 77 2.014 15.373 2.775 604 HA LYS 77 HA LYS 77 -0.183 13.816 3.909 605 HB2 LYS 77 HB2 LYS 77 0.174 16.756 3.379 606 HB3 LYS 77 HB1 LYS 77 -1.397 16.068 3.772 607 HG2 LYS 77 HG2 LYS 77 1.072 15.919 5.497 608 HG3 LYS 77 HG1 LYS 77 -0.298 17.006 5.736 609 HD2 LYS 77 HD2 LYS 77 -1.774 15.101 6.085 610 HD3 LYS 77 HD1 LYS 77 -0.447 13.985 5.769 611 HE2 LYS 77 HE2 LYS 77 0.700 14.680 7.732 612 HE3 LYS 77 HE1 LYS 77 -0.431 16.004 7.993 613 HZ1 LYS 77 HZ1 LYS 77 -1.123 13.120 8.096 614 HZ2 LYS 77 HZ2 LYS 77 -2.182 14.410 8.382 615 HZ3 LYS 77 HZ3 LYS 77 -0.893 14.125 9.441 616 H LEU 78 HN LEU 78 -1.185 12.603 2.504 617 HA LEU 78 HA LEU 78 -1.864 13.766 -0.113 618 HB2 LEU 78 HB2 LEU 78 -1.417 10.831 0.443 619 HB3 LEU 78 HB1 LEU 78 -1.676 11.587 -1.118 620 HG LEU 78 HG LEU 78 0.736 12.104 0.621 621 HD11 LEU 78 HD11 LEU 78 0.515 10.307 -1.788 622 HD12 LEU 78 HD12 LEU 78 0.617 9.751 -0.117 623 HD13 LEU 78 HD13 LEU 78 1.965 10.629 -0.839 624 HD21 LEU 78 HD21 LEU 78 0.210 12.722 -2.287 625 HD22 LEU 78 HD22 LEU 78 1.694 13.071 -1.402 626 HD23 LEU 78 HD23 LEU 78 0.196 13.896 -0.974 627 H LYS 79 HN LYS 79 -3.873 12.750 -1.059 628 HA LYS 79 HA LYS 79 -5.677 11.726 0.989 629 HB2 LYS 79 HB2 LYS 79 -7.454 13.323 0.018 630 HB3 LYS 79 HB1 LYS 79 -6.290 13.961 1.171 631 HG2 LYS 79 HG2 LYS 79 -4.950 14.829 -0.689 632 HG3 LYS 79 HG1 LYS 79 -6.171 14.235 -1.819 633 HD2 LYS 79 HD2 LYS 79 -7.825 15.643 -0.470 634 HD3 LYS 79 HD1 LYS 79 -6.396 16.422 0.227 635 HE2 LYS 79 HE2 LYS 79 -6.969 17.764 -1.599 636 HE3 LYS 79 HE1 LYS 79 -5.631 16.761 -2.166 637 HZ1 LYS 79 HZ1 LYS 79 -7.120 15.387 -3.366 638 HZ2 LYS 79 HZ2 LYS 79 -7.550 16.977 -3.737 639 HZ3 LYS 79 HZ3 LYS 79 -8.488 16.081 -2.645 640 H CYS 80 HN CYS 80 -6.770 10.032 0.239 641 HA CYS 80 HA CYS 80 -6.889 9.686 -2.684 642 HB2 CYS 80 HB2 CYS 80 -5.636 7.917 -1.616 643 HB3 CYS 80 HB1 CYS 80 -6.934 7.645 -0.456 644 H THR 81 HN THR 81 -8.806 9.052 -3.658 645 HA THR 81 HA THR 81 -11.223 9.423 -2.020 646 HB THR 81 HB THR 81 -10.936 11.170 -3.714 647 HG1 THR 81 HG1 THR 81 -13.034 9.315 -4.182 648 HG21 THR 81 HG21 THR 81 -9.608 9.891 -5.322 649 HG22 THR 81 HG22 THR 81 -10.994 10.669 -6.085 650 HG23 THR 81 HG23 THR 81 -11.035 8.943 -5.736 651 H VAL 82 HN VAL 82 -9.778 7.013 -2.277 652 HA VAL 82 HA VAL 82 -10.424 5.118 -4.066 653 HB VAL 82 HB VAL 82 -9.008 4.392 -2.413 654 HG11 VAL 82 HG11 VAL 82 -9.549 4.489 0.005 655 HG12 VAL 82 HG12 VAL 82 -10.957 5.461 -0.426 656 HG13 VAL 82 HG13 VAL 82 -9.332 6.042 -0.796 657 HG21 VAL 82 HG21 VAL 82 -10.238 2.613 -1.049 658 HG22 VAL 82 HG22 VAL 82 -10.286 2.493 -2.807 659 HG23 VAL 82 HG23 VAL 82 -11.675 3.133 -1.930 660 H HIS 83 HN HIS 83 -12.054 3.890 -4.667 661 HA HIS 83 HA HIS 83 -14.497 3.788 -3.084 662 HB2 HIS 83 HB2 HIS 83 -15.834 4.215 -5.200 663 HB3 HIS 83 HB1 HIS 83 -15.063 5.614 -4.467 664 HD1 HIS 83 HD1 HIS 83 -15.468 3.926 -7.642 665 HD2 HIS 83 HD2 HIS 83 -12.561 6.340 -5.899 666 HE1 HIS 83 HE1 HIS 83 -14.056 4.763 -9.544 667 HE2 HIS 83 HE2 HIS 83 -12.426 6.364 -8.482 668 H LEU 84 HN LEU 84 -15.966 2.113 -3.831 669 HA LEU 84 HA LEU 84 -14.470 -0.125 -4.896 670 HB2 LEU 84 HB2 LEU 84 -16.017 -0.359 -2.934 671 HB3 LEU 84 HB1 LEU 84 -17.365 -0.044 -4.016 672 HG LEU 84 HG LEU 84 -16.925 -2.460 -3.429 673 HD11 LEU 84 HD11 LEU 84 -16.991 -1.691 -6.310 674 HD12 LEU 84 HD12 LEU 84 -18.366 -1.966 -5.240 675 HD13 LEU 84 HD13 LEU 84 -17.316 -3.312 -5.693 676 HD21 LEU 84 HD21 LEU 84 -14.452 -2.243 -3.621 677 HD22 LEU 84 HD22 LEU 84 -14.673 -2.278 -5.370 678 HD23 LEU 84 HD23 LEU 84 -15.165 -3.658 -4.392 679 H ALA 85 HN ALA 85 -14.792 -1.067 -6.778 680 HA ALA 85 HA ALA 85 -16.920 -0.325 -8.562 681 HB1 ALA 85 HB1 ALA 85 -15.351 1.565 -8.824 682 HB2 ALA 85 HB2 ALA 85 -15.533 0.628 -10.306 683 HB3 ALA 85 HB3 ALA 85 -14.093 0.428 -9.306 684 H ASN 86 HN ASN 86 -17.474 -2.178 -9.406 685 HA ASN 86 HA ASN 86 -17.436 -4.245 -10.333 686 HB2 ASN 86 HB2 ASN 86 -14.669 -3.350 -11.152 687 HB3 ASN 86 HB1 ASN 86 -15.387 -4.868 -11.680 688 HD21 ASN 86 HD21 ASN 86 -15.424 -1.423 -11.960 689 HD22 ASN 86 HD22 ASN 86 -16.468 -1.332 -13.335 690 H GLY 87 HN GLY 87 -16.643 -3.903 -7.544 691 HA2 GLY 87 HA2 GLY 87 -16.121 -5.411 -5.876 692 HA3 GLY 87 HA1 GLY 87 -15.674 -6.577 -7.109 693 H LYS 88 HN LYS 88 -14.125 -3.624 -7.556 694 HA LYS 88 HA LYS 88 -11.754 -4.501 -6.047 695 HB2 LYS 88 HB2 LYS 88 -10.449 -4.499 -7.885 696 HB3 LYS 88 HB1 LYS 88 -11.956 -4.647 -8.761 697 HG2 LYS 88 HG2 LYS 88 -11.040 -2.940 -9.918 698 HG3 LYS 88 HG1 LYS 88 -11.847 -2.003 -8.657 699 HD2 LYS 88 HD2 LYS 88 -9.670 -1.124 -8.740 700 HD3 LYS 88 HD1 LYS 88 -9.673 -2.212 -7.347 701 HE2 LYS 88 HE2 LYS 88 -7.645 -2.403 -8.781 702 HE3 LYS 88 HE1 LYS 88 -8.534 -3.907 -8.575 703 HZ1 LYS 88 HZ1 LYS 88 -9.146 -3.957 -10.741 704 HZ2 LYS 88 HZ2 LYS 88 -7.697 -3.088 -10.918 705 HZ3 LYS 88 HZ3 LYS 88 -9.178 -2.269 -10.907 706 H LEU 89 HN LEU 89 -10.567 -2.883 -5.052 707 HA LEU 89 HA LEU 89 -12.010 -0.390 -4.710 708 HB2 LEU 89 HB2 LEU 89 -10.328 -1.986 -3.074 709 HB3 LEU 89 HB1 LEU 89 -9.555 -0.421 -3.252 710 HG LEU 89 HG LEU 89 -11.455 0.711 -2.355 711 HD11 LEU 89 HD11 LEU 89 -13.317 -0.387 -3.223 712 HD12 LEU 89 HD12 LEU 89 -13.399 -0.683 -1.486 713 HD13 LEU 89 HD13 LEU 89 -12.812 -1.945 -2.568 714 HD21 LEU 89 HD21 LEU 89 -10.105 0.024 -0.600 715 HD22 LEU 89 HD22 LEU 89 -10.550 -1.669 -0.802 716 HD23 LEU 89 HD23 LEU 89 -11.715 -0.529 -0.131 717 H VAL 90 HN VAL 90 -11.538 1.436 -5.668 718 HA VAL 90 HA VAL 90 -9.039 1.552 -7.220 719 HB VAL 90 HB VAL 90 -11.570 3.131 -7.695 720 HG11 VAL 90 HG11 VAL 90 -8.924 2.939 -9.053 721 HG12 VAL 90 HG12 VAL 90 -9.908 4.360 -8.693 722 HG13 VAL 90 HG13 VAL 90 -10.369 3.276 -10.005 723 HG21 VAL 90 HG21 VAL 90 -11.864 0.689 -8.020 724 HG22 VAL 90 HG22 VAL 90 -10.566 0.731 -9.212 725 HG23 VAL 90 HG23 VAL 90 -12.056 1.630 -9.498 726 H CYS 91 HN CYS 91 -7.570 2.642 -6.090 727 HA CYS 91 HA CYS 91 -8.362 5.158 -4.798 728 HB2 CYS 91 HB2 CYS 91 -7.314 3.544 -3.263 729 HB3 CYS 91 HB1 CYS 91 -5.921 3.423 -4.328 730 H LYS 92 HN LYS 92 -8.333 6.228 -6.875 731 HA LYS 92 HA LYS 92 -5.698 6.443 -8.117 732 HB2 LYS 92 HB2 LYS 92 -7.707 5.972 -9.538 733 HB3 LYS 92 HB1 LYS 92 -8.328 7.555 -9.107 734 HG2 LYS 92 HG2 LYS 92 -6.354 8.598 -10.120 735 HG3 LYS 92 HG1 LYS 92 -5.768 7.004 -10.584 736 HD2 LYS 92 HD2 LYS 92 -6.791 7.691 -12.522 737 HD3 LYS 92 HD1 LYS 92 -8.099 6.802 -11.745 738 HE2 LYS 92 HE2 LYS 92 -8.829 8.964 -12.680 739 HE3 LYS 92 HE1 LYS 92 -9.076 8.857 -10.940 740 HZ1 LYS 92 HZ1 LYS 92 -8.123 11.004 -11.717 741 HZ2 LYS 92 HZ2 LYS 92 -6.734 10.175 -12.201 742 HZ3 LYS 92 HZ3 LYS 92 -7.161 10.218 -10.569 743 H SER 93 HN SER 93 -4.625 8.346 -8.359 744 HA SER 93 HA SER 93 -5.504 10.501 -6.576 745 HB2 SER 93 HB2 SER 93 -2.781 10.791 -7.453 746 HB3 SER 93 HB1 SER 93 -3.391 10.523 -5.820 747 HG SER 93 HG SER 93 -2.738 8.547 -5.957 748 H GLU 94 HN GLU 94 -3.719 12.446 -7.633 749 HA GLU 94 HA GLU 94 -5.262 13.322 -9.900 750 HB2 GLU 94 HB2 GLU 94 -4.599 14.844 -8.048 751 HB3 GLU 94 HB1 GLU 94 -2.917 14.636 -8.512 752 HG2 GLU 94 HG2 GLU 94 -3.288 15.724 -10.607 753 HG3 GLU 94 HG1 GLU 94 -5.030 15.779 -10.331 754 H LYS 95 HN LYS 95 -1.969 12.280 -9.228 755 HA LYS 95 HA LYS 95 -1.427 12.296 -12.131 756 HB2 LYS 95 HB2 LYS 95 -0.107 13.894 -10.640 757 HB3 LYS 95 HB1 LYS 95 0.660 12.461 -9.960 758 HG2 LYS 95 HG2 LYS 95 1.545 11.865 -12.132 759 HG3 LYS 95 HG1 LYS 95 0.709 13.235 -12.869 760 HD2 LYS 95 HD2 LYS 95 2.017 14.691 -11.223 761 HD3 LYS 95 HD1 LYS 95 3.014 13.262 -10.938 762 HE2 LYS 95 HE2 LYS 95 3.694 13.188 -13.215 763 HE3 LYS 95 HE1 LYS 95 2.508 14.414 -13.669 764 HZ1 LYS 95 HZ1 LYS 95 3.727 16.013 -12.285 765 HZ2 LYS 95 HZ2 LYS 95 4.698 15.389 -13.520 766 HZ3 LYS 95 HZ3 LYS 95 4.888 14.831 -11.936 767 H PHE 96 HN PHE 96 -1.910 10.294 -9.478 768 HA PHE 96 HA PHE 96 -0.465 8.120 -10.830 769 HB2 PHE 96 HB2 PHE 96 -0.659 8.296 -7.826 770 HB3 PHE 96 HB1 PHE 96 0.383 7.260 -8.795 771 HD1 PHE 96 HD1 PHE 96 2.394 8.164 -9.860 772 HD2 PHE 96 HD2 PHE 96 -0.073 10.577 -7.373 773 HE1 PHE 96 HE1 PHE 96 4.191 9.834 -9.697 774 HE2 PHE 96 HE2 PHE 96 1.720 12.250 -7.209 775 HZ PHE 96 HZ PHE 96 3.854 11.876 -8.372 776 H SER 97 HN SER 97 -1.170 5.963 -9.522 777 HA SER 97 HA SER 97 -3.944 5.920 -8.788 778 HB2 SER 97 HB2 SER 97 -4.340 5.911 -11.138 779 HB3 SER 97 HB1 SER 97 -3.037 4.767 -11.430 780 HG SER 97 HG SER 97 -4.291 3.147 -10.819 781 H HIS 98 HN HIS 98 -4.316 4.328 -7.414 782 HA HIS 98 HA HIS 98 -2.337 2.161 -7.179 783 HB2 HIS 98 HB2 HIS 98 -2.462 3.680 -5.218 784 HB3 HIS 98 HB1 HIS 98 -4.171 3.312 -5.062 785 HD2 HIS 98 HD2 HIS 98 -4.007 0.043 -5.179 786 HE1 HIS 98 HE1 HIS 98 -1.338 0.536 -1.939 787 HE2 HIS 98 HE2 HIS 98 -2.653 -1.142 -3.300 788 H GLU 99 HN GLU 99 -3.092 0.382 -8.071 789 HA GLU 99 HA GLU 99 -5.988 -0.095 -8.049 790 HB2 GLU 99 HB2 GLU 99 -5.542 -0.600 -10.197 791 HB3 GLU 99 HB1 GLU 99 -3.814 -0.711 -9.900 792 HG2 GLU 99 HG2 GLU 99 -3.944 -2.976 -9.338 793 HG3 GLU 99 HG1 GLU 99 -5.690 -2.912 -9.118 794 H GLN 100 HN GLN 100 -6.881 -1.677 -6.846 795 HA GLN 100 HA GLN 100 -5.159 -3.793 -5.776 796 HB2 GLN 100 HB2 GLN 100 -5.374 -1.948 -4.073 797 HB3 GLN 100 HB1 GLN 100 -7.106 -2.254 -4.045 798 HG2 GLN 100 HG2 GLN 100 -6.771 -4.460 -3.192 799 HG3 GLN 100 HG1 GLN 100 -5.022 -4.323 -3.397 800 HE21 GLN 100 HE21 GLN 100 -3.839 -3.049 -1.959 801 HE22 GLN 100 HE22 GLN 100 -4.504 -2.535 -0.449 802 H GLU 101 HN GLU 101 -6.063 -5.667 -6.369 803 HA GLU 101 HA GLU 101 -9.007 -5.819 -6.438 804 HB2 GLU 101 HB2 GLU 101 -7.653 -5.789 -8.671 805 HB3 GLU 101 HB1 GLU 101 -7.296 -7.462 -8.263 806 HG2 GLU 101 HG2 GLU 101 -9.456 -8.139 -8.532 807 HG3 GLU 101 HG1 GLU 101 -10.119 -6.537 -8.207 808 H VAL 102 HN VAL 102 -9.950 -7.531 -5.476 809 HA VAL 102 HA VAL 102 -8.169 -9.504 -4.230 810 HB VAL 102 HB VAL 102 -10.942 -8.595 -3.459 811 HG11 VAL 102 HG11 VAL 102 -10.889 -10.978 -3.148 812 HG12 VAL 102 HG12 VAL 102 -10.761 -10.196 -1.572 813 HG13 VAL 102 HG13 VAL 102 -9.325 -10.879 -2.336 814 HG21 VAL 102 HG21 VAL 102 -9.412 -7.069 -2.592 815 HG22 VAL 102 HG22 VAL 102 -8.215 -8.320 -2.250 816 HG23 VAL 102 HG23 VAL 102 -9.670 -8.198 -1.260 817 H LYS 103 HN LYS 103 -8.085 -11.393 -5.209 818 HA LYS 103 HA LYS 103 -10.481 -12.362 -6.611 819 HB2 LYS 103 HB2 LYS 103 -7.558 -12.685 -7.307 820 HB3 LYS 103 HB1 LYS 103 -8.823 -13.657 -8.043 821 HG2 LYS 103 HG2 LYS 103 -9.822 -11.728 -9.043 822 HG3 LYS 103 HG1 LYS 103 -8.761 -10.649 -8.140 823 HD2 LYS 103 HD2 LYS 103 -6.822 -11.574 -9.336 824 HD3 LYS 103 HD1 LYS 103 -7.905 -12.623 -10.255 825 HE2 LYS 103 HE2 LYS 103 -9.008 -10.696 -11.211 826 HE3 LYS 103 HE1 LYS 103 -8.027 -9.612 -10.225 827 HZ1 LYS 103 HZ1 LYS 103 -6.069 -10.337 -11.391 828 HZ2 LYS 103 HZ2 LYS 103 -7.216 -9.807 -12.513 829 HZ3 LYS 103 HZ3 LYS 103 -6.960 -11.462 -12.286 830 H GLY 104 HN GLY 104 -11.347 -13.653 -5.082 831 HA2 GLY 104 HA2 GLY 104 -11.643 -15.567 -3.856 832 HA3 GLY 104 HA1 GLY 104 -10.180 -16.190 -4.599 833 H ASN 105 HN ASN 105 -8.309 -16.199 -3.473 834 HA ASN 105 HA ASN 105 -8.377 -15.097 -0.733 835 HB2 ASN 105 HB2 ASN 105 -8.411 -17.647 -1.047 836 HB3 ASN 105 HB1 ASN 105 -6.755 -17.479 -1.608 837 HD21 ASN 105 HD21 ASN 105 -5.176 -17.455 -0.163 838 HD22 ASN 105 HD22 ASN 105 -5.401 -17.360 1.551 839 H GLU 106 HN GLU 106 -7.267 -14.216 -3.518 840 HA GLU 106 HA GLU 106 -4.609 -13.477 -2.502 841 HB2 GLU 106 HB2 GLU 106 -5.334 -14.385 -5.291 842 HB3 GLU 106 HB1 GLU 106 -3.830 -13.562 -4.907 843 HG2 GLU 106 HG2 GLU 106 -3.082 -15.354 -3.564 844 HG3 GLU 106 HG1 GLU 106 -4.679 -16.102 -3.553 845 H MET 107 HN MET 107 -4.171 -11.380 -2.579 846 HA MET 107 HA MET 107 -6.008 -9.650 -4.089 847 HB2 MET 107 HB2 MET 107 -6.186 -9.182 -1.734 848 HB3 MET 107 HB1 MET 107 -4.436 -9.133 -1.558 849 HG2 MET 107 HG2 MET 107 -5.356 -7.228 -3.527 850 HG3 MET 107 HG1 MET 107 -6.141 -6.987 -1.967 851 HE1 MET 107 HE1 MET 107 -4.499 -7.439 0.256 852 HE2 MET 107 HE2 MET 107 -4.946 -5.745 0.057 853 HE3 MET 107 HE3 MET 107 -3.279 -6.177 0.435 854 H VAL 108 HN VAL 108 -5.152 -8.777 -5.829 855 HA VAL 108 HA VAL 108 -2.222 -8.508 -5.968 856 HB VAL 108 HB VAL 108 -4.118 -8.572 -8.316 857 HG11 VAL 108 HG11 VAL 108 -1.747 -7.557 -8.448 858 HG12 VAL 108 HG12 VAL 108 -2.239 -8.718 -9.681 859 HG13 VAL 108 HG13 VAL 108 -1.192 -9.230 -8.358 860 HG21 VAL 108 HG21 VAL 108 -2.490 -10.860 -7.207 861 HG22 VAL 108 HG22 VAL 108 -3.503 -10.903 -8.651 862 HG23 VAL 108 HG23 VAL 108 -4.239 -10.693 -7.061 863 H GLU 109 HN GLU 109 -1.494 -6.485 -5.806 864 HA GLU 109 HA GLU 109 -3.250 -4.354 -6.802 865 HB2 GLU 109 HB2 GLU 109 -2.935 -3.064 -4.952 866 HB3 GLU 109 HB1 GLU 109 -2.825 -4.656 -4.219 867 HG2 GLU 109 HG2 GLU 109 -0.306 -4.439 -4.547 868 HG3 GLU 109 HG1 GLU 109 -0.626 -2.731 -4.853 869 H THR 110 HN THR 110 -2.320 -2.620 -7.824 870 HA THR 110 HA THR 110 0.553 -2.801 -8.418 871 HB THR 110 HB THR 110 -1.438 -1.982 -10.519 872 HG1 THR 110 HG1 THR 110 -1.187 -4.436 -9.497 873 HG21 THR 110 HG21 THR 110 1.113 -1.559 -10.612 874 HG22 THR 110 HG22 THR 110 0.314 -2.241 -12.028 875 HG23 THR 110 HG23 THR 110 1.225 -3.288 -10.940 876 H ILE 111 HN ILE 111 1.371 -1.047 -7.525 877 HA ILE 111 HA ILE 111 -0.202 1.445 -7.577 878 HB ILE 111 HB ILE 111 2.252 1.169 -5.892 879 HG12 ILE 111 HG12 ILE 111 -0.412 0.054 -5.005 880 HG13 ILE 111 HG11 ILE 111 0.887 -0.954 -5.640 881 HG21 ILE 111 HG21 ILE 111 1.143 3.278 -5.886 882 HG22 ILE 111 HG22 ILE 111 0.829 2.502 -4.334 883 HG23 ILE 111 HG23 ILE 111 -0.419 2.522 -5.580 884 HD11 ILE 111 HD11 ILE 111 0.950 0.734 -3.152 885 HD12 ILE 111 HD12 ILE 111 2.344 -0.116 -3.820 886 HD13 ILE 111 HD13 ILE 111 0.942 -1.028 -3.256 887 H THR 112 HN THR 112 1.111 3.455 -7.818 888 HA THR 112 HA THR 112 3.700 3.222 -9.077 889 HB THR 112 HB THR 112 1.444 4.499 -10.640 890 HG1 THR 112 HG1 THR 112 2.217 1.901 -10.481 891 HG21 THR 112 HG21 THR 112 4.247 3.823 -11.519 892 HG22 THR 112 HG22 THR 112 3.782 5.404 -10.894 893 HG23 THR 112 HG23 THR 112 3.051 4.791 -12.379 894 H PHE 113 HN PHE 113 4.794 4.683 -7.968 895 HA PHE 113 HA PHE 113 3.818 7.417 -7.844 896 HB2 PHE 113 HB2 PHE 113 4.100 5.650 -5.460 897 HB3 PHE 113 HB1 PHE 113 4.673 7.303 -5.308 898 HD1 PHE 113 HD1 PHE 113 1.738 5.168 -5.759 899 HD2 PHE 113 HD2 PHE 113 3.132 9.159 -5.297 900 HE1 PHE 113 HE1 PHE 113 -0.563 5.913 -5.282 901 HE2 PHE 113 HE2 PHE 113 0.836 9.912 -4.825 902 HZ PHE 113 HZ PHE 113 -1.012 8.285 -4.818 903 H GLY 114 HN GLY 114 5.467 8.935 -7.586 904 HA2 GLY 114 HA2 GLY 114 7.601 9.772 -7.721 905 HA3 GLY 114 HA1 GLY 114 8.136 8.302 -6.920 906 H GLY 115 HN GLY 115 6.371 7.887 -9.829 907 HA2 GLY 115 HA2 GLY 115 7.071 7.545 -12.024 908 HA3 GLY 115 HA1 GLY 115 8.718 7.904 -11.526 909 H VAL 116 HN VAL 116 7.190 5.633 -9.507 910 HA VAL 116 HA VAL 116 8.431 3.416 -10.999 911 HB VAL 116 HB VAL 116 8.347 3.391 -8.004 912 HG11 VAL 116 HG11 VAL 116 10.027 1.761 -8.183 913 HG12 VAL 116 HG12 VAL 116 10.362 2.177 -9.863 914 HG13 VAL 116 HG13 VAL 116 8.848 1.381 -9.436 915 HG21 VAL 116 HG21 VAL 116 10.693 4.238 -8.000 916 HG22 VAL 116 HG22 VAL 116 9.484 5.447 -8.441 917 HG23 VAL 116 HG23 VAL 116 10.477 4.696 -9.689 918 H THR 117 HN THR 117 7.201 1.685 -11.304 919 HA THR 117 HA THR 117 4.533 1.653 -10.112 920 HB THR 117 HB THR 117 5.650 -0.033 -12.372 921 HG1 THR 117 HG1 THR 117 3.698 1.820 -12.942 922 HG21 THR 117 HG21 THR 117 3.233 -0.469 -12.843 923 HG22 THR 117 HG22 THR 117 2.847 0.311 -11.306 924 HG23 THR 117 HG23 THR 117 3.807 -1.169 -11.327 925 H LEU 118 HN LEU 118 4.982 0.863 -8.042 926 HA LEU 118 HA LEU 118 6.495 -1.551 -7.698 927 HB2 LEU 118 HB2 LEU 118 6.517 0.142 -5.935 928 HB3 LEU 118 HB1 LEU 118 4.787 -0.037 -5.719 929 HG LEU 118 HG LEU 118 5.002 -2.148 -4.707 930 HD11 LEU 118 HD11 LEU 118 6.448 -3.320 -6.147 931 HD12 LEU 118 HD12 LEU 118 7.273 -3.293 -4.586 932 HD13 LEU 118 HD13 LEU 118 7.769 -2.190 -5.871 933 HD21 LEU 118 HD21 LEU 118 7.438 -0.651 -3.769 934 HD22 LEU 118 HD22 LEU 118 6.466 -1.802 -2.852 935 HD23 LEU 118 HD23 LEU 118 5.785 -0.241 -3.309 936 H ILE 119 HN ILE 119 5.708 -3.394 -8.372 937 HA ILE 119 HA ILE 119 2.839 -3.898 -8.289 938 HB ILE 119 HB ILE 119 5.122 -5.501 -9.460 939 HG12 ILE 119 HG12 ILE 119 3.302 -3.383 -10.489 940 HG13 ILE 119 HG11 ILE 119 4.966 -3.747 -10.924 941 HG21 ILE 119 HG21 ILE 119 3.397 -6.857 -10.536 942 HG22 ILE 119 HG22 ILE 119 2.135 -5.926 -9.728 943 HG23 ILE 119 HG23 ILE 119 3.235 -6.929 -8.781 944 HD11 ILE 119 HD11 ILE 119 2.480 -5.158 -11.865 945 HD12 ILE 119 HD12 ILE 119 4.124 -5.702 -12.212 946 HD13 ILE 119 HD13 ILE 119 3.565 -4.143 -12.815 947 H ARG 120 HN ARG 120 1.986 -4.819 -6.512 948 HA ARG 120 HA ARG 120 3.680 -6.701 -5.003 949 HB2 ARG 120 HB2 ARG 120 1.714 -4.675 -3.943 950 HB3 ARG 120 HB1 ARG 120 2.391 -5.977 -2.971 951 HG2 ARG 120 HG2 ARG 120 4.671 -4.994 -3.706 952 HG3 ARG 120 HG1 ARG 120 3.730 -3.554 -4.097 953 HD2 ARG 120 HD2 ARG 120 4.266 -4.816 -1.442 954 HD3 ARG 120 HD1 ARG 120 4.374 -3.122 -1.918 955 HE ARG 120 HE ARG 120 1.681 -3.903 -2.099 956 HH11 ARG 120 HH11 ARG 120 4.122 -3.488 0.408 957 HH12 ARG 120 HH12 ARG 120 2.965 -3.085 1.631 958 HH21 ARG 120 HH21 ARG 120 0.184 -3.398 -0.517 959 HH22 ARG 120 HH22 ARG 120 0.709 -3.022 1.105 960 H ARG 121 HN ARG 121 2.677 -8.479 -4.078 961 HA ARG 121 HA ARG 121 -0.076 -9.031 -4.864 962 HB2 ARG 121 HB2 ARG 121 2.390 -10.635 -5.393 963 HB3 ARG 121 HB1 ARG 121 0.873 -11.474 -5.083 964 HG2 ARG 121 HG2 ARG 121 0.167 -11.072 -7.114 965 HG3 ARG 121 HG1 ARG 121 0.471 -9.349 -6.948 966 HD2 ARG 121 HD2 ARG 121 2.531 -11.418 -7.675 967 HD3 ARG 121 HD1 ARG 121 1.720 -10.347 -8.815 968 HE ARG 121 HE ARG 121 2.860 -8.765 -6.843 969 HH11 ARG 121 HH11 ARG 121 3.891 -10.891 -9.424 970 HH12 ARG 121 HH12 ARG 121 5.421 -10.085 -9.647 971 HH21 ARG 121 HH21 ARG 121 4.851 -7.702 -7.133 972 HH22 ARG 121 HH22 ARG 121 5.986 -8.315 -8.298 973 H SER 122 HN SER 122 -1.238 -9.642 -3.201 974 HA SER 122 HA SER 122 0.196 -10.619 -0.832 975 HB2 SER 122 HB2 SER 122 -2.419 -9.179 -0.622 976 HB3 SER 122 HB1 SER 122 -1.120 -9.317 0.562 977 HG SER 122 HG SER 122 -1.510 -7.440 -1.360 978 H LYS 123 HN LYS 123 -0.617 -12.273 0.322 979 HA LYS 123 HA LYS 123 -2.892 -13.705 -0.885 980 HB2 LYS 123 HB2 LYS 123 -1.825 -15.736 0.263 981 HB3 LYS 123 HB1 LYS 123 -1.026 -15.114 -1.175 982 HG2 LYS 123 HG2 LYS 123 0.747 -14.249 0.031 983 HG3 LYS 123 HG1 LYS 123 -0.176 -14.182 1.532 984 HD2 LYS 123 HD2 LYS 123 1.475 -15.963 1.624 985 HD3 LYS 123 HD1 LYS 123 -0.160 -16.629 1.650 986 HE2 LYS 123 HE2 LYS 123 0.000 -17.284 -0.643 987 HE3 LYS 123 HE1 LYS 123 1.508 -16.394 -0.853 988 HZ1 LYS 123 HZ1 LYS 123 2.605 -17.921 0.628 989 HZ2 LYS 123 HZ2 LYS 123 1.859 -18.793 -0.615 990 HZ3 LYS 123 HZ3 LYS 123 1.162 -18.749 0.926 991 H ARG 124 HN ARG 124 -4.516 -14.411 0.449 992 HA ARG 124 HA ARG 124 -4.758 -13.056 2.959 993 HB2 ARG 124 HB2 ARG 124 -6.616 -13.923 1.237 994 HB3 ARG 124 HB1 ARG 124 -6.568 -15.324 2.303 995 HG2 ARG 124 HG2 ARG 124 -7.071 -13.928 4.215 996 HG3 ARG 124 HG1 ARG 124 -7.069 -12.489 3.192 997 HD2 ARG 124 HD2 ARG 124 -9.337 -13.135 3.548 998 HD3 ARG 124 HD1 ARG 124 -8.924 -13.508 1.878 999 HE ARG 124 HE ARG 124 -8.497 -15.865 2.892 1000 HH11 ARG 124 HH11 ARG 124 -11.068 -13.647 3.776 1001 HH12 ARG 124 HH12 ARG 124 -12.160 -14.912 4.239 1002 HH21 ARG 124 HH21 ARG 124 -9.935 -17.514 3.506 1003 HH22 ARG 124 HH22 ARG 124 -11.514 -17.112 4.097 1004 H VAL 125 HN VAL 125 -4.776 -13.924 5.004 1005 HA VAL 125 HA VAL 125 -3.551 -16.587 5.209 1006 HB VAL 125 HB VAL 125 -3.319 -14.333 7.206 1007 HG11 VAL 125 HG11 VAL 125 -1.453 -15.737 8.093 1008 HG12 VAL 125 HG12 VAL 125 -2.005 -17.036 7.035 1009 HG13 VAL 125 HG13 VAL 125 -3.062 -16.422 8.309 1010 HG21 VAL 125 HG21 VAL 125 -2.080 -13.552 5.392 1011 HG22 VAL 125 HG22 VAL 125 -1.524 -15.168 4.957 1012 HG23 VAL 125 HG23 VAL 125 -0.876 -14.370 6.390 Start of MODEL 3 1 H1 ALA 1 HT1 ALA 1 -15.114 -10.315 0.598 2 H2 ALA 1 HT2 ALA 1 -13.759 -10.758 1.510 3 H3 ALA 1 HT3 ALA 1 -13.560 -10.132 -0.044 4 HA ALA 1 HA ALA 1 -14.539 -8.021 0.696 5 HB1 ALA 1 HB1 ALA 1 -14.382 -9.335 3.408 6 HB2 ALA 1 HB2 ALA 1 -15.853 -8.880 2.549 7 HB3 ALA 1 HB3 ALA 1 -14.743 -7.633 3.118 8 H PHE 2 HN PHE 2 -13.176 -6.345 1.625 9 HA PHE 2 HA PHE 2 -10.391 -6.954 1.236 10 HB2 PHE 2 HB2 PHE 2 -11.983 -4.470 1.724 11 HB3 PHE 2 HB1 PHE 2 -10.238 -4.428 1.946 12 HD1 PHE 2 HD1 PHE 2 -12.811 -5.449 -0.550 13 HD2 PHE 2 HD2 PHE 2 -8.892 -3.949 0.134 14 HE1 PHE 2 HE1 PHE 2 -12.525 -5.114 -2.971 15 HE2 PHE 2 HE2 PHE 2 -8.599 -3.605 -2.283 16 HZ PHE 2 HZ PHE 2 -10.415 -4.195 -3.838 17 H SER 3 HN SER 3 -12.509 -6.326 3.957 18 HA SER 3 HA SER 3 -10.634 -5.801 5.942 19 HB2 SER 3 HB2 SER 3 -12.669 -7.346 7.121 20 HB3 SER 3 HB1 SER 3 -12.594 -5.587 7.009 21 HG SER 3 HG SER 3 -14.480 -6.163 6.030 22 H GLY 4 HN GLY 4 -9.039 -6.994 6.739 23 HA2 GLY 4 HA2 GLY 4 -9.019 -9.473 7.776 24 HA3 GLY 4 HA1 GLY 4 -8.827 -9.800 6.057 25 H THR 5 HN THR 5 -6.758 -10.646 6.369 26 HA THR 5 HA THR 5 -4.731 -8.566 6.762 27 HB THR 5 HB THR 5 -3.293 -10.443 7.745 28 HG1 THR 5 HG1 THR 5 -5.441 -11.847 7.321 29 HG21 THR 5 HG21 THR 5 -4.024 -9.922 10.001 30 HG22 THR 5 HG22 THR 5 -5.579 -9.360 9.391 31 HG23 THR 5 HG23 THR 5 -4.107 -8.476 8.995 32 H TRP 6 HN TRP 6 -3.566 -8.365 4.994 33 HA TRP 6 HA TRP 6 -3.162 -10.718 3.262 34 HB2 TRP 6 HB2 TRP 6 -3.045 -7.850 2.365 35 HB3 TRP 6 HB1 TRP 6 -3.195 -9.297 1.372 36 HD1 TRP 6 HD1 TRP 6 -5.260 -7.027 3.674 37 HE1 TRP 6 HE1 TRP 6 -7.757 -7.382 3.133 38 HE3 TRP 6 HE3 TRP 6 -4.845 -11.006 0.486 39 HZ2 TRP 6 HZ2 TRP 6 -9.333 -9.138 1.590 40 HZ3 TRP 6 HZ3 TRP 6 -6.897 -11.975 -0.464 41 HH2 TRP 6 HH2 TRP 6 -9.096 -11.054 0.072 42 H GLN 7 HN GLN 7 -1.169 -11.411 3.040 43 HA GLN 7 HA GLN 7 1.037 -9.747 4.018 44 HB2 GLN 7 HB2 GLN 7 0.526 -12.237 4.696 45 HB3 GLN 7 HB1 GLN 7 1.338 -12.604 3.181 46 HG2 GLN 7 HG2 GLN 7 3.315 -11.394 3.952 47 HG3 GLN 7 HG1 GLN 7 2.503 -11.058 5.480 48 HE21 GLN 7 HE21 GLN 7 4.048 -13.470 3.522 49 HE22 GLN 7 HE22 GLN 7 4.158 -14.686 4.749 50 H VAL 8 HN VAL 8 1.950 -8.542 2.494 51 HA VAL 8 HA VAL 8 1.812 -9.211 -0.283 52 HB VAL 8 HB VAL 8 3.348 -7.193 -0.555 53 HG11 VAL 8 HG11 VAL 8 0.621 -6.954 0.692 54 HG12 VAL 8 HG12 VAL 8 1.029 -7.003 -1.028 55 HG13 VAL 8 HG13 VAL 8 1.486 -5.608 -0.050 56 HG21 VAL 8 HG21 VAL 8 2.647 -6.806 2.355 57 HG22 VAL 8 HG22 VAL 8 3.477 -5.649 1.316 58 HG23 VAL 8 HG23 VAL 8 4.254 -7.179 1.728 59 H TYR 9 HN TYR 9 3.322 -9.901 -1.628 60 HA TYR 9 HA TYR 9 6.068 -10.255 -0.802 61 HB2 TYR 9 HB2 TYR 9 6.138 -12.646 -1.249 62 HB3 TYR 9 HB1 TYR 9 4.956 -12.321 0.010 63 HD1 TYR 9 HD2 TYR 9 2.471 -11.910 -1.000 64 HD2 TYR 9 HD1 TYR 9 5.552 -14.187 -2.845 65 HE1 TYR 9 HE2 TYR 9 0.783 -13.126 -2.303 66 HE2 TYR 9 HE1 TYR 9 3.869 -15.408 -4.161 67 HH TYR 9 HH TYR 9 0.666 -14.371 -4.437 68 H ALA 10 HN ALA 10 7.162 -9.427 -2.428 69 HA ALA 10 HA ALA 10 6.951 -10.352 -5.090 70 HB1 ALA 10 HB1 ALA 10 6.174 -8.328 -6.193 71 HB2 ALA 10 HB2 ALA 10 5.941 -7.541 -4.633 72 HB3 ALA 10 HB3 ALA 10 4.939 -8.921 -5.082 73 H GLN 11 HN GLN 11 8.480 -9.117 -6.531 74 HA GLN 11 HA GLN 11 10.446 -7.550 -5.045 75 HB2 GLN 11 HB2 GLN 11 10.968 -10.127 -6.490 76 HB3 GLN 11 HB1 GLN 11 12.234 -8.917 -6.338 77 HG2 GLN 11 HG2 GLN 11 10.753 -10.158 -4.033 78 HG3 GLN 11 HG1 GLN 11 12.332 -10.678 -4.617 79 HE21 GLN 11 HE21 GLN 11 11.444 -9.558 -2.021 80 HE22 GLN 11 HE22 GLN 11 12.477 -8.201 -1.732 81 H GLU 12 HN GLU 12 8.535 -6.667 -6.937 82 HA GLU 12 HA GLU 12 10.245 -6.068 -9.257 83 HB2 GLU 12 HB2 GLU 12 7.321 -5.516 -9.123 84 HB3 GLU 12 HB1 GLU 12 8.344 -5.568 -10.538 85 HG2 GLU 12 HG2 GLU 12 7.652 -7.918 -8.830 86 HG3 GLU 12 HG1 GLU 12 6.883 -7.513 -10.359 87 H ASN 13 HN ASN 13 11.018 -4.259 -9.416 88 HA ASN 13 HA ASN 13 11.827 -2.184 -8.773 89 HB2 ASN 13 HB2 ASN 13 8.967 -1.336 -9.188 90 HB3 ASN 13 HB1 ASN 13 10.435 -0.437 -9.555 91 HD21 ASN 13 HD21 ASN 13 7.965 -1.974 -10.923 92 HD22 ASN 13 HD22 ASN 13 8.701 -2.530 -12.389 93 H TYR 14 HN TYR 14 11.370 -3.576 -6.490 94 HA TYR 14 HA TYR 14 9.673 -2.108 -4.696 95 HB2 TYR 14 HB2 TYR 14 10.062 -4.568 -4.515 96 HB3 TYR 14 HB1 TYR 14 11.733 -4.238 -4.078 97 HD1 TYR 14 HD2 TYR 14 12.242 -3.107 -1.931 98 HD2 TYR 14 HD1 TYR 14 8.306 -4.364 -2.930 99 HE1 TYR 14 HE2 TYR 14 11.598 -2.929 0.430 100 HE2 TYR 14 HE1 TYR 14 7.644 -4.190 -0.567 101 HH TYR 14 HH TYR 14 9.323 -4.303 1.831 102 H GLU 15 HN GLU 15 13.136 -2.851 -4.614 103 HA GLU 15 HA GLU 15 13.805 -0.964 -2.664 104 HB2 GLU 15 HB2 GLU 15 16.141 -1.279 -3.392 105 HB3 GLU 15 HB1 GLU 15 15.290 -2.803 -3.179 106 HG2 GLU 15 HG2 GLU 15 15.445 -3.342 -5.354 107 HG3 GLU 15 HG1 GLU 15 15.234 -1.680 -5.896 108 H GLU 16 HN GLU 16 13.667 -0.698 -6.154 109 HA GLU 16 HA GLU 16 14.975 1.808 -6.342 110 HB2 GLU 16 HB2 GLU 16 14.571 0.112 -8.203 111 HB3 GLU 16 HB1 GLU 16 12.936 0.753 -8.293 112 HG2 GLU 16 HG2 GLU 16 13.987 3.021 -8.628 113 HG3 GLU 16 HG1 GLU 16 15.520 2.179 -8.834 114 H PHE 17 HN PHE 17 11.633 0.860 -5.860 115 HA PHE 17 HA PHE 17 10.519 3.434 -6.297 116 HB2 PHE 17 HB2 PHE 17 9.117 1.485 -6.484 117 HB3 PHE 17 HB1 PHE 17 9.484 1.003 -4.830 118 HD1 PHE 17 HD1 PHE 17 8.371 4.201 -6.399 119 HD2 PHE 17 HD2 PHE 17 7.628 1.175 -3.515 120 HE1 PHE 17 HE1 PHE 17 6.371 5.404 -5.649 121 HE2 PHE 17 HE2 PHE 17 5.629 2.373 -2.754 122 HZ PHE 17 HZ PHE 17 4.992 4.494 -3.827 123 H LEU 18 HN LEU 18 11.785 1.733 -3.503 124 HA LEU 18 HA LEU 18 10.894 3.474 -1.498 125 HB2 LEU 18 HB2 LEU 18 13.544 2.035 -1.515 126 HB3 LEU 18 HB1 LEU 18 12.649 2.581 -0.111 127 HG LEU 18 HG LEU 18 12.049 0.253 -1.917 128 HD11 LEU 18 HD11 LEU 18 12.408 0.512 1.060 129 HD12 LEU 18 HD12 LEU 18 13.581 -0.143 -0.083 130 HD13 LEU 18 HD13 LEU 18 12.054 -0.978 0.187 131 HD21 LEU 18 HD21 LEU 18 10.202 1.536 0.089 132 HD22 LEU 18 HD22 LEU 18 9.967 -0.063 -0.619 133 HD23 LEU 18 HD23 LEU 18 9.939 1.369 -1.647 134 H LYS 19 HN LYS 19 13.618 3.631 -3.679 135 HA LYS 19 HA LYS 19 14.903 5.857 -2.462 136 HB2 LYS 19 HB2 LYS 19 15.139 5.102 -5.370 137 HB3 LYS 19 HB1 LYS 19 16.358 5.821 -4.323 138 HG2 LYS 19 HG2 LYS 19 16.475 3.743 -3.050 139 HG3 LYS 19 HG1 LYS 19 15.274 3.022 -4.110 140 HD2 LYS 19 HD2 LYS 19 16.781 3.212 -5.990 141 HD3 LYS 19 HD1 LYS 19 17.974 4.034 -4.979 142 HE2 LYS 19 HE2 LYS 19 18.194 2.063 -3.582 143 HE3 LYS 19 HE1 LYS 19 16.936 1.242 -4.499 144 HZ1 LYS 19 HZ1 LYS 19 19.729 1.676 -5.166 145 HZ2 LYS 19 HZ2 LYS 19 18.643 1.846 -6.448 146 HZ3 LYS 19 HZ3 LYS 19 18.699 0.395 -5.578 147 H ALA 20 HN ALA 20 12.279 5.466 -4.687 148 HA ALA 20 HA ALA 20 12.315 8.181 -5.618 149 HB1 ALA 20 HB1 ALA 20 11.451 6.363 -7.032 150 HB2 ALA 20 HB2 ALA 20 10.245 7.622 -6.765 151 HB3 ALA 20 HB3 ALA 20 10.147 6.105 -5.874 152 H LEU 21 HN LEU 21 11.317 6.635 -2.839 153 HA LEU 21 HA LEU 21 9.294 8.656 -2.207 154 HB2 LEU 21 HB2 LEU 21 10.099 6.236 -0.590 155 HB3 LEU 21 HB1 LEU 21 8.679 7.235 -0.358 156 HG LEU 21 HG LEU 21 9.130 5.620 -2.863 157 HD11 LEU 21 HD11 LEU 21 8.236 3.778 -1.928 158 HD12 LEU 21 HD12 LEU 21 7.168 4.704 -0.873 159 HD13 LEU 21 HD13 LEU 21 8.861 4.478 -0.434 160 HD21 LEU 21 HD21 LEU 21 7.494 7.630 -2.664 161 HD22 LEU 21 HD22 LEU 21 6.510 6.492 -1.750 162 HD23 LEU 21 HD23 LEU 21 6.959 6.127 -3.414 163 H ALA 22 HN ALA 22 12.451 8.505 -2.198 164 HA ALA 22 HA ALA 22 14.161 9.554 -1.150 165 HB1 ALA 22 HB1 ALA 22 12.066 11.042 0.417 166 HB2 ALA 22 HB2 ALA 22 12.549 11.464 -1.227 167 HB3 ALA 22 HB3 ALA 22 13.724 11.545 0.089 168 H LEU 23 HN LEU 23 13.065 7.098 -0.124 169 HA LEU 23 HA LEU 23 13.171 7.227 2.747 170 HB2 LEU 23 HB2 LEU 23 13.027 4.946 0.778 171 HB3 LEU 23 HB1 LEU 23 13.164 4.681 2.506 172 HG LEU 23 HG LEU 23 10.939 6.283 1.251 173 HD11 LEU 23 HD11 LEU 23 10.936 3.399 2.093 174 HD12 LEU 23 HD12 LEU 23 10.824 4.006 0.445 175 HD13 LEU 23 HD13 LEU 23 9.524 4.328 1.592 176 HD21 LEU 23 HD21 LEU 23 11.329 6.825 3.565 177 HD22 LEU 23 HD22 LEU 23 11.300 5.118 4.005 178 HD23 LEU 23 HD23 LEU 23 9.834 5.902 3.414 179 HA PRO 24 HA PRO 24 17.480 6.777 3.445 180 HB2 PRO 24 HB2 PRO 24 17.598 4.862 5.411 181 HB3 PRO 24 HB1 PRO 24 17.117 6.545 5.704 182 HG2 PRO 24 HG2 PRO 24 15.429 4.126 5.414 183 HG3 PRO 24 HG1 PRO 24 15.235 5.518 6.491 184 HD2 PRO 24 HD2 PRO 24 13.793 5.207 4.221 185 HD3 PRO 24 HD1 PRO 24 14.221 6.791 4.890 186 H GLU 25 HN GLU 25 18.870 5.884 2.107 187 HA GLU 25 HA GLU 25 18.521 3.574 0.623 188 HB2 GLU 25 HB2 GLU 25 21.225 4.638 1.424 189 HB3 GLU 25 HB1 GLU 25 20.792 3.805 -0.059 190 HG2 GLU 25 HG2 GLU 25 20.806 5.888 -0.900 191 HG3 GLU 25 HG1 GLU 25 19.165 5.922 -0.251 192 H ASP 26 HN ASP 26 20.037 4.020 3.734 193 HA ASP 26 HA ASP 26 21.247 1.509 4.027 194 HB2 ASP 26 HB2 ASP 26 21.870 3.206 5.565 195 HB3 ASP 26 HB1 ASP 26 20.197 3.516 6.028 196 H LEU 27 HN LEU 27 17.952 2.597 4.743 197 HA LEU 27 HA LEU 27 17.179 0.101 5.919 198 HB2 LEU 27 HB2 LEU 27 16.101 2.344 6.354 199 HB3 LEU 27 HB1 LEU 27 15.384 2.218 4.760 200 HG LEU 27 HG LEU 27 14.799 -0.167 6.263 201 HD11 LEU 27 HD11 LEU 27 13.411 0.845 7.996 202 HD12 LEU 27 HD12 LEU 27 14.025 2.439 7.557 203 HD13 LEU 27 HD13 LEU 27 15.119 1.224 8.220 204 HD21 LEU 27 HD21 LEU 27 13.558 0.680 4.309 205 HD22 LEU 27 HD22 LEU 27 13.036 2.070 5.263 206 HD23 LEU 27 HD23 LEU 27 12.514 0.445 5.711 207 H ILE 28 HN ILE 28 16.954 1.589 2.761 208 HA ILE 28 HA ILE 28 15.211 -0.145 1.474 209 HB ILE 28 HB ILE 28 17.600 1.327 0.370 210 HG12 ILE 28 HG12 ILE 28 14.658 2.035 0.399 211 HG13 ILE 28 HG11 ILE 28 15.851 2.670 1.528 212 HG21 ILE 28 HG21 ILE 28 15.481 -0.280 -0.973 213 HG22 ILE 28 HG22 ILE 28 17.189 -0.104 -1.373 214 HG23 ILE 28 HG23 ILE 28 16.057 1.192 -1.754 215 HD11 ILE 28 HD11 ILE 28 17.059 3.469 -0.625 216 HD12 ILE 28 HD12 ILE 28 15.671 4.362 -0.002 217 HD13 ILE 28 HD13 ILE 28 15.473 3.259 -1.367 218 H LYS 29 HN LYS 29 18.615 -0.588 2.243 219 HA LYS 29 HA LYS 29 19.055 -2.835 0.595 220 HB2 LYS 29 HB2 LYS 29 20.403 -1.660 2.987 221 HB3 LYS 29 HB1 LYS 29 20.895 -3.237 2.399 222 HG2 LYS 29 HG2 LYS 29 22.070 -1.034 1.620 223 HG3 LYS 29 HG1 LYS 29 21.863 -2.409 0.538 224 HD2 LYS 29 HD2 LYS 29 19.845 -1.315 -0.384 225 HD3 LYS 29 HD1 LYS 29 20.147 0.072 0.666 226 HE2 LYS 29 HE2 LYS 29 21.004 0.592 -1.503 227 HE3 LYS 29 HE1 LYS 29 22.377 0.321 -0.431 228 HZ1 LYS 29 HZ1 LYS 29 21.271 -1.740 -2.261 229 HZ2 LYS 29 HZ2 LYS 29 22.699 -1.839 -1.360 230 HZ3 LYS 29 HZ3 LYS 29 22.583 -0.744 -2.640 231 H MET 30 HN MET 30 17.882 -2.529 3.927 232 HA MET 30 HA MET 30 17.862 -5.438 4.166 233 HB2 MET 30 HB2 MET 30 17.004 -4.942 6.502 234 HB3 MET 30 HB1 MET 30 18.638 -4.435 6.122 235 HG2 MET 30 HG2 MET 30 17.745 -2.140 5.717 236 HG3 MET 30 HG1 MET 30 16.198 -2.708 6.357 237 HE1 MET 30 HE1 MET 30 18.551 -0.402 7.313 238 HE2 MET 30 HE2 MET 30 18.228 -0.420 9.047 239 HE3 MET 30 HE3 MET 30 16.890 -0.378 7.900 240 H ALA 31 HN ALA 31 15.692 -2.776 3.777 241 HA ALA 31 HA ALA 31 13.259 -4.018 4.376 242 HB1 ALA 31 HB1 ALA 31 12.248 -2.252 3.005 243 HB2 ALA 31 HB2 ALA 31 13.832 -1.858 2.347 244 HB3 ALA 31 HB3 ALA 31 13.503 -1.606 4.061 245 H ARG 32 HN ARG 32 15.309 -4.267 1.584 246 HA ARG 32 HA ARG 32 13.441 -5.181 -0.296 247 HB2 ARG 32 HB2 ARG 32 15.294 -5.805 -1.616 248 HB3 ARG 32 HB1 ARG 32 15.839 -4.427 -0.672 249 HG2 ARG 32 HG2 ARG 32 16.918 -5.996 0.915 250 HG3 ARG 32 HG1 ARG 32 16.485 -7.321 -0.171 251 HD2 ARG 32 HD2 ARG 32 18.248 -4.956 -0.798 252 HD3 ARG 32 HD1 ARG 32 18.759 -6.631 -0.601 253 HE ARG 32 HE ARG 32 17.406 -7.129 -2.616 254 HH11 ARG 32 HH11 ARG 32 18.610 -3.875 -2.081 255 HH12 ARG 32 HH12 ARG 32 18.479 -3.422 -3.750 256 HH21 ARG 32 HH21 ARG 32 17.244 -6.515 -4.812 257 HH22 ARG 32 HH22 ARG 32 17.693 -4.902 -5.287 258 H ASP 33 HN ASP 33 14.685 -6.725 2.499 259 HA ASP 33 HA ASP 33 13.727 -9.330 1.507 260 HB2 ASP 33 HB2 ASP 33 16.154 -9.206 2.103 261 HB3 ASP 33 HB1 ASP 33 15.684 -8.851 3.759 262 H ILE 34 HN ILE 34 12.808 -6.785 3.327 263 HA ILE 34 HA ILE 34 11.463 -8.429 5.358 264 HB ILE 34 HB ILE 34 11.923 -5.443 5.322 265 HG12 ILE 34 HG12 ILE 34 13.365 -7.765 6.477 266 HG13 ILE 34 HG11 ILE 34 13.984 -6.220 5.921 267 HG21 ILE 34 HG21 ILE 34 10.567 -7.182 7.384 268 HG22 ILE 34 HG22 ILE 34 9.820 -5.911 6.415 269 HG23 ILE 34 HG23 ILE 34 11.023 -5.497 7.636 270 HD11 ILE 34 HD11 ILE 34 12.414 -6.369 8.454 271 HD12 ILE 34 HD12 ILE 34 13.642 -5.206 7.948 272 HD13 ILE 34 HD13 ILE 34 14.114 -6.834 8.421 273 H LYS 35 HN LYS 35 9.516 -9.019 4.796 274 HA LYS 35 HA LYS 35 7.835 -7.093 3.336 275 HB2 LYS 35 HB2 LYS 35 7.430 -10.070 3.204 276 HB3 LYS 35 HB1 LYS 35 6.855 -8.831 2.096 277 HG2 LYS 35 HG2 LYS 35 8.591 -9.269 0.787 278 HG3 LYS 35 HG1 LYS 35 9.653 -8.657 2.056 279 HD2 LYS 35 HD2 LYS 35 9.627 -10.941 3.066 280 HD3 LYS 35 HD1 LYS 35 8.739 -11.498 1.648 281 HE2 LYS 35 HE2 LYS 35 10.647 -10.609 0.256 282 HE3 LYS 35 HE1 LYS 35 11.530 -10.383 1.762 283 HZ1 LYS 35 HZ1 LYS 35 10.366 -13.008 1.105 284 HZ2 LYS 35 HZ2 LYS 35 11.664 -12.645 2.128 285 HZ3 LYS 35 HZ3 LYS 35 11.854 -12.545 0.451 286 HA PRO 36 HA PRO 36 5.783 -7.797 7.393 287 HB2 PRO 36 HB2 PRO 36 4.801 -5.067 6.961 288 HB3 PRO 36 HB1 PRO 36 5.759 -5.710 8.306 289 HG2 PRO 36 HG2 PRO 36 6.777 -3.998 6.513 290 HG3 PRO 36 HG1 PRO 36 7.752 -5.254 7.300 291 HD2 PRO 36 HD2 PRO 36 6.588 -5.226 4.551 292 HD3 PRO 36 HD1 PRO 36 8.171 -5.806 5.101 293 H ILE 37 HN ILE 37 3.508 -7.749 7.944 294 HA ILE 37 HA ILE 37 1.871 -8.182 5.573 295 HB ILE 37 HB ILE 37 1.940 -9.943 7.300 296 HG12 ILE 37 HG12 ILE 37 -0.170 -9.233 5.838 297 HG13 ILE 37 HG11 ILE 37 -0.245 -10.555 6.993 298 HG21 ILE 37 HG21 ILE 37 2.218 -8.632 9.290 299 HG22 ILE 37 HG22 ILE 37 0.752 -9.601 9.438 300 HG23 ILE 37 HG23 ILE 37 0.638 -7.881 9.065 301 HD11 ILE 37 HD11 ILE 37 -1.099 -7.745 7.601 302 HD12 ILE 37 HD12 ILE 37 -1.336 -9.178 8.605 303 HD13 ILE 37 HD13 ILE 37 -2.185 -9.026 7.066 304 H VAL 38 HN VAL 38 0.032 -7.041 5.114 305 HA VAL 38 HA VAL 38 -0.222 -4.470 6.500 306 HB VAL 38 HB VAL 38 -1.402 -5.402 3.877 307 HG11 VAL 38 HG11 VAL 38 -2.848 -3.751 4.873 308 HG12 VAL 38 HG12 VAL 38 -1.964 -3.013 3.539 309 HG13 VAL 38 HG13 VAL 38 -1.477 -2.696 5.202 310 HG21 VAL 38 HG21 VAL 38 1.048 -5.119 3.872 311 HG22 VAL 38 HG22 VAL 38 0.836 -3.453 4.408 312 HG23 VAL 38 HG23 VAL 38 0.227 -3.957 2.832 313 H GLU 39 HN GLU 39 -1.641 -4.435 8.111 314 HA GLU 39 HA GLU 39 -3.927 -6.233 8.127 315 HB2 GLU 39 HB2 GLU 39 -2.517 -4.552 10.129 316 HB3 GLU 39 HB1 GLU 39 -4.236 -4.810 10.389 317 HG2 GLU 39 HG2 GLU 39 -3.993 -7.016 10.825 318 HG3 GLU 39 HG1 GLU 39 -2.596 -7.180 9.764 319 H ILE 40 HN ILE 40 -5.939 -5.649 7.610 320 HA ILE 40 HA ILE 40 -6.508 -2.776 7.436 321 HB ILE 40 HB ILE 40 -6.098 -3.524 5.175 322 HG12 ILE 40 HG12 ILE 40 -8.131 -1.996 5.847 323 HG13 ILE 40 HG11 ILE 40 -7.908 -2.511 4.182 324 HG21 ILE 40 HG21 ILE 40 -6.430 -5.835 5.215 325 HG22 ILE 40 HG22 ILE 40 -7.681 -5.209 4.137 326 HG23 ILE 40 HG23 ILE 40 -8.090 -5.676 5.787 327 HD11 ILE 40 HD11 ILE 40 -9.750 -3.837 6.152 328 HD12 ILE 40 HD12 ILE 40 -9.592 -4.210 4.435 329 HD13 ILE 40 HD13 ILE 40 -10.240 -2.652 4.945 330 H GLN 41 HN GLN 41 -8.297 -2.139 8.368 331 HA GLN 41 HA GLN 41 -10.274 -4.155 9.213 332 HB2 GLN 41 HB2 GLN 41 -9.782 -1.486 10.544 333 HB3 GLN 41 HB1 GLN 41 -10.723 -2.838 11.158 334 HG2 GLN 41 HG2 GLN 41 -8.783 -4.124 11.568 335 HG3 GLN 41 HG1 GLN 41 -7.764 -2.997 10.676 336 HE21 GLN 41 HE21 GLN 41 -10.276 -2.120 12.968 337 HE22 GLN 41 HE22 GLN 41 -9.214 -1.427 14.145 338 H GLN 42 HN GLN 42 -12.159 -3.975 8.185 339 HA GLN 42 HA GLN 42 -12.813 -1.356 7.011 340 HB2 GLN 42 HB2 GLN 42 -12.952 -2.550 5.118 341 HB3 GLN 42 HB1 GLN 42 -12.988 -4.078 5.975 342 HG2 GLN 42 HG2 GLN 42 -15.315 -4.030 6.204 343 HG3 GLN 42 HG1 GLN 42 -15.402 -2.316 5.810 344 HE21 GLN 42 HE21 GLN 42 -16.828 -2.547 4.151 345 HE22 GLN 42 HE22 GLN 42 -16.420 -3.295 2.648 346 H LYS 43 HN LYS 43 -14.854 -0.511 7.237 347 HA LYS 43 HA LYS 43 -16.810 -1.888 8.898 348 HB2 LYS 43 HB2 LYS 43 -15.352 -0.654 10.495 349 HB3 LYS 43 HB1 LYS 43 -15.728 0.841 9.649 350 HG2 LYS 43 HG2 LYS 43 -18.133 0.434 10.187 351 HG3 LYS 43 HG1 LYS 43 -17.614 -0.913 11.197 352 HD2 LYS 43 HD2 LYS 43 -16.381 0.545 12.631 353 HD3 LYS 43 HD1 LYS 43 -16.632 1.914 11.546 354 HE2 LYS 43 HE2 LYS 43 -18.955 0.459 12.761 355 HE3 LYS 43 HE1 LYS 43 -18.107 1.717 13.662 356 HZ1 LYS 43 HZ1 LYS 43 -19.146 2.196 10.930 357 HZ2 LYS 43 HZ2 LYS 43 -18.735 3.330 12.116 358 HZ3 LYS 43 HZ3 LYS 43 -20.127 2.390 12.291 359 H GLY 44 HN GLY 44 -18.254 -1.871 7.233 360 HA2 GLY 44 HA2 GLY 44 -19.931 -1.000 5.920 361 HA3 GLY 44 HA1 GLY 44 -19.654 0.554 6.704 362 H ASP 45 HN ASP 45 -18.385 2.065 5.727 363 HA ASP 45 HA ASP 45 -17.271 1.332 3.102 364 HB2 ASP 45 HB2 ASP 45 -18.609 3.911 3.926 365 HB3 ASP 45 HB1 ASP 45 -17.726 3.700 2.419 366 H ASP 46 HN ASP 46 -16.610 2.452 6.188 367 HA ASP 46 HA ASP 46 -14.297 4.030 5.373 368 HB2 ASP 46 HB2 ASP 46 -15.916 4.638 7.305 369 HB3 ASP 46 HB1 ASP 46 -15.019 3.435 8.222 370 H PHE 47 HN PHE 47 -12.265 3.362 5.506 371 HA PHE 47 HA PHE 47 -11.778 0.665 6.599 372 HB2 PHE 47 HB2 PHE 47 -10.603 1.996 4.159 373 HB3 PHE 47 HB1 PHE 47 -9.894 0.569 4.897 374 HD1 PHE 47 HD2 PHE 47 -13.402 1.545 4.054 375 HD2 PHE 47 HD1 PHE 47 -10.242 -1.258 3.597 376 HE1 PHE 47 HE2 PHE 47 -14.868 0.120 2.691 377 HE2 PHE 47 HE1 PHE 47 -11.700 -2.681 2.228 378 HZ PHE 47 HZ PHE 47 -14.017 -1.996 1.776 379 H VAL 48 HN VAL 48 -9.870 0.304 7.639 380 HA VAL 48 HA VAL 48 -8.163 2.619 8.230 381 HB VAL 48 HB VAL 48 -9.145 0.587 10.259 382 HG11 VAL 48 HG11 VAL 48 -7.041 2.715 10.381 383 HG12 VAL 48 HG12 VAL 48 -6.958 1.035 10.922 384 HG13 VAL 48 HG13 VAL 48 -7.907 2.212 11.832 385 HG21 VAL 48 HG21 VAL 48 -10.665 2.541 9.526 386 HG22 VAL 48 HG22 VAL 48 -9.526 3.554 10.412 387 HG23 VAL 48 HG23 VAL 48 -10.407 2.277 11.250 388 H VAL 49 HN VAL 49 -6.440 2.044 7.063 389 HA VAL 49 HA VAL 49 -5.486 -0.711 7.112 390 HB VAL 49 HB VAL 49 -4.464 1.647 5.525 391 HG11 VAL 49 HG11 VAL 49 -3.938 -1.296 5.158 392 HG12 VAL 49 HG12 VAL 49 -2.809 -0.154 5.877 393 HG13 VAL 49 HG13 VAL 49 -3.278 0.016 4.188 394 HG21 VAL 49 HG21 VAL 49 -6.430 1.381 4.455 395 HG22 VAL 49 HG22 VAL 49 -6.673 -0.247 5.080 396 HG23 VAL 49 HG23 VAL 49 -5.606 0.016 3.702 397 H THR 50 HN THR 50 -3.758 -1.363 8.206 398 HA THR 50 HA THR 50 -2.227 0.662 9.697 399 HB THR 50 HB THR 50 -2.670 -2.247 10.364 400 HG1 THR 50 HG1 THR 50 -4.499 -0.656 10.549 401 HG21 THR 50 HG21 THR 50 -1.752 -1.570 12.587 402 HG22 THR 50 HG22 THR 50 -1.309 -0.019 11.876 403 HG23 THR 50 HG23 THR 50 -0.578 -1.508 11.273 404 H SER 51 HN SER 51 -0.313 1.024 8.772 405 HA SER 51 HA SER 51 1.049 -1.158 7.366 406 HB2 SER 51 HB2 SER 51 1.788 1.778 7.435 407 HB3 SER 51 HB1 SER 51 2.377 0.549 6.311 408 HG SER 51 HG SER 51 -0.354 0.769 6.377 409 H LYS 52 HN LYS 52 2.188 -2.352 8.741 410 HA LYS 52 HA LYS 52 3.525 -1.147 11.025 411 HB2 LYS 52 HB2 LYS 52 3.404 -4.056 10.208 412 HB3 LYS 52 HB1 LYS 52 3.944 -3.424 11.759 413 HG2 LYS 52 HG2 LYS 52 1.679 -2.572 12.184 414 HG3 LYS 52 HG1 LYS 52 1.151 -3.256 10.642 415 HD2 LYS 52 HD2 LYS 52 2.204 -4.771 13.032 416 HD3 LYS 52 HD1 LYS 52 0.545 -4.760 12.435 417 HE2 LYS 52 HE2 LYS 52 1.358 -5.751 10.312 418 HE3 LYS 52 HE1 LYS 52 2.965 -5.862 11.023 419 HZ1 LYS 52 HZ1 LYS 52 0.511 -7.264 11.913 420 HZ2 LYS 52 HZ2 LYS 52 1.956 -7.248 12.799 421 HZ3 LYS 52 HZ3 LYS 52 1.917 -7.958 11.267 422 H THR 53 HN THR 53 5.603 -0.643 11.066 423 HA THR 53 HA THR 53 7.486 -1.960 9.207 424 HB THR 53 HB THR 53 8.421 0.094 8.468 425 HG1 THR 53 HG1 THR 53 6.819 1.770 10.027 426 HG21 THR 53 HG21 THR 53 6.669 1.246 7.388 427 HG22 THR 53 HG22 THR 53 5.509 0.823 8.648 428 HG23 THR 53 HG23 THR 53 6.120 -0.422 7.554 429 HA PRO 54 HA PRO 54 10.291 -2.201 12.665 430 HB2 PRO 54 HB2 PRO 54 12.642 -1.224 11.682 431 HB3 PRO 54 HB1 PRO 54 11.985 -2.802 11.192 432 HG2 PRO 54 HG2 PRO 54 11.681 -0.155 9.833 433 HG3 PRO 54 HG1 PRO 54 12.230 -1.697 9.156 434 HD2 PRO 54 HD2 PRO 54 9.746 -0.987 8.795 435 HD3 PRO 54 HD1 PRO 54 10.095 -2.655 9.281 436 H ARG 55 HN ARG 55 10.274 0.855 10.949 437 HA ARG 55 HA ARG 55 11.480 2.345 13.074 438 HB2 ARG 55 HB2 ARG 55 10.339 2.961 10.390 439 HB3 ARG 55 HB1 ARG 55 10.568 4.281 11.527 440 HG2 ARG 55 HG2 ARG 55 12.928 3.792 11.676 441 HG3 ARG 55 HG1 ARG 55 12.721 2.373 10.647 442 HD2 ARG 55 HD2 ARG 55 13.602 4.200 9.334 443 HD3 ARG 55 HD1 ARG 55 11.961 3.837 8.817 444 HE ARG 55 HE ARG 55 11.220 5.840 9.835 445 HH11 ARG 55 HH11 ARG 55 14.698 5.438 9.940 446 HH12 ARG 55 HH12 ARG 55 15.009 7.117 10.231 447 HH21 ARG 55 HH21 ARG 55 11.648 8.059 10.248 448 HH22 ARG 55 HH22 ARG 55 13.290 8.600 10.394 449 H GLN 56 HN GLN 56 8.236 2.512 11.576 450 HA GLN 56 HA GLN 56 6.968 2.713 14.134 451 HB2 GLN 56 HB2 GLN 56 7.976 5.041 13.610 452 HB3 GLN 56 HB1 GLN 56 6.693 5.164 12.414 453 HG2 GLN 56 HG2 GLN 56 5.010 4.962 14.108 454 HG3 GLN 56 HG1 GLN 56 6.231 4.627 15.338 455 HE21 GLN 56 HE21 GLN 56 4.728 7.052 13.384 456 HE22 GLN 56 HE22 GLN 56 5.410 8.418 14.193 457 H THR 57 HN THR 57 4.850 2.177 13.998 458 HA THR 57 HA THR 57 3.849 1.378 11.407 459 HB THR 57 HB THR 57 2.703 1.123 14.192 460 HG1 THR 57 HG1 THR 57 3.335 -1.044 13.938 461 HG21 THR 57 HG21 THR 57 1.649 0.039 11.576 462 HG22 THR 57 HG22 THR 57 0.855 1.205 12.634 463 HG23 THR 57 HG23 THR 57 1.082 -0.461 13.169 464 H VAL 58 HN VAL 58 2.649 2.621 10.154 465 HA VAL 58 HA VAL 58 1.360 4.994 11.323 466 HB VAL 58 HB VAL 58 2.342 4.445 8.519 467 HG11 VAL 58 HG11 VAL 58 1.632 6.864 8.116 468 HG12 VAL 58 HG12 VAL 58 0.593 6.668 9.527 469 HG13 VAL 58 HG13 VAL 58 0.363 5.640 8.112 470 HG21 VAL 58 HG21 VAL 58 3.087 6.543 10.549 471 HG22 VAL 58 HG22 VAL 58 3.788 6.359 8.943 472 HG23 VAL 58 HG23 VAL 58 4.029 5.103 10.161 473 H THR 59 HN THR 59 -0.756 5.478 10.918 474 HA THR 59 HA THR 59 -2.416 3.278 9.896 475 HB THR 59 HB THR 59 -3.562 5.604 11.374 476 HG1 THR 59 HG1 THR 59 -1.935 5.171 12.782 477 HG21 THR 59 HG21 THR 59 -5.060 3.888 10.561 478 HG22 THR 59 HG22 THR 59 -4.991 3.826 12.323 479 HG23 THR 59 HG23 THR 59 -4.113 2.633 11.363 480 H ASN 60 HN ASN 60 -3.877 3.599 8.290 481 HA ASN 60 HA ASN 60 -4.126 6.307 7.110 482 HB2 ASN 60 HB2 ASN 60 -3.281 3.750 5.844 483 HB3 ASN 60 HB1 ASN 60 -4.432 4.723 4.934 484 HD21 ASN 60 HD21 ASN 60 -1.902 5.906 7.090 485 HD22 ASN 60 HD22 ASN 60 -0.978 6.692 5.853 486 H SER 61 HN SER 61 -6.255 6.873 7.072 487 HA SER 61 HA SER 61 -8.244 4.694 7.015 488 HB2 SER 61 HB2 SER 61 -9.145 7.214 8.223 489 HB3 SER 61 HB1 SER 61 -9.348 5.555 8.784 490 HG SER 61 HG SER 61 -7.950 6.211 10.238 491 H PHE 62 HN PHE 62 -10.168 5.052 5.800 492 HA PHE 62 HA PHE 62 -10.579 7.530 4.426 493 HB2 PHE 62 HB2 PHE 62 -10.310 6.571 2.118 494 HB3 PHE 62 HB1 PHE 62 -8.805 6.816 2.991 495 HD1 PHE 62 HD2 PHE 62 -11.256 4.251 1.955 496 HD2 PHE 62 HD1 PHE 62 -7.324 5.045 3.358 497 HE1 PHE 62 HE2 PHE 62 -10.628 1.923 1.490 498 HE2 PHE 62 HE1 PHE 62 -6.689 2.716 2.886 499 HZ PHE 62 HZ PHE 62 -8.340 1.160 1.947 500 H THR 63 HN THR 63 -12.405 7.324 2.819 501 HA THR 63 HA THR 63 -14.244 5.192 3.661 502 HB THR 63 HB THR 63 -15.182 7.944 2.893 503 HG1 THR 63 HG1 THR 63 -14.322 7.014 5.459 504 HG21 THR 63 HG21 THR 63 -17.195 7.332 3.935 505 HG22 THR 63 HG22 THR 63 -16.439 5.989 4.793 506 HG23 THR 63 HG23 THR 63 -16.699 5.887 3.054 507 H LEU 64 HN LEU 64 -15.172 4.059 2.049 508 HA LEU 64 HA LEU 64 -14.301 4.312 -0.610 509 HB2 LEU 64 HB2 LEU 64 -16.631 2.852 0.595 510 HB3 LEU 64 HB1 LEU 64 -16.210 2.735 -1.099 511 HG LEU 64 HG LEU 64 -14.546 1.830 1.242 512 HD11 LEU 64 HD11 LEU 64 -16.154 0.458 -0.867 513 HD12 LEU 64 HD12 LEU 64 -16.141 0.200 0.878 514 HD13 LEU 64 HD13 LEU 64 -14.786 -0.354 -0.105 515 HD21 LEU 64 HD21 LEU 64 -13.875 1.858 -1.696 516 HD22 LEU 64 HD22 LEU 64 -12.949 1.021 -0.449 517 HD23 LEU 64 HD23 LEU 64 -13.071 2.780 -0.424 518 H GLY 65 HN GLY 65 -14.799 5.769 -2.056 519 HA2 GLY 65 HA2 GLY 65 -16.380 6.775 -3.529 520 HA3 GLY 65 HA1 GLY 65 -17.586 6.680 -2.254 521 H LYS 66 HN LYS 66 -14.765 7.657 -0.866 522 HA LYS 66 HA LYS 66 -15.311 10.499 -1.353 523 HB2 LYS 66 HB2 LYS 66 -15.215 9.055 1.272 524 HB3 LYS 66 HB1 LYS 66 -14.796 10.760 1.175 525 HG2 LYS 66 HG2 LYS 66 -17.003 11.241 0.248 526 HG3 LYS 66 HG1 LYS 66 -17.421 9.529 0.351 527 HD2 LYS 66 HD2 LYS 66 -17.184 9.584 2.758 528 HD3 LYS 66 HD1 LYS 66 -16.645 11.263 2.691 529 HE2 LYS 66 HE2 LYS 66 -18.796 11.963 1.853 530 HE3 LYS 66 HE1 LYS 66 -19.335 10.289 1.755 531 HZ1 LYS 66 HZ1 LYS 66 -18.461 11.411 4.336 532 HZ2 LYS 66 HZ2 LYS 66 -19.514 10.122 4.032 533 HZ3 LYS 66 HZ3 LYS 66 -20.024 11.709 3.764 534 H GLU 67 HN GLU 67 -13.590 11.887 -0.528 535 HA GLU 67 HA GLU 67 -10.962 10.717 -1.067 536 HB2 GLU 67 HB2 GLU 67 -11.656 12.658 -2.411 537 HB3 GLU 67 HB1 GLU 67 -11.938 13.582 -0.943 538 HG2 GLU 67 HG2 GLU 67 -9.470 13.225 -0.447 539 HG3 GLU 67 HG1 GLU 67 -9.334 12.706 -2.129 540 H ALA 68 HN ALA 68 -9.516 10.461 0.604 541 HA ALA 68 HA ALA 68 -10.129 11.888 3.106 542 HB1 ALA 68 HB1 ALA 68 -10.815 9.484 3.157 543 HB2 ALA 68 HB2 ALA 68 -9.664 9.959 4.405 544 HB3 ALA 68 HB3 ALA 68 -9.110 9.064 2.992 545 H ASP 69 HN ASP 69 -8.442 12.485 4.385 546 HA ASP 69 HA ASP 69 -5.907 12.818 3.031 547 HB2 ASP 69 HB2 ASP 69 -6.521 14.771 4.122 548 HB3 ASP 69 HB1 ASP 69 -7.157 13.925 5.520 549 H ILE 70 HN ILE 70 -4.359 11.394 3.205 550 HA ILE 70 HA ILE 70 -4.166 9.789 5.666 551 HB ILE 70 HB ILE 70 -3.258 7.926 4.199 552 HG12 ILE 70 HG12 ILE 70 -4.565 8.101 1.886 553 HG13 ILE 70 HG11 ILE 70 -4.206 9.811 2.109 554 HG21 ILE 70 HG21 ILE 70 -6.133 8.752 4.132 555 HG22 ILE 70 HG22 ILE 70 -5.343 7.617 5.227 556 HG23 ILE 70 HG23 ILE 70 -5.574 7.191 3.530 557 HD11 ILE 70 HD11 ILE 70 -2.419 9.006 0.853 558 HD12 ILE 70 HD12 ILE 70 -2.313 7.513 1.786 559 HD13 ILE 70 HD13 ILE 70 -1.789 9.038 2.502 560 H THR 71 HN THR 71 -1.994 8.840 6.018 561 HA THR 71 HA THR 71 0.049 10.765 5.066 562 HB THR 71 HB THR 71 0.251 9.313 7.680 563 HG1 THR 71 HG1 THR 71 -1.776 10.606 7.433 564 HG21 THR 71 HG21 THR 71 2.274 10.408 6.920 565 HG22 THR 71 HG22 THR 71 1.608 11.328 8.269 566 HG23 THR 71 HG23 THR 71 1.394 11.906 6.615 567 H THR 72 HN THR 72 2.073 9.996 4.506 568 HA THR 72 HA THR 72 2.215 7.090 4.150 569 HB THR 72 HB THR 72 2.490 8.368 2.090 570 HG1 THR 72 HG1 THR 72 4.664 7.515 1.570 571 HG21 THR 72 HG21 THR 72 3.404 10.441 3.037 572 HG22 THR 72 HG22 THR 72 4.420 9.823 1.736 573 HG23 THR 72 HG23 THR 72 4.908 9.603 3.414 574 H MET 73 HN MET 73 4.462 6.162 4.325 575 HA MET 73 HA MET 73 5.421 6.492 6.958 576 HB2 MET 73 HB2 MET 73 5.584 4.505 5.184 577 HB3 MET 73 HB1 MET 73 7.163 5.226 4.909 578 HG2 MET 73 HG2 MET 73 7.349 3.451 6.508 579 HG3 MET 73 HG1 MET 73 7.671 4.994 7.297 580 HE1 MET 73 HE1 MET 73 3.938 3.763 6.409 581 HE2 MET 73 HE2 MET 73 3.708 2.653 7.760 582 HE3 MET 73 HE3 MET 73 4.939 2.318 6.543 583 H ASP 74 HN ASP 74 6.214 8.062 4.013 584 HA ASP 74 HA ASP 74 8.849 8.885 4.722 585 HB2 ASP 74 HB2 ASP 74 8.621 8.946 2.452 586 HB3 ASP 74 HB1 ASP 74 6.935 9.432 2.523 587 H GLY 75 HN GLY 75 5.660 10.157 5.302 588 HA2 GLY 75 HA2 GLY 75 5.379 11.633 7.203 589 HA3 GLY 75 HA1 GLY 75 6.905 12.390 6.772 590 H LYS 76 HN LYS 76 4.888 11.692 4.130 591 HA LYS 76 HA LYS 76 4.202 14.537 3.911 592 HB2 LYS 76 HB2 LYS 76 4.920 12.444 1.938 593 HB3 LYS 76 HB1 LYS 76 3.714 13.627 1.440 594 HG2 LYS 76 HG2 LYS 76 5.431 15.364 2.315 595 HG3 LYS 76 HG1 LYS 76 6.586 14.038 2.154 596 HD2 LYS 76 HD2 LYS 76 4.758 14.940 -0.051 597 HD3 LYS 76 HD1 LYS 76 6.396 15.555 0.164 598 HE2 LYS 76 HE2 LYS 76 7.189 13.158 0.047 599 HE3 LYS 76 HE1 LYS 76 5.552 12.724 -0.432 600 HZ1 LYS 76 HZ1 LYS 76 5.761 14.183 -2.349 601 HZ2 LYS 76 HZ2 LYS 76 6.964 12.997 -2.352 602 HZ3 LYS 76 HZ3 LYS 76 7.345 14.579 -1.900 603 H LYS 77 HN LYS 77 2.128 15.128 3.151 604 HA LYS 77 HA LYS 77 0.051 13.217 3.933 605 HB2 LYS 77 HB2 LYS 77 0.168 16.206 3.771 606 HB3 LYS 77 HB1 LYS 77 -1.388 15.390 3.730 607 HG2 LYS 77 HG2 LYS 77 0.668 15.234 5.921 608 HG3 LYS 77 HG1 LYS 77 -0.878 16.082 5.976 609 HD2 LYS 77 HD2 LYS 77 -1.885 13.751 5.451 610 HD3 LYS 77 HD1 LYS 77 -0.322 13.143 6.003 611 HE2 LYS 77 HE2 LYS 77 -1.787 13.129 7.879 612 HE3 LYS 77 HE1 LYS 77 -0.659 14.461 8.105 613 HZ1 LYS 77 HZ1 LYS 77 -2.366 15.971 7.249 614 HZ2 LYS 77 HZ2 LYS 77 -2.879 15.163 8.642 615 HZ3 LYS 77 HZ3 LYS 77 -3.456 14.679 7.122 616 H LEU 78 HN LEU 78 -1.224 12.313 2.480 617 HA LEU 78 HA LEU 78 -1.486 13.581 -0.162 618 HB2 LEU 78 HB2 LEU 78 -1.476 10.606 0.019 619 HB3 LEU 78 HB1 LEU 78 -1.058 11.642 -1.330 620 HG LEU 78 HG LEU 78 0.756 11.693 1.019 621 HD11 LEU 78 HD11 LEU 78 0.158 9.282 0.622 622 HD12 LEU 78 HD12 LEU 78 1.863 9.680 0.438 623 HD13 LEU 78 HD13 LEU 78 0.854 9.453 -0.988 624 HD21 LEU 78 HD21 LEU 78 1.340 11.546 -1.928 625 HD22 LEU 78 HD22 LEU 78 2.412 12.085 -0.633 626 HD23 LEU 78 HD23 LEU 78 1.015 13.062 -1.086 627 H LYS 79 HN LYS 79 -3.467 13.096 -1.233 628 HA LYS 79 HA LYS 79 -5.513 12.020 0.586 629 HB2 LYS 79 HB2 LYS 79 -7.129 13.508 -0.629 630 HB3 LYS 79 HB1 LYS 79 -5.947 14.346 0.366 631 HG2 LYS 79 HG2 LYS 79 -4.697 15.021 -1.539 632 HG3 LYS 79 HG1 LYS 79 -5.636 13.968 -2.601 633 HD2 LYS 79 HD2 LYS 79 -7.655 15.374 -1.724 634 HD3 LYS 79 HD1 LYS 79 -6.404 16.556 -1.330 635 HE2 LYS 79 HE2 LYS 79 -5.820 16.864 -3.555 636 HE3 LYS 79 HE1 LYS 79 -6.510 15.320 -4.050 637 HZ1 LYS 79 HZ1 LYS 79 -8.725 16.235 -3.590 638 HZ2 LYS 79 HZ2 LYS 79 -7.909 17.109 -4.791 639 HZ3 LYS 79 HZ3 LYS 79 -8.023 17.735 -3.226 640 H CYS 80 HN CYS 80 -6.217 10.131 -0.077 641 HA CYS 80 HA CYS 80 -6.138 9.551 -2.961 642 HB2 CYS 80 HB2 CYS 80 -4.897 8.110 -1.191 643 HB3 CYS 80 HB1 CYS 80 -6.495 7.457 -0.841 644 H THR 81 HN THR 81 -7.939 9.291 -4.072 645 HA THR 81 HA THR 81 -10.490 9.209 -2.620 646 HB THR 81 HB THR 81 -10.175 9.608 -5.594 647 HG1 THR 81 HG1 THR 81 -8.990 11.172 -4.081 648 HG21 THR 81 HG21 THR 81 -12.428 9.122 -4.774 649 HG22 THR 81 HG22 THR 81 -12.321 10.785 -5.356 650 HG23 THR 81 HG23 THR 81 -12.307 10.453 -3.623 651 H VAL 82 HN VAL 82 -10.729 7.091 -2.103 652 HA VAL 82 HA VAL 82 -10.460 5.096 -4.242 653 HB VAL 82 HB VAL 82 -9.085 4.723 -2.220 654 HG11 VAL 82 HG11 VAL 82 -10.220 4.060 -0.136 655 HG12 VAL 82 HG12 VAL 82 -11.745 4.591 -0.845 656 HG13 VAL 82 HG13 VAL 82 -10.450 5.756 -0.568 657 HG21 VAL 82 HG21 VAL 82 -11.283 2.739 -2.739 658 HG22 VAL 82 HG22 VAL 82 -9.873 2.398 -1.737 659 HG23 VAL 82 HG23 VAL 82 -9.669 2.775 -3.450 660 H HIS 83 HN HIS 83 -12.063 3.592 -4.614 661 HA HIS 83 HA HIS 83 -14.525 3.642 -3.115 662 HB2 HIS 83 HB2 HIS 83 -15.896 3.922 -5.219 663 HB3 HIS 83 HB1 HIS 83 -15.143 5.377 -4.600 664 HD1 HIS 83 HD1 HIS 83 -15.596 3.504 -7.642 665 HD2 HIS 83 HD2 HIS 83 -12.689 6.057 -6.127 666 HE1 HIS 83 HE1 HIS 83 -14.243 4.238 -9.623 667 HE2 HIS 83 HE2 HIS 83 -12.599 5.911 -8.707 668 H LEU 84 HN LEU 84 -15.877 1.879 -3.616 669 HA LEU 84 HA LEU 84 -14.383 -0.369 -4.621 670 HB2 LEU 84 HB2 LEU 84 -15.758 -0.528 -2.572 671 HB3 LEU 84 HB1 LEU 84 -17.199 -0.231 -3.533 672 HG LEU 84 HG LEU 84 -16.761 -2.618 -2.867 673 HD11 LEU 84 HD11 LEU 84 -18.327 -2.075 -4.630 674 HD12 LEU 84 HD12 LEU 84 -17.476 -3.585 -4.955 675 HD13 LEU 84 HD13 LEU 84 -17.012 -2.111 -5.804 676 HD21 LEU 84 HD21 LEU 84 -14.561 -2.392 -4.880 677 HD22 LEU 84 HD22 LEU 84 -15.170 -3.900 -4.200 678 HD23 LEU 84 HD23 LEU 84 -14.393 -2.712 -3.153 679 H ALA 85 HN ALA 85 -14.774 -1.440 -6.431 680 HA ALA 85 HA ALA 85 -16.978 -0.708 -8.172 681 HB1 ALA 85 HB1 ALA 85 -15.163 0.964 -8.613 682 HB2 ALA 85 HB2 ALA 85 -15.639 0.009 -10.018 683 HB3 ALA 85 HB3 ALA 85 -14.148 -0.373 -9.158 684 H ASN 86 HN ASN 86 -17.753 -2.672 -8.531 685 HA ASN 86 HA ASN 86 -17.961 -4.803 -9.240 686 HB2 ASN 86 HB2 ASN 86 -15.337 -4.307 -10.666 687 HB3 ASN 86 HB1 ASN 86 -16.456 -5.624 -10.992 688 HD21 ASN 86 HD21 ASN 86 -15.582 -2.473 -11.749 689 HD22 ASN 86 HD22 ASN 86 -16.952 -2.058 -12.717 690 H GLY 87 HN GLY 87 -16.463 -4.215 -6.742 691 HA2 GLY 87 HA2 GLY 87 -15.768 -5.766 -5.122 692 HA3 GLY 87 HA1 GLY 87 -15.398 -6.906 -6.403 693 H LYS 88 HN LYS 88 -14.153 -3.889 -7.140 694 HA LYS 88 HA LYS 88 -11.518 -4.604 -6.039 695 HB2 LYS 88 HB2 LYS 88 -12.226 -3.390 -8.710 696 HB3 LYS 88 HB1 LYS 88 -10.597 -3.326 -8.050 697 HG2 LYS 88 HG2 LYS 88 -10.509 -5.168 -9.435 698 HG3 LYS 88 HG1 LYS 88 -10.837 -5.892 -7.861 699 HD2 LYS 88 HD2 LYS 88 -13.335 -5.559 -8.608 700 HD3 LYS 88 HD1 LYS 88 -12.616 -5.599 -10.220 701 HE2 LYS 88 HE2 LYS 88 -11.529 -7.752 -9.621 702 HE3 LYS 88 HE1 LYS 88 -12.397 -7.715 -8.083 703 HZ1 LYS 88 HZ1 LYS 88 -13.654 -9.060 -9.530 704 HZ2 LYS 88 HZ2 LYS 88 -13.542 -7.960 -10.811 705 HZ3 LYS 88 HZ3 LYS 88 -14.482 -7.586 -9.456 706 H LEU 89 HN LEU 89 -10.198 -2.840 -5.335 707 HA LEU 89 HA LEU 89 -11.809 -0.491 -4.663 708 HB2 LEU 89 HB2 LEU 89 -10.004 -2.034 -3.168 709 HB3 LEU 89 HB1 LEU 89 -9.208 -0.491 -3.433 710 HG LEU 89 HG LEU 89 -11.058 0.702 -2.447 711 HD11 LEU 89 HD11 LEU 89 -13.071 -0.199 -2.773 712 HD12 LEU 89 HD12 LEU 89 -12.741 -1.081 -1.279 713 HD13 LEU 89 HD13 LEU 89 -12.434 -1.846 -2.838 714 HD21 LEU 89 HD21 LEU 89 -11.016 -0.220 -0.166 715 HD22 LEU 89 HD22 LEU 89 -9.412 -0.067 -0.890 716 HD23 LEU 89 HD23 LEU 89 -10.193 -1.647 -0.791 717 H VAL 90 HN VAL 90 -11.568 1.289 -5.725 718 HA VAL 90 HA VAL 90 -9.169 1.615 -7.385 719 HB VAL 90 HB VAL 90 -11.814 3.039 -7.683 720 HG11 VAL 90 HG11 VAL 90 -9.550 3.925 -8.645 721 HG12 VAL 90 HG12 VAL 90 -11.014 3.954 -9.629 722 HG13 VAL 90 HG13 VAL 90 -9.816 2.680 -9.866 723 HG21 VAL 90 HG21 VAL 90 -10.806 0.560 -9.083 724 HG22 VAL 90 HG22 VAL 90 -12.227 1.482 -9.571 725 HG23 VAL 90 HG23 VAL 90 -12.197 0.673 -8.003 726 H CYS 91 HN CYS 91 -7.767 2.631 -6.024 727 HA CYS 91 HA CYS 91 -8.588 5.201 -4.862 728 HB2 CYS 91 HB2 CYS 91 -7.274 3.174 -3.621 729 HB3 CYS 91 HB1 CYS 91 -5.905 4.078 -4.257 730 H LYS 92 HN LYS 92 -8.325 6.677 -6.465 731 HA LYS 92 HA LYS 92 -5.752 6.598 -7.912 732 HB2 LYS 92 HB2 LYS 92 -7.820 6.124 -9.282 733 HB3 LYS 92 HB1 LYS 92 -8.338 7.770 -8.951 734 HG2 LYS 92 HG2 LYS 92 -6.471 8.672 -10.135 735 HG3 LYS 92 HG1 LYS 92 -5.741 7.073 -10.305 736 HD2 LYS 92 HD2 LYS 92 -8.401 7.879 -11.482 737 HD3 LYS 92 HD1 LYS 92 -6.873 7.897 -12.364 738 HE2 LYS 92 HE2 LYS 92 -6.681 5.426 -11.697 739 HE3 LYS 92 HE1 LYS 92 -8.388 5.540 -11.283 740 HZ1 LYS 92 HZ1 LYS 92 -7.160 5.985 -13.946 741 HZ2 LYS 92 HZ2 LYS 92 -8.776 6.337 -13.591 742 HZ3 LYS 92 HZ3 LYS 92 -8.217 4.742 -13.500 743 H SER 93 HN SER 93 -4.640 8.444 -8.247 744 HA SER 93 HA SER 93 -5.434 10.725 -6.576 745 HB2 SER 93 HB2 SER 93 -2.682 10.306 -7.710 746 HB3 SER 93 HB1 SER 93 -3.164 11.174 -6.251 747 HG SER 93 HG SER 93 -3.717 9.133 -5.341 748 H GLU 94 HN GLU 94 -3.724 12.613 -7.781 749 HA GLU 94 HA GLU 94 -5.316 13.242 -10.118 750 HB2 GLU 94 HB2 GLU 94 -3.057 14.877 -8.965 751 HB3 GLU 94 HB1 GLU 94 -4.372 15.429 -9.995 752 HG2 GLU 94 HG2 GLU 94 -5.944 14.810 -8.141 753 HG3 GLU 94 HG1 GLU 94 -4.523 14.563 -7.123 754 H LYS 95 HN LYS 95 -2.052 12.275 -9.356 755 HA LYS 95 HA LYS 95 -1.439 12.249 -12.241 756 HB2 LYS 95 HB2 LYS 95 -0.158 13.902 -10.819 757 HB3 LYS 95 HB1 LYS 95 0.566 12.520 -10.001 758 HG2 LYS 95 HG2 LYS 95 1.427 11.747 -12.195 759 HG3 LYS 95 HG1 LYS 95 0.810 13.232 -12.913 760 HD2 LYS 95 HD2 LYS 95 2.831 13.095 -10.678 761 HD3 LYS 95 HD1 LYS 95 3.217 13.342 -12.379 762 HE2 LYS 95 HE2 LYS 95 1.767 15.379 -12.326 763 HE3 LYS 95 HE1 LYS 95 1.629 15.164 -10.585 764 HZ1 LYS 95 HZ1 LYS 95 4.068 15.320 -10.455 765 HZ2 LYS 95 HZ2 LYS 95 3.355 16.731 -11.047 766 HZ3 LYS 95 HZ3 LYS 95 4.126 15.664 -12.108 767 H PHE 96 HN PHE 96 -1.863 10.361 -9.467 768 HA PHE 96 HA PHE 96 -0.461 8.133 -10.757 769 HB2 PHE 96 HB2 PHE 96 -0.566 8.355 -7.767 770 HB3 PHE 96 HB1 PHE 96 0.535 7.416 -8.767 771 HD1 PHE 96 HD2 PHE 96 2.482 8.449 -9.775 772 HD2 PHE 96 HD1 PHE 96 -0.185 10.704 -7.346 773 HE1 PHE 96 HE2 PHE 96 4.160 10.236 -9.597 774 HE2 PHE 96 HE1 PHE 96 1.488 12.497 -7.163 775 HZ PHE 96 HZ PHE 96 3.667 12.264 -8.289 776 H SER 97 HN SER 97 -1.209 5.995 -9.707 777 HA SER 97 HA SER 97 -3.919 6.078 -8.697 778 HB2 SER 97 HB2 SER 97 -3.430 4.411 -11.152 779 HB3 SER 97 HB1 SER 97 -4.962 4.948 -10.461 780 HG SER 97 HG SER 97 -3.725 7.144 -11.031 781 H HIS 98 HN HIS 98 -4.294 4.427 -7.342 782 HA HIS 98 HA HIS 98 -2.266 2.310 -7.199 783 HB2 HIS 98 HB2 HIS 98 -2.637 3.769 -5.179 784 HB3 HIS 98 HB1 HIS 98 -4.270 3.124 -5.085 785 HD2 HIS 98 HD2 HIS 98 -3.652 -0.067 -5.397 786 HE1 HIS 98 HE1 HIS 98 -0.908 0.589 -2.233 787 HE2 HIS 98 HE2 HIS 98 -2.286 -1.150 -3.454 788 H GLU 99 HN GLU 99 -2.835 0.449 -8.041 789 HA GLU 99 HA GLU 99 -5.689 -0.122 -8.402 790 HB2 GLU 99 HB2 GLU 99 -4.532 -0.399 -10.406 791 HB3 GLU 99 HB1 GLU 99 -3.142 -1.128 -9.618 792 HG2 GLU 99 HG2 GLU 99 -4.375 -3.158 -9.235 793 HG3 GLU 99 HG1 GLU 99 -5.831 -2.433 -9.916 794 H GLN 100 HN GLN 100 -6.745 -1.567 -7.169 795 HA GLN 100 HA GLN 100 -5.220 -3.663 -5.792 796 HB2 GLN 100 HB2 GLN 100 -7.055 -1.646 -4.547 797 HB3 GLN 100 HB1 GLN 100 -6.950 -3.263 -3.863 798 HG2 GLN 100 HG2 GLN 100 -4.382 -2.807 -3.943 799 HG3 GLN 100 HG1 GLN 100 -4.892 -1.121 -3.985 800 HE21 GLN 100 HE21 GLN 100 -3.441 -2.633 -1.936 801 HE22 GLN 100 HE22 GLN 100 -4.384 -2.472 -0.490 802 H GLU 101 HN GLU 101 -5.968 -5.491 -6.615 803 HA GLU 101 HA GLU 101 -8.879 -5.759 -7.007 804 HB2 GLU 101 HB2 GLU 101 -7.652 -5.739 -9.126 805 HB3 GLU 101 HB1 GLU 101 -6.638 -7.058 -8.569 806 HG2 GLU 101 HG2 GLU 101 -8.408 -8.602 -8.659 807 HG3 GLU 101 HG1 GLU 101 -9.610 -7.322 -8.803 808 H VAL 102 HN VAL 102 -9.761 -7.078 -5.536 809 HA VAL 102 HA VAL 102 -8.110 -9.159 -4.311 810 HB VAL 102 HB VAL 102 -10.778 -7.988 -3.520 811 HG11 VAL 102 HG11 VAL 102 -10.891 -10.347 -3.025 812 HG12 VAL 102 HG12 VAL 102 -10.646 -9.451 -1.523 813 HG13 VAL 102 HG13 VAL 102 -9.294 -10.296 -2.274 814 HG21 VAL 102 HG21 VAL 102 -8.889 -6.607 -2.940 815 HG22 VAL 102 HG22 VAL 102 -8.057 -7.986 -2.220 816 HG23 VAL 102 HG23 VAL 102 -9.527 -7.356 -1.478 817 H LYS 103 HN LYS 103 -8.248 -11.169 -4.961 818 HA LYS 103 HA LYS 103 -10.739 -12.133 -6.185 819 HB2 LYS 103 HB2 LYS 103 -7.915 -12.356 -7.182 820 HB3 LYS 103 HB1 LYS 103 -9.082 -13.614 -7.571 821 HG2 LYS 103 HG2 LYS 103 -10.423 -12.142 -8.810 822 HG3 LYS 103 HG1 LYS 103 -9.630 -10.717 -8.136 823 HD2 LYS 103 HD2 LYS 103 -7.684 -11.067 -9.409 824 HD3 LYS 103 HD1 LYS 103 -8.137 -12.726 -9.798 825 HE2 LYS 103 HE2 LYS 103 -9.809 -12.017 -11.307 826 HE3 LYS 103 HE1 LYS 103 -9.755 -10.361 -10.704 827 HZ1 LYS 103 HZ1 LYS 103 -8.605 -10.903 -12.912 828 HZ2 LYS 103 HZ2 LYS 103 -7.382 -11.583 -11.962 829 HZ3 LYS 103 HZ3 LYS 103 -7.770 -9.942 -11.794 830 H GLY 104 HN GLY 104 -11.485 -13.370 -4.566 831 HA2 GLY 104 HA2 GLY 104 -11.683 -15.224 -3.230 832 HA3 GLY 104 HA1 GLY 104 -10.241 -15.859 -4.002 833 H ASN 105 HN ASN 105 -8.431 -15.975 -2.862 834 HA ASN 105 HA ASN 105 -8.338 -14.562 -0.275 835 HB2 ASN 105 HB2 ASN 105 -6.829 -16.411 0.470 836 HB3 ASN 105 HB1 ASN 105 -8.465 -16.940 0.096 837 HD21 ASN 105 HD21 ASN 105 -5.133 -17.135 -0.745 838 HD22 ASN 105 HD22 ASN 105 -5.293 -18.360 -1.956 839 H GLU 106 HN GLU 106 -7.382 -13.821 -3.046 840 HA GLU 106 HA GLU 106 -4.642 -13.134 -2.228 841 HB2 GLU 106 HB2 GLU 106 -5.565 -14.208 -4.883 842 HB3 GLU 106 HB1 GLU 106 -4.080 -13.279 -4.725 843 HG2 GLU 106 HG2 GLU 106 -3.395 -14.972 -2.960 844 HG3 GLU 106 HG1 GLU 106 -4.744 -15.951 -3.538 845 H MET 107 HN MET 107 -3.902 -11.122 -2.886 846 HA MET 107 HA MET 107 -5.901 -9.389 -4.171 847 HB2 MET 107 HB2 MET 107 -5.896 -8.800 -1.851 848 HB3 MET 107 HB1 MET 107 -4.142 -8.778 -1.798 849 HG2 MET 107 HG2 MET 107 -3.994 -6.752 -2.885 850 HG3 MET 107 HG1 MET 107 -5.584 -6.911 -3.627 851 HE1 MET 107 HE1 MET 107 -3.857 -7.120 -0.357 852 HE2 MET 107 HE2 MET 107 -4.979 -6.457 0.832 853 HE3 MET 107 HE3 MET 107 -3.887 -5.385 -0.050 854 H VAL 108 HN VAL 108 -5.206 -8.576 -5.981 855 HA VAL 108 HA VAL 108 -2.321 -8.490 -6.551 856 HB VAL 108 HB VAL 108 -4.727 -8.376 -8.387 857 HG11 VAL 108 HG11 VAL 108 -3.217 -8.410 -10.245 858 HG12 VAL 108 HG12 VAL 108 -1.824 -8.510 -9.168 859 HG13 VAL 108 HG13 VAL 108 -2.806 -7.044 -9.207 860 HG21 VAL 108 HG21 VAL 108 -2.644 -10.545 -8.171 861 HG22 VAL 108 HG22 VAL 108 -4.159 -10.580 -9.077 862 HG23 VAL 108 HG23 VAL 108 -4.188 -10.585 -7.313 863 H GLU 109 HN GLU 109 -1.449 -6.508 -6.083 864 HA GLU 109 HA GLU 109 -3.024 -4.173 -6.906 865 HB2 GLU 109 HB2 GLU 109 -2.671 -3.051 -4.958 866 HB3 GLU 109 HB1 GLU 109 -2.729 -4.696 -4.346 867 HG2 GLU 109 HG2 GLU 109 -0.222 -4.713 -4.459 868 HG3 GLU 109 HG1 GLU 109 -0.305 -2.984 -4.809 869 H THR 110 HN THR 110 -2.037 -2.616 -7.987 870 HA THR 110 HA THR 110 0.868 -2.799 -8.409 871 HB THR 110 HB THR 110 -0.901 -2.015 -10.691 872 HG1 THR 110 HG1 THR 110 -1.747 -3.949 -10.706 873 HG21 THR 110 HG21 THR 110 0.944 -2.855 -12.019 874 HG22 THR 110 HG22 THR 110 1.748 -3.452 -10.568 875 HG23 THR 110 HG23 THR 110 1.540 -1.718 -10.812 876 H ILE 111 HN ILE 111 1.796 -0.897 -7.879 877 HA ILE 111 HA ILE 111 0.114 1.527 -8.087 878 HB ILE 111 HB ILE 111 2.422 1.645 -6.255 879 HG12 ILE 111 HG12 ILE 111 -0.015 0.111 -5.355 880 HG13 ILE 111 HG11 ILE 111 1.445 -0.690 -5.920 881 HG21 ILE 111 HG21 ILE 111 0.708 2.764 -4.828 882 HG22 ILE 111 HG22 ILE 111 -0.468 2.469 -6.112 883 HG23 ILE 111 HG23 ILE 111 0.929 3.497 -6.418 884 HD11 ILE 111 HD11 ILE 111 2.717 0.323 -4.135 885 HD12 ILE 111 HD12 ILE 111 1.330 -0.559 -3.488 886 HD13 ILE 111 HD13 ILE 111 1.285 1.202 -3.598 887 H THR 112 HN THR 112 1.426 3.555 -8.285 888 HA THR 112 HA THR 112 4.077 3.299 -9.438 889 HB THR 112 HB THR 112 1.892 4.648 -11.033 890 HG1 THR 112 HG1 THR 112 2.660 2.007 -10.914 891 HG21 THR 112 HG21 THR 112 4.730 3.910 -11.760 892 HG22 THR 112 HG22 THR 112 4.181 5.526 -11.314 893 HG23 THR 112 HG23 THR 112 3.570 4.765 -12.784 894 H PHE 113 HN PHE 113 5.149 4.733 -8.255 895 HA PHE 113 HA PHE 113 4.132 7.463 -8.091 896 HB2 PHE 113 HB2 PHE 113 4.447 5.622 -5.797 897 HB3 PHE 113 HB1 PHE 113 5.117 7.231 -5.582 898 HD1 PHE 113 HD2 PHE 113 2.062 5.283 -6.070 899 HD2 PHE 113 HD1 PHE 113 3.691 9.159 -5.431 900 HE1 PHE 113 HE2 PHE 113 -0.180 6.121 -5.507 901 HE2 PHE 113 HE1 PHE 113 1.454 10.012 -4.864 902 HZ PHE 113 HZ PHE 113 -0.489 8.488 -4.898 903 H GLY 114 HN GLY 114 5.759 8.997 -7.958 904 HA2 GLY 114 HA2 GLY 114 7.874 9.866 -8.164 905 HA3 GLY 114 HA1 GLY 114 8.450 8.434 -7.326 906 H GLY 115 HN GLY 115 6.625 7.951 -10.183 907 HA2 GLY 115 HA2 GLY 115 7.236 7.497 -12.368 908 HA3 GLY 115 HA1 GLY 115 8.889 7.938 -11.974 909 H VAL 116 HN VAL 116 7.603 5.699 -9.765 910 HA VAL 116 HA VAL 116 8.873 3.477 -11.232 911 HB VAL 116 HB VAL 116 8.790 3.763 -8.230 912 HG11 VAL 116 HG11 VAL 116 10.610 2.044 -8.379 913 HG12 VAL 116 HG12 VAL 116 10.215 1.883 -10.093 914 HG13 VAL 116 HG13 VAL 116 9.005 1.498 -8.869 915 HG21 VAL 116 HG21 VAL 116 10.141 5.563 -9.022 916 HG22 VAL 116 HG22 VAL 116 10.986 4.504 -10.152 917 HG23 VAL 116 HG23 VAL 116 11.220 4.306 -8.413 918 H THR 117 HN THR 117 7.689 1.692 -11.519 919 HA THR 117 HA THR 117 5.004 1.638 -10.370 920 HB THR 117 HB THR 117 6.130 -0.230 -12.453 921 HG1 THR 117 HG1 THR 117 5.993 2.273 -12.823 922 HG21 THR 117 HG21 THR 117 4.008 -0.849 -11.264 923 HG22 THR 117 HG22 THR 117 3.851 -0.679 -13.012 924 HG23 THR 117 HG23 THR 117 3.279 0.605 -11.943 925 H LEU 118 HN LEU 118 5.397 0.904 -8.255 926 HA LEU 118 HA LEU 118 6.912 -1.509 -7.840 927 HB2 LEU 118 HB2 LEU 118 6.961 0.148 -6.081 928 HB3 LEU 118 HB1 LEU 118 5.215 0.123 -5.953 929 HG LEU 118 HG LEU 118 5.219 -2.059 -4.971 930 HD11 LEU 118 HD11 LEU 118 6.727 -3.426 -5.950 931 HD12 LEU 118 HD12 LEU 118 7.662 -3.012 -4.513 932 HD13 LEU 118 HD13 LEU 118 7.976 -2.185 -6.041 933 HD21 LEU 118 HD21 LEU 118 7.567 -0.772 -3.628 934 HD22 LEU 118 HD22 LEU 118 6.214 -1.652 -2.915 935 HD23 LEU 118 HD23 LEU 118 5.963 -0.033 -3.570 936 H ILE 119 HN ILE 119 6.139 -3.405 -8.310 937 HA ILE 119 HA ILE 119 3.256 -3.838 -8.295 938 HB ILE 119 HB ILE 119 5.527 -5.539 -9.322 939 HG12 ILE 119 HG12 ILE 119 3.694 -3.517 -10.500 940 HG13 ILE 119 HG11 ILE 119 5.377 -3.863 -10.876 941 HG21 ILE 119 HG21 ILE 119 3.505 -6.729 -10.469 942 HG22 ILE 119 HG22 ILE 119 2.595 -6.064 -9.111 943 HG23 ILE 119 HG23 ILE 119 3.956 -7.145 -8.815 944 HD11 ILE 119 HD11 ILE 119 3.003 -5.496 -11.744 945 HD12 ILE 119 HD12 ILE 119 4.690 -5.825 -12.140 946 HD13 ILE 119 HD13 ILE 119 3.912 -4.365 -12.743 947 H ARG 120 HN ARG 120 2.331 -4.634 -6.511 948 HA ARG 120 HA ARG 120 3.962 -6.382 -4.788 949 HB2 ARG 120 HB2 ARG 120 1.813 -4.413 -3.991 950 HB3 ARG 120 HB1 ARG 120 2.531 -5.586 -2.899 951 HG2 ARG 120 HG2 ARG 120 4.771 -4.452 -3.631 952 HG3 ARG 120 HG1 ARG 120 3.702 -3.116 -4.073 953 HD2 ARG 120 HD2 ARG 120 4.259 -4.297 -1.377 954 HD3 ARG 120 HD1 ARG 120 4.278 -2.610 -1.883 955 HE ARG 120 HE ARG 120 1.651 -3.589 -2.127 956 HH11 ARG 120 HH11 ARG 120 3.969 -2.842 0.400 957 HH12 ARG 120 HH12 ARG 120 2.750 -2.473 1.573 958 HH21 ARG 120 HH21 ARG 120 0.067 -3.117 -0.621 959 HH22 ARG 120 HH22 ARG 120 0.508 -2.617 0.987 960 H ARG 121 HN ARG 121 3.139 -8.314 -4.286 961 HA ARG 121 HA ARG 121 0.360 -8.863 -5.102 962 HB2 ARG 121 HB2 ARG 121 2.618 -10.864 -4.866 963 HB3 ARG 121 HB1 ARG 121 1.009 -11.158 -5.516 964 HG2 ARG 121 HG2 ARG 121 2.923 -9.193 -6.725 965 HG3 ARG 121 HG1 ARG 121 2.873 -10.893 -7.182 966 HD2 ARG 121 HD2 ARG 121 1.426 -10.145 -8.741 967 HD3 ARG 121 HD1 ARG 121 0.270 -10.272 -7.413 968 HE ARG 121 HE ARG 121 0.984 -7.792 -7.048 969 HH11 ARG 121 HH11 ARG 121 0.587 -9.412 -10.133 970 HH12 ARG 121 HH12 ARG 121 0.085 -7.979 -10.969 971 HH21 ARG 121 HH21 ARG 121 0.342 -5.889 -8.163 972 HH22 ARG 121 HH22 ARG 121 -0.055 -5.980 -9.856 973 H SER 122 HN SER 122 -0.971 -9.725 -3.551 974 HA SER 122 HA SER 122 0.321 -10.304 -0.973 975 HB2 SER 122 HB2 SER 122 -1.040 -8.060 -1.248 976 HB3 SER 122 HB1 SER 122 -2.416 -9.124 -0.979 977 HG SER 122 HG SER 122 -0.782 -8.100 0.813 978 H LYS 123 HN LYS 123 -0.501 -11.870 0.286 979 HA LYS 123 HA LYS 123 -2.631 -13.551 -0.866 980 HB2 LYS 123 HB2 LYS 123 -1.386 -15.481 0.221 981 HB3 LYS 123 HB1 LYS 123 -0.604 -14.770 -1.183 982 HG2 LYS 123 HG2 LYS 123 1.124 -13.937 0.017 983 HG3 LYS 123 HG1 LYS 123 0.147 -13.682 1.464 984 HD2 LYS 123 HD2 LYS 123 1.717 -15.436 1.917 985 HD3 LYS 123 HD1 LYS 123 0.110 -16.155 1.786 986 HE2 LYS 123 HE2 LYS 123 0.565 -16.953 -0.415 987 HE3 LYS 123 HE1 LYS 123 2.079 -16.050 -0.489 988 HZ1 LYS 123 HZ1 LYS 123 3.017 -17.462 1.158 989 HZ2 LYS 123 HZ2 LYS 123 2.341 -18.452 -0.031 990 HZ3 LYS 123 HZ3 LYS 123 1.541 -18.239 1.443 991 H ARG 124 HN ARG 124 -4.163 -14.284 0.577 992 HA ARG 124 HA ARG 124 -4.258 -12.915 3.112 993 HB2 ARG 124 HB2 ARG 124 -6.186 -13.571 1.422 994 HB3 ARG 124 HB1 ARG 124 -6.204 -15.047 2.377 995 HG2 ARG 124 HG2 ARG 124 -6.682 -13.830 4.380 996 HG3 ARG 124 HG1 ARG 124 -6.472 -12.290 3.544 997 HD2 ARG 124 HD2 ARG 124 -8.786 -12.579 3.633 998 HD3 ARG 124 HD1 ARG 124 -8.347 -13.074 2.003 999 HE ARG 124 HE ARG 124 -8.301 -15.420 3.223 1000 HH11 ARG 124 HH11 ARG 124 -10.633 -12.830 3.495 1001 HH12 ARG 124 HH12 ARG 124 -11.963 -13.890 3.834 1002 HH21 ARG 124 HH21 ARG 124 -10.053 -16.831 3.672 1003 HH22 ARG 124 HH22 ARG 124 -11.638 -16.171 3.938 1004 H VAL 125 HN VAL 125 -4.446 -13.940 5.152 1005 HA VAL 125 HA VAL 125 -3.299 -16.642 5.227 1006 HB VAL 125 HB VAL 125 -2.778 -14.401 7.195 1007 HG11 VAL 125 HG11 VAL 125 -1.786 -17.249 7.137 1008 HG12 VAL 125 HG12 VAL 125 -2.821 -16.502 8.356 1009 HG13 VAL 125 HG13 VAL 125 -1.143 -15.986 8.189 1010 HG21 VAL 125 HG21 VAL 125 -1.582 -14.077 5.087 1011 HG22 VAL 125 HG22 VAL 125 -0.928 -15.710 5.199 1012 HG23 VAL 125 HG23 VAL 125 -0.463 -14.492 6.388 Start of MODEL 4 1 H1 ALA 1 HT1 ALA 1 -14.430 -9.578 2.309 2 H2 ALA 1 HT2 ALA 1 -14.103 -9.772 0.662 3 H3 ALA 1 HT3 ALA 1 -15.657 -9.347 1.171 4 HA ALA 1 HA ALA 1 -14.506 -7.443 0.260 5 HB1 ALA 1 HB1 ALA 1 -14.770 -5.932 2.204 6 HB2 ALA 1 HB2 ALA 1 -14.950 -7.346 3.242 7 HB3 ALA 1 HB3 ALA 1 -16.139 -7.021 1.982 8 H PHE 2 HN PHE 2 -12.936 -5.625 1.262 9 HA PHE 2 HA PHE 2 -10.327 -6.763 1.111 10 HB2 PHE 2 HB2 PHE 2 -11.489 -4.056 1.310 11 HB3 PHE 2 HB1 PHE 2 -9.844 -4.229 1.907 12 HD1 PHE 2 HD1 PHE 2 -11.846 -5.359 -1.049 13 HD2 PHE 2 HD2 PHE 2 -8.195 -3.720 0.407 14 HE1 PHE 2 HE1 PHE 2 -11.002 -5.185 -3.361 15 HE2 PHE 2 HE2 PHE 2 -7.353 -3.539 -1.903 16 HZ PHE 2 HZ PHE 2 -8.755 -4.281 -3.787 17 H SER 3 HN SER 3 -12.437 -5.850 3.723 18 HA SER 3 HA SER 3 -10.603 -5.529 5.794 19 HB2 SER 3 HB2 SER 3 -13.190 -5.228 5.780 20 HB3 SER 3 HB1 SER 3 -13.230 -6.931 6.230 21 HG SER 3 HG SER 3 -12.256 -6.480 8.120 22 H GLY 4 HN GLY 4 -9.172 -6.856 6.618 23 HA2 GLY 4 HA2 GLY 4 -9.453 -9.353 7.610 24 HA3 GLY 4 HA1 GLY 4 -9.146 -9.648 5.901 25 H THR 5 HN THR 5 -7.175 -10.621 6.270 26 HA THR 5 HA THR 5 -5.024 -8.722 6.861 27 HB THR 5 HB THR 5 -3.841 -10.719 7.980 28 HG1 THR 5 HG1 THR 5 -6.429 -11.654 7.702 29 HG21 THR 5 HG21 THR 5 -4.478 -8.689 9.174 30 HG22 THR 5 HG22 THR 5 -4.734 -10.114 10.178 31 HG23 THR 5 HG23 THR 5 -6.109 -9.328 9.401 32 H TRP 6 HN TRP 6 -3.752 -8.675 5.115 33 HA TRP 6 HA TRP 6 -3.486 -11.176 3.561 34 HB2 TRP 6 HB2 TRP 6 -2.971 -8.428 2.437 35 HB3 TRP 6 HB1 TRP 6 -3.303 -9.926 1.575 36 HD1 TRP 6 HD1 TRP 6 -5.132 -7.295 3.736 37 HE1 TRP 6 HE1 TRP 6 -7.618 -7.275 3.051 38 HE3 TRP 6 HE3 TRP 6 -5.117 -11.253 0.475 39 HZ2 TRP 6 HZ2 TRP 6 -9.340 -8.742 1.359 40 HZ3 TRP 6 HZ3 TRP 6 -7.231 -11.880 -0.618 41 HH2 TRP 6 HH2 TRP 6 -9.297 -10.647 -0.185 42 H GLN 7 HN GLN 7 -1.568 -12.039 3.385 43 HA GLN 7 HA GLN 7 0.759 -10.616 4.413 44 HB2 GLN 7 HB2 GLN 7 0.187 -13.481 3.681 45 HB3 GLN 7 HB1 GLN 7 1.827 -12.930 3.995 46 HG2 GLN 7 HG2 GLN 7 0.890 -12.062 6.223 47 HG3 GLN 7 HG1 GLN 7 -0.494 -13.097 5.875 48 HE21 GLN 7 HE21 GLN 7 -0.256 -15.316 5.950 49 HE22 GLN 7 HE22 GLN 7 1.143 -16.077 6.635 50 H VAL 8 HN VAL 8 1.592 -9.306 2.969 51 HA VAL 8 HA VAL 8 1.457 -9.773 0.149 52 HB VAL 8 HB VAL 8 1.260 -7.527 1.224 53 HG11 VAL 8 HG11 VAL 8 2.979 -7.554 2.849 54 HG12 VAL 8 HG12 VAL 8 3.422 -6.334 1.655 55 HG13 VAL 8 HG13 VAL 8 4.213 -7.911 1.639 56 HG21 VAL 8 HG21 VAL 8 3.174 -8.056 -1.013 57 HG22 VAL 8 HG22 VAL 8 2.782 -6.412 -0.511 58 HG23 VAL 8 HG23 VAL 8 1.505 -7.486 -1.079 59 H TYR 9 HN TYR 9 3.075 -10.161 -1.300 60 HA TYR 9 HA TYR 9 5.817 -10.512 -0.435 61 HB2 TYR 9 HB2 TYR 9 6.012 -12.825 -1.030 62 HB3 TYR 9 HB1 TYR 9 4.636 -12.705 0.056 63 HD1 TYR 9 HD1 TYR 9 2.302 -12.918 -0.871 64 HD2 TYR 9 HD2 TYR 9 5.762 -13.570 -3.266 65 HE1 TYR 9 HE1 TYR 9 0.926 -14.050 -2.537 66 HE2 TYR 9 HE2 TYR 9 4.384 -14.700 -4.956 67 HH TYR 9 HH TYR 9 1.034 -14.530 -5.011 68 H ALA 10 HN ALA 10 7.202 -10.070 -2.088 69 HA ALA 10 HA ALA 10 6.820 -10.501 -4.803 70 HB1 ALA 10 HB1 ALA 10 4.982 -8.893 -4.644 71 HB2 ALA 10 HB2 ALA 10 6.287 -8.282 -5.662 72 HB3 ALA 10 HB3 ALA 10 6.095 -7.678 -4.014 73 H GLN 11 HN GLN 11 8.461 -9.494 -6.130 74 HA GLN 11 HA GLN 11 10.568 -8.073 -4.689 75 HB2 GLN 11 HB2 GLN 11 10.773 -10.778 -5.906 76 HB3 GLN 11 HB1 GLN 11 12.132 -9.692 -6.122 77 HG2 GLN 11 HG2 GLN 11 10.962 -10.565 -3.497 78 HG3 GLN 11 HG1 GLN 11 12.478 -11.117 -4.203 79 HE21 GLN 11 HE21 GLN 11 10.845 -8.564 -2.552 80 HE22 GLN 11 HE22 GLN 11 12.252 -7.616 -2.193 81 H GLU 12 HN GLU 12 8.749 -7.016 -6.505 82 HA GLU 12 HA GLU 12 10.505 -6.479 -8.800 83 HB2 GLU 12 HB2 GLU 12 7.499 -6.553 -8.785 84 HB3 GLU 12 HB1 GLU 12 8.469 -5.967 -10.118 85 HG2 GLU 12 HG2 GLU 12 9.537 -8.200 -10.239 86 HG3 GLU 12 HG1 GLU 12 8.375 -8.764 -9.041 87 H ASN 13 HN ASN 13 10.695 -4.491 -9.453 88 HA ASN 13 HA ASN 13 11.344 -2.331 -8.838 89 HB2 ASN 13 HB2 ASN 13 8.379 -2.048 -9.299 90 HB3 ASN 13 HB1 ASN 13 9.630 -0.854 -9.609 91 HD21 ASN 13 HD21 ASN 13 7.624 -2.847 -11.074 92 HD22 ASN 13 HD22 ASN 13 8.527 -3.252 -12.494 93 H TYR 14 HN TYR 14 11.386 -3.347 -6.446 94 HA TYR 14 HA TYR 14 9.577 -1.804 -4.749 95 HB2 TYR 14 HB2 TYR 14 9.773 -4.251 -4.366 96 HB3 TYR 14 HB1 TYR 14 11.482 -4.033 -4.013 97 HD1 TYR 14 HD1 TYR 14 12.145 -2.676 -2.018 98 HD2 TYR 14 HD2 TYR 14 8.129 -3.887 -2.708 99 HE1 TYR 14 HE1 TYR 14 11.620 -2.240 0.333 100 HE2 TYR 14 HE2 TYR 14 7.585 -3.449 -0.349 101 HH TYR 14 HH TYR 14 9.280 -3.383 1.955 102 H GLU 15 HN GLU 15 13.003 -2.761 -4.725 103 HA GLU 15 HA GLU 15 13.797 -0.690 -2.970 104 HB2 GLU 15 HB2 GLU 15 16.129 -1.280 -3.735 105 HB3 GLU 15 HB1 GLU 15 15.188 -2.613 -3.084 106 HG2 GLU 15 HG2 GLU 15 14.583 -3.065 -5.556 107 HG3 GLU 15 HG1 GLU 15 15.998 -2.075 -5.902 108 H GLU 16 HN GLU 16 13.486 -0.885 -6.424 109 HA GLU 16 HA GLU 16 14.978 1.496 -6.980 110 HB2 GLU 16 HB2 GLU 16 13.213 -0.330 -8.560 111 HB3 GLU 16 HB1 GLU 16 13.647 1.243 -9.224 112 HG2 GLU 16 HG2 GLU 16 15.799 0.658 -9.565 113 HG3 GLU 16 HG1 GLU 16 15.859 -0.373 -8.136 114 H PHE 17 HN PHE 17 11.696 0.732 -6.178 115 HA PHE 17 HA PHE 17 10.581 3.243 -6.999 116 HB2 PHE 17 HB2 PHE 17 9.355 1.011 -6.744 117 HB3 PHE 17 HB1 PHE 17 9.436 1.272 -5.012 118 HD1 PHE 17 HD1 PHE 17 8.694 4.119 -4.745 119 HD2 PHE 17 HD2 PHE 17 7.245 1.121 -7.383 120 HE1 PHE 17 HE1 PHE 17 6.486 5.212 -4.792 121 HE2 PHE 17 HE2 PHE 17 5.052 2.209 -7.446 122 HZ PHE 17 HZ PHE 17 4.663 4.245 -6.142 123 H LEU 18 HN LEU 18 11.995 1.835 -4.129 124 HA LEU 18 HA LEU 18 11.216 3.760 -2.242 125 HB2 LEU 18 HB2 LEU 18 13.825 2.248 -2.293 126 HB3 LEU 18 HB1 LEU 18 13.080 2.997 -0.893 127 HG LEU 18 HG LEU 18 12.122 0.556 -2.389 128 HD11 LEU 18 HD11 LEU 18 13.887 0.029 -0.887 129 HD12 LEU 18 HD12 LEU 18 12.378 -0.463 -0.116 130 HD13 LEU 18 HD13 LEU 18 13.182 1.023 0.388 131 HD21 LEU 18 HD21 LEU 18 10.311 0.462 -0.727 132 HD22 LEU 18 HD22 LEU 18 10.180 1.854 -1.802 133 HD23 LEU 18 HD23 LEU 18 10.774 2.065 -0.153 134 H LYS 19 HN LYS 19 13.978 3.598 -4.427 135 HA LYS 19 HA LYS 19 15.210 5.984 -3.498 136 HB2 LYS 19 HB2 LYS 19 15.543 4.890 -6.283 137 HB3 LYS 19 HB1 LYS 19 16.717 5.754 -5.302 138 HG2 LYS 19 HG2 LYS 19 16.233 3.532 -3.788 139 HG3 LYS 19 HG1 LYS 19 16.100 2.906 -5.428 140 HD2 LYS 19 HD2 LYS 19 18.283 3.663 -5.979 141 HD3 LYS 19 HD1 LYS 19 18.410 4.584 -4.481 142 HE2 LYS 19 HE2 LYS 19 18.328 2.493 -3.203 143 HE3 LYS 19 HE1 LYS 19 18.243 1.584 -4.710 144 HZ1 LYS 19 HZ1 LYS 19 20.504 3.228 -3.708 145 HZ2 LYS 19 HZ2 LYS 19 20.419 2.637 -5.295 146 HZ3 LYS 19 HZ3 LYS 19 20.481 1.555 -3.998 147 H ALA 20 HN ALA 20 12.467 5.371 -5.397 148 HA ALA 20 HA ALA 20 12.602 7.844 -6.872 149 HB1 ALA 20 HB1 ALA 20 10.689 7.132 -8.037 150 HB2 ALA 20 HB2 ALA 20 10.276 5.960 -6.784 151 HB3 ALA 20 HB3 ALA 20 11.686 5.695 -7.813 152 H LEU 21 HN LEU 21 11.999 7.219 -3.813 153 HA LEU 21 HA LEU 21 9.998 9.369 -3.607 154 HB2 LEU 21 HB2 LEU 21 10.344 7.019 -1.749 155 HB3 LEU 21 HB1 LEU 21 9.153 8.295 -1.583 156 HG LEU 21 HG LEU 21 9.173 6.654 -4.082 157 HD11 LEU 21 HD11 LEU 21 9.265 4.963 -2.380 158 HD12 LEU 21 HD12 LEU 21 7.611 5.071 -2.983 159 HD13 LEU 21 HD13 LEU 21 8.032 5.796 -1.432 160 HD21 LEU 21 HD21 LEU 21 7.697 8.557 -4.003 161 HD22 LEU 21 HD22 LEU 21 7.040 8.025 -2.456 162 HD23 LEU 21 HD23 LEU 21 6.738 7.080 -3.914 163 H ALA 22 HN ALA 22 13.026 9.077 -3.545 164 HA ALA 22 HA ALA 22 14.820 9.992 -2.508 165 HB1 ALA 22 HB1 ALA 22 12.661 11.800 -1.430 166 HB2 ALA 22 HB2 ALA 22 13.691 12.073 -2.833 167 HB3 ALA 22 HB3 ALA 22 14.386 12.093 -1.214 168 H LEU 23 HN LEU 23 13.664 7.716 -1.296 169 HA LEU 23 HA LEU 23 13.569 8.125 1.553 170 HB2 LEU 23 HB2 LEU 23 13.545 5.663 -0.178 171 HB3 LEU 23 HB1 LEU 23 13.489 5.598 1.575 172 HG LEU 23 HG LEU 23 11.451 7.035 -0.131 173 HD11 LEU 23 HD11 LEU 23 11.403 4.281 1.073 174 HD12 LEU 23 HD12 LEU 23 11.250 4.730 -0.624 175 HD13 LEU 23 HD13 LEU 23 9.966 5.137 0.511 176 HD21 LEU 23 HD21 LEU 23 10.122 6.800 2.038 177 HD22 LEU 23 HD22 LEU 23 11.401 8.014 1.985 178 HD23 LEU 23 HD23 LEU 23 11.678 6.479 2.807 179 HA PRO 24 HA PRO 24 17.763 7.573 2.701 180 HB2 PRO 24 HB2 PRO 24 17.150 5.472 4.652 181 HB3 PRO 24 HB1 PRO 24 17.697 7.136 4.931 182 HG2 PRO 24 HG2 PRO 24 15.217 6.306 5.548 183 HG3 PRO 24 HG1 PRO 24 15.578 7.960 5.030 184 HD2 PRO 24 HD2 PRO 24 14.385 5.724 3.473 185 HD3 PRO 24 HD1 PRO 24 13.999 7.451 3.456 186 H GLU 25 HN GLU 25 19.148 6.611 1.393 187 HA GLU 25 HA GLU 25 19.001 4.265 0.020 188 HB2 GLU 25 HB2 GLU 25 21.394 5.743 1.098 189 HB3 GLU 25 HB1 GLU 25 21.567 4.320 0.078 190 HG2 GLU 25 HG2 GLU 25 19.964 6.715 -0.761 191 HG3 GLU 25 HG1 GLU 25 21.700 6.586 -1.038 192 H ASP 26 HN ASP 26 19.935 4.637 3.385 193 HA ASP 26 HA ASP 26 21.049 2.023 3.652 194 HB2 ASP 26 HB2 ASP 26 20.259 4.202 5.529 195 HB3 ASP 26 HB1 ASP 26 20.450 2.577 6.176 196 H LEU 27 HN LEU 27 17.890 3.480 4.337 197 HA LEU 27 HA LEU 27 16.764 1.160 5.502 198 HB2 LEU 27 HB2 LEU 27 15.940 3.625 5.529 199 HB3 LEU 27 HB1 LEU 27 15.141 3.199 4.027 200 HG LEU 27 HG LEU 27 14.452 1.167 5.849 201 HD11 LEU 27 HD11 LEU 27 15.150 2.476 7.705 202 HD12 LEU 27 HD12 LEU 27 13.389 2.528 7.636 203 HD13 LEU 27 HD13 LEU 27 14.334 3.907 7.075 204 HD21 LEU 27 HD21 LEU 27 13.118 2.162 3.989 205 HD22 LEU 27 HD22 LEU 27 12.825 3.566 5.018 206 HD23 LEU 27 HD23 LEU 27 12.232 1.977 5.502 207 H ILE 28 HN ILE 28 17.213 2.211 2.234 208 HA ILE 28 HA ILE 28 15.345 0.600 0.893 209 HB ILE 28 HB ILE 28 18.094 1.086 -0.230 210 HG12 ILE 28 HG12 ILE 28 17.518 3.221 0.753 211 HG13 ILE 28 HG11 ILE 28 17.391 3.317 -0.997 212 HG21 ILE 28 HG21 ILE 28 16.408 -0.193 -1.509 213 HG22 ILE 28 HG22 ILE 28 16.999 1.256 -2.323 214 HG23 ILE 28 HG23 ILE 28 15.412 1.261 -1.557 215 HD11 ILE 28 HD11 ILE 28 15.050 3.363 -0.910 216 HD12 ILE 28 HD12 ILE 28 15.624 4.491 0.322 217 HD13 ILE 28 HD13 ILE 28 15.024 2.893 0.790 218 H LYS 29 HN LYS 29 18.321 -0.141 2.472 219 HA LYS 29 HA LYS 29 18.850 -2.604 1.087 220 HB2 LYS 29 HB2 LYS 29 19.976 -1.440 3.643 221 HB3 LYS 29 HB1 LYS 29 20.598 -2.873 2.831 222 HG2 LYS 29 HG2 LYS 29 21.416 -1.630 1.035 223 HG3 LYS 29 HG1 LYS 29 20.413 -0.234 1.430 224 HD2 LYS 29 HD2 LYS 29 21.724 0.060 3.506 225 HD3 LYS 29 HD1 LYS 29 22.777 -1.260 2.998 226 HE2 LYS 29 HE2 LYS 29 23.503 -0.024 1.080 227 HE3 LYS 29 HE1 LYS 29 22.310 1.239 1.374 228 HZ1 LYS 29 HZ1 LYS 29 24.456 1.955 2.122 229 HZ2 LYS 29 HZ2 LYS 29 24.640 0.576 3.079 230 HZ3 LYS 29 HZ3 LYS 29 23.463 1.726 3.477 231 H MET 30 HN MET 30 17.277 -1.589 4.035 232 HA MET 30 HA MET 30 16.934 -4.305 4.966 233 HB2 MET 30 HB2 MET 30 15.762 -1.730 6.049 234 HB3 MET 30 HB1 MET 30 15.758 -3.290 6.858 235 HG2 MET 30 HG2 MET 30 17.590 -2.548 7.876 236 HG3 MET 30 HG1 MET 30 18.406 -2.934 6.362 237 HE1 MET 30 HE1 MET 30 17.070 1.296 7.610 238 HE2 MET 30 HE2 MET 30 16.941 -0.129 8.649 239 HE3 MET 30 HE3 MET 30 15.898 0.031 7.233 240 H ALA 31 HN ALA 31 14.842 -1.645 3.924 241 HA ALA 31 HA ALA 31 12.374 -2.856 4.101 242 HB1 ALA 31 HB1 ALA 31 11.653 -1.244 2.360 243 HB2 ALA 31 HB2 ALA 31 13.348 -0.829 2.106 244 HB3 ALA 31 HB3 ALA 31 12.587 -0.514 3.664 245 H ARG 32 HN ARG 32 14.760 -3.213 1.551 246 HA ARG 32 HA ARG 32 13.127 -4.346 -0.411 247 HB2 ARG 32 HB2 ARG 32 15.092 -4.916 -1.547 248 HB3 ARG 32 HB1 ARG 32 15.530 -3.502 -0.599 249 HG2 ARG 32 HG2 ARG 32 16.408 -5.134 1.135 250 HG3 ARG 32 HG1 ARG 32 16.263 -6.364 -0.122 251 HD2 ARG 32 HD2 ARG 32 17.834 -3.803 -0.367 252 HD3 ARG 32 HD1 ARG 32 18.526 -5.381 0.010 253 HE ARG 32 HE ARG 32 17.027 -4.986 -2.497 254 HH11 ARG 32 HH11 ARG 32 20.071 -5.689 -0.873 255 HH12 ARG 32 HH12 ARG 32 20.850 -6.219 -2.331 256 HH21 ARG 32 HH21 ARG 32 18.067 -5.665 -4.381 257 HH22 ARG 32 HH22 ARG 32 19.718 -6.210 -4.318 258 H ASP 33 HN ASP 33 14.081 -5.689 2.580 259 HA ASP 33 HA ASP 33 13.268 -8.358 1.625 260 HB2 ASP 33 HB2 ASP 33 15.715 -8.121 2.296 261 HB3 ASP 33 HB1 ASP 33 15.136 -7.893 3.945 262 H ILE 34 HN ILE 34 12.255 -5.813 3.358 263 HA ILE 34 HA ILE 34 11.103 -7.325 5.558 264 HB ILE 34 HB ILE 34 10.888 -4.369 4.958 265 HG12 ILE 34 HG12 ILE 34 12.681 -5.873 6.868 266 HG13 ILE 34 HG11 ILE 34 13.195 -5.117 5.369 267 HG21 ILE 34 HG21 ILE 34 9.062 -5.008 6.348 268 HG22 ILE 34 HG22 ILE 34 10.270 -4.265 7.399 269 HG23 ILE 34 HG23 ILE 34 10.100 -6.020 7.351 270 HD11 ILE 34 HD11 ILE 34 13.631 -3.878 7.547 271 HD12 ILE 34 HD12 ILE 34 11.903 -3.528 7.548 272 HD13 ILE 34 HD13 ILE 34 12.915 -2.970 6.217 273 H LYS 35 HN LYS 35 9.474 -8.535 4.860 274 HA LYS 35 HA LYS 35 7.276 -7.186 3.435 275 HB2 LYS 35 HB2 LYS 35 7.940 -10.121 3.212 276 HB3 LYS 35 HB1 LYS 35 6.784 -9.208 2.252 277 HG2 LYS 35 HG2 LYS 35 8.345 -8.639 0.781 278 HG3 LYS 35 HG1 LYS 35 9.437 -8.086 2.052 279 HD2 LYS 35 HD2 LYS 35 10.499 -9.866 0.836 280 HD3 LYS 35 HD1 LYS 35 10.094 -10.443 2.454 281 HE2 LYS 35 HE2 LYS 35 8.059 -11.499 1.522 282 HE3 LYS 35 HE1 LYS 35 8.562 -10.988 -0.092 283 HZ1 LYS 35 HZ1 LYS 35 9.926 -12.906 1.707 284 HZ2 LYS 35 HZ2 LYS 35 10.650 -12.275 0.320 285 HZ3 LYS 35 HZ3 LYS 35 9.255 -13.220 0.190 286 HA PRO 36 HA PRO 36 5.614 -8.824 7.362 287 HB2 PRO 36 HB2 PRO 36 4.347 -6.588 8.159 288 HB3 PRO 36 HB1 PRO 36 6.088 -6.813 8.405 289 HG2 PRO 36 HG2 PRO 36 4.676 -5.133 6.431 290 HG3 PRO 36 HG1 PRO 36 6.234 -4.877 7.237 291 HD2 PRO 36 HD2 PRO 36 5.867 -5.845 4.631 292 HD3 PRO 36 HD1 PRO 36 7.366 -5.908 5.577 293 H ILE 37 HN ILE 37 3.174 -8.307 8.166 294 HA ILE 37 HA ILE 37 1.506 -8.996 5.868 295 HB ILE 37 HB ILE 37 1.493 -10.521 7.801 296 HG12 ILE 37 HG12 ILE 37 -0.631 -9.790 6.317 297 HG13 ILE 37 HG11 ILE 37 -0.699 -11.046 7.551 298 HG21 ILE 37 HG21 ILE 37 1.922 -8.984 9.588 299 HG22 ILE 37 HG22 ILE 37 0.411 -9.833 9.906 300 HG23 ILE 37 HG23 ILE 37 0.382 -8.173 9.315 301 HD11 ILE 37 HD11 ILE 37 -2.550 -9.318 7.520 302 HD12 ILE 37 HD12 ILE 37 -1.358 -8.187 8.164 303 HD13 ILE 37 HD13 ILE 37 -1.779 -9.642 9.071 304 H VAL 38 HN VAL 38 -0.356 -7.841 5.338 305 HA VAL 38 HA VAL 38 -0.415 -5.107 6.418 306 HB VAL 38 HB VAL 38 -1.852 -6.150 3.967 307 HG11 VAL 38 HG11 VAL 38 -1.523 -3.533 3.507 308 HG12 VAL 38 HG12 VAL 38 -1.600 -3.506 5.269 309 HG13 VAL 38 HG13 VAL 38 -2.931 -4.195 4.341 310 HG21 VAL 38 HG21 VAL 38 0.643 -4.501 3.856 311 HG22 VAL 38 HG22 VAL 38 -0.086 -5.517 2.609 312 HG23 VAL 38 HG23 VAL 38 0.732 -6.258 3.989 313 H GLU 39 HN GLU 39 -1.780 -4.824 8.047 314 HA GLU 39 HA GLU 39 -4.170 -6.480 8.253 315 HB2 GLU 39 HB2 GLU 39 -2.611 -4.752 10.124 316 HB3 GLU 39 HB1 GLU 39 -4.331 -4.952 10.440 317 HG2 GLU 39 HG2 GLU 39 -4.118 -7.123 11.019 318 HG3 GLU 39 HG1 GLU 39 -2.806 -7.413 9.881 319 H ILE 40 HN ILE 40 -6.149 -5.779 7.795 320 HA ILE 40 HA ILE 40 -6.662 -2.914 7.613 321 HB ILE 40 HB ILE 40 -5.983 -3.558 5.354 322 HG12 ILE 40 HG12 ILE 40 -7.946 -1.912 5.883 323 HG13 ILE 40 HG11 ILE 40 -7.631 -2.395 4.222 324 HG21 ILE 40 HG21 ILE 40 -7.996 -5.708 5.715 325 HG22 ILE 40 HG22 ILE 40 -6.387 -5.766 4.995 326 HG23 ILE 40 HG23 ILE 40 -7.730 -5.050 4.100 327 HD11 ILE 40 HD11 ILE 40 -9.436 -4.064 4.404 328 HD12 ILE 40 HD12 ILE 40 -9.998 -2.409 4.648 329 HD13 ILE 40 HD13 ILE 40 -9.779 -3.479 6.034 330 H GLN 41 HN GLN 41 -8.462 -2.457 8.643 331 HA GLN 41 HA GLN 41 -10.567 -4.510 8.785 332 HB2 GLN 41 HB2 GLN 41 -11.100 -3.504 11.074 333 HB3 GLN 41 HB1 GLN 41 -9.659 -4.508 10.963 334 HG2 GLN 41 HG2 GLN 41 -8.245 -2.576 10.951 335 HG3 GLN 41 HG1 GLN 41 -9.639 -1.504 10.828 336 HE21 GLN 41 HE21 GLN 41 -7.507 -1.661 12.839 337 HE22 GLN 41 HE22 GLN 41 -8.320 -1.865 14.353 338 H GLN 42 HN GLN 42 -12.540 -3.856 8.222 339 HA GLN 42 HA GLN 42 -12.925 -0.959 7.874 340 HB2 GLN 42 HB2 GLN 42 -14.085 -1.278 5.910 341 HB3 GLN 42 HB1 GLN 42 -12.880 -2.552 5.808 342 HG2 GLN 42 HG2 GLN 42 -14.608 -4.105 6.757 343 HG3 GLN 42 HG1 GLN 42 -15.779 -2.812 6.535 344 HE21 GLN 42 HE21 GLN 42 -16.518 -2.340 4.523 345 HE22 GLN 42 HE22 GLN 42 -16.129 -3.265 3.119 346 H LYS 43 HN LYS 43 -15.289 -0.401 7.794 347 HA LYS 43 HA LYS 43 -17.028 -1.941 9.531 348 HB2 LYS 43 HB2 LYS 43 -15.496 -0.364 10.930 349 HB3 LYS 43 HB1 LYS 43 -16.488 0.929 10.277 350 HG2 LYS 43 HG2 LYS 43 -18.431 0.088 11.347 351 HG3 LYS 43 HG1 LYS 43 -17.623 -1.420 11.773 352 HD2 LYS 43 HD2 LYS 43 -16.083 -0.178 13.226 353 HD3 LYS 43 HD1 LYS 43 -16.909 1.319 12.806 354 HE2 LYS 43 HE2 LYS 43 -18.963 0.494 13.807 355 HE3 LYS 43 HE1 LYS 43 -18.182 -1.037 14.183 356 HZ1 LYS 43 HZ1 LYS 43 -18.285 0.476 16.090 357 HZ2 LYS 43 HZ2 LYS 43 -17.327 1.588 15.258 358 HZ3 LYS 43 HZ3 LYS 43 -16.691 0.078 15.680 359 H GLY 44 HN GLY 44 -17.994 -2.014 7.400 360 HA2 GLY 44 HA2 GLY 44 -19.872 -1.385 6.181 361 HA3 GLY 44 HA1 GLY 44 -19.847 0.178 6.989 362 H ASP 45 HN ASP 45 -18.627 1.851 6.147 363 HA ASP 45 HA ASP 45 -17.532 1.366 3.454 364 HB2 ASP 45 HB2 ASP 45 -18.773 3.876 4.600 365 HB3 ASP 45 HB1 ASP 45 -18.020 3.769 3.013 366 H ASP 46 HN ASP 46 -16.893 2.459 6.613 367 HA ASP 46 HA ASP 46 -14.543 4.006 5.948 368 HB2 ASP 46 HB2 ASP 46 -15.948 3.234 8.480 369 HB3 ASP 46 HB1 ASP 46 -14.275 3.776 8.565 370 H PHE 47 HN PHE 47 -12.536 3.316 5.814 371 HA PHE 47 HA PHE 47 -11.941 0.553 6.674 372 HB2 PHE 47 HB2 PHE 47 -10.966 2.141 4.314 373 HB3 PHE 47 HB1 PHE 47 -10.084 0.746 4.911 374 HD1 PHE 47 HD1 PHE 47 -13.753 1.217 4.572 375 HD2 PHE 47 HD2 PHE 47 -10.271 -0.805 3.231 376 HE1 PHE 47 HE1 PHE 47 -15.151 -0.256 3.180 377 HE2 PHE 47 HE2 PHE 47 -11.656 -2.279 1.834 378 HZ PHE 47 HZ PHE 47 -14.099 -2.008 1.812 379 H VAL 48 HN VAL 48 -9.948 0.158 7.591 380 HA VAL 48 HA VAL 48 -8.264 2.462 8.266 381 HB VAL 48 HB VAL 48 -9.155 0.384 10.282 382 HG11 VAL 48 HG11 VAL 48 -7.866 1.657 11.901 383 HG12 VAL 48 HG12 VAL 48 -7.372 2.793 10.649 384 HG13 VAL 48 HG13 VAL 48 -6.827 1.117 10.583 385 HG21 VAL 48 HG21 VAL 48 -10.279 2.216 11.428 386 HG22 VAL 48 HG22 VAL 48 -10.905 2.037 9.788 387 HG23 VAL 48 HG23 VAL 48 -9.774 3.338 10.163 388 H VAL 49 HN VAL 49 -6.515 1.941 7.153 389 HA VAL 49 HA VAL 49 -5.585 -0.828 7.084 390 HB VAL 49 HB VAL 49 -4.324 1.484 5.621 391 HG11 VAL 49 HG11 VAL 49 -3.071 -0.602 5.684 392 HG12 VAL 49 HG12 VAL 49 -3.651 -0.279 4.051 393 HG13 VAL 49 HG13 VAL 49 -4.468 -1.477 5.058 394 HG21 VAL 49 HG21 VAL 49 -5.749 0.988 3.703 395 HG22 VAL 49 HG22 VAL 49 -6.716 1.508 5.084 396 HG23 VAL 49 HG23 VAL 49 -6.636 -0.201 4.655 397 H THR 50 HN THR 50 -3.793 -1.518 8.058 398 HA THR 50 HA THR 50 -2.155 0.468 9.495 399 HB THR 50 HB THR 50 -2.919 -2.315 10.398 400 HG1 THR 50 HG1 THR 50 -4.139 0.053 10.670 401 HG21 THR 50 HG21 THR 50 -0.650 -1.747 11.094 402 HG22 THR 50 HG22 THR 50 -1.744 -1.746 12.476 403 HG23 THR 50 HG23 THR 50 -1.225 -0.217 11.767 404 H SER 51 HN SER 51 -0.222 0.577 8.556 405 HA SER 51 HA SER 51 0.898 -1.803 7.253 406 HB2 SER 51 HB2 SER 51 2.165 0.920 7.152 407 HB3 SER 51 HB1 SER 51 2.180 -0.361 5.937 408 HG SER 51 HG SER 51 -0.236 0.096 5.958 409 H LYS 52 HN LYS 52 2.412 -2.961 8.230 410 HA LYS 52 HA LYS 52 3.530 -2.052 10.754 411 HB2 LYS 52 HB2 LYS 52 3.936 -4.701 9.359 412 HB3 LYS 52 HB1 LYS 52 4.267 -4.331 11.046 413 HG2 LYS 52 HG2 LYS 52 1.969 -4.160 11.560 414 HG3 LYS 52 HG1 LYS 52 1.518 -4.143 9.857 415 HD2 LYS 52 HD2 LYS 52 1.061 -6.316 10.308 416 HD3 LYS 52 HD1 LYS 52 2.768 -6.481 9.896 417 HE2 LYS 52 HE2 LYS 52 2.650 -7.668 11.860 418 HE3 LYS 52 HE1 LYS 52 3.136 -6.078 12.440 419 HZ1 LYS 52 HZ1 LYS 52 0.951 -5.617 13.162 420 HZ2 LYS 52 HZ2 LYS 52 1.273 -7.192 13.686 421 HZ3 LYS 52 HZ3 LYS 52 0.297 -6.937 12.324 422 H THR 53 HN THR 53 5.522 -1.258 11.008 423 HA THR 53 HA THR 53 7.541 -1.784 8.941 424 HB THR 53 HB THR 53 8.235 0.468 8.815 425 HG1 THR 53 HG1 THR 53 6.448 1.549 10.644 426 HG21 THR 53 HG21 THR 53 5.220 0.443 8.946 427 HG22 THR 53 HG22 THR 53 6.233 0.191 7.523 428 HG23 THR 53 HG23 THR 53 6.176 1.776 8.296 429 HA PRO 54 HA PRO 54 10.418 -2.653 12.211 430 HB2 PRO 54 HB2 PRO 54 12.318 -0.814 10.838 431 HB3 PRO 54 HB1 PRO 54 12.517 -2.524 11.276 432 HG2 PRO 54 HG2 PRO 54 12.124 -1.847 8.773 433 HG3 PRO 54 HG1 PRO 54 11.325 -3.274 9.464 434 HD2 PRO 54 HD2 PRO 54 10.181 -0.574 8.896 435 HD3 PRO 54 HD1 PRO 54 9.467 -2.180 8.645 436 H ARG 55 HN ARG 55 9.294 0.481 11.649 437 HA ARG 55 HA ARG 55 10.647 1.487 14.056 438 HB2 ARG 55 HB2 ARG 55 10.045 2.682 11.507 439 HB3 ARG 55 HB1 ARG 55 9.281 3.597 12.799 440 HG2 ARG 55 HG2 ARG 55 11.375 3.945 13.890 441 HG3 ARG 55 HG1 ARG 55 12.186 2.832 12.785 442 HD2 ARG 55 HD2 ARG 55 12.137 4.332 11.028 443 HD3 ARG 55 HD1 ARG 55 10.766 5.222 11.683 444 HE ARG 55 HE ARG 55 13.090 5.447 13.327 445 HH11 ARG 55 HH11 ARG 55 11.585 6.662 10.408 446 HH12 ARG 55 HH12 ARG 55 12.345 8.218 10.511 447 HH21 ARG 55 HH21 ARG 55 14.103 7.492 13.452 448 HH22 ARG 55 HH22 ARG 55 13.780 8.686 12.234 449 H GLN 56 HN GLN 56 7.532 2.017 12.405 450 HA GLN 56 HA GLN 56 6.047 1.252 14.738 451 HB2 GLN 56 HB2 GLN 56 6.805 3.536 15.333 452 HB3 GLN 56 HB1 GLN 56 6.032 4.152 13.879 453 HG2 GLN 56 HG2 GLN 56 3.867 3.590 14.712 454 HG3 GLN 56 HG1 GLN 56 4.567 2.736 16.088 455 HE21 GLN 56 HE21 GLN 56 2.718 5.055 15.910 456 HE22 GLN 56 HE22 GLN 56 3.461 6.300 16.850 457 H THR 57 HN THR 57 3.857 0.958 14.284 458 HA THR 57 HA THR 57 3.223 0.574 11.521 459 HB THR 57 HB THR 57 0.859 0.175 12.593 460 HG1 THR 57 HG1 THR 57 1.086 0.944 14.619 461 HG21 THR 57 HG21 THR 57 1.878 -1.730 11.815 462 HG22 THR 57 HG22 THR 57 1.826 -2.071 13.547 463 HG23 THR 57 HG23 THR 57 3.320 -1.497 12.801 464 H VAL 58 HN VAL 58 2.241 1.944 10.157 465 HA VAL 58 HA VAL 58 1.223 4.468 11.248 466 HB VAL 58 HB VAL 58 1.246 5.284 8.902 467 HG11 VAL 58 HG11 VAL 58 3.671 5.466 8.705 468 HG12 VAL 58 HG12 VAL 58 3.866 4.160 9.875 469 HG13 VAL 58 HG13 VAL 58 3.147 5.694 10.374 470 HG21 VAL 58 HG21 VAL 58 0.978 3.108 7.786 471 HG22 VAL 58 HG22 VAL 58 2.608 2.666 8.294 472 HG23 VAL 58 HG23 VAL 58 2.368 4.006 7.172 473 H THR 59 HN THR 59 -0.840 5.191 10.843 474 HA THR 59 HA THR 59 -2.688 3.111 9.891 475 HB THR 59 HB THR 59 -3.496 5.401 11.652 476 HG1 THR 59 HG1 THR 59 -1.808 4.389 12.757 477 HG21 THR 59 HG21 THR 59 -5.295 3.970 12.304 478 HG22 THR 59 HG22 THR 59 -4.560 2.584 11.498 479 HG23 THR 59 HG23 THR 59 -5.199 3.919 10.541 480 H ASN 60 HN ASN 60 -3.867 3.484 8.184 481 HA ASN 60 HA ASN 60 -4.258 6.264 7.232 482 HB2 ASN 60 HB2 ASN 60 -3.678 3.737 5.662 483 HB3 ASN 60 HB1 ASN 60 -4.376 5.174 4.922 484 HD21 ASN 60 HD21 ASN 60 -1.523 3.730 6.237 485 HD22 ASN 60 HD22 ASN 60 -0.428 4.987 5.787 486 H SER 61 HN SER 61 -6.400 6.781 7.190 487 HA SER 61 HA SER 61 -8.319 4.547 7.049 488 HB2 SER 61 HB2 SER 61 -9.165 6.999 8.472 489 HB3 SER 61 HB1 SER 61 -9.492 5.308 8.840 490 HG SER 61 HG SER 61 -6.883 6.314 9.117 491 H PHE 62 HN PHE 62 -10.234 4.873 5.897 492 HA PHE 62 HA PHE 62 -10.770 7.427 4.686 493 HB2 PHE 62 HB2 PHE 62 -10.716 6.467 2.337 494 HB3 PHE 62 HB1 PHE 62 -9.152 6.775 3.079 495 HD1 PHE 62 HD1 PHE 62 -11.489 4.192 1.952 496 HD2 PHE 62 HD2 PHE 62 -7.666 4.983 3.649 497 HE1 PHE 62 HE1 PHE 62 -10.794 1.882 1.466 498 HE2 PHE 62 HE2 PHE 62 -6.974 2.676 3.176 499 HZ PHE 62 HZ PHE 62 -8.535 1.118 2.086 500 H THR 63 HN THR 63 -12.648 7.142 3.061 501 HA THR 63 HA THR 63 -14.467 5.050 4.039 502 HB THR 63 HB THR 63 -15.449 7.783 3.254 503 HG1 THR 63 HG1 THR 63 -14.791 7.006 5.924 504 HG21 THR 63 HG21 THR 63 -17.061 5.927 3.484 505 HG22 THR 63 HG22 THR 63 -17.327 7.194 4.684 506 HG23 THR 63 HG23 THR 63 -16.525 5.695 5.152 507 H LEU 64 HN LEU 64 -15.517 3.958 2.470 508 HA LEU 64 HA LEU 64 -14.656 4.023 -0.175 509 HB2 LEU 64 HB2 LEU 64 -17.180 2.921 1.033 510 HB3 LEU 64 HB1 LEU 64 -16.724 2.656 -0.639 511 HG LEU 64 HG LEU 64 -15.327 1.670 1.837 512 HD11 LEU 64 HD11 LEU 64 -17.186 0.314 1.142 513 HD12 LEU 64 HD12 LEU 64 -15.689 -0.523 0.732 514 HD13 LEU 64 HD13 LEU 64 -16.609 0.305 -0.525 515 HD21 LEU 64 HD21 LEU 64 -13.698 0.647 0.251 516 HD22 LEU 64 HD22 LEU 64 -13.584 2.402 0.387 517 HD23 LEU 64 HD23 LEU 64 -14.371 1.674 -1.015 518 H GLY 65 HN GLY 65 -14.835 5.673 -1.493 519 HA2 GLY 65 HA2 GLY 65 -16.155 6.781 -3.139 520 HA3 GLY 65 HA1 GLY 65 -17.536 6.672 -2.064 521 H LYS 66 HN LYS 66 -15.130 7.674 -0.085 522 HA LYS 66 HA LYS 66 -15.637 10.508 -0.720 523 HB2 LYS 66 HB2 LYS 66 -16.005 9.022 1.811 524 HB3 LYS 66 HB1 LYS 66 -15.282 10.622 1.947 525 HG2 LYS 66 HG2 LYS 66 -17.205 11.541 0.691 526 HG3 LYS 66 HG1 LYS 66 -17.937 9.933 0.705 527 HD2 LYS 66 HD2 LYS 66 -17.672 10.047 3.255 528 HD3 LYS 66 HD1 LYS 66 -17.392 11.776 3.017 529 HE2 LYS 66 HE2 LYS 66 -19.827 10.262 2.070 530 HE3 LYS 66 HE1 LYS 66 -19.752 11.223 3.547 531 HZ1 LYS 66 HZ1 LYS 66 -19.287 12.292 0.813 532 HZ2 LYS 66 HZ2 LYS 66 -19.369 13.186 2.246 533 HZ3 LYS 66 HZ3 LYS 66 -20.748 12.408 1.654 534 H GLU 67 HN GLU 67 -14.068 12.018 0.124 535 HA GLU 67 HA GLU 67 -11.384 11.096 -0.345 536 HB2 GLU 67 HB2 GLU 67 -12.281 13.292 -1.162 537 HB3 GLU 67 HB1 GLU 67 -12.352 13.831 0.511 538 HG2 GLU 67 HG2 GLU 67 -9.838 13.253 0.564 539 HG3 GLU 67 HG1 GLU 67 -9.954 13.291 -1.194 540 H ALA 68 HN ALA 68 -9.761 10.879 1.148 541 HA ALA 68 HA ALA 68 -10.355 11.604 3.922 542 HB1 ALA 68 HB1 ALA 68 -9.237 8.920 3.156 543 HB2 ALA 68 HB2 ALA 68 -10.932 9.212 3.544 544 HB3 ALA 68 HB3 ALA 68 -9.688 9.475 4.766 545 H ASP 69 HN ASP 69 -8.659 12.385 5.016 546 HA ASP 69 HA ASP 69 -6.206 12.832 3.548 547 HB2 ASP 69 HB2 ASP 69 -7.154 13.749 6.271 548 HB3 ASP 69 HB1 ASP 69 -5.560 14.129 5.625 549 H ILE 70 HN ILE 70 -4.912 11.135 3.470 550 HA ILE 70 HA ILE 70 -4.480 9.586 5.927 551 HB ILE 70 HB ILE 70 -3.515 7.840 4.369 552 HG12 ILE 70 HG12 ILE 70 -4.727 8.129 2.029 553 HG13 ILE 70 HG11 ILE 70 -4.470 9.833 2.381 554 HG21 ILE 70 HG21 ILE 70 -5.617 7.351 5.248 555 HG22 ILE 70 HG22 ILE 70 -5.823 7.173 3.503 556 HG23 ILE 70 HG23 ILE 70 -6.402 8.627 4.314 557 HD11 ILE 70 HD11 ILE 70 -2.329 7.718 2.282 558 HD12 ILE 70 HD12 ILE 70 -2.080 9.435 2.596 559 HD13 ILE 70 HD13 ILE 70 -2.668 8.903 1.019 560 H THR 71 HN THR 71 -2.139 8.674 6.054 561 HA THR 71 HA THR 71 -0.239 10.616 4.933 562 HB THR 71 HB THR 71 -0.176 9.890 7.863 563 HG1 THR 71 HG1 THR 71 -1.896 11.446 6.814 564 HG21 THR 71 HG21 THR 71 1.265 12.131 6.458 565 HG22 THR 71 HG22 THR 71 1.964 10.517 6.606 566 HG23 THR 71 HG23 THR 71 1.584 11.452 8.055 567 H THR 72 HN THR 72 1.527 9.719 4.167 568 HA THR 72 HA THR 72 1.913 6.886 4.410 569 HB THR 72 HB THR 72 2.358 8.054 2.280 570 HG1 THR 72 HG1 THR 72 4.503 7.090 1.960 571 HG21 THR 72 HG21 THR 72 3.252 10.147 3.153 572 HG22 THR 72 HG22 THR 72 4.384 9.403 2.022 573 HG23 THR 72 HG23 THR 72 4.676 9.298 3.759 574 H MET 73 HN MET 73 4.037 5.960 4.999 575 HA MET 73 HA MET 73 4.818 6.825 7.596 576 HB2 MET 73 HB2 MET 73 6.533 4.987 7.382 577 HB3 MET 73 HB1 MET 73 4.863 4.488 7.164 578 HG2 MET 73 HG2 MET 73 5.287 4.720 4.666 579 HG3 MET 73 HG1 MET 73 6.997 4.819 5.079 580 HE1 MET 73 HE1 MET 73 3.828 2.461 4.838 581 HE2 MET 73 HE2 MET 73 4.013 2.748 6.567 582 HE3 MET 73 HE3 MET 73 4.318 1.144 5.903 583 H ASP 74 HN ASP 74 5.771 7.785 4.522 584 HA ASP 74 HA ASP 74 8.505 8.442 5.149 585 HB2 ASP 74 HB2 ASP 74 7.901 7.887 2.858 586 HB3 ASP 74 HB1 ASP 74 6.737 9.203 2.814 587 H GLY 75 HN GLY 75 5.474 9.881 5.705 588 HA2 GLY 75 HA2 GLY 75 5.214 11.756 7.137 589 HA3 GLY 75 HA1 GLY 75 6.803 12.320 6.646 590 H LYS 76 HN LYS 76 4.903 11.292 4.051 591 HA LYS 76 HA LYS 76 4.543 14.062 3.221 592 HB2 LYS 76 HB2 LYS 76 4.203 11.503 1.649 593 HB3 LYS 76 HB1 LYS 76 4.133 13.130 0.995 594 HG2 LYS 76 HG2 LYS 76 6.568 12.038 2.370 595 HG3 LYS 76 HG1 LYS 76 6.287 11.862 0.642 596 HD2 LYS 76 HD2 LYS 76 6.791 14.019 0.212 597 HD3 LYS 76 HD1 LYS 76 5.983 14.599 1.667 598 HE2 LYS 76 HE2 LYS 76 8.349 15.057 1.838 599 HE3 LYS 76 HE1 LYS 76 7.910 13.821 3.013 600 HZ1 LYS 76 HZ1 LYS 76 9.968 13.273 1.889 601 HZ2 LYS 76 HZ2 LYS 76 9.197 13.321 0.387 602 HZ3 LYS 76 HZ3 LYS 76 8.776 12.131 1.514 603 H LYS 77 HN LYS 77 2.577 14.948 2.866 604 HA LYS 77 HA LYS 77 0.302 13.520 3.981 605 HB2 LYS 77 HB2 LYS 77 0.756 16.400 3.209 606 HB3 LYS 77 HB1 LYS 77 -0.832 15.790 3.652 607 HG2 LYS 77 HG2 LYS 77 -0.053 16.679 5.629 608 HG3 LYS 77 HG1 LYS 77 0.344 14.970 5.797 609 HD2 LYS 77 HD2 LYS 77 2.616 15.713 4.715 610 HD3 LYS 77 HD1 LYS 77 2.145 17.301 5.323 611 HE2 LYS 77 HE2 LYS 77 1.972 16.436 7.564 612 HE3 LYS 77 HE1 LYS 77 2.279 14.797 6.992 613 HZ1 LYS 77 HZ1 LYS 77 4.498 15.377 6.426 614 HZ2 LYS 77 HZ2 LYS 77 4.232 15.921 8.004 615 HZ3 LYS 77 HZ3 LYS 77 4.226 17.021 6.721 616 H LEU 78 HN LEU 78 -1.187 12.598 2.792 617 HA LEU 78 HA LEU 78 -1.602 13.491 0.029 618 HB2 LEU 78 HB2 LEU 78 -1.514 10.566 0.728 619 HB3 LEU 78 HB1 LEU 78 -1.556 11.294 -0.864 620 HG LEU 78 HG LEU 78 0.807 11.709 0.947 621 HD11 LEU 78 HD11 LEU 78 0.417 9.289 0.778 622 HD12 LEU 78 HD12 LEU 78 1.887 9.787 -0.058 623 HD13 LEU 78 HD13 LEU 78 0.428 9.422 -0.979 624 HD21 LEU 78 HD21 LEU 78 1.974 12.172 -1.071 625 HD22 LEU 78 HD22 LEU 78 0.463 13.081 -1.129 626 HD23 LEU 78 HD23 LEU 78 0.630 11.591 -2.056 627 H LYS 79 HN LYS 79 -3.683 13.072 -0.775 628 HA LYS 79 HA LYS 79 -5.621 12.048 1.178 629 HB2 LYS 79 HB2 LYS 79 -7.220 13.817 0.219 630 HB3 LYS 79 HB1 LYS 79 -6.032 14.328 1.409 631 HG2 LYS 79 HG2 LYS 79 -4.689 15.370 -0.233 632 HG3 LYS 79 HG1 LYS 79 -5.566 14.591 -1.551 633 HD2 LYS 79 HD2 LYS 79 -6.424 16.747 -1.555 634 HD3 LYS 79 HD1 LYS 79 -7.617 15.837 -0.625 635 HE2 LYS 79 HE2 LYS 79 -5.443 16.981 0.982 636 HE3 LYS 79 HE1 LYS 79 -6.458 18.175 0.177 637 HZ1 LYS 79 HZ1 LYS 79 -7.720 17.894 1.991 638 HZ2 LYS 79 HZ2 LYS 79 -7.096 16.362 2.350 639 HZ3 LYS 79 HZ3 LYS 79 -8.307 16.531 1.168 640 H CYS 80 HN CYS 80 -6.510 10.319 0.322 641 HA CYS 80 HA CYS 80 -6.887 10.285 -2.601 642 HB2 CYS 80 HB2 CYS 80 -5.252 8.615 -1.955 643 HB3 CYS 80 HB1 CYS 80 -6.345 7.972 -0.724 644 H THR 81 HN THR 81 -8.798 9.739 -3.441 645 HA THR 81 HA THR 81 -11.038 9.385 -1.587 646 HB THR 81 HB THR 81 -11.231 9.877 -4.562 647 HG1 THR 81 HG1 THR 81 -10.034 11.525 -3.104 648 HG21 THR 81 HG21 THR 81 -13.238 9.099 -3.318 649 HG22 THR 81 HG22 THR 81 -13.433 10.699 -4.027 650 HG23 THR 81 HG23 THR 81 -13.116 10.534 -2.301 651 H VAL 82 HN VAL 82 -10.385 7.198 -1.172 652 HA VAL 82 HA VAL 82 -10.177 5.260 -3.240 653 HB VAL 82 HB VAL 82 -10.805 4.660 -0.356 654 HG11 VAL 82 HG11 VAL 82 -10.867 2.814 -2.016 655 HG12 VAL 82 HG12 VAL 82 -9.653 2.598 -0.751 656 HG13 VAL 82 HG13 VAL 82 -9.165 3.127 -2.362 657 HG21 VAL 82 HG21 VAL 82 -8.357 4.583 0.014 658 HG22 VAL 82 HG22 VAL 82 -8.964 6.207 -0.308 659 HG23 VAL 82 HG23 VAL 82 -8.124 5.312 -1.575 660 H HIS 83 HN HIS 83 -11.643 3.894 -4.067 661 HA HIS 83 HA HIS 83 -14.317 3.756 -2.925 662 HB2 HIS 83 HB2 HIS 83 -15.436 4.322 -5.024 663 HB3 HIS 83 HB1 HIS 83 -14.409 5.653 -4.515 664 HD1 HIS 83 HD1 HIS 83 -15.119 3.517 -7.359 665 HD2 HIS 83 HD2 HIS 83 -11.899 5.771 -6.023 666 HE1 HIS 83 HE1 HIS 83 -13.620 3.795 -9.352 667 HE2 HIS 83 HE2 HIS 83 -11.757 5.292 -8.557 668 H LEU 84 HN LEU 84 -15.488 1.940 -3.526 669 HA LEU 84 HA LEU 84 -13.844 -0.224 -4.588 670 HB2 LEU 84 HB2 LEU 84 -15.047 -0.515 -2.436 671 HB3 LEU 84 HB1 LEU 84 -16.565 -0.320 -3.293 672 HG LEU 84 HG LEU 84 -15.738 -2.332 -4.713 673 HD11 LEU 84 HD11 LEU 84 -13.477 -2.415 -3.879 674 HD12 LEU 84 HD12 LEU 84 -14.328 -3.890 -3.432 675 HD13 LEU 84 HD13 LEU 84 -14.058 -2.632 -2.227 676 HD21 LEU 84 HD21 LEU 84 -17.644 -2.225 -3.067 677 HD22 LEU 84 HD22 LEU 84 -16.528 -2.879 -1.863 678 HD23 LEU 84 HD23 LEU 84 -16.917 -3.812 -3.309 679 H ALA 85 HN ALA 85 -13.926 -0.430 -6.738 680 HA ALA 85 HA ALA 85 -16.534 -0.078 -8.053 681 HB1 ALA 85 HB1 ALA 85 -13.858 0.169 -9.402 682 HB2 ALA 85 HB2 ALA 85 -14.678 1.538 -8.649 683 HB3 ALA 85 HB3 ALA 85 -15.434 0.691 -10.001 684 H ASN 86 HN ASN 86 -17.430 -1.911 -8.614 685 HA ASN 86 HA ASN 86 -17.778 -4.030 -9.322 686 HB2 ASN 86 HB2 ASN 86 -15.155 -3.586 -10.769 687 HB3 ASN 86 HB1 ASN 86 -16.227 -4.949 -11.052 688 HD21 ASN 86 HD21 ASN 86 -15.504 -1.748 -11.829 689 HD22 ASN 86 HD22 ASN 86 -16.870 -1.429 -12.839 690 H GLY 87 HN GLY 87 -16.475 -3.662 -6.798 691 HA2 GLY 87 HA2 GLY 87 -15.794 -5.163 -5.160 692 HA3 GLY 87 HA1 GLY 87 -15.503 -6.363 -6.411 693 H LYS 88 HN LYS 88 -14.067 -3.461 -7.216 694 HA LYS 88 HA LYS 88 -11.465 -4.359 -6.172 695 HB2 LYS 88 HB2 LYS 88 -11.240 -4.607 -8.445 696 HB3 LYS 88 HB1 LYS 88 -12.314 -3.264 -8.809 697 HG2 LYS 88 HG2 LYS 88 -10.625 -1.668 -8.309 698 HG3 LYS 88 HG1 LYS 88 -9.567 -2.911 -7.633 699 HD2 LYS 88 HD2 LYS 88 -10.497 -2.955 -10.484 700 HD3 LYS 88 HD1 LYS 88 -9.032 -2.115 -9.978 701 HE2 LYS 88 HE2 LYS 88 -8.083 -4.160 -9.152 702 HE3 LYS 88 HE1 LYS 88 -9.582 -5.032 -9.468 703 HZ1 LYS 88 HZ1 LYS 88 -9.245 -4.444 -11.866 704 HZ2 LYS 88 HZ2 LYS 88 -8.107 -5.526 -11.233 705 HZ3 LYS 88 HZ3 LYS 88 -7.693 -3.896 -11.456 706 H LEU 89 HN LEU 89 -10.396 -2.983 -4.884 707 HA LEU 89 HA LEU 89 -11.561 -0.399 -4.354 708 HB2 LEU 89 HB2 LEU 89 -10.445 -2.132 -2.703 709 HB3 LEU 89 HB1 LEU 89 -8.978 -1.284 -3.156 710 HG LEU 89 HG LEU 89 -9.798 0.774 -2.285 711 HD11 LEU 89 HD11 LEU 89 -12.057 0.843 -2.895 712 HD12 LEU 89 HD12 LEU 89 -12.079 0.770 -1.134 713 HD13 LEU 89 HD13 LEU 89 -12.415 -0.681 -2.079 714 HD21 LEU 89 HD21 LEU 89 -10.098 0.250 0.059 715 HD22 LEU 89 HD22 LEU 89 -8.867 -0.795 -0.654 716 HD23 LEU 89 HD23 LEU 89 -10.487 -1.422 -0.346 717 H VAL 90 HN VAL 90 -11.003 1.396 -5.343 718 HA VAL 90 HA VAL 90 -8.426 1.455 -6.767 719 HB VAL 90 HB VAL 90 -10.866 3.061 -7.508 720 HG11 VAL 90 HG11 VAL 90 -9.713 3.223 -9.700 721 HG12 VAL 90 HG12 VAL 90 -8.317 2.419 -8.980 722 HG13 VAL 90 HG13 VAL 90 -8.840 3.993 -8.373 723 HG21 VAL 90 HG21 VAL 90 -9.999 0.436 -8.714 724 HG22 VAL 90 HG22 VAL 90 -11.345 1.444 -9.250 725 HG23 VAL 90 HG23 VAL 90 -11.398 0.670 -7.665 726 H CYS 91 HN CYS 91 -7.074 3.064 -6.405 727 HA CYS 91 HA CYS 91 -7.976 5.481 -4.998 728 HB2 CYS 91 HB2 CYS 91 -6.904 4.080 -3.311 729 HB3 CYS 91 HB1 CYS 91 -5.515 3.826 -4.356 730 H LYS 92 HN LYS 92 -8.010 6.133 -7.297 731 HA LYS 92 HA LYS 92 -5.376 6.517 -8.490 732 HB2 LYS 92 HB2 LYS 92 -7.170 5.556 -9.886 733 HB3 LYS 92 HB1 LYS 92 -8.123 7.012 -9.645 734 HG2 LYS 92 HG2 LYS 92 -6.725 8.302 -10.973 735 HG3 LYS 92 HG1 LYS 92 -5.390 7.155 -10.850 736 HD2 LYS 92 HD2 LYS 92 -6.296 6.959 -13.043 737 HD3 LYS 92 HD1 LYS 92 -6.797 5.527 -12.144 738 HE2 LYS 92 HE2 LYS 92 -8.730 6.186 -13.263 739 HE3 LYS 92 HE1 LYS 92 -8.942 6.844 -11.647 740 HZ1 LYS 92 HZ1 LYS 92 -9.487 8.387 -13.502 741 HZ2 LYS 92 HZ2 LYS 92 -7.841 8.420 -13.891 742 HZ3 LYS 92 HZ3 LYS 92 -8.366 8.991 -12.387 743 H SER 93 HN SER 93 -4.489 8.436 -8.910 744 HA SER 93 HA SER 93 -5.770 10.774 -7.683 745 HB2 SER 93 HB2 SER 93 -3.018 11.227 -8.295 746 HB3 SER 93 HB1 SER 93 -3.770 11.118 -6.703 747 HG SER 93 HG SER 93 -3.320 8.976 -6.624 748 H GLU 94 HN GLU 94 -4.413 12.799 -8.880 749 HA GLU 94 HA GLU 94 -5.548 12.760 -11.525 750 HB2 GLU 94 HB2 GLU 94 -4.678 15.105 -11.643 751 HB3 GLU 94 HB1 GLU 94 -5.754 14.803 -10.283 752 HG2 GLU 94 HG2 GLU 94 -3.824 14.603 -8.807 753 HG3 GLU 94 HG1 GLU 94 -2.749 14.887 -10.175 754 H LYS 95 HN LYS 95 -2.476 12.213 -10.101 755 HA LYS 95 HA LYS 95 -1.194 12.246 -12.751 756 HB2 LYS 95 HB2 LYS 95 -0.429 13.717 -10.667 757 HB3 LYS 95 HB1 LYS 95 0.431 12.238 -10.259 758 HG2 LYS 95 HG2 LYS 95 0.660 13.384 -12.996 759 HG3 LYS 95 HG1 LYS 95 1.587 14.069 -11.664 760 HD2 LYS 95 HD2 LYS 95 2.744 12.039 -11.306 761 HD3 LYS 95 HD1 LYS 95 1.613 11.132 -12.313 762 HE2 LYS 95 HE2 LYS 95 2.445 12.108 -14.296 763 HE3 LYS 95 HE1 LYS 95 3.330 13.343 -13.403 764 HZ1 LYS 95 HZ1 LYS 95 4.794 11.630 -12.549 765 HZ2 LYS 95 HZ2 LYS 95 4.799 11.619 -14.240 766 HZ3 LYS 95 HZ3 LYS 95 3.938 10.436 -13.392 767 H PHE 96 HN PHE 96 -1.638 10.444 -9.783 768 HA PHE 96 HA PHE 96 -0.234 8.160 -10.990 769 HB2 PHE 96 HB2 PHE 96 -0.809 8.512 -8.052 770 HB3 PHE 96 HB1 PHE 96 0.357 7.434 -8.815 771 HD1 PHE 96 HD1 PHE 96 2.438 8.320 -9.756 772 HD2 PHE 96 HD2 PHE 96 -0.299 10.803 -7.653 773 HE1 PHE 96 HE1 PHE 96 4.180 10.042 -9.528 774 HE2 PHE 96 HE2 PHE 96 1.434 12.531 -7.415 775 HZ PHE 96 HZ PHE 96 3.676 12.153 -8.360 776 H SER 97 HN SER 97 -1.063 6.008 -9.962 777 HA SER 97 HA SER 97 -3.903 6.002 -9.441 778 HB2 SER 97 HB2 SER 97 -3.271 4.129 -11.612 779 HB3 SER 97 HB1 SER 97 -4.657 5.203 -11.410 780 HG SER 97 HG SER 97 -3.291 6.927 -12.119 781 H HIS 98 HN HIS 98 -3.746 4.881 -7.567 782 HA HIS 98 HA HIS 98 -2.123 2.453 -7.469 783 HB2 HIS 98 HB2 HIS 98 -2.085 4.052 -5.545 784 HB3 HIS 98 HB1 HIS 98 -3.796 3.747 -5.294 785 HD2 HIS 98 HD2 HIS 98 -3.638 0.419 -5.472 786 HE1 HIS 98 HE1 HIS 98 -0.968 0.941 -2.226 787 HE2 HIS 98 HE2 HIS 98 -2.330 -0.725 -3.536 788 H GLU 99 HN GLU 99 -2.987 0.498 -7.825 789 HA GLU 99 HA GLU 99 -5.912 0.251 -7.508 790 HB2 GLU 99 HB2 GLU 99 -5.554 0.445 -9.858 791 HB3 GLU 99 HB1 GLU 99 -4.232 -0.721 -9.810 792 HG2 GLU 99 HG2 GLU 99 -5.779 -2.471 -9.185 793 HG3 GLU 99 HG1 GLU 99 -7.112 -1.321 -9.193 794 H GLN 100 HN GLN 100 -6.619 -1.467 -6.441 795 HA GLN 100 HA GLN 100 -4.749 -3.681 -5.883 796 HB2 GLN 100 HB2 GLN 100 -7.003 -2.799 -4.071 797 HB3 GLN 100 HB1 GLN 100 -5.703 -3.914 -3.695 798 HG2 GLN 100 HG2 GLN 100 -4.092 -2.076 -3.784 799 HG3 GLN 100 HG1 GLN 100 -5.403 -0.956 -4.155 800 HE21 GLN 100 HE21 GLN 100 -3.821 -2.818 -1.723 801 HE22 GLN 100 HE22 GLN 100 -4.704 -2.178 -0.374 802 H GLU 101 HN GLU 101 -5.617 -5.801 -6.036 803 HA GLU 101 HA GLU 101 -8.455 -5.996 -6.746 804 HB2 GLU 101 HB2 GLU 101 -7.158 -5.907 -8.856 805 HB3 GLU 101 HB1 GLU 101 -6.258 -7.323 -8.334 806 HG2 GLU 101 HG2 GLU 101 -8.179 -8.696 -8.427 807 HG3 GLU 101 HG1 GLU 101 -9.243 -7.309 -8.650 808 H VAL 102 HN VAL 102 -9.464 -7.649 -5.825 809 HA VAL 102 HA VAL 102 -7.851 -9.626 -4.376 810 HB VAL 102 HB VAL 102 -10.708 -8.710 -4.012 811 HG11 VAL 102 HG11 VAL 102 -10.887 -10.340 -2.181 812 HG12 VAL 102 HG12 VAL 102 -9.311 -10.997 -2.625 813 HG13 VAL 102 HG13 VAL 102 -10.668 -11.130 -3.741 814 HG21 VAL 102 HG21 VAL 102 -9.818 -8.288 -1.683 815 HG22 VAL 102 HG22 VAL 102 -9.204 -7.236 -2.956 816 HG23 VAL 102 HG23 VAL 102 -8.214 -8.564 -2.355 817 H LYS 103 HN LYS 103 -7.622 -11.533 -5.306 818 HA LYS 103 HA LYS 103 -9.730 -12.517 -7.113 819 HB2 LYS 103 HB2 LYS 103 -6.756 -13.049 -7.129 820 HB3 LYS 103 HB1 LYS 103 -7.912 -13.901 -8.138 821 HG2 LYS 103 HG2 LYS 103 -8.518 -11.813 -9.234 822 HG3 LYS 103 HG1 LYS 103 -7.368 -10.945 -8.210 823 HD2 LYS 103 HD2 LYS 103 -5.542 -12.314 -9.143 824 HD3 LYS 103 HD1 LYS 103 -6.707 -13.130 -10.187 825 HE2 LYS 103 HE2 LYS 103 -6.209 -10.158 -10.220 826 HE3 LYS 103 HE1 LYS 103 -5.397 -11.301 -11.285 827 HZ1 LYS 103 HZ1 LYS 103 -7.100 -10.916 -12.643 828 HZ2 LYS 103 HZ2 LYS 103 -8.066 -10.239 -11.426 829 HZ3 LYS 103 HZ3 LYS 103 -8.002 -11.923 -11.627 830 H GLY 104 HN GLY 104 -10.862 -13.459 -5.348 831 HA2 GLY 104 HA2 GLY 104 -11.483 -15.345 -4.180 832 HA3 GLY 104 HA1 GLY 104 -10.022 -16.134 -4.756 833 H ASN 105 HN ASN 105 -8.135 -16.021 -3.522 834 HA ASN 105 HA ASN 105 -8.511 -14.974 -0.785 835 HB2 ASN 105 HB2 ASN 105 -8.212 -17.587 -1.379 836 HB3 ASN 105 HB1 ASN 105 -6.519 -17.120 -1.277 837 HD21 ASN 105 HD21 ASN 105 -6.036 -18.199 0.550 838 HD22 ASN 105 HD22 ASN 105 -6.706 -17.821 2.100 839 H GLU 106 HN GLU 106 -7.032 -14.323 -3.570 840 HA GLU 106 HA GLU 106 -4.529 -13.429 -2.300 841 HB2 GLU 106 HB2 GLU 106 -5.173 -14.175 -5.154 842 HB3 GLU 106 HB1 GLU 106 -3.734 -13.258 -4.723 843 HG2 GLU 106 HG2 GLU 106 -2.804 -15.036 -3.553 844 HG3 GLU 106 HG1 GLU 106 -4.343 -15.886 -3.427 845 H MET 107 HN MET 107 -3.771 -11.337 -2.787 846 HA MET 107 HA MET 107 -5.676 -9.532 -4.100 847 HB2 MET 107 HB2 MET 107 -6.018 -9.367 -1.652 848 HB3 MET 107 HB1 MET 107 -4.318 -8.965 -1.454 849 HG2 MET 107 HG2 MET 107 -5.722 -7.237 -3.349 850 HG3 MET 107 HG1 MET 107 -6.362 -7.173 -1.706 851 HE1 MET 107 HE1 MET 107 -3.484 -5.804 0.411 852 HE2 MET 107 HE2 MET 107 -3.880 -7.514 0.240 853 HE3 MET 107 HE3 MET 107 -5.170 -6.314 0.331 854 H VAL 108 HN VAL 108 -4.521 -9.059 -5.857 855 HA VAL 108 HA VAL 108 -1.694 -8.348 -5.507 856 HB VAL 108 HB VAL 108 -1.858 -10.073 -7.128 857 HG11 VAL 108 HG11 VAL 108 -3.344 -9.983 -9.075 858 HG12 VAL 108 HG12 VAL 108 -4.035 -8.477 -8.473 859 HG13 VAL 108 HG13 VAL 108 -4.247 -9.972 -7.560 860 HG21 VAL 108 HG21 VAL 108 -1.698 -7.480 -8.663 861 HG22 VAL 108 HG22 VAL 108 -1.034 -9.035 -9.162 862 HG23 VAL 108 HG23 VAL 108 -0.377 -8.207 -7.748 863 H GLU 109 HN GLU 109 -1.167 -6.264 -5.562 864 HA GLU 109 HA GLU 109 -3.003 -4.457 -6.974 865 HB2 GLU 109 HB2 GLU 109 -2.827 -2.819 -5.317 866 HB3 GLU 109 HB1 GLU 109 -3.044 -4.319 -4.430 867 HG2 GLU 109 HG2 GLU 109 -0.548 -4.386 -4.152 868 HG3 GLU 109 HG1 GLU 109 -0.521 -2.751 -4.815 869 H THR 110 HN THR 110 -2.138 -2.664 -7.975 870 HA THR 110 HA THR 110 0.761 -2.752 -8.458 871 HB THR 110 HB THR 110 -1.195 -2.019 -10.621 872 HG1 THR 110 HG1 THR 110 -0.815 -4.488 -9.522 873 HG21 THR 110 HG21 THR 110 1.278 -1.531 -10.784 874 HG22 THR 110 HG22 THR 110 0.603 -2.500 -12.094 875 HG23 THR 110 HG23 THR 110 1.533 -3.271 -10.813 876 H ILE 111 HN ILE 111 1.686 -0.890 -7.957 877 HA ILE 111 HA ILE 111 0.047 1.571 -8.034 878 HB ILE 111 HB ILE 111 2.522 1.459 -6.367 879 HG12 ILE 111 HG12 ILE 111 -0.084 0.340 -5.330 880 HG13 ILE 111 HG11 ILE 111 1.236 -0.673 -5.914 881 HG21 ILE 111 HG21 ILE 111 -0.183 2.689 -5.856 882 HG22 ILE 111 HG22 ILE 111 1.167 3.508 -6.642 883 HG23 ILE 111 HG23 ILE 111 1.312 2.989 -4.965 884 HD11 ILE 111 HD11 ILE 111 1.443 1.293 -3.642 885 HD12 ILE 111 HD12 ILE 111 2.696 0.183 -4.193 886 HD13 ILE 111 HD13 ILE 111 1.218 -0.448 -3.472 887 H THR 112 HN THR 112 1.413 3.576 -8.444 888 HA THR 112 HA THR 112 3.984 3.135 -9.696 889 HB THR 112 HB THR 112 1.808 4.436 -11.332 890 HG1 THR 112 HG1 THR 112 2.455 1.789 -11.016 891 HG21 THR 112 HG21 THR 112 4.485 3.448 -12.273 892 HG22 THR 112 HG22 THR 112 4.273 5.073 -11.623 893 HG23 THR 112 HG23 THR 112 3.388 4.580 -13.066 894 H PHE 113 HN PHE 113 5.153 4.573 -8.612 895 HA PHE 113 HA PHE 113 4.406 7.397 -8.761 896 HB2 PHE 113 HB2 PHE 113 5.055 5.962 -6.182 897 HB3 PHE 113 HB1 PHE 113 5.293 7.682 -6.376 898 HD1 PHE 113 HD2 PHE 113 2.656 5.063 -6.574 899 HD2 PHE 113 HD1 PHE 113 3.589 9.158 -5.911 900 HE1 PHE 113 HE2 PHE 113 0.336 5.475 -5.881 901 HE2 PHE 113 HE1 PHE 113 1.271 9.578 -5.214 902 HZ PHE 113 HZ PHE 113 -0.361 7.733 -5.195 903 H GLY 114 HN GLY 114 6.242 8.764 -8.718 904 HA2 GLY 114 HA2 GLY 114 8.459 9.305 -9.044 905 HA3 GLY 114 HA1 GLY 114 8.855 7.831 -8.173 906 H GLY 115 HN GLY 115 6.850 7.258 -10.831 907 HA2 GLY 115 HA2 GLY 115 7.281 6.646 -13.036 908 HA3 GLY 115 HA1 GLY 115 8.985 6.984 -12.778 909 H VAL 116 HN VAL 116 7.682 5.030 -10.323 910 HA VAL 116 HA VAL 116 8.752 2.624 -11.640 911 HB VAL 116 HB VAL 116 8.610 3.130 -8.672 912 HG11 VAL 116 HG11 VAL 116 10.009 1.075 -10.366 913 HG12 VAL 116 HG12 VAL 116 8.739 0.816 -9.167 914 HG13 VAL 116 HG13 VAL 116 10.345 1.327 -8.653 915 HG21 VAL 116 HG21 VAL 116 11.165 3.391 -8.988 916 HG22 VAL 116 HG22 VAL 116 10.107 4.768 -9.307 917 HG23 VAL 116 HG23 VAL 116 10.740 3.812 -10.647 918 H THR 117 HN THR 117 7.517 0.842 -11.704 919 HA THR 117 HA THR 117 4.801 1.071 -10.618 920 HB THR 117 HB THR 117 5.806 -0.919 -12.657 921 HG1 THR 117 HG1 THR 117 5.951 1.324 -13.352 922 HG21 THR 117 HG21 THR 117 3.402 -1.117 -13.197 923 HG22 THR 117 HG22 THR 117 3.036 -0.047 -11.844 924 HG23 THR 117 HG23 THR 117 3.774 -1.622 -11.549 925 H LEU 118 HN LEU 118 5.148 0.449 -8.509 926 HA LEU 118 HA LEU 118 6.583 -1.920 -7.798 927 HB2 LEU 118 HB2 LEU 118 6.247 0.085 -6.322 928 HB3 LEU 118 HB1 LEU 118 4.578 -0.388 -6.146 929 HG LEU 118 HG LEU 118 5.068 -2.078 -4.708 930 HD11 LEU 118 HD11 LEU 118 6.471 -3.325 -6.285 931 HD12 LEU 118 HD12 LEU 118 7.105 -3.367 -4.640 932 HD13 LEU 118 HD13 LEU 118 7.843 -2.309 -5.845 933 HD21 LEU 118 HD21 LEU 118 6.585 -1.323 -3.076 934 HD22 LEU 118 HD22 LEU 118 5.974 0.128 -3.869 935 HD23 LEU 118 HD23 LEU 118 7.574 -0.493 -4.277 936 H ILE 119 HN ILE 119 5.856 -3.822 -8.426 937 HA ILE 119 HA ILE 119 2.978 -4.370 -8.371 938 HB ILE 119 HB ILE 119 5.230 -5.951 -9.642 939 HG12 ILE 119 HG12 ILE 119 3.467 -3.735 -10.558 940 HG13 ILE 119 HG11 ILE 119 5.113 -4.130 -11.031 941 HG21 ILE 119 HG21 ILE 119 2.219 -6.276 -9.758 942 HG22 ILE 119 HG22 ILE 119 3.378 -7.396 -9.039 943 HG23 ILE 119 HG23 ILE 119 3.361 -7.145 -10.784 944 HD11 ILE 119 HD11 ILE 119 2.545 -5.269 -12.052 945 HD12 ILE 119 HD12 ILE 119 4.090 -6.091 -12.296 946 HD13 ILE 119 HD13 ILE 119 3.839 -4.468 -12.944 947 H ARG 120 HN ARG 120 2.305 -5.160 -6.483 948 HA ARG 120 HA ARG 120 3.979 -7.181 -5.139 949 HB2 ARG 120 HB2 ARG 120 2.341 -4.934 -4.019 950 HB3 ARG 120 HB1 ARG 120 2.661 -6.366 -3.049 951 HG2 ARG 120 HG2 ARG 120 4.919 -5.918 -2.903 952 HG3 ARG 120 HG1 ARG 120 4.916 -4.900 -4.344 953 HD2 ARG 120 HD2 ARG 120 5.126 -3.746 -2.056 954 HD3 ARG 120 HD1 ARG 120 3.972 -3.091 -3.213 955 HE ARG 120 HE ARG 120 3.286 -4.710 -0.848 956 HH11 ARG 120 HH11 ARG 120 2.433 -2.356 -3.299 957 HH12 ARG 120 HH12 ARG 120 0.828 -2.093 -2.672 958 HH21 ARG 120 HH21 ARG 120 1.157 -4.340 -0.030 959 HH22 ARG 120 HH22 ARG 120 0.119 -3.207 -0.838 960 H ARG 121 HN ARG 121 2.899 -8.880 -4.098 961 HA ARG 121 HA ARG 121 0.102 -9.301 -4.848 962 HB2 ARG 121 HB2 ARG 121 2.478 -11.100 -5.108 963 HB3 ARG 121 HB1 ARG 121 0.888 -11.795 -4.815 964 HG2 ARG 121 HG2 ARG 121 0.276 -11.486 -6.900 965 HG3 ARG 121 HG1 ARG 121 0.828 -9.819 -6.899 966 HD2 ARG 121 HD2 ARG 121 2.684 -12.159 -7.183 967 HD3 ARG 121 HD1 ARG 121 1.947 -11.343 -8.560 968 HE ARG 121 HE ARG 121 3.293 -9.564 -6.760 969 HH11 ARG 121 HH11 ARG 121 3.642 -11.713 -9.489 970 HH12 ARG 121 HH12 ARG 121 5.052 -10.917 -10.112 971 HH21 ARG 121 HH21 ARG 121 5.157 -8.470 -7.618 972 HH22 ARG 121 HH22 ARG 121 5.897 -9.074 -9.073 973 H SER 122 HN SER 122 -1.136 -10.090 -3.245 974 HA SER 122 HA SER 122 0.255 -10.819 -0.770 975 HB2 SER 122 HB2 SER 122 -2.355 -9.377 -0.642 976 HB3 SER 122 HB1 SER 122 -1.038 -9.414 0.527 977 HG SER 122 HG SER 122 -1.373 -7.841 -1.755 978 H LYS 123 HN LYS 123 -0.575 -12.416 0.446 979 HA LYS 123 HA LYS 123 -2.877 -13.864 -0.695 980 HB2 LYS 123 HB2 LYS 123 -0.500 -14.910 0.853 981 HB3 LYS 123 HB1 LYS 123 -1.852 -15.890 0.297 982 HG2 LYS 123 HG2 LYS 123 -0.699 -14.394 -1.860 983 HG3 LYS 123 HG1 LYS 123 0.526 -15.339 -1.016 984 HD2 LYS 123 HD2 LYS 123 -0.900 -17.349 -1.242 985 HD3 LYS 123 HD1 LYS 123 -2.062 -16.390 -2.160 986 HE2 LYS 123 HE2 LYS 123 -0.498 -16.039 -3.924 987 HE3 LYS 123 HE1 LYS 123 0.818 -16.717 -2.969 988 HZ1 LYS 123 HZ1 LYS 123 0.028 -18.282 -4.620 989 HZ2 LYS 123 HZ2 LYS 123 -1.535 -18.219 -3.979 990 HZ3 LYS 123 HZ3 LYS 123 -0.269 -18.870 -3.064 991 H ARG 124 HN ARG 124 -4.588 -14.217 0.620 992 HA ARG 124 HA ARG 124 -4.759 -12.832 3.076 993 HB2 ARG 124 HB2 ARG 124 -6.565 -14.086 1.364 994 HB3 ARG 124 HB1 ARG 124 -6.661 -14.997 2.868 995 HG2 ARG 124 HG2 ARG 124 -7.103 -12.932 4.094 996 HG3 ARG 124 HG1 ARG 124 -7.035 -12.035 2.575 997 HD2 ARG 124 HD2 ARG 124 -9.342 -12.562 3.315 998 HD3 ARG 124 HD1 ARG 124 -8.941 -13.198 1.723 999 HE ARG 124 HE ARG 124 -8.546 -15.376 2.943 1000 HH11 ARG 124 HH11 ARG 124 -10.852 -12.984 4.040 1001 HH12 ARG 124 HH12 ARG 124 -11.840 -14.137 4.874 1002 HH21 ARG 124 HH21 ARG 124 -9.855 -16.897 4.028 1003 HH22 ARG 124 HH22 ARG 124 -11.275 -16.368 4.871 1004 H VAL 125 HN VAL 125 -5.023 -13.614 5.155 1005 HA VAL 125 HA VAL 125 -4.745 -14.922 6.954 1006 HB VAL 125 HB VAL 125 -4.322 -17.239 5.074 1007 HG11 VAL 125 HG11 VAL 125 -5.019 -17.222 8.011 1008 HG12 VAL 125 HG12 VAL 125 -3.428 -17.596 7.347 1009 HG13 VAL 125 HG13 VAL 125 -4.800 -18.644 6.992 1010 HG21 VAL 125 HG21 VAL 125 -6.527 -16.056 4.879 1011 HG22 VAL 125 HG22 VAL 125 -6.825 -16.474 6.567 1012 HG23 VAL 125 HG23 VAL 125 -6.637 -17.749 5.366 Start of MODEL 5 1 H1 ALA 1 HT1 ALA 1 -13.028 -10.394 0.790 2 H2 ALA 1 HT2 ALA 1 -13.171 -9.711 -0.750 3 H3 ALA 1 HT3 ALA 1 -14.556 -10.103 0.135 4 HA ALA 1 HA ALA 1 -13.967 -7.691 0.079 5 HB1 ALA 1 HB1 ALA 1 -14.568 -7.336 2.379 6 HB2 ALA 1 HB2 ALA 1 -14.052 -8.965 2.808 7 HB3 ALA 1 HB3 ALA 1 -15.461 -8.732 1.773 8 H PHE 2 HN PHE 2 -12.665 -6.049 1.165 9 HA PHE 2 HA PHE 2 -9.879 -6.756 1.145 10 HB2 PHE 2 HB2 PHE 2 -11.447 -4.231 1.348 11 HB3 PHE 2 HB1 PHE 2 -9.796 -4.220 1.962 12 HD1 PHE 2 HD1 PHE 2 -7.912 -4.696 0.439 13 HD2 PHE 2 HD2 PHE 2 -11.903 -4.280 -0.977 14 HE1 PHE 2 HE1 PHE 2 -7.066 -4.364 -1.847 15 HE2 PHE 2 HE2 PHE 2 -11.059 -3.939 -3.261 16 HZ PHE 2 HZ PHE 2 -8.640 -3.986 -3.696 17 H SER 3 HN SER 3 -12.321 -6.103 3.543 18 HA SER 3 HA SER 3 -10.815 -5.567 5.808 19 HB2 SER 3 HB2 SER 3 -13.001 -7.286 6.491 20 HB3 SER 3 HB1 SER 3 -12.880 -5.537 6.661 21 HG SER 3 HG SER 3 -14.456 -6.838 5.035 22 H GLY 4 HN GLY 4 -9.026 -6.723 6.296 23 HA2 GLY 4 HA2 GLY 4 -9.076 -9.172 7.531 24 HA3 GLY 4 HA1 GLY 4 -8.800 -9.531 5.833 25 H THR 5 HN THR 5 -6.768 -10.389 6.396 26 HA THR 5 HA THR 5 -4.734 -8.297 6.764 27 HB THR 5 HB THR 5 -3.450 -10.314 7.899 28 HG1 THR 5 HG1 THR 5 -4.938 -11.907 7.963 29 HG21 THR 5 HG21 THR 5 -5.491 -8.615 9.326 30 HG22 THR 5 HG22 THR 5 -3.836 -8.147 8.938 31 HG23 THR 5 HG23 THR 5 -4.135 -9.445 10.092 32 H TRP 6 HN TRP 6 -3.438 -8.247 5.032 33 HA TRP 6 HA TRP 6 -3.079 -10.758 3.523 34 HB2 TRP 6 HB2 TRP 6 -2.746 -8.017 2.334 35 HB3 TRP 6 HB1 TRP 6 -3.004 -9.549 1.509 36 HD1 TRP 6 HD1 TRP 6 -4.937 -6.971 3.639 37 HE1 TRP 6 HE1 TRP 6 -7.430 -7.123 3.017 38 HE3 TRP 6 HE3 TRP 6 -4.736 -11.020 0.513 39 HZ2 TRP 6 HZ2 TRP 6 -9.089 -8.766 1.425 40 HZ3 TRP 6 HZ3 TRP 6 -6.827 -11.822 -0.511 41 HH2 TRP 6 HH2 TRP 6 -8.957 -10.713 -0.065 42 H GLN 7 HN GLN 7 -1.170 -11.544 3.321 43 HA GLN 7 HA GLN 7 1.117 -9.966 4.207 44 HB2 GLN 7 HB2 GLN 7 2.302 -12.117 4.294 45 HB3 GLN 7 HB1 GLN 7 0.822 -12.138 5.241 46 HG2 GLN 7 HG2 GLN 7 -0.299 -13.313 3.372 47 HG3 GLN 7 HG1 GLN 7 1.260 -13.403 2.550 48 HE21 GLN 7 HE21 GLN 7 -0.478 -15.538 3.511 49 HE22 GLN 7 HE22 GLN 7 0.481 -16.481 4.595 50 H VAL 8 HN VAL 8 2.630 -9.274 2.842 51 HA VAL 8 HA VAL 8 2.091 -9.612 -0.004 52 HB VAL 8 HB VAL 8 3.594 -7.572 1.598 53 HG11 VAL 8 HG11 VAL 8 5.000 -7.919 -0.308 54 HG12 VAL 8 HG12 VAL 8 4.104 -6.416 -0.537 55 HG13 VAL 8 HG13 VAL 8 3.613 -7.878 -1.396 56 HG21 VAL 8 HG21 VAL 8 1.297 -7.353 -0.343 57 HG22 VAL 8 HG22 VAL 8 1.996 -6.035 0.598 58 HG23 VAL 8 HG23 VAL 8 1.163 -7.357 1.416 59 H TYR 9 HN TYR 9 3.535 -10.214 -1.528 60 HA TYR 9 HA TYR 9 6.291 -10.863 -0.864 61 HB2 TYR 9 HB2 TYR 9 6.185 -13.159 -1.578 62 HB3 TYR 9 HB1 TYR 9 4.923 -12.942 -0.374 63 HD1 TYR 9 HD1 TYR 9 2.521 -12.806 -1.109 64 HD2 TYR 9 HD2 TYR 9 5.664 -13.785 -3.818 65 HE1 TYR 9 HE1 TYR 9 0.886 -13.647 -2.695 66 HE2 TYR 9 HE2 TYR 9 4.011 -14.635 -5.415 67 HH TYR 9 HH TYR 9 0.698 -14.023 -5.138 68 H ALA 10 HN ALA 10 7.517 -10.118 -2.534 69 HA ALA 10 HA ALA 10 7.089 -10.598 -5.247 70 HB1 ALA 10 HB1 ALA 10 6.088 -7.883 -4.393 71 HB2 ALA 10 HB2 ALA 10 5.148 -9.174 -5.141 72 HB3 ALA 10 HB3 ALA 10 6.413 -8.356 -6.061 73 H GLN 11 HN GLN 11 8.923 -10.197 -6.331 74 HA GLN 11 HA GLN 11 10.900 -8.432 -5.051 75 HB2 GLN 11 HB2 GLN 11 11.313 -10.883 -6.769 76 HB3 GLN 11 HB1 GLN 11 12.609 -9.803 -6.276 77 HG2 GLN 11 HG2 GLN 11 12.766 -11.489 -4.729 78 HG3 GLN 11 HG1 GLN 11 11.778 -10.306 -3.875 79 HE21 GLN 11 HE21 GLN 11 10.830 -11.825 -2.545 80 HE22 GLN 11 HE22 GLN 11 9.689 -12.993 -3.123 81 H GLU 12 HN GLU 12 9.354 -6.954 -6.400 82 HA GLU 12 HA GLU 12 10.296 -6.716 -9.169 83 HB2 GLU 12 HB2 GLU 12 7.766 -6.540 -8.268 84 HB3 GLU 12 HB1 GLU 12 8.230 -4.864 -8.101 85 HG2 GLU 12 HG2 GLU 12 7.250 -5.003 -10.203 86 HG3 GLU 12 HG1 GLU 12 8.984 -5.017 -10.530 87 H ASN 13 HN ASN 13 9.426 -3.947 -9.062 88 HA ASN 13 HA ASN 13 11.895 -2.647 -8.577 89 HB2 ASN 13 HB2 ASN 13 10.303 -0.611 -9.022 90 HB3 ASN 13 HB1 ASN 13 10.640 -1.738 -10.333 91 HD21 ASN 13 HD21 ASN 13 8.824 -1.931 -11.440 92 HD22 ASN 13 HD22 ASN 13 7.221 -2.027 -10.817 93 H TYR 14 HN TYR 14 10.710 -3.859 -6.180 94 HA TYR 14 HA TYR 14 9.434 -2.014 -4.513 95 HB2 TYR 14 HB2 TYR 14 9.487 -4.394 -4.028 96 HB3 TYR 14 HB1 TYR 14 11.234 -4.343 -3.834 97 HD1 TYR 14 HD1 TYR 14 8.015 -3.471 -2.317 98 HD2 TYR 14 HD2 TYR 14 12.237 -3.497 -1.809 99 HE1 TYR 14 HE1 TYR 14 7.727 -3.050 0.091 100 HE2 TYR 14 HE2 TYR 14 11.958 -3.068 0.589 101 HH TYR 14 HH TYR 14 9.824 -3.623 2.314 102 H GLU 15 HN GLU 15 12.861 -3.017 -4.342 103 HA GLU 15 HA GLU 15 13.625 -0.982 -2.569 104 HB2 GLU 15 HB2 GLU 15 15.968 -1.553 -3.319 105 HB3 GLU 15 HB1 GLU 15 15.015 -2.890 -2.699 106 HG2 GLU 15 HG2 GLU 15 14.496 -3.521 -5.052 107 HG3 GLU 15 HG1 GLU 15 15.636 -2.279 -5.575 108 H GLU 16 HN GLU 16 13.206 -0.942 -5.993 109 HA GLU 16 HA GLU 16 14.813 1.403 -6.437 110 HB2 GLU 16 HB2 GLU 16 12.883 -0.164 -8.130 111 HB3 GLU 16 HB1 GLU 16 13.613 1.328 -8.699 112 HG2 GLU 16 HG2 GLU 16 15.853 0.260 -8.161 113 HG3 GLU 16 HG1 GLU 16 14.964 -1.252 -7.995 114 H PHE 17 HN PHE 17 11.413 0.677 -5.910 115 HA PHE 17 HA PHE 17 10.439 3.276 -6.498 116 HB2 PHE 17 HB2 PHE 17 8.945 1.390 -6.617 117 HB3 PHE 17 HB1 PHE 17 9.255 0.965 -4.940 118 HD1 PHE 17 HD1 PHE 17 8.472 4.265 -6.460 119 HD2 PHE 17 HD2 PHE 17 7.223 1.118 -3.903 120 HE1 PHE 17 HE1 PHE 17 6.512 5.585 -5.804 121 HE2 PHE 17 HE2 PHE 17 5.257 2.422 -3.237 122 HZ PHE 17 HZ PHE 17 4.896 4.664 -4.185 123 H LEU 18 HN LEU 18 11.633 1.669 -3.633 124 HA LEU 18 HA LEU 18 10.826 3.539 -1.717 125 HB2 LEU 18 HB2 LEU 18 13.354 1.893 -1.716 126 HB3 LEU 18 HB1 LEU 18 12.626 2.660 -0.321 127 HG LEU 18 HG LEU 18 11.723 0.215 -1.804 128 HD11 LEU 18 HD11 LEU 18 11.535 -0.632 0.514 129 HD12 LEU 18 HD12 LEU 18 12.186 0.902 1.089 130 HD13 LEU 18 HD13 LEU 18 13.169 -0.145 0.067 131 HD21 LEU 18 HD21 LEU 18 10.020 1.953 -0.028 132 HD22 LEU 18 HD22 LEU 18 9.623 0.302 -0.502 133 HD23 LEU 18 HD23 LEU 18 9.733 1.567 -1.725 134 H LYS 19 HN LYS 19 13.576 3.483 -3.906 135 HA LYS 19 HA LYS 19 14.958 5.684 -2.738 136 HB2 LYS 19 HB2 LYS 19 15.150 4.881 -5.639 137 HB3 LYS 19 HB1 LYS 19 16.387 5.616 -4.627 138 HG2 LYS 19 HG2 LYS 19 15.740 3.221 -3.353 139 HG3 LYS 19 HG1 LYS 19 15.796 2.838 -5.072 140 HD2 LYS 19 HD2 LYS 19 18.026 3.629 -5.260 141 HD3 LYS 19 HD1 LYS 19 17.973 4.350 -3.648 142 HE2 LYS 19 HE2 LYS 19 17.794 2.136 -2.650 143 HE3 LYS 19 HE1 LYS 19 17.789 1.399 -4.249 144 HZ1 LYS 19 HZ1 LYS 19 20.022 3.053 -3.206 145 HZ2 LYS 19 HZ2 LYS 19 20.015 2.103 -4.609 146 HZ3 LYS 19 HZ3 LYS 19 19.974 1.361 -3.090 147 H ALA 20 HN ALA 20 12.394 5.359 -5.083 148 HA ALA 20 HA ALA 20 12.520 8.033 -6.050 149 HB1 ALA 20 HB1 ALA 20 11.464 6.283 -7.384 150 HB2 ALA 20 HB2 ALA 20 10.303 7.563 -7.029 151 HB3 ALA 20 HB3 ALA 20 10.244 6.045 -6.134 152 H LEU 21 HN LEU 21 11.046 6.447 -3.363 153 HA LEU 21 HA LEU 21 9.337 8.671 -2.680 154 HB2 LEU 21 HB2 LEU 21 10.092 6.224 -1.078 155 HB3 LEU 21 HB1 LEU 21 8.806 7.350 -0.687 156 HG LEU 21 HG LEU 21 8.831 5.747 -3.238 157 HD11 LEU 21 HD11 LEU 21 8.832 4.108 -1.530 158 HD12 LEU 21 HD12 LEU 21 7.162 4.292 -2.061 159 HD13 LEU 21 HD13 LEU 21 7.693 5.031 -0.549 160 HD21 LEU 21 HD21 LEU 21 6.289 6.199 -2.828 161 HD22 LEU 21 HD22 LEU 21 7.314 7.449 -3.532 162 HD23 LEU 21 HD23 LEU 21 6.892 7.517 -1.823 163 H ALA 22 HN ALA 22 12.503 8.376 -2.691 164 HA ALA 22 HA ALA 22 14.266 9.388 -1.694 165 HB1 ALA 22 HB1 ALA 22 12.272 11.117 -0.249 166 HB2 ALA 22 HB2 ALA 22 12.744 11.374 -1.931 167 HB3 ALA 22 HB3 ALA 22 13.949 11.496 -0.647 168 H LEU 23 HN LEU 23 13.108 7.070 -0.503 169 HA LEU 23 HA LEU 23 13.213 7.457 2.363 170 HB2 LEU 23 HB2 LEU 23 12.915 4.997 0.642 171 HB3 LEU 23 HB1 LEU 23 12.967 4.937 2.395 172 HG LEU 23 HG LEU 23 10.939 6.567 0.872 173 HD11 LEU 23 HD11 LEU 23 10.660 4.245 0.248 174 HD12 LEU 23 HD12 LEU 23 9.347 4.773 1.300 175 HD13 LEU 23 HD13 LEU 23 10.647 3.770 1.948 176 HD21 LEU 23 HD21 LEU 23 9.718 6.553 2.969 177 HD22 LEU 23 HD22 LEU 23 11.333 7.213 3.208 178 HD23 LEU 23 HD23 LEU 23 10.972 5.566 3.717 179 HA PRO 24 HA PRO 24 17.458 6.866 3.047 180 HB2 PRO 24 HB2 PRO 24 17.458 5.006 5.130 181 HB3 PRO 24 HB1 PRO 24 17.353 6.764 5.298 182 HG2 PRO 24 HG2 PRO 24 15.281 4.744 5.610 183 HG3 PRO 24 HG1 PRO 24 15.329 6.415 6.193 184 HD2 PRO 24 HD2 PRO 24 13.809 5.453 4.059 185 HD3 PRO 24 HD1 PRO 24 14.136 7.149 4.429 186 H GLU 25 HN GLU 25 18.868 5.826 1.874 187 HA GLU 25 HA GLU 25 18.442 3.442 0.526 188 HB2 GLU 25 HB2 GLU 25 21.066 4.722 1.304 189 HB3 GLU 25 HB1 GLU 25 20.876 3.473 0.079 190 HG2 GLU 25 HG2 GLU 25 19.068 5.428 -0.678 191 HG3 GLU 25 HG1 GLU 25 20.464 6.336 -0.099 192 H ASP 26 HN ASP 26 19.879 4.023 3.664 193 HA ASP 26 HA ASP 26 20.962 1.452 4.079 194 HB2 ASP 26 HB2 ASP 26 21.551 3.431 5.444 195 HB3 ASP 26 HB1 ASP 26 19.936 3.417 6.142 196 H LEU 27 HN LEU 27 17.775 2.835 4.725 197 HA LEU 27 HA LEU 27 16.806 0.509 6.080 198 HB2 LEU 27 HB2 LEU 27 15.896 2.769 6.437 199 HB3 LEU 27 HB1 LEU 27 15.301 2.778 4.787 200 HG LEU 27 HG LEU 27 14.177 0.483 5.843 201 HD11 LEU 27 HD11 LEU 27 14.182 2.655 7.925 202 HD12 LEU 27 HD12 LEU 27 14.868 1.036 8.074 203 HD13 LEU 27 HD13 LEU 27 13.123 1.246 7.932 204 HD21 LEU 27 HD21 LEU 27 13.113 3.288 5.558 205 HD22 LEU 27 HD22 LEU 27 12.102 1.877 5.852 206 HD23 LEU 27 HD23 LEU 27 13.046 1.990 4.367 207 H ILE 28 HN ILE 28 16.763 1.714 2.801 208 HA ILE 28 HA ILE 28 14.861 -0.004 1.686 209 HB ILE 28 HB ILE 28 17.307 1.242 0.421 210 HG12 ILE 28 HG12 ILE 28 14.420 2.105 0.307 211 HG13 ILE 28 HG11 ILE 28 15.565 2.727 1.489 212 HG21 ILE 28 HG21 ILE 28 14.883 0.061 -0.932 213 HG22 ILE 28 HG22 ILE 28 16.490 -0.662 -0.904 214 HG23 ILE 28 HG23 ILE 28 16.228 0.878 -1.724 215 HD11 ILE 28 HD11 ILE 28 16.924 3.223 -0.774 216 HD12 ILE 28 HD12 ILE 28 15.795 4.357 -0.031 217 HD13 ILE 28 HD13 ILE 28 15.267 3.340 -1.373 218 H LYS 29 HN LYS 29 18.272 -0.484 2.359 219 HA LYS 29 HA LYS 29 18.627 -2.873 0.904 220 HB2 LYS 29 HB2 LYS 29 20.074 -1.855 3.354 221 HB3 LYS 29 HB1 LYS 29 20.608 -3.204 2.362 222 HG2 LYS 29 HG2 LYS 29 21.131 -1.832 0.555 223 HG3 LYS 29 HG1 LYS 29 20.166 -0.491 1.172 224 HD2 LYS 29 HD2 LYS 29 22.457 0.059 1.508 225 HD3 LYS 29 HD1 LYS 29 21.779 -0.342 3.087 226 HE2 LYS 29 HE2 LYS 29 22.692 -2.667 2.752 227 HE3 LYS 29 HE1 LYS 29 23.545 -2.047 1.338 228 HZ1 LYS 29 HZ1 LYS 29 23.859 -1.036 4.111 229 HZ2 LYS 29 HZ2 LYS 29 24.704 -0.490 2.751 230 HZ3 LYS 29 HZ3 LYS 29 24.939 -2.066 3.316 231 H MET 30 HN MET 30 17.480 -2.251 4.186 232 HA MET 30 HA MET 30 17.433 -5.106 4.763 233 HB2 MET 30 HB2 MET 30 16.398 -4.307 6.968 234 HB3 MET 30 HB1 MET 30 18.075 -3.885 6.660 235 HG2 MET 30 HG2 MET 30 17.209 -1.664 5.813 236 HG3 MET 30 HG1 MET 30 15.661 -2.118 6.512 237 HE1 MET 30 HE1 MET 30 19.582 -1.532 8.797 238 HE2 MET 30 HE2 MET 30 19.208 -0.448 7.459 239 HE3 MET 30 HE3 MET 30 19.373 -2.180 7.169 240 H ALA 31 HN ALA 31 15.215 -2.473 4.132 241 HA ALA 31 HA ALA 31 12.802 -3.780 4.702 242 HB1 ALA 31 HB1 ALA 31 11.758 -2.071 3.295 243 HB2 ALA 31 HB2 ALA 31 13.344 -1.613 2.673 244 HB3 ALA 31 HB3 ALA 31 12.962 -1.374 4.378 245 H ARG 32 HN ARG 32 14.857 -3.872 1.854 246 HA ARG 32 HA ARG 32 12.982 -5.008 0.075 247 HB2 ARG 32 HB2 ARG 32 14.762 -5.318 -1.412 248 HB3 ARG 32 HB1 ARG 32 15.255 -3.926 -0.463 249 HG2 ARG 32 HG2 ARG 32 16.637 -5.434 0.929 250 HG3 ARG 32 HG1 ARG 32 16.219 -6.755 -0.161 251 HD2 ARG 32 HD2 ARG 32 17.084 -5.163 -2.015 252 HD3 ARG 32 HD1 ARG 32 17.871 -4.316 -0.687 253 HE ARG 32 HE ARG 32 18.999 -6.467 -0.191 254 HH11 ARG 32 HH11 ARG 32 17.711 -5.892 -3.410 255 HH12 ARG 32 HH12 ARG 32 18.847 -6.959 -4.177 256 HH21 ARG 32 HH21 ARG 32 20.462 -7.892 -1.220 257 HH22 ARG 32 HH22 ARG 32 20.397 -8.096 -2.942 258 H ASP 33 HN ASP 33 14.812 -6.363 2.670 259 HA ASP 33 HA ASP 33 14.344 -9.091 1.702 260 HB2 ASP 33 HB2 ASP 33 16.607 -8.379 2.607 261 HB3 ASP 33 HB1 ASP 33 15.841 -8.265 4.190 262 H ILE 34 HN ILE 34 12.999 -6.777 3.740 263 HA ILE 34 HA ILE 34 11.835 -8.650 5.612 264 HB ILE 34 HB ILE 34 11.495 -5.669 5.301 265 HG12 ILE 34 HG12 ILE 34 13.257 -7.452 6.847 266 HG13 ILE 34 HG11 ILE 34 13.537 -5.817 6.276 267 HG21 ILE 34 HG21 ILE 34 10.479 -7.213 7.660 268 HG22 ILE 34 HG22 ILE 34 9.470 -6.983 6.232 269 HG23 ILE 34 HG23 ILE 34 10.056 -5.580 7.133 270 HD11 ILE 34 HD11 ILE 34 13.577 -5.736 8.623 271 HD12 ILE 34 HD12 ILE 34 12.091 -6.677 8.757 272 HD13 ILE 34 HD13 ILE 34 12.037 -5.030 8.129 273 H LYS 35 HN LYS 35 9.847 -9.449 5.568 274 HA LYS 35 HA LYS 35 8.038 -8.543 3.434 275 HB2 LYS 35 HB2 LYS 35 7.092 -10.991 3.824 276 HB3 LYS 35 HB1 LYS 35 8.394 -10.666 2.690 277 HG2 LYS 35 HG2 LYS 35 9.192 -11.268 5.462 278 HG3 LYS 35 HG1 LYS 35 8.492 -12.585 4.525 279 HD2 LYS 35 HD2 LYS 35 10.147 -12.343 2.812 280 HD3 LYS 35 HD1 LYS 35 10.763 -10.864 3.551 281 HE2 LYS 35 HE2 LYS 35 11.348 -12.247 5.569 282 HE3 LYS 35 HE1 LYS 35 10.955 -13.676 4.614 283 HZ1 LYS 35 HZ1 LYS 35 13.357 -13.015 4.667 284 HZ2 LYS 35 HZ2 LYS 35 12.941 -11.655 3.753 285 HZ3 LYS 35 HZ3 LYS 35 12.701 -13.206 3.119 286 HA PRO 36 HA PRO 36 5.874 -7.746 7.373 287 HB2 PRO 36 HB2 PRO 36 4.849 -5.353 6.671 288 HB3 PRO 36 HB1 PRO 36 6.538 -5.522 7.192 289 HG2 PRO 36 HG2 PRO 36 5.429 -5.233 4.452 290 HG3 PRO 36 HG1 PRO 36 6.900 -4.537 5.156 291 HD2 PRO 36 HD2 PRO 36 6.846 -6.768 3.536 292 HD3 PRO 36 HD1 PRO 36 8.146 -6.379 4.677 293 H ILE 37 HN ILE 37 3.501 -6.996 7.653 294 HA ILE 37 HA ILE 37 1.888 -8.152 5.488 295 HB ILE 37 HB ILE 37 2.084 -9.706 7.406 296 HG12 ILE 37 HG12 ILE 37 -0.060 -9.230 5.898 297 HG13 ILE 37 HG11 ILE 37 -0.060 -10.452 7.163 298 HG21 ILE 37 HG21 ILE 37 2.308 -8.080 9.199 299 HG22 ILE 37 HG22 ILE 37 0.995 -9.208 9.527 300 HG23 ILE 37 HG23 ILE 37 0.634 -7.576 8.967 301 HD11 ILE 37 HD11 ILE 37 -1.057 -7.641 7.552 302 HD12 ILE 37 HD12 ILE 37 -1.231 -9.006 8.655 303 HD13 ILE 37 HD13 ILE 37 -2.084 -9.007 7.112 304 H VAL 38 HN VAL 38 0.026 -7.091 4.959 305 HA VAL 38 HA VAL 38 -0.232 -4.403 6.078 306 HB VAL 38 HB VAL 38 -1.585 -5.631 3.670 307 HG11 VAL 38 HG11 VAL 38 -2.249 -3.355 3.109 308 HG12 VAL 38 HG12 VAL 38 -1.513 -2.761 4.596 309 HG13 VAL 38 HG13 VAL 38 -2.913 -3.832 4.672 310 HG21 VAL 38 HG21 VAL 38 0.773 -5.415 3.269 311 HG22 VAL 38 HG22 VAL 38 0.773 -3.771 3.907 312 HG23 VAL 38 HG23 VAL 38 -0.063 -4.129 2.395 313 H GLU 39 HN GLU 39 -1.474 -4.273 7.825 314 HA GLU 39 HA GLU 39 -3.753 -6.047 8.142 315 HB2 GLU 39 HB2 GLU 39 -2.102 -4.371 9.904 316 HB3 GLU 39 HB1 GLU 39 -3.819 -4.339 10.286 317 HG2 GLU 39 HG2 GLU 39 -3.899 -6.631 10.704 318 HG3 GLU 39 HG1 GLU 39 -2.373 -6.926 9.883 319 H ILE 40 HN ILE 40 -5.761 -5.490 7.642 320 HA ILE 40 HA ILE 40 -6.463 -2.652 7.506 321 HB ILE 40 HB ILE 40 -5.880 -3.246 5.225 322 HG12 ILE 40 HG12 ILE 40 -8.035 -1.859 5.872 323 HG13 ILE 40 HG11 ILE 40 -7.669 -2.238 4.193 324 HG21 ILE 40 HG21 ILE 40 -6.150 -5.613 5.260 325 HG22 ILE 40 HG22 ILE 40 -7.155 -4.952 3.971 326 HG23 ILE 40 HG23 ILE 40 -7.890 -5.463 5.491 327 HD11 ILE 40 HD11 ILE 40 -9.996 -2.597 4.595 328 HD12 ILE 40 HD12 ILE 40 -9.648 -3.631 5.980 329 HD13 ILE 40 HD13 ILE 40 -9.223 -4.161 4.352 330 H GLN 41 HN GLN 41 -8.365 -2.201 8.397 331 HA GLN 41 HA GLN 41 -10.376 -4.323 8.618 332 HB2 GLN 41 HB2 GLN 41 -10.831 -3.533 10.978 333 HB3 GLN 41 HB1 GLN 41 -9.340 -4.435 10.755 334 HG2 GLN 41 HG2 GLN 41 -8.144 -2.239 10.619 335 HG3 GLN 41 HG1 GLN 41 -9.658 -1.471 11.090 336 HE21 GLN 41 HE21 GLN 41 -7.036 -1.632 12.430 337 HE22 GLN 41 HE22 GLN 41 -7.360 -2.279 13.998 338 H GLN 42 HN GLN 42 -12.463 -3.607 8.366 339 HA GLN 42 HA GLN 42 -12.788 -0.695 8.127 340 HB2 GLN 42 HB2 GLN 42 -14.325 -1.007 6.286 341 HB3 GLN 42 HB1 GLN 42 -12.770 -1.741 5.916 342 HG2 GLN 42 HG2 GLN 42 -13.606 -3.801 5.879 343 HG3 GLN 42 HG1 GLN 42 -14.761 -3.506 7.158 344 HE21 GLN 42 HE21 GLN 42 -14.993 -4.764 4.481 345 HE22 GLN 42 HE22 GLN 42 -16.312 -3.940 3.730 346 H LYS 43 HN LYS 43 -15.446 -0.649 7.571 347 HA LYS 43 HA LYS 43 -17.136 -2.073 9.278 348 HB2 LYS 43 HB2 LYS 43 -15.813 -0.871 11.045 349 HB3 LYS 43 HB1 LYS 43 -16.370 0.652 10.368 350 HG2 LYS 43 HG2 LYS 43 -18.589 0.255 11.028 351 HG3 LYS 43 HG1 LYS 43 -18.277 -1.454 11.334 352 HD2 LYS 43 HD2 LYS 43 -18.469 -0.187 13.417 353 HD3 LYS 43 HD1 LYS 43 -16.849 -0.864 13.223 354 HE2 LYS 43 HE2 LYS 43 -15.976 1.265 12.545 355 HE3 LYS 43 HE1 LYS 43 -17.593 1.968 12.487 356 HZ1 LYS 43 HZ1 LYS 43 -16.226 2.490 14.512 357 HZ2 LYS 43 HZ2 LYS 43 -16.410 0.875 14.973 358 HZ3 LYS 43 HZ3 LYS 43 -17.769 1.867 14.821 359 H GLY 44 HN GLY 44 -18.383 -1.967 7.391 360 HA2 GLY 44 HA2 GLY 44 -20.237 -1.080 6.295 361 HA3 GLY 44 HA1 GLY 44 -19.973 0.446 7.129 362 H ASP 45 HN ASP 45 -18.537 1.956 6.253 363 HA ASP 45 HA ASP 45 -17.534 1.363 3.560 364 HB2 ASP 45 HB2 ASP 45 -18.010 3.978 3.319 365 HB3 ASP 45 HB1 ASP 45 -19.197 2.761 2.892 366 H ASP 46 HN ASP 46 -16.914 2.545 6.664 367 HA ASP 46 HA ASP 46 -14.647 4.198 5.892 368 HB2 ASP 46 HB2 ASP 46 -16.039 3.567 8.465 369 HB3 ASP 46 HB1 ASP 46 -14.370 4.122 8.527 370 H PHE 47 HN PHE 47 -12.666 3.451 5.654 371 HA PHE 47 HA PHE 47 -12.020 0.774 6.724 372 HB2 PHE 47 HB2 PHE 47 -11.107 2.214 4.250 373 HB3 PHE 47 HB1 PHE 47 -10.184 0.880 4.918 374 HD1 PHE 47 HD2 PHE 47 -13.834 1.440 4.362 375 HD2 PHE 47 HD1 PHE 47 -10.412 -0.969 3.614 376 HE1 PHE 47 HE2 PHE 47 -15.228 -0.148 3.105 377 HE2 PHE 47 HE1 PHE 47 -11.799 -2.555 2.352 378 HZ PHE 47 HZ PHE 47 -14.210 -2.149 2.099 379 H VAL 48 HN VAL 48 -10.015 0.428 7.625 380 HA VAL 48 HA VAL 48 -8.318 2.766 8.150 381 HB VAL 48 HB VAL 48 -8.834 0.669 10.260 382 HG11 VAL 48 HG11 VAL 48 -7.922 2.425 11.746 383 HG12 VAL 48 HG12 VAL 48 -7.649 3.444 10.331 384 HG13 VAL 48 HG13 VAL 48 -6.777 1.920 10.502 385 HG21 VAL 48 HG21 VAL 48 -10.966 1.762 9.813 386 HG22 VAL 48 HG22 VAL 48 -10.203 3.343 9.987 387 HG23 VAL 48 HG23 VAL 48 -10.318 2.261 11.377 388 H VAL 49 HN VAL 49 -6.606 2.246 6.951 389 HA VAL 49 HA VAL 49 -5.605 -0.512 6.986 390 HB VAL 49 HB VAL 49 -4.632 1.733 5.221 391 HG11 VAL 49 HG11 VAL 49 -4.494 -1.245 4.795 392 HG12 VAL 49 HG12 VAL 49 -3.208 -0.308 5.558 393 HG13 VAL 49 HG13 VAL 49 -3.666 0.020 3.888 394 HG21 VAL 49 HG21 VAL 49 -6.754 -0.319 4.583 395 HG22 VAL 49 HG22 VAL 49 -6.098 0.886 3.478 396 HG23 VAL 49 HG23 VAL 49 -7.042 1.396 4.876 397 H THR 50 HN THR 50 -3.754 -1.045 7.964 398 HA THR 50 HA THR 50 -2.143 1.137 9.111 399 HB THR 50 HB THR 50 -2.757 -1.603 10.242 400 HG1 THR 50 HG1 THR 50 -4.385 -0.109 10.654 401 HG21 THR 50 HG21 THR 50 -0.704 0.440 11.031 402 HG22 THR 50 HG22 THR 50 -0.549 -1.313 10.909 403 HG23 THR 50 HG23 THR 50 -1.441 -0.601 12.254 404 H SER 51 HN SER 51 -0.331 1.321 7.962 405 HA SER 51 HA SER 51 0.875 -0.968 6.663 406 HB2 SER 51 HB2 SER 51 2.234 1.699 6.871 407 HB3 SER 51 HB1 SER 51 2.176 0.576 5.510 408 HG SER 51 HG SER 51 0.228 1.318 4.945 409 H LYS 52 HN LYS 52 2.272 -2.254 7.645 410 HA LYS 52 HA LYS 52 3.324 -1.464 10.246 411 HB2 LYS 52 HB2 LYS 52 3.136 -4.158 8.901 412 HB3 LYS 52 HB1 LYS 52 3.846 -3.886 10.488 413 HG2 LYS 52 HG2 LYS 52 1.723 -3.097 11.340 414 HG3 LYS 52 HG1 LYS 52 0.991 -3.266 9.744 415 HD2 LYS 52 HD2 LYS 52 0.330 -5.199 10.871 416 HD3 LYS 52 HD1 LYS 52 1.706 -5.727 9.900 417 HE2 LYS 52 HE2 LYS 52 3.154 -5.679 11.790 418 HE3 LYS 52 HE1 LYS 52 1.945 -4.862 12.777 419 HZ1 LYS 52 HZ1 LYS 52 1.842 -7.655 11.776 420 HZ2 LYS 52 HZ2 LYS 52 0.538 -6.882 12.530 421 HZ3 LYS 52 HZ3 LYS 52 1.978 -7.147 13.383 422 H THR 53 HN THR 53 5.329 -0.863 10.519 423 HA THR 53 HA THR 53 7.398 -1.871 8.703 424 HB THR 53 HB THR 53 8.319 0.223 8.236 425 HG1 THR 53 HG1 THR 53 6.738 1.786 9.906 426 HG21 THR 53 HG21 THR 53 6.602 1.611 7.325 427 HG22 THR 53 HG22 THR 53 5.398 0.941 8.428 428 HG23 THR 53 HG23 THR 53 6.088 -0.065 7.149 429 HA PRO 54 HA PRO 54 9.768 -2.775 12.333 430 HB2 PRO 54 HB2 PRO 54 11.977 -1.564 10.688 431 HB3 PRO 54 HB1 PRO 54 11.937 -3.115 11.555 432 HG2 PRO 54 HG2 PRO 54 11.655 -3.086 8.955 433 HG3 PRO 54 HG1 PRO 54 10.623 -4.133 9.950 434 HD2 PRO 54 HD2 PRO 54 9.950 -1.555 8.609 435 HD3 PRO 54 HD1 PRO 54 8.964 -3.015 8.821 436 H ARG 55 HN ARG 55 9.729 0.422 10.933 437 HA ARG 55 HA ARG 55 11.059 1.566 13.251 438 HB2 ARG 55 HB2 ARG 55 10.123 2.713 10.628 439 HB3 ARG 55 HB1 ARG 55 10.679 3.737 11.945 440 HG2 ARG 55 HG2 ARG 55 12.823 2.365 11.894 441 HG3 ARG 55 HG1 ARG 55 12.240 1.727 10.353 442 HD2 ARG 55 HD2 ARG 55 12.200 3.897 9.386 443 HD3 ARG 55 HD1 ARG 55 12.495 4.663 10.946 444 HE ARG 55 HE ARG 55 14.590 2.869 10.193 445 HH11 ARG 55 HH11 ARG 55 13.314 6.091 9.726 446 HH12 ARG 55 HH12 ARG 55 14.850 6.776 9.300 447 HH21 ARG 55 HH21 ARG 55 16.609 3.752 9.598 448 HH22 ARG 55 HH22 ARG 55 16.730 5.447 9.240 449 H GLN 56 HN GLN 56 8.075 2.385 11.448 450 HA GLN 56 HA GLN 56 6.607 2.586 13.945 451 HB2 GLN 56 HB2 GLN 56 7.604 4.783 13.822 452 HB3 GLN 56 HB1 GLN 56 7.107 4.957 12.148 453 HG2 GLN 56 HG2 GLN 56 4.711 4.545 13.326 454 HG3 GLN 56 HG1 GLN 56 5.582 5.349 14.630 455 HE21 GLN 56 HE21 GLN 56 6.180 5.937 11.228 456 HE22 GLN 56 HE22 GLN 56 5.569 7.554 11.211 457 H THR 57 HN THR 57 4.456 2.233 13.694 458 HA THR 57 HA THR 57 3.526 1.449 11.069 459 HB THR 57 HB THR 57 1.356 1.205 12.708 460 HG1 THR 57 HG1 THR 57 2.122 1.609 14.665 461 HG21 THR 57 HG21 THR 57 3.640 -0.692 12.215 462 HG22 THR 57 HG22 THR 57 2.079 -0.616 11.393 463 HG23 THR 57 HG23 THR 57 2.165 -1.170 13.064 464 H VAL 58 HN VAL 58 2.450 2.768 9.739 465 HA VAL 58 HA VAL 58 1.329 5.256 10.832 466 HB VAL 58 HB VAL 58 1.150 5.982 8.445 467 HG11 VAL 58 HG11 VAL 58 2.992 6.795 9.688 468 HG12 VAL 58 HG12 VAL 58 3.633 6.259 8.135 469 HG13 VAL 58 HG13 VAL 58 3.843 5.254 9.569 470 HG21 VAL 58 HG21 VAL 58 2.681 3.437 7.947 471 HG22 VAL 58 HG22 VAL 58 2.468 4.733 6.767 472 HG23 VAL 58 HG23 VAL 58 1.066 3.836 7.354 473 H THR 59 HN THR 59 -0.812 5.892 10.368 474 HA THR 59 HA THR 59 -2.550 3.641 9.582 475 HB THR 59 HB THR 59 -3.615 5.848 11.279 476 HG1 THR 59 HG1 THR 59 -1.526 5.045 12.173 477 HG21 THR 59 HG21 THR 59 -4.105 2.883 10.998 478 HG22 THR 59 HG22 THR 59 -5.198 4.209 10.593 479 HG23 THR 59 HG23 THR 59 -4.821 3.858 12.280 480 H ASN 60 HN ASN 60 -3.854 3.914 7.930 481 HA ASN 60 HA ASN 60 -4.410 6.657 6.946 482 HB2 ASN 60 HB2 ASN 60 -3.755 4.128 5.410 483 HB3 ASN 60 HB1 ASN 60 -4.538 5.514 4.656 484 HD21 ASN 60 HD21 ASN 60 -1.609 4.354 6.178 485 HD22 ASN 60 HD22 ASN 60 -0.579 5.605 5.584 486 H SER 61 HN SER 61 -6.580 7.084 6.811 487 HA SER 61 HA SER 61 -8.428 4.774 6.823 488 HB2 SER 61 HB2 SER 61 -9.270 7.283 8.182 489 HB3 SER 61 HB1 SER 61 -9.643 5.606 8.578 490 HG SER 61 HG SER 61 -6.987 6.336 8.824 491 H PHE 62 HN PHE 62 -10.424 5.063 5.712 492 HA PHE 62 HA PHE 62 -10.985 7.554 4.392 493 HB2 PHE 62 HB2 PHE 62 -10.898 6.546 2.076 494 HB3 PHE 62 HB1 PHE 62 -9.338 6.856 2.825 495 HD1 PHE 62 HD1 PHE 62 -11.736 4.228 1.876 496 HD2 PHE 62 HD2 PHE 62 -7.826 5.084 3.326 497 HE1 PHE 62 HE1 PHE 62 -11.078 1.892 1.485 498 HE2 PHE 62 HE2 PHE 62 -7.171 2.752 2.931 499 HZ PHE 62 HZ PHE 62 -8.794 1.152 2.013 500 H THR 63 HN THR 63 -12.875 7.284 2.856 501 HA THR 63 HA THR 63 -14.708 5.194 3.841 502 HB THR 63 HB THR 63 -15.578 7.968 3.025 503 HG1 THR 63 HG1 THR 63 -15.030 7.003 5.669 504 HG21 THR 63 HG21 THR 63 -17.258 6.123 3.036 505 HG22 THR 63 HG22 THR 63 -17.623 7.429 4.160 506 HG23 THR 63 HG23 THR 63 -16.951 5.916 4.762 507 H LEU 64 HN LEU 64 -15.679 4.025 2.324 508 HA LEU 64 HA LEU 64 -14.905 4.098 -0.365 509 HB2 LEU 64 HB2 LEU 64 -17.300 2.812 0.936 510 HB3 LEU 64 HB1 LEU 64 -16.850 2.549 -0.737 511 HG LEU 64 HG LEU 64 -15.224 1.798 1.691 512 HD11 LEU 64 HD11 LEU 64 -15.635 -0.494 0.919 513 HD12 LEU 64 HD12 LEU 64 -16.668 0.129 -0.368 514 HD13 LEU 64 HD13 LEU 64 -17.134 0.343 1.320 515 HD21 LEU 64 HD21 LEU 64 -14.617 1.560 -1.252 516 HD22 LEU 64 HD22 LEU 64 -13.760 0.675 0.008 517 HD23 LEU 64 HD23 LEU 64 -13.696 2.435 -0.029 518 H GLY 65 HN GLY 65 -15.267 5.728 -1.688 519 HA2 GLY 65 HA2 GLY 65 -16.740 6.724 -3.279 520 HA3 GLY 65 HA1 GLY 65 -18.063 6.526 -2.143 521 H LYS 66 HN LYS 66 -15.347 7.660 -0.555 522 HA LYS 66 HA LYS 66 -16.046 10.479 -1.004 523 HB2 LYS 66 HB2 LYS 66 -16.265 8.925 1.505 524 HB3 LYS 66 HB1 LYS 66 -15.538 10.518 1.645 525 HG2 LYS 66 HG2 LYS 66 -17.513 11.557 0.762 526 HG3 LYS 66 HG1 LYS 66 -18.226 9.984 0.400 527 HD2 LYS 66 HD2 LYS 66 -19.189 10.894 2.436 528 HD3 LYS 66 HD1 LYS 66 -18.240 9.458 2.802 529 HE2 LYS 66 HE2 LYS 66 -16.350 10.934 3.456 530 HE3 LYS 66 HE1 LYS 66 -17.396 12.324 3.197 531 HZ1 LYS 66 HZ1 LYS 66 -17.929 10.151 5.147 532 HZ2 LYS 66 HZ2 LYS 66 -18.848 11.553 4.940 533 HZ3 LYS 66 HZ3 LYS 66 -17.272 11.659 5.532 534 H GLU 67 HN GLU 67 -14.392 11.965 -0.270 535 HA GLU 67 HA GLU 67 -11.741 10.844 -0.638 536 HB2 GLU 67 HB2 GLU 67 -12.464 12.936 -1.820 537 HB3 GLU 67 HB1 GLU 67 -12.543 13.733 -0.255 538 HG2 GLU 67 HG2 GLU 67 -10.152 13.315 0.074 539 HG3 GLU 67 HG1 GLU 67 -10.082 12.550 -1.513 540 H ALA 68 HN ALA 68 -10.118 10.890 0.901 541 HA ALA 68 HA ALA 68 -10.817 11.962 3.530 542 HB1 ALA 68 HB1 ALA 68 -9.991 9.110 3.011 543 HB2 ALA 68 HB2 ALA 68 -11.502 9.684 3.721 544 HB3 ALA 68 HB3 ALA 68 -9.986 9.869 4.604 545 H ASP 69 HN ASP 69 -9.085 12.517 4.792 546 HA ASP 69 HA ASP 69 -6.642 13.023 3.350 547 HB2 ASP 69 HB2 ASP 69 -7.160 14.884 4.609 548 HB3 ASP 69 HB1 ASP 69 -7.840 13.948 5.925 549 H ILE 70 HN ILE 70 -4.984 11.725 3.373 550 HA ILE 70 HA ILE 70 -4.650 9.920 5.663 551 HB ILE 70 HB ILE 70 -3.658 8.247 4.063 552 HG12 ILE 70 HG12 ILE 70 -4.791 8.508 1.719 553 HG13 ILE 70 HG11 ILE 70 -4.730 10.229 2.102 554 HG21 ILE 70 HG21 ILE 70 -5.838 7.908 5.026 555 HG22 ILE 70 HG22 ILE 70 -5.841 7.376 3.345 556 HG23 ILE 70 HG23 ILE 70 -6.575 8.917 3.782 557 HD11 ILE 70 HD11 ILE 70 -2.795 9.277 0.753 558 HD12 ILE 70 HD12 ILE 70 -2.293 8.459 2.237 559 HD13 ILE 70 HD13 ILE 70 -2.372 10.221 2.182 560 H THR 71 HN THR 71 -2.375 9.166 5.960 561 HA THR 71 HA THR 71 -0.478 11.124 4.849 562 HB THR 71 HB THR 71 -0.355 10.272 7.725 563 HG1 THR 71 HG1 THR 71 -2.320 11.386 7.457 564 HG21 THR 71 HG21 THR 71 1.689 11.192 6.653 565 HG22 THR 71 HG22 THR 71 1.088 12.206 7.966 566 HG23 THR 71 HG23 THR 71 0.797 12.670 6.290 567 H THR 72 HN THR 72 1.288 10.253 4.048 568 HA THR 72 HA THR 72 1.767 7.425 4.439 569 HB THR 72 HB THR 72 1.928 8.364 2.173 570 HG1 THR 72 HG1 THR 72 4.167 7.553 1.787 571 HG21 THR 72 HG21 THR 72 4.193 9.968 3.340 572 HG22 THR 72 HG22 THR 72 2.708 10.587 2.621 573 HG23 THR 72 HG23 THR 72 3.910 9.776 1.613 574 H MET 73 HN MET 73 4.085 6.703 4.803 575 HA MET 73 HA MET 73 5.057 7.824 7.235 576 HB2 MET 73 HB2 MET 73 6.950 6.180 6.910 577 HB3 MET 73 HB1 MET 73 5.335 5.492 6.987 578 HG2 MET 73 HG2 MET 73 6.483 6.140 4.322 579 HG3 MET 73 HG1 MET 73 7.079 4.722 5.189 580 HE1 MET 73 HE1 MET 73 5.717 2.572 5.665 581 HE2 MET 73 HE2 MET 73 3.963 2.457 5.526 582 HE3 MET 73 HE3 MET 73 4.688 3.538 6.717 583 H ASP 74 HN ASP 74 5.676 8.545 3.963 584 HA ASP 74 HA ASP 74 8.353 9.537 4.333 585 HB2 ASP 74 HB2 ASP 74 7.875 8.753 2.159 586 HB3 ASP 74 HB1 ASP 74 6.379 9.664 2.061 587 H GLY 75 HN GLY 75 5.241 10.720 4.973 588 HA2 GLY 75 HA2 GLY 75 4.802 12.694 6.169 589 HA3 GLY 75 HA1 GLY 75 6.379 13.302 5.693 590 H LYS 76 HN LYS 76 3.922 12.025 3.519 591 HA LYS 76 HA LYS 76 3.723 14.689 2.297 592 HB2 LYS 76 HB2 LYS 76 3.349 11.943 1.097 593 HB3 LYS 76 HB1 LYS 76 3.005 13.441 0.251 594 HG2 LYS 76 HG2 LYS 76 5.708 12.851 1.404 595 HG3 LYS 76 HG1 LYS 76 5.233 12.303 -0.204 596 HD2 LYS 76 HD2 LYS 76 4.915 14.542 -0.959 597 HD3 LYS 76 HD1 LYS 76 5.101 15.180 0.677 598 HE2 LYS 76 HE2 LYS 76 7.105 15.455 -0.795 599 HE3 LYS 76 HE1 LYS 76 7.409 14.611 0.723 600 HZ1 LYS 76 HZ1 LYS 76 6.899 13.198 -1.839 601 HZ2 LYS 76 HZ2 LYS 76 7.483 12.540 -0.388 602 HZ3 LYS 76 HZ3 LYS 76 8.449 13.596 -1.296 603 H LYS 77 HN LYS 77 1.786 15.660 2.362 604 HA LYS 77 HA LYS 77 -0.438 14.227 3.536 605 HB2 LYS 77 HB2 LYS 77 0.282 17.059 3.123 606 HB3 LYS 77 HB1 LYS 77 -1.435 16.699 2.999 607 HG2 LYS 77 HG2 LYS 77 0.362 16.137 5.351 608 HG3 LYS 77 HG1 LYS 77 -0.913 17.354 5.250 609 HD2 LYS 77 HD2 LYS 77 -2.539 15.486 4.861 610 HD3 LYS 77 HD1 LYS 77 -1.231 14.358 5.221 611 HE2 LYS 77 HE2 LYS 77 -0.977 15.447 7.438 612 HE3 LYS 77 HE1 LYS 77 -2.383 16.447 7.061 613 HZ1 LYS 77 HZ1 LYS 77 -3.629 14.325 6.737 614 HZ2 LYS 77 HZ2 LYS 77 -3.139 14.629 8.331 615 HZ3 LYS 77 HZ3 LYS 77 -2.293 13.504 7.388 616 H LEU 78 HN LEU 78 -1.607 13.010 2.237 617 HA LEU 78 HA LEU 78 -2.381 14.147 -0.362 618 HB2 LEU 78 HB2 LEU 78 -2.022 11.198 0.083 619 HB3 LEU 78 HB1 LEU 78 -2.174 12.054 -1.436 620 HG LEU 78 HG LEU 78 0.204 12.475 0.352 621 HD11 LEU 78 HD11 LEU 78 -0.126 10.334 -1.749 622 HD12 LEU 78 HD12 LEU 78 0.073 10.085 -0.014 623 HD13 LEU 78 HD13 LEU 78 1.390 10.773 -0.961 624 HD21 LEU 78 HD21 LEU 78 1.276 13.138 -1.717 625 HD22 LEU 78 HD22 LEU 78 -0.204 14.064 -1.476 626 HD23 LEU 78 HD23 LEU 78 -0.176 12.730 -2.629 627 H LYS 79 HN LYS 79 -4.450 13.677 -1.055 628 HA LYS 79 HA LYS 79 -6.221 12.406 0.930 629 HB2 LYS 79 HB2 LYS 79 -7.020 14.654 -0.926 630 HB3 LYS 79 HB1 LYS 79 -7.964 13.953 0.378 631 HG2 LYS 79 HG2 LYS 79 -6.492 14.891 2.031 632 HG3 LYS 79 HG1 LYS 79 -5.402 15.483 0.772 633 HD2 LYS 79 HD2 LYS 79 -8.288 16.318 1.021 634 HD3 LYS 79 HD1 LYS 79 -6.951 17.204 1.752 635 HE2 LYS 79 HE2 LYS 79 -6.468 18.201 -0.172 636 HE3 LYS 79 HE1 LYS 79 -6.396 16.659 -1.016 637 HZ1 LYS 79 HZ1 LYS 79 -8.935 16.795 -1.031 638 HZ2 LYS 79 HZ2 LYS 79 -8.087 17.824 -2.078 639 HZ3 LYS 79 HZ3 LYS 79 -8.728 18.434 -0.639 640 H CYS 80 HN CYS 80 -6.922 10.544 0.110 641 HA CYS 80 HA CYS 80 -7.251 10.406 -2.812 642 HB2 CYS 80 HB2 CYS 80 -5.613 8.818 -1.941 643 HB3 CYS 80 HB1 CYS 80 -6.827 8.139 -0.860 644 H THR 81 HN THR 81 -9.071 9.665 -3.732 645 HA THR 81 HA THR 81 -11.428 9.454 -2.004 646 HB THR 81 HB THR 81 -11.511 9.635 -5.004 647 HG1 THR 81 HG1 THR 81 -10.792 11.622 -3.164 648 HG21 THR 81 HG21 THR 81 -13.605 9.161 -3.879 649 HG22 THR 81 HG22 THR 81 -13.647 10.805 -4.517 650 HG23 THR 81 HG23 THR 81 -13.368 10.531 -2.797 651 H VAL 82 HN VAL 82 -10.860 7.336 -1.352 652 HA VAL 82 HA VAL 82 -10.555 5.243 -3.290 653 HB VAL 82 HB VAL 82 -11.051 4.870 -0.342 654 HG11 VAL 82 HG11 VAL 82 -9.778 3.196 -2.490 655 HG12 VAL 82 HG12 VAL 82 -11.199 2.827 -1.516 656 HG13 VAL 82 HG13 VAL 82 -9.602 2.851 -0.769 657 HG21 VAL 82 HG21 VAL 82 -8.483 5.536 -1.763 658 HG22 VAL 82 HG22 VAL 82 -8.542 4.810 -0.156 659 HG23 VAL 82 HG23 VAL 82 -9.245 6.405 -0.430 660 H HIS 83 HN HIS 83 -11.981 3.716 -3.890 661 HA HIS 83 HA HIS 83 -14.587 3.532 -2.666 662 HB2 HIS 83 HB2 HIS 83 -15.808 3.946 -4.790 663 HB3 HIS 83 HB1 HIS 83 -14.988 5.373 -4.183 664 HD1 HIS 83 HD1 HIS 83 -15.437 3.449 -7.184 665 HD2 HIS 83 HD2 HIS 83 -12.437 5.850 -5.610 666 HE1 HIS 83 HE1 HIS 83 -13.955 4.034 -9.130 667 HE2 HIS 83 HE2 HIS 83 -12.313 5.700 -8.190 668 H LEU 84 HN LEU 84 -15.726 1.653 -3.266 669 HA LEU 84 HA LEU 84 -13.984 -0.415 -4.344 670 HB2 LEU 84 HB2 LEU 84 -15.132 -0.861 -2.224 671 HB3 LEU 84 HB1 LEU 84 -16.687 -0.604 -2.999 672 HG LEU 84 HG LEU 84 -15.828 -2.560 -4.573 673 HD11 LEU 84 HD11 LEU 84 -13.630 -2.630 -3.358 674 HD12 LEU 84 HD12 LEU 84 -14.482 -4.165 -3.494 675 HD13 LEU 84 HD13 LEU 84 -14.508 -3.273 -1.971 676 HD21 LEU 84 HD21 LEU 84 -16.884 -3.098 -1.806 677 HD22 LEU 84 HD22 LEU 84 -17.077 -4.110 -3.238 678 HD23 LEU 84 HD23 LEU 84 -17.860 -2.533 -3.162 679 H ALA 85 HN ALA 85 -14.004 -0.533 -6.477 680 HA ALA 85 HA ALA 85 -16.601 -0.404 -7.866 681 HB1 ALA 85 HB1 ALA 85 -14.886 1.459 -8.316 682 HB2 ALA 85 HB2 ALA 85 -15.620 0.654 -9.704 683 HB3 ALA 85 HB3 ALA 85 -13.988 0.224 -9.199 684 H ASN 86 HN ASN 86 -17.200 -2.243 -8.769 685 HA ASN 86 HA ASN 86 -17.207 -4.329 -9.643 686 HB2 ASN 86 HB2 ASN 86 -14.386 -3.666 -10.527 687 HB3 ASN 86 HB1 ASN 86 -15.365 -4.996 -11.128 688 HD21 ASN 86 HD21 ASN 86 -14.598 -1.702 -11.420 689 HD22 ASN 86 HD22 ASN 86 -15.740 -1.305 -12.655 690 H GLY 87 HN GLY 87 -16.293 -3.867 -6.904 691 HA2 GLY 87 HA2 GLY 87 -15.811 -5.366 -5.196 692 HA3 GLY 87 HA1 GLY 87 -15.323 -6.544 -6.405 693 H LYS 88 HN LYS 88 -13.795 -3.661 -7.034 694 HA LYS 88 HA LYS 88 -11.394 -4.497 -5.531 695 HB2 LYS 88 HB2 LYS 88 -11.317 -2.938 -8.104 696 HB3 LYS 88 HB1 LYS 88 -10.036 -3.878 -7.351 697 HG2 LYS 88 HG2 LYS 88 -12.530 -5.035 -8.579 698 HG3 LYS 88 HG1 LYS 88 -10.956 -4.936 -9.373 699 HD2 LYS 88 HD2 LYS 88 -10.029 -6.561 -8.029 700 HD3 LYS 88 HD1 LYS 88 -11.131 -6.232 -6.693 701 HE2 LYS 88 HE2 LYS 88 -11.577 -8.396 -7.744 702 HE3 LYS 88 HE1 LYS 88 -12.945 -7.292 -7.879 703 HZ1 LYS 88 HZ1 LYS 88 -12.498 -8.494 -9.947 704 HZ2 LYS 88 HZ2 LYS 88 -10.949 -7.812 -10.025 705 HZ3 LYS 88 HZ3 LYS 88 -12.320 -6.823 -10.150 706 H LEU 89 HN LEU 89 -9.926 -2.707 -4.978 707 HA LEU 89 HA LEU 89 -11.494 -0.327 -4.297 708 HB2 LEU 89 HB2 LEU 89 -9.690 -1.889 -2.826 709 HB3 LEU 89 HB1 LEU 89 -8.865 -0.371 -3.132 710 HG LEU 89 HG LEU 89 -10.644 0.871 -2.101 711 HD11 LEU 89 HD11 LEU 89 -12.425 -0.587 -0.878 712 HD12 LEU 89 HD12 LEU 89 -12.059 -1.739 -2.161 713 HD13 LEU 89 HD13 LEU 89 -12.652 -0.127 -2.566 714 HD21 LEU 89 HD21 LEU 89 -10.560 -0.075 0.201 715 HD22 LEU 89 HD22 LEU 89 -8.987 0.105 -0.580 716 HD23 LEU 89 HD23 LEU 89 -9.744 -1.485 -0.477 717 H VAL 90 HN VAL 90 -11.179 1.506 -5.325 718 HA VAL 90 HA VAL 90 -8.742 1.754 -6.957 719 HB VAL 90 HB VAL 90 -11.366 3.186 -7.404 720 HG11 VAL 90 HG11 VAL 90 -9.474 4.376 -8.314 721 HG12 VAL 90 HG12 VAL 90 -10.405 3.654 -9.627 722 HG13 VAL 90 HG13 VAL 90 -8.893 2.910 -9.107 723 HG21 VAL 90 HG21 VAL 90 -10.275 0.711 -8.735 724 HG22 VAL 90 HG22 VAL 90 -11.662 1.636 -9.311 725 HG23 VAL 90 HG23 VAL 90 -11.730 0.825 -7.745 726 H CYS 91 HN CYS 91 -7.317 3.084 -6.166 727 HA CYS 91 HA CYS 91 -8.223 5.549 -4.835 728 HB2 CYS 91 HB2 CYS 91 -7.250 4.078 -3.152 729 HB3 CYS 91 HB1 CYS 91 -5.820 3.832 -4.145 730 H LYS 92 HN LYS 92 -8.103 6.693 -6.766 731 HA LYS 92 HA LYS 92 -5.491 6.786 -8.093 732 HB2 LYS 92 HB2 LYS 92 -7.468 6.371 -9.498 733 HB3 LYS 92 HB1 LYS 92 -8.164 7.895 -8.974 734 HG2 LYS 92 HG2 LYS 92 -6.285 9.091 -9.996 735 HG3 LYS 92 HG1 LYS 92 -5.628 7.557 -10.556 736 HD2 LYS 92 HD2 LYS 92 -6.760 8.341 -12.409 737 HD3 LYS 92 HD1 LYS 92 -7.927 7.238 -11.675 738 HE2 LYS 92 HE2 LYS 92 -9.037 9.283 -12.345 739 HE3 LYS 92 HE1 LYS 92 -9.014 9.178 -10.585 740 HZ1 LYS 92 HZ1 LYS 92 -8.435 11.400 -11.548 741 HZ2 LYS 92 HZ2 LYS 92 -7.006 10.710 -12.137 742 HZ3 LYS 92 HZ3 LYS 92 -7.291 10.772 -10.471 743 H SER 93 HN SER 93 -4.340 8.617 -8.348 744 HA SER 93 HA SER 93 -5.072 10.873 -6.616 745 HB2 SER 93 HB2 SER 93 -2.339 10.568 -7.788 746 HB3 SER 93 HB1 SER 93 -2.815 11.178 -6.202 747 HG SER 93 HG SER 93 -3.546 8.774 -6.031 748 H GLU 94 HN GLU 94 -3.367 12.787 -7.797 749 HA GLU 94 HA GLU 94 -4.954 13.434 -10.141 750 HB2 GLU 94 HB2 GLU 94 -2.800 15.037 -8.757 751 HB3 GLU 94 HB1 GLU 94 -3.881 15.629 -10.009 752 HG2 GLU 94 HG2 GLU 94 -4.649 14.743 -7.236 753 HG3 GLU 94 HG1 GLU 94 -4.649 16.390 -7.865 754 H LYS 95 HN LYS 95 -1.692 12.484 -9.331 755 HA LYS 95 HA LYS 95 -1.001 12.533 -12.203 756 HB2 LYS 95 HB2 LYS 95 0.243 14.152 -10.692 757 HB3 LYS 95 HB1 LYS 95 0.953 12.746 -9.910 758 HG2 LYS 95 HG2 LYS 95 1.940 12.067 -12.042 759 HG3 LYS 95 HG1 LYS 95 1.235 13.492 -12.811 760 HD2 LYS 95 HD2 LYS 95 2.518 14.916 -11.233 761 HD3 LYS 95 HD1 LYS 95 3.277 13.460 -10.591 762 HE2 LYS 95 HE2 LYS 95 3.486 14.539 -13.395 763 HE3 LYS 95 HE1 LYS 95 4.766 14.476 -12.184 764 HZ1 LYS 95 HZ1 LYS 95 3.448 12.139 -13.460 765 HZ2 LYS 95 HZ2 LYS 95 4.636 12.050 -12.260 766 HZ3 LYS 95 HZ3 LYS 95 5.009 12.698 -13.775 767 H PHE 96 HN PHE 96 -1.647 10.550 -9.608 768 HA PHE 96 HA PHE 96 -0.158 8.345 -10.826 769 HB2 PHE 96 HB2 PHE 96 -0.377 8.616 -7.832 770 HB3 PHE 96 HB1 PHE 96 0.660 7.536 -8.754 771 HD1 PHE 96 HD2 PHE 96 2.697 8.376 -9.818 772 HD2 PHE 96 HD1 PHE 96 0.260 10.897 -7.407 773 HE1 PHE 96 HE2 PHE 96 4.527 10.005 -9.673 774 HE2 PHE 96 HE1 PHE 96 2.088 12.531 -7.261 775 HZ PHE 96 HZ PHE 96 4.229 12.084 -8.391 776 H SER 97 HN SER 97 -0.938 6.213 -9.645 777 HA SER 97 HA SER 97 -3.707 6.278 -8.849 778 HB2 SER 97 HB2 SER 97 -3.956 4.398 -10.804 779 HB3 SER 97 HB1 SER 97 -4.445 6.079 -10.988 780 HG SER 97 HG SER 97 -3.111 6.000 -12.610 781 H HIS 98 HN HIS 98 -4.155 4.655 -7.488 782 HA HIS 98 HA HIS 98 -2.214 2.442 -7.302 783 HB2 HIS 98 HB2 HIS 98 -2.422 3.976 -5.305 784 HB3 HIS 98 HB1 HIS 98 -4.090 3.442 -5.147 785 HD2 HIS 98 HD2 HIS 98 -3.599 0.208 -5.459 786 HE1 HIS 98 HE1 HIS 98 -0.952 0.793 -2.207 787 HE2 HIS 98 HE2 HIS 98 -2.202 -0.929 -3.568 788 H GLU 99 HN GLU 99 -2.946 0.547 -7.961 789 HA GLU 99 HA GLU 99 -5.870 0.125 -8.047 790 HB2 GLU 99 HB2 GLU 99 -5.135 -0.076 -10.246 791 HB3 GLU 99 HB1 GLU 99 -3.603 -0.799 -9.773 792 HG2 GLU 99 HG2 GLU 99 -4.791 -2.848 -9.142 793 HG3 GLU 99 HG1 GLU 99 -6.299 -2.128 -9.708 794 H GLN 100 HN GLN 100 -6.720 -1.389 -6.741 795 HA GLN 100 HA GLN 100 -4.952 -3.514 -5.727 796 HB2 GLN 100 HB2 GLN 100 -6.780 -1.696 -4.206 797 HB3 GLN 100 HB1 GLN 100 -6.540 -3.341 -3.636 798 HG2 GLN 100 HG2 GLN 100 -4.048 -2.831 -3.736 799 HG3 GLN 100 HG1 GLN 100 -4.517 -1.139 -3.895 800 HE21 GLN 100 HE21 GLN 100 -3.033 -2.475 -1.798 801 HE22 GLN 100 HE22 GLN 100 -3.925 -2.211 -0.336 802 H GLU 101 HN GLU 101 -5.670 -5.389 -6.523 803 HA GLU 101 HA GLU 101 -8.580 -5.756 -6.761 804 HB2 GLU 101 HB2 GLU 101 -7.873 -5.960 -8.953 805 HB3 GLU 101 HB1 GLU 101 -6.326 -6.669 -8.501 806 HG2 GLU 101 HG2 GLU 101 -7.217 -8.789 -8.279 807 HG3 GLU 101 HG1 GLU 101 -8.846 -8.188 -7.989 808 H VAL 102 HN VAL 102 -9.514 -7.300 -5.647 809 HA VAL 102 HA VAL 102 -7.813 -9.206 -4.210 810 HB VAL 102 HB VAL 102 -10.571 -8.125 -3.632 811 HG11 VAL 102 HG11 VAL 102 -10.778 -10.497 -3.289 812 HG12 VAL 102 HG12 VAL 102 -10.669 -9.700 -1.720 813 HG13 VAL 102 HG13 VAL 102 -9.265 -10.540 -2.380 814 HG21 VAL 102 HG21 VAL 102 -8.560 -6.911 -2.842 815 HG22 VAL 102 HG22 VAL 102 -8.121 -8.339 -1.899 816 HG23 VAL 102 HG23 VAL 102 -9.612 -7.469 -1.540 817 H LYS 103 HN LYS 103 -7.765 -11.217 -4.947 818 HA LYS 103 HA LYS 103 -10.095 -12.196 -6.458 819 HB2 LYS 103 HB2 LYS 103 -7.715 -11.643 -7.627 820 HB3 LYS 103 HB1 LYS 103 -7.451 -13.317 -7.155 821 HG2 LYS 103 HG2 LYS 103 -8.682 -14.057 -8.843 822 HG3 LYS 103 HG1 LYS 103 -10.036 -13.027 -8.373 823 HD2 LYS 103 HD2 LYS 103 -9.457 -12.383 -10.570 824 HD3 LYS 103 HD1 LYS 103 -8.817 -11.127 -9.515 825 HE2 LYS 103 HE2 LYS 103 -6.600 -12.215 -9.631 826 HE3 LYS 103 HE1 LYS 103 -7.261 -13.394 -10.761 827 HZ1 LYS 103 HZ1 LYS 103 -7.168 -10.455 -11.219 828 HZ2 LYS 103 HZ2 LYS 103 -7.728 -11.624 -12.309 829 HZ3 LYS 103 HZ3 LYS 103 -6.092 -11.579 -11.887 830 H GLY 104 HN GLY 104 -10.867 -13.200 -4.571 831 HA2 GLY 104 HA2 GLY 104 -11.222 -15.087 -3.307 832 HA3 GLY 104 HA1 GLY 104 -9.923 -15.861 -4.198 833 H ASN 105 HN ASN 105 -8.148 -16.336 -3.114 834 HA ASN 105 HA ASN 105 -7.819 -15.295 -0.402 835 HB2 ASN 105 HB2 ASN 105 -6.322 -17.144 -0.049 836 HB3 ASN 105 HB1 ASN 105 -7.746 -17.759 -0.884 837 HD21 ASN 105 HD21 ASN 105 -4.918 -18.699 -0.724 838 HD22 ASN 105 HD22 ASN 105 -4.416 -18.887 -2.370 839 H GLU 106 HN GLU 106 -6.957 -14.093 -3.220 840 HA GLU 106 HA GLU 106 -4.314 -13.265 -2.237 841 HB2 GLU 106 HB2 GLU 106 -5.087 -14.225 -4.961 842 HB3 GLU 106 HB1 GLU 106 -3.769 -13.077 -4.782 843 HG2 GLU 106 HG2 GLU 106 -2.574 -14.630 -3.349 844 HG3 GLU 106 HG1 GLU 106 -3.918 -15.766 -3.438 845 H MET 107 HN MET 107 -3.610 -11.209 -2.846 846 HA MET 107 HA MET 107 -5.627 -9.419 -3.996 847 HB2 MET 107 HB2 MET 107 -5.590 -9.254 -1.472 848 HB3 MET 107 HB1 MET 107 -3.927 -8.697 -1.603 849 HG2 MET 107 HG2 MET 107 -5.673 -7.192 -3.328 850 HG3 MET 107 HG1 MET 107 -6.230 -7.148 -1.657 851 HE1 MET 107 HE1 MET 107 -3.477 -5.378 0.268 852 HE2 MET 107 HE2 MET 107 -3.332 -7.125 0.073 853 HE3 MET 107 HE3 MET 107 -4.919 -6.389 0.308 854 H VAL 108 HN VAL 108 -4.699 -8.852 -5.837 855 HA VAL 108 HA VAL 108 -1.812 -8.353 -5.890 856 HB VAL 108 HB VAL 108 -2.178 -8.346 -8.422 857 HG11 VAL 108 HG11 VAL 108 -2.787 -10.974 -7.088 858 HG12 VAL 108 HG12 VAL 108 -1.205 -10.204 -6.994 859 HG13 VAL 108 HG13 VAL 108 -1.860 -10.684 -8.560 860 HG21 VAL 108 HG21 VAL 108 -4.126 -9.341 -9.323 861 HG22 VAL 108 HG22 VAL 108 -4.698 -8.129 -8.180 862 HG23 VAL 108 HG23 VAL 108 -4.705 -9.834 -7.732 863 H GLU 109 HN GLU 109 -1.158 -6.305 -5.814 864 HA GLU 109 HA GLU 109 -3.005 -4.252 -6.814 865 HB2 GLU 109 HB2 GLU 109 -2.546 -2.856 -5.046 866 HB3 GLU 109 HB1 GLU 109 -2.490 -4.425 -4.260 867 HG2 GLU 109 HG2 GLU 109 0.017 -4.351 -4.622 868 HG3 GLU 109 HG1 GLU 109 -0.203 -2.653 -5.049 869 H THR 110 HN THR 110 -2.148 -2.462 -7.838 870 HA THR 110 HA THR 110 0.674 -2.619 -8.645 871 HB THR 110 HB THR 110 -1.193 -1.644 -10.722 872 HG1 THR 110 HG1 THR 110 -2.327 -3.412 -10.871 873 HG21 THR 110 HG21 THR 110 1.309 -1.904 -10.918 874 HG22 THR 110 HG22 THR 110 0.359 -2.655 -12.200 875 HG23 THR 110 HG23 THR 110 1.041 -3.648 -10.911 876 H ILE 111 HN ILE 111 1.591 -0.799 -8.000 877 HA ILE 111 HA ILE 111 -0.024 1.669 -8.026 878 HB ILE 111 HB ILE 111 2.443 1.624 -6.389 879 HG12 ILE 111 HG12 ILE 111 -0.017 0.188 -5.388 880 HG13 ILE 111 HG11 ILE 111 1.412 -0.643 -5.995 881 HG21 ILE 111 HG21 ILE 111 0.982 3.563 -6.462 882 HG22 ILE 111 HG22 ILE 111 1.026 2.879 -4.838 883 HG23 ILE 111 HG23 ILE 111 -0.369 2.590 -5.879 884 HD11 ILE 111 HD11 ILE 111 1.252 1.165 -3.595 885 HD12 ILE 111 HD12 ILE 111 2.740 0.456 -4.224 886 HD13 ILE 111 HD13 ILE 111 1.463 -0.585 -3.597 887 H THR 112 HN THR 112 1.310 3.662 -8.337 888 HA THR 112 HA THR 112 3.877 3.349 -9.684 889 HB THR 112 HB THR 112 1.546 4.675 -11.087 890 HG1 THR 112 HG1 THR 112 2.318 2.116 -11.055 891 HG21 THR 112 HG21 THR 112 3.480 5.881 -11.663 892 HG22 THR 112 HG22 THR 112 3.277 4.721 -12.976 893 HG23 THR 112 HG23 THR 112 4.479 4.430 -11.716 894 H PHE 113 HN PHE 113 5.050 4.749 -8.527 895 HA PHE 113 HA PHE 113 4.135 7.515 -8.299 896 HB2 PHE 113 HB2 PHE 113 4.560 5.675 -6.001 897 HB3 PHE 113 HB1 PHE 113 5.152 7.319 -5.840 898 HD1 PHE 113 HD2 PHE 113 2.200 5.194 -6.141 899 HD2 PHE 113 HD1 PHE 113 3.622 9.174 -5.658 900 HE1 PHE 113 HE2 PHE 113 -0.055 5.911 -5.455 901 HE2 PHE 113 HE1 PHE 113 1.372 9.899 -4.965 902 HZ PHE 113 HZ PHE 113 -0.468 8.265 -4.863 903 H GLY 114 HN GLY 114 5.809 9.000 -8.192 904 HA2 GLY 114 HA2 GLY 114 7.931 9.822 -8.491 905 HA3 GLY 114 HA1 GLY 114 8.480 8.447 -7.550 906 H GLY 115 HN GLY 115 6.738 7.885 -10.484 907 HA2 GLY 115 HA2 GLY 115 7.483 7.346 -12.620 908 HA3 GLY 115 HA1 GLY 115 9.129 7.657 -12.101 909 H VAL 116 HN VAL 116 7.497 5.596 -9.955 910 HA VAL 116 HA VAL 116 8.591 3.225 -11.318 911 HB VAL 116 HB VAL 116 8.536 3.473 -8.319 912 HG11 VAL 116 HG11 VAL 116 10.196 1.695 -8.434 913 HG12 VAL 116 HG12 VAL 116 10.139 1.745 -10.198 914 HG13 VAL 116 HG13 VAL 116 8.717 1.239 -9.281 915 HG21 VAL 116 HG21 VAL 116 10.849 4.179 -10.121 916 HG22 VAL 116 HG22 VAL 116 10.902 4.076 -8.362 917 HG23 VAL 116 HG23 VAL 116 9.916 5.312 -9.145 918 H THR 117 HN THR 117 7.183 1.649 -11.615 919 HA THR 117 HA THR 117 4.576 1.838 -10.317 920 HB THR 117 HB THR 117 4.280 1.731 -12.606 921 HG1 THR 117 HG1 THR 117 4.046 -0.926 -11.631 922 HG21 THR 117 HG21 THR 117 6.513 1.219 -13.230 923 HG22 THR 117 HG22 THR 117 5.409 0.121 -14.066 924 HG23 THR 117 HG23 THR 117 6.325 -0.439 -12.663 925 H LEU 118 HN LEU 118 5.360 1.026 -8.335 926 HA LEU 118 HA LEU 118 6.568 -1.480 -8.065 927 HB2 LEU 118 HB2 LEU 118 6.584 0.141 -6.242 928 HB3 LEU 118 HB1 LEU 118 4.849 -0.037 -6.050 929 HG LEU 118 HG LEU 118 5.082 -2.304 -5.287 930 HD11 LEU 118 HD11 LEU 118 6.776 -3.221 -6.625 931 HD12 LEU 118 HD12 LEU 118 7.455 -3.223 -4.994 932 HD13 LEU 118 HD13 LEU 118 7.939 -1.982 -6.154 933 HD21 LEU 118 HD21 LEU 118 5.667 -0.309 -3.754 934 HD22 LEU 118 HD22 LEU 118 7.320 -0.910 -3.884 935 HD23 LEU 118 HD23 LEU 118 6.057 -1.942 -3.220 936 H ILE 119 HN ILE 119 5.788 -3.338 -8.649 937 HA ILE 119 HA ILE 119 2.884 -3.772 -8.573 938 HB ILE 119 HB ILE 119 5.007 -5.520 -9.833 939 HG12 ILE 119 HG12 ILE 119 3.410 -3.189 -10.836 940 HG13 ILE 119 HG11 ILE 119 5.090 -3.601 -11.147 941 HG21 ILE 119 HG21 ILE 119 3.124 -6.577 -10.981 942 HG22 ILE 119 HG22 ILE 119 2.001 -5.532 -10.112 943 HG23 ILE 119 HG23 ILE 119 2.962 -6.719 -9.231 944 HD11 ILE 119 HD11 ILE 119 3.929 -3.884 -13.173 945 HD12 ILE 119 HD12 ILE 119 2.631 -4.781 -12.390 946 HD13 ILE 119 HD13 ILE 119 4.231 -5.508 -12.554 947 H ARG 120 HN ARG 120 2.151 -4.597 -6.719 948 HA ARG 120 HA ARG 120 3.892 -6.399 -5.208 949 HB2 ARG 120 HB2 ARG 120 2.651 -4.076 -4.467 950 HB3 ARG 120 HB1 ARG 120 1.526 -5.298 -3.894 951 HG2 ARG 120 HG2 ARG 120 2.934 -4.879 -2.106 952 HG3 ARG 120 HG1 ARG 120 3.495 -6.397 -2.794 953 HD2 ARG 120 HD2 ARG 120 5.210 -5.052 -4.067 954 HD3 ARG 120 HD1 ARG 120 4.732 -3.675 -3.075 955 HE ARG 120 HE ARG 120 5.441 -4.977 -1.127 956 HH11 ARG 120 HH11 ARG 120 6.732 -5.830 -4.267 957 HH12 ARG 120 HH12 ARG 120 8.026 -6.788 -3.611 958 HH21 ARG 120 HH21 ARG 120 7.165 -6.193 -0.276 959 HH22 ARG 120 HH22 ARG 120 8.271 -6.993 -1.342 960 H ARG 121 HN ARG 121 3.102 -8.252 -4.303 961 HA ARG 121 HA ARG 121 0.460 -9.173 -5.135 962 HB2 ARG 121 HB2 ARG 121 3.134 -10.460 -5.391 963 HB3 ARG 121 HB1 ARG 121 1.760 -11.489 -4.994 964 HG2 ARG 121 HG2 ARG 121 0.981 -11.395 -7.052 965 HG3 ARG 121 HG1 ARG 121 1.182 -9.651 -7.150 966 HD2 ARG 121 HD2 ARG 121 3.464 -11.585 -7.434 967 HD3 ARG 121 HD1 ARG 121 2.520 -11.001 -8.804 968 HE ARG 121 HE ARG 121 3.529 -8.896 -7.145 969 HH11 ARG 121 HH11 ARG 121 4.279 -11.039 -9.804 970 HH12 ARG 121 HH12 ARG 121 5.479 -9.989 -10.488 971 HH21 ARG 121 HH21 ARG 121 5.121 -7.486 -8.075 972 HH22 ARG 121 HH22 ARG 121 5.942 -7.966 -9.535 973 H SER 122 HN SER 122 -0.746 -9.801 -3.503 974 HA SER 122 HA SER 122 0.586 -10.485 -0.977 975 HB2 SER 122 HB2 SER 122 -2.038 -9.236 -0.656 976 HB3 SER 122 HB1 SER 122 -0.514 -8.894 0.165 977 HG SER 122 HG SER 122 -1.475 -7.867 -2.282 978 H LYS 123 HN LYS 123 -0.454 -11.914 0.393 979 HA LYS 123 HA LYS 123 -2.604 -13.533 -0.813 980 HB2 LYS 123 HB2 LYS 123 -0.213 -14.372 0.829 981 HB3 LYS 123 HB1 LYS 123 -1.564 -15.438 0.479 982 HG2 LYS 123 HG2 LYS 123 -0.574 -14.284 -1.934 983 HG3 LYS 123 HG1 LYS 123 0.750 -15.008 -1.023 984 HD2 LYS 123 HD2 LYS 123 -0.461 -17.110 -0.883 985 HD3 LYS 123 HD1 LYS 123 -1.842 -16.396 -1.712 986 HE2 LYS 123 HE2 LYS 123 -0.626 -16.177 -3.731 987 HE3 LYS 123 HE1 LYS 123 0.898 -16.556 -2.933 988 HZ1 LYS 123 HZ1 LYS 123 -1.341 -18.490 -3.061 989 HZ2 LYS 123 HZ2 LYS 123 0.279 -18.790 -2.676 990 HZ3 LYS 123 HZ3 LYS 123 -0.149 -18.394 -4.260 991 H ARG 124 HN ARG 124 -4.223 -14.264 0.623 992 HA ARG 124 HA ARG 124 -4.581 -12.616 2.960 993 HB2 ARG 124 HB2 ARG 124 -6.311 -13.709 1.206 994 HB3 ARG 124 HB1 ARG 124 -6.390 -14.905 2.491 995 HG2 ARG 124 HG2 ARG 124 -6.923 -13.103 4.088 996 HG3 ARG 124 HG1 ARG 124 -6.942 -11.957 2.748 997 HD2 ARG 124 HD2 ARG 124 -9.193 -12.623 3.254 998 HD3 ARG 124 HD1 ARG 124 -8.737 -13.286 1.687 999 HE ARG 124 HE ARG 124 -8.217 -15.145 3.764 1000 HH11 ARG 124 HH11 ARG 124 -10.870 -13.750 1.951 1001 HH12 ARG 124 HH12 ARG 124 -11.877 -15.150 2.103 1002 HH21 ARG 124 HH21 ARG 124 -9.538 -16.979 3.975 1003 HH22 ARG 124 HH22 ARG 124 -11.119 -16.988 3.262 1004 H VAL 125 HN VAL 125 -4.706 -13.293 5.091 1005 HA VAL 125 HA VAL 125 -4.003 -16.054 5.709 1006 HB VAL 125 HB VAL 125 -1.827 -15.085 5.686 1007 HG11 VAL 125 HG11 VAL 125 -2.333 -12.740 5.721 1008 HG12 VAL 125 HG12 VAL 125 -1.242 -13.099 7.059 1009 HG13 VAL 125 HG13 VAL 125 -2.961 -12.853 7.367 1010 HG21 VAL 125 HG21 VAL 125 -1.066 -15.515 7.876 1011 HG22 VAL 125 HG22 VAL 125 -2.485 -16.535 7.640 1012 HG23 VAL 125 HG23 VAL 125 -2.611 -15.050 8.583 Start of MODEL 6 1 H1 ALA 1 HT1 ALA 1 -12.398 -11.089 1.820 2 H2 ALA 1 HT2 ALA 1 -12.403 -10.715 0.170 3 H3 ALA 1 HT3 ALA 1 -13.849 -11.108 0.954 4 HA ALA 1 HA ALA 1 -13.606 -8.712 0.538 5 HB1 ALA 1 HB1 ALA 1 -13.858 -9.819 3.308 6 HB2 ALA 1 HB2 ALA 1 -15.109 -9.162 2.251 7 HB3 ALA 1 HB3 ALA 1 -13.952 -8.082 3.026 8 H PHE 2 HN PHE 2 -12.561 -6.740 1.160 9 HA PHE 2 HA PHE 2 -9.725 -6.926 1.262 10 HB2 PHE 2 HB2 PHE 2 -11.641 -4.597 1.490 11 HB3 PHE 2 HB1 PHE 2 -9.898 -4.386 1.614 12 HD1 PHE 2 HD1 PHE 2 -12.597 -5.561 -0.642 13 HD2 PHE 2 HD2 PHE 2 -8.561 -4.258 -0.299 14 HE1 PHE 2 HE1 PHE 2 -12.442 -5.422 -3.089 15 HE2 PHE 2 HE2 PHE 2 -8.401 -4.118 -2.753 16 HZ PHE 2 HZ PHE 2 -10.337 -4.698 -4.145 17 H SER 3 HN SER 3 -12.221 -6.511 3.657 18 HA SER 3 HA SER 3 -10.596 -5.600 5.784 19 HB2 SER 3 HB2 SER 3 -12.672 -7.023 6.943 20 HB3 SER 3 HB1 SER 3 -12.710 -5.313 6.511 21 HG SER 3 HG SER 3 -13.900 -5.742 4.789 22 H GLY 4 HN GLY 4 -8.769 -6.784 6.185 23 HA2 GLY 4 HA2 GLY 4 -8.905 -9.122 7.689 24 HA3 GLY 4 HA1 GLY 4 -8.629 -9.598 6.021 25 H THR 5 HN THR 5 -6.619 -10.444 6.465 26 HA THR 5 HA THR 5 -4.538 -8.424 6.896 27 HB THR 5 HB THR 5 -3.283 -10.496 7.927 28 HG1 THR 5 HG1 THR 5 -5.023 -11.982 7.661 29 HG21 THR 5 HG21 THR 5 -3.613 -8.447 9.134 30 HG22 THR 5 HG22 THR 5 -4.077 -9.786 10.184 31 HG23 THR 5 HG23 THR 5 -5.316 -8.819 9.387 32 H TRP 6 HN TRP 6 -3.224 -8.328 5.212 33 HA TRP 6 HA TRP 6 -2.905 -10.720 3.508 34 HB2 TRP 6 HB2 TRP 6 -2.606 -7.882 2.583 35 HB3 TRP 6 HB1 TRP 6 -2.830 -9.332 1.608 36 HD1 TRP 6 HD1 TRP 6 -4.771 -6.908 3.852 37 HE1 TRP 6 HE1 TRP 6 -7.272 -7.101 3.295 38 HE3 TRP 6 HE3 TRP 6 -4.582 -10.919 0.690 39 HZ2 TRP 6 HZ2 TRP 6 -8.950 -8.764 1.745 40 HZ3 TRP 6 HZ3 TRP 6 -6.683 -11.756 -0.271 41 HH2 TRP 6 HH2 TRP 6 -8.820 -10.702 0.243 42 H GLN 7 HN GLN 7 -0.935 -11.503 3.245 43 HA GLN 7 HA GLN 7 1.355 -9.939 4.209 44 HB2 GLN 7 HB2 GLN 7 0.881 -12.269 5.107 45 HB3 GLN 7 HB1 GLN 7 1.317 -12.879 3.517 46 HG2 GLN 7 HG2 GLN 7 3.374 -11.129 4.364 47 HG3 GLN 7 HG1 GLN 7 3.009 -12.224 5.694 48 HE21 GLN 7 HE21 GLN 7 4.269 -11.940 2.476 49 HE22 GLN 7 HE22 GLN 7 4.861 -13.561 2.352 50 H VAL 8 HN VAL 8 2.391 -8.848 2.696 51 HA VAL 8 HA VAL 8 2.240 -9.519 -0.101 52 HB VAL 8 HB VAL 8 3.908 -7.405 1.276 53 HG11 VAL 8 HG11 VAL 8 3.922 -6.328 -0.954 54 HG12 VAL 8 HG12 VAL 8 3.151 -7.768 -1.620 55 HG13 VAL 8 HG13 VAL 8 4.768 -7.874 -0.925 56 HG21 VAL 8 HG21 VAL 8 1.262 -7.050 -0.110 57 HG22 VAL 8 HG22 VAL 8 2.170 -5.852 0.810 58 HG23 VAL 8 HG23 VAL 8 1.440 -7.229 1.635 59 H TYR 9 HN TYR 9 3.990 -10.180 -1.449 60 HA TYR 9 HA TYR 9 6.521 -10.880 -0.168 61 HB2 TYR 9 HB2 TYR 9 6.413 -13.214 -0.939 62 HB3 TYR 9 HB1 TYR 9 5.114 -12.851 0.191 63 HD1 TYR 9 HD1 TYR 9 2.774 -12.573 -0.657 64 HD2 TYR 9 HD2 TYR 9 5.942 -13.868 -3.186 65 HE1 TYR 9 HE1 TYR 9 1.149 -13.350 -2.288 66 HE2 TYR 9 HE2 TYR 9 4.300 -14.662 -4.830 67 HH TYR 9 HH TYR 9 0.994 -13.852 -4.670 68 H ALA 10 HN ALA 10 5.645 -9.020 -2.339 69 HA ALA 10 HA ALA 10 6.893 -10.228 -4.699 70 HB1 ALA 10 HB1 ALA 10 5.346 -7.666 -4.387 71 HB2 ALA 10 HB2 ALA 10 4.788 -9.166 -5.129 72 HB3 ALA 10 HB3 ALA 10 6.069 -8.230 -5.891 73 H GLN 11 HN GLN 11 8.688 -9.416 -5.696 74 HA GLN 11 HA GLN 11 10.084 -7.177 -4.406 75 HB2 GLN 11 HB2 GLN 11 11.063 -9.958 -4.850 76 HB3 GLN 11 HB1 GLN 11 12.206 -8.642 -5.054 77 HG2 GLN 11 HG2 GLN 11 12.524 -9.223 -2.856 78 HG3 GLN 11 HG1 GLN 11 11.375 -7.892 -2.718 79 HE21 GLN 11 HE21 GLN 11 10.564 -8.569 -0.770 80 HE22 GLN 11 HE22 GLN 11 9.577 -9.980 -0.607 81 H GLU 12 HN GLU 12 8.612 -6.842 -6.680 82 HA GLU 12 HA GLU 12 10.089 -7.205 -9.070 83 HB2 GLU 12 HB2 GLU 12 7.607 -5.821 -8.290 84 HB3 GLU 12 HB1 GLU 12 8.435 -5.182 -9.699 85 HG2 GLU 12 HG2 GLU 12 6.612 -6.978 -10.010 86 HG3 GLU 12 HG1 GLU 12 8.103 -7.077 -10.943 87 H ASN 13 HN ASN 13 8.983 -4.138 -8.114 88 HA ASN 13 HA ASN 13 11.651 -2.957 -8.467 89 HB2 ASN 13 HB2 ASN 13 10.162 -0.860 -9.013 90 HB3 ASN 13 HB1 ASN 13 10.435 -2.080 -10.249 91 HD21 ASN 13 HD21 ASN 13 8.526 -1.271 -11.219 92 HD22 ASN 13 HD22 ASN 13 6.956 -1.732 -10.670 93 H TYR 14 HN TYR 14 10.392 -3.997 -6.047 94 HA TYR 14 HA TYR 14 9.287 -2.059 -4.393 95 HB2 TYR 14 HB2 TYR 14 9.232 -4.449 -3.898 96 HB3 TYR 14 HB1 TYR 14 10.977 -4.462 -3.684 97 HD1 TYR 14 HD1 TYR 14 11.992 -3.435 -1.709 98 HD2 TYR 14 HD2 TYR 14 7.767 -3.650 -2.162 99 HE1 TYR 14 HE1 TYR 14 11.717 -2.990 0.686 100 HE2 TYR 14 HE2 TYR 14 7.483 -3.207 0.243 101 HH TYR 14 HH TYR 14 9.205 -3.660 2.396 102 H GLU 15 HN GLU 15 12.699 -3.165 -4.417 103 HA GLU 15 HA GLU 15 13.573 -1.185 -2.617 104 HB2 GLU 15 HB2 GLU 15 15.859 -1.809 -3.343 105 HB3 GLU 15 HB1 GLU 15 14.869 -3.193 -2.905 106 HG2 GLU 15 HG2 GLU 15 14.539 -3.747 -5.212 107 HG3 GLU 15 HG1 GLU 15 15.354 -2.272 -5.727 108 H GLU 16 HN GLU 16 12.973 -1.050 -6.007 109 HA GLU 16 HA GLU 16 14.635 1.248 -6.487 110 HB2 GLU 16 HB2 GLU 16 14.147 -0.336 -8.294 111 HB3 GLU 16 HB1 GLU 16 12.433 0.028 -8.155 112 HG2 GLU 16 HG2 GLU 16 12.651 2.108 -9.108 113 HG3 GLU 16 HG1 GLU 16 14.359 2.232 -8.689 114 H PHE 17 HN PHE 17 11.220 0.603 -5.927 115 HA PHE 17 HA PHE 17 10.294 3.229 -6.366 116 HB2 PHE 17 HB2 PHE 17 8.773 1.366 -6.443 117 HB3 PHE 17 HB1 PHE 17 9.126 0.937 -4.770 118 HD1 PHE 17 HD2 PHE 17 8.271 4.170 -6.430 119 HD2 PHE 17 HD1 PHE 17 7.235 1.261 -3.511 120 HE1 PHE 17 HE2 PHE 17 6.361 5.545 -5.744 121 HE2 PHE 17 HE1 PHE 17 5.318 2.629 -2.812 122 HZ PHE 17 HZ PHE 17 4.876 4.779 -3.930 123 H LEU 18 HN LEU 18 11.595 1.594 -3.553 124 HA LEU 18 HA LEU 18 10.810 3.397 -1.571 125 HB2 LEU 18 HB2 LEU 18 13.405 1.875 -1.703 126 HB3 LEU 18 HB1 LEU 18 12.688 2.568 -0.266 127 HG LEU 18 HG LEU 18 11.801 0.151 -1.810 128 HD11 LEU 18 HD11 LEU 18 12.545 0.702 1.048 129 HD12 LEU 18 HD12 LEU 18 13.379 -0.330 -0.112 130 HD13 LEU 18 HD13 LEU 18 11.797 -0.799 0.508 131 HD21 LEU 18 HD21 LEU 18 9.815 0.094 -0.345 132 HD22 LEU 18 HD22 LEU 18 9.791 1.426 -1.500 133 HD23 LEU 18 HD23 LEU 18 10.200 1.729 0.191 134 H LYS 19 HN LYS 19 13.512 3.513 -3.821 135 HA LYS 19 HA LYS 19 14.798 5.746 -2.613 136 HB2 LYS 19 HB2 LYS 19 15.109 5.101 -5.521 137 HB3 LYS 19 HB1 LYS 19 16.317 5.652 -4.370 138 HG2 LYS 19 HG2 LYS 19 15.668 3.259 -3.301 139 HG3 LYS 19 HG1 LYS 19 15.414 2.930 -5.014 140 HD2 LYS 19 HD2 LYS 19 17.659 3.540 -5.536 141 HD3 LYS 19 HD1 LYS 19 17.935 4.159 -3.907 142 HE2 LYS 19 HE2 LYS 19 17.632 1.895 -3.010 143 HE3 LYS 19 HE1 LYS 19 17.388 1.289 -4.647 144 HZ1 LYS 19 HZ1 LYS 19 19.864 2.657 -3.741 145 HZ2 LYS 19 HZ2 LYS 19 19.613 1.845 -5.209 146 HZ3 LYS 19 HZ3 LYS 19 19.661 0.975 -3.764 147 H ALA 20 HN ALA 20 12.149 5.376 -4.795 148 HA ALA 20 HA ALA 20 12.291 8.058 -5.818 149 HB1 ALA 20 HB1 ALA 20 10.288 7.542 -7.018 150 HB2 ALA 20 HB2 ALA 20 9.985 6.136 -6.000 151 HB3 ALA 20 HB3 ALA 20 11.355 6.141 -7.110 152 H LEU 21 HN LEU 21 11.305 6.698 -2.960 153 HA LEU 21 HA LEU 21 9.289 8.758 -2.421 154 HB2 LEU 21 HB2 LEU 21 10.074 6.418 -0.696 155 HB3 LEU 21 HB1 LEU 21 8.654 7.435 -0.523 156 HG LEU 21 HG LEU 21 9.106 5.748 -2.971 157 HD11 LEU 21 HD11 LEU 21 7.526 4.946 -0.539 158 HD12 LEU 21 HD12 LEU 21 9.144 4.351 -0.901 159 HD13 LEU 21 HD13 LEU 21 7.808 3.994 -1.998 160 HD21 LEU 21 HD21 LEU 21 7.405 7.714 -2.739 161 HD22 LEU 21 HD22 LEU 21 6.479 6.535 -1.810 162 HD23 LEU 21 HD23 LEU 21 6.915 6.192 -3.482 163 H ALA 22 HN ALA 22 12.450 8.638 -2.404 164 HA ALA 22 HA ALA 22 14.132 9.771 -1.389 165 HB1 ALA 22 HB1 ALA 22 12.571 11.664 -1.481 166 HB2 ALA 22 HB2 ALA 22 13.627 11.731 -0.070 167 HB3 ALA 22 HB3 ALA 22 11.949 11.214 0.106 168 H LEU 23 HN LEU 23 12.993 7.311 -0.279 169 HA LEU 23 HA LEU 23 13.241 7.484 2.581 170 HB2 LEU 23 HB2 LEU 23 13.066 5.156 0.672 171 HB3 LEU 23 HB1 LEU 23 13.191 4.959 2.408 172 HG LEU 23 HG LEU 23 10.963 6.488 1.077 173 HD11 LEU 23 HD11 LEU 23 10.955 4.130 0.387 174 HD12 LEU 23 HD12 LEU 23 9.571 4.550 1.395 175 HD13 LEU 23 HD13 LEU 23 10.924 3.650 2.085 176 HD21 LEU 23 HD21 LEU 23 11.279 5.394 3.867 177 HD22 LEU 23 HD22 LEU 23 9.852 6.220 3.239 178 HD23 LEU 23 HD23 LEU 23 11.378 7.093 3.403 179 HA PRO 24 HA PRO 24 17.574 6.867 2.855 180 HB2 PRO 24 HB2 PRO 24 17.810 5.280 5.099 181 HB3 PRO 24 HB1 PRO 24 17.494 7.022 5.122 182 HG2 PRO 24 HG2 PRO 24 15.721 4.828 5.786 183 HG3 PRO 24 HG1 PRO 24 15.552 6.558 6.120 184 HD2 PRO 24 HD2 PRO 24 14.252 5.003 4.106 185 HD3 PRO 24 HD1 PRO 24 14.056 6.725 4.461 186 H GLU 25 HN GLU 25 18.843 5.678 1.591 187 HA GLU 25 HA GLU 25 18.153 3.149 0.638 188 HB2 GLU 25 HB2 GLU 25 20.688 4.743 0.553 189 HB3 GLU 25 HB1 GLU 25 20.623 3.113 -0.112 190 HG2 GLU 25 HG2 GLU 25 18.703 3.848 -1.523 191 HG3 GLU 25 HG1 GLU 25 18.970 5.491 -0.944 192 H ASP 26 HN ASP 26 19.859 4.051 3.519 193 HA ASP 26 HA ASP 26 21.199 1.594 3.942 194 HB2 ASP 26 HB2 ASP 26 21.678 2.349 6.113 195 HB3 ASP 26 HB1 ASP 26 21.536 3.836 5.191 196 H LEU 27 HN LEU 27 17.962 2.743 4.573 197 HA LEU 27 HA LEU 27 17.189 0.356 6.030 198 HB2 LEU 27 HB2 LEU 27 16.257 2.754 6.312 199 HB3 LEU 27 HB1 LEU 27 15.323 2.410 4.869 200 HG LEU 27 HG LEU 27 14.697 0.239 6.393 201 HD11 LEU 27 HD11 LEU 27 15.976 1.073 8.288 202 HD12 LEU 27 HD12 LEU 27 14.252 1.017 8.649 203 HD13 LEU 27 HD13 LEU 27 15.028 2.560 8.286 204 HD21 LEU 27 HD21 LEU 27 13.095 1.604 5.224 205 HD22 LEU 27 HD22 LEU 27 13.354 2.944 6.339 206 HD23 LEU 27 HD23 LEU 27 12.596 1.454 6.910 207 H ILE 28 HN ILE 28 16.928 1.705 2.807 208 HA ILE 28 HA ILE 28 15.019 -0.003 1.693 209 HB ILE 28 HB ILE 28 17.393 1.350 0.398 210 HG12 ILE 28 HG12 ILE 28 14.470 2.121 0.427 211 HG13 ILE 28 HG11 ILE 28 15.683 2.804 1.503 212 HG21 ILE 28 HG21 ILE 28 16.604 0.801 -1.699 213 HG22 ILE 28 HG22 ILE 28 14.972 0.487 -1.119 214 HG23 ILE 28 HG23 ILE 28 16.259 -0.675 -0.800 215 HD11 ILE 28 HD11 ILE 28 16.288 2.956 -1.375 216 HD12 ILE 28 HD12 ILE 28 16.520 4.148 -0.093 217 HD13 ILE 28 HD13 ILE 28 14.925 3.921 -0.810 218 H LYS 29 HN LYS 29 18.467 -0.448 2.251 219 HA LYS 29 HA LYS 29 18.786 -2.763 0.641 220 HB2 LYS 29 HB2 LYS 29 20.365 -1.654 2.957 221 HB3 LYS 29 HB1 LYS 29 20.845 -3.111 2.098 222 HG2 LYS 29 HG2 LYS 29 21.232 -1.934 0.105 223 HG3 LYS 29 HG1 LYS 29 20.374 -0.507 0.685 224 HD2 LYS 29 HD2 LYS 29 22.650 0.049 0.840 225 HD3 LYS 29 HD1 LYS 29 22.170 -0.364 2.490 226 HE2 LYS 29 HE2 LYS 29 23.076 -2.637 2.127 227 HE3 LYS 29 HE1 LYS 29 23.625 -2.139 0.525 228 HZ1 LYS 29 HZ1 LYS 29 24.463 -0.673 2.949 229 HZ2 LYS 29 HZ2 LYS 29 25.199 -0.711 1.428 230 HZ3 LYS 29 HZ3 LYS 29 25.288 -2.058 2.444 231 H MET 30 HN MET 30 17.555 -2.216 3.837 232 HA MET 30 HA MET 30 17.656 -5.043 4.532 233 HB2 MET 30 HB2 MET 30 16.375 -2.740 6.021 234 HB3 MET 30 HB1 MET 30 16.679 -4.352 6.653 235 HG2 MET 30 HG2 MET 30 19.010 -4.017 6.667 236 HG3 MET 30 HG1 MET 30 18.875 -2.552 5.696 237 HE1 MET 30 HE1 MET 30 20.699 -2.080 7.823 238 HE2 MET 30 HE2 MET 30 20.068 -0.779 8.832 239 HE3 MET 30 HE3 MET 30 19.948 -0.668 7.072 240 H ALA 31 HN ALA 31 15.301 -2.540 3.766 241 HA ALA 31 HA ALA 31 12.951 -3.996 4.134 242 HB1 ALA 31 HB1 ALA 31 11.879 -2.316 2.794 243 HB2 ALA 31 HB2 ALA 31 13.426 -1.822 2.108 244 HB3 ALA 31 HB3 ALA 31 13.094 -1.556 3.819 245 H ARG 32 HN ARG 32 15.215 -4.069 1.471 246 HA ARG 32 HA ARG 32 13.505 -5.174 -0.475 247 HB2 ARG 32 HB2 ARG 32 15.432 -5.571 -1.765 248 HB3 ARG 32 HB1 ARG 32 15.806 -4.144 -0.816 249 HG2 ARG 32 HG2 ARG 32 17.059 -5.572 0.766 250 HG3 ARG 32 HG1 ARG 32 16.746 -6.953 -0.287 251 HD2 ARG 32 HD2 ARG 32 18.352 -4.484 -0.898 252 HD3 ARG 32 HD1 ARG 32 18.930 -6.144 -0.795 253 HE ARG 32 HE ARG 32 17.538 -4.895 -3.021 254 HH11 ARG 32 HH11 ARG 32 18.697 -7.865 -1.566 255 HH12 ARG 32 HH12 ARG 32 18.696 -8.747 -3.057 256 HH21 ARG 32 HH21 ARG 32 17.507 -6.056 -4.984 257 HH22 ARG 32 HH22 ARG 32 18.018 -7.722 -5.000 258 H ASP 33 HN ASP 33 14.683 -6.540 2.386 259 HA ASP 33 HA ASP 33 14.202 -9.264 1.354 260 HB2 ASP 33 HB2 ASP 33 16.499 -8.941 2.202 261 HB3 ASP 33 HB1 ASP 33 15.855 -8.440 3.762 262 H ILE 34 HN ILE 34 13.204 -6.834 3.535 263 HA ILE 34 HA ILE 34 11.779 -8.559 5.341 264 HB ILE 34 HB ILE 34 11.583 -5.565 5.006 265 HG12 ILE 34 HG12 ILE 34 13.246 -7.245 6.891 266 HG13 ILE 34 HG11 ILE 34 13.851 -6.233 5.588 267 HG21 ILE 34 HG21 ILE 34 9.641 -6.541 6.127 268 HG22 ILE 34 HG22 ILE 34 10.605 -5.562 7.235 269 HG23 ILE 34 HG23 ILE 34 10.711 -7.324 7.293 270 HD11 ILE 34 HD11 ILE 34 12.471 -5.281 8.088 271 HD12 ILE 34 HD12 ILE 34 13.010 -4.248 6.766 272 HD13 ILE 34 HD13 ILE 34 14.190 -5.150 7.716 273 H LYS 35 HN LYS 35 9.866 -9.419 4.985 274 HA LYS 35 HA LYS 35 8.024 -8.092 3.106 275 HB2 LYS 35 HB2 LYS 35 7.021 -10.451 2.865 276 HB3 LYS 35 HB1 LYS 35 8.551 -10.131 2.061 277 HG2 LYS 35 HG2 LYS 35 9.752 -11.264 3.838 278 HG3 LYS 35 HG1 LYS 35 8.245 -11.532 4.710 279 HD2 LYS 35 HD2 LYS 35 7.432 -12.790 2.681 280 HD3 LYS 35 HD1 LYS 35 9.088 -12.705 2.075 281 HE2 LYS 35 HE2 LYS 35 9.905 -13.911 3.993 282 HE3 LYS 35 HE1 LYS 35 8.305 -13.880 4.738 283 HZ1 LYS 35 HZ1 LYS 35 9.352 -15.788 2.979 284 HZ2 LYS 35 HZ2 LYS 35 8.082 -15.008 2.180 285 HZ3 LYS 35 HZ3 LYS 35 7.809 -15.744 3.677 286 HA PRO 36 HA PRO 36 6.017 -7.952 7.220 287 HB2 PRO 36 HB2 PRO 36 5.015 -5.469 6.988 288 HB3 PRO 36 HB1 PRO 36 6.724 -5.748 7.381 289 HG2 PRO 36 HG2 PRO 36 5.486 -5.021 4.775 290 HG3 PRO 36 HG1 PRO 36 6.977 -4.420 5.523 291 HD2 PRO 36 HD2 PRO 36 6.919 -6.339 3.576 292 HD3 PRO 36 HD1 PRO 36 8.220 -6.173 4.767 293 H ILE 37 HN ILE 37 3.788 -7.721 7.848 294 HA ILE 37 HA ILE 37 1.979 -8.412 5.665 295 HB ILE 37 HB ILE 37 2.209 -9.924 7.681 296 HG12 ILE 37 HG12 ILE 37 0.131 -9.474 6.029 297 HG13 ILE 37 HG11 ILE 37 0.123 -10.717 7.280 298 HG21 ILE 37 HG21 ILE 37 0.526 -7.857 9.081 299 HG22 ILE 37 HG22 ILE 37 2.255 -8.070 9.355 300 HG23 ILE 37 HG23 ILE 37 1.136 -9.380 9.729 301 HD11 ILE 37 HD11 ILE 37 -1.937 -9.275 7.099 302 HD12 ILE 37 HD12 ILE 37 -0.965 -7.945 7.734 303 HD13 ILE 37 HD13 ILE 37 -1.219 -9.397 8.704 304 H VAL 38 HN VAL 38 0.085 -7.312 5.267 305 HA VAL 38 HA VAL 38 -0.041 -4.641 6.474 306 HB VAL 38 HB VAL 38 -1.446 -5.555 3.966 307 HG11 VAL 38 HG11 VAL 38 -0.831 -2.818 5.070 308 HG12 VAL 38 HG12 VAL 38 -2.419 -3.586 5.000 309 HG13 VAL 38 HG13 VAL 38 -1.587 -3.142 3.509 310 HG21 VAL 38 HG21 VAL 38 0.906 -5.802 3.555 311 HG22 VAL 38 HG22 VAL 38 1.245 -4.233 4.282 312 HG23 VAL 38 HG23 VAL 38 0.363 -4.325 2.758 313 H GLU 39 HN GLU 39 -1.375 -4.590 8.152 314 HA GLU 39 HA GLU 39 -3.740 -6.261 8.254 315 HB2 GLU 39 HB2 GLU 39 -2.201 -4.600 10.153 316 HB3 GLU 39 HB1 GLU 39 -3.939 -4.644 10.425 317 HG2 GLU 39 HG2 GLU 39 -3.953 -6.929 10.809 318 HG3 GLU 39 HG1 GLU 39 -2.398 -7.160 10.022 319 H ILE 40 HN ILE 40 -5.755 -5.608 7.768 320 HA ILE 40 HA ILE 40 -6.320 -2.747 7.641 321 HB ILE 40 HB ILE 40 -5.549 -3.269 5.393 322 HG12 ILE 40 HG12 ILE 40 -7.644 -1.770 5.938 323 HG13 ILE 40 HG11 ILE 40 -7.191 -2.101 4.274 324 HG21 ILE 40 HG21 ILE 40 -6.628 -4.853 3.938 325 HG22 ILE 40 HG22 ILE 40 -7.787 -5.271 5.199 326 HG23 ILE 40 HG23 ILE 40 -6.082 -5.673 5.403 327 HD11 ILE 40 HD11 ILE 40 -8.933 -3.703 4.041 328 HD12 ILE 40 HD12 ILE 40 -9.631 -2.260 4.778 329 HD13 ILE 40 HD13 ILE 40 -9.266 -3.668 5.772 330 H GLN 41 HN GLN 41 -8.234 -2.280 8.462 331 HA GLN 41 HA GLN 41 -10.291 -4.383 8.495 332 HB2 GLN 41 HB2 GLN 41 -10.957 -3.732 10.736 333 HB3 GLN 41 HB1 GLN 41 -9.255 -4.174 10.733 334 HG2 GLN 41 HG2 GLN 41 -8.554 -1.992 11.039 335 HG3 GLN 41 HG1 GLN 41 -10.067 -1.316 10.434 336 HE21 GLN 41 HE21 GLN 41 -11.826 -1.167 11.807 337 HE22 GLN 41 HE22 GLN 41 -11.686 -1.362 13.519 338 H GLN 42 HN GLN 42 -12.430 -3.702 8.283 339 HA GLN 42 HA GLN 42 -12.810 -0.826 7.775 340 HB2 GLN 42 HB2 GLN 42 -13.806 -1.151 5.742 341 HB3 GLN 42 HB1 GLN 42 -12.713 -2.530 5.729 342 HG2 GLN 42 HG2 GLN 42 -14.574 -3.930 6.592 343 HG3 GLN 42 HG1 GLN 42 -15.639 -2.537 6.430 344 HE21 GLN 42 HE21 GLN 42 -16.338 -1.914 4.427 345 HE22 GLN 42 HE22 GLN 42 -16.062 -2.842 2.995 346 H LYS 43 HN LYS 43 -15.154 -0.240 7.740 347 HA LYS 43 HA LYS 43 -16.908 -1.929 9.311 348 HB2 LYS 43 HB2 LYS 43 -15.531 -0.511 10.917 349 HB3 LYS 43 HB1 LYS 43 -16.329 0.893 10.227 350 HG2 LYS 43 HG2 LYS 43 -17.474 0.350 12.225 351 HG3 LYS 43 HG1 LYS 43 -18.513 -0.140 10.887 352 HD2 LYS 43 HD2 LYS 43 -17.774 -2.460 11.150 353 HD3 LYS 43 HD1 LYS 43 -16.709 -1.968 12.470 354 HE2 LYS 43 HE2 LYS 43 -18.747 -2.939 13.341 355 HE3 LYS 43 HE1 LYS 43 -18.661 -1.227 13.754 356 HZ1 LYS 43 HZ1 LYS 43 -20.273 -2.413 11.547 357 HZ2 LYS 43 HZ2 LYS 43 -20.176 -0.762 11.908 358 HZ3 LYS 43 HZ3 LYS 43 -20.872 -1.831 13.017 359 H GLY 44 HN GLY 44 -17.749 -1.877 7.076 360 HA2 GLY 44 HA2 GLY 44 -19.728 -1.242 5.967 361 HA3 GLY 44 HA1 GLY 44 -19.680 0.300 6.818 362 H ASP 45 HN ASP 45 -18.418 1.980 6.021 363 HA ASP 45 HA ASP 45 -17.358 1.512 3.309 364 HB2 ASP 45 HB2 ASP 45 -18.724 3.960 4.421 365 HB3 ASP 45 HB1 ASP 45 -17.862 3.947 2.892 366 H ASP 46 HN ASP 46 -16.661 2.625 6.485 367 HA ASP 46 HA ASP 46 -14.338 4.144 5.645 368 HB2 ASP 46 HB2 ASP 46 -14.004 4.724 7.927 369 HB3 ASP 46 HB1 ASP 46 -15.733 4.804 7.643 370 H PHE 47 HN PHE 47 -12.267 3.536 5.747 371 HA PHE 47 HA PHE 47 -11.718 0.762 6.592 372 HB2 PHE 47 HB2 PHE 47 -10.768 2.256 4.163 373 HB3 PHE 47 HB1 PHE 47 -9.862 0.898 4.801 374 HD1 PHE 47 HD2 PHE 47 -13.499 1.510 4.226 375 HD2 PHE 47 HD1 PHE 47 -10.099 -0.914 3.457 376 HE1 PHE 47 HE2 PHE 47 -14.898 -0.027 2.911 377 HE2 PHE 47 HE1 PHE 47 -11.485 -2.458 2.137 378 HZ PHE 47 HZ PHE 47 -13.889 -2.013 1.858 379 H VAL 48 HN VAL 48 -9.775 0.369 7.545 380 HA VAL 48 HA VAL 48 -8.053 2.671 8.141 381 HB VAL 48 HB VAL 48 -9.007 0.623 10.166 382 HG11 VAL 48 HG11 VAL 48 -6.677 1.092 10.547 383 HG12 VAL 48 HG12 VAL 48 -7.633 1.910 11.781 384 HG13 VAL 48 HG13 VAL 48 -6.962 2.826 10.430 385 HG21 VAL 48 HG21 VAL 48 -10.624 2.416 9.691 386 HG22 VAL 48 HG22 VAL 48 -9.394 3.618 10.086 387 HG23 VAL 48 HG23 VAL 48 -9.987 2.516 11.332 388 H VAL 49 HN VAL 49 -6.370 2.108 6.914 389 HA VAL 49 HA VAL 49 -5.431 -0.660 6.923 390 HB VAL 49 HB VAL 49 -4.242 1.597 5.317 391 HG11 VAL 49 HG11 VAL 49 -2.918 -0.399 5.357 392 HG12 VAL 49 HG12 VAL 49 -3.678 -0.271 3.772 393 HG13 VAL 49 HG13 VAL 49 -4.320 -1.397 4.969 394 HG21 VAL 49 HG21 VAL 49 -5.757 1.056 3.499 395 HG22 VAL 49 HG22 VAL 49 -6.669 1.560 4.920 396 HG23 VAL 49 HG23 VAL 49 -6.563 -0.149 4.498 397 H THR 50 HN THR 50 -3.771 -1.299 8.099 398 HA THR 50 HA THR 50 -2.126 0.735 9.426 399 HB THR 50 HB THR 50 -2.594 -2.137 10.252 400 HG1 THR 50 HG1 THR 50 -4.475 -1.280 10.791 401 HG21 THR 50 HG21 THR 50 -1.713 -1.254 12.458 402 HG22 THR 50 HG22 THR 50 -1.194 0.181 11.574 403 HG23 THR 50 HG23 THR 50 -0.525 -1.399 11.157 404 H SER 51 HN SER 51 -0.294 1.021 8.316 405 HA SER 51 HA SER 51 1.022 -1.233 7.011 406 HB2 SER 51 HB2 SER 51 2.089 1.579 7.152 407 HB3 SER 51 HB1 SER 51 2.334 0.371 5.891 408 HG SER 51 HG SER 51 -0.089 0.613 5.653 409 H LYS 52 HN LYS 52 1.915 -2.488 8.530 410 HA LYS 52 HA LYS 52 3.335 -1.321 10.779 411 HB2 LYS 52 HB2 LYS 52 2.847 -4.230 10.107 412 HB3 LYS 52 HB1 LYS 52 3.501 -3.610 11.617 413 HG2 LYS 52 HG2 LYS 52 1.288 -2.280 11.762 414 HG3 LYS 52 HG1 LYS 52 0.712 -3.432 10.556 415 HD2 LYS 52 HD2 LYS 52 1.859 -4.122 13.257 416 HD3 LYS 52 HD1 LYS 52 0.149 -4.146 12.823 417 HE2 LYS 52 HE2 LYS 52 0.635 -5.860 11.121 418 HE3 LYS 52 HE1 LYS 52 2.323 -5.867 11.633 419 HZ1 LYS 52 HZ1 LYS 52 1.200 -6.318 13.953 420 HZ2 LYS 52 HZ2 LYS 52 1.523 -7.570 12.872 421 HZ3 LYS 52 HZ3 LYS 52 -0.045 -6.940 12.983 422 H THR 53 HN THR 53 5.381 -0.833 10.643 423 HA THR 53 HA THR 53 7.138 -2.491 8.964 424 HB THR 53 HB THR 53 8.263 -0.612 8.100 425 HG1 THR 53 HG1 THR 53 6.882 1.388 9.415 426 HG21 THR 53 HG21 THR 53 6.562 0.673 7.000 427 HG22 THR 53 HG22 THR 53 5.391 0.298 8.273 428 HG23 THR 53 HG23 THR 53 5.972 -0.979 7.194 429 HA PRO 54 HA PRO 54 9.827 -2.793 12.450 430 HB2 PRO 54 HB2 PRO 54 12.167 -2.207 10.747 431 HB3 PRO 54 HB1 PRO 54 11.730 -3.710 11.588 432 HG2 PRO 54 HG2 PRO 54 11.611 -3.503 8.932 433 HG3 PRO 54 HG1 PRO 54 10.432 -4.463 9.853 434 HD2 PRO 54 HD2 PRO 54 10.139 -1.710 8.706 435 HD3 PRO 54 HD1 PRO 54 8.989 -3.064 8.691 436 H ARG 55 HN ARG 55 9.457 0.124 10.859 437 HA ARG 55 HA ARG 55 11.249 1.499 12.748 438 HB2 ARG 55 HB2 ARG 55 10.489 2.110 9.928 439 HB3 ARG 55 HB1 ARG 55 10.939 3.423 11.007 440 HG2 ARG 55 HG2 ARG 55 12.647 1.025 10.385 441 HG3 ARG 55 HG1 ARG 55 12.818 2.621 9.657 442 HD2 ARG 55 HD2 ARG 55 13.076 3.489 12.041 443 HD3 ARG 55 HD1 ARG 55 13.281 1.799 12.506 444 HE ARG 55 HE ARG 55 15.261 1.738 11.122 445 HH11 ARG 55 HH11 ARG 55 13.964 4.929 11.768 446 HH12 ARG 55 HH12 ARG 55 15.460 5.736 11.432 447 HH21 ARG 55 HH21 ARG 55 17.223 2.811 10.650 448 HH22 ARG 55 HH22 ARG 55 17.314 4.537 10.802 449 H GLN 56 HN GLN 56 8.288 2.110 10.863 450 HA GLN 56 HA GLN 56 7.015 3.190 13.257 451 HB2 GLN 56 HB2 GLN 56 8.129 5.098 12.109 452 HB3 GLN 56 HB1 GLN 56 7.193 4.743 10.666 453 HG2 GLN 56 HG2 GLN 56 5.883 6.359 11.512 454 HG3 GLN 56 HG1 GLN 56 5.190 4.995 12.393 455 HE21 GLN 56 HE21 GLN 56 4.498 6.400 14.023 456 HE22 GLN 56 HE22 GLN 56 5.594 7.047 15.193 457 H THR 57 HN THR 57 5.036 2.367 13.403 458 HA THR 57 HA THR 57 3.805 1.163 11.053 459 HB THR 57 HB THR 57 2.081 0.370 12.708 460 HG1 THR 57 HG1 THR 57 2.427 2.091 14.236 461 HG21 THR 57 HG21 THR 57 4.582 -0.606 12.242 462 HG22 THR 57 HG22 THR 57 3.337 -1.434 13.175 463 HG23 THR 57 HG23 THR 57 4.570 -0.480 13.999 464 H VAL 58 HN VAL 58 2.868 2.715 9.779 465 HA VAL 58 HA VAL 58 1.432 4.867 11.128 466 HB VAL 58 HB VAL 58 1.340 6.052 9.077 467 HG11 VAL 58 HG11 VAL 58 3.473 6.282 10.046 468 HG12 VAL 58 HG12 VAL 58 3.753 6.014 8.325 469 HG13 VAL 58 HG13 VAL 58 3.989 4.696 9.473 470 HG21 VAL 58 HG21 VAL 58 2.237 3.512 7.734 471 HG22 VAL 58 HG22 VAL 58 2.133 5.083 6.942 472 HG23 VAL 58 HG23 VAL 58 0.676 4.311 7.567 473 H THR 59 HN THR 59 -0.697 5.496 10.490 474 HA THR 59 HA THR 59 -2.304 3.243 9.513 475 HB THR 59 HB THR 59 -2.603 3.684 11.962 476 HG1 THR 59 HG1 THR 59 -4.389 2.733 11.305 477 HG21 THR 59 HG21 THR 59 -3.863 6.249 10.999 478 HG22 THR 59 HG22 THR 59 -2.374 6.122 11.934 479 HG23 THR 59 HG23 THR 59 -3.911 5.634 12.650 480 H ASN 60 HN ASN 60 -3.707 3.648 7.934 481 HA ASN 60 HA ASN 60 -4.106 6.443 7.044 482 HB2 ASN 60 HB2 ASN 60 -3.455 3.979 5.428 483 HB3 ASN 60 HB1 ASN 60 -4.248 5.373 4.699 484 HD21 ASN 60 HD21 ASN 60 -1.319 4.115 6.064 485 HD22 ASN 60 HD22 ASN 60 -0.298 5.429 5.590 486 H SER 61 HN SER 61 -6.234 6.954 6.993 487 HA SER 61 HA SER 61 -8.170 4.732 6.836 488 HB2 SER 61 HB2 SER 61 -8.887 7.195 8.355 489 HB3 SER 61 HB1 SER 61 -9.377 5.522 8.624 490 HG SER 61 HG SER 61 -6.702 6.344 9.001 491 H PHE 62 HN PHE 62 -10.128 5.126 5.748 492 HA PHE 62 HA PHE 62 -10.675 7.683 4.558 493 HB2 PHE 62 HB2 PHE 62 -10.598 6.791 2.197 494 HB3 PHE 62 HB1 PHE 62 -9.030 7.039 2.953 495 HD1 PHE 62 HD1 PHE 62 -11.416 4.557 1.717 496 HD2 PHE 62 HD2 PHE 62 -7.612 5.174 3.521 497 HE1 PHE 62 HE1 PHE 62 -10.807 2.227 1.211 498 HE2 PHE 62 HE2 PHE 62 -6.994 2.852 3.021 499 HZ PHE 62 HZ PHE 62 -8.584 1.369 1.869 500 H THR 63 HN THR 63 -12.540 7.336 2.843 501 HA THR 63 HA THR 63 -14.344 5.229 3.827 502 HB THR 63 HB THR 63 -15.189 8.049 3.106 503 HG1 THR 63 HG1 THR 63 -13.932 7.672 5.161 504 HG21 THR 63 HG21 THR 63 -16.722 5.797 4.412 505 HG22 THR 63 HG22 THR 63 -16.911 6.326 2.740 506 HG23 THR 63 HG23 THR 63 -17.339 7.413 4.061 507 H LEU 64 HN LEU 64 -15.378 4.101 2.269 508 HA LEU 64 HA LEU 64 -14.437 4.069 -0.353 509 HB2 LEU 64 HB2 LEU 64 -17.016 3.020 0.809 510 HB3 LEU 64 HB1 LEU 64 -16.453 2.655 -0.812 511 HG LEU 64 HG LEU 64 -15.203 1.839 1.797 512 HD11 LEU 64 HD11 LEU 64 -16.531 0.402 -0.474 513 HD12 LEU 64 HD12 LEU 64 -16.896 0.331 1.251 514 HD13 LEU 64 HD13 LEU 64 -15.430 -0.426 0.627 515 HD21 LEU 64 HD21 LEU 64 -13.357 2.437 0.476 516 HD22 LEU 64 HD22 LEU 64 -14.078 1.762 -0.984 517 HD23 LEU 64 HD23 LEU 64 -13.520 0.690 0.301 518 H GLY 65 HN GLY 65 -14.629 5.639 -1.773 519 HA2 GLY 65 HA2 GLY 65 -15.927 6.660 -3.483 520 HA3 GLY 65 HA1 GLY 65 -17.336 6.548 -2.443 521 H LYS 66 HN LYS 66 -14.790 7.667 -0.619 522 HA LYS 66 HA LYS 66 -15.404 10.456 -1.284 523 HB2 LYS 66 HB2 LYS 66 -15.549 9.134 1.410 524 HB3 LYS 66 HB1 LYS 66 -15.325 10.871 1.247 525 HG2 LYS 66 HG2 LYS 66 -17.426 11.152 0.235 526 HG3 LYS 66 HG1 LYS 66 -17.602 9.425 -0.063 527 HD2 LYS 66 HD2 LYS 66 -17.749 9.030 2.352 528 HD3 LYS 66 HD1 LYS 66 -17.574 10.762 2.645 529 HE2 LYS 66 HE2 LYS 66 -19.826 9.439 1.126 530 HE3 LYS 66 HE1 LYS 66 -19.921 10.062 2.772 531 HZ1 LYS 66 HZ1 LYS 66 -19.418 12.275 1.895 532 HZ2 LYS 66 HZ2 LYS 66 -20.836 11.645 1.230 533 HZ3 LYS 66 HZ3 LYS 66 -19.412 11.655 0.322 534 H GLU 67 HN GLU 67 -13.767 11.867 -1.134 535 HA GLU 67 HA GLU 67 -11.108 10.903 -1.155 536 HB2 GLU 67 HB2 GLU 67 -11.822 12.905 -2.411 537 HB3 GLU 67 HB1 GLU 67 -12.116 13.751 -0.898 538 HG2 GLU 67 HG2 GLU 67 -9.714 13.506 -0.351 539 HG3 GLU 67 HG1 GLU 67 -9.462 12.785 -1.942 540 H ALA 68 HN ALA 68 -9.567 10.876 0.423 541 HA ALA 68 HA ALA 68 -10.233 12.055 3.013 542 HB1 ALA 68 HB1 ALA 68 -10.970 9.713 3.099 543 HB2 ALA 68 HB2 ALA 68 -9.648 10.038 4.221 544 HB3 ALA 68 HB3 ALA 68 -9.331 9.198 2.702 545 H ASP 69 HN ASP 69 -8.536 12.771 4.171 546 HA ASP 69 HA ASP 69 -6.003 12.904 2.781 547 HB2 ASP 69 HB2 ASP 69 -5.335 14.486 4.524 548 HB3 ASP 69 HB1 ASP 69 -6.901 14.940 3.863 549 H ILE 70 HN ILE 70 -4.503 11.471 3.045 550 HA ILE 70 HA ILE 70 -4.372 9.991 5.583 551 HB ILE 70 HB ILE 70 -3.306 8.143 4.160 552 HG12 ILE 70 HG12 ILE 70 -4.545 8.201 1.826 553 HG13 ILE 70 HG11 ILE 70 -4.383 9.943 2.045 554 HG21 ILE 70 HG21 ILE 70 -5.451 7.883 5.221 555 HG22 ILE 70 HG22 ILE 70 -5.505 7.187 3.602 556 HG23 ILE 70 HG23 ILE 70 -6.240 8.760 3.910 557 HD11 ILE 70 HD11 ILE 70 -2.141 7.923 2.021 558 HD12 ILE 70 HD12 ILE 70 -1.949 9.655 2.297 559 HD13 ILE 70 HD13 ILE 70 -2.538 9.070 0.740 560 H THR 71 HN THR 71 -2.113 8.990 5.887 561 HA THR 71 HA THR 71 -0.125 11.011 5.044 562 HB THR 71 HB THR 71 -0.064 9.651 7.719 563 HG1 THR 71 HG1 THR 71 -2.018 11.008 7.246 564 HG21 THR 71 HG21 THR 71 2.036 10.641 7.050 565 HG22 THR 71 HG22 THR 71 1.308 11.645 8.307 566 HG23 THR 71 HG23 THR 71 1.230 12.150 6.620 567 H THR 72 HN THR 72 1.591 10.218 4.057 568 HA THR 72 HA THR 72 1.986 7.363 3.941 569 HB THR 72 HB THR 72 2.291 8.645 1.893 570 HG1 THR 72 HG1 THR 72 4.470 7.893 1.417 571 HG21 THR 72 HG21 THR 72 4.440 10.063 1.767 572 HG22 THR 72 HG22 THR 72 4.314 10.139 3.525 573 HG23 THR 72 HG23 THR 72 3.010 10.774 2.519 574 H MET 73 HN MET 73 4.216 6.486 4.225 575 HA MET 73 HA MET 73 5.139 7.048 6.872 576 HB2 MET 73 HB2 MET 73 5.110 4.828 5.476 577 HB3 MET 73 HB1 MET 73 6.684 5.378 4.934 578 HG2 MET 73 HG2 MET 73 7.626 5.189 7.028 579 HG3 MET 73 HG1 MET 73 6.067 5.265 7.848 580 HE1 MET 73 HE1 MET 73 4.379 3.194 5.991 581 HE2 MET 73 HE2 MET 73 4.266 3.306 7.747 582 HE3 MET 73 HE3 MET 73 4.546 1.742 6.981 583 H ASP 74 HN ASP 74 5.834 8.305 3.842 584 HA ASP 74 HA ASP 74 8.576 8.989 4.275 585 HB2 ASP 74 HB2 ASP 74 8.300 9.085 2.032 586 HB3 ASP 74 HB1 ASP 74 6.569 9.349 2.165 587 H GLY 75 HN GLY 75 5.514 10.370 5.045 588 HA2 GLY 75 HA2 GLY 75 5.271 11.973 6.791 589 HA3 GLY 75 HA1 GLY 75 6.878 12.578 6.415 590 H LYS 76 HN LYS 76 3.890 12.046 4.563 591 HA LYS 76 HA LYS 76 3.727 14.878 3.958 592 HB2 LYS 76 HB2 LYS 76 4.986 13.137 2.170 593 HB3 LYS 76 HB1 LYS 76 3.366 13.340 1.522 594 HG2 LYS 76 HG2 LYS 76 4.144 15.911 2.190 595 HG3 LYS 76 HG1 LYS 76 5.601 15.171 1.529 596 HD2 LYS 76 HD2 LYS 76 4.133 14.384 -0.399 597 HD3 LYS 76 HD1 LYS 76 2.918 15.504 0.219 598 HE2 LYS 76 HE2 LYS 76 4.177 16.586 -1.520 599 HE3 LYS 76 HE1 LYS 76 4.573 17.333 0.027 600 HZ1 LYS 76 HZ1 LYS 76 6.564 16.960 -1.280 601 HZ2 LYS 76 HZ2 LYS 76 6.215 15.307 -1.404 602 HZ3 LYS 76 HZ3 LYS 76 6.591 15.982 0.100 603 H LYS 77 HN LYS 77 1.666 15.529 3.489 604 HA LYS 77 HA LYS 77 -0.427 13.596 4.063 605 HB2 LYS 77 HB2 LYS 77 -0.485 16.595 3.687 606 HB3 LYS 77 HB1 LYS 77 -1.906 15.619 4.031 607 HG2 LYS 77 HG2 LYS 77 0.505 15.860 5.822 608 HG3 LYS 77 HG1 LYS 77 -1.031 16.699 6.041 609 HD2 LYS 77 HD2 LYS 77 -2.130 14.437 6.105 610 HD3 LYS 77 HD1 LYS 77 -0.512 13.736 6.164 611 HE2 LYS 77 HE2 LYS 77 -1.376 13.902 8.404 612 HE3 LYS 77 HE1 LYS 77 -0.067 15.069 8.207 613 HZ1 LYS 77 HZ1 LYS 77 -1.778 16.778 7.790 614 HZ2 LYS 77 HZ2 LYS 77 -1.879 16.112 9.338 615 HZ3 LYS 77 HZ3 LYS 77 -2.980 15.642 8.147 616 H LEU 78 HN LEU 78 -1.450 12.558 2.513 617 HA LEU 78 HA LEU 78 -1.674 13.835 -0.135 618 HB2 LEU 78 HB2 LEU 78 -1.413 10.864 0.268 619 HB3 LEU 78 HB1 LEU 78 -1.306 11.759 -1.232 620 HG LEU 78 HG LEU 78 0.726 12.051 0.975 621 HD11 LEU 78 HD11 LEU 78 2.108 10.456 -0.104 622 HD12 LEU 78 HD12 LEU 78 0.994 10.309 -1.462 623 HD13 LEU 78 HD13 LEU 78 0.535 9.691 0.125 624 HD21 LEU 78 HD21 LEU 78 0.646 13.870 -0.650 625 HD22 LEU 78 HD22 LEU 78 0.795 12.712 -1.969 626 HD23 LEU 78 HD23 LEU 78 2.124 12.928 -0.831 627 H LYS 79 HN LYS 79 -3.573 13.342 -1.306 628 HA LYS 79 HA LYS 79 -5.767 12.402 0.403 629 HB2 LYS 79 HB2 LYS 79 -6.135 13.954 -2.146 630 HB3 LYS 79 HB1 LYS 79 -7.252 13.760 -0.808 631 HG2 LYS 79 HG2 LYS 79 -5.285 15.004 0.491 632 HG3 LYS 79 HG1 LYS 79 -4.996 15.637 -1.132 633 HD2 LYS 79 HD2 LYS 79 -6.493 17.176 -0.255 634 HD3 LYS 79 HD1 LYS 79 -7.552 16.073 -1.138 635 HE2 LYS 79 HE2 LYS 79 -7.827 14.820 1.038 636 HE3 LYS 79 HE1 LYS 79 -7.049 16.198 1.816 637 HZ1 LYS 79 HZ1 LYS 79 -9.505 16.398 0.146 638 HZ2 LYS 79 HZ2 LYS 79 -8.796 17.631 1.068 639 HZ3 LYS 79 HZ3 LYS 79 -9.507 16.307 1.837 640 H CYS 80 HN CYS 80 -6.378 10.405 0.024 641 HA CYS 80 HA CYS 80 -6.120 9.375 -2.724 642 HB2 CYS 80 HB2 CYS 80 -4.960 8.364 -0.507 643 HB3 CYS 80 HB1 CYS 80 -6.480 7.475 -0.477 644 H THR 81 HN THR 81 -8.058 9.523 -3.714 645 HA THR 81 HA THR 81 -10.511 9.209 -2.215 646 HB THR 81 HB THR 81 -10.280 9.381 -5.225 647 HG1 THR 81 HG1 THR 81 -9.268 11.224 -4.383 648 HG21 THR 81 HG21 THR 81 -12.468 8.769 -4.696 649 HG22 THR 81 HG22 THR 81 -12.566 10.531 -4.807 650 HG23 THR 81 HG23 THR 81 -12.489 9.747 -3.226 651 H VAL 82 HN VAL 82 -9.936 7.011 -1.517 652 HA VAL 82 HA VAL 82 -9.957 4.937 -3.517 653 HB VAL 82 HB VAL 82 -10.359 4.391 -0.601 654 HG11 VAL 82 HG11 VAL 82 -10.583 2.484 -1.940 655 HG12 VAL 82 HG12 VAL 82 -8.926 2.393 -1.337 656 HG13 VAL 82 HG13 VAL 82 -9.239 2.942 -2.989 657 HG21 VAL 82 HG21 VAL 82 -8.217 4.815 -0.018 658 HG22 VAL 82 HG22 VAL 82 -8.317 5.986 -1.333 659 HG23 VAL 82 HG23 VAL 82 -7.590 4.403 -1.612 660 H HIS 83 HN HIS 83 -11.679 4.081 -4.367 661 HA HIS 83 HA HIS 83 -14.176 4.146 -2.841 662 HB2 HIS 83 HB2 HIS 83 -15.370 4.779 -4.899 663 HB3 HIS 83 HB1 HIS 83 -14.234 6.029 -4.395 664 HD1 HIS 83 HD1 HIS 83 -11.674 5.382 -5.748 665 HD2 HIS 83 HD2 HIS 83 -15.325 4.656 -7.502 666 HE1 HIS 83 HE1 HIS 83 -11.192 5.033 -8.190 667 HE2 HIS 83 HE2 HIS 83 -13.462 4.858 -9.268 668 H LEU 84 HN LEU 84 -15.589 2.473 -3.316 669 HA LEU 84 HA LEU 84 -14.309 0.177 -4.478 670 HB2 LEU 84 HB2 LEU 84 -15.794 0.098 -2.428 671 HB3 LEU 84 HB1 LEU 84 -17.159 0.379 -3.498 672 HG LEU 84 HG LEU 84 -16.664 -2.024 -2.800 673 HD11 LEU 84 HD11 LEU 84 -16.900 -1.423 -5.720 674 HD12 LEU 84 HD12 LEU 84 -18.229 -1.481 -4.562 675 HD13 LEU 84 HD13 LEU 84 -17.321 -2.945 -4.935 676 HD21 LEU 84 HD21 LEU 84 -14.997 -3.246 -3.942 677 HD22 LEU 84 HD22 LEU 84 -14.221 -1.842 -3.209 678 HD23 LEU 84 HD23 LEU 84 -14.581 -1.850 -4.932 679 H ALA 85 HN ALA 85 -14.765 -0.700 -6.354 680 HA ALA 85 HA ALA 85 -16.812 0.471 -8.063 681 HB1 ALA 85 HB1 ALA 85 -15.200 0.839 -9.902 682 HB2 ALA 85 HB2 ALA 85 -13.884 0.453 -8.791 683 HB3 ALA 85 HB3 ALA 85 -14.887 1.874 -8.506 684 H ASN 86 HN ASN 86 -17.920 -1.344 -8.403 685 HA ASN 86 HA ASN 86 -18.501 -3.379 -9.204 686 HB2 ASN 86 HB2 ASN 86 -15.932 -3.220 -10.790 687 HB3 ASN 86 HB1 ASN 86 -17.319 -4.247 -11.139 688 HD21 ASN 86 HD21 ASN 86 -15.858 -1.265 -11.685 689 HD22 ASN 86 HD22 ASN 86 -17.168 -0.492 -12.507 690 H GLY 87 HN GLY 87 -16.957 -3.290 -6.772 691 HA2 GLY 87 HA2 GLY 87 -16.381 -5.030 -5.319 692 HA3 GLY 87 HA1 GLY 87 -16.168 -6.089 -6.703 693 H LYS 88 HN LYS 88 -14.600 -3.282 -7.361 694 HA LYS 88 HA LYS 88 -12.038 -4.343 -6.366 695 HB2 LYS 88 HB2 LYS 88 -12.079 -4.471 -8.748 696 HB3 LYS 88 HB1 LYS 88 -12.762 -2.862 -8.893 697 HG2 LYS 88 HG2 LYS 88 -10.650 -2.316 -9.413 698 HG3 LYS 88 HG1 LYS 88 -10.451 -2.268 -7.660 699 HD2 LYS 88 HD2 LYS 88 -9.410 -4.354 -7.602 700 HD3 LYS 88 HD1 LYS 88 -10.027 -4.811 -9.191 701 HE2 LYS 88 HE2 LYS 88 -8.281 -2.425 -9.077 702 HE3 LYS 88 HE1 LYS 88 -7.512 -3.979 -8.769 703 HZ1 LYS 88 HZ1 LYS 88 -7.364 -3.539 -11.075 704 HZ2 LYS 88 HZ2 LYS 88 -9.012 -3.167 -11.190 705 HZ3 LYS 88 HZ3 LYS 88 -8.524 -4.767 -10.889 706 H LEU 89 HN LEU 89 -10.847 -3.044 -5.077 707 HA LEU 89 HA LEU 89 -11.923 -0.435 -4.402 708 HB2 LEU 89 HB2 LEU 89 -10.971 -2.231 -2.775 709 HB3 LEU 89 HB1 LEU 89 -9.411 -1.586 -3.243 710 HG LEU 89 HG LEU 89 -9.814 0.478 -2.250 711 HD11 LEU 89 HD11 LEU 89 -11.929 1.065 -3.133 712 HD12 LEU 89 HD12 LEU 89 -12.115 1.068 -1.381 713 HD13 LEU 89 HD13 LEU 89 -12.722 -0.289 -2.329 714 HD21 LEU 89 HD21 LEU 89 -9.465 -1.212 -0.559 715 HD22 LEU 89 HD22 LEU 89 -11.190 -1.592 -0.547 716 HD23 LEU 89 HD23 LEU 89 -10.628 -0.023 0.025 717 H VAL 90 HN VAL 90 -11.104 1.480 -5.150 718 HA VAL 90 HA VAL 90 -8.421 1.432 -6.298 719 HB VAL 90 HB VAL 90 -9.629 0.996 -8.162 720 HG11 VAL 90 HG11 VAL 90 -11.715 2.154 -8.834 721 HG12 VAL 90 HG12 VAL 90 -11.729 2.858 -7.215 722 HG13 VAL 90 HG13 VAL 90 -11.830 1.112 -7.417 723 HG21 VAL 90 HG21 VAL 90 -9.446 3.983 -8.155 724 HG22 VAL 90 HG22 VAL 90 -9.600 2.979 -9.596 725 HG23 VAL 90 HG23 VAL 90 -8.156 2.863 -8.592 726 H CYS 91 HN CYS 91 -7.307 3.268 -6.287 727 HA CYS 91 HA CYS 91 -8.627 5.755 -5.479 728 HB2 CYS 91 HB2 CYS 91 -7.514 4.971 -3.460 729 HB3 CYS 91 HB1 CYS 91 -6.020 4.696 -4.348 730 H LYS 92 HN LYS 92 -8.567 6.471 -7.585 731 HA LYS 92 HA LYS 92 -5.973 6.536 -8.910 732 HB2 LYS 92 HB2 LYS 92 -7.893 5.794 -10.238 733 HB3 LYS 92 HB1 LYS 92 -8.732 7.305 -9.912 734 HG2 LYS 92 HG2 LYS 92 -7.163 8.542 -11.213 735 HG3 LYS 92 HG1 LYS 92 -6.106 7.139 -11.367 736 HD2 LYS 92 HD2 LYS 92 -7.244 7.301 -13.421 737 HD3 LYS 92 HD1 LYS 92 -8.027 5.989 -12.545 738 HE2 LYS 92 HE2 LYS 92 -9.838 7.466 -11.891 739 HE3 LYS 92 HE1 LYS 92 -9.040 8.825 -12.685 740 HZ1 LYS 92 HZ1 LYS 92 -10.206 6.415 -13.960 741 HZ2 LYS 92 HZ2 LYS 92 -9.212 7.500 -14.791 742 HZ3 LYS 92 HZ3 LYS 92 -10.691 8.023 -14.157 743 H SER 93 HN SER 93 -4.937 8.397 -9.522 744 HA SER 93 HA SER 93 -5.924 10.878 -8.290 745 HB2 SER 93 HB2 SER 93 -3.970 10.038 -7.091 746 HB3 SER 93 HB1 SER 93 -3.073 9.889 -8.600 747 HG SER 93 HG SER 93 -3.384 12.036 -7.004 748 H GLU 94 HN GLU 94 -4.527 12.779 -9.406 749 HA GLU 94 HA GLU 94 -5.351 12.738 -12.163 750 HB2 GLU 94 HB2 GLU 94 -4.415 15.080 -12.157 751 HB3 GLU 94 HB1 GLU 94 -5.693 14.776 -10.986 752 HG2 GLU 94 HG2 GLU 94 -4.070 14.584 -9.212 753 HG3 GLU 94 HG1 GLU 94 -2.746 14.779 -10.358 754 H LYS 95 HN LYS 95 -2.468 12.054 -10.454 755 HA LYS 95 HA LYS 95 -1.005 11.981 -13.016 756 HB2 LYS 95 HB2 LYS 95 -0.312 13.767 -11.279 757 HB3 LYS 95 HB1 LYS 95 0.371 12.413 -10.382 758 HG2 LYS 95 HG2 LYS 95 1.670 11.835 -12.449 759 HG3 LYS 95 HG1 LYS 95 1.113 13.357 -13.132 760 HD2 LYS 95 HD2 LYS 95 2.752 13.024 -10.619 761 HD3 LYS 95 HD1 LYS 95 3.342 13.601 -12.178 762 HE2 LYS 95 HE2 LYS 95 1.912 15.551 -12.029 763 HE3 LYS 95 HE1 LYS 95 1.215 14.956 -10.527 764 HZ1 LYS 95 HZ1 LYS 95 3.437 15.098 -9.525 765 HZ2 LYS 95 HZ2 LYS 95 2.866 16.605 -10.046 766 HZ3 LYS 95 HZ3 LYS 95 4.030 15.777 -10.954 767 H PHE 96 HN PHE 96 -2.070 10.265 -10.298 768 HA PHE 96 HA PHE 96 -0.352 8.002 -11.020 769 HB2 PHE 96 HB2 PHE 96 -1.122 8.478 -8.166 770 HB3 PHE 96 HB1 PHE 96 0.190 7.498 -8.807 771 HD1 PHE 96 HD2 PHE 96 2.263 8.550 -9.571 772 HD2 PHE 96 HD1 PHE 96 -0.863 10.819 -7.787 773 HE1 PHE 96 HE2 PHE 96 3.826 10.416 -9.217 774 HE2 PHE 96 HE1 PHE 96 0.689 12.691 -7.429 775 HZ PHE 96 HZ PHE 96 3.040 12.492 -8.145 776 H SER 97 HN SER 97 -1.235 5.949 -9.880 777 HA SER 97 HA SER 97 -4.069 5.916 -9.418 778 HB2 SER 97 HB2 SER 97 -3.887 3.911 -11.330 779 HB3 SER 97 HB1 SER 97 -4.677 5.473 -11.532 780 HG SER 97 HG SER 97 -2.062 4.693 -12.292 781 H HIS 98 HN HIS 98 -4.455 4.451 -7.900 782 HA HIS 98 HA HIS 98 -2.431 2.374 -7.444 783 HB2 HIS 98 HB2 HIS 98 -2.909 3.931 -5.565 784 HB3 HIS 98 HB1 HIS 98 -4.587 3.404 -5.575 785 HD2 HIS 98 HD2 HIS 98 -4.377 0.245 -5.406 786 HE1 HIS 98 HE1 HIS 98 -1.513 0.835 -2.359 787 HE2 HIS 98 HE2 HIS 98 -2.979 -0.857 -3.514 788 H GLU 99 HN GLU 99 -2.914 0.302 -7.800 789 HA GLU 99 HA GLU 99 -5.743 -0.386 -8.194 790 HB2 GLU 99 HB2 GLU 99 -4.817 -0.794 -10.270 791 HB3 GLU 99 HB1 GLU 99 -3.260 -1.250 -9.590 792 HG2 GLU 99 HG2 GLU 99 -3.964 -3.392 -9.070 793 HG3 GLU 99 HG1 GLU 99 -5.671 -2.964 -9.157 794 H GLN 100 HN GLN 100 -6.637 -1.903 -6.985 795 HA GLN 100 HA GLN 100 -4.932 -3.764 -5.495 796 HB2 GLN 100 HB2 GLN 100 -5.688 -1.674 -4.143 797 HB3 GLN 100 HB1 GLN 100 -7.276 -2.425 -4.166 798 HG2 GLN 100 HG2 GLN 100 -6.501 -4.314 -2.969 799 HG3 GLN 100 HG1 GLN 100 -4.822 -3.817 -3.152 800 HE21 GLN 100 HE21 GLN 100 -4.270 -3.614 -1.061 801 HE22 GLN 100 HE22 GLN 100 -4.995 -2.483 0.025 802 H GLU 101 HN GLU 101 -5.584 -5.666 -6.384 803 HA GLU 101 HA GLU 101 -8.490 -6.103 -6.643 804 HB2 GLU 101 HB2 GLU 101 -7.210 -5.971 -8.808 805 HB3 GLU 101 HB1 GLU 101 -6.355 -7.424 -8.318 806 HG2 GLU 101 HG2 GLU 101 -8.221 -8.761 -8.540 807 HG3 GLU 101 HG1 GLU 101 -9.336 -7.405 -8.385 808 H VAL 102 HN VAL 102 -9.343 -7.783 -5.604 809 HA VAL 102 HA VAL 102 -7.504 -9.650 -4.283 810 HB VAL 102 HB VAL 102 -10.352 -8.896 -3.597 811 HG11 VAL 102 HG11 VAL 102 -9.843 -11.310 -3.227 812 HG12 VAL 102 HG12 VAL 102 -10.249 -10.413 -1.762 813 HG13 VAL 102 HG13 VAL 102 -8.566 -10.811 -2.115 814 HG21 VAL 102 HG21 VAL 102 -9.411 -7.987 -1.568 815 HG22 VAL 102 HG22 VAL 102 -8.625 -7.257 -2.969 816 HG23 VAL 102 HG23 VAL 102 -7.798 -8.512 -2.048 817 H LYS 103 HN LYS 103 -7.349 -11.595 -5.136 818 HA LYS 103 HA LYS 103 -9.671 -12.703 -6.569 819 HB2 LYS 103 HB2 LYS 103 -7.149 -12.135 -7.610 820 HB3 LYS 103 HB1 LYS 103 -7.118 -13.868 -7.326 821 HG2 LYS 103 HG2 LYS 103 -7.879 -13.704 -9.502 822 HG3 LYS 103 HG1 LYS 103 -9.372 -13.889 -8.580 823 HD2 LYS 103 HD2 LYS 103 -9.910 -11.619 -8.780 824 HD3 LYS 103 HD1 LYS 103 -8.271 -11.185 -9.270 825 HE2 LYS 103 HE2 LYS 103 -8.577 -12.370 -11.380 826 HE3 LYS 103 HE1 LYS 103 -10.201 -12.845 -10.890 827 HZ1 LYS 103 HZ1 LYS 103 -9.325 -10.020 -11.165 828 HZ2 LYS 103 HZ2 LYS 103 -10.903 -10.597 -10.938 829 HZ3 LYS 103 HZ3 LYS 103 -10.103 -10.893 -12.395 830 H GLY 104 HN GLY 104 -10.511 -13.908 -4.932 831 HA2 GLY 104 HA2 GLY 104 -10.763 -15.834 -3.699 832 HA3 GLY 104 HA1 GLY 104 -9.228 -16.391 -4.352 833 H ASN 105 HN ASN 105 -7.442 -16.274 -3.145 834 HA ASN 105 HA ASN 105 -7.683 -15.021 -0.488 835 HB2 ASN 105 HB2 ASN 105 -7.427 -17.675 -0.965 836 HB3 ASN 105 HB1 ASN 105 -5.735 -17.216 -0.852 837 HD21 ASN 105 HD21 ASN 105 -4.865 -16.900 1.110 838 HD22 ASN 105 HD22 ASN 105 -5.752 -16.933 2.594 839 H GLU 106 HN GLU 106 -6.522 -14.255 -3.252 840 HA GLU 106 HA GLU 106 -3.900 -13.384 -2.226 841 HB2 GLU 106 HB2 GLU 106 -4.575 -14.026 -5.099 842 HB3 GLU 106 HB1 GLU 106 -3.005 -13.531 -4.483 843 HG2 GLU 106 HG2 GLU 106 -2.821 -15.594 -3.232 844 HG3 GLU 106 HG1 GLU 106 -4.425 -16.090 -3.770 845 H MET 107 HN MET 107 -3.401 -11.258 -2.504 846 HA MET 107 HA MET 107 -5.334 -9.604 -3.987 847 HB2 MET 107 HB2 MET 107 -5.656 -9.271 -1.577 848 HB3 MET 107 HB1 MET 107 -3.950 -8.895 -1.386 849 HG2 MET 107 HG2 MET 107 -4.189 -6.903 -2.718 850 HG3 MET 107 HG1 MET 107 -5.870 -7.303 -3.067 851 HE1 MET 107 HE1 MET 107 -3.533 -5.464 -0.278 852 HE2 MET 107 HE2 MET 107 -3.466 -7.221 -0.126 853 HE3 MET 107 HE3 MET 107 -4.284 -6.263 1.111 854 H VAL 108 HN VAL 108 -4.395 -8.626 -5.640 855 HA VAL 108 HA VAL 108 -1.496 -8.129 -5.459 856 HB VAL 108 HB VAL 108 -1.530 -8.142 -7.974 857 HG11 VAL 108 HG11 VAL 108 -1.369 -10.524 -8.141 858 HG12 VAL 108 HG12 VAL 108 -2.364 -10.738 -6.700 859 HG13 VAL 108 HG13 VAL 108 -0.755 -10.033 -6.563 860 HG21 VAL 108 HG21 VAL 108 -4.102 -7.883 -7.984 861 HG22 VAL 108 HG22 VAL 108 -4.117 -9.636 -7.779 862 HG23 VAL 108 HG23 VAL 108 -3.347 -8.920 -9.197 863 H GLU 109 HN GLU 109 -0.737 -6.131 -5.767 864 HA GLU 109 HA GLU 109 -2.687 -4.078 -6.560 865 HB2 GLU 109 HB2 GLU 109 -0.521 -3.916 -4.477 866 HB3 GLU 109 HB1 GLU 109 -1.291 -2.495 -5.181 867 HG2 GLU 109 HG2 GLU 109 -3.331 -2.954 -4.213 868 HG3 GLU 109 HG1 GLU 109 -2.916 -4.642 -3.888 869 H THR 110 HN THR 110 -1.955 -2.350 -7.715 870 HA THR 110 HA THR 110 0.770 -2.443 -8.781 871 HB THR 110 HB THR 110 -1.295 -1.770 -10.791 872 HG1 THR 110 HG1 THR 110 -2.249 -3.655 -10.813 873 HG21 THR 110 HG21 THR 110 1.129 -3.554 -10.902 874 HG22 THR 110 HG22 THR 110 1.148 -1.818 -11.213 875 HG23 THR 110 HG23 THR 110 0.236 -2.895 -12.272 876 H ILE 111 HN ILE 111 1.427 -0.598 -7.854 877 HA ILE 111 HA ILE 111 -0.248 1.812 -8.192 878 HB ILE 111 HB ILE 111 2.078 1.832 -6.328 879 HG12 ILE 111 HG12 ILE 111 -0.528 0.525 -5.533 880 HG13 ILE 111 HG11 ILE 111 0.909 -0.385 -5.983 881 HG21 ILE 111 HG21 ILE 111 0.654 3.804 -6.667 882 HG22 ILE 111 HG22 ILE 111 0.589 3.235 -5.001 883 HG23 ILE 111 HG23 ILE 111 -0.742 2.889 -6.104 884 HD11 ILE 111 HD11 ILE 111 0.733 1.555 -3.691 885 HD12 ILE 111 HD12 ILE 111 2.117 0.545 -4.114 886 HD13 ILE 111 HD13 ILE 111 0.616 -0.199 -3.563 887 H THR 112 HN THR 112 1.159 3.860 -8.414 888 HA THR 112 HA THR 112 3.763 3.437 -9.649 889 HB THR 112 HB THR 112 1.591 4.906 -11.152 890 HG1 THR 112 HG1 THR 112 2.285 2.244 -11.106 891 HG21 THR 112 HG21 THR 112 3.234 5.027 -12.931 892 HG22 THR 112 HG22 THR 112 4.387 4.103 -11.965 893 HG23 THR 112 HG23 THR 112 3.909 5.724 -11.455 894 H PHE 113 HN PHE 113 4.902 4.768 -8.361 895 HA PHE 113 HA PHE 113 4.113 7.585 -8.265 896 HB2 PHE 113 HB2 PHE 113 4.423 5.777 -5.906 897 HB3 PHE 113 HB1 PHE 113 4.995 7.434 -5.767 898 HD1 PHE 113 HD2 PHE 113 2.066 5.282 -6.139 899 HD2 PHE 113 HD1 PHE 113 3.449 9.286 -5.735 900 HE1 PHE 113 HE2 PHE 113 -0.227 6.018 -5.643 901 HE2 PHE 113 HE1 PHE 113 1.156 10.029 -5.232 902 HZ PHE 113 HZ PHE 113 -0.681 8.392 -5.179 903 H GLY 114 HN GLY 114 5.846 9.002 -8.103 904 HA2 GLY 114 HA2 GLY 114 8.015 9.708 -8.357 905 HA3 GLY 114 HA1 GLY 114 8.481 8.288 -7.436 906 H GLY 115 HN GLY 115 6.698 7.877 -10.373 907 HA2 GLY 115 HA2 GLY 115 7.376 7.283 -12.504 908 HA3 GLY 115 HA1 GLY 115 9.042 7.556 -12.019 909 H VAL 116 HN VAL 116 7.379 5.560 -9.840 910 HA VAL 116 HA VAL 116 8.428 3.158 -11.177 911 HB VAL 116 HB VAL 116 8.410 3.582 -8.193 912 HG11 VAL 116 HG11 VAL 116 9.914 1.610 -8.214 913 HG12 VAL 116 HG12 VAL 116 9.633 1.461 -9.948 914 HG13 VAL 116 HG13 VAL 116 8.294 1.265 -8.819 915 HG21 VAL 116 HG21 VAL 116 10.864 3.633 -9.926 916 HG22 VAL 116 HG22 VAL 116 10.701 4.111 -8.237 917 HG23 VAL 116 HG23 VAL 116 9.984 5.101 -9.511 918 H THR 117 HN THR 117 6.891 1.779 -11.649 919 HA THR 117 HA THR 117 4.310 1.888 -10.315 920 HB THR 117 HB THR 117 4.189 1.814 -12.685 921 HG1 THR 117 HG1 THR 117 3.607 -0.727 -11.544 922 HG21 THR 117 HG21 THR 117 6.409 0.052 -12.283 923 HG22 THR 117 HG22 THR 117 5.989 1.042 -13.689 924 HG23 THR 117 HG23 THR 117 5.284 -0.569 -13.500 925 H LEU 118 HN LEU 118 5.404 1.102 -8.379 926 HA LEU 118 HA LEU 118 6.476 -1.430 -8.070 927 HB2 LEU 118 HB2 LEU 118 6.645 0.187 -6.286 928 HB3 LEU 118 HB1 LEU 118 4.903 0.202 -6.077 929 HG LEU 118 HG LEU 118 4.901 -2.025 -5.185 930 HD11 LEU 118 HD11 LEU 118 6.369 -3.445 -6.085 931 HD12 LEU 118 HD12 LEU 118 7.503 -2.844 -4.876 932 HD13 LEU 118 HD13 LEU 118 7.501 -2.159 -6.506 933 HD21 LEU 118 HD21 LEU 118 6.156 -1.754 -3.179 934 HD22 LEU 118 HD22 LEU 118 5.576 -0.162 -3.669 935 HD23 LEU 118 HD23 LEU 118 7.259 -0.617 -3.950 936 H ILE 119 HN ILE 119 5.667 -3.300 -8.501 937 HA ILE 119 HA ILE 119 2.771 -3.725 -8.327 938 HB ILE 119 HB ILE 119 4.805 -5.559 -9.594 939 HG12 ILE 119 HG12 ILE 119 3.358 -3.165 -10.699 940 HG13 ILE 119 HG11 ILE 119 5.045 -3.625 -10.887 941 HG21 ILE 119 HG21 ILE 119 1.808 -5.332 -9.870 942 HG22 ILE 119 HG22 ILE 119 2.691 -6.611 -9.037 943 HG23 ILE 119 HG23 ILE 119 2.836 -6.433 -10.785 944 HD11 ILE 119 HD11 ILE 119 4.303 -5.496 -12.352 945 HD12 ILE 119 HD12 ILE 119 3.926 -3.895 -12.988 946 HD13 ILE 119 HD13 ILE 119 2.658 -4.868 -12.240 947 H ARG 120 HN ARG 120 1.985 -4.882 -6.654 948 HA ARG 120 HA ARG 120 3.906 -6.564 -5.191 949 HB2 ARG 120 HB2 ARG 120 1.932 -4.565 -4.134 950 HB3 ARG 120 HB1 ARG 120 2.441 -5.923 -3.141 951 HG2 ARG 120 HG2 ARG 120 4.640 -5.182 -3.024 952 HG3 ARG 120 HG1 ARG 120 4.457 -4.111 -4.414 953 HD2 ARG 120 HD2 ARG 120 4.529 -3.029 -2.097 954 HD3 ARG 120 HD1 ARG 120 3.225 -2.537 -3.177 955 HE ARG 120 HE ARG 120 2.948 -4.363 -0.879 956 HH11 ARG 120 HH11 ARG 120 1.569 -2.089 -3.165 957 HH12 ARG 120 HH12 ARG 120 -0.022 -2.140 -2.457 958 HH21 ARG 120 HH21 ARG 120 0.827 -4.409 0.051 959 HH22 ARG 120 HH22 ARG 120 -0.443 -3.469 -0.674 960 H ARG 121 HN ARG 121 3.297 -8.335 -4.296 961 HA ARG 121 HA ARG 121 0.677 -9.440 -5.043 962 HB2 ARG 121 HB2 ARG 121 3.444 -10.630 -4.954 963 HB3 ARG 121 HB1 ARG 121 2.021 -11.649 -4.845 964 HG2 ARG 121 HG2 ARG 121 2.928 -11.559 -7.097 965 HG3 ARG 121 HG1 ARG 121 1.295 -10.915 -7.024 966 HD2 ARG 121 HD2 ARG 121 3.186 -8.808 -6.646 967 HD3 ARG 121 HD1 ARG 121 3.594 -9.716 -8.101 968 HE ARG 121 HE ARG 121 1.142 -8.205 -7.608 969 HH11 ARG 121 HH11 ARG 121 3.038 -10.231 -9.751 970 HH12 ARG 121 HH12 ARG 121 2.054 -9.911 -11.143 971 HH21 ARG 121 HH21 ARG 121 -0.159 -7.775 -9.456 972 HH22 ARG 121 HH22 ARG 121 0.239 -8.526 -10.970 973 H SER 122 HN SER 122 -0.535 -10.001 -3.330 974 HA SER 122 HA SER 122 0.850 -10.587 -0.814 975 HB2 SER 122 HB2 SER 122 -0.090 -8.290 -0.786 976 HB3 SER 122 HB1 SER 122 -1.698 -8.969 -1.032 977 HG SER 122 HG SER 122 -1.059 -8.523 1.190 978 H LYS 123 HN LYS 123 -0.219 -11.945 0.626 979 HA LYS 123 HA LYS 123 -2.326 -13.620 -0.577 980 HB2 LYS 123 HB2 LYS 123 0.041 -14.421 1.112 981 HB3 LYS 123 HB1 LYS 123 -1.290 -15.499 0.719 982 HG2 LYS 123 HG2 LYS 123 -0.152 -14.255 -1.613 983 HG3 LYS 123 HG1 LYS 123 1.047 -15.152 -0.686 984 HD2 LYS 123 HD2 LYS 123 -0.454 -17.117 -0.727 985 HD3 LYS 123 HD1 LYS 123 -1.577 -16.205 -1.735 986 HE2 LYS 123 HE2 LYS 123 0.168 -15.960 -3.445 987 HE3 LYS 123 HE1 LYS 123 1.271 -16.896 -2.441 988 HZ1 LYS 123 HZ1 LYS 123 -0.493 -18.693 -2.547 989 HZ2 LYS 123 HZ2 LYS 123 0.410 -18.419 -3.950 990 HZ3 LYS 123 HZ3 LYS 123 -1.167 -17.814 -3.829 991 H ARG 124 HN ARG 124 -4.053 -14.080 0.723 992 HA ARG 124 HA ARG 124 -4.396 -12.537 3.086 993 HB2 ARG 124 HB2 ARG 124 -6.146 -13.624 1.385 994 HB3 ARG 124 HB1 ARG 124 -6.137 -14.891 2.601 995 HG2 ARG 124 HG2 ARG 124 -6.731 -13.265 4.318 996 HG3 ARG 124 HG1 ARG 124 -6.757 -11.990 3.098 997 HD2 ARG 124 HD2 ARG 124 -9.004 -12.717 3.521 998 HD3 ARG 124 HD1 ARG 124 -8.528 -13.228 1.905 999 HE ARG 124 HE ARG 124 -7.948 -15.408 3.341 1000 HH11 ARG 124 HH11 ARG 124 -10.810 -13.376 3.305 1001 HH12 ARG 124 HH12 ARG 124 -11.885 -14.675 3.707 1002 HH21 ARG 124 HH21 ARG 124 -9.378 -17.113 3.834 1003 HH22 ARG 124 HH22 ARG 124 -11.075 -16.797 3.997 1004 H VAL 125 HN VAL 125 -4.468 -13.179 5.217 1005 HA VAL 125 HA VAL 125 -3.558 -15.893 5.833 1006 HB VAL 125 HB VAL 125 -1.578 -14.343 5.764 1007 HG11 VAL 125 HG11 VAL 125 -1.268 -12.810 7.666 1008 HG12 VAL 125 HG12 VAL 125 -2.944 -13.091 8.136 1009 HG13 VAL 125 HG13 VAL 125 -2.579 -12.319 6.591 1010 HG21 VAL 125 HG21 VAL 125 -1.599 -16.424 7.078 1011 HG22 VAL 125 HG22 VAL 125 -2.176 -15.515 8.473 1012 HG23 VAL 125 HG23 VAL 125 -0.582 -15.176 7.801 Start of MODEL 7 1 H1 ALA 1 HT1 ALA 1 -13.076 -10.855 0.744 2 H2 ALA 1 HT2 ALA 1 -12.942 -10.115 -0.768 3 H3 ALA 1 HT3 ALA 1 -14.465 -10.460 -0.132 4 HA ALA 1 HA ALA 1 -13.969 -8.118 0.057 5 HB1 ALA 1 HB1 ALA 1 -13.957 -9.505 2.733 6 HB2 ALA 1 HB2 ALA 1 -15.389 -9.240 1.738 7 HB3 ALA 1 HB3 ALA 1 -14.507 -7.862 2.398 8 H PHE 2 HN PHE 2 -12.706 -6.448 1.076 9 HA PHE 2 HA PHE 2 -9.891 -7.004 1.023 10 HB2 PHE 2 HB2 PHE 2 -11.437 -4.511 1.728 11 HB3 PHE 2 HB1 PHE 2 -9.684 -4.577 1.630 12 HD1 PHE 2 HD1 PHE 2 -12.773 -5.080 -0.367 13 HD2 PHE 2 HD2 PHE 2 -8.604 -4.243 -0.416 14 HE1 PHE 2 HE1 PHE 2 -12.908 -4.588 -2.769 15 HE2 PHE 2 HE2 PHE 2 -8.727 -3.753 -2.819 16 HZ PHE 2 HZ PHE 2 -10.886 -3.919 -4.001 17 H SER 3 HN SER 3 -12.318 -6.597 3.485 18 HA SER 3 HA SER 3 -10.738 -6.033 5.711 19 HB2 SER 3 HB2 SER 3 -12.767 -7.532 6.749 20 HB3 SER 3 HB1 SER 3 -12.906 -5.827 6.317 21 HG SER 3 HG SER 3 -14.165 -6.336 4.704 22 H GLY 4 HN GLY 4 -9.198 -7.193 6.688 23 HA2 GLY 4 HA2 GLY 4 -9.183 -9.637 7.732 24 HA3 GLY 4 HA1 GLY 4 -8.888 -10.019 6.040 25 H THR 5 HN THR 5 -6.828 -10.843 6.503 26 HA THR 5 HA THR 5 -4.812 -8.753 6.930 27 HB THR 5 HB THR 5 -3.454 -10.524 8.144 28 HG1 THR 5 HG1 THR 5 -5.203 -12.154 7.469 29 HG21 THR 5 HG21 THR 5 -5.970 -9.559 9.508 30 HG22 THR 5 HG22 THR 5 -4.496 -8.609 9.295 31 HG23 THR 5 HG23 THR 5 -4.478 -10.052 10.309 32 H TRP 6 HN TRP 6 -3.598 -8.656 5.152 33 HA TRP 6 HA TRP 6 -3.189 -11.147 3.629 34 HB2 TRP 6 HB2 TRP 6 -2.817 -8.402 2.473 35 HB3 TRP 6 HB1 TRP 6 -3.118 -9.924 1.640 36 HD1 TRP 6 HD1 TRP 6 -4.978 -7.313 3.794 37 HE1 TRP 6 HE1 TRP 6 -7.484 -7.429 3.197 38 HE3 TRP 6 HE3 TRP 6 -4.885 -11.369 0.676 39 HZ2 TRP 6 HZ2 TRP 6 -9.185 -9.048 1.632 40 HZ3 TRP 6 HZ3 TRP 6 -6.998 -12.142 -0.320 41 HH2 TRP 6 HH2 TRP 6 -9.103 -11.006 0.147 42 H GLN 7 HN GLN 7 -1.227 -11.904 3.348 43 HA GLN 7 HA GLN 7 1.031 -10.306 4.312 44 HB2 GLN 7 HB2 GLN 7 0.371 -13.030 4.528 45 HB3 GLN 7 HB1 GLN 7 1.692 -12.984 3.374 46 HG2 GLN 7 HG2 GLN 7 1.763 -11.769 6.129 47 HG3 GLN 7 HG1 GLN 7 2.441 -13.334 5.688 48 HE21 GLN 7 HE21 GLN 7 3.711 -10.901 6.742 49 HE22 GLN 7 HE22 GLN 7 4.944 -10.475 5.602 50 H VAL 8 HN VAL 8 1.891 -9.062 2.802 51 HA VAL 8 HA VAL 8 1.581 -9.670 0.003 52 HB VAL 8 HB VAL 8 1.225 -7.395 0.774 53 HG11 VAL 8 HG11 VAL 8 2.800 -7.348 2.624 54 HG12 VAL 8 HG12 VAL 8 3.086 -6.004 1.521 55 HG13 VAL 8 HG13 VAL 8 4.149 -7.407 1.491 56 HG21 VAL 8 HG21 VAL 8 1.913 -7.716 -1.505 57 HG22 VAL 8 HG22 VAL 8 3.613 -7.689 -1.028 58 HG23 VAL 8 HG23 VAL 8 2.624 -6.235 -0.866 59 H TYR 9 HN TYR 9 3.102 -10.102 -1.486 60 HA TYR 9 HA TYR 9 5.908 -10.303 -0.695 61 HB2 TYR 9 HB2 TYR 9 6.145 -12.551 -1.656 62 HB3 TYR 9 HB1 TYR 9 5.015 -12.570 -0.311 63 HD1 TYR 9 HD2 TYR 9 2.509 -12.615 -0.857 64 HD2 TYR 9 HD1 TYR 9 5.521 -13.359 -3.771 65 HE1 TYR 9 HE2 TYR 9 0.844 -13.721 -2.292 66 HE2 TYR 9 HE1 TYR 9 3.862 -14.478 -5.209 67 HH TYR 9 HH TYR 9 0.539 -14.230 -4.722 68 H ALA 10 HN ALA 10 7.274 -9.732 -2.342 69 HA ALA 10 HA ALA 10 6.513 -9.809 -5.086 70 HB1 ALA 10 HB1 ALA 10 5.149 -7.888 -4.161 71 HB2 ALA 10 HB2 ALA 10 6.168 -7.524 -5.556 72 HB3 ALA 10 HB3 ALA 10 6.677 -7.032 -3.939 73 H GLN 11 HN GLN 11 8.207 -9.272 -6.490 74 HA GLN 11 HA GLN 11 10.728 -8.438 -5.246 75 HB2 GLN 11 HB2 GLN 11 10.469 -10.703 -7.239 76 HB3 GLN 11 HB1 GLN 11 11.974 -10.098 -6.568 77 HG2 GLN 11 HG2 GLN 11 11.655 -11.959 -5.300 78 HG3 GLN 11 HG1 GLN 11 10.853 -10.753 -4.295 79 HE21 GLN 11 HE21 GLN 11 9.593 -12.352 -3.331 80 HE22 GLN 11 HE22 GLN 11 8.260 -13.079 -4.155 81 H GLU 12 HN GLU 12 8.652 -7.191 -6.870 82 HA GLU 12 HA GLU 12 10.268 -6.421 -9.196 83 HB2 GLU 12 HB2 GLU 12 7.274 -6.485 -8.908 84 HB3 GLU 12 HB1 GLU 12 8.105 -5.727 -10.250 85 HG2 GLU 12 HG2 GLU 12 7.822 -7.709 -11.244 86 HG3 GLU 12 HG1 GLU 12 9.233 -8.178 -10.299 87 H ASN 13 HN ASN 13 10.249 -4.305 -9.804 88 HA ASN 13 HA ASN 13 11.100 -2.241 -8.940 89 HB2 ASN 13 HB2 ASN 13 8.130 -1.846 -9.243 90 HB3 ASN 13 HB1 ASN 13 9.405 -0.665 -9.523 91 HD21 ASN 13 HD21 ASN 13 7.237 -2.294 -11.086 92 HD22 ASN 13 HD22 ASN 13 8.062 -2.686 -12.555 93 H TYR 14 HN TYR 14 11.316 -3.346 -6.645 94 HA TYR 14 HA TYR 14 9.550 -1.967 -4.755 95 HB2 TYR 14 HB2 TYR 14 9.750 -4.422 -4.543 96 HB3 TYR 14 HB1 TYR 14 11.484 -4.247 -4.299 97 HD1 TYR 14 HD1 TYR 14 12.336 -3.189 -2.232 98 HD2 TYR 14 HD2 TYR 14 8.210 -4.067 -2.761 99 HE1 TYR 14 HE1 TYR 14 11.988 -2.963 0.181 100 HE2 TYR 14 HE2 TYR 14 7.847 -3.837 -0.338 101 HH TYR 14 HH TYR 14 9.657 -4.150 1.816 102 H GLU 15 HN GLU 15 13.010 -2.855 -4.965 103 HA GLU 15 HA GLU 15 13.785 -0.929 -3.048 104 HB2 GLU 15 HB2 GLU 15 16.062 -1.403 -3.636 105 HB3 GLU 15 HB1 GLU 15 15.164 -2.908 -3.633 106 HG2 GLU 15 HG2 GLU 15 15.146 -3.012 -5.997 107 HG3 GLU 15 HG1 GLU 15 15.738 -1.358 -6.140 108 H GLU 16 HN GLU 16 13.292 -0.750 -6.478 109 HA GLU 16 HA GLU 16 14.655 1.743 -6.834 110 HB2 GLU 16 HB2 GLU 16 12.780 0.112 -8.516 111 HB3 GLU 16 HB1 GLU 16 13.232 1.740 -9.006 112 HG2 GLU 16 HG2 GLU 16 15.621 1.023 -8.852 113 HG3 GLU 16 HG1 GLU 16 15.043 -0.623 -8.600 114 H PHE 17 HN PHE 17 11.422 0.742 -6.021 115 HA PHE 17 HA PHE 17 10.176 3.262 -6.458 116 HB2 PHE 17 HB2 PHE 17 8.856 1.217 -6.433 117 HB3 PHE 17 HB1 PHE 17 9.335 0.891 -4.773 118 HD1 PHE 17 HD2 PHE 17 8.186 4.085 -6.311 119 HD2 PHE 17 HD1 PHE 17 7.366 0.930 -3.577 120 HE1 PHE 17 HE2 PHE 17 6.192 5.284 -5.524 121 HE2 PHE 17 HE1 PHE 17 5.369 2.123 -2.783 122 HZ PHE 17 HZ PHE 17 4.777 4.306 -3.759 123 H LEU 18 HN LEU 18 11.735 1.695 -3.732 124 HA LEU 18 HA LEU 18 10.960 3.498 -1.740 125 HB2 LEU 18 HB2 LEU 18 13.600 2.053 -1.850 126 HB3 LEU 18 HB1 LEU 18 12.775 2.663 -0.428 127 HG LEU 18 HG LEU 18 12.039 0.278 -2.108 128 HD11 LEU 18 HD11 LEU 18 13.729 0.077 -0.282 129 HD12 LEU 18 HD12 LEU 18 12.300 -0.931 -0.076 130 HD13 LEU 18 HD13 LEU 18 12.473 0.554 0.856 131 HD21 LEU 18 HD21 LEU 18 10.393 1.583 0.054 132 HD22 LEU 18 HD22 LEU 18 10.052 0.040 -0.727 133 HD23 LEU 18 HD23 LEU 18 9.994 1.532 -1.664 134 H LYS 19 HN LYS 19 13.595 3.615 -4.074 135 HA LYS 19 HA LYS 19 14.875 5.884 -2.931 136 HB2 LYS 19 HB2 LYS 19 15.050 5.224 -5.852 137 HB3 LYS 19 HB1 LYS 19 16.292 5.864 -4.789 138 HG2 LYS 19 HG2 LYS 19 15.769 3.426 -3.668 139 HG3 LYS 19 HG1 LYS 19 15.575 3.103 -5.389 140 HD2 LYS 19 HD2 LYS 19 17.782 3.951 -5.839 141 HD3 LYS 19 HD1 LYS 19 17.974 4.438 -4.151 142 HE2 LYS 19 HE2 LYS 19 17.677 2.028 -3.525 143 HE3 LYS 19 HE1 LYS 19 17.742 1.640 -5.244 144 HZ1 LYS 19 HZ1 LYS 19 19.903 1.342 -4.357 145 HZ2 LYS 19 HZ2 LYS 19 19.884 2.858 -3.592 146 HZ3 LYS 19 HZ3 LYS 19 19.952 2.760 -5.284 147 H ALA 20 HN ALA 20 12.208 5.414 -5.114 148 HA ALA 20 HA ALA 20 12.176 8.091 -6.109 149 HB1 ALA 20 HB1 ALA 20 11.206 6.103 -7.289 150 HB2 ALA 20 HB2 ALA 20 10.156 7.517 -7.208 151 HB3 ALA 20 HB3 ALA 20 9.882 6.153 -6.125 152 H LEU 21 HN LEU 21 11.184 6.625 -3.227 153 HA LEU 21 HA LEU 21 9.231 8.708 -2.606 154 HB2 LEU 21 HB2 LEU 21 10.135 6.374 -0.924 155 HB3 LEU 21 HB1 LEU 21 8.755 7.410 -0.613 156 HG LEU 21 HG LEU 21 8.931 5.783 -3.133 157 HD11 LEU 21 HD11 LEU 21 7.785 4.888 -0.495 158 HD12 LEU 21 HD12 LEU 21 9.251 4.257 -1.242 159 HD13 LEU 21 HD13 LEU 21 7.691 4.017 -2.025 160 HD21 LEU 21 HD21 LEU 21 6.541 6.014 -3.129 161 HD22 LEU 21 HD22 LEU 21 7.258 7.612 -2.924 162 HD23 LEU 21 HD23 LEU 21 6.573 6.768 -1.537 163 H ALA 22 HN ALA 22 12.372 8.696 -2.734 164 HA ALA 22 HA ALA 22 14.079 9.856 -1.799 165 HB1 ALA 22 HB1 ALA 22 12.521 11.731 -1.949 166 HB2 ALA 22 HB2 ALA 22 13.552 11.869 -0.527 167 HB3 ALA 22 HB3 ALA 22 11.882 11.334 -0.356 168 H LEU 23 HN LEU 23 13.175 7.407 -0.593 169 HA LEU 23 HA LEU 23 13.411 7.729 2.266 170 HB2 LEU 23 HB2 LEU 23 13.238 5.316 0.471 171 HB3 LEU 23 HB1 LEU 23 13.421 5.190 2.210 172 HG LEU 23 HG LEU 23 11.136 6.682 0.930 173 HD11 LEU 23 HD11 LEU 23 11.142 4.335 0.193 174 HD12 LEU 23 HD12 LEU 23 9.776 4.722 1.240 175 HD13 LEU 23 HD13 LEU 23 11.155 3.827 1.881 176 HD21 LEU 23 HD21 LEU 23 11.405 7.320 3.188 177 HD22 LEU 23 HD22 LEU 23 11.718 5.663 3.699 178 HD23 LEU 23 HD23 LEU 23 10.100 6.135 3.175 179 HA PRO 24 HA PRO 24 17.764 7.331 2.719 180 HB2 PRO 24 HB2 PRO 24 17.529 5.428 4.924 181 HB3 PRO 24 HB1 PRO 24 17.998 7.135 4.971 182 HG2 PRO 24 HG2 PRO 24 15.678 6.232 6.002 183 HG3 PRO 24 HG1 PRO 24 15.879 7.865 5.332 184 HD2 PRO 24 HD2 PRO 24 14.616 5.458 4.091 185 HD3 PRO 24 HD1 PRO 24 14.110 7.157 4.032 186 H GLU 25 HN GLU 25 19.321 6.195 1.767 187 HA GLU 25 HA GLU 25 18.875 3.815 0.408 188 HB2 GLU 25 HB2 GLU 25 21.405 5.202 1.250 189 HB3 GLU 25 HB1 GLU 25 21.427 3.723 0.300 190 HG2 GLU 25 HG2 GLU 25 20.136 6.324 -0.480 191 HG3 GLU 25 HG1 GLU 25 21.631 5.656 -1.133 192 H ASP 26 HN ASP 26 20.156 4.314 3.655 193 HA ASP 26 HA ASP 26 21.074 1.651 4.014 194 HB2 ASP 26 HB2 ASP 26 21.269 2.167 6.353 195 HB3 ASP 26 HB1 ASP 26 21.788 3.575 5.441 196 H LEU 27 HN LEU 27 18.006 3.236 4.473 197 HA LEU 27 HA LEU 27 16.738 1.094 5.865 198 HB2 LEU 27 HB2 LEU 27 15.894 3.338 6.083 199 HB3 LEU 27 HB1 LEU 27 15.694 3.484 4.348 200 HG LEU 27 HG LEU 27 14.161 1.262 5.365 201 HD11 LEU 27 HD11 LEU 27 14.195 2.606 7.422 202 HD12 LEU 27 HD12 LEU 27 12.589 2.478 6.712 203 HD13 LEU 27 HD13 LEU 27 13.524 3.964 6.518 204 HD21 LEU 27 HD21 LEU 27 13.303 3.852 4.087 205 HD22 LEU 27 HD22 LEU 27 12.389 2.346 4.162 206 HD23 LEU 27 HD23 LEU 27 13.863 2.433 3.202 207 H ILE 28 HN ILE 28 17.001 2.126 2.535 208 HA ILE 28 HA ILE 28 15.141 0.368 1.375 209 HB ILE 28 HB ILE 28 17.591 1.689 0.202 210 HG12 ILE 28 HG12 ILE 28 14.684 2.477 0.025 211 HG13 ILE 28 HG11 ILE 28 15.796 3.129 1.217 212 HG21 ILE 28 HG21 ILE 28 15.404 0.110 -1.097 213 HG22 ILE 28 HG22 ILE 28 17.143 0.051 -1.374 214 HG23 ILE 28 HG23 ILE 28 16.203 1.420 -1.966 215 HD11 ILE 28 HD11 ILE 28 17.203 3.741 -0.907 216 HD12 ILE 28 HD12 ILE 28 15.871 4.757 -0.351 217 HD13 ILE 28 HD13 ILE 28 15.626 3.637 -1.692 218 H LYS 29 HN LYS 29 18.413 -0.088 2.445 219 HA LYS 29 HA LYS 29 18.861 -2.503 0.963 220 HB2 LYS 29 HB2 LYS 29 20.310 -1.139 3.208 221 HB3 LYS 29 HB1 LYS 29 20.802 -2.724 2.627 222 HG2 LYS 29 HG2 LYS 29 21.122 -1.791 0.385 223 HG3 LYS 29 HG1 LYS 29 20.645 -0.202 0.986 224 HD2 LYS 29 HD2 LYS 29 22.534 -0.378 2.633 225 HD3 LYS 29 HD1 LYS 29 23.065 -1.815 1.758 226 HE2 LYS 29 HE2 LYS 29 24.304 0.079 0.958 227 HE3 LYS 29 HE1 LYS 29 23.196 -0.451 -0.304 228 HZ1 LYS 29 HZ1 LYS 29 21.713 1.329 0.236 229 HZ2 LYS 29 HZ2 LYS 29 23.259 1.969 -0.024 230 HZ3 LYS 29 HZ3 LYS 29 22.669 1.798 1.551 231 H MET 30 HN MET 30 17.116 -1.775 3.808 232 HA MET 30 HA MET 30 17.392 -4.521 4.817 233 HB2 MET 30 HB2 MET 30 15.665 -2.389 6.041 234 HB3 MET 30 HB1 MET 30 16.383 -3.785 6.825 235 HG2 MET 30 HG2 MET 30 18.579 -2.764 6.659 236 HG3 MET 30 HG1 MET 30 17.878 -1.389 5.808 237 HE1 MET 30 HE1 MET 30 19.121 0.058 7.311 238 HE2 MET 30 HE2 MET 30 19.637 -0.878 8.712 239 HE3 MET 30 HE3 MET 30 18.612 0.537 8.929 240 H ALA 31 HN ALA 31 15.019 -2.216 3.644 241 HA ALA 31 HA ALA 31 12.717 -3.772 3.878 242 HB1 ALA 31 HB1 ALA 31 11.698 -2.211 2.364 243 HB2 ALA 31 HB2 ALA 31 13.285 -1.653 1.826 244 HB3 ALA 31 HB3 ALA 31 12.760 -1.355 3.484 245 H ARG 32 HN ARG 32 15.257 -3.898 1.531 246 HA ARG 32 HA ARG 32 14.067 -4.920 -0.713 247 HB2 ARG 32 HB2 ARG 32 16.195 -5.990 -1.236 248 HB3 ARG 32 HB1 ARG 32 16.447 -4.384 -0.573 249 HG2 ARG 32 HG2 ARG 32 17.246 -5.202 1.459 250 HG3 ARG 32 HG1 ARG 32 16.569 -6.809 1.179 251 HD2 ARG 32 HD2 ARG 32 18.337 -6.267 -0.953 252 HD3 ARG 32 HD1 ARG 32 19.164 -5.801 0.535 253 HE ARG 32 HE ARG 32 17.874 -8.415 0.550 254 HH11 ARG 32 HH11 ARG 32 20.820 -6.579 0.093 255 HH12 ARG 32 HH12 ARG 32 21.864 -7.941 0.327 256 HH21 ARG 32 HH21 ARG 32 19.243 -10.211 0.886 257 HH22 ARG 32 HH22 ARG 32 20.967 -10.012 0.798 258 H ASP 33 HN ASP 33 14.658 -6.618 2.306 259 HA ASP 33 HA ASP 33 13.458 -9.015 1.079 260 HB2 ASP 33 HB2 ASP 33 15.754 -8.686 2.899 261 HB3 ASP 33 HB1 ASP 33 14.661 -10.011 3.287 262 H ILE 34 HN ILE 34 12.474 -6.546 2.757 263 HA ILE 34 HA ILE 34 11.138 -8.078 4.863 264 HB ILE 34 HB ILE 34 11.483 -5.110 4.499 265 HG12 ILE 34 HG12 ILE 34 12.727 -7.235 6.165 266 HG13 ILE 34 HG11 ILE 34 13.456 -5.818 5.427 267 HG21 ILE 34 HG21 ILE 34 9.470 -4.990 5.517 268 HG22 ILE 34 HG22 ILE 34 10.438 -5.289 6.961 269 HG23 ILE 34 HG23 ILE 34 9.581 -6.621 6.181 270 HD11 ILE 34 HD11 ILE 34 12.414 -4.427 7.173 271 HD12 ILE 34 HD12 ILE 34 13.550 -5.618 7.806 272 HD13 ILE 34 HD13 ILE 34 11.812 -5.896 7.939 273 H LYS 35 HN LYS 35 9.205 -8.763 4.534 274 HA LYS 35 HA LYS 35 7.362 -7.186 2.883 275 HB2 LYS 35 HB2 LYS 35 6.310 -9.420 2.259 276 HB3 LYS 35 HB1 LYS 35 7.852 -9.053 1.505 277 HG2 LYS 35 HG2 LYS 35 8.999 -10.559 2.948 278 HG3 LYS 35 HG1 LYS 35 7.563 -10.781 3.949 279 HD2 LYS 35 HD2 LYS 35 6.523 -11.531 1.625 280 HD3 LYS 35 HD1 LYS 35 8.212 -11.896 1.275 281 HE2 LYS 35 HE2 LYS 35 6.956 -13.825 2.199 282 HE3 LYS 35 HE1 LYS 35 8.354 -13.363 3.168 283 HZ1 LYS 35 HZ1 LYS 35 6.944 -12.304 4.744 284 HZ2 LYS 35 HZ2 LYS 35 6.313 -13.846 4.465 285 HZ3 LYS 35 HZ3 LYS 35 5.579 -12.494 3.760 286 HA PRO 36 HA PRO 36 5.673 -7.675 7.123 287 HB2 PRO 36 HB2 PRO 36 4.460 -5.075 6.633 288 HB3 PRO 36 HB1 PRO 36 5.662 -5.525 7.854 289 HG2 PRO 36 HG2 PRO 36 6.210 -3.895 5.762 290 HG3 PRO 36 HG1 PRO 36 7.420 -4.926 6.552 291 HD2 PRO 36 HD2 PRO 36 5.973 -5.352 3.977 292 HD3 PRO 36 HD1 PRO 36 7.656 -5.724 4.405 293 H ILE 37 HN ILE 37 3.525 -7.871 7.865 294 HA ILE 37 HA ILE 37 1.680 -8.525 5.736 295 HB ILE 37 HB ILE 37 2.001 -10.030 7.706 296 HG12 ILE 37 HG12 ILE 37 -0.192 -9.626 6.209 297 HG13 ILE 37 HG11 ILE 37 -0.106 -10.849 7.470 298 HG21 ILE 37 HG21 ILE 37 0.547 -7.853 9.194 299 HG22 ILE 37 HG22 ILE 37 2.204 -8.394 9.470 300 HG23 ILE 37 HG23 ILE 37 0.853 -9.477 9.810 301 HD11 ILE 37 HD11 ILE 37 -1.115 -8.110 8.098 302 HD12 ILE 37 HD12 ILE 37 -1.438 -9.637 8.920 303 HD13 ILE 37 HD13 ILE 37 -2.165 -9.309 7.344 304 H VAL 38 HN VAL 38 -0.185 -7.477 5.276 305 HA VAL 38 HA VAL 38 -0.426 -4.801 6.477 306 HB VAL 38 HB VAL 38 -1.820 -5.844 4.000 307 HG11 VAL 38 HG11 VAL 38 -2.207 -3.482 3.526 308 HG12 VAL 38 HG12 VAL 38 -1.368 -3.034 5.008 309 HG13 VAL 38 HG13 VAL 38 -2.894 -3.915 5.091 310 HG21 VAL 38 HG21 VAL 38 0.709 -4.209 4.212 311 HG22 VAL 38 HG22 VAL 38 -0.137 -4.608 2.718 312 HG23 VAL 38 HG23 VAL 38 0.605 -5.885 3.681 313 H GLU 39 HN GLU 39 -1.725 -4.783 8.204 314 HA GLU 39 HA GLU 39 -4.036 -6.537 8.330 315 HB2 GLU 39 HB2 GLU 39 -2.589 -4.774 10.257 316 HB3 GLU 39 HB1 GLU 39 -4.288 -5.106 10.563 317 HG2 GLU 39 HG2 GLU 39 -3.934 -7.290 11.032 318 HG3 GLU 39 HG1 GLU 39 -2.567 -7.416 9.929 319 H ILE 40 HN ILE 40 -6.020 -5.933 7.773 320 HA ILE 40 HA ILE 40 -6.651 -3.077 7.696 321 HB ILE 40 HB ILE 40 -5.954 -3.654 5.434 322 HG12 ILE 40 HG12 ILE 40 -8.065 -2.160 6.001 323 HG13 ILE 40 HG11 ILE 40 -7.632 -2.519 4.340 324 HG21 ILE 40 HG21 ILE 40 -6.374 -6.018 5.412 325 HG22 ILE 40 HG22 ILE 40 -7.245 -5.265 4.073 326 HG23 ILE 40 HG23 ILE 40 -8.115 -5.753 5.528 327 HD11 ILE 40 HD11 ILE 40 -10.063 -2.704 4.916 328 HD12 ILE 40 HD12 ILE 40 -9.642 -4.124 5.872 329 HD13 ILE 40 HD13 ILE 40 -9.350 -4.115 4.131 330 H GLN 41 HN GLN 41 -8.557 -2.588 8.466 331 HA GLN 41 HA GLN 41 -10.580 -4.697 8.726 332 HB2 GLN 41 HB2 GLN 41 -11.214 -3.746 10.917 333 HB3 GLN 41 HB1 GLN 41 -9.572 -4.369 10.919 334 HG2 GLN 41 HG2 GLN 41 -9.795 -1.527 10.253 335 HG3 GLN 41 HG1 GLN 41 -10.330 -1.943 11.879 336 HE21 GLN 41 HE21 GLN 41 -8.617 -0.853 12.816 337 HE22 GLN 41 HE22 GLN 41 -7.000 -1.466 12.780 338 H GLN 42 HN GLN 42 -12.624 -4.106 8.148 339 HA GLN 42 HA GLN 42 -13.003 -1.263 7.492 340 HB2 GLN 42 HB2 GLN 42 -13.893 -1.736 5.459 341 HB3 GLN 42 HB1 GLN 42 -12.894 -3.172 5.616 342 HG2 GLN 42 HG2 GLN 42 -14.837 -4.395 6.479 343 HG3 GLN 42 HG1 GLN 42 -15.823 -2.960 6.249 344 HE21 GLN 42 HE21 GLN 42 -16.570 -2.463 4.259 345 HE22 GLN 42 HE22 GLN 42 -16.323 -3.448 2.864 346 H LYS 43 HN LYS 43 -15.235 -0.565 7.418 347 HA LYS 43 HA LYS 43 -17.130 -2.001 9.111 348 HB2 LYS 43 HB2 LYS 43 -16.478 0.908 9.623 349 HB3 LYS 43 HB1 LYS 43 -17.542 -0.125 10.563 350 HG2 LYS 43 HG2 LYS 43 -15.841 -1.055 11.724 351 HG3 LYS 43 HG1 LYS 43 -14.714 -0.970 10.369 352 HD2 LYS 43 HD2 LYS 43 -15.640 1.451 11.909 353 HD3 LYS 43 HD1 LYS 43 -14.181 0.545 12.315 354 HE2 LYS 43 HE2 LYS 43 -13.199 1.051 10.184 355 HE3 LYS 43 HE1 LYS 43 -14.701 1.758 9.602 356 HZ1 LYS 43 HZ1 LYS 43 -12.767 2.856 11.533 357 HZ2 LYS 43 HZ2 LYS 43 -14.377 3.365 11.566 358 HZ3 LYS 43 HZ3 LYS 43 -13.452 3.596 10.163 359 H GLY 44 HN GLY 44 -18.059 -2.248 6.968 360 HA2 GLY 44 HA2 GLY 44 -19.806 -1.684 5.560 361 HA3 GLY 44 HA1 GLY 44 -19.910 -0.124 6.370 362 H ASP 45 HN ASP 45 -18.808 1.632 5.544 363 HA ASP 45 HA ASP 45 -17.577 1.202 2.901 364 HB2 ASP 45 HB2 ASP 45 -18.861 3.683 4.055 365 HB3 ASP 45 HB1 ASP 45 -18.053 3.611 2.498 366 H ASP 46 HN ASP 46 -17.037 2.357 6.097 367 HA ASP 46 HA ASP 46 -14.641 3.827 5.372 368 HB2 ASP 46 HB2 ASP 46 -16.247 4.501 7.245 369 HB3 ASP 46 HB1 ASP 46 -15.526 3.194 8.173 370 H PHE 47 HN PHE 47 -12.638 3.119 5.485 371 HA PHE 47 HA PHE 47 -12.153 0.430 6.601 372 HB2 PHE 47 HB2 PHE 47 -10.990 1.767 4.155 373 HB3 PHE 47 HB1 PHE 47 -10.266 0.347 4.893 374 HD1 PHE 47 HD1 PHE 47 -13.828 1.199 4.179 375 HD2 PHE 47 HD2 PHE 47 -10.535 -1.377 3.444 376 HE1 PHE 47 HE1 PHE 47 -15.264 -0.229 2.783 377 HE2 PHE 47 HE2 PHE 47 -11.961 -2.808 2.050 378 HZ PHE 47 HZ PHE 47 -14.329 -2.242 1.716 379 H VAL 48 HN VAL 48 -10.106 0.073 7.537 380 HA VAL 48 HA VAL 48 -8.472 2.447 8.066 381 HB VAL 48 HB VAL 48 -9.455 0.518 10.183 382 HG11 VAL 48 HG11 VAL 48 -7.294 2.608 10.305 383 HG12 VAL 48 HG12 VAL 48 -7.155 0.882 10.647 384 HG13 VAL 48 HG13 VAL 48 -8.074 1.924 11.732 385 HG21 VAL 48 HG21 VAL 48 -9.797 3.490 9.804 386 HG22 VAL 48 HG22 VAL 48 -10.233 2.620 11.272 387 HG23 VAL 48 HG23 VAL 48 -11.056 2.256 9.756 388 H VAL 49 HN VAL 49 -6.710 1.924 7.016 389 HA VAL 49 HA VAL 49 -5.744 -0.833 7.038 390 HB VAL 49 HB VAL 49 -4.887 1.573 5.424 391 HG11 VAL 49 HG11 VAL 49 -2.970 0.074 5.964 392 HG12 VAL 49 HG12 VAL 49 -3.342 0.166 4.243 393 HG13 VAL 49 HG13 VAL 49 -3.838 -1.244 5.178 394 HG21 VAL 49 HG21 VAL 49 -6.090 -1.012 4.473 395 HG22 VAL 49 HG22 VAL 49 -5.901 0.495 3.577 396 HG23 VAL 49 HG23 VAL 49 -7.061 0.395 4.902 397 H THR 50 HN THR 50 -4.041 -1.492 8.159 398 HA THR 50 HA THR 50 -2.475 0.547 9.586 399 HB THR 50 HB THR 50 -2.909 -2.355 10.304 400 HG1 THR 50 HG1 THR 50 -4.792 -1.035 10.551 401 HG21 THR 50 HG21 THR 50 -1.982 -1.588 12.527 402 HG22 THR 50 HG22 THR 50 -1.481 -0.105 11.717 403 HG23 THR 50 HG23 THR 50 -0.817 -1.657 11.205 404 H SER 51 HN SER 51 -0.539 0.873 8.704 405 HA SER 51 HA SER 51 0.764 -1.379 7.336 406 HB2 SER 51 HB2 SER 51 1.502 1.543 7.110 407 HB3 SER 51 HB1 SER 51 1.943 0.226 6.020 408 HG SER 51 HG SER 51 -0.733 0.395 6.270 409 H LYS 52 HN LYS 52 2.040 -2.411 8.650 410 HA LYS 52 HA LYS 52 3.412 -1.073 10.816 411 HB2 LYS 52 HB2 LYS 52 2.214 -3.481 10.682 412 HB3 LYS 52 HB1 LYS 52 3.860 -3.950 10.280 413 HG2 LYS 52 HG2 LYS 52 3.337 -2.234 12.655 414 HG3 LYS 52 HG1 LYS 52 3.073 -3.976 12.738 415 HD2 LYS 52 HD2 LYS 52 5.297 -4.463 12.558 416 HD3 LYS 52 HD1 LYS 52 5.639 -3.033 11.579 417 HE2 LYS 52 HE2 LYS 52 5.326 -1.635 13.597 418 HE3 LYS 52 HE1 LYS 52 5.142 -3.107 14.550 419 HZ1 LYS 52 HZ1 LYS 52 7.380 -3.765 13.835 420 HZ2 LYS 52 HZ2 LYS 52 7.388 -2.313 14.702 421 HZ3 LYS 52 HZ3 LYS 52 7.549 -2.295 13.018 422 H THR 53 HN THR 53 5.417 -0.381 10.693 423 HA THR 53 HA THR 53 7.188 -1.558 8.654 424 HB THR 53 HB THR 53 8.179 0.549 8.199 425 HG1 THR 53 HG1 THR 53 6.696 2.159 9.858 426 HG21 THR 53 HG21 THR 53 5.947 0.216 7.191 427 HG22 THR 53 HG22 THR 53 6.352 1.915 7.420 428 HG23 THR 53 HG23 THR 53 5.233 1.118 8.529 429 HA PRO 54 HA PRO 54 10.146 -2.332 11.850 430 HB2 PRO 54 HB2 PRO 54 12.264 -1.262 10.066 431 HB3 PRO 54 HB1 PRO 54 12.051 -2.904 10.707 432 HG2 PRO 54 HG2 PRO 54 11.613 -2.397 8.153 433 HG3 PRO 54 HG1 PRO 54 10.557 -3.501 9.059 434 HD2 PRO 54 HD2 PRO 54 10.095 -0.628 8.335 435 HD3 PRO 54 HD1 PRO 54 8.995 -2.019 8.195 436 H ARG 55 HN ARG 55 9.408 0.770 10.929 437 HA ARG 55 HA ARG 55 11.264 1.919 12.909 438 HB2 ARG 55 HB2 ARG 55 10.328 2.980 10.270 439 HB3 ARG 55 HB1 ARG 55 10.822 4.089 11.541 440 HG2 ARG 55 HG2 ARG 55 13.005 2.928 11.633 441 HG3 ARG 55 HG1 ARG 55 12.494 1.940 10.266 442 HD2 ARG 55 HD2 ARG 55 13.864 3.768 9.481 443 HD3 ARG 55 HD1 ARG 55 12.204 3.979 8.925 444 HE ARG 55 HE ARG 55 11.978 5.582 10.843 445 HH11 ARG 55 HH11 ARG 55 15.092 4.937 9.378 446 HH12 ARG 55 HH12 ARG 55 15.749 6.483 9.806 447 HH21 ARG 55 HH21 ARG 55 12.828 7.645 11.356 448 HH22 ARG 55 HH22 ARG 55 14.456 8.031 10.905 449 H GLN 56 HN GLN 56 8.184 2.738 11.270 450 HA GLN 56 HA GLN 56 6.916 3.081 13.855 451 HB2 GLN 56 HB2 GLN 56 7.956 5.281 13.432 452 HB3 GLN 56 HB1 GLN 56 7.092 5.385 11.905 453 HG2 GLN 56 HG2 GLN 56 5.996 6.703 13.616 454 HG3 GLN 56 HG1 GLN 56 4.965 5.369 13.097 455 HE21 GLN 56 HE21 GLN 56 6.942 6.642 15.651 456 HE22 GLN 56 HE22 GLN 56 6.355 5.606 16.905 457 H THR 57 HN THR 57 4.904 2.370 13.756 458 HA THR 57 HA THR 57 3.774 1.584 11.229 459 HB THR 57 HB THR 57 2.611 1.445 14.017 460 HG1 THR 57 HG1 THR 57 4.406 0.170 13.993 461 HG21 THR 57 HG21 THR 57 1.840 -0.387 11.793 462 HG22 THR 57 HG22 THR 57 1.126 1.221 11.852 463 HG23 THR 57 HG23 THR 57 0.916 0.113 13.209 464 H VAL 58 HN VAL 58 2.252 2.635 10.074 465 HA VAL 58 HA VAL 58 1.034 5.021 11.299 466 HB VAL 58 HB VAL 58 0.791 5.926 8.993 467 HG11 VAL 58 HG11 VAL 58 2.601 6.726 10.339 468 HG12 VAL 58 HG12 VAL 58 3.192 6.501 8.695 469 HG13 VAL 58 HG13 VAL 58 3.582 5.316 9.942 470 HG21 VAL 58 HG21 VAL 58 0.877 3.853 7.734 471 HG22 VAL 58 HG22 VAL 58 2.545 3.594 8.235 472 HG23 VAL 58 HG23 VAL 58 2.140 4.951 7.187 473 H THR 59 HN THR 59 -1.123 5.463 10.871 474 HA THR 59 HA THR 59 -2.678 3.174 9.863 475 HB THR 59 HB THR 59 -3.531 5.264 11.877 476 HG1 THR 59 HG1 THR 59 -2.320 4.040 13.128 477 HG21 THR 59 HG21 THR 59 -4.861 2.692 11.020 478 HG22 THR 59 HG22 THR 59 -5.394 4.318 10.589 479 HG23 THR 59 HG23 THR 59 -5.438 3.792 12.273 480 H ASN 60 HN ASN 60 -3.883 3.517 8.114 481 HA ASN 60 HA ASN 60 -4.456 6.316 7.289 482 HB2 ASN 60 HB2 ASN 60 -3.558 3.903 5.758 483 HB3 ASN 60 HB1 ASN 60 -4.657 5.029 4.968 484 HD21 ASN 60 HD21 ASN 60 -2.353 6.089 7.361 485 HD22 ASN 60 HD22 ASN 60 -1.294 6.905 6.261 486 H SER 61 HN SER 61 -6.636 6.749 7.201 487 HA SER 61 HA SER 61 -8.488 4.451 7.064 488 HB2 SER 61 HB2 SER 61 -9.357 7.028 8.301 489 HB3 SER 61 HB1 SER 61 -9.846 5.374 8.676 490 HG SER 61 HG SER 61 -8.129 5.126 9.946 491 H PHE 62 HN PHE 62 -10.467 4.751 5.845 492 HA PHE 62 HA PHE 62 -10.862 7.182 4.390 493 HB2 PHE 62 HB2 PHE 62 -10.495 6.220 2.126 494 HB3 PHE 62 HB1 PHE 62 -9.011 6.381 3.057 495 HD1 PHE 62 HD1 PHE 62 -7.826 4.424 3.858 496 HD2 PHE 62 HD2 PHE 62 -11.387 4.050 1.559 497 HE1 PHE 62 HE1 PHE 62 -7.297 2.062 3.433 498 HE2 PHE 62 HE2 PHE 62 -10.867 1.687 1.131 499 HZ PHE 62 HZ PHE 62 -8.815 0.690 2.064 500 H THR 63 HN THR 63 -12.781 7.209 3.227 501 HA THR 63 HA THR 63 -14.537 4.918 3.752 502 HB THR 63 HB THR 63 -15.470 7.707 3.100 503 HG1 THR 63 HG1 THR 63 -14.505 6.651 5.518 504 HG21 THR 63 HG21 THR 63 -16.936 5.532 3.057 505 HG22 THR 63 HG22 THR 63 -17.567 7.013 3.778 506 HG23 THR 63 HG23 THR 63 -16.923 5.735 4.810 507 H LEU 64 HN LEU 64 -15.452 3.876 2.077 508 HA LEU 64 HA LEU 64 -14.448 4.138 -0.511 509 HB2 LEU 64 HB2 LEU 64 -16.943 2.769 0.490 510 HB3 LEU 64 HB1 LEU 64 -16.354 2.631 -1.153 511 HG LEU 64 HG LEU 64 -14.980 1.672 1.343 512 HD11 LEU 64 HD11 LEU 64 -15.141 -0.506 0.095 513 HD12 LEU 64 HD12 LEU 64 -16.271 0.304 -0.989 514 HD13 LEU 64 HD13 LEU 64 -16.651 0.149 0.727 515 HD21 LEU 64 HD21 LEU 64 -13.291 2.575 -0.118 516 HD22 LEU 64 HD22 LEU 64 -13.980 1.724 -1.503 517 HD23 LEU 64 HD23 LEU 64 -13.236 0.815 -0.188 518 H GLY 65 HN GLY 65 -14.730 5.721 -1.889 519 HA2 GLY 65 HA2 GLY 65 -16.101 6.825 -3.485 520 HA3 GLY 65 HA1 GLY 65 -17.462 6.675 -2.384 521 H LYS 66 HN LYS 66 -14.941 7.609 -0.523 522 HA LYS 66 HA LYS 66 -15.583 10.460 -0.906 523 HB2 LYS 66 HB2 LYS 66 -15.172 8.888 1.631 524 HB3 LYS 66 HB1 LYS 66 -15.071 10.640 1.594 525 HG2 LYS 66 HG2 LYS 66 -17.371 10.805 0.886 526 HG3 LYS 66 HG1 LYS 66 -17.485 9.049 0.750 527 HD2 LYS 66 HD2 LYS 66 -18.506 9.610 2.810 528 HD3 LYS 66 HD1 LYS 66 -16.921 8.958 3.220 529 HE2 LYS 66 HE2 LYS 66 -16.074 11.297 3.354 530 HE3 LYS 66 HE1 LYS 66 -17.729 11.861 3.125 531 HZ1 LYS 66 HZ1 LYS 66 -16.695 10.236 5.380 532 HZ2 LYS 66 HZ2 LYS 66 -18.329 10.583 5.142 533 HZ3 LYS 66 HZ3 LYS 66 -17.236 11.834 5.444 534 H GLU 67 HN GLU 67 -13.909 11.869 0.213 535 HA GLU 67 HA GLU 67 -11.282 11.095 -0.781 536 HB2 GLU 67 HB2 GLU 67 -12.197 13.288 -1.437 537 HB3 GLU 67 HB1 GLU 67 -12.315 13.748 0.257 538 HG2 GLU 67 HG2 GLU 67 -9.842 13.489 0.422 539 HG3 GLU 67 HG1 GLU 67 -9.810 13.227 -1.324 540 H ALA 68 HN ALA 68 -9.648 10.537 0.546 541 HA ALA 68 HA ALA 68 -10.113 10.848 3.436 542 HB1 ALA 68 HB1 ALA 68 -8.622 8.737 1.910 543 HB2 ALA 68 HB2 ALA 68 -10.108 8.549 2.839 544 HB3 ALA 68 HB3 ALA 68 -8.587 8.890 3.664 545 H ASP 69 HN ASP 69 -8.731 11.946 4.620 546 HA ASP 69 HA ASP 69 -6.307 13.012 3.372 547 HB2 ASP 69 HB2 ASP 69 -7.907 14.492 4.617 548 HB3 ASP 69 HB1 ASP 69 -7.467 13.627 6.082 549 H ILE 70 HN ILE 70 -5.202 11.084 3.370 550 HA ILE 70 HA ILE 70 -4.578 9.817 5.927 551 HB ILE 70 HB ILE 70 -3.491 8.049 4.495 552 HG12 ILE 70 HG12 ILE 70 -4.747 8.103 2.138 553 HG13 ILE 70 HG11 ILE 70 -4.546 9.832 2.368 554 HG21 ILE 70 HG21 ILE 70 -6.433 8.504 4.062 555 HG22 ILE 70 HG22 ILE 70 -5.715 7.833 5.526 556 HG23 ILE 70 HG23 ILE 70 -5.588 6.957 4.001 557 HD11 ILE 70 HD11 ILE 70 -2.747 8.747 1.043 558 HD12 ILE 70 HD12 ILE 70 -2.287 7.850 2.494 559 HD13 ILE 70 HD13 ILE 70 -2.170 9.610 2.472 560 H THR 71 HN THR 71 -2.297 8.902 6.100 561 HA THR 71 HA THR 71 -0.353 10.915 5.110 562 HB THR 71 HB THR 71 -0.199 9.704 7.869 563 HG1 THR 71 HG1 THR 71 -1.736 11.066 8.388 564 HG21 THR 71 HG21 THR 71 1.899 10.581 6.845 565 HG22 THR 71 HG22 THR 71 1.406 11.481 8.283 566 HG23 THR 71 HG23 THR 71 1.119 12.157 6.680 567 H THR 72 HN THR 72 1.600 10.149 4.444 568 HA THR 72 HA THR 72 1.861 7.241 4.373 569 HB THR 72 HB THR 72 1.995 8.472 2.231 570 HG1 THR 72 HG1 THR 72 4.039 7.432 1.609 571 HG21 THR 72 HG21 THR 72 3.942 9.805 1.688 572 HG22 THR 72 HG22 THR 72 4.611 9.544 3.298 573 HG23 THR 72 HG23 THR 72 3.140 10.499 3.101 574 H MET 73 HN MET 73 4.113 6.378 4.481 575 HA MET 73 HA MET 73 5.223 6.830 7.025 576 HB2 MET 73 HB2 MET 73 6.059 5.274 4.609 577 HB3 MET 73 HB1 MET 73 7.156 5.426 5.973 578 HG2 MET 73 HG2 MET 73 5.913 4.092 7.303 579 HG3 MET 73 HG1 MET 73 4.391 4.578 6.558 580 HE1 MET 73 HE1 MET 73 3.150 3.434 5.176 581 HE2 MET 73 HE2 MET 73 3.334 1.965 6.148 582 HE3 MET 73 HE3 MET 73 3.465 1.889 4.389 583 H ASP 74 HN ASP 74 5.967 8.183 3.910 584 HA ASP 74 HA ASP 74 8.608 9.034 4.536 585 HB2 ASP 74 HB2 ASP 74 8.392 9.033 2.274 586 HB3 ASP 74 HB1 ASP 74 6.697 9.490 2.323 587 H GLY 75 HN GLY 75 5.469 10.359 5.159 588 HA2 GLY 75 HA2 GLY 75 5.207 11.959 6.927 589 HA3 GLY 75 HA1 GLY 75 6.783 12.614 6.518 590 H LYS 76 HN LYS 76 4.453 11.863 4.066 591 HA LYS 76 HA LYS 76 4.064 14.738 3.609 592 HB2 LYS 76 HB2 LYS 76 4.529 12.465 1.761 593 HB3 LYS 76 HB1 LYS 76 3.381 13.687 1.235 594 HG2 LYS 76 HG2 LYS 76 5.336 15.312 1.984 595 HG3 LYS 76 HG1 LYS 76 6.310 13.885 1.630 596 HD2 LYS 76 HD2 LYS 76 4.336 15.173 -0.240 597 HD3 LYS 76 HD1 LYS 76 6.088 15.359 -0.317 598 HE2 LYS 76 HE2 LYS 76 5.954 12.689 -0.352 599 HE3 LYS 76 HE1 LYS 76 4.377 13.050 -1.056 600 HZ1 LYS 76 HZ1 LYS 76 7.060 13.741 -2.100 601 HZ2 LYS 76 HZ2 LYS 76 5.674 14.554 -2.624 602 HZ3 LYS 76 HZ3 LYS 76 5.812 12.887 -2.863 603 H LYS 77 HN LYS 77 2.033 15.498 3.220 604 HA LYS 77 HA LYS 77 -0.137 13.734 4.058 605 HB2 LYS 77 HB2 LYS 77 0.360 16.637 4.114 606 HB3 LYS 77 HB1 LYS 77 -1.292 16.175 3.739 607 HG2 LYS 77 HG2 LYS 77 0.210 15.153 6.127 608 HG3 LYS 77 HG1 LYS 77 -0.828 16.578 6.157 609 HD2 LYS 77 HD2 LYS 77 -2.722 15.206 5.428 610 HD3 LYS 77 HD1 LYS 77 -1.679 13.782 5.417 611 HE2 LYS 77 HE2 LYS 77 -1.280 14.094 7.827 612 HE3 LYS 77 HE1 LYS 77 -2.384 15.471 7.813 613 HZ1 LYS 77 HZ1 LYS 77 -4.147 13.974 7.065 614 HZ2 LYS 77 HZ2 LYS 77 -3.514 13.502 8.564 615 HZ3 LYS 77 HZ3 LYS 77 -3.078 12.661 7.166 616 H LEU 78 HN LEU 78 -1.277 12.730 2.547 617 HA LEU 78 HA LEU 78 -1.784 14.138 0.018 618 HB2 LEU 78 HB2 LEU 78 -1.300 11.179 0.112 619 HB3 LEU 78 HB1 LEU 78 -1.354 12.219 -1.290 620 HG LEU 78 HG LEU 78 0.830 12.418 0.771 621 HD11 LEU 78 HD11 LEU 78 0.982 10.189 -0.044 622 HD12 LEU 78 HD12 LEU 78 2.196 11.137 -0.907 623 HD13 LEU 78 HD13 LEU 78 0.679 10.712 -1.699 624 HD21 LEU 78 HD21 LEU 78 0.716 13.277 -2.113 625 HD22 LEU 78 HD22 LEU 78 2.032 13.561 -0.975 626 HD23 LEU 78 HD23 LEU 78 0.472 14.349 -0.733 627 H LYS 79 HN LYS 79 -3.762 13.714 -0.928 628 HA LYS 79 HA LYS 79 -5.666 12.323 0.824 629 HB2 LYS 79 HB2 LYS 79 -6.301 14.379 -1.294 630 HB3 LYS 79 HB1 LYS 79 -7.411 13.686 -0.120 631 HG2 LYS 79 HG2 LYS 79 -6.178 14.772 1.690 632 HG3 LYS 79 HG1 LYS 79 -5.059 15.456 0.507 633 HD2 LYS 79 HD2 LYS 79 -6.945 16.627 -0.559 634 HD3 LYS 79 HD1 LYS 79 -8.023 15.989 0.683 635 HE2 LYS 79 HE2 LYS 79 -5.584 17.603 1.354 636 HE3 LYS 79 HE1 LYS 79 -7.138 18.358 0.999 637 HZ1 LYS 79 HZ1 LYS 79 -8.074 16.920 2.808 638 HZ2 LYS 79 HZ2 LYS 79 -7.007 18.118 3.332 639 HZ3 LYS 79 HZ3 LYS 79 -6.487 16.509 3.236 640 H CYS 80 HN CYS 80 -6.111 10.379 0.164 641 HA CYS 80 HA CYS 80 -6.045 9.781 -2.712 642 HB2 CYS 80 HB2 CYS 80 -4.676 8.191 -1.759 643 HB3 CYS 80 HB1 CYS 80 -5.578 8.168 -0.247 644 H THR 81 HN THR 81 -7.884 9.599 -3.760 645 HA THR 81 HA THR 81 -10.375 9.397 -2.280 646 HB THR 81 HB THR 81 -10.989 9.441 -4.988 647 HG1 THR 81 HG1 THR 81 -9.096 10.090 -5.810 648 HG21 THR 81 HG21 THR 81 -10.715 11.741 -3.054 649 HG22 THR 81 HG22 THR 81 -12.111 10.676 -3.205 650 HG23 THR 81 HG23 THR 81 -11.674 11.752 -4.536 651 H VAL 82 HN VAL 82 -10.535 7.306 -1.631 652 HA VAL 82 HA VAL 82 -10.115 5.165 -3.572 653 HB VAL 82 HB VAL 82 -11.125 4.499 -0.866 654 HG11 VAL 82 HG11 VAL 82 -10.402 2.891 -2.697 655 HG12 VAL 82 HG12 VAL 82 -9.746 2.616 -1.083 656 HG13 VAL 82 HG13 VAL 82 -8.749 3.381 -2.321 657 HG21 VAL 82 HG21 VAL 82 -8.944 4.770 0.190 658 HG22 VAL 82 HG22 VAL 82 -9.580 6.327 -0.342 659 HG23 VAL 82 HG23 VAL 82 -8.316 5.523 -1.276 660 H HIS 83 HN HIS 83 -11.668 3.731 -4.187 661 HA HIS 83 HA HIS 83 -14.352 3.856 -3.187 662 HB2 HIS 83 HB2 HIS 83 -15.393 4.322 -5.398 663 HB3 HIS 83 HB1 HIS 83 -14.561 5.710 -4.708 664 HD1 HIS 83 HD1 HIS 83 -14.847 3.733 -7.726 665 HD2 HIS 83 HD2 HIS 83 -11.963 6.183 -6.010 666 HE1 HIS 83 HE1 HIS 83 -13.257 4.312 -9.589 667 HE2 HIS 83 HE2 HIS 83 -11.621 5.937 -8.562 668 H LEU 84 HN LEU 84 -15.583 2.098 -3.789 669 HA LEU 84 HA LEU 84 -14.023 -0.109 -4.826 670 HB2 LEU 84 HB2 LEU 84 -15.462 -0.323 -2.797 671 HB3 LEU 84 HB1 LEU 84 -16.870 -0.086 -3.814 672 HG LEU 84 HG LEU 84 -16.303 -2.461 -3.155 673 HD11 LEU 84 HD11 LEU 84 -17.817 -1.786 -5.038 674 HD12 LEU 84 HD12 LEU 84 -17.126 -3.405 -5.114 675 HD13 LEU 84 HD13 LEU 84 -16.452 -2.112 -6.108 676 HD21 LEU 84 HD21 LEU 84 -14.650 -3.629 -4.484 677 HD22 LEU 84 HD22 LEU 84 -13.930 -2.386 -3.466 678 HD23 LEU 84 HD23 LEU 84 -14.149 -2.096 -5.187 679 H ALA 85 HN ALA 85 -14.384 -1.106 -6.673 680 HA ALA 85 HA ALA 85 -16.614 -0.470 -8.388 681 HB1 ALA 85 HB1 ALA 85 -13.817 0.325 -9.206 682 HB2 ALA 85 HB2 ALA 85 -15.150 1.425 -8.847 683 HB3 ALA 85 HB3 ALA 85 -15.237 0.358 -10.251 684 H ASN 86 HN ASN 86 -17.194 -2.413 -9.038 685 HA ASN 86 HA ASN 86 -17.180 -4.505 -9.915 686 HB2 ASN 86 HB2 ASN 86 -14.397 -3.844 -10.908 687 HB3 ASN 86 HB1 ASN 86 -15.438 -5.133 -11.495 688 HD21 ASN 86 HD21 ASN 86 -14.364 -2.087 -12.090 689 HD22 ASN 86 HD22 ASN 86 -15.620 -1.537 -13.142 690 H GLY 87 HN GLY 87 -16.120 -3.979 -7.204 691 HA2 GLY 87 HA2 GLY 87 -15.465 -5.432 -5.517 692 HA3 GLY 87 HA1 GLY 87 -15.059 -6.622 -6.745 693 H LYS 88 HN LYS 88 -13.700 -3.656 -7.447 694 HA LYS 88 HA LYS 88 -11.157 -4.395 -6.172 695 HB2 LYS 88 HB2 LYS 88 -10.076 -4.352 -8.138 696 HB3 LYS 88 HB1 LYS 88 -11.667 -4.481 -8.866 697 HG2 LYS 88 HG2 LYS 88 -10.841 -2.723 -10.040 698 HG3 LYS 88 HG1 LYS 88 -11.566 -1.847 -8.689 699 HD2 LYS 88 HD2 LYS 88 -9.393 -0.942 -8.982 700 HD3 LYS 88 HD1 LYS 88 -9.329 -1.978 -7.552 701 HE2 LYS 88 HE2 LYS 88 -7.385 -2.199 -9.118 702 HE3 LYS 88 HE1 LYS 88 -8.223 -3.699 -8.735 703 HZ1 LYS 88 HZ1 LYS 88 -9.015 -3.908 -10.841 704 HZ2 LYS 88 HZ2 LYS 88 -7.577 -3.068 -11.184 705 HZ3 LYS 88 HZ3 LYS 88 -9.050 -2.235 -11.130 706 H LEU 89 HN LEU 89 -9.955 -2.743 -5.293 707 HA LEU 89 HA LEU 89 -11.477 -0.314 -4.788 708 HB2 LEU 89 HB2 LEU 89 -9.785 -1.903 -3.212 709 HB3 LEU 89 HB1 LEU 89 -8.927 -0.391 -3.452 710 HG LEU 89 HG LEU 89 -10.699 0.867 -2.478 711 HD11 LEU 89 HD11 LEU 89 -12.258 -1.582 -2.957 712 HD12 LEU 89 HD12 LEU 89 -12.740 0.112 -3.061 713 HD13 LEU 89 HD13 LEU 89 -12.637 -0.682 -1.490 714 HD21 LEU 89 HD21 LEU 89 -10.847 -0.102 -0.236 715 HD22 LEU 89 HD22 LEU 89 -9.205 -0.152 -0.886 716 HD23 LEU 89 HD23 LEU 89 -10.193 -1.614 -0.863 717 H VAL 90 HN VAL 90 -11.076 1.542 -5.707 718 HA VAL 90 HA VAL 90 -8.583 1.794 -7.255 719 HB VAL 90 HB VAL 90 -11.096 3.366 -7.790 720 HG11 VAL 90 HG11 VAL 90 -8.651 2.715 -9.420 721 HG12 VAL 90 HG12 VAL 90 -9.132 4.288 -8.786 722 HG13 VAL 90 HG13 VAL 90 -10.082 3.522 -10.063 723 HG21 VAL 90 HG21 VAL 90 -11.599 0.935 -7.922 724 HG22 VAL 90 HG22 VAL 90 -10.339 0.783 -9.146 725 HG23 VAL 90 HG23 VAL 90 -11.758 1.775 -9.464 726 H CYS 91 HN CYS 91 -7.196 3.109 -6.342 727 HA CYS 91 HA CYS 91 -8.184 5.556 -5.017 728 HB2 CYS 91 HB2 CYS 91 -7.107 4.269 -3.314 729 HB3 CYS 91 HB1 CYS 91 -5.793 3.815 -4.385 730 H LYS 92 HN LYS 92 -8.205 6.517 -7.120 731 HA LYS 92 HA LYS 92 -5.570 6.834 -8.352 732 HB2 LYS 92 HB2 LYS 92 -7.609 6.065 -9.693 733 HB3 LYS 92 HB1 LYS 92 -8.197 7.715 -9.534 734 HG2 LYS 92 HG2 LYS 92 -5.587 8.007 -10.436 735 HG3 LYS 92 HG1 LYS 92 -6.215 6.624 -11.332 736 HD2 LYS 92 HD2 LYS 92 -7.695 9.228 -11.093 737 HD3 LYS 92 HD1 LYS 92 -6.562 8.886 -12.402 738 HE2 LYS 92 HE2 LYS 92 -7.923 6.830 -12.893 739 HE3 LYS 92 HE1 LYS 92 -9.117 7.436 -11.747 740 HZ1 LYS 92 HZ1 LYS 92 -9.469 7.955 -14.181 741 HZ2 LYS 92 HZ2 LYS 92 -8.198 9.058 -14.040 742 HZ3 LYS 92 HZ3 LYS 92 -9.597 9.255 -13.109 743 H SER 93 HN SER 93 -4.682 8.805 -8.758 744 HA SER 93 HA SER 93 -5.935 11.101 -7.410 745 HB2 SER 93 HB2 SER 93 -2.992 11.005 -7.880 746 HB3 SER 93 HB1 SER 93 -3.894 11.693 -6.534 747 HG SER 93 HG SER 93 -4.341 9.120 -6.440 748 H GLU 94 HN GLU 94 -4.091 13.001 -8.438 749 HA GLU 94 HA GLU 94 -5.124 13.240 -11.144 750 HB2 GLU 94 HB2 GLU 94 -5.152 15.132 -9.500 751 HB3 GLU 94 HB1 GLU 94 -3.397 15.154 -9.567 752 HG2 GLU 94 HG2 GLU 94 -3.663 15.517 -12.071 753 HG3 GLU 94 HG1 GLU 94 -5.353 15.869 -11.713 754 H LYS 95 HN LYS 95 -2.129 12.644 -9.480 755 HA LYS 95 HA LYS 95 -0.691 12.606 -12.052 756 HB2 LYS 95 HB2 LYS 95 0.052 14.221 -10.254 757 HB3 LYS 95 HB1 LYS 95 0.515 12.824 -9.288 758 HG2 LYS 95 HG2 LYS 95 2.170 12.187 -10.877 759 HG3 LYS 95 HG1 LYS 95 1.613 13.400 -12.031 760 HD2 LYS 95 HD2 LYS 95 2.396 15.180 -10.674 761 HD3 LYS 95 HD1 LYS 95 2.638 14.110 -9.290 762 HE2 LYS 95 HE2 LYS 95 4.763 14.690 -10.331 763 HE3 LYS 95 HE1 LYS 95 4.430 12.967 -10.486 764 HZ1 LYS 95 HZ1 LYS 95 3.818 13.269 -12.750 765 HZ2 LYS 95 HZ2 LYS 95 5.306 14.036 -12.525 766 HZ3 LYS 95 HZ3 LYS 95 3.888 14.954 -12.624 767 H PHE 96 HN PHE 96 -1.736 10.672 -9.411 768 HA PHE 96 HA PHE 96 -0.139 8.439 -10.452 769 HB2 PHE 96 HB2 PHE 96 -0.741 8.661 -7.518 770 HB3 PHE 96 HB1 PHE 96 0.498 7.705 -8.324 771 HD1 PHE 96 HD1 PHE 96 2.535 8.804 -9.192 772 HD2 PHE 96 HD2 PHE 96 -0.348 10.904 -6.873 773 HE1 PHE 96 HE1 PHE 96 4.183 10.580 -8.753 774 HE2 PHE 96 HE2 PHE 96 1.290 12.679 -6.432 775 HZ PHE 96 HZ PHE 96 3.558 12.522 -7.373 776 H SER 97 HN SER 97 -0.978 6.291 -9.633 777 HA SER 97 HA SER 97 -3.810 6.244 -9.031 778 HB2 SER 97 HB2 SER 97 -3.163 4.469 -11.293 779 HB3 SER 97 HB1 SER 97 -4.587 5.470 -11.014 780 HG SER 97 HG SER 97 -2.104 6.196 -12.141 781 H HIS 98 HN HIS 98 -4.129 4.767 -7.534 782 HA HIS 98 HA HIS 98 -2.292 2.475 -7.370 783 HB2 HIS 98 HB2 HIS 98 -2.337 3.996 -5.407 784 HB3 HIS 98 HB1 HIS 98 -4.054 3.691 -5.226 785 HD2 HIS 98 HD2 HIS 98 -4.005 0.410 -5.352 786 HE1 HIS 98 HE1 HIS 98 -1.285 0.796 -2.148 787 HE2 HIS 98 HE2 HIS 98 -2.689 -0.825 -3.478 788 H GLU 99 HN GLU 99 -3.115 0.574 -7.985 789 HA GLU 99 HA GLU 99 -6.038 0.255 -7.825 790 HB2 GLU 99 HB2 GLU 99 -6.109 -0.440 -9.952 791 HB3 GLU 99 HB1 GLU 99 -4.488 0.208 -10.104 792 HG2 GLU 99 HG2 GLU 99 -3.502 -1.904 -9.860 793 HG3 GLU 99 HG1 GLU 99 -4.994 -2.620 -9.256 794 H GLN 100 HN GLN 100 -6.799 -1.368 -6.629 795 HA GLN 100 HA GLN 100 -4.981 -3.573 -5.933 796 HB2 GLN 100 HB2 GLN 100 -5.145 -1.852 -4.086 797 HB3 GLN 100 HB1 GLN 100 -6.857 -2.245 -3.971 798 HG2 GLN 100 HG2 GLN 100 -6.331 -4.524 -3.373 799 HG3 GLN 100 HG1 GLN 100 -4.610 -4.205 -3.574 800 HE21 GLN 100 HE21 GLN 100 -3.528 -2.953 -2.039 801 HE22 GLN 100 HE22 GLN 100 -4.214 -2.658 -0.478 802 H GLU 101 HN GLU 101 -5.875 -5.371 -6.714 803 HA GLU 101 HA GLU 101 -8.815 -5.578 -6.676 804 HB2 GLU 101 HB2 GLU 101 -7.520 -5.523 -8.924 805 HB3 GLU 101 HB1 GLU 101 -7.054 -7.167 -8.514 806 HG2 GLU 101 HG2 GLU 101 -9.184 -7.979 -8.732 807 HG3 GLU 101 HG1 GLU 101 -9.934 -6.412 -8.435 808 H VAL 102 HN VAL 102 -9.639 -7.075 -5.393 809 HA VAL 102 HA VAL 102 -7.895 -9.189 -4.354 810 HB VAL 102 HB VAL 102 -10.556 -8.152 -3.363 811 HG11 VAL 102 HG11 VAL 102 -10.428 -9.693 -1.563 812 HG12 VAL 102 HG12 VAL 102 -8.806 -10.206 -2.027 813 HG13 VAL 102 HG13 VAL 102 -10.187 -10.626 -3.039 814 HG21 VAL 102 HG21 VAL 102 -9.325 -7.299 -1.495 815 HG22 VAL 102 HG22 VAL 102 -8.568 -6.714 -2.974 816 HG23 VAL 102 HG23 VAL 102 -7.839 -8.045 -2.076 817 H LYS 103 HN LYS 103 -8.071 -11.150 -5.177 818 HA LYS 103 HA LYS 103 -10.620 -11.929 -6.428 819 HB2 LYS 103 HB2 LYS 103 -8.705 -11.523 -8.023 820 HB3 LYS 103 HB1 LYS 103 -7.867 -12.862 -7.252 821 HG2 LYS 103 HG2 LYS 103 -9.784 -14.324 -7.861 822 HG3 LYS 103 HG1 LYS 103 -10.443 -12.979 -8.796 823 HD2 LYS 103 HD2 LYS 103 -8.323 -12.917 -10.090 824 HD3 LYS 103 HD1 LYS 103 -7.787 -14.348 -9.210 825 HE2 LYS 103 HE2 LYS 103 -9.757 -15.567 -10.083 826 HE3 LYS 103 HE1 LYS 103 -10.185 -14.138 -11.024 827 HZ1 LYS 103 HZ1 LYS 103 -7.958 -14.318 -12.082 828 HZ2 LYS 103 HZ2 LYS 103 -9.000 -15.601 -12.436 829 HZ3 LYS 103 HZ3 LYS 103 -7.752 -15.810 -11.311 830 H GLY 104 HN GLY 104 -11.492 -13.112 -4.790 831 HA2 GLY 104 HA2 GLY 104 -11.870 -15.015 -3.558 832 HA3 GLY 104 HA1 GLY 104 -10.455 -15.732 -4.318 833 H ASN 105 HN ASN 105 -8.594 -15.864 -3.192 834 HA ASN 105 HA ASN 105 -8.506 -14.508 -0.582 835 HB2 ASN 105 HB2 ASN 105 -7.417 -16.436 0.384 836 HB3 ASN 105 HB1 ASN 105 -8.899 -16.971 -0.394 837 HD21 ASN 105 HD21 ASN 105 -6.621 -18.568 0.287 838 HD22 ASN 105 HD22 ASN 105 -6.007 -19.220 -1.193 839 H GLU 106 HN GLU 106 -7.440 -13.915 -3.342 840 HA GLU 106 HA GLU 106 -4.668 -13.427 -2.496 841 HB2 GLU 106 HB2 GLU 106 -5.610 -14.466 -5.165 842 HB3 GLU 106 HB1 GLU 106 -4.052 -13.685 -4.960 843 HG2 GLU 106 HG2 GLU 106 -3.301 -15.390 -3.484 844 HG3 GLU 106 HG1 GLU 106 -4.911 -16.103 -3.405 845 H MET 107 HN MET 107 -4.111 -11.376 -2.639 846 HA MET 107 HA MET 107 -5.863 -9.573 -4.170 847 HB2 MET 107 HB2 MET 107 -5.901 -9.043 -1.825 848 HB3 MET 107 HB1 MET 107 -4.147 -9.093 -1.729 849 HG2 MET 107 HG2 MET 107 -4.723 -7.201 -3.696 850 HG3 MET 107 HG1 MET 107 -5.876 -6.896 -2.396 851 HE1 MET 107 HE1 MET 107 -3.592 -6.162 0.658 852 HE2 MET 107 HE2 MET 107 -4.380 -7.680 0.238 853 HE3 MET 107 HE3 MET 107 -5.239 -6.155 0.022 854 H VAL 108 HN VAL 108 -5.041 -8.834 -5.988 855 HA VAL 108 HA VAL 108 -2.108 -8.618 -6.230 856 HB VAL 108 HB VAL 108 -4.127 -8.841 -8.470 857 HG11 VAL 108 HG11 VAL 108 -1.115 -8.877 -8.474 858 HG12 VAL 108 HG12 VAL 108 -2.148 -7.606 -9.123 859 HG13 VAL 108 HG13 VAL 108 -2.135 -9.201 -9.875 860 HG21 VAL 108 HG21 VAL 108 -3.141 -11.107 -8.794 861 HG22 VAL 108 HG22 VAL 108 -4.043 -10.936 -7.290 862 HG23 VAL 108 HG23 VAL 108 -2.281 -10.901 -7.268 863 H GLU 109 HN GLU 109 -1.599 -6.579 -5.734 864 HA GLU 109 HA GLU 109 -3.248 -4.450 -6.913 865 HB2 GLU 109 HB2 GLU 109 -3.088 -3.256 -5.004 866 HB3 GLU 109 HB1 GLU 109 -2.726 -4.815 -4.286 867 HG2 GLU 109 HG2 GLU 109 -0.288 -4.278 -4.674 868 HG3 GLU 109 HG1 GLU 109 -0.813 -2.637 -5.050 869 H THR 110 HN THR 110 -2.240 -2.642 -7.794 870 HA THR 110 HA THR 110 0.632 -2.818 -8.335 871 HB THR 110 HB THR 110 -1.458 -2.346 -10.470 872 HG1 THR 110 HG1 THR 110 -0.394 -4.608 -9.509 873 HG21 THR 110 HG21 THR 110 0.514 -1.002 -10.860 874 HG22 THR 110 HG22 THR 110 0.460 -2.336 -12.014 875 HG23 THR 110 HG23 THR 110 1.552 -2.406 -10.630 876 H ILE 111 HN ILE 111 1.489 -0.979 -7.692 877 HA ILE 111 HA ILE 111 -0.181 1.456 -7.773 878 HB ILE 111 HB ILE 111 2.248 1.267 -6.042 879 HG12 ILE 111 HG12 ILE 111 -0.436 0.253 -5.114 880 HG13 ILE 111 HG11 ILE 111 0.825 -0.823 -5.704 881 HG21 ILE 111 HG21 ILE 111 1.027 2.806 -4.640 882 HG22 ILE 111 HG22 ILE 111 -0.434 2.580 -5.603 883 HG23 ILE 111 HG23 ILE 111 0.970 3.376 -6.309 884 HD11 ILE 111 HD11 ILE 111 2.287 -0.208 -3.928 885 HD12 ILE 111 HD12 ILE 111 0.713 -0.606 -3.231 886 HD13 ILE 111 HD13 ILE 111 1.195 1.081 -3.416 887 H THR 112 HN THR 112 0.953 3.461 -8.244 888 HA THR 112 HA THR 112 3.614 3.191 -9.413 889 HB THR 112 HB THR 112 1.428 4.652 -10.911 890 HG1 THR 112 HG1 THR 112 1.953 1.985 -10.789 891 HG21 THR 112 HG21 THR 112 3.015 4.818 -12.671 892 HG22 THR 112 HG22 THR 112 4.108 3.680 -11.886 893 HG23 THR 112 HG23 THR 112 3.867 5.287 -11.197 894 H PHE 113 HN PHE 113 4.753 4.550 -8.196 895 HA PHE 113 HA PHE 113 3.829 7.311 -7.962 896 HB2 PHE 113 HB2 PHE 113 4.137 5.412 -5.722 897 HB3 PHE 113 HB1 PHE 113 4.921 6.966 -5.490 898 HD1 PHE 113 HD2 PHE 113 1.697 5.288 -6.044 899 HD2 PHE 113 HD1 PHE 113 3.660 8.931 -5.059 900 HE1 PHE 113 HE2 PHE 113 -0.459 6.256 -5.347 901 HE2 PHE 113 HE1 PHE 113 1.506 9.912 -4.359 902 HZ PHE 113 HZ PHE 113 -0.553 8.566 -4.500 903 H GLY 114 HN GLY 114 5.503 8.800 -7.956 904 HA2 GLY 114 HA2 GLY 114 7.645 9.601 -8.203 905 HA3 GLY 114 HA1 GLY 114 8.195 8.159 -7.364 906 H GLY 115 HN GLY 115 6.305 7.610 -10.150 907 HA2 GLY 115 HA2 GLY 115 6.880 7.161 -12.366 908 HA3 GLY 115 HA1 GLY 115 8.558 7.504 -11.978 909 H VAL 116 HN VAL 116 7.216 5.393 -9.711 910 HA VAL 116 HA VAL 116 8.357 3.103 -11.165 911 HB VAL 116 HB VAL 116 8.250 3.355 -8.165 912 HG11 VAL 116 HG11 VAL 116 9.966 1.581 -8.283 913 HG12 VAL 116 HG12 VAL 116 9.755 1.529 -10.033 914 HG13 VAL 116 HG13 VAL 116 8.417 1.093 -8.969 915 HG21 VAL 116 HG21 VAL 116 9.641 5.157 -8.963 916 HG22 VAL 116 HG22 VAL 116 10.513 4.055 -10.030 917 HG23 VAL 116 HG23 VAL 116 10.665 3.891 -8.281 918 H THR 117 HN THR 117 7.126 1.382 -11.447 919 HA THR 117 HA THR 117 4.426 1.403 -10.324 920 HB THR 117 HB THR 117 5.444 -0.468 -12.449 921 HG1 THR 117 HG1 THR 117 5.746 1.899 -12.910 922 HG21 THR 117 HG21 THR 117 3.225 -0.829 -11.301 923 HG22 THR 117 HG22 THR 117 3.152 -0.675 -13.056 924 HG23 THR 117 HG23 THR 117 2.690 0.683 -12.031 925 H LEU 118 HN LEU 118 4.817 0.580 -8.256 926 HA LEU 118 HA LEU 118 6.284 -1.899 -7.977 927 HB2 LEU 118 HB2 LEU 118 6.570 -0.254 -6.240 928 HB3 LEU 118 HB1 LEU 118 4.843 -0.186 -5.960 929 HG LEU 118 HG LEU 118 4.813 -2.308 -4.920 930 HD11 LEU 118 HD11 LEU 118 6.781 -3.776 -4.788 931 HD12 LEU 118 HD12 LEU 118 7.627 -2.698 -5.898 932 HD13 LEU 118 HD13 LEU 118 6.189 -3.567 -6.438 933 HD21 LEU 118 HD21 LEU 118 5.786 -0.452 -3.582 934 HD22 LEU 118 HD22 LEU 118 7.388 -1.063 -4.007 935 HD23 LEU 118 HD23 LEU 118 6.284 -2.063 -3.063 936 H ILE 119 HN ILE 119 5.348 -3.673 -8.623 937 HA ILE 119 HA ILE 119 2.508 -4.125 -8.295 938 HB ILE 119 HB ILE 119 4.764 -5.612 -9.645 939 HG12 ILE 119 HG12 ILE 119 2.979 -5.388 -11.524 940 HG13 ILE 119 HG11 ILE 119 2.265 -4.180 -10.478 941 HG21 ILE 119 HG21 ILE 119 3.073 -7.319 -10.326 942 HG22 ILE 119 HG22 ILE 119 1.940 -6.609 -9.177 943 HG23 ILE 119 HG23 ILE 119 3.433 -7.349 -8.600 944 HD11 ILE 119 HD11 ILE 119 3.589 -3.030 -12.008 945 HD12 ILE 119 HD12 ILE 119 4.942 -4.143 -11.797 946 HD13 ILE 119 HD13 ILE 119 4.496 -3.036 -10.495 947 H ARG 120 HN ARG 120 1.674 -5.120 -6.544 948 HA ARG 120 HA ARG 120 3.456 -6.890 -5.001 949 HB2 ARG 120 HB2 ARG 120 1.442 -4.939 -3.866 950 HB3 ARG 120 HB1 ARG 120 2.349 -6.114 -2.931 951 HG2 ARG 120 HG2 ARG 120 4.430 -4.939 -3.921 952 HG3 ARG 120 HG1 ARG 120 3.300 -3.626 -4.263 953 HD2 ARG 120 HD2 ARG 120 4.139 -4.757 -1.619 954 HD3 ARG 120 HD1 ARG 120 4.143 -3.081 -2.157 955 HE ARG 120 HE ARG 120 1.486 -3.922 -2.152 956 HH11 ARG 120 HH11 ARG 120 4.048 -3.533 0.219 957 HH12 ARG 120 HH12 ARG 120 2.956 -3.139 1.505 958 HH21 ARG 120 HH21 ARG 120 0.070 -3.418 -0.503 959 HH22 ARG 120 HH22 ARG 120 0.669 -3.074 1.097 960 H ARG 121 HN ARG 121 2.538 -8.682 -4.036 961 HA ARG 121 HA ARG 121 -0.264 -9.245 -4.690 962 HB2 ARG 121 HB2 ARG 121 2.178 -10.967 -5.006 963 HB3 ARG 121 HB1 ARG 121 0.602 -11.700 -4.732 964 HG2 ARG 121 HG2 ARG 121 0.103 -11.474 -6.848 965 HG3 ARG 121 HG1 ARG 121 0.379 -9.740 -6.773 966 HD2 ARG 121 HD2 ARG 121 2.514 -11.820 -7.176 967 HD3 ARG 121 HD1 ARG 121 1.789 -10.858 -8.461 968 HE ARG 121 HE ARG 121 2.781 -9.131 -6.490 969 HH11 ARG 121 HH11 ARG 121 3.916 -11.332 -8.964 970 HH12 ARG 121 HH12 ARG 121 5.421 -10.487 -9.200 971 HH21 ARG 121 HH21 ARG 121 4.764 -8.024 -6.809 972 HH22 ARG 121 HH22 ARG 121 5.923 -8.655 -7.945 973 H SER 122 HN SER 122 -1.424 -9.795 -2.972 974 HA SER 122 HA SER 122 0.075 -10.550 -0.563 975 HB2 SER 122 HB2 SER 122 -2.501 -9.064 -0.341 976 HB3 SER 122 HB1 SER 122 -1.126 -9.102 0.758 977 HG SER 122 HG SER 122 -1.650 -7.374 -1.246 978 H LYS 123 HN LYS 123 -0.322 -12.510 0.028 979 HA LYS 123 HA LYS 123 -2.744 -13.869 -0.827 980 HB2 LYS 123 HB2 LYS 123 -1.578 -15.820 0.395 981 HB3 LYS 123 HB1 LYS 123 -0.875 -15.237 -1.110 982 HG2 LYS 123 HG2 LYS 123 0.916 -14.259 -0.049 983 HG3 LYS 123 HG1 LYS 123 0.071 -14.121 1.491 984 HD2 LYS 123 HD2 LYS 123 1.727 -15.822 1.720 985 HD3 LYS 123 HD1 LYS 123 0.153 -16.618 1.667 986 HE2 LYS 123 HE2 LYS 123 0.494 -17.308 -0.587 987 HE3 LYS 123 HE1 LYS 123 1.917 -16.282 -0.754 988 HZ1 LYS 123 HZ1 LYS 123 2.460 -18.635 -0.432 989 HZ2 LYS 123 HZ2 LYS 123 1.719 -18.596 1.086 990 HZ3 LYS 123 HZ3 LYS 123 3.096 -17.659 0.793 991 H ARG 124 HN ARG 124 -4.374 -14.515 0.504 992 HA ARG 124 HA ARG 124 -4.580 -13.219 3.056 993 HB2 ARG 124 HB2 ARG 124 -6.437 -13.928 1.273 994 HB3 ARG 124 HB1 ARG 124 -6.478 -15.366 2.283 995 HG2 ARG 124 HG2 ARG 124 -6.955 -14.011 4.238 996 HG3 ARG 124 HG1 ARG 124 -6.873 -12.550 3.252 997 HD2 ARG 124 HD2 ARG 124 -9.172 -13.138 3.557 998 HD3 ARG 124 HD1 ARG 124 -8.739 -13.445 1.880 999 HE ARG 124 HE ARG 124 -8.364 -15.818 3.282 1000 HH11 ARG 124 HH11 ARG 124 -11.022 -13.687 2.434 1001 HH12 ARG 124 HH12 ARG 124 -12.194 -14.965 2.400 1002 HH21 ARG 124 HH21 ARG 124 -9.927 -17.493 3.259 1003 HH22 ARG 124 HH22 ARG 124 -11.572 -17.122 2.858 1004 H VAL 125 HN VAL 125 -4.633 -14.166 5.064 1005 HA VAL 125 HA VAL 125 -3.679 -16.944 5.212 1006 HB VAL 125 HB VAL 125 -2.335 -16.290 7.218 1007 HG11 VAL 125 HG11 VAL 125 -1.385 -16.547 4.911 1008 HG12 VAL 125 HG12 VAL 125 -0.451 -15.518 5.998 1009 HG13 VAL 125 HG13 VAL 125 -1.471 -14.791 4.755 1010 HG21 VAL 125 HG21 VAL 125 -3.486 -14.212 7.769 1011 HG22 VAL 125 HG22 VAL 125 -2.896 -13.480 6.277 1012 HG23 VAL 125 HG23 VAL 125 -1.759 -13.941 7.544 Start of MODEL 8 1 H1 ALA 1 HT1 ALA 1 -12.767 -10.667 1.014 2 H2 ALA 1 HT2 ALA 1 -14.455 -10.603 1.066 3 H3 ALA 1 HT3 ALA 1 -13.555 -10.370 2.480 4 HA ALA 1 HA ALA 1 -13.698 -8.588 0.129 5 HB1 ALA 1 HB1 ALA 1 -15.048 -7.246 1.334 6 HB2 ALA 1 HB2 ALA 1 -14.190 -7.563 2.840 7 HB3 ALA 1 HB3 ALA 1 -15.385 -8.717 2.248 8 H PHE 2 HN PHE 2 -12.747 -6.312 1.219 9 HA PHE 2 HA PHE 2 -9.941 -6.744 1.247 10 HB2 PHE 2 HB2 PHE 2 -11.721 -4.366 1.613 11 HB3 PHE 2 HB1 PHE 2 -10.014 -4.234 2.020 12 HD1 PHE 2 HD1 PHE 2 -12.157 -5.505 -0.765 13 HD2 PHE 2 HD2 PHE 2 -8.599 -3.479 0.394 14 HE1 PHE 2 HE1 PHE 2 -11.621 -5.094 -3.131 15 HE2 PHE 2 HE2 PHE 2 -8.064 -3.059 -1.970 16 HZ PHE 2 HZ PHE 2 -9.573 -3.875 -3.732 17 H SER 3 HN SER 3 -12.346 -6.337 3.742 18 HA SER 3 HA SER 3 -10.632 -5.755 5.901 19 HB2 SER 3 HB2 SER 3 -12.681 -7.061 7.096 20 HB3 SER 3 HB1 SER 3 -12.770 -5.379 6.568 21 HG SER 3 HG SER 3 -14.055 -5.922 4.960 22 H GLY 4 HN GLY 4 -8.887 -7.019 6.226 23 HA2 GLY 4 HA2 GLY 4 -9.065 -9.496 7.455 24 HA3 GLY 4 HA1 GLY 4 -8.824 -9.809 5.743 25 H THR 5 HN THR 5 -6.835 -10.791 6.331 26 HA THR 5 HA THR 5 -4.711 -8.803 6.764 27 HB THR 5 HB THR 5 -3.436 -10.737 7.844 28 HG1 THR 5 HG1 THR 5 -5.271 -12.233 7.156 29 HG21 THR 5 HG21 THR 5 -4.311 -10.219 10.032 30 HG22 THR 5 HG22 THR 5 -5.843 -9.692 9.340 31 HG23 THR 5 HG23 THR 5 -4.376 -8.760 9.045 32 H TRP 6 HN TRP 6 -3.453 -8.657 5.015 33 HA TRP 6 HA TRP 6 -3.154 -11.041 3.314 34 HB2 TRP 6 HB2 TRP 6 -2.676 -8.215 2.399 35 HB3 TRP 6 HB1 TRP 6 -2.997 -9.649 1.428 36 HD1 TRP 6 HD1 TRP 6 -4.805 -7.142 3.719 37 HE1 TRP 6 HE1 TRP 6 -7.323 -7.197 3.152 38 HE3 TRP 6 HE3 TRP 6 -4.796 -11.062 0.429 39 HZ2 TRP 6 HZ2 TRP 6 -9.061 -8.721 1.526 40 HZ3 TRP 6 HZ3 TRP 6 -6.936 -11.764 -0.571 41 HH2 TRP 6 HH2 TRP 6 -9.018 -10.613 -0.035 42 H GLN 7 HN GLN 7 -1.210 -11.889 3.039 43 HA GLN 7 HA GLN 7 1.106 -10.444 4.119 44 HB2 GLN 7 HB2 GLN 7 0.633 -12.766 4.940 45 HB3 GLN 7 HB1 GLN 7 0.876 -13.352 3.302 46 HG2 GLN 7 HG2 GLN 7 2.822 -13.627 4.858 47 HG3 GLN 7 HG1 GLN 7 3.169 -12.805 3.337 48 HE21 GLN 7 HE21 GLN 7 3.808 -10.694 3.350 49 HE22 GLN 7 HE22 GLN 7 4.136 -9.797 4.796 50 H VAL 8 HN VAL 8 1.841 -9.158 2.576 51 HA VAL 8 HA VAL 8 1.729 -9.792 -0.192 52 HB VAL 8 HB VAL 8 1.523 -7.502 0.502 53 HG11 VAL 8 HG11 VAL 8 3.582 -6.281 1.307 54 HG12 VAL 8 HG12 VAL 8 4.277 -7.868 1.637 55 HG13 VAL 8 HG13 VAL 8 2.803 -7.361 2.462 56 HG21 VAL 8 HG21 VAL 8 3.036 -6.457 -1.063 57 HG22 VAL 8 HG22 VAL 8 2.445 -7.983 -1.720 58 HG23 VAL 8 HG23 VAL 8 4.078 -7.879 -1.053 59 H TYR 9 HN TYR 9 3.293 -10.254 -1.640 60 HA TYR 9 HA TYR 9 6.049 -10.664 -0.845 61 HB2 TYR 9 HB2 TYR 9 6.159 -12.995 -1.403 62 HB3 TYR 9 HB1 TYR 9 4.834 -12.812 -0.261 63 HD1 TYR 9 HD2 TYR 9 2.472 -12.391 -1.459 64 HD2 TYR 9 HD1 TYR 9 5.803 -14.340 -3.242 65 HE1 TYR 9 HE2 TYR 9 0.963 -13.500 -3.054 66 HE2 TYR 9 HE1 TYR 9 4.303 -15.458 -4.837 67 HH TYR 9 HH TYR 9 1.056 -14.536 -5.266 68 H ALA 10 HN ALA 10 7.415 -10.373 -2.600 69 HA ALA 10 HA ALA 10 6.741 -10.851 -5.288 70 HB1 ALA 10 HB1 ALA 10 6.407 -8.600 -6.139 71 HB2 ALA 10 HB2 ALA 10 6.519 -7.943 -4.507 72 HB3 ALA 10 HB3 ALA 10 5.167 -8.986 -4.946 73 H GLN 11 HN GLN 11 8.326 -10.051 -6.801 74 HA GLN 11 HA GLN 11 10.818 -9.056 -5.596 75 HB2 GLN 11 HB2 GLN 11 10.610 -11.374 -7.538 76 HB3 GLN 11 HB1 GLN 11 12.116 -10.632 -7.023 77 HG2 GLN 11 HG2 GLN 11 12.063 -12.434 -5.644 78 HG3 GLN 11 HG1 GLN 11 11.216 -11.263 -4.636 79 HE21 GLN 11 HE21 GLN 11 10.140 -12.878 -3.501 80 HE22 GLN 11 HE22 GLN 11 8.846 -13.788 -4.202 81 H GLU 12 HN GLU 12 9.315 -7.261 -6.735 82 HA GLU 12 HA GLU 12 10.074 -7.104 -9.570 83 HB2 GLU 12 HB2 GLU 12 7.621 -6.682 -8.454 84 HB3 GLU 12 HB1 GLU 12 8.236 -5.055 -8.556 85 HG2 GLU 12 HG2 GLU 12 6.980 -5.538 -10.527 86 HG3 GLU 12 HG1 GLU 12 8.687 -5.445 -10.960 87 H ASN 13 HN ASN 13 9.458 -4.349 -9.631 88 HA ASN 13 HA ASN 13 11.988 -3.161 -9.316 89 HB2 ASN 13 HB2 ASN 13 10.454 -1.076 -9.800 90 HB3 ASN 13 HB1 ASN 13 10.729 -2.278 -11.055 91 HD21 ASN 13 HD21 ASN 13 8.877 -2.415 -12.123 92 HD22 ASN 13 HD22 ASN 13 7.288 -2.447 -11.455 93 H TYR 14 HN TYR 14 11.119 -4.086 -6.751 94 HA TYR 14 HA TYR 14 10.014 -2.004 -5.170 95 HB2 TYR 14 HB2 TYR 14 9.955 -4.395 -4.544 96 HB3 TYR 14 HB1 TYR 14 11.699 -4.367 -4.311 97 HD1 TYR 14 HD2 TYR 14 8.479 -3.141 -3.006 98 HD2 TYR 14 HD1 TYR 14 12.666 -3.472 -2.319 99 HE1 TYR 14 HE2 TYR 14 8.144 -2.453 -0.672 100 HE2 TYR 14 HE1 TYR 14 12.342 -2.786 0.007 101 HH TYR 14 HH TYR 14 9.968 -2.981 1.676 102 H GLU 15 HN GLU 15 13.325 -3.299 -5.198 103 HA GLU 15 HA GLU 15 14.495 -1.328 -3.610 104 HB2 GLU 15 HB2 GLU 15 16.635 -2.132 -4.503 105 HB3 GLU 15 HB1 GLU 15 15.569 -3.453 -4.048 106 HG2 GLU 15 HG2 GLU 15 14.922 -3.595 -6.490 107 HG3 GLU 15 HG1 GLU 15 16.263 -2.499 -6.813 108 H GLU 16 HN GLU 16 13.424 -1.053 -6.829 109 HA GLU 16 HA GLU 16 15.221 1.172 -7.445 110 HB2 GLU 16 HB2 GLU 16 14.124 -0.828 -8.999 111 HB3 GLU 16 HB1 GLU 16 13.092 0.546 -9.365 112 HG2 GLU 16 HG2 GLU 16 14.675 1.573 -10.553 113 HG3 GLU 16 HG1 GLU 16 15.946 1.154 -9.404 114 H PHE 17 HN PHE 17 11.806 0.449 -6.954 115 HA PHE 17 HA PHE 17 10.793 3.015 -7.525 116 HB2 PHE 17 HB2 PHE 17 9.372 1.055 -7.522 117 HB3 PHE 17 HB1 PHE 17 9.683 0.786 -5.814 118 HD1 PHE 17 HD1 PHE 17 8.941 4.058 -7.387 119 HD2 PHE 17 HD2 PHE 17 7.518 0.824 -5.034 120 HE1 PHE 17 HE1 PHE 17 6.932 5.358 -6.820 121 HE2 PHE 17 HE2 PHE 17 5.505 2.105 -4.466 122 HZ PHE 17 HZ PHE 17 5.208 4.376 -5.347 123 H LEU 18 HN LEU 18 11.921 1.555 -4.510 124 HA LEU 18 HA LEU 18 11.007 3.465 -2.713 125 HB2 LEU 18 HB2 LEU 18 13.660 2.048 -2.552 126 HB3 LEU 18 HB1 LEU 18 12.773 2.770 -1.227 127 HG LEU 18 HG LEU 18 12.202 0.223 -2.698 128 HD11 LEU 18 HD11 LEU 18 11.926 -0.556 -0.323 129 HD12 LEU 18 HD12 LEU 18 12.518 1.031 0.179 130 HD13 LEU 18 HD13 LEU 18 13.548 -0.033 -0.778 131 HD21 LEU 18 HD21 LEU 18 10.248 1.844 -1.083 132 HD22 LEU 18 HD22 LEU 18 10.048 0.129 -1.458 133 HD23 LEU 18 HD23 LEU 18 10.086 1.320 -2.761 134 H LYS 19 HN LYS 19 13.830 3.506 -4.772 135 HA LYS 19 HA LYS 19 15.046 5.788 -3.618 136 HB2 LYS 19 HB2 LYS 19 15.467 4.944 -6.470 137 HB3 LYS 19 HB1 LYS 19 16.623 5.637 -5.343 138 HG2 LYS 19 HG2 LYS 19 15.797 3.252 -4.160 139 HG3 LYS 19 HG1 LYS 19 16.013 2.881 -5.868 140 HD2 LYS 19 HD2 LYS 19 18.254 3.473 -5.847 141 HD3 LYS 19 HD1 LYS 19 18.089 4.425 -4.369 142 HE2 LYS 19 HE2 LYS 19 19.193 2.498 -3.651 143 HE3 LYS 19 HE1 LYS 19 17.505 2.173 -3.255 144 HZ1 LYS 19 HZ1 LYS 19 18.839 1.232 -5.737 145 HZ2 LYS 19 HZ2 LYS 19 17.297 0.809 -5.180 146 HZ3 LYS 19 HZ3 LYS 19 18.672 0.296 -4.337 147 H ALA 20 HN ALA 20 12.446 5.402 -5.892 148 HA ALA 20 HA ALA 20 12.757 8.058 -7.001 149 HB1 ALA 20 HB1 ALA 20 10.687 7.594 -8.209 150 HB2 ALA 20 HB2 ALA 20 10.479 6.105 -7.292 151 HB3 ALA 20 HB3 ALA 20 11.845 6.281 -8.393 152 H LEU 21 HN LEU 21 11.324 6.698 -4.258 153 HA LEU 21 HA LEU 21 9.409 8.864 -3.925 154 HB2 LEU 21 HB2 LEU 21 10.031 6.504 -2.141 155 HB3 LEU 21 HB1 LEU 21 8.704 7.632 -1.921 156 HG LEU 21 HG LEU 21 8.855 6.184 -4.509 157 HD11 LEU 21 HD11 LEU 21 7.479 4.352 -3.341 158 HD12 LEU 21 HD12 LEU 21 8.282 4.908 -1.871 159 HD13 LEU 21 HD13 LEU 21 9.235 4.309 -3.226 160 HD21 LEU 21 HD21 LEU 21 6.467 6.290 -4.364 161 HD22 LEU 21 HD22 LEU 21 7.118 7.880 -3.977 162 HD23 LEU 21 HD23 LEU 21 6.544 6.824 -2.688 163 H ALA 22 HN ALA 22 12.570 8.663 -3.626 164 HA ALA 22 HA ALA 22 14.193 9.781 -2.497 165 HB1 ALA 22 HB1 ALA 22 11.790 11.411 -1.732 166 HB2 ALA 22 HB2 ALA 22 13.117 11.827 -2.816 167 HB3 ALA 22 HB3 ALA 22 13.384 11.777 -1.073 168 H LEU 23 HN LEU 23 13.132 7.408 -1.407 169 HA LEU 23 HA LEU 23 12.884 7.758 1.442 170 HB2 LEU 23 HB2 LEU 23 13.060 5.329 -0.325 171 HB3 LEU 23 HB1 LEU 23 12.955 5.229 1.423 172 HG LEU 23 HG LEU 23 10.891 6.565 -0.321 173 HD11 LEU 23 HD11 LEU 23 10.948 4.212 -0.820 174 HD12 LEU 23 HD12 LEU 23 9.515 4.587 0.139 175 HD13 LEU 23 HD13 LEU 23 10.908 3.818 0.898 176 HD21 LEU 23 HD21 LEU 23 11.064 5.951 2.614 177 HD22 LEU 23 HD22 LEU 23 9.523 6.216 1.803 178 HD23 LEU 23 HD23 LEU 23 10.735 7.497 1.825 179 HA PRO 24 HA PRO 24 17.117 7.426 2.553 180 HB2 PRO 24 HB2 PRO 24 16.601 5.606 4.763 181 HB3 PRO 24 HB1 PRO 24 17.011 7.326 4.820 182 HG2 PRO 24 HG2 PRO 24 14.594 6.354 5.528 183 HG3 PRO 24 HG1 PRO 24 14.852 7.992 4.894 184 HD2 PRO 24 HD2 PRO 24 13.797 5.571 3.504 185 HD3 PRO 24 HD1 PRO 24 13.319 7.272 3.343 186 H GLU 25 HN GLU 25 18.670 6.277 1.621 187 HA GLU 25 HA GLU 25 18.405 3.852 0.368 188 HB2 GLU 25 HB2 GLU 25 20.213 5.380 -0.097 189 HB3 GLU 25 HB1 GLU 25 20.862 5.174 1.517 190 HG2 GLU 25 HG2 GLU 25 22.202 3.927 0.016 191 HG3 GLU 25 HG1 GLU 25 21.271 2.798 0.997 192 H ASP 26 HN ASP 26 19.372 4.528 3.662 193 HA ASP 26 HA ASP 26 20.301 1.982 4.384 194 HB2 ASP 26 HB2 ASP 26 20.685 3.990 5.746 195 HB3 ASP 26 HB1 ASP 26 18.960 4.084 6.101 196 H LEU 27 HN LEU 27 17.092 3.472 4.882 197 HA LEU 27 HA LEU 27 15.890 1.179 5.992 198 HB2 LEU 27 HB2 LEU 27 15.105 3.701 5.837 199 HB3 LEU 27 HB1 LEU 27 14.261 3.112 4.415 200 HG LEU 27 HG LEU 27 13.488 1.242 6.202 201 HD11 LEU 27 HD11 LEU 27 12.938 2.371 8.311 202 HD12 LEU 27 HD12 LEU 27 13.893 3.761 7.799 203 HD13 LEU 27 HD13 LEU 27 14.674 2.203 8.062 204 HD21 LEU 27 HD21 LEU 27 12.368 3.824 5.279 205 HD22 LEU 27 HD22 LEU 27 11.550 3.021 6.617 206 HD23 LEU 27 HD23 LEU 27 11.758 2.179 5.081 207 H ILE 28 HN ILE 28 16.398 2.218 2.697 208 HA ILE 28 HA ILE 28 14.588 0.470 1.418 209 HB ILE 28 HB ILE 28 17.196 1.640 0.411 210 HG12 ILE 28 HG12 ILE 28 14.363 2.556 -0.119 211 HG13 ILE 28 HG11 ILE 28 15.408 3.266 1.107 212 HG21 ILE 28 HG21 ILE 28 15.811 -0.415 -0.767 213 HG22 ILE 28 HG22 ILE 28 16.913 0.691 -1.587 214 HG23 ILE 28 HG23 ILE 28 15.179 1.010 -1.597 215 HD11 ILE 28 HD11 ILE 28 15.866 4.706 -0.551 216 HD12 ILE 28 HD12 ILE 28 15.448 3.551 -1.817 217 HD13 ILE 28 HD13 ILE 28 17.019 3.455 -1.021 218 H LYS 29 HN LYS 29 17.655 -0.105 2.930 219 HA LYS 29 HA LYS 29 18.117 -2.590 1.500 220 HB2 LYS 29 HB2 LYS 29 19.543 -1.488 3.926 221 HB3 LYS 29 HB1 LYS 29 20.077 -2.825 2.917 222 HG2 LYS 29 HG2 LYS 29 20.339 -1.296 1.033 223 HG3 LYS 29 HG1 LYS 29 19.801 0.044 2.048 224 HD2 LYS 29 HD2 LYS 29 21.717 -0.370 3.548 225 HD3 LYS 29 HD1 LYS 29 22.269 -1.648 2.461 226 HE2 LYS 29 HE2 LYS 29 22.138 1.313 1.974 227 HE3 LYS 29 HE1 LYS 29 23.532 0.243 1.860 228 HZ1 LYS 29 HZ1 LYS 29 21.338 0.654 -0.060 229 HZ2 LYS 29 HZ2 LYS 29 22.110 -0.854 -0.010 230 HZ3 LYS 29 HZ3 LYS 29 23.007 0.539 -0.335 231 H MET 30 HN MET 30 16.736 -1.454 4.472 232 HA MET 30 HA MET 30 16.592 -4.082 5.638 233 HB2 MET 30 HB2 MET 30 15.530 -1.382 6.461 234 HB3 MET 30 HB1 MET 30 15.265 -2.851 7.395 235 HG2 MET 30 HG2 MET 30 17.198 -2.502 8.391 236 HG3 MET 30 HG1 MET 30 18.001 -2.780 6.855 237 HE1 MET 30 HE1 MET 30 15.608 0.146 7.786 238 HE2 MET 30 HE2 MET 30 16.726 1.448 8.188 239 HE3 MET 30 HE3 MET 30 16.546 0.070 9.278 240 H ALA 31 HN ALA 31 14.254 -1.674 4.450 241 HA ALA 31 HA ALA 31 11.968 -3.216 4.841 242 HB1 ALA 31 HB1 ALA 31 12.320 -1.114 2.715 243 HB2 ALA 31 HB2 ALA 31 12.022 -0.763 4.416 244 HB3 ALA 31 HB3 ALA 31 10.814 -1.634 3.472 245 H ARG 32 HN ARG 32 14.368 -3.475 2.364 246 HA ARG 32 HA ARG 32 12.689 -4.803 0.455 247 HB2 ARG 32 HB2 ARG 32 14.665 -5.151 -0.837 248 HB3 ARG 32 HB1 ARG 32 14.797 -3.548 -0.127 249 HG2 ARG 32 HG2 ARG 32 16.402 -4.267 1.441 250 HG3 ARG 32 HG1 ARG 32 16.071 -5.970 1.100 251 HD2 ARG 32 HD2 ARG 32 17.289 -3.981 -0.814 252 HD3 ARG 32 HD1 ARG 32 18.169 -5.232 0.066 253 HE ARG 32 HE ARG 32 16.475 -6.761 -1.213 254 HH11 ARG 32 HH11 ARG 32 18.137 -3.926 -2.413 255 HH12 ARG 32 HH12 ARG 32 18.126 -4.454 -4.073 256 HH21 ARG 32 HH21 ARG 32 16.450 -7.467 -3.396 257 HH22 ARG 32 HH22 ARG 32 17.176 -6.474 -4.624 258 H ASP 33 HN ASP 33 14.147 -5.712 3.342 259 HA ASP 33 HA ASP 33 14.052 -8.565 2.626 260 HB2 ASP 33 HB2 ASP 33 16.254 -7.879 3.423 261 HB3 ASP 33 HB1 ASP 33 15.542 -7.177 4.872 262 H ILE 34 HN ILE 34 12.964 -6.084 4.825 263 HA ILE 34 HA ILE 34 11.595 -7.864 6.603 264 HB ILE 34 HB ILE 34 10.908 -4.952 6.273 265 HG12 ILE 34 HG12 ILE 34 13.230 -6.120 7.817 266 HG13 ILE 34 HG11 ILE 34 13.338 -5.036 6.441 267 HG21 ILE 34 HG21 ILE 34 10.904 -6.803 8.645 268 HG22 ILE 34 HG22 ILE 34 9.489 -6.315 7.712 269 HG23 ILE 34 HG23 ILE 34 10.389 -5.119 8.645 270 HD11 ILE 34 HD11 ILE 34 13.741 -3.949 8.620 271 HD12 ILE 34 HD12 ILE 34 12.076 -4.314 9.072 272 HD13 ILE 34 HD13 ILE 34 12.407 -3.241 7.712 273 H LYS 35 HN LYS 35 9.879 -8.991 5.972 274 HA LYS 35 HA LYS 35 7.932 -7.678 4.191 275 HB2 LYS 35 HB2 LYS 35 8.665 -10.610 4.332 276 HB3 LYS 35 HB1 LYS 35 7.368 -9.948 3.345 277 HG2 LYS 35 HG2 LYS 35 8.844 -8.875 1.904 278 HG3 LYS 35 HG1 LYS 35 10.178 -8.962 3.058 279 HD2 LYS 35 HD2 LYS 35 8.939 -11.422 1.849 280 HD3 LYS 35 HD1 LYS 35 10.271 -10.553 1.077 281 HE2 LYS 35 HE2 LYS 35 11.653 -10.892 3.044 282 HE3 LYS 35 HE1 LYS 35 10.317 -11.692 3.872 283 HZ1 LYS 35 HZ1 LYS 35 11.580 -12.667 1.374 284 HZ2 LYS 35 HZ2 LYS 35 10.389 -13.462 2.273 285 HZ3 LYS 35 HZ3 LYS 35 11.937 -13.246 2.920 286 HA PRO 36 HA PRO 36 5.752 -8.723 8.133 287 HB2 PRO 36 HB2 PRO 36 4.609 -6.337 8.541 288 HB3 PRO 36 HB1 PRO 36 6.326 -6.584 8.924 289 HG2 PRO 36 HG2 PRO 36 5.096 -5.308 6.525 290 HG3 PRO 36 HG1 PRO 36 6.476 -4.772 7.505 291 HD2 PRO 36 HD2 PRO 36 6.746 -6.115 5.144 292 HD3 PRO 36 HD1 PRO 36 7.943 -6.170 6.447 293 H ILE 37 HN ILE 37 3.288 -8.175 8.556 294 HA ILE 37 HA ILE 37 1.924 -8.799 6.040 295 HB ILE 37 HB ILE 37 1.722 -10.438 7.882 296 HG12 ILE 37 HG12 ILE 37 -0.140 -9.718 6.095 297 HG13 ILE 37 HG11 ILE 37 -0.390 -11.011 7.264 298 HG21 ILE 37 HG21 ILE 37 0.291 -9.914 9.817 299 HG22 ILE 37 HG22 ILE 37 0.268 -8.224 9.318 300 HG23 ILE 37 HG23 ILE 37 1.787 -8.981 9.796 301 HD11 ILE 37 HD11 ILE 37 -1.249 -8.179 7.774 302 HD12 ILE 37 HD12 ILE 37 -1.722 -9.638 8.648 303 HD13 ILE 37 HD13 ILE 37 -2.281 -9.377 6.994 304 H VAL 38 HN VAL 38 0.200 -7.597 5.314 305 HA VAL 38 HA VAL 38 -0.035 -4.939 6.508 306 HB VAL 38 HB VAL 38 -1.344 -5.909 3.964 307 HG11 VAL 38 HG11 VAL 38 -2.255 -3.851 5.010 308 HG12 VAL 38 HG12 VAL 38 -1.548 -3.566 3.419 309 HG13 VAL 38 HG13 VAL 38 -0.661 -3.114 4.873 310 HG21 VAL 38 HG21 VAL 38 1.367 -4.654 4.350 311 HG22 VAL 38 HG22 VAL 38 0.536 -4.748 2.798 312 HG23 VAL 38 HG23 VAL 38 0.997 -6.227 3.644 313 H GLU 39 HN GLU 39 -1.401 -4.911 8.171 314 HA GLU 39 HA GLU 39 -3.812 -6.519 8.146 315 HB2 GLU 39 HB2 GLU 39 -2.214 -5.106 10.159 316 HB3 GLU 39 HB1 GLU 39 -3.949 -4.968 10.415 317 HG2 GLU 39 HG2 GLU 39 -4.216 -7.257 10.682 318 HG3 GLU 39 HG1 GLU 39 -2.684 -7.619 9.891 319 H ILE 40 HN ILE 40 -5.747 -5.812 7.563 320 HA ILE 40 HA ILE 40 -6.269 -2.934 7.601 321 HB ILE 40 HB ILE 40 -5.592 -3.405 5.313 322 HG12 ILE 40 HG12 ILE 40 -7.705 -1.954 5.939 323 HG13 ILE 40 HG11 ILE 40 -7.293 -2.259 4.258 324 HG21 ILE 40 HG21 ILE 40 -6.016 -5.779 5.235 325 HG22 ILE 40 HG22 ILE 40 -6.815 -4.969 3.886 326 HG23 ILE 40 HG23 ILE 40 -7.753 -5.489 5.286 327 HD11 ILE 40 HD11 ILE 40 -9.699 -2.486 4.731 328 HD12 ILE 40 HD12 ILE 40 -9.335 -3.811 5.835 329 HD13 ILE 40 HD13 ILE 40 -8.982 -3.977 4.114 330 H GLN 41 HN GLN 41 -8.179 -2.445 8.432 331 HA GLN 41 HA GLN 41 -10.204 -4.570 8.627 332 HB2 GLN 41 HB2 GLN 41 -10.810 -3.788 10.840 333 HB3 GLN 41 HB1 GLN 41 -9.097 -4.171 10.813 334 HG2 GLN 41 HG2 GLN 41 -8.599 -1.771 10.535 335 HG3 GLN 41 HG1 GLN 41 -10.319 -1.430 10.687 336 HE21 GLN 41 HE21 GLN 41 -11.326 -1.682 12.676 337 HE22 GLN 41 HE22 GLN 41 -10.429 -1.816 14.149 338 H GLN 42 HN GLN 42 -12.357 -3.906 8.427 339 HA GLN 42 HA GLN 42 -12.720 -1.097 7.664 340 HB2 GLN 42 HB2 GLN 42 -13.662 -1.554 5.653 341 HB3 GLN 42 HB1 GLN 42 -12.666 -2.997 5.769 342 HG2 GLN 42 HG2 GLN 42 -14.574 -4.242 6.632 343 HG3 GLN 42 HG1 GLN 42 -15.570 -2.799 6.525 344 HE21 GLN 42 HE21 GLN 42 -16.389 -2.171 4.582 345 HE22 GLN 42 HE22 GLN 42 -16.229 -3.102 3.135 346 H LYS 43 HN LYS 43 -15.001 -0.476 7.611 347 HA LYS 43 HA LYS 43 -16.842 -1.943 9.293 348 HB2 LYS 43 HB2 LYS 43 -15.286 -0.542 10.796 349 HB3 LYS 43 HB1 LYS 43 -16.074 0.865 10.098 350 HG2 LYS 43 HG2 LYS 43 -18.156 0.288 11.050 351 HG3 LYS 43 HG1 LYS 43 -17.591 -1.331 11.473 352 HD2 LYS 43 HD2 LYS 43 -16.112 -0.462 13.133 353 HD3 LYS 43 HD1 LYS 43 -16.384 1.190 12.591 354 HE2 LYS 43 HE2 LYS 43 -18.715 1.052 13.316 355 HE3 LYS 43 HE1 LYS 43 -18.449 -0.606 13.845 356 HZ1 LYS 43 HZ1 LYS 43 -16.765 0.244 15.406 357 HZ2 LYS 43 HZ2 LYS 43 -18.312 0.850 15.717 358 HZ3 LYS 43 HZ3 LYS 43 -17.162 1.824 14.954 359 H GLY 44 HN GLY 44 -17.925 -1.950 7.265 360 HA2 GLY 44 HA2 GLY 44 -19.708 -1.129 6.008 361 HA3 GLY 44 HA1 GLY 44 -19.535 0.425 6.821 362 H ASP 45 HN ASP 45 -18.621 2.042 5.707 363 HA ASP 45 HA ASP 45 -17.204 1.351 3.222 364 HB2 ASP 45 HB2 ASP 45 -18.675 3.875 4.015 365 HB3 ASP 45 HB1 ASP 45 -17.712 3.725 2.550 366 H ASP 46 HN ASP 46 -16.680 2.289 6.336 367 HA ASP 46 HA ASP 46 -14.429 4.058 5.759 368 HB2 ASP 46 HB2 ASP 46 -15.787 3.218 8.313 369 HB3 ASP 46 HB1 ASP 46 -14.241 4.062 8.320 370 H PHE 47 HN PHE 47 -12.367 3.402 5.727 371 HA PHE 47 HA PHE 47 -11.809 0.650 6.642 372 HB2 PHE 47 HB2 PHE 47 -10.730 2.191 4.292 373 HB3 PHE 47 HB1 PHE 47 -9.880 0.800 4.946 374 HD1 PHE 47 HD1 PHE 47 -13.482 1.476 4.281 375 HD2 PHE 47 HD2 PHE 47 -10.090 -0.964 3.508 376 HE1 PHE 47 HE1 PHE 47 -14.872 -0.012 2.894 377 HE2 PHE 47 HE2 PHE 47 -11.469 -2.456 2.126 378 HZ PHE 47 HZ PHE 47 -13.866 -1.987 1.818 379 H VAL 48 HN VAL 48 -9.844 0.225 7.627 380 HA VAL 48 HA VAL 48 -8.219 2.527 8.467 381 HB VAL 48 HB VAL 48 -9.043 0.305 10.351 382 HG11 VAL 48 HG11 VAL 48 -8.010 1.671 12.063 383 HG12 VAL 48 HG12 VAL 48 -7.632 2.921 10.880 384 HG13 VAL 48 HG13 VAL 48 -6.850 1.343 10.778 385 HG21 VAL 48 HG21 VAL 48 -10.986 1.681 9.872 386 HG22 VAL 48 HG22 VAL 48 -10.054 3.141 10.214 387 HG23 VAL 48 HG23 VAL 48 -10.398 1.990 11.508 388 H VAL 49 HN VAL 49 -6.431 2.073 7.382 389 HA VAL 49 HA VAL 49 -5.458 -0.675 7.176 390 HB VAL 49 HB VAL 49 -4.323 1.884 6.019 391 HG11 VAL 49 HG11 VAL 49 -2.585 0.213 6.289 392 HG12 VAL 49 HG12 VAL 49 -3.002 0.375 4.583 393 HG13 VAL 49 HG13 VAL 49 -3.600 -1.003 5.508 394 HG21 VAL 49 HG21 VAL 49 -5.410 1.373 4.016 395 HG22 VAL 49 HG22 VAL 49 -6.626 1.000 5.240 396 HG23 VAL 49 HG23 VAL 49 -5.698 -0.299 4.487 397 H THR 50 HN THR 50 -3.815 -1.494 8.308 398 HA THR 50 HA THR 50 -2.352 0.302 10.129 399 HB THR 50 HB THR 50 -3.273 -2.542 10.579 400 HG1 THR 50 HG1 THR 50 -4.781 -0.667 10.805 401 HG21 THR 50 HG21 THR 50 -2.351 -2.292 12.853 402 HG22 THR 50 HG22 THR 50 -1.677 -0.730 12.390 403 HG23 THR 50 HG23 THR 50 -1.098 -2.202 11.615 404 H SER 51 HN SER 51 -0.372 0.541 9.278 405 HA SER 51 HA SER 51 0.976 -1.808 8.131 406 HB2 SER 51 HB2 SER 51 1.956 1.026 7.888 407 HB3 SER 51 HB1 SER 51 2.252 -0.340 6.815 408 HG SER 51 HG SER 51 -0.105 -0.235 6.419 409 H LYS 52 HN LYS 52 2.378 -2.796 9.389 410 HA LYS 52 HA LYS 52 3.407 -1.477 11.775 411 HB2 LYS 52 HB2 LYS 52 3.435 -4.359 10.852 412 HB3 LYS 52 HB1 LYS 52 4.243 -3.809 12.314 413 HG2 LYS 52 HG2 LYS 52 2.201 -3.251 13.352 414 HG3 LYS 52 HG1 LYS 52 1.310 -3.365 11.836 415 HD2 LYS 52 HD2 LYS 52 1.548 -5.740 11.788 416 HD3 LYS 52 HD1 LYS 52 2.687 -5.705 13.135 417 HE2 LYS 52 HE2 LYS 52 0.950 -4.956 14.637 418 HE3 LYS 52 HE1 LYS 52 -0.196 -4.833 13.303 419 HZ1 LYS 52 HZ1 LYS 52 -0.361 -7.123 13.124 420 HZ2 LYS 52 HZ2 LYS 52 -0.259 -6.895 14.801 421 HZ3 LYS 52 HZ3 LYS 52 1.099 -7.408 13.938 422 H THR 53 HN THR 53 5.438 -0.721 11.918 423 HA THR 53 HA THR 53 7.446 -1.676 9.989 424 HB THR 53 HB THR 53 8.159 0.501 9.423 425 HG1 THR 53 HG1 THR 53 6.542 2.132 10.795 426 HG21 THR 53 HG21 THR 53 5.147 0.561 9.589 427 HG22 THR 53 HG22 THR 53 6.124 -0.018 8.241 428 HG23 THR 53 HG23 THR 53 6.122 1.696 8.651 429 HA PRO 54 HA PRO 54 10.418 -1.879 13.299 430 HB2 PRO 54 HB2 PRO 54 12.161 -0.123 11.616 431 HB3 PRO 54 HB1 PRO 54 12.517 -1.706 12.341 432 HG2 PRO 54 HG2 PRO 54 12.070 -1.534 9.768 433 HG3 PRO 54 HG1 PRO 54 11.361 -2.860 10.711 434 HD2 PRO 54 HD2 PRO 54 10.053 -0.378 9.691 435 HD3 PRO 54 HD1 PRO 54 9.438 -2.043 9.733 436 H ARG 55 HN ARG 55 9.737 1.207 11.844 437 HA ARG 55 HA ARG 55 10.810 2.799 13.969 438 HB2 ARG 55 HB2 ARG 55 9.062 3.388 11.584 439 HB3 ARG 55 HB1 ARG 55 9.433 4.619 12.786 440 HG2 ARG 55 HG2 ARG 55 11.775 4.466 12.309 441 HG3 ARG 55 HG1 ARG 55 11.512 3.095 11.230 442 HD2 ARG 55 HD2 ARG 55 11.843 5.202 10.006 443 HD3 ARG 55 HD1 ARG 55 10.254 4.498 9.704 444 HE ARG 55 HE ARG 55 9.963 6.282 11.810 445 HH11 ARG 55 HH11 ARG 55 10.881 6.451 8.428 446 HH12 ARG 55 HH12 ARG 55 10.244 8.049 8.212 447 HH21 ARG 55 HH21 ARG 55 9.146 8.385 11.519 448 HH22 ARG 55 HH22 ARG 55 9.282 9.159 9.970 449 H GLN 56 HN GLN 56 7.496 2.462 12.746 450 HA GLN 56 HA GLN 56 6.321 1.851 15.231 451 HB2 GLN 56 HB2 GLN 56 7.002 4.375 15.423 452 HB3 GLN 56 HB1 GLN 56 5.631 4.637 14.354 453 HG2 GLN 56 HG2 GLN 56 4.170 3.542 15.990 454 HG3 GLN 56 HG1 GLN 56 5.551 3.334 17.067 455 HE21 GLN 56 HE21 GLN 56 6.711 5.919 16.369 456 HE22 GLN 56 HE22 GLN 56 5.736 7.112 17.156 457 H THR 57 HN THR 57 4.157 1.312 14.964 458 HA THR 57 HA THR 57 3.313 0.794 12.296 459 HB THR 57 HB THR 57 1.705 0.636 14.863 460 HG1 THR 57 HG1 THR 57 3.799 -0.710 14.405 461 HG21 THR 57 HG21 THR 57 0.310 0.619 12.854 462 HG22 THR 57 HG22 THR 57 0.316 -0.963 13.629 463 HG23 THR 57 HG23 THR 57 1.281 -0.689 12.179 464 H VAL 58 HN VAL 58 2.088 2.008 10.980 465 HA VAL 58 HA VAL 58 0.972 4.494 12.081 466 HB VAL 58 HB VAL 58 1.002 5.385 9.811 467 HG11 VAL 58 HG11 VAL 58 3.601 4.231 10.785 468 HG12 VAL 58 HG12 VAL 58 2.945 5.844 11.082 469 HG13 VAL 58 HG13 VAL 58 3.489 5.395 9.463 470 HG21 VAL 58 HG21 VAL 58 0.669 3.232 8.629 471 HG22 VAL 58 HG22 VAL 58 2.347 2.817 8.982 472 HG23 VAL 58 HG23 VAL 58 1.979 4.202 7.958 473 H THR 59 HN THR 59 -1.084 5.230 11.203 474 HA THR 59 HA THR 59 -2.783 3.014 10.286 475 HB THR 59 HB THR 59 -3.125 3.538 12.717 476 HG1 THR 59 HG1 THR 59 -4.808 2.570 11.636 477 HG21 THR 59 HG21 THR 59 -2.871 5.856 12.927 478 HG22 THR 59 HG22 THR 59 -4.605 5.604 13.097 479 HG23 THR 59 HG23 THR 59 -3.947 6.188 11.571 480 H ASN 60 HN ASN 60 -4.077 3.456 8.634 481 HA ASN 60 HA ASN 60 -4.349 6.256 7.717 482 HB2 ASN 60 HB2 ASN 60 -3.668 3.752 6.182 483 HB3 ASN 60 HB1 ASN 60 -4.495 5.082 5.378 484 HD21 ASN 60 HD21 ASN 60 -1.770 3.912 5.084 485 HD22 ASN 60 HD22 ASN 60 -0.695 5.254 5.242 486 H SER 61 HN SER 61 -6.484 6.822 7.757 487 HA SER 61 HA SER 61 -8.431 4.649 7.359 488 HB2 SER 61 HB2 SER 61 -9.143 6.971 9.104 489 HB3 SER 61 HB1 SER 61 -9.752 5.316 9.123 490 HG SER 61 HG SER 61 -7.099 6.008 9.853 491 H PHE 62 HN PHE 62 -10.238 5.075 6.143 492 HA PHE 62 HA PHE 62 -10.769 7.750 5.202 493 HB2 PHE 62 HB2 PHE 62 -10.553 6.964 2.759 494 HB3 PHE 62 HB1 PHE 62 -9.076 7.359 3.624 495 HD1 PHE 62 HD2 PHE 62 -11.076 4.671 2.168 496 HD2 PHE 62 HD1 PHE 62 -7.478 5.660 4.213 497 HE1 PHE 62 HE2 PHE 62 -10.156 2.460 1.613 498 HE2 PHE 62 HE1 PHE 62 -6.550 3.449 3.654 499 HZ PHE 62 HZ PHE 62 -7.890 1.850 2.352 500 H THR 63 HN THR 63 -12.552 7.679 3.498 501 HA THR 63 HA THR 63 -14.406 5.475 4.108 502 HB THR 63 HB THR 63 -15.292 8.269 3.417 503 HG1 THR 63 HG1 THR 63 -14.976 7.201 6.058 504 HG21 THR 63 HG21 THR 63 -16.668 6.024 4.903 505 HG22 THR 63 HG22 THR 63 -16.944 6.449 3.211 506 HG23 THR 63 HG23 THR 63 -17.368 7.588 4.489 507 H LEU 64 HN LEU 64 -15.179 4.410 2.392 508 HA LEU 64 HA LEU 64 -14.141 4.803 -0.172 509 HB2 LEU 64 HB2 LEU 64 -16.591 3.295 0.725 510 HB3 LEU 64 HB1 LEU 64 -15.916 3.207 -0.890 511 HG LEU 64 HG LEU 64 -14.664 2.244 1.674 512 HD11 LEU 64 HD11 LEU 64 -15.574 0.906 -0.861 513 HD12 LEU 64 HD12 LEU 64 -16.250 0.711 0.755 514 HD13 LEU 64 HD13 LEU 64 -14.635 0.100 0.394 515 HD21 LEU 64 HD21 LEU 64 -13.440 2.523 -1.071 516 HD22 LEU 64 HD22 LEU 64 -12.768 1.525 0.219 517 HD23 LEU 64 HD23 LEU 64 -12.893 3.270 0.430 518 H GLY 65 HN GLY 65 -14.690 6.047 -1.824 519 HA2 GLY 65 HA2 GLY 65 -16.121 7.202 -3.271 520 HA3 GLY 65 HA1 GLY 65 -17.415 7.037 -2.092 521 H LYS 66 HN LYS 66 -14.694 8.034 -0.501 522 HA LYS 66 HA LYS 66 -15.252 10.881 -0.919 523 HB2 LYS 66 HB2 LYS 66 -15.421 9.331 1.629 524 HB3 LYS 66 HB1 LYS 66 -14.785 10.969 1.693 525 HG2 LYS 66 HG2 LYS 66 -17.011 11.332 2.101 526 HG3 LYS 66 HG1 LYS 66 -16.953 11.544 0.353 527 HD2 LYS 66 HD2 LYS 66 -17.524 9.052 0.217 528 HD3 LYS 66 HD1 LYS 66 -17.966 9.194 1.918 529 HE2 LYS 66 HE2 LYS 66 -19.927 9.466 0.529 530 HE3 LYS 66 HE1 LYS 66 -19.548 10.984 1.342 531 HZ1 LYS 66 HZ1 LYS 66 -18.622 11.852 -0.658 532 HZ2 LYS 66 HZ2 LYS 66 -20.135 11.207 -1.049 533 HZ3 LYS 66 HZ3 LYS 66 -18.727 10.357 -1.443 534 H GLU 67 HN GLU 67 -13.552 12.246 0.088 535 HA GLU 67 HA GLU 67 -10.923 11.018 -0.338 536 HB2 GLU 67 HB2 GLU 67 -11.356 12.903 -1.790 537 HB3 GLU 67 HB1 GLU 67 -11.882 13.886 -0.433 538 HG2 GLU 67 HG2 GLU 67 -9.445 13.414 0.436 539 HG3 GLU 67 HG1 GLU 67 -9.131 13.152 -1.283 540 H ALA 68 HN ALA 68 -9.613 10.749 1.373 541 HA ALA 68 HA ALA 68 -10.157 12.335 3.783 542 HB1 ALA 68 HB1 ALA 68 -11.192 10.185 4.158 543 HB2 ALA 68 HB2 ALA 68 -9.757 10.330 5.173 544 HB3 ALA 68 HB3 ALA 68 -9.705 9.354 3.705 545 H ASP 69 HN ASP 69 -8.409 12.885 4.994 546 HA ASP 69 HA ASP 69 -5.862 12.815 3.661 547 HB2 ASP 69 HB2 ASP 69 -6.341 14.849 4.757 548 HB3 ASP 69 HB1 ASP 69 -6.868 14.034 6.222 549 H ILE 70 HN ILE 70 -4.340 11.388 3.938 550 HA ILE 70 HA ILE 70 -4.298 9.753 6.379 551 HB ILE 70 HB ILE 70 -3.470 7.845 4.890 552 HG12 ILE 70 HG12 ILE 70 -4.789 8.098 2.586 553 HG13 ILE 70 HG11 ILE 70 -4.390 9.793 2.844 554 HG21 ILE 70 HG21 ILE 70 -6.293 8.805 5.053 555 HG22 ILE 70 HG22 ILE 70 -5.517 7.448 5.870 556 HG23 ILE 70 HG23 ILE 70 -5.918 7.333 4.157 557 HD11 ILE 70 HD11 ILE 70 -2.409 7.525 2.753 558 HD12 ILE 70 HD12 ILE 70 -2.032 9.234 2.972 559 HD13 ILE 70 HD13 ILE 70 -2.731 8.674 1.453 560 H THR 71 HN THR 71 -2.075 8.635 6.595 561 HA THR 71 HA THR 71 -0.060 10.507 5.508 562 HB THR 71 HB THR 71 0.118 9.353 8.272 563 HG1 THR 71 HG1 THR 71 -1.727 10.900 7.738 564 HG21 THR 71 HG21 THR 71 1.796 11.064 8.615 565 HG22 THR 71 HG22 THR 71 1.485 11.741 7.018 566 HG23 THR 71 HG23 THR 71 2.208 10.143 7.172 567 H THR 72 HN THR 72 1.655 9.677 4.585 568 HA THR 72 HA THR 72 1.994 6.797 4.548 569 HB THR 72 HB THR 72 2.210 8.082 2.428 570 HG1 THR 72 HG1 THR 72 4.446 7.228 1.944 571 HG21 THR 72 HG21 THR 72 4.684 9.258 3.695 572 HG22 THR 72 HG22 THR 72 3.192 10.130 3.347 573 HG23 THR 72 HG23 THR 72 4.162 9.485 2.023 574 H MET 73 HN MET 73 4.023 5.790 5.113 575 HA MET 73 HA MET 73 5.087 6.783 7.551 576 HB2 MET 73 HB2 MET 73 6.757 4.880 7.274 577 HB3 MET 73 HB1 MET 73 5.062 4.438 7.372 578 HG2 MET 73 HG2 MET 73 6.226 4.853 4.683 579 HG3 MET 73 HG1 MET 73 6.698 3.409 5.570 580 HE1 MET 73 HE1 MET 73 3.636 2.822 7.152 581 HE2 MET 73 HE2 MET 73 5.035 1.853 6.698 582 HE3 MET 73 HE3 MET 73 3.446 1.457 6.050 583 H ASP 74 HN ASP 74 5.799 7.555 4.354 584 HA ASP 74 HA ASP 74 8.583 8.118 4.647 585 HB2 ASP 74 HB2 ASP 74 7.905 7.819 2.423 586 HB3 ASP 74 HB1 ASP 74 6.485 8.839 2.615 587 H GLY 75 HN GLY 75 5.641 9.772 5.376 588 HA2 GLY 75 HA2 GLY 75 5.657 11.491 7.054 589 HA3 GLY 75 HA1 GLY 75 7.219 12.011 6.446 590 H LYS 76 HN LYS 76 4.549 11.248 4.326 591 HA LYS 76 HA LYS 76 4.315 14.110 3.700 592 HB2 LYS 76 HB2 LYS 76 4.148 11.707 1.883 593 HB3 LYS 76 HB1 LYS 76 3.707 13.326 1.391 594 HG2 LYS 76 HG2 LYS 76 6.252 13.582 2.484 595 HG3 LYS 76 HG1 LYS 76 6.301 12.100 1.536 596 HD2 LYS 76 HD2 LYS 76 5.314 13.388 -0.371 597 HD3 LYS 76 HD1 LYS 76 5.531 14.851 0.594 598 HE2 LYS 76 HE2 LYS 76 7.389 14.572 -0.939 599 HE3 LYS 76 HE1 LYS 76 7.941 14.386 0.722 600 HZ1 LYS 76 HZ1 LYS 76 7.430 12.222 -1.234 601 HZ2 LYS 76 HZ2 LYS 76 7.783 11.947 0.400 602 HZ3 LYS 76 HZ3 LYS 76 8.926 12.694 -0.604 603 H LYS 77 HN LYS 77 2.276 14.937 3.333 604 HA LYS 77 HA LYS 77 0.080 13.307 4.362 605 HB2 LYS 77 HB2 LYS 77 0.560 16.237 4.047 606 HB3 LYS 77 HB1 LYS 77 -1.102 15.667 4.039 607 HG2 LYS 77 HG2 LYS 77 0.926 15.391 6.240 608 HG3 LYS 77 HG1 LYS 77 -0.574 16.320 6.257 609 HD2 LYS 77 HD2 LYS 77 -1.727 14.055 5.846 610 HD3 LYS 77 HD1 LYS 77 -0.192 13.346 6.351 611 HE2 LYS 77 HE2 LYS 77 -1.391 13.422 8.330 612 HE3 LYS 77 HE1 LYS 77 -0.426 14.893 8.405 613 HZ1 LYS 77 HZ1 LYS 77 -3.275 14.705 7.578 614 HZ2 LYS 77 HZ2 LYS 77 -2.360 16.131 7.591 615 HZ3 LYS 77 HZ3 LYS 77 -2.702 15.336 9.044 616 H LEU 78 HN LEU 78 -1.040 12.189 2.953 617 HA LEU 78 HA LEU 78 -1.459 13.337 0.271 618 HB2 LEU 78 HB2 LEU 78 -1.451 10.401 0.958 619 HB3 LEU 78 HB1 LEU 78 -1.514 11.116 -0.639 620 HG LEU 78 HG LEU 78 0.858 11.434 1.194 621 HD11 LEU 78 HD11 LEU 78 1.920 9.665 -0.174 622 HD12 LEU 78 HD12 LEU 78 0.356 9.355 -0.933 623 HD13 LEU 78 HD13 LEU 78 0.570 9.074 0.797 624 HD21 LEU 78 HD21 LEU 78 1.217 13.017 -0.383 625 HD22 LEU 78 HD22 LEU 78 0.174 12.236 -1.568 626 HD23 LEU 78 HD23 LEU 78 1.811 11.635 -1.300 627 H LYS 79 HN LYS 79 -3.464 12.882 -0.742 628 HA LYS 79 HA LYS 79 -5.617 12.329 1.189 629 HB2 LYS 79 HB2 LYS 79 -5.754 13.973 -1.344 630 HB3 LYS 79 HB1 LYS 79 -7.085 13.668 -0.238 631 HG2 LYS 79 HG2 LYS 79 -5.806 14.849 1.535 632 HG3 LYS 79 HG1 LYS 79 -4.591 15.263 0.323 633 HD2 LYS 79 HD2 LYS 79 -7.515 15.984 0.098 634 HD3 LYS 79 HD1 LYS 79 -6.282 17.056 0.758 635 HE2 LYS 79 HE2 LYS 79 -5.349 17.481 -1.273 636 HE3 LYS 79 HE1 LYS 79 -5.739 15.880 -1.901 637 HZ1 LYS 79 HZ1 LYS 79 -8.083 16.599 -2.042 638 HZ2 LYS 79 HZ2 LYS 79 -7.052 17.513 -3.031 639 HZ3 LYS 79 HZ3 LYS 79 -7.611 18.160 -1.572 640 H CYS 80 HN CYS 80 -6.394 10.358 0.904 641 HA CYS 80 HA CYS 80 -6.126 9.124 -1.717 642 HB2 CYS 80 HB2 CYS 80 -5.424 7.794 0.195 643 HB3 CYS 80 HB1 CYS 80 -7.024 7.947 0.913 644 H THR 81 HN THR 81 -7.654 9.522 -3.119 645 HA THR 81 HA THR 81 -10.446 9.689 -2.246 646 HB THR 81 HB THR 81 -9.617 10.049 -5.098 647 HG1 THR 81 HG1 THR 81 -8.679 11.538 -2.982 648 HG21 THR 81 HG21 THR 81 -11.983 10.185 -4.365 649 HG22 THR 81 HG22 THR 81 -11.397 11.677 -5.104 650 HG23 THR 81 HG23 THR 81 -11.558 11.563 -3.350 651 H VAL 82 HN VAL 82 -10.514 7.465 -1.763 652 HA VAL 82 HA VAL 82 -10.222 5.591 -4.001 653 HB VAL 82 HB VAL 82 -8.919 5.182 -1.925 654 HG11 VAL 82 HG11 VAL 82 -10.511 6.094 -0.354 655 HG12 VAL 82 HG12 VAL 82 -10.056 4.444 0.082 656 HG13 VAL 82 HG13 VAL 82 -11.616 4.761 -0.683 657 HG21 VAL 82 HG21 VAL 82 -10.989 3.046 -2.373 658 HG22 VAL 82 HG22 VAL 82 -9.346 2.842 -1.762 659 HG23 VAL 82 HG23 VAL 82 -9.612 3.329 -3.436 660 H HIS 83 HN HIS 83 -11.752 3.932 -4.298 661 HA HIS 83 HA HIS 83 -14.288 3.987 -2.974 662 HB2 HIS 83 HB2 HIS 83 -15.647 4.439 -4.972 663 HB3 HIS 83 HB1 HIS 83 -14.624 5.812 -4.588 664 HD1 HIS 83 HD1 HIS 83 -15.625 3.741 -7.352 665 HD2 HIS 83 HD2 HIS 83 -12.191 5.855 -6.321 666 HE1 HIS 83 HE1 HIS 83 -14.337 4.029 -9.489 667 HE2 HIS 83 HE2 HIS 83 -12.356 5.455 -8.872 668 H LEU 84 HN LEU 84 -15.556 2.129 -3.502 669 HA LEU 84 HA LEU 84 -13.896 -0.048 -4.497 670 HB2 LEU 84 HB2 LEU 84 -15.057 -0.329 -2.364 671 HB3 LEU 84 HB1 LEU 84 -16.601 -0.080 -3.159 672 HG LEU 84 HG LEU 84 -15.861 -2.147 -4.602 673 HD11 LEU 84 HD11 LEU 84 -14.329 -2.629 -2.054 674 HD12 LEU 84 HD12 LEU 84 -13.592 -2.204 -3.599 675 HD13 LEU 84 HD13 LEU 84 -14.477 -3.720 -3.432 676 HD21 LEU 84 HD21 LEU 84 -16.770 -2.445 -1.743 677 HD22 LEU 84 HD22 LEU 84 -17.007 -3.606 -3.048 678 HD23 LEU 84 HD23 LEU 84 -17.803 -2.036 -3.111 679 H ALA 85 HN ALA 85 -13.906 -0.193 -6.643 680 HA ALA 85 HA ALA 85 -16.504 -0.057 -8.020 681 HB1 ALA 85 HB1 ALA 85 -15.264 0.582 -10.039 682 HB2 ALA 85 HB2 ALA 85 -13.750 0.507 -9.133 683 HB3 ALA 85 HB3 ALA 85 -14.967 1.718 -8.720 684 H ASN 86 HN ASN 86 -17.246 -1.958 -8.608 685 HA ASN 86 HA ASN 86 -17.407 -4.090 -9.362 686 HB2 ASN 86 HB2 ASN 86 -14.658 -3.494 -10.464 687 HB3 ASN 86 HB1 ASN 86 -15.512 -5.002 -10.764 688 HD21 ASN 86 HD21 ASN 86 -14.962 -1.902 -11.849 689 HD22 ASN 86 HD22 ASN 86 -16.269 -1.783 -12.975 690 H GLY 87 HN GLY 87 -16.183 -3.427 -6.715 691 HA2 GLY 87 HA2 GLY 87 -15.674 -4.855 -4.935 692 HA3 GLY 87 HA1 GLY 87 -15.332 -6.134 -6.094 693 H LYS 88 HN LYS 88 -13.825 -3.244 -6.936 694 HA LYS 88 HA LYS 88 -11.323 -4.108 -5.656 695 HB2 LYS 88 HB2 LYS 88 -11.786 -3.027 -8.434 696 HB3 LYS 88 HB1 LYS 88 -10.196 -3.023 -7.686 697 HG2 LYS 88 HG2 LYS 88 -10.173 -4.962 -8.952 698 HG3 LYS 88 HG1 LYS 88 -10.597 -5.550 -7.342 699 HD2 LYS 88 HD2 LYS 88 -13.048 -5.112 -8.237 700 HD3 LYS 88 HD1 LYS 88 -12.258 -5.358 -9.797 701 HE2 LYS 88 HE2 LYS 88 -11.396 -7.361 -7.928 702 HE3 LYS 88 HE1 LYS 88 -13.159 -7.313 -7.988 703 HZ1 LYS 88 HZ1 LYS 88 -12.153 -8.834 -9.621 704 HZ2 LYS 88 HZ2 LYS 88 -11.397 -7.514 -10.374 705 HZ3 LYS 88 HZ3 LYS 88 -13.088 -7.622 -10.344 706 H LEU 89 HN LEU 89 -9.994 -2.504 -4.801 707 HA LEU 89 HA LEU 89 -11.365 0.021 -4.327 708 HB2 LEU 89 HB2 LEU 89 -9.700 -1.629 -2.780 709 HB3 LEU 89 HB1 LEU 89 -8.782 -0.162 -3.069 710 HG LEU 89 HG LEU 89 -10.493 1.183 -2.068 711 HD11 LEU 89 HD11 LEU 89 -12.549 0.367 -2.641 712 HD12 LEU 89 HD12 LEU 89 -12.443 -0.166 -0.961 713 HD13 LEU 89 HD13 LEU 89 -12.107 -1.299 -2.270 714 HD21 LEU 89 HD21 LEU 89 -10.036 -1.245 -0.362 715 HD22 LEU 89 HD22 LEU 89 -10.469 0.372 0.201 716 HD23 LEU 89 HD23 LEU 89 -8.903 0.090 -0.567 717 H VAL 90 HN VAL 90 -10.880 1.817 -5.342 718 HA VAL 90 HA VAL 90 -8.340 1.917 -6.823 719 HB VAL 90 HB VAL 90 -10.805 3.418 -7.665 720 HG11 VAL 90 HG11 VAL 90 -9.627 3.500 -9.819 721 HG12 VAL 90 HG12 VAL 90 -8.293 2.591 -9.113 722 HG13 VAL 90 HG13 VAL 90 -8.664 4.208 -8.522 723 HG21 VAL 90 HG21 VAL 90 -9.931 0.757 -8.783 724 HG22 VAL 90 HG22 VAL 90 -11.363 1.692 -9.220 725 HG23 VAL 90 HG23 VAL 90 -11.244 0.949 -7.624 726 H CYS 91 HN CYS 91 -7.106 3.120 -5.460 727 HA CYS 91 HA CYS 91 -8.172 5.702 -4.548 728 HB2 CYS 91 HB2 CYS 91 -7.080 4.287 -2.816 729 HB3 CYS 91 HB1 CYS 91 -5.588 4.333 -3.750 730 H LYS 92 HN LYS 92 -8.009 7.041 -6.235 731 HA LYS 92 HA LYS 92 -5.488 7.024 -7.744 732 HB2 LYS 92 HB2 LYS 92 -7.432 6.590 -9.134 733 HB3 LYS 92 HB1 LYS 92 -8.235 8.031 -8.528 734 HG2 LYS 92 HG2 LYS 92 -6.798 9.461 -9.698 735 HG3 LYS 92 HG1 LYS 92 -5.626 8.178 -9.998 736 HD2 LYS 92 HD2 LYS 92 -6.707 8.451 -12.047 737 HD3 LYS 92 HD1 LYS 92 -7.500 7.048 -11.334 738 HE2 LYS 92 HE2 LYS 92 -9.389 8.371 -10.684 739 HE3 LYS 92 HE1 LYS 92 -8.567 9.860 -11.148 740 HZ1 LYS 92 HZ1 LYS 92 -9.974 9.423 -12.921 741 HZ2 LYS 92 HZ2 LYS 92 -9.690 7.756 -12.889 742 HZ3 LYS 92 HZ3 LYS 92 -8.495 8.807 -13.463 743 H SER 93 HN SER 93 -4.261 8.780 -7.960 744 HA SER 93 HA SER 93 -4.884 11.075 -6.263 745 HB2 SER 93 HB2 SER 93 -2.266 11.120 -7.530 746 HB3 SER 93 HB1 SER 93 -2.660 11.071 -5.812 747 HG SER 93 HG SER 93 -2.678 8.876 -5.866 748 H GLU 94 HN GLU 94 -3.411 13.048 -7.522 749 HA GLU 94 HA GLU 94 -5.144 13.642 -9.753 750 HB2 GLU 94 HB2 GLU 94 -2.885 15.330 -8.680 751 HB3 GLU 94 HB1 GLU 94 -4.240 15.860 -9.668 752 HG2 GLU 94 HG2 GLU 94 -5.744 15.133 -7.782 753 HG3 GLU 94 HG1 GLU 94 -4.291 14.954 -6.807 754 H LYS 95 HN LYS 95 -1.885 12.546 -9.310 755 HA LYS 95 HA LYS 95 -1.487 12.709 -12.230 756 HB2 LYS 95 HB2 LYS 95 -0.008 14.257 -10.958 757 HB3 LYS 95 HB1 LYS 95 0.661 12.870 -10.107 758 HG2 LYS 95 HG2 LYS 95 1.535 11.984 -12.191 759 HG3 LYS 95 HG1 LYS 95 0.798 13.310 -13.087 760 HD2 LYS 95 HD2 LYS 95 2.225 14.907 -11.966 761 HD3 LYS 95 HD1 LYS 95 2.904 13.633 -10.952 762 HE2 LYS 95 HE2 LYS 95 4.422 14.178 -12.769 763 HE3 LYS 95 HE1 LYS 95 3.808 12.537 -12.948 764 HZ1 LYS 95 HZ1 LYS 95 2.561 14.823 -14.348 765 HZ2 LYS 95 HZ2 LYS 95 2.434 13.174 -14.709 766 HZ3 LYS 95 HZ3 LYS 95 3.883 13.994 -15.001 767 H PHE 96 HN PHE 96 -1.684 10.694 -9.491 768 HA PHE 96 HA PHE 96 -0.539 8.477 -11.034 769 HB2 PHE 96 HB2 PHE 96 -0.291 8.652 -8.035 770 HB3 PHE 96 HB1 PHE 96 0.566 7.583 -9.140 771 HD1 PHE 96 HD2 PHE 96 2.452 8.411 -10.455 772 HD2 PHE 96 HD1 PHE 96 0.428 10.913 -7.671 773 HE1 PHE 96 HE2 PHE 96 4.321 10.013 -10.543 774 HE2 PHE 96 HE1 PHE 96 2.286 12.523 -7.754 775 HZ PHE 96 HZ PHE 96 4.242 12.073 -9.191 776 H SER 97 HN SER 97 -1.180 6.325 -9.706 777 HA SER 97 HA SER 97 -3.774 6.439 -8.493 778 HB2 SER 97 HB2 SER 97 -4.453 6.645 -10.826 779 HB3 SER 97 HB1 SER 97 -3.482 5.238 -11.258 780 HG SER 97 HG SER 97 -4.864 4.029 -9.794 781 H HIS 98 HN HIS 98 -4.087 4.734 -7.217 782 HA HIS 98 HA HIS 98 -2.114 2.558 -7.353 783 HB2 HIS 98 HB2 HIS 98 -2.185 3.889 -5.257 784 HB3 HIS 98 HB1 HIS 98 -3.871 3.436 -5.046 785 HD2 HIS 98 HD2 HIS 98 -3.506 0.172 -5.564 786 HE1 HIS 98 HE1 HIS 98 -0.728 0.494 -2.388 787 HE2 HIS 98 HE2 HIS 98 -1.998 -1.106 -3.887 788 H GLU 99 HN GLU 99 -2.797 0.684 -8.095 789 HA GLU 99 HA GLU 99 -5.689 0.137 -8.068 790 HB2 GLU 99 HB2 GLU 99 -5.001 0.083 -10.296 791 HB3 GLU 99 HB1 GLU 99 -3.464 -0.678 -9.910 792 HG2 GLU 99 HG2 GLU 99 -4.836 -2.698 -9.197 793 HG3 GLU 99 HG1 GLU 99 -6.184 -1.922 -10.030 794 H GLN 100 HN GLN 100 -6.465 -1.563 -6.951 795 HA GLN 100 HA GLN 100 -4.660 -3.726 -6.185 796 HB2 GLN 100 HB2 GLN 100 -5.728 -3.658 -3.851 797 HB3 GLN 100 HB1 GLN 100 -4.474 -2.484 -4.218 798 HG2 GLN 100 HG2 GLN 100 -6.272 -0.839 -4.730 799 HG3 GLN 100 HG1 GLN 100 -7.438 -2.016 -4.125 800 HE21 GLN 100 HE21 GLN 100 -5.565 -2.982 -2.064 801 HE22 GLN 100 HE22 GLN 100 -5.555 -1.767 -0.839 802 H GLU 101 HN GLU 101 -5.573 -5.499 -6.938 803 HA GLU 101 HA GLU 101 -8.511 -5.659 -6.942 804 HB2 GLU 101 HB2 GLU 101 -7.547 -5.622 -9.179 805 HB3 GLU 101 HB1 GLU 101 -6.507 -6.978 -8.777 806 HG2 GLU 101 HG2 GLU 101 -8.228 -8.504 -8.854 807 HG3 GLU 101 HG1 GLU 101 -9.462 -7.283 -8.561 808 H VAL 102 HN VAL 102 -9.455 -7.187 -5.779 809 HA VAL 102 HA VAL 102 -7.773 -9.251 -4.546 810 HB VAL 102 HB VAL 102 -10.502 -8.211 -3.762 811 HG11 VAL 102 HG11 VAL 102 -8.875 -10.400 -2.473 812 HG12 VAL 102 HG12 VAL 102 -10.399 -10.611 -3.331 813 HG13 VAL 102 HG13 VAL 102 -10.355 -9.700 -1.822 814 HG21 VAL 102 HG21 VAL 102 -9.097 -7.771 -1.614 815 HG22 VAL 102 HG22 VAL 102 -9.008 -6.654 -2.973 816 HG23 VAL 102 HG23 VAL 102 -7.731 -7.844 -2.728 817 H LYS 103 HN LYS 103 -7.832 -11.199 -5.397 818 HA LYS 103 HA LYS 103 -10.276 -12.078 -6.775 819 HB2 LYS 103 HB2 LYS 103 -7.394 -12.773 -7.353 820 HB3 LYS 103 HB1 LYS 103 -8.771 -13.543 -8.117 821 HG2 LYS 103 HG2 LYS 103 -9.441 -11.465 -9.133 822 HG3 LYS 103 HG1 LYS 103 -8.156 -10.607 -8.281 823 HD2 LYS 103 HD2 LYS 103 -7.318 -10.963 -10.450 824 HD3 LYS 103 HD1 LYS 103 -6.540 -12.188 -9.451 825 HE2 LYS 103 HE2 LYS 103 -7.248 -13.232 -11.481 826 HE3 LYS 103 HE1 LYS 103 -8.287 -13.806 -10.182 827 HZ1 LYS 103 HZ1 LYS 103 -9.539 -13.258 -12.175 828 HZ2 LYS 103 HZ2 LYS 103 -8.986 -11.663 -12.109 829 HZ3 LYS 103 HZ3 LYS 103 -9.990 -12.261 -10.886 830 H GLY 104 HN GLY 104 -11.128 -12.980 -4.880 831 HA2 GLY 104 HA2 GLY 104 -11.625 -14.830 -3.602 832 HA3 GLY 104 HA1 GLY 104 -10.301 -15.670 -4.390 833 H ASN 105 HN ASN 105 -8.268 -15.656 -3.484 834 HA ASN 105 HA ASN 105 -8.150 -14.635 -0.718 835 HB2 ASN 105 HB2 ASN 105 -8.238 -17.185 -1.152 836 HB3 ASN 105 HB1 ASN 105 -6.578 -17.003 -1.701 837 HD21 ASN 105 HD21 ASN 105 -4.997 -17.000 -0.233 838 HD22 ASN 105 HD22 ASN 105 -5.238 -16.978 1.479 839 H GLU 106 HN GLU 106 -7.108 -13.828 -3.622 840 HA GLU 106 HA GLU 106 -4.440 -13.059 -2.633 841 HB2 GLU 106 HB2 GLU 106 -5.224 -14.079 -5.348 842 HB3 GLU 106 HB1 GLU 106 -3.758 -13.136 -5.107 843 HG2 GLU 106 HG2 GLU 106 -2.818 -14.789 -3.697 844 HG3 GLU 106 HG1 GLU 106 -4.356 -15.642 -3.560 845 H MET 107 HN MET 107 -3.952 -10.973 -2.751 846 HA MET 107 HA MET 107 -5.722 -9.207 -4.315 847 HB2 MET 107 HB2 MET 107 -5.985 -8.703 -1.977 848 HB3 MET 107 HB1 MET 107 -4.246 -8.711 -1.725 849 HG2 MET 107 HG2 MET 107 -3.981 -6.692 -2.970 850 HG3 MET 107 HG1 MET 107 -5.661 -6.737 -3.494 851 HE1 MET 107 HE1 MET 107 -3.635 -5.428 0.194 852 HE2 MET 107 HE2 MET 107 -3.406 -6.988 -0.591 853 HE3 MET 107 HE3 MET 107 -4.519 -6.844 0.771 854 H VAL 108 HN VAL 108 -4.702 -8.664 -6.141 855 HA VAL 108 HA VAL 108 -1.779 -8.326 -6.096 856 HB VAL 108 HB VAL 108 -3.582 -8.513 -8.512 857 HG11 VAL 108 HG11 VAL 108 -1.392 -9.185 -9.604 858 HG12 VAL 108 HG12 VAL 108 -0.601 -8.573 -8.149 859 HG13 VAL 108 HG13 VAL 108 -1.565 -7.489 -9.151 860 HG21 VAL 108 HG21 VAL 108 -3.736 -10.570 -7.225 861 HG22 VAL 108 HG22 VAL 108 -1.978 -10.697 -7.185 862 HG23 VAL 108 HG23 VAL 108 -2.837 -10.837 -8.717 863 H GLU 109 HN GLU 109 -1.106 -6.288 -5.830 864 HA GLU 109 HA GLU 109 -2.816 -4.163 -6.905 865 HB2 GLU 109 HB2 GLU 109 -2.117 -2.723 -5.231 866 HB3 GLU 109 HB1 GLU 109 -2.249 -4.266 -4.401 867 HG2 GLU 109 HG2 GLU 109 0.395 -3.566 -5.527 868 HG3 GLU 109 HG1 GLU 109 -0.159 -2.633 -4.140 869 H THR 110 HN THR 110 -2.031 -2.549 -8.114 870 HA THR 110 HA THR 110 0.736 -2.765 -9.105 871 HB THR 110 HB THR 110 -1.505 -1.924 -10.927 872 HG1 THR 110 HG1 THR 110 -2.247 -3.895 -10.909 873 HG21 THR 110 HG21 THR 110 -0.008 -2.495 -12.669 874 HG22 THR 110 HG22 THR 110 1.063 -3.356 -11.566 875 HG23 THR 110 HG23 THR 110 0.943 -1.598 -11.480 876 H ILE 111 HN ILE 111 1.699 -0.960 -8.393 877 HA ILE 111 HA ILE 111 0.143 1.552 -8.441 878 HB ILE 111 HB ILE 111 2.631 1.315 -6.803 879 HG12 ILE 111 HG12 ILE 111 -0.008 0.367 -5.697 880 HG13 ILE 111 HG11 ILE 111 1.135 -0.756 -6.430 881 HG21 ILE 111 HG21 ILE 111 1.317 3.425 -7.053 882 HG22 ILE 111 HG22 ILE 111 1.517 2.885 -5.384 883 HG23 ILE 111 HG23 ILE 111 -0.020 2.632 -6.218 884 HD11 ILE 111 HD11 ILE 111 1.365 -0.718 -4.018 885 HD12 ILE 111 HD12 ILE 111 1.673 1.019 -4.055 886 HD13 ILE 111 HD13 ILE 111 2.825 -0.100 -4.791 887 H THR 112 HN THR 112 1.428 3.527 -8.915 888 HA THR 112 HA THR 112 3.996 3.116 -10.260 889 HB THR 112 HB THR 112 1.754 4.552 -11.699 890 HG1 THR 112 HG1 THR 112 2.342 1.872 -11.558 891 HG21 THR 112 HG21 THR 112 4.485 3.624 -12.605 892 HG22 THR 112 HG22 THR 112 4.047 5.285 -12.203 893 HG23 THR 112 HG23 THR 112 3.298 4.486 -13.591 894 H PHE 113 HN PHE 113 5.194 4.546 -9.116 895 HA PHE 113 HA PHE 113 4.332 7.348 -9.063 896 HB2 PHE 113 HB2 PHE 113 5.036 5.678 -6.682 897 HB3 PHE 113 HB1 PHE 113 5.471 7.376 -6.696 898 HD1 PHE 113 HD2 PHE 113 2.661 4.996 -6.756 899 HD2 PHE 113 HD1 PHE 113 3.833 9.068 -6.346 900 HE1 PHE 113 HE2 PHE 113 0.404 5.561 -5.953 901 HE2 PHE 113 HE1 PHE 113 1.580 9.636 -5.540 902 HZ PHE 113 HZ PHE 113 -0.134 7.882 -5.340 903 H GLY 114 HN GLY 114 6.044 8.815 -9.140 904 HA2 GLY 114 HA2 GLY 114 8.134 9.559 -9.714 905 HA3 GLY 114 HA1 GLY 114 8.748 8.215 -8.768 906 H GLY 115 HN GLY 115 6.690 7.384 -11.378 907 HA2 GLY 115 HA2 GLY 115 7.175 6.783 -13.585 908 HA3 GLY 115 HA1 GLY 115 8.877 7.090 -13.270 909 H VAL 116 HN VAL 116 7.646 5.246 -10.764 910 HA VAL 116 HA VAL 116 8.601 2.787 -12.076 911 HB VAL 116 HB VAL 116 8.667 3.038 -9.107 912 HG11 VAL 116 HG11 VAL 116 10.551 1.531 -9.334 913 HG12 VAL 116 HG12 VAL 116 10.505 1.697 -11.086 914 HG13 VAL 116 HG13 VAL 116 9.173 0.912 -10.241 915 HG21 VAL 116 HG21 VAL 116 9.758 5.073 -9.642 916 HG22 VAL 116 HG22 VAL 116 10.631 4.331 -10.985 917 HG23 VAL 116 HG23 VAL 116 11.035 3.897 -9.323 918 H THR 117 HN THR 117 7.146 1.299 -12.332 919 HA THR 117 HA THR 117 4.612 1.426 -10.901 920 HB THR 117 HB THR 117 4.152 1.209 -13.134 921 HG1 THR 117 HG1 THR 117 4.299 -1.417 -12.092 922 HG21 THR 117 HG21 THR 117 6.567 -0.516 -13.279 923 HG22 THR 117 HG22 THR 117 6.307 1.076 -13.999 924 HG23 THR 117 HG23 THR 117 5.447 -0.334 -14.633 925 H LEU 118 HN LEU 118 5.461 0.663 -8.924 926 HA LEU 118 HA LEU 118 6.709 -1.861 -8.698 927 HB2 LEU 118 HB2 LEU 118 6.943 -0.179 -6.944 928 HB3 LEU 118 HB1 LEU 118 5.231 -0.297 -6.582 929 HG LEU 118 HG LEU 118 5.478 -2.556 -5.789 930 HD11 LEU 118 HD11 LEU 118 7.565 -3.740 -5.744 931 HD12 LEU 118 HD12 LEU 118 8.411 -2.354 -6.427 932 HD13 LEU 118 HD13 LEU 118 7.243 -3.238 -7.408 933 HD21 LEU 118 HD21 LEU 118 6.136 -0.534 -4.352 934 HD22 LEU 118 HD22 LEU 118 7.792 -1.101 -4.577 935 HD23 LEU 118 HD23 LEU 118 6.600 -2.141 -3.798 936 H ILE 119 HN ILE 119 5.814 -3.679 -9.229 937 HA ILE 119 HA ILE 119 2.930 -4.049 -8.782 938 HB ILE 119 HB ILE 119 4.801 -5.772 -10.416 939 HG12 ILE 119 HG12 ILE 119 2.952 -3.510 -11.131 940 HG13 ILE 119 HG11 ILE 119 4.620 -3.764 -11.620 941 HG21 ILE 119 HG21 ILE 119 2.685 -6.759 -11.259 942 HG22 ILE 119 HG22 ILE 119 1.808 -5.819 -10.051 943 HG23 ILE 119 HG23 ILE 119 2.963 -7.053 -9.540 944 HD11 ILE 119 HD11 ILE 119 2.187 -5.219 -12.606 945 HD12 ILE 119 HD12 ILE 119 3.843 -5.703 -12.976 946 HD13 ILE 119 HD13 ILE 119 3.244 -4.133 -13.509 947 H ARG 120 HN ARG 120 2.198 -5.368 -7.229 948 HA ARG 120 HA ARG 120 4.026 -7.378 -6.131 949 HB2 ARG 120 HB2 ARG 120 2.594 -5.225 -4.611 950 HB3 ARG 120 HB1 ARG 120 3.047 -6.732 -3.833 951 HG2 ARG 120 HG2 ARG 120 5.263 -6.235 -3.837 952 HG3 ARG 120 HG1 ARG 120 5.153 -5.297 -5.330 953 HD2 ARG 120 HD2 ARG 120 5.633 -3.967 -3.248 954 HD3 ARG 120 HD1 ARG 120 4.255 -3.429 -4.205 955 HE ARG 120 HE ARG 120 2.791 -4.412 -2.555 956 HH11 ARG 120 HH11 ARG 120 6.188 -4.339 -1.638 957 HH12 ARG 120 HH12 ARG 120 5.848 -4.264 0.062 958 HH21 ARG 120 HH21 ARG 120 2.369 -4.323 -0.322 959 HH22 ARG 120 HH22 ARG 120 3.689 -4.253 0.806 960 H ARG 121 HN ARG 121 2.825 -8.823 -4.564 961 HA ARG 121 HA ARG 121 0.007 -9.146 -5.199 962 HB2 ARG 121 HB2 ARG 121 0.470 -11.690 -5.318 963 HB3 ARG 121 HB1 ARG 121 0.757 -10.725 -6.748 964 HG2 ARG 121 HG2 ARG 121 3.139 -10.823 -5.185 965 HG3 ARG 121 HG1 ARG 121 2.528 -12.457 -5.450 966 HD2 ARG 121 HD2 ARG 121 3.854 -12.124 -7.310 967 HD3 ARG 121 HD1 ARG 121 2.255 -11.686 -7.907 968 HE ARG 121 HE ARG 121 3.195 -9.322 -7.094 969 HH11 ARG 121 HH11 ARG 121 4.596 -11.825 -9.109 970 HH12 ARG 121 HH12 ARG 121 5.620 -10.728 -9.981 971 HH21 ARG 121 HH21 ARG 121 4.606 -7.878 -8.227 972 HH22 ARG 121 HH22 ARG 121 5.631 -8.499 -9.486 973 H SER 122 HN SER 122 -1.108 -9.648 -3.486 974 HA SER 122 HA SER 122 0.356 -10.477 -1.086 975 HB2 SER 122 HB2 SER 122 -2.145 -8.804 -1.074 976 HB3 SER 122 HB1 SER 122 -1.014 -9.078 0.250 977 HG SER 122 HG SER 122 -0.602 -7.555 -2.116 978 H LYS 123 HN LYS 123 -0.144 -12.379 -0.345 979 HA LYS 123 HA LYS 123 -2.674 -13.583 -1.180 980 HB2 LYS 123 HB2 LYS 123 -1.522 -15.654 -0.067 981 HB3 LYS 123 HB1 LYS 123 -1.034 -15.130 -1.671 982 HG2 LYS 123 HG2 LYS 123 0.950 -14.166 -0.880 983 HG3 LYS 123 HG1 LYS 123 0.399 -14.203 0.791 984 HD2 LYS 123 HD2 LYS 123 0.524 -16.629 0.808 985 HD3 LYS 123 HD1 LYS 123 0.987 -16.635 -0.892 986 HE2 LYS 123 HE2 LYS 123 3.040 -15.440 -0.357 987 HE3 LYS 123 HE1 LYS 123 2.571 -15.372 1.341 988 HZ1 LYS 123 HZ1 LYS 123 2.548 -17.876 1.252 989 HZ2 LYS 123 HZ2 LYS 123 4.066 -17.149 1.139 990 HZ3 LYS 123 HZ3 LYS 123 3.317 -17.754 -0.251 991 H ARG 124 HN ARG 124 -4.220 -14.164 0.246 992 HA ARG 124 HA ARG 124 -4.179 -12.909 2.814 993 HB2 ARG 124 HB2 ARG 124 -6.169 -13.579 1.148 994 HB3 ARG 124 HB1 ARG 124 -6.212 -14.983 2.204 995 HG2 ARG 124 HG2 ARG 124 -6.553 -13.570 4.129 996 HG3 ARG 124 HG1 ARG 124 -6.379 -12.126 3.130 997 HD2 ARG 124 HD2 ARG 124 -8.715 -12.570 3.559 998 HD3 ARG 124 HD1 ARG 124 -8.361 -12.795 1.848 999 HE ARG 124 HE ARG 124 -8.120 -15.285 2.706 1000 HH11 ARG 124 HH11 ARG 124 -10.574 -12.910 3.461 1001 HH12 ARG 124 HH12 ARG 124 -11.820 -14.089 3.718 1002 HH21 ARG 124 HH21 ARG 124 -9.729 -16.849 3.076 1003 HH22 ARG 124 HH22 ARG 124 -11.332 -16.351 3.510 1004 H VAL 125 HN VAL 125 -4.156 -13.847 4.830 1005 HA VAL 125 HA VAL 125 -3.357 -16.668 4.945 1006 HB VAL 125 HB VAL 125 -1.827 -15.974 6.892 1007 HG11 VAL 125 HG11 VAL 125 -1.013 -15.170 4.105 1008 HG12 VAL 125 HG12 VAL 125 -1.052 -16.825 4.708 1009 HG13 VAL 125 HG13 VAL 125 0.060 -15.655 5.417 1010 HG21 VAL 125 HG21 VAL 125 -1.926 -13.323 5.456 1011 HG22 VAL 125 HG22 VAL 125 -0.913 -13.743 6.840 1012 HG23 VAL 125 HG23 VAL 125 -2.666 -13.648 7.025 Start of MODEL 9 1 H1 ALA 1 HT1 ALA 1 -15.068 -10.221 1.043 2 H2 ALA 1 HT2 ALA 1 -13.926 -10.225 2.286 3 H3 ALA 1 HT3 ALA 1 -13.438 -10.520 0.696 4 HA ALA 1 HA ALA 1 -14.092 -8.279 0.066 5 HB1 ALA 1 HB1 ALA 1 -15.093 -6.811 1.486 6 HB2 ALA 1 HB2 ALA 1 -14.292 -7.475 2.912 7 HB3 ALA 1 HB3 ALA 1 -15.678 -8.306 2.212 8 H PHE 2 HN PHE 2 -12.865 -6.213 1.359 9 HA PHE 2 HA PHE 2 -10.106 -6.997 1.161 10 HB2 PHE 2 HB2 PHE 2 -11.592 -4.432 1.404 11 HB3 PHE 2 HB1 PHE 2 -9.903 -4.442 1.890 12 HD1 PHE 2 HD1 PHE 2 -12.066 -5.530 -0.942 13 HD2 PHE 2 HD2 PHE 2 -8.302 -4.012 0.312 14 HE1 PHE 2 HE1 PHE 2 -11.398 -5.282 -3.297 15 HE2 PHE 2 HE2 PHE 2 -7.613 -3.754 -2.035 16 HZ PHE 2 HZ PHE 2 -9.158 -4.403 -3.849 17 H SER 3 HN SER 3 -12.334 -6.279 3.751 18 HA SER 3 HA SER 3 -10.614 -5.672 5.841 19 HB2 SER 3 HB2 SER 3 -12.499 -7.062 7.145 20 HB3 SER 3 HB1 SER 3 -12.799 -5.454 6.487 21 HG SER 3 HG SER 3 -14.151 -6.282 5.106 22 H GLY 4 HN GLY 4 -8.918 -6.771 6.612 23 HA2 GLY 4 HA2 GLY 4 -8.869 -9.214 7.750 24 HA3 GLY 4 HA1 GLY 4 -8.638 -9.593 6.049 25 H THR 5 HN THR 5 -6.587 -10.368 6.287 26 HA THR 5 HA THR 5 -4.537 -8.312 6.677 27 HB THR 5 HB THR 5 -3.186 -10.285 7.754 28 HG1 THR 5 HG1 THR 5 -5.393 -11.525 7.487 29 HG21 THR 5 HG21 THR 5 -5.262 -8.773 9.342 30 HG22 THR 5 HG22 THR 5 -3.717 -8.114 8.814 31 HG23 THR 5 HG23 THR 5 -3.756 -9.454 9.961 32 H TRP 6 HN TRP 6 -3.389 -8.244 4.850 33 HA TRP 6 HA TRP 6 -3.013 -10.772 3.385 34 HB2 TRP 6 HB2 TRP 6 -2.844 -8.039 2.140 35 HB3 TRP 6 HB1 TRP 6 -3.068 -9.592 1.347 36 HD1 TRP 6 HD1 TRP 6 -5.012 -7.091 3.555 37 HE1 TRP 6 HE1 TRP 6 -7.527 -7.348 3.053 38 HE3 TRP 6 HE3 TRP 6 -4.788 -11.121 0.417 39 HZ2 TRP 6 HZ2 TRP 6 -9.187 -9.049 1.514 40 HZ3 TRP 6 HZ3 TRP 6 -6.883 -11.999 -0.524 41 HH2 TRP 6 HH2 TRP 6 -9.037 -10.986 0.014 42 H GLN 7 HN GLN 7 -1.012 -11.486 3.123 43 HA GLN 7 HA GLN 7 1.229 -9.826 3.982 44 HB2 GLN 7 HB2 GLN 7 1.076 -12.131 4.828 45 HB3 GLN 7 HB1 GLN 7 1.091 -12.750 3.184 46 HG2 GLN 7 HG2 GLN 7 3.257 -12.956 4.374 47 HG3 GLN 7 HG1 GLN 7 3.345 -12.054 2.862 48 HE21 GLN 7 HE21 GLN 7 4.031 -9.980 2.885 49 HE22 GLN 7 HE22 GLN 7 4.516 -9.136 4.320 50 H VAL 8 HN VAL 8 2.065 -8.567 2.512 51 HA VAL 8 HA VAL 8 1.774 -9.104 -0.299 52 HB VAL 8 HB VAL 8 1.699 -6.809 1.031 53 HG11 VAL 8 HG11 VAL 8 3.948 -6.755 1.814 54 HG12 VAL 8 HG12 VAL 8 3.781 -5.518 0.567 55 HG13 VAL 8 HG13 VAL 8 4.578 -7.048 0.195 56 HG21 VAL 8 HG21 VAL 8 1.050 -7.056 -1.256 57 HG22 VAL 8 HG22 VAL 8 2.733 -7.204 -1.767 58 HG23 VAL 8 HG23 VAL 8 2.137 -5.674 -1.126 59 H TYR 9 HN TYR 9 3.416 -9.370 -1.812 60 HA TYR 9 HA TYR 9 6.168 -9.624 -0.939 61 HB2 TYR 9 HB2 TYR 9 6.429 -11.927 -1.728 62 HB3 TYR 9 HB1 TYR 9 5.245 -11.860 -0.429 63 HD1 TYR 9 HD1 TYR 9 2.854 -12.249 -0.910 64 HD2 TYR 9 HD2 TYR 9 5.803 -12.564 -3.965 65 HE1 TYR 9 HE1 TYR 9 1.250 -13.455 -2.331 66 HE2 TYR 9 HE2 TYR 9 4.209 -13.767 -5.390 67 HH TYR 9 HH TYR 9 0.871 -13.918 -4.697 68 H ALA 10 HN ALA 10 7.627 -9.554 -2.716 69 HA ALA 10 HA ALA 10 6.772 -9.604 -5.412 70 HB1 ALA 10 HB1 ALA 10 6.667 -7.330 -5.989 71 HB2 ALA 10 HB2 ALA 10 7.327 -6.826 -4.431 72 HB3 ALA 10 HB3 ALA 10 5.694 -7.482 -4.523 73 H GLN 11 HN GLN 11 8.467 -8.629 -6.895 74 HA GLN 11 HA GLN 11 11.094 -8.339 -5.692 75 HB2 GLN 11 HB2 GLN 11 12.061 -10.021 -7.288 76 HB3 GLN 11 HB1 GLN 11 11.058 -10.713 -6.029 77 HG2 GLN 11 HG2 GLN 11 9.841 -10.061 -8.671 78 HG3 GLN 11 HG1 GLN 11 10.844 -11.498 -8.513 79 HE21 GLN 11 HE21 GLN 11 10.100 -12.175 -5.857 80 HE22 GLN 11 HE22 GLN 11 8.462 -12.717 -5.892 81 H GLU 12 HN GLU 12 9.134 -6.754 -7.136 82 HA GLU 12 HA GLU 12 10.817 -5.899 -9.385 83 HB2 GLU 12 HB2 GLU 12 7.801 -5.887 -9.298 84 HB3 GLU 12 HB1 GLU 12 8.775 -5.207 -10.585 85 HG2 GLU 12 HG2 GLU 12 8.507 -7.182 -11.582 86 HG3 GLU 12 HG1 GLU 12 9.729 -7.752 -10.447 87 H ASN 13 HN ASN 13 10.915 -3.784 -9.769 88 HA ASN 13 HA ASN 13 11.623 -1.762 -8.798 89 HB2 ASN 13 HB2 ASN 13 8.657 -1.403 -9.195 90 HB3 ASN 13 HB1 ASN 13 9.900 -0.169 -9.331 91 HD21 ASN 13 HD21 ASN 13 7.840 -1.656 -11.126 92 HD22 ASN 13 HD22 ASN 13 8.750 -1.924 -12.579 93 H TYR 14 HN TYR 14 11.541 -3.195 -6.513 94 HA TYR 14 HA TYR 14 9.728 -1.807 -4.695 95 HB2 TYR 14 HB2 TYR 14 9.976 -4.255 -4.511 96 HB3 TYR 14 HB1 TYR 14 11.687 -4.047 -4.168 97 HD1 TYR 14 HD1 TYR 14 12.415 -3.066 -2.040 98 HD2 TYR 14 HD2 TYR 14 8.316 -3.888 -2.816 99 HE1 TYR 14 HE1 TYR 14 11.935 -2.895 0.351 100 HE2 TYR 14 HE2 TYR 14 7.819 -3.724 -0.415 101 HH TYR 14 HH TYR 14 9.480 -4.091 1.838 102 H GLU 15 HN GLU 15 13.181 -2.622 -4.738 103 HA GLU 15 HA GLU 15 13.911 -0.776 -2.750 104 HB2 GLU 15 HB2 GLU 15 16.244 -1.112 -3.632 105 HB3 GLU 15 HB1 GLU 15 15.390 -2.585 -3.194 106 HG2 GLU 15 HG2 GLU 15 14.877 -2.974 -5.564 107 HG3 GLU 15 HG1 GLU 15 15.775 -1.517 -5.986 108 H GLU 16 HN GLU 16 13.539 -0.463 -6.201 109 HA GLU 16 HA GLU 16 14.876 2.052 -6.399 110 HB2 GLU 16 HB2 GLU 16 12.992 0.604 -8.257 111 HB3 GLU 16 HB1 GLU 16 13.778 2.123 -8.661 112 HG2 GLU 16 HG2 GLU 16 15.967 0.905 -8.110 113 HG3 GLU 16 HG1 GLU 16 15.009 -0.566 -8.238 114 H PHE 17 HN PHE 17 11.602 1.009 -5.798 115 HA PHE 17 HA PHE 17 10.391 3.548 -6.225 116 HB2 PHE 17 HB2 PHE 17 9.039 1.548 -6.348 117 HB3 PHE 17 HB1 PHE 17 9.462 1.103 -4.696 118 HD1 PHE 17 HD1 PHE 17 8.331 4.318 -6.185 119 HD2 PHE 17 HD2 PHE 17 7.526 1.167 -3.449 120 HE1 PHE 17 HE1 PHE 17 6.322 5.497 -5.418 121 HE2 PHE 17 HE2 PHE 17 5.507 2.348 -2.675 122 HZ PHE 17 HZ PHE 17 4.910 4.515 -3.664 123 H LEU 18 HN LEU 18 11.859 1.902 -3.504 124 HA LEU 18 HA LEU 18 10.990 3.608 -1.462 125 HB2 LEU 18 HB2 LEU 18 13.665 2.210 -1.581 126 HB3 LEU 18 HB1 LEU 18 12.817 2.752 -0.142 127 HG LEU 18 HG LEU 18 12.123 0.425 -1.930 128 HD11 LEU 18 HD11 LEU 18 12.441 -0.894 0.004 129 HD12 LEU 18 HD12 LEU 18 12.547 0.528 1.043 130 HD13 LEU 18 HD13 LEU 18 13.829 0.182 -0.112 131 HD21 LEU 18 HD21 LEU 18 10.061 1.597 -1.445 132 HD22 LEU 18 HD22 LEU 18 10.456 1.635 0.272 133 HD23 LEU 18 HD23 LEU 18 10.143 0.095 -0.530 134 H LYS 19 HN LYS 19 13.749 3.790 -3.660 135 HA LYS 19 HA LYS 19 14.919 6.086 -2.450 136 HB2 LYS 19 HB2 LYS 19 15.316 5.483 -5.356 137 HB3 LYS 19 HB1 LYS 19 16.479 6.031 -4.155 138 HG2 LYS 19 HG2 LYS 19 16.027 3.663 -3.112 139 HG3 LYS 19 HG1 LYS 19 15.520 3.282 -4.754 140 HD2 LYS 19 HD2 LYS 19 17.681 3.974 -5.602 141 HD3 LYS 19 HD1 LYS 19 18.190 4.455 -3.983 142 HE2 LYS 19 HE2 LYS 19 17.835 2.095 -3.255 143 HE3 LYS 19 HE1 LYS 19 17.528 1.673 -4.933 144 HZ1 LYS 19 HZ1 LYS 19 19.823 1.222 -4.252 145 HZ2 LYS 19 HZ2 LYS 19 20.062 2.868 -3.930 146 HZ3 LYS 19 HZ3 LYS 19 19.750 2.344 -5.517 147 H ALA 20 HN ALA 20 12.256 5.607 -4.561 148 HA ALA 20 HA ALA 20 12.274 8.287 -5.645 149 HB1 ALA 20 HB1 ALA 20 11.393 6.260 -6.870 150 HB2 ALA 20 HB2 ALA 20 10.332 7.668 -6.861 151 HB3 ALA 20 HB3 ALA 20 10.007 6.311 -5.782 152 H LEU 21 HN LEU 21 11.195 6.777 -2.815 153 HA LEU 21 HA LEU 21 9.177 8.826 -2.280 154 HB2 LEU 21 HB2 LEU 21 9.981 6.441 -0.608 155 HB3 LEU 21 HB1 LEU 21 8.585 7.471 -0.354 156 HG LEU 21 HG LEU 21 8.908 5.922 -2.904 157 HD11 LEU 21 HD11 LEU 21 7.558 4.921 -0.408 158 HD12 LEU 21 HD12 LEU 21 9.116 4.354 -1.011 159 HD13 LEU 21 HD13 LEU 21 7.656 4.098 -1.966 160 HD21 LEU 21 HD21 LEU 21 7.206 7.829 -2.470 161 HD22 LEU 21 HD22 LEU 21 6.354 6.614 -1.519 162 HD23 LEU 21 HD23 LEU 21 6.661 6.337 -3.232 163 H ALA 22 HN ALA 22 12.309 8.786 -2.215 164 HA ALA 22 HA ALA 22 13.949 9.933 -1.161 165 HB1 ALA 22 HB1 ALA 22 11.719 11.313 0.337 166 HB2 ALA 22 HB2 ALA 22 12.330 11.796 -1.246 167 HB3 ALA 22 HB3 ALA 22 13.380 11.874 0.165 168 H LEU 23 HN LEU 23 13.131 7.406 -0.169 169 HA LEU 23 HA LEU 23 13.246 7.568 2.721 170 HB2 LEU 23 HB2 LEU 23 13.188 5.248 0.790 171 HB3 LEU 23 HB1 LEU 23 13.286 5.043 2.530 172 HG LEU 23 HG LEU 23 11.029 6.501 1.148 173 HD11 LEU 23 HD11 LEU 23 11.124 3.655 2.123 174 HD12 LEU 23 HD12 LEU 23 11.031 4.174 0.440 175 HD13 LEU 23 HD13 LEU 23 9.688 4.498 1.539 176 HD21 LEU 23 HD21 LEU 23 11.284 7.136 3.447 177 HD22 LEU 23 HD22 LEU 23 11.387 5.448 3.943 178 HD23 LEU 23 HD23 LEU 23 9.876 6.087 3.294 179 HA PRO 24 HA PRO 24 17.611 7.169 3.164 180 HB2 PRO 24 HB2 PRO 24 17.487 5.157 5.243 181 HB3 PRO 24 HB1 PRO 24 17.817 6.888 5.401 182 HG2 PRO 24 HG2 PRO 24 15.563 5.674 6.341 183 HG3 PRO 24 HG1 PRO 24 15.669 7.389 5.907 184 HD2 PRO 24 HD2 PRO 24 14.482 5.126 4.379 185 HD3 PRO 24 HD1 PRO 24 13.959 6.820 4.490 186 H GLU 25 HN GLU 25 19.084 6.125 1.995 187 HA GLU 25 HA GLU 25 18.652 3.767 0.595 188 HB2 GLU 25 HB2 GLU 25 20.928 5.544 1.131 189 HB3 GLU 25 HB1 GLU 25 21.382 3.894 0.737 190 HG2 GLU 25 HG2 GLU 25 19.388 5.251 -0.995 191 HG3 GLU 25 HG1 GLU 25 21.079 5.733 -1.124 192 H ASP 26 HN ASP 26 20.125 4.287 3.730 193 HA ASP 26 HA ASP 26 21.191 1.715 4.138 194 HB2 ASP 26 HB2 ASP 26 21.830 3.594 5.544 195 HB3 ASP 26 HB1 ASP 26 20.176 3.775 6.117 196 H LEU 27 HN LEU 27 18.022 3.098 4.769 197 HA LEU 27 HA LEU 27 17.002 0.769 6.077 198 HB2 LEU 27 HB2 LEU 27 16.214 3.211 6.269 199 HB3 LEU 27 HB1 LEU 27 15.361 2.916 4.766 200 HG LEU 27 HG LEU 27 14.449 0.836 6.134 201 HD11 LEU 27 HD11 LEU 27 15.766 1.331 8.125 202 HD12 LEU 27 HD12 LEU 27 14.034 1.432 8.452 203 HD13 LEU 27 HD13 LEU 27 14.984 2.908 8.252 204 HD21 LEU 27 HD21 LEU 27 12.497 2.214 6.735 205 HD22 LEU 27 HD22 LEU 27 13.058 2.485 5.082 206 HD23 LEU 27 HD23 LEU 27 13.434 3.659 6.344 207 H ILE 28 HN ILE 28 17.094 2.032 2.850 208 HA ILE 28 HA ILE 28 15.176 0.408 1.595 209 HB ILE 28 HB ILE 28 17.653 1.778 0.537 210 HG12 ILE 28 HG12 ILE 28 14.752 2.514 0.169 211 HG13 ILE 28 HG11 ILE 28 15.727 3.118 1.502 212 HG21 ILE 28 HG21 ILE 28 15.422 0.542 -1.073 213 HG22 ILE 28 HG22 ILE 28 17.059 -0.094 -0.933 214 HG23 ILE 28 HG23 ILE 28 16.783 1.466 -1.702 215 HD11 ILE 28 HD11 ILE 28 15.418 4.367 -0.881 216 HD12 ILE 28 HD12 ILE 28 16.930 3.491 -1.140 217 HD13 ILE 28 HD13 ILE 28 16.777 4.608 0.216 218 H LYS 29 HN LYS 29 18.513 -0.132 2.464 219 HA LYS 29 HA LYS 29 18.852 -2.472 0.866 220 HB2 LYS 29 HB2 LYS 29 20.425 -1.369 3.192 221 HB3 LYS 29 HB1 LYS 29 20.910 -2.779 2.257 222 HG2 LYS 29 HG2 LYS 29 21.060 -1.443 0.250 223 HG3 LYS 29 HG1 LYS 29 20.468 -0.029 1.121 224 HD2 LYS 29 HD2 LYS 29 22.449 -0.081 2.550 225 HD3 LYS 29 HD1 LYS 29 23.034 -1.508 1.692 226 HE2 LYS 29 HE2 LYS 29 24.173 0.377 0.789 227 HE3 LYS 29 HE1 LYS 29 22.992 -0.145 -0.412 228 HZ1 LYS 29 HZ1 LYS 29 22.250 1.945 1.517 229 HZ2 LYS 29 HZ2 LYS 29 21.687 1.697 -0.065 230 HZ3 LYS 29 HZ3 LYS 29 23.225 2.353 0.199 231 H MET 30 HN MET 30 17.261 -1.858 3.813 232 HA MET 30 HA MET 30 17.507 -4.631 4.719 233 HB2 MET 30 HB2 MET 30 15.825 -2.443 5.948 234 HB3 MET 30 HB1 MET 30 16.324 -3.956 6.691 235 HG2 MET 30 HG2 MET 30 18.591 -3.231 6.794 236 HG3 MET 30 HG1 MET 30 18.212 -1.800 5.842 237 HE1 MET 30 HE1 MET 30 18.969 -0.077 9.186 238 HE2 MET 30 HE2 MET 30 19.223 -0.092 7.438 239 HE3 MET 30 HE3 MET 30 19.829 -1.418 8.432 240 H ALA 31 HN ALA 31 15.035 -2.335 3.693 241 HA ALA 31 HA ALA 31 12.793 -3.949 3.909 242 HB1 ALA 31 HB1 ALA 31 13.212 -1.817 1.832 243 HB2 ALA 31 HB2 ALA 31 12.806 -1.500 3.519 244 HB3 ALA 31 HB3 ALA 31 11.679 -2.385 2.494 245 H ARG 32 HN ARG 32 15.232 -3.902 1.417 246 HA ARG 32 HA ARG 32 13.860 -5.077 -0.698 247 HB2 ARG 32 HB2 ARG 32 16.050 -5.822 -1.516 248 HB3 ARG 32 HB1 ARG 32 16.099 -4.158 -0.952 249 HG2 ARG 32 HG2 ARG 32 17.397 -4.668 0.871 250 HG3 ARG 32 HG1 ARG 32 16.854 -6.347 0.922 251 HD2 ARG 32 HD2 ARG 32 18.613 -5.177 -1.228 252 HD3 ARG 32 HD1 ARG 32 19.206 -6.069 0.172 253 HE ARG 32 HE ARG 32 17.616 -7.170 -2.042 254 HH11 ARG 32 HH11 ARG 32 19.616 -7.663 0.793 255 HH12 ARG 32 HH12 ARG 32 19.774 -9.371 0.538 256 HH21 ARG 32 HH21 ARG 32 17.817 -9.425 -2.373 257 HH22 ARG 32 HH22 ARG 32 18.741 -10.377 -1.251 258 H ASP 33 HN ASP 33 14.814 -6.524 2.293 259 HA ASP 33 HA ASP 33 14.048 -9.160 1.202 260 HB2 ASP 33 HB2 ASP 33 16.522 -8.810 1.922 261 HB3 ASP 33 HB1 ASP 33 15.888 -8.860 3.563 262 H ILE 34 HN ILE 34 12.632 -6.878 2.666 263 HA ILE 34 HA ILE 34 11.590 -8.451 4.932 264 HB ILE 34 HB ILE 34 11.591 -5.460 4.519 265 HG12 ILE 34 HG12 ILE 34 13.338 -7.355 5.892 266 HG13 ILE 34 HG11 ILE 34 13.639 -5.689 5.420 267 HG21 ILE 34 HG21 ILE 34 9.497 -6.150 5.574 268 HG22 ILE 34 HG22 ILE 34 10.521 -5.291 6.727 269 HG23 ILE 34 HG23 ILE 34 10.401 -7.049 6.795 270 HD11 ILE 34 HD11 ILE 34 13.869 -5.919 7.790 271 HD12 ILE 34 HD12 ILE 34 12.260 -6.632 7.917 272 HD13 ILE 34 HD13 ILE 34 12.441 -4.941 7.442 273 H LYS 35 HN LYS 35 9.481 -8.951 5.004 274 HA LYS 35 HA LYS 35 7.756 -7.891 2.866 275 HB2 LYS 35 HB2 LYS 35 7.788 -10.655 4.091 276 HB3 LYS 35 HB1 LYS 35 6.517 -10.070 3.027 277 HG2 LYS 35 HG2 LYS 35 7.835 -10.172 1.160 278 HG3 LYS 35 HG1 LYS 35 9.326 -9.920 2.073 279 HD2 LYS 35 HD2 LYS 35 9.270 -12.185 1.255 280 HD3 LYS 35 HD1 LYS 35 9.084 -12.198 3.008 281 HE2 LYS 35 HE2 LYS 35 6.543 -12.218 2.493 282 HE3 LYS 35 HE1 LYS 35 7.050 -12.752 0.890 283 HZ1 LYS 35 HZ1 LYS 35 6.650 -14.677 2.171 284 HZ2 LYS 35 HZ2 LYS 35 7.557 -14.100 3.477 285 HZ3 LYS 35 HZ3 LYS 35 8.329 -14.540 2.039 286 HA PRO 36 HA PRO 36 5.875 -6.557 6.849 287 HB2 PRO 36 HB2 PRO 36 4.854 -4.390 5.143 288 HB3 PRO 36 HB1 PRO 36 5.791 -4.284 6.641 289 HG2 PRO 36 HG2 PRO 36 6.838 -3.643 4.276 290 HG3 PRO 36 HG1 PRO 36 7.796 -4.381 5.575 291 HD2 PRO 36 HD2 PRO 36 6.672 -5.645 3.118 292 HD3 PRO 36 HD1 PRO 36 8.231 -5.922 3.915 293 H ILE 37 HN ILE 37 3.789 -6.915 7.462 294 HA ILE 37 HA ILE 37 2.002 -7.924 5.401 295 HB ILE 37 HB ILE 37 2.451 -9.284 7.432 296 HG12 ILE 37 HG12 ILE 37 0.193 -9.115 5.998 297 HG13 ILE 37 HG11 ILE 37 0.397 -10.250 7.329 298 HG21 ILE 37 HG21 ILE 37 0.895 -7.142 8.869 299 HG22 ILE 37 HG22 ILE 37 2.604 -7.522 9.083 300 HG23 ILE 37 HG23 ILE 37 1.376 -8.697 9.549 301 HD11 ILE 37 HD11 ILE 37 -1.763 -8.951 7.243 302 HD12 ILE 37 HD12 ILE 37 -0.819 -7.538 7.711 303 HD13 ILE 37 HD13 ILE 37 -0.900 -8.939 8.781 304 H VAL 38 HN VAL 38 0.018 -7.075 4.936 305 HA VAL 38 HA VAL 38 -0.394 -4.330 5.875 306 HB VAL 38 HB VAL 38 -1.759 -5.752 3.589 307 HG11 VAL 38 HG11 VAL 38 -3.069 -3.901 4.368 308 HG12 VAL 38 HG12 VAL 38 -2.276 -3.411 2.870 309 HG13 VAL 38 HG13 VAL 38 -1.650 -2.858 4.424 310 HG21 VAL 38 HG21 VAL 38 -0.233 -4.703 2.097 311 HG22 VAL 38 HG22 VAL 38 0.734 -5.498 3.341 312 HG23 VAL 38 HG23 VAL 38 0.485 -3.751 3.398 313 H GLU 39 HN GLU 39 -1.590 -4.246 7.664 314 HA GLU 39 HA GLU 39 -3.805 -6.114 8.018 315 HB2 GLU 39 HB2 GLU 39 -2.264 -4.275 9.786 316 HB3 GLU 39 HB1 GLU 39 -3.944 -4.585 10.216 317 HG2 GLU 39 HG2 GLU 39 -3.558 -6.777 10.698 318 HG3 GLU 39 HG1 GLU 39 -2.208 -6.894 9.574 319 H ILE 40 HN ILE 40 -5.798 -5.598 7.454 320 HA ILE 40 HA ILE 40 -6.515 -2.747 7.376 321 HB ILE 40 HB ILE 40 -5.970 -3.409 5.100 322 HG12 ILE 40 HG12 ILE 40 -8.041 -1.910 5.742 323 HG13 ILE 40 HG11 ILE 40 -7.744 -2.361 4.068 324 HG21 ILE 40 HG21 ILE 40 -6.326 -5.761 5.152 325 HG22 ILE 40 HG22 ILE 40 -7.351 -5.072 3.892 326 HG23 ILE 40 HG23 ILE 40 -8.052 -5.544 5.444 327 HD11 ILE 40 HD11 ILE 40 -9.617 -3.861 5.875 328 HD12 ILE 40 HD12 ILE 40 -9.462 -3.996 4.123 329 HD13 ILE 40 HD13 ILE 40 -10.120 -2.526 4.841 330 H GLN 41 HN GLN 41 -8.366 -2.240 8.271 331 HA GLN 41 HA GLN 41 -10.289 -4.396 8.878 332 HB2 GLN 41 HB2 GLN 41 -9.982 -1.934 10.580 333 HB3 GLN 41 HB1 GLN 41 -10.717 -3.475 10.997 334 HG2 GLN 41 HG2 GLN 41 -8.589 -4.535 11.146 335 HG3 GLN 41 HG1 GLN 41 -7.778 -3.112 10.490 336 HE21 GLN 41 HE21 GLN 41 -6.447 -2.938 12.299 337 HE22 GLN 41 HE22 GLN 41 -7.037 -2.377 13.822 338 H GLN 42 HN GLN 42 -12.442 -3.956 8.406 339 HA GLN 42 HA GLN 42 -12.973 -1.237 7.418 340 HB2 GLN 42 HB2 GLN 42 -13.700 -1.957 5.430 341 HB3 GLN 42 HB1 GLN 42 -12.894 -3.470 5.816 342 HG2 GLN 42 HG2 GLN 42 -14.982 -4.359 6.695 343 HG3 GLN 42 HG1 GLN 42 -15.787 -2.832 6.353 344 HE21 GLN 42 HE21 GLN 42 -16.433 -2.372 4.299 345 HE22 GLN 42 HE22 GLN 42 -16.307 -3.488 2.986 346 H LYS 43 HN LYS 43 -15.141 -0.536 7.489 347 HA LYS 43 HA LYS 43 -17.026 -1.959 9.180 348 HB2 LYS 43 HB2 LYS 43 -15.487 -0.499 10.633 349 HB3 LYS 43 HB1 LYS 43 -16.245 0.880 9.851 350 HG2 LYS 43 HG2 LYS 43 -18.334 0.419 10.807 351 HG3 LYS 43 HG1 LYS 43 -17.856 -1.215 11.272 352 HD2 LYS 43 HD2 LYS 43 -17.870 0.183 13.228 353 HD3 LYS 43 HD1 LYS 43 -16.201 -0.232 12.839 354 HE2 LYS 43 HE2 LYS 43 -16.163 2.061 13.366 355 HE3 LYS 43 HE1 LYS 43 -16.090 1.983 11.608 356 HZ1 LYS 43 HZ1 LYS 43 -18.369 2.572 11.455 357 HZ2 LYS 43 HZ2 LYS 43 -17.645 3.675 12.513 358 HZ3 LYS 43 HZ3 LYS 43 -18.598 2.419 13.120 359 H GLY 44 HN GLY 44 -18.083 -2.058 7.121 360 HA2 GLY 44 HA2 GLY 44 -19.806 -1.339 5.755 361 HA3 GLY 44 HA1 GLY 44 -19.817 0.184 6.639 362 H ASP 45 HN ASP 45 -18.910 1.928 5.739 363 HA ASP 45 HA ASP 45 -17.597 1.545 3.141 364 HB2 ASP 45 HB2 ASP 45 -18.849 4.021 4.349 365 HB3 ASP 45 HB1 ASP 45 -18.098 3.937 2.759 366 H ASP 46 HN ASP 46 -17.044 2.511 6.369 367 HA ASP 46 HA ASP 46 -14.671 4.074 5.771 368 HB2 ASP 46 HB2 ASP 46 -16.253 3.428 8.206 369 HB3 ASP 46 HB1 ASP 46 -14.546 3.795 8.428 370 H PHE 47 HN PHE 47 -12.647 3.380 5.809 371 HA PHE 47 HA PHE 47 -12.121 0.606 6.686 372 HB2 PHE 47 HB2 PHE 47 -11.126 2.089 4.259 373 HB3 PHE 47 HB1 PHE 47 -10.244 0.723 4.914 374 HD1 PHE 47 HD1 PHE 47 -13.877 1.339 4.334 375 HD2 PHE 47 HD2 PHE 47 -10.467 -1.064 3.528 376 HE1 PHE 47 HE1 PHE 47 -15.274 -0.197 3.012 377 HE2 PHE 47 HE2 PHE 47 -11.857 -2.609 2.211 378 HZ PHE 47 HZ PHE 47 -14.261 -2.173 1.951 379 H VAL 48 HN VAL 48 -10.070 0.194 7.559 380 HA VAL 48 HA VAL 48 -8.397 2.516 8.222 381 HB VAL 48 HB VAL 48 -9.280 0.374 10.177 382 HG11 VAL 48 HG11 VAL 48 -7.865 1.568 11.812 383 HG12 VAL 48 HG12 VAL 48 -7.241 2.572 10.503 384 HG13 VAL 48 HG13 VAL 48 -6.929 0.837 10.507 385 HG21 VAL 48 HG21 VAL 48 -9.749 3.342 10.044 386 HG22 VAL 48 HG22 VAL 48 -10.025 2.381 11.494 387 HG23 VAL 48 HG23 VAL 48 -10.953 2.053 10.030 388 H VAL 49 HN VAL 49 -6.646 2.059 7.059 389 HA VAL 49 HA VAL 49 -5.657 -0.696 6.943 390 HB VAL 49 HB VAL 49 -4.778 1.730 5.364 391 HG11 VAL 49 HG11 VAL 49 -2.952 0.194 5.499 392 HG12 VAL 49 HG12 VAL 49 -3.678 0.018 3.903 393 HG13 VAL 49 HG13 VAL 49 -4.004 -1.175 5.157 394 HG21 VAL 49 HG21 VAL 49 -7.065 1.021 4.837 395 HG22 VAL 49 HG22 VAL 49 -6.479 -0.614 4.527 396 HG23 VAL 49 HG23 VAL 49 -5.963 0.717 3.495 397 H THR 50 HN THR 50 -3.969 -1.334 8.075 398 HA THR 50 HA THR 50 -2.347 0.699 9.452 399 HB THR 50 HB THR 50 -2.852 -2.179 10.237 400 HG1 THR 50 HG1 THR 50 -4.456 -0.161 10.494 401 HG21 THR 50 HG21 THR 50 -1.782 -1.526 12.356 402 HG22 THR 50 HG22 THR 50 -1.413 0.056 11.672 403 HG23 THR 50 HG23 THR 50 -0.681 -1.397 10.985 404 H SER 51 HN SER 51 -0.373 0.928 8.641 405 HA SER 51 HA SER 51 0.821 -1.311 7.169 406 HB2 SER 51 HB2 SER 51 1.907 1.496 7.233 407 HB3 SER 51 HB1 SER 51 2.108 0.260 5.989 408 HG SER 51 HG SER 51 -0.480 0.685 6.237 409 H LYS 52 HN LYS 52 1.811 -2.576 8.591 410 HA LYS 52 HA LYS 52 3.290 -1.511 10.850 411 HB2 LYS 52 HB2 LYS 52 3.071 -4.398 9.999 412 HB3 LYS 52 HB1 LYS 52 3.487 -3.776 11.590 413 HG2 LYS 52 HG2 LYS 52 0.828 -3.110 10.422 414 HG3 LYS 52 HG1 LYS 52 1.103 -4.723 11.083 415 HD2 LYS 52 HD2 LYS 52 1.814 -2.278 12.665 416 HD3 LYS 52 HD1 LYS 52 0.151 -2.873 12.628 417 HE2 LYS 52 HE2 LYS 52 2.551 -4.511 13.436 418 HE3 LYS 52 HE1 LYS 52 1.450 -3.717 14.559 419 HZ1 LYS 52 HZ1 LYS 52 0.422 -5.612 12.543 420 HZ2 LYS 52 HZ2 LYS 52 -0.259 -5.154 14.025 421 HZ3 LYS 52 HZ3 LYS 52 1.087 -6.178 13.995 422 H THR 53 HN THR 53 5.342 -0.944 10.671 423 HA THR 53 HA THR 53 7.057 -2.417 8.786 424 HB THR 53 HB THR 53 8.034 -0.448 7.943 425 HG1 THR 53 HG1 THR 53 6.611 1.377 9.484 426 HG21 THR 53 HG21 THR 53 6.265 0.692 6.906 427 HG22 THR 53 HG22 THR 53 5.180 0.444 8.279 428 HG23 THR 53 HG23 THR 53 5.629 -0.918 7.244 429 HA PRO 54 HA PRO 54 10.006 -2.505 12.092 430 HB2 PRO 54 HB2 PRO 54 12.265 -2.070 10.311 431 HB3 PRO 54 HB1 PRO 54 11.737 -3.577 11.075 432 HG2 PRO 54 HG2 PRO 54 11.592 -3.140 8.420 433 HG3 PRO 54 HG1 PRO 54 10.481 -4.207 9.296 434 HD2 PRO 54 HD2 PRO 54 10.051 -1.401 8.350 435 HD3 PRO 54 HD1 PRO 54 8.941 -2.790 8.329 436 H ARG 55 HN ARG 55 9.005 0.215 11.230 437 HA ARG 55 HA ARG 55 11.057 1.736 12.621 438 HB2 ARG 55 HB2 ARG 55 10.886 1.823 9.840 439 HB3 ARG 55 HB1 ARG 55 10.057 3.282 10.374 440 HG2 ARG 55 HG2 ARG 55 12.013 3.901 11.694 441 HG3 ARG 55 HG1 ARG 55 12.842 2.444 11.148 442 HD2 ARG 55 HD2 ARG 55 13.673 4.032 9.697 443 HD3 ARG 55 HD1 ARG 55 12.329 3.376 8.769 444 HE ARG 55 HE ARG 55 11.092 5.350 9.225 445 HH11 ARG 55 HH11 ARG 55 14.391 5.469 10.397 446 HH12 ARG 55 HH12 ARG 55 14.429 7.202 10.493 447 HH21 ARG 55 HH21 ARG 55 11.140 7.627 9.340 448 HH22 ARG 55 HH22 ARG 55 12.581 8.435 9.881 449 H GLN 56 HN GLN 56 8.009 2.209 10.825 450 HA GLN 56 HA GLN 56 6.732 3.142 13.257 451 HB2 GLN 56 HB2 GLN 56 7.692 5.214 12.486 452 HB3 GLN 56 HB1 GLN 56 7.129 4.923 10.845 453 HG2 GLN 56 HG2 GLN 56 4.790 5.044 11.740 454 HG3 GLN 56 HG1 GLN 56 5.476 5.576 13.272 455 HE21 GLN 56 HE21 GLN 56 6.360 7.616 13.427 456 HE22 GLN 56 HE22 GLN 56 6.107 8.836 12.229 457 H THR 57 HN THR 57 4.694 2.466 13.302 458 HA THR 57 HA THR 57 3.535 1.348 10.872 459 HB THR 57 HB THR 57 3.370 -0.158 12.705 460 HG1 THR 57 HG1 THR 57 0.866 0.265 13.158 461 HG21 THR 57 HG21 THR 57 2.134 0.526 14.814 462 HG22 THR 57 HG22 THR 57 2.347 2.190 14.282 463 HG23 THR 57 HG23 THR 57 3.756 1.182 14.610 464 H VAL 58 HN VAL 58 2.317 2.644 9.664 465 HA VAL 58 HA VAL 58 1.015 4.921 10.982 466 HB VAL 58 HB VAL 58 0.545 5.615 8.529 467 HG11 VAL 58 HG11 VAL 58 2.024 6.789 10.064 468 HG12 VAL 58 HG12 VAL 58 2.685 6.759 8.429 469 HG13 VAL 58 HG13 VAL 58 3.332 5.674 9.662 470 HG21 VAL 58 HG21 VAL 58 2.768 3.612 8.157 471 HG22 VAL 58 HG22 VAL 58 2.343 4.856 6.983 472 HG23 VAL 58 HG23 VAL 58 1.177 3.599 7.395 473 H THR 59 HN THR 59 -1.089 5.374 10.847 474 HA THR 59 HA THR 59 -2.852 3.191 9.989 475 HB THR 59 HB THR 59 -3.601 5.471 11.817 476 HG1 THR 59 HG1 THR 59 -2.483 4.554 13.347 477 HG21 THR 59 HG21 THR 59 -5.467 4.209 10.909 478 HG22 THR 59 HG22 THR 59 -5.281 3.846 12.626 479 HG23 THR 59 HG23 THR 59 -4.720 2.693 11.414 480 H ASN 60 HN ASN 60 -3.842 3.531 8.124 481 HA ASN 60 HA ASN 60 -4.428 6.308 7.276 482 HB2 ASN 60 HB2 ASN 60 -3.849 3.811 5.662 483 HB3 ASN 60 HB1 ASN 60 -4.439 5.315 4.962 484 HD21 ASN 60 HD21 ASN 60 -1.736 3.663 6.355 485 HD22 ASN 60 HD22 ASN 60 -0.553 4.867 5.989 486 H SER 61 HN SER 61 -6.591 6.776 7.317 487 HA SER 61 HA SER 61 -8.484 4.526 7.040 488 HB2 SER 61 HB2 SER 61 -9.214 7.038 8.517 489 HB3 SER 61 HB1 SER 61 -9.872 5.411 8.683 490 HG SER 61 HG SER 61 -7.222 6.112 9.397 491 H PHE 62 HN PHE 62 -10.380 4.851 5.819 492 HA PHE 62 HA PHE 62 -10.848 7.395 4.556 493 HB2 PHE 62 HB2 PHE 62 -10.705 6.428 2.224 494 HB3 PHE 62 HB1 PHE 62 -9.167 6.697 3.030 495 HD1 PHE 62 HD1 PHE 62 -11.530 4.164 1.822 496 HD2 PHE 62 HD2 PHE 62 -7.744 4.867 3.639 497 HE1 PHE 62 HE1 PHE 62 -10.879 1.841 1.352 498 HE2 PHE 62 HE2 PHE 62 -7.088 2.545 3.172 499 HZ PHE 62 HZ PHE 62 -8.652 1.031 2.028 500 H THR 63 HN THR 63 -12.692 7.223 2.961 501 HA THR 63 HA THR 63 -14.602 5.154 3.822 502 HB THR 63 HB THR 63 -15.464 7.919 2.978 503 HG1 THR 63 HG1 THR 63 -14.998 7.108 5.685 504 HG21 THR 63 HG21 THR 63 -17.443 7.375 4.341 505 HG22 THR 63 HG22 THR 63 -16.738 5.805 4.726 506 HG23 THR 63 HG23 THR 63 -17.187 6.183 3.064 507 H LEU 64 HN LEU 64 -15.626 4.089 2.230 508 HA LEU 64 HA LEU 64 -14.679 4.112 -0.388 509 HB2 LEU 64 HB2 LEU 64 -17.339 3.103 0.632 510 HB3 LEU 64 HB1 LEU 64 -16.649 2.722 -0.931 511 HG LEU 64 HG LEU 64 -15.545 1.927 1.754 512 HD11 LEU 64 HD11 LEU 64 -16.702 0.283 -0.490 513 HD12 LEU 64 HD12 LEU 64 -17.501 0.649 1.041 514 HD13 LEU 64 HD13 LEU 64 -16.043 -0.340 1.022 515 HD21 LEU 64 HD21 LEU 64 -13.862 0.678 0.487 516 HD22 LEU 64 HD22 LEU 64 -13.727 2.415 0.219 517 HD23 LEU 64 HD23 LEU 64 -14.469 1.387 -1.008 518 H GLY 65 HN GLY 65 -14.867 5.617 -1.864 519 HA2 GLY 65 HA2 GLY 65 -16.097 6.787 -3.495 520 HA3 GLY 65 HA1 GLY 65 -17.510 6.715 -2.453 521 H LYS 66 HN LYS 66 -14.884 7.653 -0.618 522 HA LYS 66 HA LYS 66 -15.331 10.496 -1.202 523 HB2 LYS 66 HB2 LYS 66 -15.562 9.124 1.460 524 HB3 LYS 66 HB1 LYS 66 -15.196 10.840 1.346 525 HG2 LYS 66 HG2 LYS 66 -17.278 11.266 0.226 526 HG3 LYS 66 HG1 LYS 66 -17.618 9.535 0.125 527 HD2 LYS 66 HD2 LYS 66 -17.646 9.449 2.605 528 HD3 LYS 66 HD1 LYS 66 -17.426 11.198 2.635 529 HE2 LYS 66 HE2 LYS 66 -19.711 9.915 1.171 530 HE3 LYS 66 HE1 LYS 66 -19.802 10.278 2.892 531 HZ1 LYS 66 HZ1 LYS 66 -19.343 12.238 0.705 532 HZ2 LYS 66 HZ2 LYS 66 -19.314 12.610 2.354 533 HZ3 LYS 66 HZ3 LYS 66 -20.747 12.078 1.634 534 H GLU 67 HN GLU 67 -13.675 11.888 -0.640 535 HA GLU 67 HA GLU 67 -11.049 10.767 -0.820 536 HB2 GLU 67 HB2 GLU 67 -11.606 12.845 -1.980 537 HB3 GLU 67 HB1 GLU 67 -11.988 13.616 -0.446 538 HG2 GLU 67 HG2 GLU 67 -9.599 13.196 0.228 539 HG3 GLU 67 HG1 GLU 67 -9.302 12.731 -1.448 540 H ALA 68 HN ALA 68 -9.623 10.417 0.794 541 HA ALA 68 HA ALA 68 -10.276 11.527 3.437 542 HB1 ALA 68 HB1 ALA 68 -9.551 8.705 2.741 543 HB2 ALA 68 HB2 ALA 68 -10.975 9.291 3.599 544 HB3 ALA 68 HB3 ALA 68 -9.391 9.349 4.373 545 H ASP 69 HN ASP 69 -8.666 12.554 4.359 546 HA ASP 69 HA ASP 69 -6.089 12.641 3.098 547 HB2 ASP 69 HB2 ASP 69 -7.567 14.327 4.803 548 HB3 ASP 69 HB1 ASP 69 -6.123 13.872 5.706 549 H ILE 70 HN ILE 70 -4.586 11.186 3.436 550 HA ILE 70 HA ILE 70 -4.521 9.803 6.031 551 HB ILE 70 HB ILE 70 -3.434 7.904 4.702 552 HG12 ILE 70 HG12 ILE 70 -4.535 7.932 2.294 553 HG13 ILE 70 HG11 ILE 70 -4.381 9.673 2.491 554 HG21 ILE 70 HG21 ILE 70 -5.686 7.810 5.658 555 HG22 ILE 70 HG22 ILE 70 -5.591 6.941 4.126 556 HG23 ILE 70 HG23 ILE 70 -6.333 8.537 4.188 557 HD11 ILE 70 HD11 ILE 70 -2.491 8.680 1.287 558 HD12 ILE 70 HD12 ILE 70 -2.124 7.693 2.705 559 HD13 ILE 70 HD13 ILE 70 -1.993 9.447 2.796 560 H THR 71 HN THR 71 -2.192 8.717 6.292 561 HA THR 71 HA THR 71 -0.173 10.618 5.304 562 HB THR 71 HB THR 71 -0.248 9.803 8.209 563 HG1 THR 71 HG1 THR 71 -1.771 11.623 6.915 564 HG21 THR 71 HG21 THR 71 1.941 10.448 7.262 565 HG22 THR 71 HG22 THR 71 1.372 11.601 8.473 566 HG23 THR 71 HG23 THR 71 1.250 11.989 6.758 567 H THR 72 HN THR 72 1.642 9.693 4.648 568 HA THR 72 HA THR 72 1.960 6.844 4.939 569 HB THR 72 HB THR 72 2.485 7.863 2.784 570 HG1 THR 72 HG1 THR 72 4.594 6.921 2.540 571 HG21 THR 72 HG21 THR 72 3.237 10.052 3.483 572 HG22 THR 72 HG22 THR 72 4.501 9.275 2.527 573 HG23 THR 72 HG23 THR 72 4.645 9.349 4.279 574 H MET 73 HN MET 73 4.128 5.964 5.563 575 HA MET 73 HA MET 73 4.777 6.834 8.191 576 HB2 MET 73 HB2 MET 73 6.502 5.045 8.102 577 HB3 MET 73 HB1 MET 73 4.888 4.498 7.679 578 HG2 MET 73 HG2 MET 73 5.649 4.913 5.241 579 HG3 MET 73 HG1 MET 73 7.273 4.876 5.924 580 HE1 MET 73 HE1 MET 73 4.212 1.536 6.479 581 HE2 MET 73 HE2 MET 73 4.193 2.256 4.867 582 HE3 MET 73 HE3 MET 73 3.913 3.265 6.281 583 H ASP 74 HN ASP 74 5.898 7.839 5.158 584 HA ASP 74 HA ASP 74 8.549 8.553 5.998 585 HB2 ASP 74 HB2 ASP 74 8.424 8.238 3.684 586 HB3 ASP 74 HB1 ASP 74 6.911 9.123 3.542 587 H GLY 75 HN GLY 75 5.465 10.221 5.633 588 HA2 GLY 75 HA2 GLY 75 5.069 11.915 7.434 589 HA3 GLY 75 HA1 GLY 75 6.645 12.557 6.999 590 H LYS 76 HN LYS 76 4.704 11.415 4.422 591 HA LYS 76 HA LYS 76 4.312 14.170 3.531 592 HB2 LYS 76 HB2 LYS 76 4.307 11.522 2.099 593 HB3 LYS 76 HB1 LYS 76 3.697 12.982 1.339 594 HG2 LYS 76 HG2 LYS 76 6.453 12.876 2.503 595 HG3 LYS 76 HG1 LYS 76 6.111 12.280 0.879 596 HD2 LYS 76 HD2 LYS 76 5.178 14.494 0.299 597 HD3 LYS 76 HD1 LYS 76 5.623 15.080 1.901 598 HE2 LYS 76 HE2 LYS 76 7.323 15.765 0.381 599 HE3 LYS 76 HE1 LYS 76 7.989 14.472 1.376 600 HZ1 LYS 76 HZ1 LYS 76 8.516 14.257 -1.010 601 HZ2 LYS 76 HZ2 LYS 76 6.871 14.074 -1.347 602 HZ3 LYS 76 HZ3 LYS 76 7.674 12.919 -0.405 603 H LYS 77 HN LYS 77 2.358 15.072 3.401 604 HA LYS 77 HA LYS 77 0.082 13.541 4.345 605 HB2 LYS 77 HB2 LYS 77 0.518 16.462 3.746 606 HB3 LYS 77 HB1 LYS 77 -1.080 15.818 4.096 607 HG2 LYS 77 HG2 LYS 77 -0.345 16.606 6.156 608 HG3 LYS 77 HG1 LYS 77 -0.017 14.874 6.235 609 HD2 LYS 77 HD2 LYS 77 2.325 15.612 5.275 610 HD3 LYS 77 HD1 LYS 77 1.885 17.160 5.991 611 HE2 LYS 77 HE2 LYS 77 1.763 14.590 7.540 612 HE3 LYS 77 HE1 LYS 77 3.240 15.544 7.424 613 HZ1 LYS 77 HZ1 LYS 77 1.979 17.445 8.334 614 HZ2 LYS 77 HZ2 LYS 77 2.081 16.141 9.408 615 HZ3 LYS 77 HZ3 LYS 77 0.647 16.429 8.564 616 H LEU 78 HN LEU 78 -0.978 12.349 2.952 617 HA LEU 78 HA LEU 78 -1.417 13.396 0.232 618 HB2 LEU 78 HB2 LEU 78 -1.207 10.479 0.967 619 HB3 LEU 78 HB1 LEU 78 -1.262 11.170 -0.643 620 HG LEU 78 HG LEU 78 1.005 11.662 1.275 621 HD11 LEU 78 HD11 LEU 78 0.856 9.599 -0.916 622 HD12 LEU 78 HD12 LEU 78 0.779 9.255 0.812 623 HD13 LEU 78 HD13 LEU 78 2.244 9.946 0.114 624 HD21 LEU 78 HD21 LEU 78 0.689 13.271 -0.588 625 HD22 LEU 78 HD22 LEU 78 0.858 11.930 -1.724 626 HD23 LEU 78 HD23 LEU 78 2.205 12.375 -0.680 627 H LYS 79 HN LYS 79 -3.420 12.728 -0.764 628 HA LYS 79 HA LYS 79 -5.464 11.863 1.171 629 HB2 LYS 79 HB2 LYS 79 -7.058 13.336 -0.160 630 HB3 LYS 79 HB1 LYS 79 -5.908 14.169 0.877 631 HG2 LYS 79 HG2 LYS 79 -4.537 14.743 -1.005 632 HG3 LYS 79 HG1 LYS 79 -5.522 13.745 -2.077 633 HD2 LYS 79 HD2 LYS 79 -7.451 15.305 -1.159 634 HD3 LYS 79 HD1 LYS 79 -6.099 16.408 -0.891 635 HE2 LYS 79 HE2 LYS 79 -5.614 16.570 -3.144 636 HE3 LYS 79 HE1 LYS 79 -6.397 15.040 -3.525 637 HZ1 LYS 79 HZ1 LYS 79 -7.735 17.588 -2.833 638 HZ2 LYS 79 HZ2 LYS 79 -8.542 16.116 -3.033 639 HZ3 LYS 79 HZ3 LYS 79 -7.731 16.826 -4.341 640 H CYS 80 HN CYS 80 -6.499 10.080 0.552 641 HA CYS 80 HA CYS 80 -6.361 9.397 -2.310 642 HB2 CYS 80 HB2 CYS 80 -5.203 7.986 -0.327 643 HB3 CYS 80 HB1 CYS 80 -6.788 7.220 -0.348 644 H THR 81 HN THR 81 -8.203 9.324 -3.346 645 HA THR 81 HA THR 81 -10.721 9.179 -1.854 646 HB THR 81 HB THR 81 -10.500 9.568 -4.836 647 HG1 THR 81 HG1 THR 81 -9.144 11.133 -3.864 648 HG21 THR 81 HG21 THR 81 -12.481 10.679 -2.849 649 HG22 THR 81 HG22 THR 81 -12.721 9.174 -3.734 650 HG23 THR 81 HG23 THR 81 -12.600 10.705 -4.604 651 H VAL 82 HN VAL 82 -10.379 6.966 -1.329 652 HA VAL 82 HA VAL 82 -10.188 5.016 -3.435 653 HB VAL 82 HB VAL 82 -10.813 4.369 -0.572 654 HG11 VAL 82 HG11 VAL 82 -10.895 2.465 -1.903 655 HG12 VAL 82 HG12 VAL 82 -9.267 2.431 -1.218 656 HG13 VAL 82 HG13 VAL 82 -9.516 2.973 -2.883 657 HG21 VAL 82 HG21 VAL 82 -8.355 4.268 -0.191 658 HG22 VAL 82 HG22 VAL 82 -8.971 5.904 -0.426 659 HG23 VAL 82 HG23 VAL 82 -8.124 5.084 -1.738 660 H HIS 83 HN HIS 83 -11.756 3.780 -4.279 661 HA HIS 83 HA HIS 83 -14.397 3.834 -3.043 662 HB2 HIS 83 HB2 HIS 83 -15.544 4.447 -5.054 663 HB3 HIS 83 HB1 HIS 83 -14.292 5.650 -4.784 664 HD1 HIS 83 HD1 HIS 83 -15.725 3.798 -7.431 665 HD2 HIS 83 HD2 HIS 83 -11.824 4.819 -6.403 666 HE1 HIS 83 HE1 HIS 83 -14.378 3.555 -9.546 667 HE2 HIS 83 HE2 HIS 83 -12.044 4.279 -8.925 668 H LEU 84 HN LEU 84 -15.708 2.072 -3.533 669 HA LEU 84 HA LEU 84 -14.221 -0.258 -4.451 670 HB2 LEU 84 HB2 LEU 84 -15.494 -0.374 -2.337 671 HB3 LEU 84 HB1 LEU 84 -16.971 -0.045 -3.221 672 HG LEU 84 HG LEU 84 -16.433 -2.190 -4.548 673 HD11 LEU 84 HD11 LEU 84 -14.730 -2.672 -2.111 674 HD12 LEU 84 HD12 LEU 84 -14.109 -2.362 -3.731 675 HD13 LEU 84 HD13 LEU 84 -15.058 -3.816 -3.413 676 HD21 LEU 84 HD21 LEU 84 -18.298 -2.260 -3.149 677 HD22 LEU 84 HD22 LEU 84 -17.325 -2.073 -1.690 678 HD23 LEU 84 HD23 LEU 84 -17.301 -3.598 -2.576 679 H ALA 85 HN ALA 85 -14.222 -0.536 -6.573 680 HA ALA 85 HA ALA 85 -16.736 -0.122 -8.037 681 HB1 ALA 85 HB1 ALA 85 -15.099 1.501 -8.743 682 HB2 ALA 85 HB2 ALA 85 -15.317 0.316 -10.032 683 HB3 ALA 85 HB3 ALA 85 -13.897 0.235 -8.991 684 H ASN 86 HN ASN 86 -17.639 -1.913 -8.707 685 HA ASN 86 HA ASN 86 -18.007 -4.022 -9.431 686 HB2 ASN 86 HB2 ASN 86 -15.205 -3.794 -10.553 687 HB3 ASN 86 HB1 ASN 86 -16.373 -5.036 -10.980 688 HD21 ASN 86 HD21 ASN 86 -15.341 -1.808 -11.463 689 HD22 ASN 86 HD22 ASN 86 -16.482 -1.388 -12.690 690 H GLY 87 HN GLY 87 -16.885 -3.633 -6.779 691 HA2 GLY 87 HA2 GLY 87 -16.526 -5.203 -5.078 692 HA3 GLY 87 HA1 GLY 87 -16.130 -6.400 -6.302 693 H LYS 88 HN LYS 88 -14.335 -3.872 -7.208 694 HA LYS 88 HA LYS 88 -12.031 -4.774 -5.619 695 HB2 LYS 88 HB2 LYS 88 -12.209 -3.634 -8.408 696 HB3 LYS 88 HB1 LYS 88 -10.691 -3.708 -7.527 697 HG2 LYS 88 HG2 LYS 88 -10.659 -5.609 -8.849 698 HG3 LYS 88 HG1 LYS 88 -11.188 -6.217 -7.279 699 HD2 LYS 88 HD2 LYS 88 -13.564 -5.913 -8.145 700 HD3 LYS 88 HD1 LYS 88 -12.839 -5.707 -9.743 701 HE2 LYS 88 HE2 LYS 88 -11.740 -7.920 -9.460 702 HE3 LYS 88 HE1 LYS 88 -12.620 -8.121 -7.943 703 HZ1 LYS 88 HZ1 LYS 88 -13.702 -8.010 -10.686 704 HZ2 LYS 88 HZ2 LYS 88 -14.688 -7.751 -9.336 705 HZ3 LYS 88 HZ3 LYS 88 -13.885 -9.228 -9.525 706 H LEU 89 HN LEU 89 -10.539 -3.215 -4.864 707 HA LEU 89 HA LEU 89 -11.809 -0.638 -4.336 708 HB2 LEU 89 HB2 LEU 89 -10.714 -2.300 -2.588 709 HB3 LEU 89 HB1 LEU 89 -9.246 -1.470 -3.062 710 HG LEU 89 HG LEU 89 -10.027 0.599 -2.248 711 HD11 LEU 89 HD11 LEU 89 -12.364 0.708 -1.217 712 HD12 LEU 89 HD12 LEU 89 -12.708 -0.749 -2.149 713 HD13 LEU 89 HD13 LEU 89 -12.250 0.742 -2.975 714 HD21 LEU 89 HD21 LEU 89 -10.675 0.060 0.105 715 HD22 LEU 89 HD22 LEU 89 -9.227 -0.761 -0.475 716 HD23 LEU 89 HD23 LEU 89 -10.759 -1.634 -0.377 717 H VAL 90 HN VAL 90 -11.151 1.153 -5.300 718 HA VAL 90 HA VAL 90 -8.487 1.150 -6.558 719 HB VAL 90 HB VAL 90 -10.782 2.547 -7.868 720 HG11 VAL 90 HG11 VAL 90 -8.652 3.118 -8.733 721 HG12 VAL 90 HG12 VAL 90 -9.388 2.021 -9.904 722 HG13 VAL 90 HG13 VAL 90 -8.148 1.430 -8.799 723 HG21 VAL 90 HG21 VAL 90 -10.082 -0.353 -8.298 724 HG22 VAL 90 HG22 VAL 90 -11.195 0.593 -9.284 725 HG23 VAL 90 HG23 VAL 90 -11.574 0.269 -7.595 726 H CYS 91 HN CYS 91 -7.362 3.019 -6.508 727 HA CYS 91 HA CYS 91 -8.671 5.477 -5.648 728 HB2 CYS 91 HB2 CYS 91 -7.629 4.243 -3.624 729 HB3 CYS 91 HB1 CYS 91 -6.077 4.688 -4.333 730 H LYS 92 HN LYS 92 -8.318 6.513 -7.508 731 HA LYS 92 HA LYS 92 -5.564 6.548 -8.536 732 HB2 LYS 92 HB2 LYS 92 -7.158 5.584 -10.120 733 HB3 LYS 92 HB1 LYS 92 -8.179 7.010 -9.994 734 HG2 LYS 92 HG2 LYS 92 -6.186 8.324 -10.875 735 HG3 LYS 92 HG1 LYS 92 -5.485 6.760 -11.290 736 HD2 LYS 92 HD2 LYS 92 -6.587 7.570 -13.232 737 HD3 LYS 92 HD1 LYS 92 -7.590 6.272 -12.576 738 HE2 LYS 92 HE2 LYS 92 -9.080 7.888 -11.573 739 HE3 LYS 92 HE1 LYS 92 -8.029 9.213 -12.078 740 HZ1 LYS 92 HZ1 LYS 92 -9.556 7.398 -13.867 741 HZ2 LYS 92 HZ2 LYS 92 -8.474 8.588 -14.395 742 HZ3 LYS 92 HZ3 LYS 92 -9.883 9.031 -13.571 743 H SER 93 HN SER 93 -4.606 8.458 -9.059 744 HA SER 93 HA SER 93 -5.935 10.895 -8.077 745 HB2 SER 93 HB2 SER 93 -2.991 10.871 -8.412 746 HB3 SER 93 HB1 SER 93 -3.967 11.530 -7.101 747 HG SER 93 HG SER 93 -3.996 9.610 -6.115 748 H GLU 94 HN GLU 94 -4.297 12.802 -9.205 749 HA GLU 94 HA GLU 94 -5.068 12.632 -11.994 750 HB2 GLU 94 HB2 GLU 94 -3.547 14.856 -10.629 751 HB3 GLU 94 HB1 GLU 94 -4.439 14.944 -12.137 752 HG2 GLU 94 HG2 GLU 94 -5.891 15.960 -10.703 753 HG3 GLU 94 HG1 GLU 94 -6.480 14.300 -10.662 754 H LYS 95 HN LYS 95 -2.207 12.358 -10.050 755 HA LYS 95 HA LYS 95 -0.573 12.125 -12.493 756 HB2 LYS 95 HB2 LYS 95 -0.039 13.900 -10.683 757 HB3 LYS 95 HB1 LYS 95 0.547 12.541 -9.734 758 HG2 LYS 95 HG2 LYS 95 2.167 11.994 -11.442 759 HG3 LYS 95 HG1 LYS 95 1.543 13.275 -12.478 760 HD2 LYS 95 HD2 LYS 95 2.297 14.971 -10.974 761 HD3 LYS 95 HD1 LYS 95 2.702 13.771 -9.741 762 HE2 LYS 95 HE2 LYS 95 4.436 12.855 -11.194 763 HE3 LYS 95 HE1 LYS 95 4.015 14.020 -12.445 764 HZ1 LYS 95 HZ1 LYS 95 5.978 14.644 -11.107 765 HZ2 LYS 95 HZ2 LYS 95 4.989 14.755 -9.742 766 HZ3 LYS 95 HZ3 LYS 95 4.743 15.797 -11.048 767 H PHE 96 HN PHE 96 -1.786 10.407 -9.776 768 HA PHE 96 HA PHE 96 -0.031 8.153 -10.473 769 HB2 PHE 96 HB2 PHE 96 -0.960 8.628 -7.654 770 HB3 PHE 96 HB1 PHE 96 0.347 7.597 -8.227 771 HD1 PHE 96 HD2 PHE 96 2.441 8.646 -9.088 772 HD2 PHE 96 HD1 PHE 96 -0.582 10.889 -7.104 773 HE1 PHE 96 HE2 PHE 96 4.055 10.452 -8.677 774 HE2 PHE 96 HE1 PHE 96 1.026 12.703 -6.697 775 HZ PHE 96 HZ PHE 96 3.346 12.483 -7.484 776 H SER 97 HN SER 97 -0.959 6.075 -9.388 777 HA SER 97 HA SER 97 -3.815 5.988 -9.124 778 HB2 SER 97 HB2 SER 97 -2.801 4.233 -11.325 779 HB3 SER 97 HB1 SER 97 -4.425 4.856 -11.043 780 HG SER 97 HG SER 97 -3.172 6.995 -11.505 781 H HIS 98 HN HIS 98 -4.276 4.457 -7.679 782 HA HIS 98 HA HIS 98 -2.331 2.273 -7.309 783 HB2 HIS 98 HB2 HIS 98 -2.628 3.880 -5.381 784 HB3 HIS 98 HB1 HIS 98 -4.297 3.330 -5.267 785 HD2 HIS 98 HD2 HIS 98 -3.661 0.072 -5.550 786 HE1 HIS 98 HE1 HIS 98 -1.257 0.775 -2.132 787 HE2 HIS 98 HE2 HIS 98 -2.508 -0.976 -3.455 788 H GLU 99 HN GLU 99 -3.020 0.406 -8.049 789 HA GLU 99 HA GLU 99 -5.935 -0.041 -8.239 790 HB2 GLU 99 HB2 GLU 99 -5.066 -0.273 -10.383 791 HB3 GLU 99 HB1 GLU 99 -3.581 -1.022 -9.810 792 HG2 GLU 99 HG2 GLU 99 -5.033 -2.987 -9.121 793 HG3 GLU 99 HG1 GLU 99 -6.295 -2.249 -10.106 794 H GLN 100 HN GLN 100 -6.905 -1.605 -7.054 795 HA GLN 100 HA GLN 100 -5.224 -3.688 -5.817 796 HB2 GLN 100 HB2 GLN 100 -7.535 -2.282 -4.453 797 HB3 GLN 100 HB1 GLN 100 -6.546 -3.560 -3.769 798 HG2 GLN 100 HG2 GLN 100 -5.171 -2.048 -2.939 799 HG3 GLN 100 HG1 GLN 100 -4.815 -1.474 -4.569 800 HE21 GLN 100 HE21 GLN 100 -5.892 0.319 -5.363 801 HE22 GLN 100 HE22 GLN 100 -6.774 1.394 -4.343 802 H GLU 101 HN GLU 101 -5.909 -5.640 -6.532 803 HA GLU 101 HA GLU 101 -8.808 -5.992 -6.926 804 HB2 GLU 101 HB2 GLU 101 -7.793 -5.812 -9.126 805 HB3 GLU 101 HB1 GLU 101 -6.593 -7.026 -8.705 806 HG2 GLU 101 HG2 GLU 101 -8.066 -8.759 -8.914 807 HG3 GLU 101 HG1 GLU 101 -9.471 -7.758 -8.557 808 H VAL 102 HN VAL 102 -9.669 -7.642 -5.861 809 HA VAL 102 HA VAL 102 -7.851 -9.575 -4.604 810 HB VAL 102 HB VAL 102 -10.651 -8.712 -3.842 811 HG11 VAL 102 HG11 VAL 102 -8.961 -10.854 -2.557 812 HG12 VAL 102 HG12 VAL 102 -10.434 -11.122 -3.492 813 HG13 VAL 102 HG13 VAL 102 -10.508 -10.249 -1.960 814 HG21 VAL 102 HG21 VAL 102 -8.712 -7.252 -3.232 815 HG22 VAL 102 HG22 VAL 102 -8.104 -8.584 -2.248 816 HG23 VAL 102 HG23 VAL 102 -9.661 -7.843 -1.868 817 H LYS 103 HN LYS 103 -7.893 -11.637 -5.169 818 HA LYS 103 HA LYS 103 -10.207 -12.662 -6.667 819 HB2 LYS 103 HB2 LYS 103 -7.415 -12.449 -7.501 820 HB3 LYS 103 HB1 LYS 103 -8.054 -14.077 -7.664 821 HG2 LYS 103 HG2 LYS 103 -9.649 -11.794 -8.711 822 HG3 LYS 103 HG1 LYS 103 -8.240 -12.348 -9.617 823 HD2 LYS 103 HD2 LYS 103 -9.199 -14.662 -9.530 824 HD3 LYS 103 HD1 LYS 103 -10.660 -13.974 -8.821 825 HE2 LYS 103 HE2 LYS 103 -11.043 -12.649 -10.790 826 HE3 LYS 103 HE1 LYS 103 -9.509 -13.164 -11.488 827 HZ1 LYS 103 HZ1 LYS 103 -10.465 -15.493 -11.336 828 HZ2 LYS 103 HZ2 LYS 103 -11.120 -14.470 -12.512 829 HZ3 LYS 103 HZ3 LYS 103 -11.964 -14.750 -11.075 830 H GLY 104 HN GLY 104 -11.057 -13.856 -5.045 831 HA2 GLY 104 HA2 GLY 104 -11.328 -15.758 -3.779 832 HA3 GLY 104 HA1 GLY 104 -9.800 -16.340 -4.419 833 H ASN 105 HN ASN 105 -8.039 -16.285 -3.177 834 HA ASN 105 HA ASN 105 -8.265 -14.938 -0.561 835 HB2 ASN 105 HB2 ASN 105 -7.737 -17.689 -1.197 836 HB3 ASN 105 HB1 ASN 105 -6.328 -16.997 -0.406 837 HD21 ASN 105 HD21 ASN 105 -9.716 -17.760 -0.086 838 HD22 ASN 105 HD22 ASN 105 -9.773 -17.631 1.642 839 H GLU 106 HN GLU 106 -7.077 -14.253 -3.297 840 HA GLU 106 HA GLU 106 -4.467 -13.393 -2.252 841 HB2 GLU 106 HB2 GLU 106 -5.103 -14.706 -4.883 842 HB3 GLU 106 HB1 GLU 106 -3.696 -13.665 -4.706 843 HG2 GLU 106 HG2 GLU 106 -2.713 -15.118 -3.115 844 HG3 GLU 106 HG1 GLU 106 -4.211 -16.034 -2.928 845 H MET 107 HN MET 107 -3.853 -11.363 -2.788 846 HA MET 107 HA MET 107 -5.744 -9.766 -4.388 847 HB2 MET 107 HB2 MET 107 -5.736 -9.251 -1.927 848 HB3 MET 107 HB1 MET 107 -4.042 -8.800 -2.070 849 HG2 MET 107 HG2 MET 107 -5.293 -7.325 -4.048 850 HG3 MET 107 HG1 MET 107 -6.433 -7.296 -2.705 851 HE1 MET 107 HE1 MET 107 -4.059 -5.887 0.175 852 HE2 MET 107 HE2 MET 107 -4.141 -7.591 -0.276 853 HE3 MET 107 HE3 MET 107 -5.617 -6.633 -0.171 854 H VAL 108 HN VAL 108 -4.882 -8.481 -5.948 855 HA VAL 108 HA VAL 108 -1.949 -8.406 -6.159 856 HB VAL 108 HB VAL 108 -2.371 -8.318 -8.706 857 HG11 VAL 108 HG11 VAL 108 -1.273 -10.180 -7.592 858 HG12 VAL 108 HG12 VAL 108 -2.327 -10.757 -8.879 859 HG13 VAL 108 HG13 VAL 108 -2.840 -10.885 -7.195 860 HG21 VAL 108 HG21 VAL 108 -4.799 -8.037 -8.617 861 HG22 VAL 108 HG22 VAL 108 -4.960 -9.604 -7.828 862 HG23 VAL 108 HG23 VAL 108 -4.364 -9.510 -9.484 863 H GLU 109 HN GLU 109 -1.338 -6.358 -5.798 864 HA GLU 109 HA GLU 109 -3.056 -4.247 -6.905 865 HB2 GLU 109 HB2 GLU 109 -2.722 -2.895 -5.043 866 HB3 GLU 109 HB1 GLU 109 -2.895 -4.495 -4.344 867 HG2 GLU 109 HG2 GLU 109 -0.345 -4.592 -4.401 868 HG3 GLU 109 HG1 GLU 109 -0.426 -2.852 -4.680 869 H THR 110 HN THR 110 -2.159 -2.603 -7.978 870 HA THR 110 HA THR 110 0.745 -2.684 -8.481 871 HB THR 110 HB THR 110 -1.165 -1.818 -10.626 872 HG1 THR 110 HG1 THR 110 -1.986 -3.779 -10.634 873 HG21 THR 110 HG21 THR 110 1.513 -3.205 -10.696 874 HG22 THR 110 HG22 THR 110 1.260 -1.469 -10.868 875 HG23 THR 110 HG23 THR 110 0.625 -2.581 -12.082 876 H ILE 111 HN ILE 111 1.614 -0.821 -7.767 877 HA ILE 111 HA ILE 111 -0.060 1.615 -7.878 878 HB ILE 111 HB ILE 111 2.316 1.535 -6.079 879 HG12 ILE 111 HG12 ILE 111 -0.289 0.262 -5.229 880 HG13 ILE 111 HG11 ILE 111 1.106 -0.674 -5.761 881 HG21 ILE 111 HG21 ILE 111 1.010 3.558 -6.231 882 HG22 ILE 111 HG22 ILE 111 0.794 2.847 -4.632 883 HG23 ILE 111 HG23 ILE 111 -0.469 2.675 -5.850 884 HD11 ILE 111 HD11 ILE 111 1.323 1.309 -3.529 885 HD12 ILE 111 HD12 ILE 111 2.363 -0.069 -3.900 886 HD13 ILE 111 HD13 ILE 111 0.743 -0.335 -3.258 887 H THR 112 HN THR 112 1.302 3.656 -8.014 888 HA THR 112 HA THR 112 3.924 3.417 -9.209 889 HB THR 112 HB THR 112 1.699 4.725 -10.796 890 HG1 THR 112 HG1 THR 112 2.456 2.153 -10.651 891 HG21 THR 112 HG21 THR 112 3.898 5.784 -11.084 892 HG22 THR 112 HG22 THR 112 3.399 4.937 -12.549 893 HG23 THR 112 HG23 THR 112 4.600 4.216 -11.480 894 H PHE 113 HN PHE 113 5.046 4.852 -8.118 895 HA PHE 113 HA PHE 113 4.064 7.588 -7.872 896 HB2 PHE 113 HB2 PHE 113 4.299 5.714 -5.616 897 HB3 PHE 113 HB1 PHE 113 5.174 7.223 -5.377 898 HD1 PHE 113 HD2 PHE 113 1.876 5.699 -5.853 899 HD2 PHE 113 HD1 PHE 113 4.013 9.296 -5.084 900 HE1 PHE 113 HE2 PHE 113 -0.220 6.797 -5.180 901 HE2 PHE 113 HE1 PHE 113 1.919 10.400 -4.411 902 HZ PHE 113 HZ PHE 113 -0.201 9.147 -4.448 903 H GLY 114 HN GLY 114 5.747 9.106 -7.741 904 HA2 GLY 114 HA2 GLY 114 7.888 9.913 -7.997 905 HA3 GLY 114 HA1 GLY 114 8.442 8.452 -7.191 906 H GLY 115 HN GLY 115 6.525 8.072 -10.013 907 HA2 GLY 115 HA2 GLY 115 7.071 7.580 -12.206 908 HA3 GLY 115 HA1 GLY 115 8.740 8.000 -11.854 909 H VAL 116 HN VAL 116 7.450 5.790 -9.619 910 HA VAL 116 HA VAL 116 8.692 3.559 -11.088 911 HB VAL 116 HB VAL 116 8.579 3.784 -8.085 912 HG11 VAL 116 HG11 VAL 116 10.205 2.066 -9.950 913 HG12 VAL 116 HG12 VAL 116 8.859 1.543 -8.937 914 HG13 VAL 116 HG13 VAL 116 10.363 2.092 -8.194 915 HG21 VAL 116 HG21 VAL 116 10.645 4.807 -9.989 916 HG22 VAL 116 HG22 VAL 116 11.097 4.272 -8.370 917 HG23 VAL 116 HG23 VAL 116 9.945 5.593 -8.573 918 H THR 117 HN THR 117 7.328 1.968 -11.578 919 HA THR 117 HA THR 117 4.745 1.846 -10.237 920 HB THR 117 HB THR 117 5.778 0.282 -12.617 921 HG1 THR 117 HG1 THR 117 3.945 2.474 -12.509 922 HG21 THR 117 HG21 THR 117 3.973 -0.872 -11.365 923 HG22 THR 117 HG22 THR 117 3.477 -0.386 -12.984 924 HG23 THR 117 HG23 THR 117 2.947 0.545 -11.581 925 H LEU 118 HN LEU 118 5.247 0.981 -8.238 926 HA LEU 118 HA LEU 118 6.800 -1.412 -7.985 927 HB2 LEU 118 HB2 LEU 118 6.806 0.130 -6.129 928 HB3 LEU 118 HB1 LEU 118 5.062 0.048 -5.990 929 HG LEU 118 HG LEU 118 5.136 -2.155 -5.090 930 HD11 LEU 118 HD11 LEU 118 7.174 -3.487 -4.937 931 HD12 LEU 118 HD12 LEU 118 8.069 -2.219 -5.770 932 HD13 LEU 118 HD13 LEU 118 6.800 -3.098 -6.618 933 HD21 LEU 118 HD21 LEU 118 7.518 -0.766 -3.893 934 HD22 LEU 118 HD22 LEU 118 6.429 -1.904 -3.106 935 HD23 LEU 118 HD23 LEU 118 5.847 -0.302 -3.568 936 H ILE 119 HN ILE 119 6.066 -3.245 -8.730 937 HA ILE 119 HA ILE 119 3.207 -3.839 -8.584 938 HB ILE 119 HB ILE 119 5.442 -5.240 -10.064 939 HG12 ILE 119 HG12 ILE 119 3.461 -3.117 -10.775 940 HG13 ILE 119 HG11 ILE 119 5.142 -3.297 -11.265 941 HG21 ILE 119 HG21 ILE 119 3.628 -6.504 -11.172 942 HG22 ILE 119 HG22 ILE 119 2.452 -5.737 -10.099 943 HG23 ILE 119 HG23 ILE 119 3.685 -6.809 -9.436 944 HD11 ILE 119 HD11 ILE 119 3.786 -3.589 -13.182 945 HD12 ILE 119 HD12 ILE 119 2.748 -4.749 -12.352 946 HD13 ILE 119 HD13 ILE 119 4.416 -5.178 -12.742 947 H ARG 120 HN ARG 120 2.471 -5.117 -6.978 948 HA ARG 120 HA ARG 120 4.253 -7.178 -5.919 949 HB2 ARG 120 HB2 ARG 120 3.757 -6.515 -3.587 950 HB3 ARG 120 HB1 ARG 120 4.655 -5.284 -4.463 951 HG2 ARG 120 HG2 ARG 120 2.497 -4.100 -4.868 952 HG3 ARG 120 HG1 ARG 120 1.726 -5.270 -3.798 953 HD2 ARG 120 HD2 ARG 120 3.603 -4.557 -2.130 954 HD3 ARG 120 HD1 ARG 120 3.699 -3.124 -3.156 955 HE ARG 120 HE ARG 120 1.052 -3.885 -2.181 956 HH11 ARG 120 HH11 ARG 120 3.862 -1.820 -1.792 957 HH12 ARG 120 HH12 ARG 120 3.008 -0.630 -0.872 958 HH21 ARG 120 HH21 ARG 120 -0.074 -2.331 -1.012 959 HH22 ARG 120 HH22 ARG 120 0.750 -0.916 -0.428 960 H ARG 121 HN ARG 121 3.161 -8.772 -4.615 961 HA ARG 121 HA ARG 121 0.279 -8.959 -5.173 962 HB2 ARG 121 HB2 ARG 121 2.454 -11.039 -5.243 963 HB3 ARG 121 HB1 ARG 121 0.773 -11.496 -4.991 964 HG2 ARG 121 HG2 ARG 121 0.523 -11.525 -7.173 965 HG3 ARG 121 HG1 ARG 121 0.752 -9.779 -7.176 966 HD2 ARG 121 HD2 ARG 121 3.067 -11.690 -7.235 967 HD3 ARG 121 HD1 ARG 121 2.247 -11.170 -8.709 968 HE ARG 121 HE ARG 121 2.806 -8.843 -7.491 969 HH11 ARG 121 HH11 ARG 121 4.778 -11.644 -8.187 970 HH12 ARG 121 HH12 ARG 121 6.227 -10.725 -8.452 971 HH21 ARG 121 HH21 ARG 121 4.737 -7.626 -7.834 972 HH22 ARG 121 HH22 ARG 121 6.201 -8.463 -8.270 973 H SER 122 HN SER 122 -1.007 -9.733 -3.512 974 HA SER 122 HA SER 122 0.361 -10.150 -0.947 975 HB2 SER 122 HB2 SER 122 -2.078 -9.042 -0.273 976 HB3 SER 122 HB1 SER 122 -0.541 -8.182 -0.327 977 HG SER 122 HG SER 122 -1.658 -7.001 -1.704 978 H LYS 123 HN LYS 123 -0.140 -11.952 0.065 979 HA LYS 123 HA LYS 123 -2.499 -13.441 -0.874 980 HB2 LYS 123 HB2 LYS 123 -1.277 -15.406 0.222 981 HB3 LYS 123 HB1 LYS 123 -0.632 -14.784 -1.289 982 HG2 LYS 123 HG2 LYS 123 1.222 -13.857 -0.270 983 HG3 LYS 123 HG1 LYS 123 0.436 -13.768 1.311 984 HD2 LYS 123 HD2 LYS 123 2.094 -15.510 1.356 985 HD3 LYS 123 HD1 LYS 123 0.497 -16.249 1.405 986 HE2 LYS 123 HE2 LYS 123 0.650 -16.620 -1.044 987 HE3 LYS 123 HE1 LYS 123 2.303 -16.012 -0.997 988 HZ1 LYS 123 HZ1 LYS 123 1.270 -18.427 0.390 989 HZ2 LYS 123 HZ2 LYS 123 2.839 -17.818 0.572 990 HZ3 LYS 123 HZ3 LYS 123 2.324 -18.397 -0.932 991 H ARG 124 HN ARG 124 -4.027 -14.137 0.544 992 HA ARG 124 HA ARG 124 -4.147 -12.835 3.088 993 HB2 ARG 124 HB2 ARG 124 -6.018 -13.941 1.354 994 HB3 ARG 124 HB1 ARG 124 -6.003 -15.051 2.723 995 HG2 ARG 124 HG2 ARG 124 -6.376 -13.139 4.242 996 HG3 ARG 124 HG1 ARG 124 -6.509 -12.088 2.831 997 HD2 ARG 124 HD2 ARG 124 -8.714 -12.679 3.543 998 HD3 ARG 124 HD1 ARG 124 -8.383 -13.499 2.020 999 HE ARG 124 HE ARG 124 -7.834 -15.495 3.494 1000 HH11 ARG 124 HH11 ARG 124 -10.201 -13.056 4.368 1001 HH12 ARG 124 HH12 ARG 124 -11.107 -14.122 5.395 1002 HH21 ARG 124 HH21 ARG 124 -9.031 -16.897 4.846 1003 HH22 ARG 124 HH22 ARG 124 -10.432 -16.302 5.681 1004 H VAL 125 HN VAL 125 -4.461 -14.022 5.136 1005 HA VAL 125 HA VAL 125 -2.584 -16.239 5.234 1006 HB VAL 125 HB VAL 125 -2.750 -15.953 7.740 1007 HG11 VAL 125 HG11 VAL 125 -1.377 -13.882 7.746 1008 HG12 VAL 125 HG12 VAL 125 -1.776 -13.666 6.039 1009 HG13 VAL 125 HG13 VAL 125 -0.863 -15.081 6.560 1010 HG21 VAL 125 HG21 VAL 125 -4.314 -13.517 6.906 1011 HG22 VAL 125 HG22 VAL 125 -3.594 -13.732 8.499 1012 HG23 VAL 125 HG23 VAL 125 -4.855 -14.835 7.944 Start of MODEL 10 1 H1 ALA 1 HT1 ALA 1 -13.568 -9.506 -0.916 2 H2 ALA 1 HT2 ALA 1 -14.868 -10.197 -0.085 3 H3 ALA 1 HT3 ALA 1 -13.281 -10.602 0.336 4 HA ALA 1 HA ALA 1 -14.443 -7.894 0.574 5 HB1 ALA 1 HB1 ALA 1 -13.882 -9.862 2.787 6 HB2 ALA 1 HB2 ALA 1 -15.480 -9.580 2.095 7 HB3 ALA 1 HB3 ALA 1 -14.637 -8.273 2.930 8 H PHE 2 HN PHE 2 -13.047 -6.365 1.426 9 HA PHE 2 HA PHE 2 -10.222 -6.977 1.123 10 HB2 PHE 2 HB2 PHE 2 -11.872 -4.507 1.257 11 HB3 PHE 2 HB1 PHE 2 -10.219 -4.382 1.845 12 HD1 PHE 2 HD2 PHE 2 -12.141 -5.648 -1.086 13 HD2 PHE 2 HD1 PHE 2 -8.548 -3.889 0.360 14 HE1 PHE 2 HE2 PHE 2 -11.333 -5.403 -3.405 15 HE2 PHE 2 HE1 PHE 2 -7.743 -3.629 -1.949 16 HZ PHE 2 HZ PHE 2 -9.128 -4.399 -3.834 17 H SER 3 HN SER 3 -12.543 -6.300 3.639 18 HA SER 3 HA SER 3 -10.873 -5.654 5.776 19 HB2 SER 3 HB2 SER 3 -13.046 -7.242 6.715 20 HB3 SER 3 HB1 SER 3 -12.892 -5.484 6.720 21 HG SER 3 HG SER 3 -14.687 -6.687 5.447 22 H GLY 4 HN GLY 4 -9.070 -6.863 6.209 23 HA2 GLY 4 HA2 GLY 4 -9.160 -9.270 7.557 24 HA3 GLY 4 HA1 GLY 4 -8.936 -9.692 5.865 25 H THR 5 HN THR 5 -6.873 -10.575 6.366 26 HA THR 5 HA THR 5 -4.819 -8.500 6.707 27 HB THR 5 HB THR 5 -3.432 -10.358 7.788 28 HG1 THR 5 HG1 THR 5 -4.410 -12.211 8.077 29 HG21 THR 5 HG21 THR 5 -4.358 -8.397 8.983 30 HG22 THR 5 HG22 THR 5 -4.266 -9.839 9.996 31 HG23 THR 5 HG23 THR 5 -5.814 -9.332 9.324 32 H TRP 6 HN TRP 6 -3.582 -8.363 4.977 33 HA TRP 6 HA TRP 6 -3.140 -10.776 3.334 34 HB2 TRP 6 HB2 TRP 6 -2.997 -7.970 2.274 35 HB3 TRP 6 HB1 TRP 6 -3.185 -9.473 1.383 36 HD1 TRP 6 HD1 TRP 6 -5.191 -7.072 3.615 37 HE1 TRP 6 HE1 TRP 6 -7.685 -7.321 3.027 38 HE3 TRP 6 HE3 TRP 6 -4.866 -11.053 0.426 39 HZ2 TRP 6 HZ2 TRP 6 -9.300 -9.018 1.442 40 HZ3 TRP 6 HZ3 TRP 6 -6.933 -11.928 -0.580 41 HH2 TRP 6 HH2 TRP 6 -9.102 -10.931 -0.078 42 H GLN 7 HN GLN 7 -1.094 -11.385 3.028 43 HA GLN 7 HA GLN 7 1.027 -9.590 3.989 44 HB2 GLN 7 HB2 GLN 7 0.702 -11.927 4.973 45 HB3 GLN 7 HB1 GLN 7 1.293 -12.542 3.437 46 HG2 GLN 7 HG2 GLN 7 2.962 -10.503 4.755 47 HG3 GLN 7 HG1 GLN 7 2.857 -12.072 5.552 48 HE21 GLN 7 HE21 GLN 7 5.061 -10.675 4.125 49 HE22 GLN 7 HE22 GLN 7 5.608 -11.801 2.936 50 H VAL 8 HN VAL 8 2.034 -8.511 2.481 51 HA VAL 8 HA VAL 8 1.882 -9.204 -0.293 52 HB VAL 8 HB VAL 8 3.301 -6.979 1.164 53 HG11 VAL 8 HG11 VAL 8 3.833 -6.027 -1.037 54 HG12 VAL 8 HG12 VAL 8 3.279 -7.517 -1.801 55 HG13 VAL 8 HG13 VAL 8 4.690 -7.537 -0.739 56 HG21 VAL 8 HG21 VAL 8 0.833 -6.898 0.903 57 HG22 VAL 8 HG22 VAL 8 1.071 -6.893 -0.845 58 HG23 VAL 8 HG23 VAL 8 1.685 -5.560 0.134 59 H TYR 9 HN TYR 9 3.280 -10.252 -1.528 60 HA TYR 9 HA TYR 9 6.026 -10.629 -0.618 61 HB2 TYR 9 HB2 TYR 9 5.977 -13.044 -0.966 62 HB3 TYR 9 HB1 TYR 9 4.772 -12.591 0.225 63 HD1 TYR 9 HD1 TYR 9 2.441 -11.833 -1.322 64 HD2 TYR 9 HD2 TYR 9 5.270 -14.920 -2.083 65 HE1 TYR 9 HE1 TYR 9 0.760 -13.038 -2.649 66 HE2 TYR 9 HE2 TYR 9 3.586 -16.140 -3.391 67 HH TYR 9 HH TYR 9 0.698 -14.720 -4.440 68 H ALA 10 HN ALA 10 6.600 -9.198 -2.295 69 HA ALA 10 HA ALA 10 6.698 -10.471 -4.917 70 HB1 ALA 10 HB1 ALA 10 5.974 -8.405 -6.063 71 HB2 ALA 10 HB2 ALA 10 5.568 -7.702 -4.496 72 HB3 ALA 10 HB3 ALA 10 4.697 -9.120 -5.083 73 H GLN 11 HN GLN 11 8.289 -9.541 -6.326 74 HA GLN 11 HA GLN 11 10.191 -7.746 -5.016 75 HB2 GLN 11 HB2 GLN 11 10.765 -10.482 -6.084 76 HB3 GLN 11 HB1 GLN 11 12.009 -9.243 -6.126 77 HG2 GLN 11 HG2 GLN 11 10.558 -10.124 -3.646 78 HG3 GLN 11 HG1 GLN 11 12.151 -10.696 -4.143 79 HE21 GLN 11 HE21 GLN 11 10.325 -8.006 -2.896 80 HE22 GLN 11 HE22 GLN 11 11.689 -7.059 -2.404 81 H GLU 12 HN GLU 12 8.545 -6.724 -6.778 82 HA GLU 12 HA GLU 12 9.686 -6.769 -9.449 83 HB2 GLU 12 HB2 GLU 12 7.160 -6.438 -8.670 84 HB3 GLU 12 HB1 GLU 12 7.656 -4.755 -8.603 85 HG2 GLU 12 HG2 GLU 12 6.592 -5.389 -10.738 86 HG3 GLU 12 HG1 GLU 12 8.223 -4.759 -10.932 87 H ASN 13 HN ASN 13 9.024 -3.850 -9.657 88 HA ASN 13 HA ASN 13 11.626 -2.827 -9.064 89 HB2 ASN 13 HB2 ASN 13 9.285 -1.052 -9.721 90 HB3 ASN 13 HB1 ASN 13 10.972 -0.884 -10.205 91 HD21 ASN 13 HD21 ASN 13 7.911 -1.907 -11.133 92 HD22 ASN 13 HD22 ASN 13 8.352 -2.746 -12.583 93 H TYR 14 HN TYR 14 11.505 -3.425 -6.806 94 HA TYR 14 HA TYR 14 9.778 -1.847 -5.076 95 HB2 TYR 14 HB2 TYR 14 9.944 -4.262 -4.734 96 HB3 TYR 14 HB1 TYR 14 11.676 -4.122 -4.484 97 HD1 TYR 14 HD2 TYR 14 8.367 -3.528 -3.026 98 HD2 TYR 14 HD1 TYR 14 12.570 -3.316 -2.398 99 HE1 TYR 14 HE2 TYR 14 7.986 -3.263 -0.612 100 HE2 TYR 14 HE1 TYR 14 12.200 -3.054 0.019 101 HH TYR 14 HH TYR 14 9.638 -3.862 1.578 102 H GLU 15 HN GLU 15 13.264 -2.713 -5.035 103 HA GLU 15 HA GLU 15 13.974 -0.866 -3.083 104 HB2 GLU 15 HB2 GLU 15 16.297 -1.055 -4.065 105 HB3 GLU 15 HB1 GLU 15 15.531 -2.541 -3.512 106 HG2 GLU 15 HG2 GLU 15 15.075 -1.868 -6.318 107 HG3 GLU 15 HG1 GLU 15 16.737 -2.208 -5.877 108 H GLU 16 HN GLU 16 13.813 -0.438 -6.580 109 HA GLU 16 HA GLU 16 15.015 2.132 -6.573 110 HB2 GLU 16 HB2 GLU 16 13.323 0.637 -8.545 111 HB3 GLU 16 HB1 GLU 16 13.775 2.315 -8.827 112 HG2 GLU 16 HG2 GLU 16 16.093 1.767 -8.828 113 HG3 GLU 16 HG1 GLU 16 15.755 0.120 -8.295 114 H PHE 17 HN PHE 17 11.777 0.966 -6.075 115 HA PHE 17 HA PHE 17 10.439 3.447 -6.395 116 HB2 PHE 17 HB2 PHE 17 9.230 1.322 -6.508 117 HB3 PHE 17 HB1 PHE 17 9.654 0.974 -4.831 118 HD1 PHE 17 HD1 PHE 17 8.431 4.129 -6.380 119 HD2 PHE 17 HD2 PHE 17 7.650 0.930 -3.687 120 HE1 PHE 17 HE1 PHE 17 6.367 5.243 -5.658 121 HE2 PHE 17 HE2 PHE 17 5.579 2.040 -2.949 122 HZ PHE 17 HZ PHE 17 4.933 4.206 -3.937 123 H LEU 18 HN LEU 18 11.902 1.754 -3.673 124 HA LEU 18 HA LEU 18 11.039 3.501 -1.645 125 HB2 LEU 18 HB2 LEU 18 13.691 2.079 -1.623 126 HB3 LEU 18 HB1 LEU 18 12.686 2.516 -0.261 127 HG LEU 18 HG LEU 18 12.256 0.280 -2.226 128 HD11 LEU 18 HD11 LEU 18 13.411 -0.775 -0.645 129 HD12 LEU 18 HD12 LEU 18 11.938 -0.655 0.321 130 HD13 LEU 18 HD13 LEU 18 13.215 0.546 0.507 131 HD21 LEU 18 HD21 LEU 18 10.142 -0.183 -1.142 132 HD22 LEU 18 HD22 LEU 18 10.114 1.429 -1.851 133 HD23 LEU 18 HD23 LEU 18 10.331 1.238 -0.112 134 H LYS 19 HN LYS 19 13.749 3.595 -3.871 135 HA LYS 19 HA LYS 19 15.036 5.831 -2.643 136 HB2 LYS 19 HB2 LYS 19 15.348 4.968 -5.519 137 HB3 LYS 19 HB1 LYS 19 16.504 5.833 -4.519 138 HG2 LYS 19 HG2 LYS 19 16.045 3.469 -3.145 139 HG3 LYS 19 HG1 LYS 19 16.099 2.995 -4.841 140 HD2 LYS 19 HD2 LYS 19 18.262 4.063 -5.099 141 HD3 LYS 19 HD1 LYS 19 18.207 4.635 -3.430 142 HE2 LYS 19 HE2 LYS 19 18.148 2.301 -2.654 143 HE3 LYS 19 HE1 LYS 19 18.256 1.752 -4.323 144 HZ1 LYS 19 HZ1 LYS 19 20.310 3.527 -3.149 145 HZ2 LYS 19 HZ2 LYS 19 20.427 2.527 -4.511 146 HZ3 LYS 19 HZ3 LYS 19 20.383 1.844 -2.966 147 H ALA 20 HN ALA 20 12.287 5.458 -4.575 148 HA ALA 20 HA ALA 20 12.434 8.116 -5.731 149 HB1 ALA 20 HB1 ALA 20 11.564 6.144 -7.011 150 HB2 ALA 20 HB2 ALA 20 10.504 7.550 -6.982 151 HB3 ALA 20 HB3 ALA 20 10.157 6.168 -5.946 152 H LEU 21 HN LEU 21 11.463 6.789 -2.852 153 HA LEU 21 HA LEU 21 9.412 8.854 -2.434 154 HB2 LEU 21 HB2 LEU 21 9.958 6.529 -0.612 155 HB3 LEU 21 HB1 LEU 21 8.509 7.505 -0.722 156 HG LEU 21 HG LEU 21 9.393 5.781 -3.020 157 HD11 LEU 21 HD11 LEU 21 7.313 4.703 -1.240 158 HD12 LEU 21 HD12 LEU 21 8.960 4.650 -0.613 159 HD13 LEU 21 HD13 LEU 21 8.579 3.883 -2.151 160 HD21 LEU 21 HD21 LEU 21 7.693 6.980 -3.873 161 HD22 LEU 21 HD22 LEU 21 7.034 7.377 -2.291 162 HD23 LEU 21 HD23 LEU 21 6.697 5.803 -3.015 163 H ALA 22 HN ALA 22 12.486 8.751 -2.298 164 HA ALA 22 HA ALA 22 14.160 9.765 -1.166 165 HB1 ALA 22 HB1 ALA 22 12.536 11.674 -1.241 166 HB2 ALA 22 HB2 ALA 22 13.679 11.729 0.099 167 HB3 ALA 22 HB3 ALA 22 12.015 11.212 0.383 168 H LEU 23 HN LEU 23 13.225 7.242 -0.216 169 HA LEU 23 HA LEU 23 13.235 7.378 2.686 170 HB2 LEU 23 HB2 LEU 23 13.403 4.939 0.902 171 HB3 LEU 23 HB1 LEU 23 13.060 4.952 2.623 172 HG LEU 23 HG LEU 23 11.298 5.746 0.343 173 HD11 LEU 23 HD11 LEU 23 9.681 4.367 1.517 174 HD12 LEU 23 HD12 LEU 23 10.841 4.097 2.815 175 HD13 LEU 23 HD13 LEU 23 11.167 3.475 1.197 176 HD21 LEU 23 HD21 LEU 23 11.104 6.721 3.177 177 HD22 LEU 23 HD22 LEU 23 9.723 6.668 2.079 178 HD23 LEU 23 HD23 LEU 23 11.120 7.674 1.692 179 HA PRO 24 HA PRO 24 17.564 6.797 3.311 180 HB2 PRO 24 HB2 PRO 24 17.246 4.722 5.316 181 HB3 PRO 24 HB1 PRO 24 17.690 6.420 5.549 182 HG2 PRO 24 HG2 PRO 24 15.340 5.367 6.386 183 HG3 PRO 24 HG1 PRO 24 15.553 7.069 5.936 184 HD2 PRO 24 HD2 PRO 24 14.348 4.839 4.366 185 HD3 PRO 24 HD1 PRO 24 13.850 6.537 4.482 186 H GLU 25 HN GLU 25 18.809 5.799 1.895 187 HA GLU 25 HA GLU 25 18.231 3.407 0.603 188 HB2 GLU 25 HB2 GLU 25 20.899 4.769 0.987 189 HB3 GLU 25 HB1 GLU 25 20.613 3.447 -0.135 190 HG2 GLU 25 HG2 GLU 25 18.887 4.848 -1.249 191 HG3 GLU 25 HG1 GLU 25 19.373 6.184 -0.207 192 H ASP 26 HN ASP 26 19.817 3.982 3.617 193 HA ASP 26 HA ASP 26 21.091 1.477 3.927 194 HB2 ASP 26 HB2 ASP 26 21.531 3.537 5.312 195 HB3 ASP 26 HB1 ASP 26 19.994 3.254 6.122 196 H LEU 27 HN LEU 27 17.878 2.673 4.835 197 HA LEU 27 HA LEU 27 17.085 0.200 6.048 198 HB2 LEU 27 HB2 LEU 27 16.178 2.612 6.409 199 HB3 LEU 27 HB1 LEU 27 15.165 2.250 5.024 200 HG LEU 27 HG LEU 27 14.697 0.064 6.534 201 HD11 LEU 27 HD11 LEU 27 16.100 0.861 8.356 202 HD12 LEU 27 HD12 LEU 27 14.412 0.742 8.849 203 HD13 LEU 27 HD13 LEU 27 15.116 2.320 8.486 204 HD21 LEU 27 HD21 LEU 27 12.874 1.169 5.670 205 HD22 LEU 27 HD22 LEU 27 13.355 2.721 6.348 206 HD23 LEU 27 HD23 LEU 27 12.690 1.467 7.398 207 H ILE 28 HN ILE 28 16.898 1.670 2.903 208 HA ILE 28 HA ILE 28 14.986 0.073 1.663 209 HB ILE 28 HB ILE 28 17.458 1.390 0.531 210 HG12 ILE 28 HG12 ILE 28 14.548 2.213 0.437 211 HG13 ILE 28 HG11 ILE 28 15.718 2.840 1.588 212 HG21 ILE 28 HG21 ILE 28 15.096 0.354 -1.024 213 HG22 ILE 28 HG22 ILE 28 16.635 -0.496 -0.887 214 HG23 ILE 28 HG23 ILE 28 16.565 1.087 -1.666 215 HD11 ILE 28 HD11 ILE 28 15.135 3.760 -1.019 216 HD12 ILE 28 HD12 ILE 28 16.798 3.170 -1.006 217 HD13 ILE 28 HD13 ILE 28 16.289 4.402 0.148 218 H LYS 29 HN LYS 29 18.387 -0.483 2.318 219 HA LYS 29 HA LYS 29 18.759 -2.772 0.733 220 HB2 LYS 29 HB2 LYS 29 20.095 -2.008 3.333 221 HB3 LYS 29 HB1 LYS 29 20.664 -3.251 2.229 222 HG2 LYS 29 HG2 LYS 29 21.012 -1.556 0.506 223 HG3 LYS 29 HG1 LYS 29 20.432 -0.315 1.621 224 HD2 LYS 29 HD2 LYS 29 22.916 -2.013 1.881 225 HD3 LYS 29 HD1 LYS 29 22.833 -0.271 1.648 226 HE2 LYS 29 HE2 LYS 29 21.407 -0.464 3.902 227 HE3 LYS 29 HE1 LYS 29 22.440 -1.880 4.097 228 HZ1 LYS 29 HZ1 LYS 29 24.326 -0.599 4.199 229 HZ2 LYS 29 HZ2 LYS 29 23.217 0.415 4.984 230 HZ3 LYS 29 HZ3 LYS 29 23.641 0.707 3.367 231 H MET 30 HN MET 30 17.637 -2.367 4.066 232 HA MET 30 HA MET 30 17.491 -5.181 4.595 233 HB2 MET 30 HB2 MET 30 16.092 -2.943 6.061 234 HB3 MET 30 HB1 MET 30 16.458 -4.548 6.678 235 HG2 MET 30 HG2 MET 30 18.629 -4.051 7.090 236 HG3 MET 30 HG1 MET 30 18.732 -2.908 5.753 237 HE1 MET 30 HE1 MET 30 20.261 -2.020 8.148 238 HE2 MET 30 HE2 MET 30 19.644 -0.396 8.449 239 HE3 MET 30 HE3 MET 30 19.898 -0.950 6.795 240 H ALA 31 HN ALA 31 15.323 -2.689 3.500 241 HA ALA 31 HA ALA 31 12.882 -4.036 3.800 242 HB1 ALA 31 HB1 ALA 31 13.170 -1.608 3.361 243 HB2 ALA 31 HB2 ALA 31 11.970 -2.384 2.327 244 HB3 ALA 31 HB3 ALA 31 13.569 -2.002 1.688 245 H ARG 32 HN ARG 32 15.413 -4.448 1.482 246 HA ARG 32 HA ARG 32 13.875 -5.571 -0.617 247 HB2 ARG 32 HB2 ARG 32 16.805 -5.829 0.068 248 HB3 ARG 32 HB1 ARG 32 16.088 -6.476 -1.402 249 HG2 ARG 32 HG2 ARG 32 15.451 -4.236 -2.096 250 HG3 ARG 32 HG1 ARG 32 16.094 -3.573 -0.590 251 HD2 ARG 32 HD2 ARG 32 17.753 -3.214 -2.238 252 HD3 ARG 32 HD1 ARG 32 18.328 -4.552 -1.249 253 HE ARG 32 HE ARG 32 17.031 -4.935 -3.881 254 HH11 ARG 32 HH11 ARG 32 19.580 -5.688 -1.587 255 HH12 ARG 32 HH12 ARG 32 20.278 -6.922 -2.582 256 HH21 ARG 32 HH21 ARG 32 17.958 -6.568 -5.181 257 HH22 ARG 32 HH22 ARG 32 19.377 -7.403 -4.631 258 H ASP 33 HN ASP 33 14.615 -6.707 2.437 259 HA ASP 33 HA ASP 33 14.179 -9.506 1.624 260 HB2 ASP 33 HB2 ASP 33 16.338 -9.292 2.687 261 HB3 ASP 33 HB1 ASP 33 15.641 -8.392 4.032 262 H ILE 34 HN ILE 34 13.304 -6.940 3.852 263 HA ILE 34 HA ILE 34 11.531 -8.442 5.467 264 HB ILE 34 HB ILE 34 11.416 -5.467 4.976 265 HG12 ILE 34 HG12 ILE 34 13.169 -7.138 6.764 266 HG13 ILE 34 HG11 ILE 34 13.646 -5.875 5.640 267 HG21 ILE 34 HG21 ILE 34 10.196 -5.281 6.969 268 HG22 ILE 34 HG22 ILE 34 10.646 -6.904 7.498 269 HG23 ILE 34 HG23 ILE 34 9.498 -6.699 6.177 270 HD11 ILE 34 HD11 ILE 34 13.899 -4.863 7.684 271 HD12 ILE 34 HD12 ILE 34 12.463 -5.628 8.360 272 HD13 ILE 34 HD13 ILE 34 12.297 -4.324 7.187 273 H LYS 35 HN LYS 35 9.575 -9.147 5.116 274 HA LYS 35 HA LYS 35 7.962 -7.936 2.968 275 HB2 LYS 35 HB2 LYS 35 8.102 -10.855 3.770 276 HB3 LYS 35 HB1 LYS 35 6.975 -10.189 2.598 277 HG2 LYS 35 HG2 LYS 35 8.933 -9.487 1.222 278 HG3 LYS 35 HG1 LYS 35 9.973 -10.344 2.365 279 HD2 LYS 35 HD2 LYS 35 8.598 -12.403 1.897 280 HD3 LYS 35 HD1 LYS 35 7.831 -11.499 0.588 281 HE2 LYS 35 HE2 LYS 35 9.692 -12.909 -0.215 282 HE3 LYS 35 HE1 LYS 35 9.973 -11.197 -0.502 283 HZ1 LYS 35 HZ1 LYS 35 11.075 -12.608 1.851 284 HZ2 LYS 35 HZ2 LYS 35 11.515 -11.093 1.241 285 HZ3 LYS 35 HZ3 LYS 35 11.907 -12.494 0.381 286 HA PRO 36 HA PRO 36 5.810 -7.553 7.007 287 HB2 PRO 36 HB2 PRO 36 4.799 -5.077 6.544 288 HB3 PRO 36 HB1 PRO 36 6.435 -5.354 7.169 289 HG2 PRO 36 HG2 PRO 36 5.561 -4.673 4.418 290 HG3 PRO 36 HG1 PRO 36 6.987 -4.128 5.323 291 HD2 PRO 36 HD2 PRO 36 7.051 -6.088 3.408 292 HD3 PRO 36 HD1 PRO 36 8.212 -5.962 4.741 293 H ILE 37 HN ILE 37 3.555 -7.252 7.526 294 HA ILE 37 HA ILE 37 1.835 -8.068 5.288 295 HB ILE 37 HB ILE 37 2.039 -9.703 7.114 296 HG12 ILE 37 HG12 ILE 37 -0.222 -9.053 5.820 297 HG13 ILE 37 HG11 ILE 37 -0.142 -10.359 7.001 298 HG21 ILE 37 HG21 ILE 37 0.971 -9.173 9.323 299 HG22 ILE 37 HG22 ILE 37 0.961 -7.478 8.827 300 HG23 ILE 37 HG23 ILE 37 2.491 -8.337 9.000 301 HD11 ILE 37 HD11 ILE 37 -1.025 -8.877 8.715 302 HD12 ILE 37 HD12 ILE 37 -2.109 -8.963 7.326 303 HD13 ILE 37 HD13 ILE 37 -1.076 -7.551 7.552 304 H VAL 38 HN VAL 38 -0.096 -7.008 4.910 305 HA VAL 38 HA VAL 38 -0.328 -4.372 6.189 306 HB VAL 38 HB VAL 38 -1.553 -5.407 3.622 307 HG11 VAL 38 HG11 VAL 38 -2.280 -3.117 3.218 308 HG12 VAL 38 HG12 VAL 38 -1.644 -2.620 4.786 309 HG13 VAL 38 HG13 VAL 38 -2.999 -3.751 4.698 310 HG21 VAL 38 HG21 VAL 38 -0.018 -3.840 2.517 311 HG22 VAL 38 HG22 VAL 38 0.848 -5.068 3.442 312 HG23 VAL 38 HG23 VAL 38 0.686 -3.436 4.085 313 H GLU 39 HN GLU 39 -1.722 -4.272 7.819 314 HA GLU 39 HA GLU 39 -3.948 -6.152 7.951 315 HB2 GLU 39 HB2 GLU 39 -2.380 -4.607 9.869 316 HB3 GLU 39 HB1 GLU 39 -4.112 -4.484 10.159 317 HG2 GLU 39 HG2 GLU 39 -4.345 -6.787 10.467 318 HG3 GLU 39 HG1 GLU 39 -2.778 -7.126 9.746 319 H ILE 40 HN ILE 40 -5.935 -5.616 7.308 320 HA ILE 40 HA ILE 40 -6.651 -2.769 7.263 321 HB ILE 40 HB ILE 40 -6.038 -3.361 4.994 322 HG12 ILE 40 HG12 ILE 40 -8.180 -1.937 5.619 323 HG13 ILE 40 HG11 ILE 40 -7.799 -2.318 3.943 324 HG21 ILE 40 HG21 ILE 40 -7.121 -5.054 3.701 325 HG22 ILE 40 HG22 ILE 40 -8.177 -5.464 5.051 326 HG23 ILE 40 HG23 ILE 40 -6.445 -5.773 5.161 327 HD11 ILE 40 HD11 ILE 40 -10.137 -2.648 4.295 328 HD12 ILE 40 HD12 ILE 40 -9.837 -3.669 5.698 329 HD13 ILE 40 HD13 ILE 40 -9.384 -4.226 4.086 330 H GLN 41 HN GLN 41 -8.538 -2.303 8.120 331 HA GLN 41 HA GLN 41 -10.576 -4.399 8.387 332 HB2 GLN 41 HB2 GLN 41 -11.036 -3.554 10.704 333 HB3 GLN 41 HB1 GLN 41 -9.494 -4.383 10.529 334 HG2 GLN 41 HG2 GLN 41 -8.299 -2.322 10.548 335 HG3 GLN 41 HG1 GLN 41 -9.791 -1.391 10.447 336 HE21 GLN 41 HE21 GLN 41 -11.110 -1.230 12.267 337 HE22 GLN 41 HE22 GLN 41 -10.528 -1.582 13.855 338 H GLN 42 HN GLN 42 -12.702 -3.634 8.262 339 HA GLN 42 HA GLN 42 -12.970 -0.729 7.861 340 HB2 GLN 42 HB2 GLN 42 -14.487 -1.030 6.059 341 HB3 GLN 42 HB1 GLN 42 -13.038 -1.961 5.719 342 HG2 GLN 42 HG2 GLN 42 -14.093 -3.931 5.894 343 HG3 GLN 42 HG1 GLN 42 -15.237 -3.362 7.091 344 HE21 GLN 42 HE21 GLN 42 -15.514 -4.811 4.480 345 HE22 GLN 42 HE22 GLN 42 -16.706 -3.898 3.629 346 H LYS 43 HN LYS 43 -15.634 -0.566 7.427 347 HA LYS 43 HA LYS 43 -17.165 -1.863 9.477 348 HB2 LYS 43 HB2 LYS 43 -16.139 0.925 9.892 349 HB3 LYS 43 HB1 LYS 43 -17.749 0.522 10.454 350 HG2 LYS 43 HG2 LYS 43 -15.223 -0.894 11.285 351 HG3 LYS 43 HG1 LYS 43 -16.067 0.341 12.224 352 HD2 LYS 43 HD2 LYS 43 -17.215 -2.321 11.387 353 HD3 LYS 43 HD1 LYS 43 -16.592 -1.932 12.990 354 HE2 LYS 43 HE2 LYS 43 -18.296 -0.153 13.173 355 HE3 LYS 43 HE1 LYS 43 -18.956 -0.658 11.617 356 HZ1 LYS 43 HZ1 LYS 43 -18.869 -2.217 14.131 357 HZ2 LYS 43 HZ2 LYS 43 -19.261 -2.897 12.636 358 HZ3 LYS 43 HZ3 LYS 43 -20.236 -1.684 13.294 359 H GLY 44 HN GLY 44 -17.380 -1.544 6.647 360 HA2 GLY 44 HA2 GLY 44 -19.559 -1.460 5.568 361 HA3 GLY 44 HA1 GLY 44 -19.908 -0.022 6.520 362 H ASP 45 HN ASP 45 -18.439 1.862 6.125 363 HA ASP 45 HA ASP 45 -17.593 1.935 3.296 364 HB2 ASP 45 HB2 ASP 45 -18.786 4.208 4.898 365 HB3 ASP 45 HB1 ASP 45 -18.185 4.330 3.253 366 H ASP 46 HN ASP 46 -17.019 2.964 6.582 367 HA ASP 46 HA ASP 46 -14.608 4.401 5.925 368 HB2 ASP 46 HB2 ASP 46 -15.801 3.598 8.588 369 HB3 ASP 46 HB1 ASP 46 -14.364 4.593 8.393 370 H PHE 47 HN PHE 47 -12.690 3.562 5.688 371 HA PHE 47 HA PHE 47 -12.168 0.852 6.723 372 HB2 PHE 47 HB2 PHE 47 -11.202 2.289 4.270 373 HB3 PHE 47 HB1 PHE 47 -10.299 0.937 4.931 374 HD1 PHE 47 HD2 PHE 47 -13.935 1.560 4.390 375 HD2 PHE 47 HD1 PHE 47 -10.568 -0.904 3.611 376 HE1 PHE 47 HE2 PHE 47 -15.370 -0.001 3.146 377 HE2 PHE 47 HE1 PHE 47 -11.991 -2.474 2.361 378 HZ PHE 47 HZ PHE 47 -14.399 -2.018 2.127 379 H VAL 48 HN VAL 48 -10.180 0.418 7.633 380 HA VAL 48 HA VAL 48 -8.445 2.702 8.243 381 HB VAL 48 HB VAL 48 -9.290 0.575 10.226 382 HG11 VAL 48 HG11 VAL 48 -7.954 1.900 11.844 383 HG12 VAL 48 HG12 VAL 48 -7.367 2.884 10.500 384 HG13 VAL 48 HG13 VAL 48 -6.982 1.163 10.570 385 HG21 VAL 48 HG21 VAL 48 -10.154 2.583 11.502 386 HG22 VAL 48 HG22 VAL 48 -11.068 2.120 10.067 387 HG23 VAL 48 HG23 VAL 48 -9.966 3.493 10.003 388 H VAL 49 HN VAL 49 -6.728 2.201 7.075 389 HA VAL 49 HA VAL 49 -5.783 -0.572 6.979 390 HB VAL 49 HB VAL 49 -4.802 1.822 5.413 391 HG11 VAL 49 HG11 VAL 49 -3.334 -0.299 5.788 392 HG12 VAL 49 HG12 VAL 49 -3.471 0.406 4.178 393 HG13 VAL 49 HG13 VAL 49 -4.414 -1.025 4.598 394 HG21 VAL 49 HG21 VAL 49 -7.119 1.361 4.863 395 HG22 VAL 49 HG22 VAL 49 -6.747 -0.345 4.623 396 HG23 VAL 49 HG23 VAL 49 -6.073 0.863 3.533 397 H THR 50 HN THR 50 -4.257 -1.203 8.307 398 HA THR 50 HA THR 50 -2.580 0.805 9.640 399 HB THR 50 HB THR 50 -3.121 -2.088 10.341 400 HG1 THR 50 HG1 THR 50 -4.440 0.228 10.888 401 HG21 THR 50 HG21 THR 50 -0.859 -1.167 11.010 402 HG22 THR 50 HG22 THR 50 -1.869 -1.782 12.317 403 HG23 THR 50 HG23 THR 50 -1.728 -0.044 12.059 404 H SER 51 HN SER 51 -0.649 1.115 8.779 405 HA SER 51 HA SER 51 0.627 -1.045 7.267 406 HB2 SER 51 HB2 SER 51 1.646 1.784 7.458 407 HB3 SER 51 HB1 SER 51 1.877 0.608 6.161 408 HG SER 51 HG SER 51 -0.653 0.861 6.208 409 H LYS 52 HN LYS 52 1.541 -2.323 8.759 410 HA LYS 52 HA LYS 52 3.068 -1.239 10.981 411 HB2 LYS 52 HB2 LYS 52 2.325 -4.044 10.156 412 HB3 LYS 52 HB1 LYS 52 3.429 -3.716 11.487 413 HG2 LYS 52 HG2 LYS 52 0.631 -2.620 11.352 414 HG3 LYS 52 HG1 LYS 52 1.038 -4.148 12.131 415 HD2 LYS 52 HD2 LYS 52 2.604 -2.941 13.609 416 HD3 LYS 52 HD1 LYS 52 2.111 -1.424 12.864 417 HE2 LYS 52 HE2 LYS 52 -0.280 -2.147 13.546 418 HE3 LYS 52 HE1 LYS 52 0.545 -3.255 14.639 419 HZ1 LYS 52 HZ1 LYS 52 1.721 -1.314 15.576 420 HZ2 LYS 52 HZ2 LYS 52 0.044 -1.243 15.797 421 HZ3 LYS 52 HZ3 LYS 52 0.779 -0.294 14.606 422 H THR 53 HN THR 53 5.153 -0.791 10.817 423 HA THR 53 HA THR 53 6.817 -2.384 8.991 424 HB THR 53 HB THR 53 7.850 -0.493 8.030 425 HG1 THR 53 HG1 THR 53 6.559 1.518 9.395 426 HG21 THR 53 HG21 THR 53 5.445 -0.874 7.327 427 HG22 THR 53 HG22 THR 53 6.114 0.719 6.986 428 HG23 THR 53 HG23 THR 53 5.017 0.503 8.356 429 HA PRO 54 HA PRO 54 9.680 -2.388 12.377 430 HB2 PRO 54 HB2 PRO 54 12.023 -2.307 10.723 431 HB3 PRO 54 HB1 PRO 54 11.263 -3.719 11.468 432 HG2 PRO 54 HG2 PRO 54 11.360 -3.235 8.770 433 HG3 PRO 54 HG1 PRO 54 10.207 -4.311 9.579 434 HD2 PRO 54 HD2 PRO 54 9.803 -1.547 8.547 435 HD3 PRO 54 HD1 PRO 54 8.671 -2.909 8.627 436 H ARG 55 HN ARG 55 9.068 0.308 10.854 437 HA ARG 55 HA ARG 55 11.176 1.782 12.265 438 HB2 ARG 55 HB2 ARG 55 10.825 1.683 9.480 439 HB3 ARG 55 HB1 ARG 55 10.202 3.248 9.983 440 HG2 ARG 55 HG2 ARG 55 12.408 3.421 11.316 441 HG3 ARG 55 HG1 ARG 55 12.956 2.145 10.227 442 HD2 ARG 55 HD2 ARG 55 12.600 3.506 8.313 443 HD3 ARG 55 HD1 ARG 55 11.702 4.697 9.248 444 HE ARG 55 HE ARG 55 14.472 4.314 10.021 445 HH11 ARG 55 HH11 ARG 55 12.148 6.183 8.183 446 HH12 ARG 55 HH12 ARG 55 13.212 7.539 7.972 447 HH21 ARG 55 HH21 ARG 55 15.874 6.113 9.747 448 HH22 ARG 55 HH22 ARG 55 15.314 7.499 8.865 449 H GLN 56 HN GLN 56 8.063 2.261 10.590 450 HA GLN 56 HA GLN 56 6.963 3.529 12.956 451 HB2 GLN 56 HB2 GLN 56 8.173 5.328 11.650 452 HB3 GLN 56 HB1 GLN 56 7.016 5.060 10.354 453 HG2 GLN 56 HG2 GLN 56 5.192 5.670 11.852 454 HG3 GLN 56 HG1 GLN 56 6.350 5.941 13.155 455 HE21 GLN 56 HE21 GLN 56 8.338 7.111 11.317 456 HE22 GLN 56 HE22 GLN 56 7.758 8.698 10.960 457 H THR 57 HN THR 57 4.975 2.764 13.174 458 HA THR 57 HA THR 57 3.621 1.648 10.839 459 HB THR 57 HB THR 57 3.601 0.137 12.676 460 HG1 THR 57 HG1 THR 57 1.032 1.340 12.841 461 HG21 THR 57 HG21 THR 57 4.109 1.569 14.525 462 HG22 THR 57 HG22 THR 57 2.590 0.747 14.882 463 HG23 THR 57 HG23 THR 57 2.580 2.429 14.350 464 H VAL 58 HN VAL 58 2.186 2.815 9.756 465 HA VAL 58 HA VAL 58 0.968 5.096 11.181 466 HB VAL 58 HB VAL 58 0.559 6.099 8.944 467 HG11 VAL 58 HG11 VAL 58 2.430 6.834 10.273 468 HG12 VAL 58 HG12 VAL 58 2.907 6.768 8.575 469 HG13 VAL 58 HG13 VAL 58 3.418 5.496 9.686 470 HG21 VAL 58 HG21 VAL 58 2.290 3.818 8.005 471 HG22 VAL 58 HG22 VAL 58 1.889 5.240 7.043 472 HG23 VAL 58 HG23 VAL 58 0.616 4.129 7.551 473 H THR 59 HN THR 59 -1.178 5.671 10.803 474 HA THR 59 HA THR 59 -2.899 3.419 10.019 475 HB THR 59 HB THR 59 -3.725 5.783 11.704 476 HG1 THR 59 HG1 THR 59 -2.043 4.770 12.832 477 HG21 THR 59 HG21 THR 59 -5.518 4.423 10.737 478 HG22 THR 59 HG22 THR 59 -5.458 4.250 12.490 479 HG23 THR 59 HG23 THR 59 -4.810 2.978 11.457 480 H ASN 60 HN ASN 60 -3.865 3.654 8.116 481 HA ASN 60 HA ASN 60 -4.372 6.384 7.086 482 HB2 ASN 60 HB2 ASN 60 -3.838 3.764 5.659 483 HB3 ASN 60 HB1 ASN 60 -4.496 5.180 4.838 484 HD21 ASN 60 HD21 ASN 60 -1.703 3.795 6.386 485 HD22 ASN 60 HD22 ASN 60 -0.569 4.976 5.838 486 H SER 61 HN SER 61 -6.493 6.928 7.191 487 HA SER 61 HA SER 61 -8.466 4.744 7.022 488 HB2 SER 61 HB2 SER 61 -9.069 7.273 8.505 489 HB3 SER 61 HB1 SER 61 -9.744 5.656 8.720 490 HG SER 61 HG SER 61 -7.247 6.680 9.577 491 H PHE 62 HN PHE 62 -10.351 5.089 5.847 492 HA PHE 62 HA PHE 62 -10.855 7.659 4.633 493 HB2 PHE 62 HB2 PHE 62 -10.778 6.711 2.295 494 HB3 PHE 62 HB1 PHE 62 -9.214 6.945 3.060 495 HD1 PHE 62 HD2 PHE 62 -11.652 4.479 1.883 496 HD2 PHE 62 HD1 PHE 62 -7.824 5.072 3.649 497 HE1 PHE 62 HE2 PHE 62 -11.075 2.139 1.413 498 HE2 PHE 62 HE1 PHE 62 -7.243 2.731 3.185 499 HZ PHE 62 HZ PHE 62 -8.866 1.257 2.063 500 H THR 63 HN THR 63 -12.718 7.402 2.975 501 HA THR 63 HA THR 63 -14.606 5.371 3.949 502 HB THR 63 HB THR 63 -15.404 8.152 3.073 503 HG1 THR 63 HG1 THR 63 -15.314 7.277 5.785 504 HG21 THR 63 HG21 THR 63 -17.106 6.334 2.977 505 HG22 THR 63 HG22 THR 63 -17.521 7.626 4.100 506 HG23 THR 63 HG23 THR 63 -16.892 6.093 4.710 507 H LEU 64 HN LEU 64 -15.691 4.249 2.421 508 HA LEU 64 HA LEU 64 -14.740 4.155 -0.207 509 HB2 LEU 64 HB2 LEU 64 -17.320 3.124 0.973 510 HB3 LEU 64 HB1 LEU 64 -16.769 2.748 -0.650 511 HG LEU 64 HG LEU 64 -15.445 1.967 1.943 512 HD11 LEU 64 HD11 LEU 64 -15.887 -0.319 1.143 513 HD12 LEU 64 HD12 LEU 64 -16.723 0.346 -0.262 514 HD13 LEU 64 HD13 LEU 64 -17.374 0.607 1.356 515 HD21 LEU 64 HD21 LEU 64 -14.488 1.702 -0.899 516 HD22 LEU 64 HD22 LEU 64 -13.864 0.728 0.430 517 HD23 LEU 64 HD23 LEU 64 -13.674 2.480 0.459 518 H GLY 65 HN GLY 65 -14.924 5.696 -1.682 519 HA2 GLY 65 HA2 GLY 65 -16.229 6.726 -3.378 520 HA3 GLY 65 HA1 GLY 65 -17.614 6.677 -2.302 521 H LYS 66 HN LYS 66 -14.859 7.780 -0.684 522 HA LYS 66 HA LYS 66 -15.400 10.576 -1.375 523 HB2 LYS 66 HB2 LYS 66 -16.118 9.287 1.131 524 HB3 LYS 66 HB1 LYS 66 -15.053 10.664 1.374 525 HG2 LYS 66 HG2 LYS 66 -16.604 12.054 0.041 526 HG3 LYS 66 HG1 LYS 66 -17.699 10.676 -0.068 527 HD2 LYS 66 HD2 LYS 66 -16.756 11.817 2.550 528 HD3 LYS 66 HD1 LYS 66 -18.208 12.385 1.728 529 HE2 LYS 66 HE2 LYS 66 -19.138 10.116 1.812 530 HE3 LYS 66 HE1 LYS 66 -17.689 9.556 2.645 531 HZ1 LYS 66 HZ1 LYS 66 -19.694 11.498 3.648 532 HZ2 LYS 66 HZ2 LYS 66 -18.222 11.184 4.422 533 HZ3 LYS 66 HZ3 LYS 66 -19.370 9.956 4.256 534 H GLU 67 HN GLU 67 -13.775 12.036 -0.820 535 HA GLU 67 HA GLU 67 -11.125 10.929 -0.938 536 HB2 GLU 67 HB2 GLU 67 -11.623 12.935 -2.201 537 HB3 GLU 67 HB1 GLU 67 -12.143 13.768 -0.743 538 HG2 GLU 67 HG2 GLU 67 -9.689 13.237 0.038 539 HG3 GLU 67 HG1 GLU 67 -9.404 13.155 -1.703 540 H ALA 68 HN ALA 68 -9.706 10.680 0.694 541 HA ALA 68 HA ALA 68 -10.448 11.807 3.306 542 HB1 ALA 68 HB1 ALA 68 -9.293 9.079 2.767 543 HB2 ALA 68 HB2 ALA 68 -10.926 9.434 3.323 544 HB3 ALA 68 HB3 ALA 68 -9.545 9.781 4.365 545 H ASP 69 HN ASP 69 -8.730 12.276 4.719 546 HA ASP 69 HA ASP 69 -6.269 12.970 3.310 547 HB2 ASP 69 HB2 ASP 69 -7.650 13.977 5.750 548 HB3 ASP 69 HB1 ASP 69 -5.897 14.108 5.684 549 H ILE 70 HN ILE 70 -5.048 11.161 3.276 550 HA ILE 70 HA ILE 70 -4.600 9.785 5.824 551 HB ILE 70 HB ILE 70 -3.528 7.987 4.407 552 HG12 ILE 70 HG12 ILE 70 -4.754 8.116 2.019 553 HG13 ILE 70 HG11 ILE 70 -4.450 9.830 2.281 554 HG21 ILE 70 HG21 ILE 70 -6.451 8.544 3.970 555 HG22 ILE 70 HG22 ILE 70 -5.742 7.756 5.378 556 HG23 ILE 70 HG23 ILE 70 -5.660 6.975 3.799 557 HD11 ILE 70 HD11 ILE 70 -2.650 8.815 1.018 558 HD12 ILE 70 HD12 ILE 70 -2.387 7.635 2.299 559 HD13 ILE 70 HD13 ILE 70 -2.064 9.343 2.596 560 H THR 71 HN THR 71 -2.282 8.864 6.019 561 HA THR 71 HA THR 71 -0.334 10.772 4.943 562 HB THR 71 HB THR 71 -0.358 10.116 7.888 563 HG1 THR 71 HG1 THR 71 -2.029 11.708 6.598 564 HG21 THR 71 HG21 THR 71 1.012 12.370 6.416 565 HG22 THR 71 HG22 THR 71 1.791 10.830 6.764 566 HG23 THR 71 HG23 THR 71 1.262 11.867 8.088 567 H THR 72 HN THR 72 1.480 9.820 4.318 568 HA THR 72 HA THR 72 1.783 6.991 4.823 569 HB THR 72 HB THR 72 2.137 7.938 2.550 570 HG1 THR 72 HG1 THR 72 4.570 6.929 2.673 571 HG21 THR 72 HG21 THR 72 4.626 9.119 3.773 572 HG22 THR 72 HG22 THR 72 3.227 10.026 3.202 573 HG23 THR 72 HG23 THR 72 4.216 9.116 2.059 574 H MET 73 HN MET 73 3.975 6.147 5.421 575 HA MET 73 HA MET 73 4.782 7.277 7.910 576 HB2 MET 73 HB2 MET 73 6.425 5.422 7.950 577 HB3 MET 73 HB1 MET 73 4.785 4.885 7.621 578 HG2 MET 73 HG2 MET 73 5.454 5.006 5.148 579 HG3 MET 73 HG1 MET 73 7.109 5.056 5.750 580 HE1 MET 73 HE1 MET 73 3.818 3.256 6.783 581 HE2 MET 73 HE2 MET 73 4.156 1.564 6.407 582 HE3 MET 73 HE3 MET 73 3.956 2.738 5.104 583 H ASP 74 HN ASP 74 5.724 7.928 4.753 584 HA ASP 74 HA ASP 74 8.462 8.621 5.341 585 HB2 ASP 74 HB2 ASP 74 7.114 9.535 2.840 586 HB3 ASP 74 HB1 ASP 74 8.732 8.882 3.066 587 H GLY 75 HN GLY 75 5.607 10.024 6.086 588 HA2 GLY 75 HA2 GLY 75 5.301 12.071 7.153 589 HA3 GLY 75 HA1 GLY 75 6.874 12.586 6.572 590 H LYS 76 HN LYS 76 4.691 11.272 4.265 591 HA LYS 76 HA LYS 76 4.314 13.971 3.183 592 HB2 LYS 76 HB2 LYS 76 4.455 11.264 1.908 593 HB3 LYS 76 HB1 LYS 76 3.633 12.580 1.082 594 HG2 LYS 76 HG2 LYS 76 6.403 12.974 2.124 595 HG3 LYS 76 HG1 LYS 76 6.141 12.105 0.607 596 HD2 LYS 76 HD2 LYS 76 4.819 14.066 -0.201 597 HD3 LYS 76 HD1 LYS 76 5.278 14.926 1.271 598 HE2 LYS 76 HE2 LYS 76 6.733 15.547 -0.583 599 HE3 LYS 76 HE1 LYS 76 7.638 14.695 0.668 600 HZ1 LYS 76 HZ1 LYS 76 7.807 12.803 -0.639 601 HZ2 LYS 76 HZ2 LYS 76 8.032 14.052 -1.754 602 HZ3 LYS 76 HZ3 LYS 76 6.544 13.253 -1.669 603 H LYS 77 HN LYS 77 2.385 14.858 3.076 604 HA LYS 77 HA LYS 77 0.080 13.313 3.995 605 HB2 LYS 77 HB2 LYS 77 0.712 16.238 3.788 606 HB3 LYS 77 HB1 LYS 77 -0.968 15.721 3.849 607 HG2 LYS 77 HG2 LYS 77 -0.830 15.644 6.050 608 HG3 LYS 77 HG1 LYS 77 0.362 14.353 5.911 609 HD2 LYS 77 HD2 LYS 77 1.083 17.274 5.770 610 HD3 LYS 77 HD1 LYS 77 1.059 16.362 7.277 611 HE2 LYS 77 HE2 LYS 77 2.695 14.787 6.332 612 HE3 LYS 77 HE1 LYS 77 2.741 15.745 4.856 613 HZ1 LYS 77 HZ1 LYS 77 3.656 16.549 7.556 614 HZ2 LYS 77 HZ2 LYS 77 3.482 17.644 6.279 615 HZ3 LYS 77 HZ3 LYS 77 4.588 16.370 6.155 616 H LEU 78 HN LEU 78 -0.954 12.272 2.426 617 HA LEU 78 HA LEU 78 -1.398 13.698 -0.114 618 HB2 LEU 78 HB2 LEU 78 -1.248 10.709 0.024 619 HB3 LEU 78 HB1 LEU 78 -1.056 11.758 -1.365 620 HG LEU 78 HG LEU 78 0.961 11.742 0.865 621 HD11 LEU 78 HD11 LEU 78 2.261 10.121 -0.329 622 HD12 LEU 78 HD12 LEU 78 1.053 10.023 -1.609 623 HD13 LEU 78 HD13 LEU 78 0.674 9.431 0.009 624 HD21 LEU 78 HD21 LEU 78 1.134 13.606 -0.631 625 HD22 LEU 78 HD22 LEU 78 1.022 12.547 -2.039 626 HD23 LEU 78 HD23 LEU 78 2.441 12.477 -0.994 627 H LYS 79 HN LYS 79 -3.392 13.451 -1.072 628 HA LYS 79 HA LYS 79 -5.482 12.384 0.686 629 HB2 LYS 79 HB2 LYS 79 -6.071 14.003 -1.752 630 HB3 LYS 79 HB1 LYS 79 -6.949 13.909 -0.231 631 HG2 LYS 79 HG2 LYS 79 -4.297 14.997 0.149 632 HG3 LYS 79 HG1 LYS 79 -5.219 15.924 -1.038 633 HD2 LYS 79 HD2 LYS 79 -6.334 15.147 1.642 634 HD3 LYS 79 HD1 LYS 79 -5.438 16.645 1.386 635 HE2 LYS 79 HE2 LYS 79 -7.042 17.430 -0.177 636 HE3 LYS 79 HE1 LYS 79 -7.842 15.860 -0.235 637 HZ1 LYS 79 HZ1 LYS 79 -8.139 16.338 2.320 638 HZ2 LYS 79 HZ2 LYS 79 -9.222 16.973 1.177 639 HZ3 LYS 79 HZ3 LYS 79 -7.993 17.952 1.812 640 H CYS 80 HN CYS 80 -6.239 10.425 0.180 641 HA CYS 80 HA CYS 80 -6.131 9.613 -2.649 642 HB2 CYS 80 HB2 CYS 80 -4.783 8.359 -0.741 643 HB3 CYS 80 HB1 CYS 80 -6.337 7.579 -0.466 644 H THR 81 HN THR 81 -8.022 9.530 -3.607 645 HA THR 81 HA THR 81 -10.470 9.383 -2.028 646 HB THR 81 HB THR 81 -10.286 9.643 -5.033 647 HG1 THR 81 HG1 THR 81 -9.038 11.289 -3.852 648 HG21 THR 81 HG21 THR 81 -12.453 10.666 -4.858 649 HG22 THR 81 HG22 THR 81 -12.364 10.676 -3.095 650 HG23 THR 81 HG23 THR 81 -12.496 9.146 -3.963 651 H VAL 82 HN VAL 82 -10.537 7.259 -1.365 652 HA VAL 82 HA VAL 82 -10.250 5.145 -3.338 653 HB VAL 82 HB VAL 82 -10.995 4.600 -0.501 654 HG11 VAL 82 HG11 VAL 82 -9.431 3.232 -2.658 655 HG12 VAL 82 HG12 VAL 82 -10.857 2.670 -1.788 656 HG13 VAL 82 HG13 VAL 82 -9.294 2.741 -0.970 657 HG21 VAL 82 HG21 VAL 82 -8.274 5.498 -1.432 658 HG22 VAL 82 HG22 VAL 82 -8.555 4.621 0.071 659 HG23 VAL 82 HG23 VAL 82 -9.275 6.215 -0.170 660 H HIS 83 HN HIS 83 -11.807 3.618 -3.806 661 HA HIS 83 HA HIS 83 -14.430 3.763 -2.665 662 HB2 HIS 83 HB2 HIS 83 -15.613 4.242 -4.781 663 HB3 HIS 83 HB1 HIS 83 -14.624 5.595 -4.260 664 HD1 HIS 83 HD1 HIS 83 -15.095 3.214 -7.039 665 HD2 HIS 83 HD2 HIS 83 -12.309 6.070 -5.880 666 HE1 HIS 83 HE1 HIS 83 -13.676 3.637 -9.072 667 HE2 HIS 83 HE2 HIS 83 -12.118 5.497 -8.395 668 H LEU 84 HN LEU 84 -15.690 1.974 -3.128 669 HA LEU 84 HA LEU 84 -14.162 -0.284 -4.175 670 HB2 LEU 84 HB2 LEU 84 -15.250 -0.437 -1.939 671 HB3 LEU 84 HB1 LEU 84 -16.812 -0.277 -2.723 672 HG LEU 84 HG LEU 84 -16.048 -2.377 -4.077 673 HD11 LEU 84 HD11 LEU 84 -13.757 -2.396 -3.277 674 HD12 LEU 84 HD12 LEU 84 -14.604 -3.864 -2.793 675 HD13 LEU 84 HD13 LEU 84 -14.327 -2.583 -1.614 676 HD21 LEU 84 HD21 LEU 84 -17.948 -2.430 -2.653 677 HD22 LEU 84 HD22 LEU 84 -16.944 -2.411 -1.204 678 HD23 LEU 84 HD23 LEU 84 -16.956 -3.828 -2.256 679 H ALA 85 HN ALA 85 -14.396 -0.775 -6.225 680 HA ALA 85 HA ALA 85 -17.045 -0.463 -7.467 681 HB1 ALA 85 HB1 ALA 85 -15.925 0.189 -9.545 682 HB2 ALA 85 HB2 ALA 85 -14.366 0.103 -8.725 683 HB3 ALA 85 HB3 ALA 85 -15.556 1.308 -8.234 684 H ASN 86 HN ASN 86 -17.826 -2.361 -7.984 685 HA ASN 86 HA ASN 86 -18.051 -4.487 -8.741 686 HB2 ASN 86 HB2 ASN 86 -15.475 -3.774 -10.133 687 HB3 ASN 86 HB1 ASN 86 -16.239 -5.346 -10.333 688 HD21 ASN 86 HD21 ASN 86 -16.337 -1.989 -11.128 689 HD22 ASN 86 HD22 ASN 86 -17.636 -2.084 -12.265 690 H GLY 87 HN GLY 87 -16.761 -3.933 -6.199 691 HA2 GLY 87 HA2 GLY 87 -16.072 -5.372 -4.497 692 HA3 GLY 87 HA1 GLY 87 -15.743 -6.605 -5.707 693 H LYS 88 HN LYS 88 -14.341 -3.807 -6.742 694 HA LYS 88 HA LYS 88 -11.732 -4.594 -5.643 695 HB2 LYS 88 HB2 LYS 88 -12.510 -3.224 -8.212 696 HB3 LYS 88 HB1 LYS 88 -10.853 -3.276 -7.625 697 HG2 LYS 88 HG2 LYS 88 -10.865 -5.686 -7.718 698 HG3 LYS 88 HG1 LYS 88 -12.555 -5.675 -8.234 699 HD2 LYS 88 HD2 LYS 88 -11.027 -5.979 -10.128 700 HD3 LYS 88 HD1 LYS 88 -11.947 -4.481 -10.260 701 HE2 LYS 88 HE2 LYS 88 -10.100 -3.155 -9.715 702 HE3 LYS 88 HE1 LYS 88 -9.214 -4.516 -9.032 703 HZ1 LYS 88 HZ1 LYS 88 -9.762 -3.998 -11.900 704 HZ2 LYS 88 HZ2 LYS 88 -9.111 -5.452 -11.318 705 HZ3 LYS 88 HZ3 LYS 88 -8.254 -3.995 -11.125 706 H LEU 89 HN LEU 89 -10.345 -2.989 -4.833 707 HA LEU 89 HA LEU 89 -11.719 -0.516 -4.114 708 HB2 LEU 89 HB2 LEU 89 -10.469 -2.145 -2.474 709 HB3 LEU 89 HB1 LEU 89 -9.048 -1.279 -3.029 710 HG LEU 89 HG LEU 89 -9.845 0.783 -2.173 711 HD11 LEU 89 HD11 LEU 89 -12.132 0.792 -2.743 712 HD12 LEU 89 HD12 LEU 89 -12.082 0.842 -0.980 713 HD13 LEU 89 HD13 LEU 89 -12.450 -0.672 -1.810 714 HD21 LEU 89 HD21 LEU 89 -8.921 -0.861 -0.539 715 HD22 LEU 89 HD22 LEU 89 -10.583 -1.280 -0.115 716 HD23 LEU 89 HD23 LEU 89 -9.989 0.359 0.158 717 H VAL 90 HN VAL 90 -11.311 1.246 -5.253 718 HA VAL 90 HA VAL 90 -8.781 1.350 -6.763 719 HB VAL 90 HB VAL 90 -11.441 2.564 -7.518 720 HG11 VAL 90 HG11 VAL 90 -8.862 2.471 -9.081 721 HG12 VAL 90 HG12 VAL 90 -9.504 3.892 -8.257 722 HG13 VAL 90 HG13 VAL 90 -10.385 3.188 -9.612 723 HG21 VAL 90 HG21 VAL 90 -11.581 0.916 -9.247 724 HG22 VAL 90 HG22 VAL 90 -11.297 0.073 -7.721 725 HG23 VAL 90 HG23 VAL 90 -9.972 0.302 -8.864 726 H CYS 91 HN CYS 91 -7.462 3.004 -6.385 727 HA CYS 91 HA CYS 91 -8.573 5.495 -5.319 728 HB2 CYS 91 HB2 CYS 91 -7.301 3.912 -3.585 729 HB3 CYS 91 HB1 CYS 91 -5.889 4.689 -4.305 730 H LYS 92 HN LYS 92 -8.388 6.283 -7.419 731 HA LYS 92 HA LYS 92 -5.683 6.471 -8.496 732 HB2 LYS 92 HB2 LYS 92 -7.379 5.589 -10.026 733 HB3 LYS 92 HB1 LYS 92 -8.358 7.027 -9.793 734 HG2 LYS 92 HG2 LYS 92 -6.572 8.380 -10.796 735 HG3 LYS 92 HG1 LYS 92 -5.647 6.912 -11.085 736 HD2 LYS 92 HD2 LYS 92 -8.373 7.520 -12.212 737 HD3 LYS 92 HD1 LYS 92 -6.850 7.670 -13.086 738 HE2 LYS 92 HE2 LYS 92 -6.472 5.238 -12.710 739 HE3 LYS 92 HE1 LYS 92 -8.081 5.141 -11.992 740 HZ1 LYS 92 HZ1 LYS 92 -8.195 4.473 -14.267 741 HZ2 LYS 92 HZ2 LYS 92 -7.422 5.879 -14.797 742 HZ3 LYS 92 HZ3 LYS 92 -8.974 5.967 -14.126 743 H SER 93 HN SER 93 -4.741 8.399 -8.963 744 HA SER 93 HA SER 93 -6.049 10.787 -7.852 745 HB2 SER 93 HB2 SER 93 -3.253 11.202 -8.137 746 HB3 SER 93 HB1 SER 93 -4.176 11.060 -6.641 747 HG SER 93 HG SER 93 -3.358 9.154 -6.363 748 H GLU 94 HN GLU 94 -4.557 12.760 -8.928 749 HA GLU 94 HA GLU 94 -5.328 12.634 -11.721 750 HB2 GLU 94 HB2 GLU 94 -4.023 14.909 -10.213 751 HB3 GLU 94 HB1 GLU 94 -4.841 15.002 -11.767 752 HG2 GLU 94 HG2 GLU 94 -6.238 14.140 -9.261 753 HG3 GLU 94 HG1 GLU 94 -6.111 15.828 -9.739 754 H LYS 95 HN LYS 95 -2.493 12.279 -9.823 755 HA LYS 95 HA LYS 95 -0.817 12.416 -12.243 756 HB2 LYS 95 HB2 LYS 95 -0.364 13.976 -10.233 757 HB3 LYS 95 HB1 LYS 95 0.220 12.536 -9.417 758 HG2 LYS 95 HG2 LYS 95 1.932 12.233 -11.086 759 HG3 LYS 95 HG1 LYS 95 1.312 13.599 -12.012 760 HD2 LYS 95 HD2 LYS 95 1.872 15.126 -10.224 761 HD3 LYS 95 HD1 LYS 95 2.359 13.787 -9.183 762 HE2 LYS 95 HE2 LYS 95 4.149 13.234 -10.779 763 HE3 LYS 95 HE1 LYS 95 3.676 14.610 -11.772 764 HZ1 LYS 95 HZ1 LYS 95 5.552 15.139 -10.363 765 HZ2 LYS 95 HZ2 LYS 95 4.666 14.751 -8.976 766 HZ3 LYS 95 HZ3 LYS 95 4.211 16.072 -9.929 767 H PHE 96 HN PHE 96 -1.943 10.394 -9.673 768 HA PHE 96 HA PHE 96 -0.282 8.202 -10.706 769 HB2 PHE 96 HB2 PHE 96 -0.939 8.364 -7.783 770 HB3 PHE 96 HB1 PHE 96 0.335 7.450 -8.581 771 HD1 PHE 96 HD2 PHE 96 2.404 8.555 -9.272 772 HD2 PHE 96 HD1 PHE 96 -0.634 10.650 -7.152 773 HE1 PHE 96 HE2 PHE 96 4.010 10.339 -8.741 774 HE2 PHE 96 HE1 PHE 96 0.964 12.440 -6.621 775 HZ PHE 96 HZ PHE 96 3.289 12.286 -7.409 776 H SER 97 HN SER 97 -1.186 6.084 -9.447 777 HA SER 97 HA SER 97 -4.001 6.060 -9.004 778 HB2 SER 97 HB2 SER 97 -3.965 6.181 -11.475 779 HB3 SER 97 HB1 SER 97 -3.005 4.704 -11.515 780 HG SER 97 HG SER 97 -4.895 3.775 -11.561 781 H HIS 98 HN HIS 98 -4.312 4.568 -7.509 782 HA HIS 98 HA HIS 98 -2.373 2.373 -7.294 783 HB2 HIS 98 HB2 HIS 98 -2.819 3.832 -5.282 784 HB3 HIS 98 HB1 HIS 98 -4.467 3.216 -5.278 785 HD2 HIS 98 HD2 HIS 98 -3.788 0.017 -5.642 786 HE1 HIS 98 HE1 HIS 98 -1.414 0.598 -2.194 787 HE2 HIS 98 HE2 HIS 98 -2.576 -1.117 -3.644 788 H GLU 99 HN GLU 99 -2.923 0.463 -8.029 789 HA GLU 99 HA GLU 99 -5.785 -0.091 -8.444 790 HB2 GLU 99 HB2 GLU 99 -4.797 -0.336 -10.521 791 HB3 GLU 99 HB1 GLU 99 -3.286 -0.929 -9.850 792 HG2 GLU 99 HG2 GLU 99 -4.232 -2.760 -10.936 793 HG3 GLU 99 HG1 GLU 99 -4.546 -3.024 -9.220 794 H GLN 100 HN GLN 100 -6.778 -1.727 -7.394 795 HA GLN 100 HA GLN 100 -5.169 -3.789 -6.085 796 HB2 GLN 100 HB2 GLN 100 -6.981 -1.845 -4.715 797 HB3 GLN 100 HB1 GLN 100 -6.895 -3.494 -4.113 798 HG2 GLN 100 HG2 GLN 100 -4.407 -3.212 -3.983 799 HG3 GLN 100 HG1 GLN 100 -4.664 -1.505 -4.330 800 HE21 GLN 100 HE21 GLN 100 -3.512 -2.772 -1.974 801 HE22 GLN 100 HE22 GLN 100 -4.484 -2.259 -0.635 802 H GLU 101 HN GLU 101 -6.042 -5.773 -6.267 803 HA GLU 101 HA GLU 101 -8.912 -6.040 -6.724 804 HB2 GLU 101 HB2 GLU 101 -7.775 -5.883 -8.960 805 HB3 GLU 101 HB1 GLU 101 -6.879 -7.334 -8.543 806 HG2 GLU 101 HG2 GLU 101 -8.962 -8.583 -8.355 807 HG3 GLU 101 HG1 GLU 101 -9.867 -7.132 -8.776 808 H VAL 102 HN VAL 102 -9.740 -7.759 -5.684 809 HA VAL 102 HA VAL 102 -7.837 -9.634 -4.464 810 HB VAL 102 HB VAL 102 -10.691 -8.993 -3.713 811 HG11 VAL 102 HG11 VAL 102 -10.257 -11.352 -3.326 812 HG12 VAL 102 HG12 VAL 102 -10.345 -10.485 -1.793 813 HG13 VAL 102 HG13 VAL 102 -8.779 -10.956 -2.453 814 HG21 VAL 102 HG21 VAL 102 -8.064 -8.473 -2.330 815 HG22 VAL 102 HG22 VAL 102 -9.656 -8.161 -1.638 816 HG23 VAL 102 HG23 VAL 102 -9.122 -7.265 -3.063 817 H LYS 103 HN LYS 103 -7.624 -11.518 -5.444 818 HA LYS 103 HA LYS 103 -9.928 -12.595 -6.918 819 HB2 LYS 103 HB2 LYS 103 -7.578 -12.010 -8.006 820 HB3 LYS 103 HB1 LYS 103 -7.150 -13.592 -7.363 821 HG2 LYS 103 HG2 LYS 103 -8.645 -14.698 -8.744 822 HG3 LYS 103 HG1 LYS 103 -9.598 -13.245 -9.047 823 HD2 LYS 103 HD2 LYS 103 -7.837 -12.317 -10.405 824 HD3 LYS 103 HD1 LYS 103 -6.765 -13.657 -9.997 825 HE2 LYS 103 HE2 LYS 103 -8.148 -15.207 -11.189 826 HE3 LYS 103 HE1 LYS 103 -9.392 -13.982 -11.436 827 HZ1 LYS 103 HZ1 LYS 103 -6.661 -13.976 -12.596 828 HZ2 LYS 103 HZ2 LYS 103 -7.784 -12.723 -12.777 829 HZ3 LYS 103 HZ3 LYS 103 -8.108 -14.248 -13.430 830 H GLY 104 HN GLY 104 -10.781 -13.499 -4.990 831 HA2 GLY 104 HA2 GLY 104 -11.221 -15.410 -3.758 832 HA3 GLY 104 HA1 GLY 104 -9.771 -16.138 -4.440 833 H ASN 105 HN ASN 105 -7.827 -15.927 -3.390 834 HA ASN 105 HA ASN 105 -7.930 -14.664 -0.729 835 HB2 ASN 105 HB2 ASN 105 -6.544 -16.446 0.157 836 HB3 ASN 105 HB1 ASN 105 -7.959 -17.159 -0.608 837 HD21 ASN 105 HD21 ASN 105 -5.308 -18.291 -0.027 838 HD22 ASN 105 HD22 ASN 105 -4.703 -18.864 -1.543 839 H GLU 106 HN GLU 106 -6.771 -14.189 -3.653 840 HA GLU 106 HA GLU 106 -4.133 -13.291 -2.700 841 HB2 GLU 106 HB2 GLU 106 -4.914 -14.208 -5.470 842 HB3 GLU 106 HB1 GLU 106 -3.347 -13.543 -5.040 843 HG2 GLU 106 HG2 GLU 106 -2.936 -15.410 -3.543 844 HG3 GLU 106 HG1 GLU 106 -4.530 -16.071 -3.910 845 H MET 107 HN MET 107 -3.938 -11.172 -2.620 846 HA MET 107 HA MET 107 -5.749 -9.526 -4.237 847 HB2 MET 107 HB2 MET 107 -5.865 -9.091 -1.849 848 HB3 MET 107 HB1 MET 107 -4.124 -8.843 -1.781 849 HG2 MET 107 HG2 MET 107 -4.255 -6.798 -2.917 850 HG3 MET 107 HG1 MET 107 -5.886 -7.126 -3.498 851 HE1 MET 107 HE1 MET 107 -3.736 -7.005 -0.481 852 HE2 MET 107 HE2 MET 107 -4.766 -6.465 0.847 853 HE3 MET 107 HE3 MET 107 -4.021 -5.283 -0.235 854 H VAL 108 HN VAL 108 -4.892 -9.004 -6.111 855 HA VAL 108 HA VAL 108 -2.016 -8.519 -6.319 856 HB VAL 108 HB VAL 108 -2.730 -9.966 -8.029 857 HG11 VAL 108 HG11 VAL 108 -4.993 -8.074 -8.653 858 HG12 VAL 108 HG12 VAL 108 -5.139 -9.610 -7.804 859 HG13 VAL 108 HG13 VAL 108 -4.637 -9.582 -9.494 860 HG21 VAL 108 HG21 VAL 108 -2.544 -7.169 -9.129 861 HG22 VAL 108 HG22 VAL 108 -2.514 -8.621 -10.131 862 HG23 VAL 108 HG23 VAL 108 -1.248 -8.349 -8.938 863 H GLU 109 HN GLU 109 -1.293 -6.493 -6.121 864 HA GLU 109 HA GLU 109 -3.073 -4.339 -7.026 865 HB2 GLU 109 HB2 GLU 109 -2.700 -3.059 -5.152 866 HB3 GLU 109 HB1 GLU 109 -2.720 -4.677 -4.467 867 HG2 GLU 109 HG2 GLU 109 -0.155 -4.583 -4.758 868 HG3 GLU 109 HG1 GLU 109 -0.405 -2.842 -4.912 869 H THR 110 HN THR 110 -2.045 -2.409 -7.727 870 HA THR 110 HA THR 110 0.794 -2.578 -8.362 871 HB THR 110 HB THR 110 -1.320 -2.159 -10.483 872 HG1 THR 110 HG1 THR 110 -0.167 -4.360 -9.560 873 HG21 THR 110 HG21 THR 110 0.419 -0.712 -11.075 874 HG22 THR 110 HG22 THR 110 0.763 -2.186 -11.978 875 HG23 THR 110 HG23 THR 110 1.659 -1.826 -10.504 876 H ILE 111 HN ILE 111 1.675 -0.717 -7.803 877 HA ILE 111 HA ILE 111 -0.001 1.710 -7.906 878 HB ILE 111 HB ILE 111 2.333 1.599 -6.048 879 HG12 ILE 111 HG12 ILE 111 -0.323 0.375 -5.283 880 HG13 ILE 111 HG11 ILE 111 1.077 -0.582 -5.760 881 HG21 ILE 111 HG21 ILE 111 0.967 3.624 -6.339 882 HG22 ILE 111 HG22 ILE 111 0.910 3.014 -4.687 883 HG23 ILE 111 HG23 ILE 111 -0.448 2.738 -5.777 884 HD11 ILE 111 HD11 ILE 111 2.331 0.537 -3.897 885 HD12 ILE 111 HD12 ILE 111 1.032 -0.550 -3.409 886 HD13 ILE 111 HD13 ILE 111 0.785 1.197 -3.366 887 H THR 112 HN THR 112 1.347 3.739 -8.091 888 HA THR 112 HA THR 112 3.983 3.422 -9.258 889 HB THR 112 HB THR 112 1.830 4.872 -10.801 890 HG1 THR 112 HG1 THR 112 2.503 2.217 -10.746 891 HG21 THR 112 HG21 THR 112 4.590 4.022 -11.673 892 HG22 THR 112 HG22 THR 112 4.214 5.624 -11.044 893 HG23 THR 112 HG23 THR 112 3.461 5.068 -12.540 894 H PHE 113 HN PHE 113 5.126 4.789 -8.067 895 HA PHE 113 HA PHE 113 4.213 7.557 -7.841 896 HB2 PHE 113 HB2 PHE 113 4.531 5.671 -5.581 897 HB3 PHE 113 HB1 PHE 113 5.233 7.266 -5.358 898 HD1 PHE 113 HD1 PHE 113 2.105 5.423 -5.972 899 HD2 PHE 113 HD2 PHE 113 3.867 9.161 -4.976 900 HE1 PHE 113 HE1 PHE 113 -0.107 6.289 -5.341 901 HE2 PHE 113 HE2 PHE 113 1.657 10.039 -4.345 902 HZ PHE 113 HZ PHE 113 -0.333 8.598 -4.519 903 H GLY 114 HN GLY 114 5.910 9.039 -7.696 904 HA2 GLY 114 HA2 GLY 114 8.061 9.812 -7.954 905 HA3 GLY 114 HA1 GLY 114 8.592 8.337 -7.162 906 H GLY 115 HN GLY 115 6.681 7.855 -9.944 907 HA2 GLY 115 HA2 GLY 115 7.255 7.500 -12.170 908 HA3 GLY 115 HA1 GLY 115 8.928 7.851 -11.771 909 H VAL 116 HN VAL 116 7.547 5.594 -9.625 910 HA VAL 116 HA VAL 116 8.747 3.395 -11.181 911 HB VAL 116 HB VAL 116 8.629 3.554 -8.169 912 HG11 VAL 116 HG11 VAL 116 10.360 1.718 -8.391 913 HG12 VAL 116 HG12 VAL 116 9.897 1.624 -10.089 914 HG13 VAL 116 HG13 VAL 116 8.703 1.299 -8.831 915 HG21 VAL 116 HG21 VAL 116 11.098 3.920 -8.315 916 HG22 VAL 116 HG22 VAL 116 10.118 5.275 -8.874 917 HG23 VAL 116 HG23 VAL 116 10.892 4.206 -10.045 918 H THR 117 HN THR 117 7.459 1.773 -11.660 919 HA THR 117 HA THR 117 4.778 1.682 -10.523 920 HB THR 117 HB THR 117 5.760 -0.171 -12.674 921 HG1 THR 117 HG1 THR 117 6.376 1.670 -13.637 922 HG21 THR 117 HG21 THR 117 3.521 -0.267 -13.331 923 HG22 THR 117 HG22 THR 117 3.125 1.257 -12.534 924 HG23 THR 117 HG23 THR 117 3.422 -0.190 -11.570 925 H LEU 118 HN LEU 118 5.100 0.747 -8.497 926 HA LEU 118 HA LEU 118 6.580 -1.753 -8.357 927 HB2 LEU 118 HB2 LEU 118 7.021 -0.204 -6.576 928 HB3 LEU 118 HB1 LEU 118 5.314 -0.058 -6.208 929 HG LEU 118 HG LEU 118 5.237 -2.306 -5.351 930 HD11 LEU 118 HD11 LEU 118 7.267 -3.706 -5.229 931 HD12 LEU 118 HD12 LEU 118 8.115 -2.525 -6.232 932 HD13 LEU 118 HD13 LEU 118 6.736 -3.412 -6.885 933 HD21 LEU 118 HD21 LEU 118 7.716 -1.009 -4.257 934 HD22 LEU 118 HD22 LEU 118 6.607 -2.094 -3.422 935 HD23 LEU 118 HD23 LEU 118 6.076 -0.476 -3.883 936 H ILE 119 HN ILE 119 5.475 -3.406 -9.161 937 HA ILE 119 HA ILE 119 2.663 -3.774 -8.592 938 HB ILE 119 HB ILE 119 4.688 -5.343 -10.196 939 HG12 ILE 119 HG12 ILE 119 2.907 -4.846 -11.987 940 HG13 ILE 119 HG11 ILE 119 2.290 -3.659 -10.846 941 HG21 ILE 119 HG21 ILE 119 1.828 -6.090 -9.624 942 HG22 ILE 119 HG22 ILE 119 3.274 -6.995 -9.176 943 HG23 ILE 119 HG23 ILE 119 2.826 -6.831 -10.873 944 HD11 ILE 119 HD11 ILE 119 4.944 -3.708 -12.230 945 HD12 ILE 119 HD12 ILE 119 4.602 -2.661 -10.850 946 HD13 ILE 119 HD13 ILE 119 3.664 -2.496 -12.337 947 H ARG 120 HN ARG 120 1.902 -4.966 -6.925 948 HA ARG 120 HA ARG 120 3.750 -6.862 -5.644 949 HB2 ARG 120 HB2 ARG 120 1.929 -5.004 -4.106 950 HB3 ARG 120 HB1 ARG 120 3.066 -6.161 -3.437 951 HG2 ARG 120 HG2 ARG 120 4.914 -4.848 -4.483 952 HG3 ARG 120 HG1 ARG 120 3.711 -3.639 -4.937 953 HD2 ARG 120 HD2 ARG 120 4.579 -4.470 -2.186 954 HD3 ARG 120 HD1 ARG 120 4.659 -2.873 -2.925 955 HE ARG 120 HE ARG 120 2.099 -4.177 -2.208 956 HH11 ARG 120 HH11 ARG 120 4.185 -1.368 -2.312 957 HH12 ARG 120 HH12 ARG 120 3.005 -0.314 -1.614 958 HH21 ARG 120 HH21 ARG 120 0.541 -2.804 -1.318 959 HH22 ARG 120 HH22 ARG 120 0.920 -1.129 -1.045 960 H ARG 121 HN ARG 121 2.739 -8.474 -4.344 961 HA ARG 121 HA ARG 121 -0.107 -8.892 -4.892 962 HB2 ARG 121 HB2 ARG 121 0.446 -11.387 -4.940 963 HB3 ARG 121 HB1 ARG 121 0.836 -10.462 -6.373 964 HG2 ARG 121 HG2 ARG 121 3.152 -10.271 -5.004 965 HG3 ARG 121 HG1 ARG 121 2.586 -11.863 -4.496 966 HD2 ARG 121 HD2 ARG 121 3.986 -11.997 -6.502 967 HD3 ARG 121 HD1 ARG 121 2.337 -12.539 -6.812 968 HE ARG 121 HE ARG 121 2.207 -9.962 -7.528 969 HH11 ARG 121 HH11 ARG 121 4.518 -12.469 -8.305 970 HH12 ARG 121 HH12 ARG 121 4.891 -11.826 -9.872 971 HH21 ARG 121 HH21 ARG 121 2.697 -9.097 -9.589 972 HH22 ARG 121 HH22 ARG 121 3.859 -9.893 -10.605 973 H SER 122 HN SER 122 -1.229 -9.452 -3.165 974 HA SER 122 HA SER 122 0.289 -10.145 -0.743 975 HB2 SER 122 HB2 SER 122 -0.780 -7.777 -0.914 976 HB3 SER 122 HB1 SER 122 -2.288 -8.622 -0.595 977 HG SER 122 HG SER 122 -1.027 -7.780 1.253 978 H LYS 123 HN LYS 123 -0.147 -12.101 -0.141 979 HA LYS 123 HA LYS 123 -2.648 -13.353 -0.939 980 HB2 LYS 123 HB2 LYS 123 -1.593 -15.418 -0.069 981 HB3 LYS 123 HB1 LYS 123 -0.646 -14.633 -1.324 982 HG2 LYS 123 HG2 LYS 123 1.092 -14.701 0.019 983 HG3 LYS 123 HG1 LYS 123 0.266 -13.566 1.088 984 HD2 LYS 123 HD2 LYS 123 -0.844 -15.521 2.188 985 HD3 LYS 123 HD1 LYS 123 0.167 -16.583 1.211 986 HE2 LYS 123 HE2 LYS 123 2.136 -15.848 2.255 987 HE3 LYS 123 HE1 LYS 123 1.328 -14.455 2.972 988 HZ1 LYS 123 HZ1 LYS 123 1.720 -16.207 4.596 989 HZ2 LYS 123 HZ2 LYS 123 0.800 -17.288 3.677 990 HZ3 LYS 123 HZ3 LYS 123 0.057 -15.939 4.384 991 H ARG 124 HN ARG 124 -4.224 -13.948 0.480 992 HA ARG 124 HA ARG 124 -4.390 -12.553 2.941 993 HB2 ARG 124 HB2 ARG 124 -6.174 -13.942 1.337 994 HB3 ARG 124 HB1 ARG 124 -6.056 -14.931 2.790 995 HG2 ARG 124 HG2 ARG 124 -6.803 -13.178 4.173 996 HG3 ARG 124 HG1 ARG 124 -6.632 -11.987 2.884 997 HD2 ARG 124 HD2 ARG 124 -8.981 -12.661 3.316 998 HD3 ARG 124 HD1 ARG 124 -8.450 -12.964 1.666 999 HE ARG 124 HE ARG 124 -8.266 -15.194 3.519 1000 HH11 ARG 124 HH11 ARG 124 -10.088 -13.598 0.992 1001 HH12 ARG 124 HH12 ARG 124 -11.003 -15.013 0.582 1002 HH21 ARG 124 HH21 ARG 124 -9.467 -17.049 2.998 1003 HH22 ARG 124 HH22 ARG 124 -10.649 -16.984 1.728 1004 H VAL 125 HN VAL 125 -4.489 -13.387 5.029 1005 HA VAL 125 HA VAL 125 -3.910 -14.643 6.796 1006 HB VAL 125 HB VAL 125 -3.477 -16.965 4.926 1007 HG11 VAL 125 HG11 VAL 125 -4.046 -18.295 6.939 1008 HG12 VAL 125 HG12 VAL 125 -4.079 -16.799 7.874 1009 HG13 VAL 125 HG13 VAL 125 -2.577 -17.337 7.128 1010 HG21 VAL 125 HG21 VAL 125 -5.720 -15.896 4.654 1011 HG22 VAL 125 HG22 VAL 125 -6.031 -16.242 6.355 1012 HG23 VAL 125 HG23 VAL 125 -5.777 -17.567 5.220 Start of MODEL 11 1 H1 ALA 1 HT1 ALA 1 -15.592 -10.022 1.420 2 H2 ALA 1 HT2 ALA 1 -14.142 -10.158 2.278 3 H3 ALA 1 HT3 ALA 1 -14.152 -10.348 0.601 4 HA ALA 1 HA ALA 1 -14.563 -8.111 0.204 5 HB1 ALA 1 HB1 ALA 1 -16.289 -7.783 1.875 6 HB2 ALA 1 HB2 ALA 1 -15.068 -6.521 2.018 7 HB3 ALA 1 HB3 ALA 1 -15.090 -7.860 3.162 8 H PHE 2 HN PHE 2 -13.218 -6.091 1.163 9 HA PHE 2 HA PHE 2 -10.496 -6.906 1.098 10 HB2 PHE 2 HB2 PHE 2 -11.983 -4.356 1.295 11 HB3 PHE 2 HB1 PHE 2 -10.323 -4.341 1.884 12 HD1 PHE 2 HD2 PHE 2 -12.311 -5.465 -1.076 13 HD2 PHE 2 HD1 PHE 2 -8.637 -3.896 0.395 14 HE1 PHE 2 HE2 PHE 2 -11.482 -5.245 -3.387 15 HE2 PHE 2 HE1 PHE 2 -7.809 -3.661 -1.907 16 HZ PHE 2 HZ PHE 2 -9.223 -4.349 -3.806 17 H SER 3 HN SER 3 -12.749 -6.322 3.640 18 HA SER 3 HA SER 3 -11.024 -5.703 5.763 19 HB2 SER 3 HB2 SER 3 -13.215 -7.314 6.673 20 HB3 SER 3 HB1 SER 3 -13.003 -5.568 6.808 21 HG SER 3 HG SER 3 -14.019 -5.313 4.830 22 H GLY 4 HN GLY 4 -9.257 -6.933 6.188 23 HA2 GLY 4 HA2 GLY 4 -9.397 -9.416 7.397 24 HA3 GLY 4 HA1 GLY 4 -9.142 -9.729 5.687 25 H THR 5 HN THR 5 -7.157 -10.629 5.969 26 HA THR 5 HA THR 5 -5.010 -8.719 6.538 27 HB THR 5 HB THR 5 -3.758 -10.711 7.545 28 HG1 THR 5 HG1 THR 5 -6.175 -11.833 7.083 29 HG21 THR 5 HG21 THR 5 -4.473 -10.183 9.745 30 HG22 THR 5 HG22 THR 5 -6.078 -9.718 9.183 31 HG23 THR 5 HG23 THR 5 -4.685 -8.715 8.791 32 H TRP 6 HN TRP 6 -3.717 -8.585 4.852 33 HA TRP 6 HA TRP 6 -3.383 -10.935 3.103 34 HB2 TRP 6 HB2 TRP 6 -3.095 -8.089 2.197 35 HB3 TRP 6 HB1 TRP 6 -3.331 -9.535 1.223 36 HD1 TRP 6 HD1 TRP 6 -5.264 -7.119 3.489 37 HE1 TRP 6 HE1 TRP 6 -7.771 -7.318 2.952 38 HE3 TRP 6 HE3 TRP 6 -5.084 -11.109 0.296 39 HZ2 TRP 6 HZ2 TRP 6 -9.452 -8.971 1.398 40 HZ3 TRP 6 HZ3 TRP 6 -7.192 -11.940 -0.667 41 HH2 TRP 6 HH2 TRP 6 -9.329 -10.888 -0.126 42 H GLN 7 HN GLN 7 -1.407 -11.721 2.934 43 HA GLN 7 HA GLN 7 0.842 -10.151 3.973 44 HB2 GLN 7 HB2 GLN 7 0.347 -12.558 4.700 45 HB3 GLN 7 HB1 GLN 7 0.898 -13.037 3.100 46 HG2 GLN 7 HG2 GLN 7 3.080 -12.087 3.538 47 HG3 GLN 7 HG1 GLN 7 2.540 -11.512 5.114 48 HE21 GLN 7 HE21 GLN 7 2.171 -13.004 6.765 49 HE22 GLN 7 HE22 GLN 7 2.832 -14.598 6.710 50 H VAL 8 HN VAL 8 1.891 -8.964 2.524 51 HA VAL 8 HA VAL 8 1.727 -9.527 -0.290 52 HB VAL 8 HB VAL 8 3.443 -7.564 -0.378 53 HG11 VAL 8 HG11 VAL 8 1.082 -7.483 -1.091 54 HG12 VAL 8 HG12 VAL 8 1.629 -5.968 -0.369 55 HG13 VAL 8 HG13 VAL 8 0.619 -7.077 0.562 56 HG21 VAL 8 HG21 VAL 8 3.418 -6.085 1.518 57 HG22 VAL 8 HG22 VAL 8 3.958 -7.679 2.046 58 HG23 VAL 8 HG23 VAL 8 2.309 -7.150 2.386 59 H TYR 9 HN TYR 9 3.288 -10.069 -1.679 60 HA TYR 9 HA TYR 9 6.017 -10.543 -0.907 61 HB2 TYR 9 HB2 TYR 9 6.043 -12.927 -1.418 62 HB3 TYR 9 HB1 TYR 9 4.914 -12.618 -0.108 63 HD1 TYR 9 HD1 TYR 9 2.398 -12.177 -0.987 64 HD2 TYR 9 HD2 TYR 9 5.377 -14.405 -3.053 65 HE1 TYR 9 HE1 TYR 9 0.643 -13.362 -2.232 66 HE2 TYR 9 HE2 TYR 9 3.621 -15.595 -4.305 67 HH TYR 9 HH TYR 9 1.132 -16.169 -3.874 68 H ALA 10 HN ALA 10 7.310 -10.268 -2.670 69 HA ALA 10 HA ALA 10 6.654 -10.931 -5.321 70 HB1 ALA 10 HB1 ALA 10 5.029 -9.162 -5.298 71 HB2 ALA 10 HB2 ALA 10 6.413 -8.605 -6.243 72 HB3 ALA 10 HB3 ALA 10 6.192 -8.036 -4.588 73 H GLN 11 HN GLN 11 8.235 -9.836 -6.889 74 HA GLN 11 HA GLN 11 10.642 -8.852 -5.565 75 HB2 GLN 11 HB2 GLN 11 10.571 -11.470 -5.926 76 HB3 GLN 11 HB1 GLN 11 11.013 -11.034 -7.573 77 HG2 GLN 11 HG2 GLN 11 13.095 -11.243 -6.727 78 HG3 GLN 11 HG1 GLN 11 12.808 -9.570 -6.263 79 HE21 GLN 11 HE21 GLN 11 10.929 -10.290 -4.140 80 HE22 GLN 11 HE22 GLN 11 11.896 -10.923 -2.857 81 H GLU 12 HN GLU 12 9.218 -7.162 -6.886 82 HA GLU 12 HA GLU 12 10.335 -6.976 -9.608 83 HB2 GLU 12 HB2 GLU 12 7.888 -5.609 -8.480 84 HB3 GLU 12 HB1 GLU 12 8.480 -5.453 -10.124 85 HG2 GLU 12 HG2 GLU 12 7.398 -7.934 -8.855 86 HG3 GLU 12 HG1 GLU 12 6.611 -6.924 -10.065 87 H ASN 13 HN ASN 13 9.528 -4.189 -9.696 88 HA ASN 13 HA ASN 13 11.891 -2.868 -8.960 89 HB2 ASN 13 HB2 ASN 13 10.183 -0.858 -9.430 90 HB3 ASN 13 HB1 ASN 13 10.830 -1.847 -10.736 91 HD21 ASN 13 HD21 ASN 13 9.302 -2.361 -12.110 92 HD22 ASN 13 HD22 ASN 13 7.656 -2.691 -11.752 93 H TYR 14 HN TYR 14 11.292 -3.896 -6.580 94 HA TYR 14 HA TYR 14 9.626 -2.212 -4.988 95 HB2 TYR 14 HB2 TYR 14 9.985 -4.600 -4.471 96 HB3 TYR 14 HB1 TYR 14 11.675 -4.260 -4.122 97 HD1 TYR 14 HD2 TYR 14 12.268 -2.864 -2.152 98 HD2 TYR 14 HD1 TYR 14 8.279 -4.164 -2.872 99 HE1 TYR 14 HE2 TYR 14 11.690 -2.364 0.177 100 HE2 TYR 14 HE1 TYR 14 7.698 -3.675 -0.533 101 HH TYR 14 HH TYR 14 10.020 -3.129 1.849 102 H GLU 15 HN GLU 15 13.132 -2.873 -4.721 103 HA GLU 15 HA GLU 15 13.559 -0.620 -3.058 104 HB2 GLU 15 HB2 GLU 15 15.986 -1.053 -3.460 105 HB3 GLU 15 HB1 GLU 15 15.079 -2.429 -2.852 106 HG2 GLU 15 HG2 GLU 15 14.924 -3.252 -5.207 107 HG3 GLU 15 HG1 GLU 15 16.044 -1.966 -5.657 108 H GLU 16 HN GLU 16 13.676 -1.066 -6.511 109 HA GLU 16 HA GLU 16 15.086 1.314 -7.120 110 HB2 GLU 16 HB2 GLU 16 13.306 -0.521 -8.687 111 HB3 GLU 16 HB1 GLU 16 13.859 0.999 -9.385 112 HG2 GLU 16 HG2 GLU 16 16.132 0.347 -9.198 113 HG3 GLU 16 HG1 GLU 16 15.713 -1.073 -8.240 114 H PHE 17 HN PHE 17 11.721 0.617 -6.449 115 HA PHE 17 HA PHE 17 10.768 3.156 -7.376 116 HB2 PHE 17 HB2 PHE 17 9.194 1.367 -7.403 117 HB3 PHE 17 HB1 PHE 17 9.531 0.946 -5.726 118 HD1 PHE 17 HD1 PHE 17 8.693 4.190 -7.384 119 HD2 PHE 17 HD2 PHE 17 7.609 1.252 -4.514 120 HE1 PHE 17 HE1 PHE 17 6.803 5.582 -6.678 121 HE2 PHE 17 HE2 PHE 17 5.711 2.637 -3.815 122 HZ PHE 17 HZ PHE 17 5.308 4.805 -4.887 123 H LEU 18 HN LEU 18 11.967 1.797 -4.394 124 HA LEU 18 HA LEU 18 11.079 3.757 -2.604 125 HB2 LEU 18 HB2 LEU 18 13.703 2.257 -2.453 126 HB3 LEU 18 HB1 LEU 18 12.870 3.044 -1.127 127 HG LEU 18 HG LEU 18 12.109 0.512 -2.555 128 HD11 LEU 18 HD11 LEU 18 12.992 1.272 0.186 129 HD12 LEU 18 HD12 LEU 18 13.529 -0.059 -0.843 130 HD13 LEU 18 HD13 LEU 18 11.961 -0.142 -0.036 131 HD21 LEU 18 HD21 LEU 18 10.425 2.284 -0.820 132 HD22 LEU 18 HD22 LEU 18 10.126 0.552 -0.960 133 HD23 LEU 18 HD23 LEU 18 10.033 1.579 -2.389 134 H LYS 19 HN LYS 19 13.763 3.667 -4.829 135 HA LYS 19 HA LYS 19 15.137 5.939 -3.823 136 HB2 LYS 19 HB2 LYS 19 15.258 4.889 -6.650 137 HB3 LYS 19 HB1 LYS 19 16.510 5.756 -5.766 138 HG2 LYS 19 HG2 LYS 19 15.878 3.461 -4.259 139 HG3 LYS 19 HG1 LYS 19 16.041 2.950 -5.939 140 HD2 LYS 19 HD2 LYS 19 18.252 3.716 -6.074 141 HD3 LYS 19 HD1 LYS 19 18.088 4.713 -4.625 142 HE2 LYS 19 HE2 LYS 19 18.003 2.768 -3.231 143 HE3 LYS 19 HE1 LYS 19 17.943 1.705 -4.632 144 HZ1 LYS 19 HZ1 LYS 19 20.196 2.770 -5.195 145 HZ2 LYS 19 HZ2 LYS 19 20.136 1.609 -3.968 146 HZ3 LYS 19 HZ3 LYS 19 20.215 3.255 -3.567 147 H ALA 20 HN ALA 20 12.394 5.537 -5.903 148 HA ALA 20 HA ALA 20 12.623 8.137 -7.120 149 HB1 ALA 20 HB1 ALA 20 11.524 6.191 -8.260 150 HB2 ALA 20 HB2 ALA 20 10.550 7.661 -8.231 151 HB3 ALA 20 HB3 ALA 20 10.196 6.348 -7.110 152 H LEU 21 HN LEU 21 11.451 6.936 -4.204 153 HA LEU 21 HA LEU 21 9.645 9.200 -3.812 154 HB2 LEU 21 HB2 LEU 21 10.254 6.922 -1.931 155 HB3 LEU 21 HB1 LEU 21 8.899 8.037 -1.844 156 HG LEU 21 HG LEU 21 9.268 6.230 -4.212 157 HD11 LEU 21 HD11 LEU 21 9.241 4.641 -2.494 158 HD12 LEU 21 HD12 LEU 21 7.563 4.758 -3.027 159 HD13 LEU 21 HD13 LEU 21 8.072 5.564 -1.543 160 HD21 LEU 21 HD21 LEU 21 6.791 7.400 -2.967 161 HD22 LEU 21 HD22 LEU 21 6.915 6.544 -4.502 162 HD23 LEU 21 HD23 LEU 21 7.668 8.129 -4.313 163 H ALA 22 HN ALA 22 12.757 8.887 -3.791 164 HA ALA 22 HA ALA 22 14.553 9.841 -2.785 165 HB1 ALA 22 HB1 ALA 22 14.259 12.038 -1.846 166 HB2 ALA 22 HB2 ALA 22 12.529 11.763 -1.646 167 HB3 ALA 22 HB3 ALA 22 13.223 11.867 -3.264 168 H LEU 23 HN LEU 23 13.493 7.651 -1.496 169 HA LEU 23 HA LEU 23 13.297 8.188 1.339 170 HB2 LEU 23 HB2 LEU 23 13.332 5.670 -0.311 171 HB3 LEU 23 HB1 LEU 23 13.318 5.633 1.445 172 HG LEU 23 HG LEU 23 11.215 7.076 -0.164 173 HD11 LEU 23 HD11 LEU 23 9.806 5.076 0.372 174 HD12 LEU 23 HD12 LEU 23 11.306 4.229 0.760 175 HD13 LEU 23 HD13 LEU 23 11.036 4.848 -0.869 176 HD21 LEU 23 HD21 LEU 23 11.190 7.844 2.043 177 HD22 LEU 23 HD22 LEU 23 11.510 6.237 2.700 178 HD23 LEU 23 HD23 LEU 23 9.936 6.603 1.989 179 HA PRO 24 HA PRO 24 17.528 7.850 2.503 180 HB2 PRO 24 HB2 PRO 24 17.429 6.130 4.666 181 HB3 PRO 24 HB1 PRO 24 17.035 7.855 4.745 182 HG2 PRO 24 HG2 PRO 24 15.223 5.517 4.628 183 HG3 PRO 24 HG1 PRO 24 15.034 7.061 5.480 184 HD2 PRO 24 HD2 PRO 24 13.735 6.495 3.173 185 HD3 PRO 24 HD1 PRO 24 14.212 8.133 3.641 186 H GLU 25 HN GLU 25 19.074 6.809 1.503 187 HA GLU 25 HA GLU 25 18.858 4.417 0.136 188 HB2 GLU 25 HB2 GLU 25 21.222 5.967 1.138 189 HB3 GLU 25 HB1 GLU 25 21.448 4.441 0.295 190 HG2 GLU 25 HG2 GLU 25 20.001 6.838 -0.796 191 HG3 GLU 25 HG1 GLU 25 21.653 6.366 -1.193 192 H ASP 26 HN ASP 26 19.774 4.976 3.459 193 HA ASP 26 HA ASP 26 20.886 2.412 3.948 194 HB2 ASP 26 HB2 ASP 26 21.259 4.427 5.389 195 HB3 ASP 26 HB1 ASP 26 19.595 4.283 5.941 196 H LEU 27 HN LEU 27 17.663 3.810 4.645 197 HA LEU 27 HA LEU 27 16.623 1.420 5.749 198 HB2 LEU 27 HB2 LEU 27 15.759 3.845 5.962 199 HB3 LEU 27 HB1 LEU 27 14.909 3.510 4.462 200 HG LEU 27 HG LEU 27 14.410 1.366 6.280 201 HD11 LEU 27 HD11 LEU 27 14.952 2.876 8.072 202 HD12 LEU 27 HD12 LEU 27 13.208 2.623 8.020 203 HD13 LEU 27 HD13 LEU 27 13.900 4.118 7.388 204 HD21 LEU 27 HD21 LEU 27 12.137 1.893 5.840 205 HD22 LEU 27 HD22 LEU 27 13.038 2.167 4.348 206 HD23 LEU 27 HD23 LEU 27 12.547 3.535 5.349 207 H ILE 28 HN ILE 28 16.859 2.603 2.488 208 HA ILE 28 HA ILE 28 14.925 0.945 1.282 209 HB ILE 28 HB ILE 28 17.471 2.164 0.170 210 HG12 ILE 28 HG12 ILE 28 14.584 2.966 -0.187 211 HG13 ILE 28 HG11 ILE 28 15.667 3.694 0.991 212 HG21 ILE 28 HG21 ILE 28 16.580 1.741 -2.060 213 HG22 ILE 28 HG22 ILE 28 15.201 0.898 -1.364 214 HG23 ILE 28 HG23 ILE 28 16.821 0.228 -1.190 215 HD11 ILE 28 HD11 ILE 28 17.144 4.358 -0.905 216 HD12 ILE 28 HD12 ILE 28 15.559 5.130 -0.885 217 HD13 ILE 28 HD13 ILE 28 15.878 3.802 -2.002 218 H LYS 29 HN LYS 29 18.032 0.239 2.608 219 HA LYS 29 HA LYS 29 18.373 -2.202 1.072 220 HB2 LYS 29 HB2 LYS 29 19.943 -0.968 3.336 221 HB3 LYS 29 HB1 LYS 29 20.346 -2.519 2.612 222 HG2 LYS 29 HG2 LYS 29 21.080 -1.585 0.661 223 HG3 LYS 29 HG1 LYS 29 20.059 -0.155 0.835 224 HD2 LYS 29 HD2 LYS 29 22.369 0.472 1.160 225 HD3 LYS 29 HD1 LYS 29 21.512 0.603 2.694 226 HE2 LYS 29 HE2 LYS 29 22.390 -1.608 3.333 227 HE3 LYS 29 HE1 LYS 29 23.299 -1.661 1.822 228 HZ1 LYS 29 HZ1 LYS 29 24.416 0.412 2.554 229 HZ2 LYS 29 HZ2 LYS 29 24.738 -0.917 3.545 230 HZ3 LYS 29 HZ3 LYS 29 23.645 0.269 4.051 231 H MET 30 HN MET 30 17.137 -1.124 4.108 232 HA MET 30 HA MET 30 16.961 -3.762 5.240 233 HB2 MET 30 HB2 MET 30 15.958 -1.056 6.113 234 HB3 MET 30 HB1 MET 30 15.677 -2.527 7.036 235 HG2 MET 30 HG2 MET 30 17.603 -2.181 8.030 236 HG3 MET 30 HG1 MET 30 18.393 -2.521 6.498 237 HE1 MET 30 HE1 MET 30 17.312 1.745 7.884 238 HE2 MET 30 HE2 MET 30 17.237 0.372 8.993 239 HE3 MET 30 HE3 MET 30 16.131 0.461 7.620 240 H ALA 31 HN ALA 31 14.667 -1.283 4.159 241 HA ALA 31 HA ALA 31 12.341 -2.770 4.577 242 HB1 ALA 31 HB1 ALA 31 12.815 -0.542 2.600 243 HB2 ALA 31 HB2 ALA 31 12.336 -0.356 4.287 244 HB3 ALA 31 HB3 ALA 31 11.242 -1.125 3.139 245 H ARG 32 HN ARG 32 14.655 -3.015 2.004 246 HA ARG 32 HA ARG 32 12.853 -4.147 0.097 247 HB2 ARG 32 HB2 ARG 32 14.765 -4.612 -1.250 248 HB3 ARG 32 HB1 ARG 32 14.990 -3.030 -0.526 249 HG2 ARG 32 HG2 ARG 32 16.463 -4.114 1.177 250 HG3 ARG 32 HG1 ARG 32 16.351 -5.603 0.236 251 HD2 ARG 32 HD2 ARG 32 17.165 -4.276 -1.748 252 HD3 ARG 32 HD1 ARG 32 17.497 -2.956 -0.634 253 HE ARG 32 HE ARG 32 18.830 -5.009 0.487 254 HH11 ARG 32 HH11 ARG 32 18.774 -3.735 -2.794 255 HH12 ARG 32 HH12 ARG 32 20.414 -4.193 -3.128 256 HH21 ARG 32 HH21 ARG 32 20.981 -5.622 0.025 257 HH22 ARG 32 HH22 ARG 32 21.658 -5.278 -1.535 258 H ASP 33 HN ASP 33 14.151 -5.285 2.942 259 HA ASP 33 HA ASP 33 13.735 -8.090 2.134 260 HB2 ASP 33 HB2 ASP 33 16.000 -7.819 2.891 261 HB3 ASP 33 HB1 ASP 33 15.485 -6.909 4.301 262 H ILE 34 HN ILE 34 12.966 -5.529 4.331 263 HA ILE 34 HA ILE 34 11.412 -7.125 6.139 264 HB ILE 34 HB ILE 34 11.414 -4.121 5.830 265 HG12 ILE 34 HG12 ILE 34 13.129 -5.875 7.585 266 HG13 ILE 34 HG11 ILE 34 13.681 -5.000 6.175 267 HG21 ILE 34 HG21 ILE 34 10.493 -5.969 8.022 268 HG22 ILE 34 HG22 ILE 34 9.547 -4.774 7.132 269 HG23 ILE 34 HG23 ILE 34 10.783 -4.249 8.281 270 HD11 ILE 34 HD11 ILE 34 14.299 -3.891 8.248 271 HD12 ILE 34 HD12 ILE 34 12.596 -3.751 8.675 272 HD13 ILE 34 HD13 ILE 34 13.225 -2.894 7.268 273 H LYS 35 HN LYS 35 9.703 -8.086 5.251 274 HA LYS 35 HA LYS 35 7.702 -6.378 3.934 275 HB2 LYS 35 HB2 LYS 35 7.083 -8.633 2.750 276 HB3 LYS 35 HB1 LYS 35 8.395 -7.649 2.118 277 HG2 LYS 35 HG2 LYS 35 10.038 -9.079 3.006 278 HG3 LYS 35 HG1 LYS 35 8.877 -9.892 4.053 279 HD2 LYS 35 HD2 LYS 35 8.792 -10.002 1.043 280 HD3 LYS 35 HD1 LYS 35 9.571 -11.221 2.059 281 HE2 LYS 35 HE2 LYS 35 6.654 -10.491 1.922 282 HE3 LYS 35 HE1 LYS 35 7.407 -12.035 1.542 283 HZ1 LYS 35 HZ1 LYS 35 6.966 -10.821 4.201 284 HZ2 LYS 35 HZ2 LYS 35 8.090 -12.060 3.977 285 HZ3 LYS 35 HZ3 LYS 35 6.459 -12.335 3.635 286 HA PRO 36 HA PRO 36 5.689 -8.415 7.502 287 HB2 PRO 36 HB2 PRO 36 4.314 -6.270 8.366 288 HB3 PRO 36 HB1 PRO 36 6.037 -6.476 8.737 289 HG2 PRO 36 HG2 PRO 36 4.747 -4.747 6.687 290 HG3 PRO 36 HG1 PRO 36 6.137 -4.410 7.737 291 HD2 PRO 36 HD2 PRO 36 6.347 -5.170 5.107 292 HD3 PRO 36 HD1 PRO 36 7.607 -5.409 6.328 293 H ILE 37 HN ILE 37 3.221 -8.206 8.128 294 HA ILE 37 HA ILE 37 1.738 -8.672 5.664 295 HB ILE 37 HB ILE 37 1.682 -10.335 7.515 296 HG12 ILE 37 HG12 ILE 37 -0.294 -9.671 5.816 297 HG13 ILE 37 HG11 ILE 37 -0.412 -11.005 6.954 298 HG21 ILE 37 HG21 ILE 37 0.138 -9.778 9.451 299 HG22 ILE 37 HG22 ILE 37 0.359 -8.088 8.990 300 HG23 ILE 37 HG23 ILE 37 1.749 -9.059 9.471 301 HD11 ILE 37 HD11 ILE 37 -1.774 -9.765 8.421 302 HD12 ILE 37 HD12 ILE 37 -2.401 -9.464 6.799 303 HD13 ILE 37 HD13 ILE 37 -1.405 -8.248 7.599 304 H VAL 38 HN VAL 38 -0.191 -7.609 5.136 305 HA VAL 38 HA VAL 38 -0.452 -4.939 6.312 306 HB VAL 38 HB VAL 38 -1.774 -5.993 3.801 307 HG11 VAL 38 HG11 VAL 38 -2.883 -4.055 4.745 308 HG12 VAL 38 HG12 VAL 38 -2.032 -3.603 3.267 309 HG13 VAL 38 HG13 VAL 38 -1.344 -3.195 4.837 310 HG21 VAL 38 HG21 VAL 38 0.858 -4.575 4.171 311 HG22 VAL 38 HG22 VAL 38 0.006 -4.626 2.631 312 HG23 VAL 38 HG23 VAL 38 0.558 -6.124 3.380 313 H GLU 39 HN GLU 39 -1.809 -4.901 8.003 314 HA GLU 39 HA GLU 39 -4.180 -6.598 8.004 315 HB2 GLU 39 HB2 GLU 39 -2.607 -5.125 10.025 316 HB3 GLU 39 HB1 GLU 39 -4.342 -5.151 10.302 317 HG2 GLU 39 HG2 GLU 39 -4.398 -7.375 10.696 318 HG3 GLU 39 HG1 GLU 39 -3.044 -7.719 9.628 319 H ILE 40 HN ILE 40 -6.096 -5.871 7.317 320 HA ILE 40 HA ILE 40 -6.553 -2.962 7.349 321 HB ILE 40 HB ILE 40 -6.027 -3.561 5.073 322 HG12 ILE 40 HG12 ILE 40 -8.111 -2.056 5.729 323 HG13 ILE 40 HG11 ILE 40 -7.733 -2.417 4.050 324 HG21 ILE 40 HG21 ILE 40 -8.132 -5.683 5.384 325 HG22 ILE 40 HG22 ILE 40 -6.426 -5.884 4.995 326 HG23 ILE 40 HG23 ILE 40 -7.518 -5.159 3.817 327 HD11 ILE 40 HD11 ILE 40 -9.437 -4.109 3.977 328 HD12 ILE 40 HD12 ILE 40 -10.133 -2.614 4.606 329 HD13 ILE 40 HD13 ILE 40 -9.735 -3.929 5.706 330 H GLN 41 HN GLN 41 -8.460 -2.284 8.087 331 HA GLN 41 HA GLN 41 -10.477 -4.331 8.728 332 HB2 GLN 41 HB2 GLN 41 -10.069 -1.738 10.207 333 HB3 GLN 41 HB1 GLN 41 -11.060 -3.104 10.691 334 HG2 GLN 41 HG2 GLN 41 -9.026 -4.457 10.984 335 HG3 GLN 41 HG1 GLN 41 -8.053 -3.055 10.545 336 HE21 GLN 41 HE21 GLN 41 -10.960 -3.099 12.509 337 HE22 GLN 41 HE22 GLN 41 -10.199 -2.563 13.967 338 H GLN 42 HN GLN 42 -12.649 -3.825 8.351 339 HA GLN 42 HA GLN 42 -13.169 -1.250 7.035 340 HB2 GLN 42 HB2 GLN 42 -13.187 -2.441 5.099 341 HB3 GLN 42 HB1 GLN 42 -13.509 -3.965 5.912 342 HG2 GLN 42 HG2 GLN 42 -15.823 -3.525 6.025 343 HG3 GLN 42 HG1 GLN 42 -15.597 -1.835 5.580 344 HE21 GLN 42 HE21 GLN 42 -16.900 -1.869 3.815 345 HE22 GLN 42 HE22 GLN 42 -16.514 -2.742 2.380 346 H LYS 43 HN LYS 43 -15.171 -0.380 7.326 347 HA LYS 43 HA LYS 43 -17.171 -1.845 8.864 348 HB2 LYS 43 HB2 LYS 43 -15.934 0.760 9.787 349 HB3 LYS 43 HB1 LYS 43 -17.439 0.109 10.421 350 HG2 LYS 43 HG2 LYS 43 -16.286 -1.823 11.288 351 HG3 LYS 43 HG1 LYS 43 -14.773 -1.287 10.557 352 HD2 LYS 43 HD2 LYS 43 -14.853 0.739 11.965 353 HD3 LYS 43 HD1 LYS 43 -16.321 0.128 12.726 354 HE2 LYS 43 HE2 LYS 43 -15.093 -1.820 13.536 355 HE3 LYS 43 HE1 LYS 43 -13.628 -1.222 12.753 356 HZ1 LYS 43 HZ1 LYS 43 -15.099 0.294 14.837 357 HZ2 LYS 43 HZ2 LYS 43 -13.570 0.637 14.207 358 HZ3 LYS 43 HZ3 LYS 43 -13.794 -0.728 15.175 359 H GLY 44 HN GLY 44 -18.133 -1.698 6.723 360 HA2 GLY 44 HA2 GLY 44 -19.961 -0.791 5.587 361 HA3 GLY 44 HA1 GLY 44 -19.769 0.696 6.512 362 H ASP 45 HN ASP 45 -18.738 2.385 5.597 363 HA ASP 45 HA ASP 45 -17.567 1.932 2.939 364 HB2 ASP 45 HB2 ASP 45 -18.696 4.465 4.155 365 HB3 ASP 45 HB1 ASP 45 -17.924 4.369 2.579 366 H ASP 46 HN ASP 46 -16.848 2.766 6.150 367 HA ASP 46 HA ASP 46 -14.426 4.237 5.484 368 HB2 ASP 46 HB2 ASP 46 -15.806 3.532 8.059 369 HB3 ASP 46 HB1 ASP 46 -14.152 4.139 8.057 370 H PHE 47 HN PHE 47 -12.435 3.441 5.475 371 HA PHE 47 HA PHE 47 -12.055 0.644 6.333 372 HB2 PHE 47 HB2 PHE 47 -10.907 2.151 3.993 373 HB3 PHE 47 HB1 PHE 47 -10.167 0.683 4.604 374 HD1 PHE 47 HD1 PHE 47 -13.596 1.837 3.667 375 HD2 PHE 47 HD2 PHE 47 -10.642 -1.207 3.446 376 HE1 PHE 47 HE1 PHE 47 -15.092 0.497 2.251 377 HE2 PHE 47 HE2 PHE 47 -12.122 -2.551 2.022 378 HZ PHE 47 HZ PHE 47 -14.354 -1.699 1.417 379 H VAL 48 HN VAL 48 -10.122 0.152 7.332 380 HA VAL 48 HA VAL 48 -8.385 2.399 8.093 381 HB VAL 48 HB VAL 48 -9.393 0.270 9.998 382 HG11 VAL 48 HG11 VAL 48 -7.188 0.753 10.643 383 HG12 VAL 48 HG12 VAL 48 -8.197 1.756 11.686 384 HG13 VAL 48 HG13 VAL 48 -7.376 2.471 10.300 385 HG21 VAL 48 HG21 VAL 48 -11.082 1.978 9.507 386 HG22 VAL 48 HG22 VAL 48 -9.931 3.239 9.956 387 HG23 VAL 48 HG23 VAL 48 -10.504 2.095 11.171 388 H VAL 49 HN VAL 49 -6.676 1.829 6.875 389 HA VAL 49 HA VAL 49 -5.790 -0.946 6.838 390 HB VAL 49 HB VAL 49 -4.585 1.407 5.377 391 HG11 VAL 49 HG11 VAL 49 -3.562 -0.267 3.951 392 HG12 VAL 49 HG12 VAL 49 -4.353 -1.555 4.856 393 HG13 VAL 49 HG13 VAL 49 -3.125 -0.560 5.635 394 HG21 VAL 49 HG21 VAL 49 -6.756 -0.504 4.529 395 HG22 VAL 49 HG22 VAL 49 -5.837 0.485 3.396 396 HG23 VAL 49 HG23 VAL 49 -6.835 1.254 4.627 397 H THR 50 HN THR 50 -4.214 -1.679 8.021 398 HA THR 50 HA THR 50 -2.581 0.205 9.585 399 HB THR 50 HB THR 50 -3.043 -2.732 10.116 400 HG1 THR 50 HG1 THR 50 -4.943 -1.142 10.135 401 HG21 THR 50 HG21 THR 50 -1.100 -1.766 11.224 402 HG22 THR 50 HG22 THR 50 -2.360 -2.155 12.395 403 HG23 THR 50 HG23 THR 50 -2.106 -0.482 11.897 404 H SER 51 HN SER 51 -0.731 0.541 8.485 405 HA SER 51 HA SER 51 0.547 -1.702 7.112 406 HB2 SER 51 HB2 SER 51 1.582 1.111 7.091 407 HB3 SER 51 HB1 SER 51 1.701 -0.125 5.837 408 HG SER 51 HG SER 51 -0.872 0.354 6.275 409 H LYS 52 HN LYS 52 2.010 -2.838 8.179 410 HA LYS 52 HA LYS 52 3.164 -1.817 10.627 411 HB2 LYS 52 HB2 LYS 52 3.212 -4.492 9.257 412 HB3 LYS 52 HB1 LYS 52 4.211 -4.156 10.665 413 HG2 LYS 52 HG2 LYS 52 2.278 -3.744 12.018 414 HG3 LYS 52 HG1 LYS 52 1.217 -3.849 10.616 415 HD2 LYS 52 HD2 LYS 52 1.470 -6.154 10.438 416 HD3 LYS 52 HD1 LYS 52 2.968 -6.156 11.372 417 HE2 LYS 52 HE2 LYS 52 1.771 -5.709 13.401 418 HE3 LYS 52 HE1 LYS 52 0.262 -5.475 12.518 419 HZ1 LYS 52 HZ1 LYS 52 0.674 -7.707 13.673 420 HZ2 LYS 52 HZ2 LYS 52 1.702 -8.045 12.377 421 HZ3 LYS 52 HZ3 LYS 52 0.061 -7.725 12.093 422 H THR 53 HN THR 53 5.332 -1.556 11.050 423 HA THR 53 HA THR 53 7.175 -1.604 8.756 424 HB THR 53 HB THR 53 7.991 0.582 9.194 425 HG1 THR 53 HG1 THR 53 6.306 1.309 11.233 426 HG21 THR 53 HG21 THR 53 4.995 0.773 9.500 427 HG22 THR 53 HG22 THR 53 5.841 0.538 7.973 428 HG23 THR 53 HG23 THR 53 6.071 2.026 8.890 429 HA PRO 54 HA PRO 54 10.188 -3.089 11.661 430 HB2 PRO 54 HB2 PRO 54 12.279 -1.195 10.979 431 HB3 PRO 54 HB1 PRO 54 12.113 -2.887 10.482 432 HG2 PRO 54 HG2 PRO 54 11.877 -0.779 8.782 433 HG3 PRO 54 HG1 PRO 54 11.111 -2.351 8.525 434 HD2 PRO 54 HD2 PRO 54 9.922 0.177 9.539 435 HD3 PRO 54 HD1 PRO 54 9.225 -1.050 8.462 436 H ARG 55 HN ARG 55 8.858 -0.141 12.201 437 HA ARG 55 HA ARG 55 10.266 0.106 14.762 438 HB2 ARG 55 HB2 ARG 55 10.462 1.963 12.630 439 HB3 ARG 55 HB1 ARG 55 9.487 2.717 13.884 440 HG2 ARG 55 HG2 ARG 55 11.272 2.215 15.518 441 HG3 ARG 55 HG1 ARG 55 12.255 1.576 14.199 442 HD2 ARG 55 HD2 ARG 55 12.423 3.697 13.170 443 HD3 ARG 55 HD1 ARG 55 11.145 4.374 14.176 444 HE ARG 55 HE ARG 55 12.755 4.044 16.077 445 HH11 ARG 55 HH11 ARG 55 13.883 4.556 12.792 446 HH12 ARG 55 HH12 ARG 55 15.417 5.198 13.291 447 HH21 ARG 55 HH21 ARG 55 14.785 4.879 16.719 448 HH22 ARG 55 HH22 ARG 55 15.922 5.385 15.510 449 H GLN 56 HN GLN 56 7.515 1.523 12.947 450 HA GLN 56 HA GLN 56 5.708 0.702 15.062 451 HB2 GLN 56 HB2 GLN 56 6.571 2.893 15.849 452 HB3 GLN 56 HB1 GLN 56 5.981 3.634 14.369 453 HG2 GLN 56 HG2 GLN 56 3.687 2.769 15.017 454 HG3 GLN 56 HG1 GLN 56 4.383 2.426 16.598 455 HE21 GLN 56 HE21 GLN 56 3.019 3.896 17.612 456 HE22 GLN 56 HE22 GLN 56 3.234 5.605 17.458 457 H THR 57 HN THR 57 3.717 0.262 14.281 458 HA THR 57 HA THR 57 3.305 0.444 11.447 459 HB THR 57 HB THR 57 2.519 -1.537 12.633 460 HG1 THR 57 HG1 THR 57 1.273 -0.432 10.797 461 HG21 THR 57 HG21 THR 57 1.927 -0.821 14.793 462 HG22 THR 57 HG22 THR 57 0.396 -1.275 14.043 463 HG23 THR 57 HG23 THR 57 0.845 0.423 14.176 464 H VAL 58 HN VAL 58 2.008 1.803 10.333 465 HA VAL 58 HA VAL 58 0.875 4.052 11.835 466 HB VAL 58 HB VAL 58 0.821 5.277 9.717 467 HG11 VAL 58 HG11 VAL 58 3.283 5.403 9.330 468 HG12 VAL 58 HG12 VAL 58 3.466 4.008 10.392 469 HG13 VAL 58 HG13 VAL 58 2.809 5.516 11.024 470 HG21 VAL 58 HG21 VAL 58 1.991 4.301 7.736 471 HG22 VAL 58 HG22 VAL 58 0.446 3.545 8.119 472 HG23 VAL 58 HG23 VAL 58 1.953 2.741 8.554 473 H THR 59 HN THR 59 -1.205 4.856 11.312 474 HA THR 59 HA THR 59 -2.994 2.776 10.255 475 HB THR 59 HB THR 59 -3.672 4.992 12.190 476 HG1 THR 59 HG1 THR 59 -2.602 2.471 12.534 477 HG21 THR 59 HG21 THR 59 -5.227 2.578 11.267 478 HG22 THR 59 HG22 THR 59 -5.587 4.263 10.887 479 HG23 THR 59 HG23 THR 59 -5.728 3.682 12.548 480 H ASN 60 HN ASN 60 -3.767 3.195 8.321 481 HA ASN 60 HA ASN 60 -4.160 6.005 7.471 482 HB2 ASN 60 HB2 ASN 60 -3.350 3.510 5.996 483 HB3 ASN 60 HB1 ASN 60 -4.150 4.824 5.132 484 HD21 ASN 60 HD21 ASN 60 -1.343 3.712 5.098 485 HD22 ASN 60 HD22 ASN 60 -0.341 5.107 5.307 486 H SER 61 HN SER 61 -6.278 6.585 7.320 487 HA SER 61 HA SER 61 -8.255 4.430 6.912 488 HB2 SER 61 HB2 SER 61 -9.080 6.833 8.455 489 HB3 SER 61 HB1 SER 61 -9.556 5.146 8.647 490 HG SER 61 HG SER 61 -6.912 5.876 9.212 491 H PHE 62 HN PHE 62 -10.156 4.962 5.756 492 HA PHE 62 HA PHE 62 -10.495 7.577 4.616 493 HB2 PHE 62 HB2 PHE 62 -10.355 6.759 2.240 494 HB3 PHE 62 HB1 PHE 62 -8.810 6.870 3.073 495 HD1 PHE 62 HD1 PHE 62 -11.324 4.600 1.689 496 HD2 PHE 62 HD2 PHE 62 -7.527 4.904 3.586 497 HE1 PHE 62 HE1 PHE 62 -10.837 2.273 1.073 498 HE2 PHE 62 HE2 PHE 62 -7.033 2.576 2.980 499 HZ PHE 62 HZ PHE 62 -8.686 1.249 1.731 500 H THR 63 HN THR 63 -12.249 7.312 2.741 501 HA THR 63 HA THR 63 -14.222 5.313 3.596 502 HB THR 63 HB THR 63 -15.021 8.125 2.881 503 HG1 THR 63 HG1 THR 63 -14.674 7.143 5.545 504 HG21 THR 63 HG21 THR 63 -16.816 6.547 2.781 505 HG22 THR 63 HG22 THR 63 -17.017 7.486 4.260 506 HG23 THR 63 HG23 THR 63 -16.363 5.851 4.337 507 H LEU 64 HN LEU 64 -15.443 4.448 1.970 508 HA LEU 64 HA LEU 64 -14.419 4.410 -0.633 509 HB2 LEU 64 HB2 LEU 64 -17.120 3.630 0.455 510 HB3 LEU 64 HB1 LEU 64 -16.634 3.320 -1.198 511 HG LEU 64 HG LEU 64 -15.349 2.189 1.284 512 HD11 LEU 64 HD11 LEU 64 -16.183 0.058 0.464 513 HD12 LEU 64 HD12 LEU 64 -16.896 0.853 -0.938 514 HD13 LEU 64 HD13 LEU 64 -17.518 1.190 0.678 515 HD21 LEU 64 HD21 LEU 64 -14.600 1.982 -1.620 516 HD22 LEU 64 HD22 LEU 64 -14.060 0.828 -0.399 517 HD23 LEU 64 HD23 LEU 64 -13.602 2.527 -0.271 518 H GLY 65 HN GLY 65 -14.457 5.922 -2.135 519 HA2 GLY 65 HA2 GLY 65 -15.370 7.397 -3.674 520 HA3 GLY 65 HA1 GLY 65 -16.929 7.209 -2.887 521 H LYS 66 HN LYS 66 -14.214 7.993 -0.934 522 HA LYS 66 HA LYS 66 -14.947 10.832 -0.951 523 HB2 LYS 66 HB2 LYS 66 -15.516 8.961 1.134 524 HB3 LYS 66 HB1 LYS 66 -14.324 10.109 1.723 525 HG2 LYS 66 HG2 LYS 66 -15.770 11.945 1.339 526 HG3 LYS 66 HG1 LYS 66 -16.887 10.953 0.402 527 HD2 LYS 66 HD2 LYS 66 -17.837 11.317 2.568 528 HD3 LYS 66 HD1 LYS 66 -17.338 9.629 2.458 529 HE2 LYS 66 HE2 LYS 66 -15.407 10.031 3.795 530 HE3 LYS 66 HE1 LYS 66 -15.640 11.774 3.713 531 HZ1 LYS 66 HZ1 LYS 66 -17.465 9.855 5.061 532 HZ2 LYS 66 HZ2 LYS 66 -17.666 11.531 4.997 533 HZ3 LYS 66 HZ3 LYS 66 -16.359 10.870 5.841 534 H GLU 67 HN GLU 67 -13.311 12.246 -0.359 535 HA GLU 67 HA GLU 67 -10.632 11.219 -0.734 536 HB2 GLU 67 HB2 GLU 67 -11.327 13.313 -1.829 537 HB3 GLU 67 HB1 GLU 67 -11.617 14.044 -0.256 538 HG2 GLU 67 HG2 GLU 67 -9.096 13.389 0.133 539 HG3 GLU 67 HG1 GLU 67 -9.057 13.430 -1.628 540 H ALA 68 HN ALA 68 -9.280 10.717 0.904 541 HA ALA 68 HA ALA 68 -9.874 11.874 3.541 542 HB1 ALA 68 HB1 ALA 68 -10.705 9.597 3.508 543 HB2 ALA 68 HB2 ALA 68 -9.320 9.741 4.590 544 HB3 ALA 68 HB3 ALA 68 -9.123 9.015 2.996 545 H ASP 69 HN ASP 69 -8.157 12.203 4.908 546 HA ASP 69 HA ASP 69 -5.593 12.555 3.581 547 HB2 ASP 69 HB2 ASP 69 -6.652 14.347 4.999 548 HB3 ASP 69 HB1 ASP 69 -6.420 13.298 6.392 549 H ILE 70 HN ILE 70 -4.032 11.123 3.768 550 HA ILE 70 HA ILE 70 -3.984 9.352 6.115 551 HB ILE 70 HB ILE 70 -3.061 7.563 4.528 552 HG12 ILE 70 HG12 ILE 70 -4.339 7.839 2.238 553 HG13 ILE 70 HG11 ILE 70 -4.113 9.554 2.570 554 HG21 ILE 70 HG21 ILE 70 -5.956 8.359 4.497 555 HG22 ILE 70 HG22 ILE 70 -5.153 7.253 5.610 556 HG23 ILE 70 HG23 ILE 70 -5.357 6.807 3.915 557 HD11 ILE 70 HD11 ILE 70 -2.305 8.786 1.192 558 HD12 ILE 70 HD12 ILE 70 -1.967 7.450 2.295 559 HD13 ILE 70 HD13 ILE 70 -1.671 9.110 2.806 560 H THR 71 HN THR 71 -1.823 8.308 6.431 561 HA THR 71 HA THR 71 0.245 10.294 5.702 562 HB THR 71 HB THR 71 0.358 8.456 8.081 563 HG1 THR 71 HG1 THR 71 -0.994 10.907 7.730 564 HG21 THR 71 HG21 THR 71 1.954 10.089 8.931 565 HG22 THR 71 HG22 THR 71 1.707 11.100 7.507 566 HG23 THR 71 HG23 THR 71 2.469 9.517 7.342 567 H THR 72 HN THR 72 2.227 9.635 4.999 568 HA THR 72 HA THR 72 2.464 6.793 4.303 569 HB THR 72 HB THR 72 2.523 8.229 2.339 570 HG1 THR 72 HG1 THR 72 4.645 7.583 1.584 571 HG21 THR 72 HG21 THR 72 4.889 9.579 3.638 572 HG22 THR 72 HG22 THR 72 3.297 10.297 3.402 573 HG23 THR 72 HG23 THR 72 4.290 9.880 2.007 574 H MET 73 HN MET 73 4.705 5.917 4.374 575 HA MET 73 HA MET 73 5.827 6.302 6.935 576 HB2 MET 73 HB2 MET 73 6.139 4.477 4.739 577 HB3 MET 73 HB1 MET 73 7.717 4.956 5.349 578 HG2 MET 73 HG2 MET 73 6.911 2.948 6.447 579 HG3 MET 73 HG1 MET 73 7.084 4.279 7.589 580 HE1 MET 73 HE1 MET 73 3.313 2.015 6.433 581 HE2 MET 73 HE2 MET 73 4.985 1.678 5.990 582 HE3 MET 73 HE3 MET 73 4.076 2.915 5.124 583 H ASP 74 HN ASP 74 6.402 7.845 3.937 584 HA ASP 74 HA ASP 74 9.097 8.655 4.449 585 HB2 ASP 74 HB2 ASP 74 8.411 8.572 2.165 586 HB3 ASP 74 HB1 ASP 74 7.009 9.591 2.478 587 H GLY 75 HN GLY 75 5.989 9.772 5.406 588 HA2 GLY 75 HA2 GLY 75 5.623 11.304 7.161 589 HA3 GLY 75 HA1 GLY 75 7.238 11.951 6.900 590 H LYS 76 HN LYS 76 4.697 11.429 4.524 591 HA LYS 76 HA LYS 76 4.594 14.334 4.070 592 HB2 LYS 76 HB2 LYS 76 4.800 12.066 2.136 593 HB3 LYS 76 HB1 LYS 76 3.925 13.512 1.661 594 HG2 LYS 76 HG2 LYS 76 6.139 14.683 2.535 595 HG3 LYS 76 HG1 LYS 76 6.825 13.110 2.122 596 HD2 LYS 76 HD2 LYS 76 5.615 13.380 -0.112 597 HD3 LYS 76 HD1 LYS 76 5.428 15.074 0.340 598 HE2 LYS 76 HE2 LYS 76 7.392 15.036 -0.931 599 HE3 LYS 76 HE1 LYS 76 7.959 15.050 0.739 600 HZ1 LYS 76 HZ1 LYS 76 9.197 13.431 -0.484 601 HZ2 LYS 76 HZ2 LYS 76 7.788 12.695 -1.061 602 HZ3 LYS 76 HZ3 LYS 76 8.177 12.599 0.586 603 H LYS 77 HN LYS 77 2.590 15.177 3.368 604 HA LYS 77 HA LYS 77 0.316 13.657 4.358 605 HB2 LYS 77 HB2 LYS 77 0.559 16.542 3.472 606 HB3 LYS 77 HB1 LYS 77 -0.904 15.811 4.116 607 HG2 LYS 77 HG2 LYS 77 1.695 16.282 5.555 608 HG3 LYS 77 HG1 LYS 77 0.134 17.046 5.861 609 HD2 LYS 77 HD2 LYS 77 -0.761 14.754 6.383 610 HD3 LYS 77 HD1 LYS 77 0.905 14.174 6.327 611 HE2 LYS 77 HE2 LYS 77 -0.194 16.283 8.171 612 HE3 LYS 77 HE1 LYS 77 0.230 14.631 8.607 613 HZ1 LYS 77 HZ1 LYS 77 2.124 16.685 7.611 614 HZ2 LYS 77 HZ2 LYS 77 2.527 15.104 8.052 615 HZ3 LYS 77 HZ3 LYS 77 1.968 16.194 9.219 616 H LEU 78 HN LEU 78 -0.874 12.496 3.014 617 HA LEU 78 HA LEU 78 -1.202 13.455 0.252 618 HB2 LEU 78 HB2 LEU 78 -0.946 10.545 0.971 619 HB3 LEU 78 HB1 LEU 78 -0.987 11.247 -0.628 620 HG LEU 78 HG LEU 78 1.265 11.855 1.264 621 HD11 LEU 78 HD11 LEU 78 1.040 9.522 -0.636 622 HD12 LEU 78 HD12 LEU 78 1.182 9.447 1.122 623 HD13 LEU 78 HD13 LEU 78 2.527 10.050 0.153 624 HD21 LEU 78 HD21 LEU 78 0.943 13.262 -0.742 625 HD22 LEU 78 HD22 LEU 78 1.112 11.820 -1.746 626 HD23 LEU 78 HD23 LEU 78 2.465 12.372 -0.757 627 H LYS 79 HN LYS 79 -3.149 12.912 -0.737 628 HA LYS 79 HA LYS 79 -5.247 11.951 1.087 629 HB2 LYS 79 HB2 LYS 79 -5.877 13.741 -1.224 630 HB3 LYS 79 HB1 LYS 79 -6.757 13.510 0.277 631 HG2 LYS 79 HG2 LYS 79 -4.512 14.588 1.259 632 HG3 LYS 79 HG1 LYS 79 -4.521 15.327 -0.343 633 HD2 LYS 79 HD2 LYS 79 -5.706 16.829 1.032 634 HD3 LYS 79 HD1 LYS 79 -6.946 15.944 0.133 635 HE2 LYS 79 HE2 LYS 79 -7.170 14.412 2.078 636 HE3 LYS 79 HE1 LYS 79 -6.061 15.449 2.972 637 HZ1 LYS 79 HZ1 LYS 79 -8.396 15.931 3.447 638 HZ2 LYS 79 HZ2 LYS 79 -8.657 16.321 1.819 639 HZ3 LYS 79 HZ3 LYS 79 -7.612 17.265 2.760 640 H CYS 80 HN CYS 80 -5.999 10.051 0.479 641 HA CYS 80 HA CYS 80 -5.806 9.332 -2.369 642 HB2 CYS 80 HB2 CYS 80 -4.757 7.961 -0.299 643 HB3 CYS 80 HB1 CYS 80 -6.355 7.224 -0.347 644 H THR 81 HN THR 81 -7.644 9.657 -3.403 645 HA THR 81 HA THR 81 -10.208 9.442 -2.076 646 HB THR 81 HB THR 81 -9.928 9.749 -5.045 647 HG1 THR 81 HG1 THR 81 -9.861 12.170 -4.107 648 HG21 THR 81 HG21 THR 81 -11.697 11.287 -3.166 649 HG22 THR 81 HG22 THR 81 -12.120 9.661 -3.700 650 HG23 THR 81 HG23 THR 81 -11.924 10.953 -4.882 651 H VAL 82 HN VAL 82 -9.976 7.207 -1.527 652 HA VAL 82 HA VAL 82 -9.780 5.221 -3.614 653 HB VAL 82 HB VAL 82 -10.532 4.641 -0.768 654 HG11 VAL 82 HG11 VAL 82 -8.946 3.137 -2.838 655 HG12 VAL 82 HG12 VAL 82 -10.612 2.817 -2.342 656 HG13 VAL 82 HG13 VAL 82 -9.290 2.584 -1.196 657 HG21 VAL 82 HG21 VAL 82 -8.651 6.111 -0.542 658 HG22 VAL 82 HG22 VAL 82 -7.773 5.256 -1.807 659 HG23 VAL 82 HG23 VAL 82 -8.096 4.459 -0.270 660 H HIS 83 HN HIS 83 -11.359 3.816 -4.274 661 HA HIS 83 HA HIS 83 -14.023 4.003 -3.148 662 HB2 HIS 83 HB2 HIS 83 -15.081 4.416 -5.341 663 HB3 HIS 83 HB1 HIS 83 -14.063 5.760 -4.851 664 HD1 HIS 83 HD1 HIS 83 -14.522 3.249 -7.507 665 HD2 HIS 83 HD2 HIS 83 -11.650 6.033 -6.376 666 HE1 HIS 83 HE1 HIS 83 -12.977 3.462 -9.474 667 HE2 HIS 83 HE2 HIS 83 -11.389 5.311 -8.847 668 H LEU 84 HN LEU 84 -15.329 2.215 -3.634 669 HA LEU 84 HA LEU 84 -13.798 -0.115 -4.513 670 HB2 LEU 84 HB2 LEU 84 -14.959 -0.224 -2.350 671 HB3 LEU 84 HB1 LEU 84 -16.491 0.063 -3.157 672 HG LEU 84 HG LEU 84 -15.824 -2.093 -4.511 673 HD11 LEU 84 HD11 LEU 84 -14.355 -2.508 -1.912 674 HD12 LEU 84 HD12 LEU 84 -13.596 -2.279 -3.488 675 HD13 LEU 84 HD13 LEU 84 -14.597 -3.701 -3.190 676 HD21 LEU 84 HD21 LEU 84 -17.062 -3.436 -2.891 677 HD22 LEU 84 HD22 LEU 84 -17.810 -1.856 -3.122 678 HD23 LEU 84 HD23 LEU 84 -16.847 -2.173 -1.680 679 H ALA 85 HN ALA 85 -13.879 -0.434 -6.615 680 HA ALA 85 HA ALA 85 -16.443 -0.062 -8.004 681 HB1 ALA 85 HB1 ALA 85 -15.172 0.376 -10.033 682 HB2 ALA 85 HB2 ALA 85 -13.657 0.094 -9.171 683 HB3 ALA 85 HB3 ALA 85 -14.668 1.477 -8.751 684 H ASN 86 HN ASN 86 -17.401 -1.870 -8.577 685 HA ASN 86 HA ASN 86 -17.818 -4.013 -9.195 686 HB2 ASN 86 HB2 ASN 86 -15.033 -3.901 -10.377 687 HB3 ASN 86 HB1 ASN 86 -16.267 -5.090 -10.767 688 HD21 ASN 86 HD21 ASN 86 -15.030 -1.977 -11.398 689 HD22 ASN 86 HD22 ASN 86 -16.203 -1.493 -12.575 690 H GLY 87 HN GLY 87 -16.456 -3.429 -6.618 691 HA2 GLY 87 HA2 GLY 87 -16.083 -4.898 -4.834 692 HA3 GLY 87 HA1 GLY 87 -15.787 -6.193 -5.985 693 H LYS 88 HN LYS 88 -14.052 -3.652 -7.081 694 HA LYS 88 HA LYS 88 -11.619 -4.581 -5.704 695 HB2 LYS 88 HB2 LYS 88 -12.024 -3.347 -8.436 696 HB3 LYS 88 HB1 LYS 88 -10.438 -3.547 -7.705 697 HG2 LYS 88 HG2 LYS 88 -10.632 -5.385 -9.098 698 HG3 LYS 88 HG1 LYS 88 -11.070 -6.028 -7.515 699 HD2 LYS 88 HD2 LYS 88 -13.478 -5.577 -8.153 700 HD3 LYS 88 HD1 LYS 88 -12.893 -5.297 -9.794 701 HE2 LYS 88 HE2 LYS 88 -12.020 -7.535 -9.921 702 HE3 LYS 88 HE1 LYS 88 -12.407 -7.825 -8.226 703 HZ1 LYS 88 HZ1 LYS 88 -14.088 -8.842 -9.510 704 HZ2 LYS 88 HZ2 LYS 88 -14.303 -7.475 -10.478 705 HZ3 LYS 88 HZ3 LYS 88 -14.786 -7.447 -8.857 706 H LEU 89 HN LEU 89 -10.154 -3.027 -4.887 707 HA LEU 89 HA LEU 89 -11.416 -0.448 -4.352 708 HB2 LEU 89 HB2 LEU 89 -10.233 -2.105 -2.629 709 HB3 LEU 89 HB1 LEU 89 -8.814 -1.203 -3.128 710 HG LEU 89 HG LEU 89 -9.720 0.846 -2.346 711 HD11 LEU 89 HD11 LEU 89 -11.967 0.835 -2.944 712 HD12 LEU 89 HD12 LEU 89 -12.010 0.769 -1.181 713 HD13 LEU 89 HD13 LEU 89 -12.276 -0.695 -2.126 714 HD21 LEU 89 HD21 LEU 89 -10.104 0.376 0.032 715 HD22 LEU 89 HD22 LEU 89 -8.725 -0.516 -0.618 716 HD23 LEU 89 HD23 LEU 89 -10.263 -1.340 -0.349 717 H VAL 90 HN VAL 90 -10.841 1.313 -5.435 718 HA VAL 90 HA VAL 90 -8.192 1.352 -6.724 719 HB VAL 90 HB VAL 90 -10.752 2.435 -7.895 720 HG11 VAL 90 HG11 VAL 90 -7.914 2.448 -8.878 721 HG12 VAL 90 HG12 VAL 90 -9.002 3.815 -8.638 722 HG13 VAL 90 HG13 VAL 90 -9.290 2.679 -9.955 723 HG21 VAL 90 HG21 VAL 90 -9.159 -0.028 -8.587 724 HG22 VAL 90 HG22 VAL 90 -10.395 0.665 -9.635 725 HG23 VAL 90 HG23 VAL 90 -10.833 0.058 -8.036 726 H CYS 91 HN CYS 91 -7.030 3.165 -6.467 727 HA CYS 91 HA CYS 91 -8.386 5.615 -5.583 728 HB2 CYS 91 HB2 CYS 91 -7.267 4.516 -3.616 729 HB3 CYS 91 HB1 CYS 91 -5.731 4.685 -4.464 730 H LYS 92 HN LYS 92 -8.173 6.781 -7.399 731 HA LYS 92 HA LYS 92 -5.550 6.776 -8.711 732 HB2 LYS 92 HB2 LYS 92 -7.592 6.101 -10.035 733 HB3 LYS 92 HB1 LYS 92 -8.166 7.751 -9.868 734 HG2 LYS 92 HG2 LYS 92 -6.310 8.591 -11.120 735 HG3 LYS 92 HG1 LYS 92 -5.543 7.006 -11.140 736 HD2 LYS 92 HD2 LYS 92 -8.209 7.633 -12.400 737 HD3 LYS 92 HD1 LYS 92 -6.677 7.585 -13.273 738 HE2 LYS 92 HE2 LYS 92 -6.402 5.227 -12.619 739 HE3 LYS 92 HE1 LYS 92 -7.945 5.286 -11.778 740 HZ1 LYS 92 HZ1 LYS 92 -7.648 5.806 -14.678 741 HZ2 LYS 92 HZ2 LYS 92 -9.089 5.598 -13.821 742 HZ3 LYS 92 HZ3 LYS 92 -8.034 4.293 -14.032 743 H SER 93 HN SER 93 -4.529 8.672 -9.214 744 HA SER 93 HA SER 93 -5.552 11.084 -7.874 745 HB2 SER 93 HB2 SER 93 -2.737 11.223 -8.456 746 HB3 SER 93 HB1 SER 93 -3.536 11.252 -6.884 747 HG SER 93 HG SER 93 -3.180 9.165 -6.636 748 H GLU 94 HN GLU 94 -4.207 13.054 -8.957 749 HA GLU 94 HA GLU 94 -4.997 12.970 -11.758 750 HB2 GLU 94 HB2 GLU 94 -5.157 14.920 -9.754 751 HB3 GLU 94 HB1 GLU 94 -3.913 15.500 -10.852 752 HG2 GLU 94 HG2 GLU 94 -6.220 16.289 -11.365 753 HG3 GLU 94 HG1 GLU 94 -5.397 15.475 -12.696 754 H LYS 95 HN LYS 95 -2.643 11.597 -10.771 755 HA LYS 95 HA LYS 95 -0.773 12.403 -12.766 756 HB2 LYS 95 HB2 LYS 95 -0.346 13.924 -10.723 757 HB3 LYS 95 HB1 LYS 95 0.287 12.480 -9.948 758 HG2 LYS 95 HG2 LYS 95 1.980 12.264 -11.669 759 HG3 LYS 95 HG1 LYS 95 1.312 13.648 -12.529 760 HD2 LYS 95 HD2 LYS 95 1.727 14.962 -10.369 761 HD3 LYS 95 HD1 LYS 95 2.737 13.600 -9.892 762 HE2 LYS 95 HE2 LYS 95 4.164 15.230 -10.872 763 HE3 LYS 95 HE1 LYS 95 4.012 13.899 -12.020 764 HZ1 LYS 95 HZ1 LYS 95 3.798 16.290 -12.878 765 HZ2 LYS 95 HZ2 LYS 95 2.249 16.257 -12.200 766 HZ3 LYS 95 HZ3 LYS 95 2.664 15.151 -13.406 767 H PHE 96 HN PHE 96 -1.598 10.418 -9.983 768 HA PHE 96 HA PHE 96 -0.067 8.205 -11.173 769 HB2 PHE 96 HB2 PHE 96 -0.561 8.490 -8.216 770 HB3 PHE 96 HB1 PHE 96 0.583 7.429 -9.032 771 HD1 PHE 96 HD2 PHE 96 2.636 8.360 -10.014 772 HD2 PHE 96 HD1 PHE 96 -0.017 10.728 -7.682 773 HE1 PHE 96 HE2 PHE 96 4.410 10.040 -9.711 774 HE2 PHE 96 HE1 PHE 96 1.744 12.418 -7.383 775 HZ PHE 96 HZ PHE 96 3.963 12.075 -8.396 776 H SER 97 HN SER 97 -0.864 6.083 -9.897 777 HA SER 97 HA SER 97 -3.713 6.046 -9.439 778 HB2 SER 97 HB2 SER 97 -3.410 3.975 -11.313 779 HB3 SER 97 HB1 SER 97 -4.318 5.470 -11.522 780 HG SER 97 HG SER 97 -2.122 4.691 -12.787 781 H HIS 98 HN HIS 98 -4.184 4.574 -7.955 782 HA HIS 98 HA HIS 98 -2.269 2.379 -7.483 783 HB2 HIS 98 HB2 HIS 98 -2.389 4.155 -5.683 784 HB3 HIS 98 HB1 HIS 98 -4.069 3.702 -5.435 785 HD2 HIS 98 HD2 HIS 98 -3.862 0.508 -5.196 786 HE1 HIS 98 HE1 HIS 98 -0.764 1.248 -2.418 787 HE2 HIS 98 HE2 HIS 98 -2.242 -0.527 -3.442 788 H GLU 99 HN GLU 99 -3.109 0.365 -7.752 789 HA GLU 99 HA GLU 99 -6.043 0.120 -7.573 790 HB2 GLU 99 HB2 GLU 99 -6.221 -1.011 -9.580 791 HB3 GLU 99 HB1 GLU 99 -4.967 0.171 -9.931 792 HG2 GLU 99 HG2 GLU 99 -3.255 -1.504 -9.631 793 HG3 GLU 99 HG1 GLU 99 -4.472 -2.695 -9.178 794 H GLN 100 HN GLN 100 -6.901 -1.638 -6.655 795 HA GLN 100 HA GLN 100 -5.134 -3.828 -5.806 796 HB2 GLN 100 HB2 GLN 100 -7.061 -2.318 -4.032 797 HB3 GLN 100 HB1 GLN 100 -6.289 -3.835 -3.592 798 HG2 GLN 100 HG2 GLN 100 -4.085 -2.627 -3.950 799 HG3 GLN 100 HG1 GLN 100 -5.030 -1.141 -3.983 800 HE21 GLN 100 HE21 GLN 100 -2.988 -2.210 -2.083 801 HE22 GLN 100 HE22 GLN 100 -3.770 -2.147 -0.536 802 H GLU 101 HN GLU 101 -5.992 -5.742 -6.361 803 HA GLU 101 HA GLU 101 -8.929 -5.924 -6.551 804 HB2 GLU 101 HB2 GLU 101 -8.150 -5.876 -8.811 805 HB3 GLU 101 HB1 GLU 101 -6.870 -7.031 -8.464 806 HG2 GLU 101 HG2 GLU 101 -8.470 -8.806 -8.179 807 HG3 GLU 101 HG1 GLU 101 -9.813 -7.673 -8.304 808 H VAL 102 HN VAL 102 -9.851 -7.559 -5.501 809 HA VAL 102 HA VAL 102 -8.081 -9.493 -4.200 810 HB VAL 102 HB VAL 102 -10.913 -8.633 -3.616 811 HG11 VAL 102 HG11 VAL 102 -9.379 -10.860 -2.274 812 HG12 VAL 102 HG12 VAL 102 -10.786 -11.059 -3.321 813 HG13 VAL 102 HG13 VAL 102 -10.948 -10.229 -1.773 814 HG21 VAL 102 HG21 VAL 102 -8.343 -8.487 -2.054 815 HG22 VAL 102 HG22 VAL 102 -9.929 -8.047 -1.419 816 HG23 VAL 102 HG23 VAL 102 -9.235 -7.141 -2.765 817 H LYS 103 HN LYS 103 -7.950 -11.479 -4.981 818 HA LYS 103 HA LYS 103 -10.120 -12.444 -6.716 819 HB2 LYS 103 HB2 LYS 103 -7.208 -13.242 -6.790 820 HB3 LYS 103 HB1 LYS 103 -8.467 -13.735 -7.910 821 HG2 LYS 103 HG2 LYS 103 -8.733 -11.398 -8.616 822 HG3 LYS 103 HG1 LYS 103 -7.408 -10.949 -7.541 823 HD2 LYS 103 HD2 LYS 103 -6.329 -11.176 -9.586 824 HD3 LYS 103 HD1 LYS 103 -6.073 -12.756 -8.844 825 HE2 LYS 103 HE2 LYS 103 -6.749 -13.316 -10.990 826 HE3 LYS 103 HE1 LYS 103 -8.252 -13.421 -10.080 827 HZ1 LYS 103 HZ1 LYS 103 -8.732 -12.232 -12.037 828 HZ2 LYS 103 HZ2 LYS 103 -7.369 -11.247 -11.882 829 HZ3 LYS 103 HZ3 LYS 103 -8.667 -11.058 -10.813 830 H GLY 104 HN GLY 104 -11.147 -13.192 -4.737 831 HA2 GLY 104 HA2 GLY 104 -11.841 -15.051 -3.566 832 HA3 GLY 104 HA1 GLY 104 -10.499 -15.945 -4.260 833 H ASN 105 HN ASN 105 -8.462 -15.895 -3.221 834 HA ASN 105 HA ASN 105 -8.567 -14.958 -0.425 835 HB2 ASN 105 HB2 ASN 105 -8.675 -17.525 -1.002 836 HB3 ASN 105 HB1 ASN 105 -6.942 -17.335 -1.225 837 HD21 ASN 105 HD21 ASN 105 -6.336 -18.559 0.489 838 HD22 ASN 105 HD22 ASN 105 -6.628 -18.111 2.135 839 H GLU 106 HN GLU 106 -7.447 -13.865 -2.994 840 HA GLU 106 HA GLU 106 -4.793 -13.235 -1.941 841 HB2 GLU 106 HB2 GLU 106 -5.400 -14.488 -4.588 842 HB3 GLU 106 HB1 GLU 106 -4.093 -13.311 -4.497 843 HG2 GLU 106 HG2 GLU 106 -2.878 -14.630 -2.967 844 HG3 GLU 106 HG1 GLU 106 -4.261 -15.682 -2.667 845 H MET 107 HN MET 107 -3.898 -11.258 -2.876 846 HA MET 107 HA MET 107 -5.888 -9.557 -4.207 847 HB2 MET 107 HB2 MET 107 -6.040 -9.019 -1.821 848 HB3 MET 107 HB1 MET 107 -4.302 -8.785 -1.749 849 HG2 MET 107 HG2 MET 107 -4.410 -6.830 -3.072 850 HG3 MET 107 HG1 MET 107 -6.088 -7.137 -3.511 851 HE1 MET 107 HE1 MET 107 -3.874 -5.468 -0.324 852 HE2 MET 107 HE2 MET 107 -3.890 -7.223 -0.503 853 HE3 MET 107 HE3 MET 107 -4.818 -6.459 0.793 854 H VAL 108 HN VAL 108 -5.042 -8.734 -5.963 855 HA VAL 108 HA VAL 108 -2.117 -8.479 -6.124 856 HB VAL 108 HB VAL 108 -2.461 -8.424 -8.605 857 HG11 VAL 108 HG11 VAL 108 -3.474 -10.863 -7.154 858 HG12 VAL 108 HG12 VAL 108 -1.791 -10.463 -7.473 859 HG13 VAL 108 HG13 VAL 108 -2.877 -10.837 -8.813 860 HG21 VAL 108 HG21 VAL 108 -5.282 -9.222 -7.902 861 HG22 VAL 108 HG22 VAL 108 -4.581 -9.225 -9.522 862 HG23 VAL 108 HG23 VAL 108 -4.792 -7.703 -8.651 863 H GLU 109 HN GLU 109 -1.266 -6.516 -6.106 864 HA GLU 109 HA GLU 109 -2.993 -4.268 -6.877 865 HB2 GLU 109 HB2 GLU 109 -2.786 -3.513 -4.804 866 HB3 GLU 109 HB1 GLU 109 -1.632 -4.767 -4.387 867 HG2 GLU 109 HG2 GLU 109 0.149 -3.330 -5.382 868 HG3 GLU 109 HG1 GLU 109 -1.059 -2.059 -5.565 869 H THR 110 HN THR 110 -2.132 -2.625 -8.039 870 HA THR 110 HA THR 110 0.666 -2.804 -8.880 871 HB THR 110 HB THR 110 -1.571 -2.382 -10.863 872 HG1 THR 110 HG1 THR 110 -1.620 -4.536 -10.071 873 HG21 THR 110 HG21 THR 110 0.569 -1.406 -11.495 874 HG22 THR 110 HG22 THR 110 0.199 -2.800 -12.510 875 HG23 THR 110 HG23 THR 110 1.369 -2.950 -11.200 876 H ILE 111 HN ILE 111 1.432 -0.930 -8.165 877 HA ILE 111 HA ILE 111 -0.246 1.486 -8.407 878 HB ILE 111 HB ILE 111 2.271 1.542 -6.809 879 HG12 ILE 111 HG12 ILE 111 -0.206 0.279 -5.652 880 HG13 ILE 111 HG11 ILE 111 1.116 -0.681 -6.317 881 HG21 ILE 111 HG21 ILE 111 0.800 3.498 -6.996 882 HG22 ILE 111 HG22 ILE 111 0.921 2.930 -5.331 883 HG23 ILE 111 HG23 ILE 111 -0.517 2.570 -6.284 884 HD11 ILE 111 HD11 ILE 111 1.372 -0.531 -3.941 885 HD12 ILE 111 HD12 ILE 111 1.238 1.226 -3.990 886 HD13 ILE 111 HD13 ILE 111 2.643 0.428 -4.701 887 H THR 112 HN THR 112 1.126 3.529 -8.749 888 HA THR 112 HA THR 112 3.646 3.172 -10.135 889 HB THR 112 HB THR 112 1.286 4.457 -11.529 890 HG1 THR 112 HG1 THR 112 2.046 1.937 -11.435 891 HG21 THR 112 HG21 THR 112 4.124 4.083 -12.511 892 HG22 THR 112 HG22 THR 112 3.449 5.608 -11.945 893 HG23 THR 112 HG23 THR 112 2.797 4.841 -13.394 894 H PHE 113 HN PHE 113 4.892 4.562 -9.079 895 HA PHE 113 HA PHE 113 4.017 7.340 -8.811 896 HB2 PHE 113 HB2 PHE 113 4.632 5.492 -6.562 897 HB3 PHE 113 HB1 PHE 113 5.223 7.140 -6.437 898 HD1 PHE 113 HD2 PHE 113 2.224 5.019 -6.606 899 HD2 PHE 113 HD1 PHE 113 3.728 8.960 -6.024 900 HE1 PHE 113 HE2 PHE 113 0.030 5.725 -5.747 901 HE2 PHE 113 HE1 PHE 113 1.537 9.666 -5.156 902 HZ PHE 113 HZ PHE 113 -0.311 8.047 -5.011 903 H GLY 114 HN GLY 114 5.719 8.817 -8.792 904 HA2 GLY 114 HA2 GLY 114 7.798 9.602 -9.330 905 HA3 GLY 114 HA1 GLY 114 8.420 8.215 -8.452 906 H GLY 115 HN GLY 115 6.368 7.722 -11.205 907 HA2 GLY 115 HA2 GLY 115 6.851 7.117 -13.387 908 HA3 GLY 115 HA1 GLY 115 8.538 7.496 -13.084 909 H VAL 116 HN VAL 116 7.215 5.401 -10.744 910 HA VAL 116 HA VAL 116 8.311 3.072 -12.176 911 HB VAL 116 HB VAL 116 8.416 3.551 -9.194 912 HG11 VAL 116 HG11 VAL 116 10.016 1.608 -9.292 913 HG12 VAL 116 HG12 VAL 116 9.469 1.340 -10.947 914 HG13 VAL 116 HG13 VAL 116 8.325 1.221 -9.609 915 HG21 VAL 116 HG21 VAL 116 9.915 5.087 -10.354 916 HG22 VAL 116 HG22 VAL 116 10.629 3.736 -11.237 917 HG23 VAL 116 HG23 VAL 116 10.832 3.851 -9.489 918 H THR 117 HN THR 117 6.903 1.492 -12.500 919 HA THR 117 HA THR 117 4.357 1.521 -11.073 920 HB THR 117 HB THR 117 5.251 -0.158 -13.433 921 HG1 THR 117 HG1 THR 117 3.495 2.092 -13.314 922 HG21 THR 117 HG21 THR 117 3.535 -1.369 -12.323 923 HG22 THR 117 HG22 THR 117 2.755 -0.541 -13.668 924 HG23 THR 117 HG23 THR 117 2.593 0.095 -12.033 925 H LEU 118 HN LEU 118 4.994 0.758 -9.059 926 HA LEU 118 HA LEU 118 6.476 -1.678 -8.800 927 HB2 LEU 118 HB2 LEU 118 6.707 0.070 -7.114 928 HB3 LEU 118 HB1 LEU 118 5.005 -0.064 -6.711 929 HG LEU 118 HG LEU 118 5.296 -2.201 -5.724 930 HD11 LEU 118 HD11 LEU 118 6.650 -3.482 -7.051 931 HD12 LEU 118 HD12 LEU 118 7.757 -3.129 -5.723 932 HD13 LEU 118 HD13 LEU 118 7.867 -2.219 -7.236 933 HD21 LEU 118 HD21 LEU 118 6.107 -0.224 -4.428 934 HD22 LEU 118 HD22 LEU 118 7.745 -0.655 -4.924 935 HD23 LEU 118 HD23 LEU 118 6.797 -1.770 -3.942 936 H ILE 119 HN ILE 119 5.753 -3.621 -8.843 937 HA ILE 119 HA ILE 119 2.852 -4.094 -8.609 938 HB ILE 119 HB ILE 119 4.893 -5.893 -9.931 939 HG12 ILE 119 HG12 ILE 119 3.279 -3.584 -10.957 940 HG13 ILE 119 HG11 ILE 119 4.932 -4.041 -11.335 941 HG21 ILE 119 HG21 ILE 119 1.879 -5.863 -10.102 942 HG22 ILE 119 HG22 ILE 119 2.822 -6.968 -9.106 943 HG23 ILE 119 HG23 ILE 119 2.968 -7.026 -10.861 944 HD11 ILE 119 HD11 ILE 119 3.600 -4.383 -13.269 945 HD12 ILE 119 HD12 ILE 119 2.412 -5.309 -12.352 946 HD13 ILE 119 HD13 ILE 119 4.025 -5.968 -12.619 947 H ARG 120 HN ARG 120 2.216 -4.954 -6.746 948 HA ARG 120 HA ARG 120 4.038 -6.831 -5.377 949 HB2 ARG 120 HB2 ARG 120 2.005 -5.035 -4.043 950 HB3 ARG 120 HB1 ARG 120 3.173 -6.080 -3.248 951 HG2 ARG 120 HG2 ARG 120 4.971 -4.687 -3.814 952 HG3 ARG 120 HG1 ARG 120 4.022 -3.817 -5.023 953 HD2 ARG 120 HD2 ARG 120 4.167 -2.367 -3.167 954 HD3 ARG 120 HD1 ARG 120 2.545 -3.053 -3.112 955 HE ARG 120 HE ARG 120 4.709 -4.146 -1.449 956 HH11 ARG 120 HH11 ARG 120 1.462 -2.834 -1.798 957 HH12 ARG 120 HH12 ARG 120 1.084 -3.034 -0.110 958 HH21 ARG 120 HH21 ARG 120 4.193 -4.398 0.761 959 HH22 ARG 120 HH22 ARG 120 2.631 -3.915 1.335 960 H ARG 121 HN ARG 121 3.125 -8.661 -4.446 961 HA ARG 121 HA ARG 121 0.323 -9.213 -5.193 962 HB2 ARG 121 HB2 ARG 121 2.494 -11.259 -4.727 963 HB3 ARG 121 HB1 ARG 121 0.882 -11.544 -5.371 964 HG2 ARG 121 HG2 ARG 121 2.923 -9.845 -6.768 965 HG3 ARG 121 HG1 ARG 121 2.779 -11.584 -7.027 966 HD2 ARG 121 HD2 ARG 121 1.470 -10.773 -8.728 967 HD3 ARG 121 HD1 ARG 121 0.267 -11.003 -7.462 968 HE ARG 121 HE ARG 121 0.987 -8.457 -7.062 969 HH11 ARG 121 HH11 ARG 121 0.118 -10.188 -9.978 970 HH12 ARG 121 HH12 ARG 121 -0.504 -8.780 -10.780 971 HH21 ARG 121 HH21 ARG 121 0.138 -6.603 -8.111 972 HH22 ARG 121 HH22 ARG 121 -0.506 -6.754 -9.719 973 H SER 122 HN SER 122 -0.967 -10.278 -3.618 974 HA SER 122 HA SER 122 0.271 -10.691 -1.009 975 HB2 SER 122 HB2 SER 122 -0.915 -8.363 -1.322 976 HB3 SER 122 HB1 SER 122 -2.375 -9.308 -1.070 977 HG SER 122 HG SER 122 -0.299 -9.753 0.696 978 H LYS 123 HN LYS 123 -0.549 -12.293 0.170 979 HA LYS 123 HA LYS 123 -2.817 -13.803 -0.963 980 HB2 LYS 123 HB2 LYS 123 -1.696 -15.763 0.256 981 HB3 LYS 123 HB1 LYS 123 -0.927 -15.187 -1.220 982 HG2 LYS 123 HG2 LYS 123 0.876 -14.335 -0.117 983 HG3 LYS 123 HG1 LYS 123 -0.032 -14.023 1.362 984 HD2 LYS 123 HD2 LYS 123 1.401 -15.802 1.905 985 HD3 LYS 123 HD1 LYS 123 -0.164 -16.558 1.611 986 HE2 LYS 123 HE2 LYS 123 0.526 -17.202 -0.618 987 HE3 LYS 123 HE1 LYS 123 2.062 -16.362 -0.409 988 HZ1 LYS 123 HZ1 LYS 123 1.138 -18.734 1.116 989 HZ2 LYS 123 HZ2 LYS 123 2.572 -17.895 1.416 990 HZ3 LYS 123 HZ3 LYS 123 2.360 -18.706 -0.052 991 H ARG 124 HN ARG 124 -4.487 -14.286 0.415 992 HA ARG 124 HA ARG 124 -4.549 -12.920 2.922 993 HB2 ARG 124 HB2 ARG 124 -6.479 -13.804 1.191 994 HB3 ARG 124 HB1 ARG 124 -6.594 -14.978 2.491 995 HG2 ARG 124 HG2 ARG 124 -6.827 -13.140 4.106 996 HG3 ARG 124 HG1 ARG 124 -6.797 -11.994 2.772 997 HD2 ARG 124 HD2 ARG 124 -9.066 -12.360 3.396 998 HD3 ARG 124 HD1 ARG 124 -8.790 -13.119 1.828 999 HE ARG 124 HE ARG 124 -8.546 -15.255 3.154 1000 HH11 ARG 124 HH11 ARG 124 -10.534 -12.583 4.264 1001 HH12 ARG 124 HH12 ARG 124 -11.585 -13.593 5.201 1002 HH21 ARG 124 HH21 ARG 124 -9.947 -16.582 4.381 1003 HH22 ARG 124 HH22 ARG 124 -11.262 -15.867 5.260 1004 H VAL 125 HN VAL 125 -4.659 -13.801 4.988 1005 HA VAL 125 HA VAL 125 -3.606 -16.546 5.218 1006 HB VAL 125 HB VAL 125 -3.048 -14.207 7.053 1007 HG11 VAL 125 HG11 VAL 125 -1.887 -16.986 7.118 1008 HG12 VAL 125 HG12 VAL 125 -3.186 -16.426 8.170 1009 HG13 VAL 125 HG13 VAL 125 -1.592 -15.681 8.268 1010 HG21 VAL 125 HG21 VAL 125 -1.816 -13.921 5.023 1011 HG22 VAL 125 HG22 VAL 125 -1.327 -15.616 5.017 1012 HG23 VAL 125 HG23 VAL 125 -0.694 -14.521 6.246 Start of MODEL 12 1 H1 ALA 1 HT1 ALA 1 -15.422 -9.952 1.063 2 H2 ALA 1 HT2 ALA 1 -14.089 -10.099 2.091 3 H3 ALA 1 HT3 ALA 1 -13.875 -10.154 0.415 4 HA ALA 1 HA ALA 1 -14.514 -7.885 0.180 5 HB1 ALA 1 HB1 ALA 1 -16.151 -7.908 2.035 6 HB2 ALA 1 HB2 ALA 1 -15.072 -6.516 2.084 7 HB3 ALA 1 HB3 ALA 1 -14.810 -7.872 3.179 8 H PHE 2 HN PHE 2 -13.182 -5.943 1.222 9 HA PHE 2 HA PHE 2 -10.445 -6.755 1.097 10 HB2 PHE 2 HB2 PHE 2 -11.913 -4.188 1.306 11 HB3 PHE 2 HB1 PHE 2 -10.251 -4.200 1.882 12 HD1 PHE 2 HD2 PHE 2 -12.239 -5.347 -1.055 13 HD2 PHE 2 HD1 PHE 2 -8.594 -3.685 0.381 14 HE1 PHE 2 HE2 PHE 2 -11.452 -5.080 -3.368 15 HE2 PHE 2 HE1 PHE 2 -7.813 -3.399 -1.929 16 HZ PHE 2 HZ PHE 2 -9.236 -4.111 -3.811 17 H SER 3 HN SER 3 -12.692 -6.049 3.658 18 HA SER 3 HA SER 3 -10.906 -5.570 5.760 19 HB2 SER 3 HB2 SER 3 -12.774 -6.439 7.211 20 HB3 SER 3 HB1 SER 3 -13.248 -5.168 6.089 21 HG SER 3 HG SER 3 -13.591 -7.956 5.657 22 H GLY 4 HN GLY 4 -9.191 -6.868 6.086 23 HA2 GLY 4 HA2 GLY 4 -9.455 -9.388 7.235 24 HA3 GLY 4 HA1 GLY 4 -9.141 -9.626 5.521 25 H THR 5 HN THR 5 -7.170 -10.611 6.002 26 HA THR 5 HA THR 5 -5.035 -8.706 6.626 27 HB THR 5 HB THR 5 -3.938 -10.796 7.769 28 HG1 THR 5 HG1 THR 5 -5.418 -12.388 7.667 29 HG21 THR 5 HG21 THR 5 -4.853 -10.040 9.941 30 HG22 THR 5 HG22 THR 5 -6.075 -9.114 9.071 31 HG23 THR 5 HG23 THR 5 -4.370 -8.701 8.900 32 H TRP 6 HN TRP 6 -3.697 -8.643 4.950 33 HA TRP 6 HA TRP 6 -3.324 -11.109 3.375 34 HB2 TRP 6 HB2 TRP 6 -2.929 -8.377 2.211 35 HB3 TRP 6 HB1 TRP 6 -3.275 -9.894 1.392 36 HD1 TRP 6 HD1 TRP 6 -5.063 -7.229 3.557 37 HE1 TRP 6 HE1 TRP 6 -7.563 -7.270 2.946 38 HE3 TRP 6 HE3 TRP 6 -5.059 -11.270 0.411 39 HZ2 TRP 6 HZ2 TRP 6 -9.308 -8.837 1.365 40 HZ3 TRP 6 HZ3 TRP 6 -7.190 -11.976 -0.593 41 HH2 TRP 6 HH2 TRP 6 -9.269 -10.786 -0.130 42 H GLN 7 HN GLN 7 -1.350 -11.867 3.167 43 HA GLN 7 HA GLN 7 0.909 -10.319 4.209 44 HB2 GLN 7 HB2 GLN 7 0.252 -12.919 4.581 45 HB3 GLN 7 HB1 GLN 7 1.295 -13.082 3.176 46 HG2 GLN 7 HG2 GLN 7 2.141 -11.608 5.650 47 HG3 GLN 7 HG1 GLN 7 2.360 -13.346 5.458 48 HE21 GLN 7 HE21 GLN 7 3.526 -10.231 4.664 49 HE22 GLN 7 HE22 GLN 7 4.856 -10.739 3.685 50 H VAL 8 HN VAL 8 2.131 -9.202 2.842 51 HA VAL 8 HA VAL 8 1.805 -9.542 -0.016 52 HB VAL 8 HB VAL 8 3.315 -7.503 1.608 53 HG11 VAL 8 HG11 VAL 8 2.870 -7.551 -1.376 54 HG12 VAL 8 HG12 VAL 8 4.412 -7.827 -0.565 55 HG13 VAL 8 HG13 VAL 8 3.627 -6.252 -0.453 56 HG21 VAL 8 HG21 VAL 8 0.859 -7.406 1.725 57 HG22 VAL 8 HG22 VAL 8 0.797 -7.274 -0.034 58 HG23 VAL 8 HG23 VAL 8 1.552 -5.995 0.923 59 H TYR 9 HN TYR 9 3.289 -10.128 -1.489 60 HA TYR 9 HA TYR 9 6.036 -10.686 -0.695 61 HB2 TYR 9 HB2 TYR 9 5.935 -12.929 -1.848 62 HB3 TYR 9 HB1 TYR 9 5.075 -12.852 -0.319 63 HD1 TYR 9 HD1 TYR 9 2.557 -12.701 -0.346 64 HD2 TYR 9 HD2 TYR 9 4.817 -13.499 -3.859 65 HE1 TYR 9 HE1 TYR 9 0.536 -13.559 -1.445 66 HE2 TYR 9 HE2 TYR 9 2.797 -14.361 -4.965 67 HH TYR 9 HH TYR 9 -0.280 -13.805 -3.857 68 H ALA 10 HN ALA 10 7.424 -10.078 -2.328 69 HA ALA 10 HA ALA 10 6.618 -10.115 -5.075 70 HB1 ALA 10 HB1 ALA 10 6.654 -7.707 -5.468 71 HB2 ALA 10 HB2 ALA 10 6.851 -7.427 -3.738 72 HB3 ALA 10 HB3 ALA 10 5.366 -8.160 -4.348 73 H GLN 11 HN GLN 11 8.237 -9.643 -6.517 74 HA GLN 11 HA GLN 11 10.896 -8.991 -5.462 75 HB2 GLN 11 HB2 GLN 11 10.161 -11.370 -7.175 76 HB3 GLN 11 HB1 GLN 11 11.801 -10.739 -7.104 77 HG2 GLN 11 HG2 GLN 11 11.967 -12.345 -5.524 78 HG3 GLN 11 HG1 GLN 11 11.393 -11.027 -4.505 79 HE21 GLN 11 HE21 GLN 11 10.469 -12.367 -3.012 80 HE22 GLN 11 HE22 GLN 11 9.046 -13.295 -3.326 81 H GLU 12 HN GLU 12 9.101 -7.297 -6.739 82 HA GLU 12 HA GLU 12 10.014 -7.073 -9.518 83 HB2 GLU 12 HB2 GLU 12 7.838 -5.558 -8.067 84 HB3 GLU 12 HB1 GLU 12 8.195 -5.457 -9.783 85 HG2 GLU 12 HG2 GLU 12 7.224 -7.898 -8.333 86 HG3 GLU 12 HG1 GLU 12 6.256 -6.842 -9.355 87 H ASN 13 HN ASN 13 9.512 -4.258 -9.686 88 HA ASN 13 HA ASN 13 12.039 -3.229 -8.878 89 HB2 ASN 13 HB2 ASN 13 9.809 -1.410 -9.717 90 HB3 ASN 13 HB1 ASN 13 11.524 -1.332 -10.108 91 HD21 ASN 13 HD21 ASN 13 8.445 -2.427 -11.084 92 HD22 ASN 13 HD22 ASN 13 8.942 -3.218 -12.539 93 H TYR 14 HN TYR 14 11.850 -3.663 -6.635 94 HA TYR 14 HA TYR 14 10.011 -2.016 -5.091 95 HB2 TYR 14 HB2 TYR 14 10.204 -4.424 -4.590 96 HB3 TYR 14 HB1 TYR 14 11.910 -4.213 -4.228 97 HD1 TYR 14 HD1 TYR 14 12.588 -2.924 -2.229 98 HD2 TYR 14 HD2 TYR 14 8.527 -3.911 -3.001 99 HE1 TYR 14 HE1 TYR 14 12.036 -2.481 0.120 100 HE2 TYR 14 HE2 TYR 14 7.959 -3.466 -0.651 101 HH TYR 14 HH TYR 14 9.639 -3.547 1.669 102 H GLU 15 HN GLU 15 13.465 -2.897 -4.871 103 HA GLU 15 HA GLU 15 14.159 -0.796 -3.166 104 HB2 GLU 15 HB2 GLU 15 16.521 -1.263 -3.966 105 HB3 GLU 15 HB1 GLU 15 15.648 -2.563 -3.173 106 HG2 GLU 15 HG2 GLU 15 15.610 -2.323 -6.132 107 HG3 GLU 15 HG1 GLU 15 16.987 -3.021 -5.300 108 H GLU 16 HN GLU 16 13.978 -0.921 -6.650 109 HA GLU 16 HA GLU 16 15.379 1.529 -7.102 110 HB2 GLU 16 HB2 GLU 16 15.188 -0.013 -8.937 111 HB3 GLU 16 HB1 GLU 16 13.439 -0.057 -8.803 112 HG2 GLU 16 HG2 GLU 16 14.152 1.249 -10.725 113 HG3 GLU 16 HG1 GLU 16 13.301 2.252 -9.549 114 H PHE 17 HN PHE 17 11.998 0.623 -6.695 115 HA PHE 17 HA PHE 17 10.884 3.166 -7.171 116 HB2 PHE 17 HB2 PHE 17 9.666 0.925 -7.081 117 HB3 PHE 17 HB1 PHE 17 9.776 1.031 -5.330 118 HD1 PHE 17 HD2 PHE 17 9.025 3.850 -4.811 119 HD2 PHE 17 HD1 PHE 17 7.516 1.095 -7.671 120 HE1 PHE 17 HE2 PHE 17 6.832 4.948 -4.722 121 HE2 PHE 17 HE1 PHE 17 5.328 2.187 -7.585 122 HZ PHE 17 HZ PHE 17 4.978 4.103 -6.105 123 H LEU 18 HN LEU 18 12.311 1.637 -4.332 124 HA LEU 18 HA LEU 18 11.478 3.412 -2.346 125 HB2 LEU 18 HB2 LEU 18 14.172 2.069 -2.569 126 HB3 LEU 18 HB1 LEU 18 13.478 2.745 -1.109 127 HG LEU 18 HG LEU 18 12.595 0.287 -2.603 128 HD11 LEU 18 HD11 LEU 18 12.956 -0.725 -0.334 129 HD12 LEU 18 HD12 LEU 18 13.729 0.789 0.132 130 HD13 LEU 18 HD13 LEU 18 14.410 -0.186 -1.168 131 HD21 LEU 18 HD21 LEU 18 11.205 1.787 -0.401 132 HD22 LEU 18 HD22 LEU 18 10.870 0.100 -0.790 133 HD23 LEU 18 HD23 LEU 18 10.575 1.356 -1.992 134 H LYS 19 HN LYS 19 14.113 3.619 -4.667 135 HA LYS 19 HA LYS 19 15.274 5.987 -3.581 136 HB2 LYS 19 HB2 LYS 19 15.590 5.338 -6.468 137 HB3 LYS 19 HB1 LYS 19 16.797 5.855 -5.298 138 HG2 LYS 19 HG2 LYS 19 15.798 3.257 -4.585 139 HG3 LYS 19 HG1 LYS 19 16.329 3.265 -6.268 140 HD2 LYS 19 HD2 LYS 19 18.494 4.066 -5.644 141 HD3 LYS 19 HD1 LYS 19 17.981 4.285 -3.970 142 HE2 LYS 19 HE2 LYS 19 17.577 1.825 -3.847 143 HE3 LYS 19 HE1 LYS 19 18.262 1.683 -5.462 144 HZ1 LYS 19 HZ1 LYS 19 20.358 2.373 -4.696 145 HZ2 LYS 19 HZ2 LYS 19 19.823 1.243 -3.560 146 HZ3 LYS 19 HZ3 LYS 19 19.752 2.900 -3.203 147 H ALA 20 HN ALA 20 12.519 5.376 -5.529 148 HA ALA 20 HA ALA 20 12.543 7.852 -6.930 149 HB1 ALA 20 HB1 ALA 20 11.235 5.514 -7.314 150 HB2 ALA 20 HB2 ALA 20 10.817 7.036 -8.098 151 HB3 ALA 20 HB3 ALA 20 9.953 6.526 -6.647 152 H LEU 21 HN LEU 21 11.289 6.775 -3.898 153 HA LEU 21 HA LEU 21 9.680 9.175 -3.552 154 HB2 LEU 21 HB2 LEU 21 10.258 7.074 -1.493 155 HB3 LEU 21 HB1 LEU 21 8.922 8.204 -1.524 156 HG LEU 21 HG LEU 21 8.762 6.678 -3.896 157 HD11 LEU 21 HD11 LEU 21 8.493 4.407 -2.853 158 HD12 LEU 21 HD12 LEU 21 9.341 5.037 -1.440 159 HD13 LEU 21 HD13 LEU 21 10.154 4.978 -3.002 160 HD21 LEU 21 HD21 LEU 21 7.129 6.418 -1.378 161 HD22 LEU 21 HD22 LEU 21 6.629 6.047 -3.029 162 HD23 LEU 21 HD23 LEU 21 6.944 7.715 -2.557 163 H ALA 22 HN ALA 22 12.782 8.787 -3.582 164 HA ALA 22 HA ALA 22 14.602 9.789 -2.678 165 HB1 ALA 22 HB1 ALA 22 13.009 11.788 -2.990 166 HB2 ALA 22 HB2 ALA 22 14.403 11.990 -1.928 167 HB3 ALA 22 HB3 ALA 22 12.803 11.707 -1.240 168 H LEU 23 HN LEU 23 13.781 7.551 -1.394 169 HA LEU 23 HA LEU 23 13.613 8.057 1.457 170 HB2 LEU 23 HB2 LEU 23 13.864 5.486 -0.098 171 HB3 LEU 23 HB1 LEU 23 13.607 5.582 1.636 172 HG LEU 23 HG LEU 23 11.713 6.464 -0.536 173 HD11 LEU 23 HD11 LEU 23 11.666 4.264 1.493 174 HD12 LEU 23 HD12 LEU 23 11.539 4.144 -0.262 175 HD13 LEU 23 HD13 LEU 23 10.213 4.841 0.677 176 HD21 LEU 23 HD21 LEU 23 11.615 6.905 2.430 177 HD22 LEU 23 HD22 LEU 23 10.170 6.922 1.418 178 HD23 LEU 23 HD23 LEU 23 11.455 8.097 1.140 179 HA PRO 24 HA PRO 24 17.870 7.819 2.497 180 HB2 PRO 24 HB2 PRO 24 17.420 5.998 4.733 181 HB3 PRO 24 HB1 PRO 24 17.811 7.726 4.768 182 HG2 PRO 24 HG2 PRO 24 15.418 6.762 5.534 183 HG3 PRO 24 HG1 PRO 24 15.626 8.367 4.804 184 HD2 PRO 24 HD2 PRO 24 14.676 5.830 3.533 185 HD3 PRO 24 HD1 PRO 24 14.073 7.485 3.335 186 H GLU 25 HN GLU 25 19.491 6.734 1.633 187 HA GLU 25 HA GLU 25 19.364 4.312 0.344 188 HB2 GLU 25 HB2 GLU 25 21.554 6.041 1.323 189 HB3 GLU 25 HB1 GLU 25 21.988 4.384 0.923 190 HG2 GLU 25 HG2 GLU 25 20.517 6.227 -0.952 191 HG3 GLU 25 HG1 GLU 25 22.270 6.037 -0.927 192 H ASP 26 HN ASP 26 20.123 4.886 3.736 193 HA ASP 26 HA ASP 26 21.155 2.311 4.276 194 HB2 ASP 26 HB2 ASP 26 21.567 4.203 5.775 195 HB3 ASP 26 HB1 ASP 26 19.852 4.300 6.151 196 H LEU 27 HN LEU 27 17.916 3.731 4.813 197 HA LEU 27 HA LEU 27 16.819 1.315 5.802 198 HB2 LEU 27 HB2 LEU 27 15.971 3.811 5.951 199 HB3 LEU 27 HB1 LEU 27 15.064 3.346 4.523 200 HG LEU 27 HG LEU 27 14.833 1.401 6.708 201 HD11 LEU 27 HD11 LEU 27 13.375 2.782 8.089 202 HD12 LEU 27 HD12 LEU 27 13.777 4.192 7.110 203 HD13 LEU 27 HD13 LEU 27 15.025 3.399 8.070 204 HD21 LEU 27 HD21 LEU 27 13.474 1.521 4.599 205 HD22 LEU 27 HD22 LEU 27 12.728 2.981 5.245 206 HD23 LEU 27 HD23 LEU 27 12.538 1.444 6.090 207 H ILE 28 HN ILE 28 17.307 2.540 2.592 208 HA ILE 28 HA ILE 28 15.414 0.943 1.236 209 HB ILE 28 HB ILE 28 18.078 2.008 0.280 210 HG12 ILE 28 HG12 ILE 28 15.273 3.072 -0.099 211 HG13 ILE 28 HG11 ILE 28 16.434 3.694 1.067 212 HG21 ILE 28 HG21 ILE 28 17.009 0.067 -1.038 213 HG22 ILE 28 HG22 ILE 28 17.506 1.510 -1.916 214 HG23 ILE 28 HG23 ILE 28 15.804 1.264 -1.523 215 HD11 ILE 28 HD11 ILE 28 17.934 4.034 -1.031 216 HD12 ILE 28 HD12 ILE 28 16.653 5.182 -0.651 217 HD13 ILE 28 HD13 ILE 28 16.398 3.959 -1.898 218 H LYS 29 HN LYS 29 18.401 0.177 2.801 219 HA LYS 29 HA LYS 29 18.783 -2.313 1.339 220 HB2 LYS 29 HB2 LYS 29 20.268 -0.975 3.597 221 HB3 LYS 29 HB1 LYS 29 20.619 -2.625 3.110 222 HG2 LYS 29 HG2 LYS 29 21.195 -1.869 0.877 223 HG3 LYS 29 HG1 LYS 29 20.797 -0.211 1.326 224 HD2 LYS 29 HD2 LYS 29 22.560 -0.209 2.991 225 HD3 LYS 29 HD1 LYS 29 22.934 -1.896 2.619 226 HE2 LYS 29 HE2 LYS 29 23.478 -1.196 0.296 227 HE3 LYS 29 HE1 LYS 29 23.235 0.479 0.785 228 HZ1 LYS 29 HZ1 LYS 29 25.582 -0.188 0.822 229 HZ2 LYS 29 HZ2 LYS 29 25.236 -1.358 1.993 230 HZ3 LYS 29 HZ3 LYS 29 25.032 0.282 2.351 231 H MET 30 HN MET 30 17.228 -1.150 4.178 232 HA MET 30 HA MET 30 16.960 -3.819 5.279 233 HB2 MET 30 HB2 MET 30 15.942 -1.131 6.207 234 HB3 MET 30 HB1 MET 30 15.665 -2.645 7.064 235 HG2 MET 30 HG2 MET 30 17.544 -2.256 8.138 236 HG3 MET 30 HG1 MET 30 18.396 -2.604 6.641 237 HE1 MET 30 HE1 MET 30 17.266 0.440 9.100 238 HE2 MET 30 HE2 MET 30 16.091 0.205 7.810 239 HE3 MET 30 HE3 MET 30 17.110 1.646 7.820 240 H ALA 31 HN ALA 31 15.044 -1.319 3.728 241 HA ALA 31 HA ALA 31 12.500 -2.446 3.994 242 HB1 ALA 31 HB1 ALA 31 12.712 -0.180 3.291 243 HB2 ALA 31 HB2 ALA 31 11.938 -1.068 1.978 244 HB3 ALA 31 HB3 ALA 31 13.649 -0.653 1.872 245 H ARG 32 HN ARG 32 15.063 -3.109 1.703 246 HA ARG 32 HA ARG 32 13.579 -4.547 -0.188 247 HB2 ARG 32 HB2 ARG 32 15.762 -5.607 -0.783 248 HB3 ARG 32 HB1 ARG 32 15.803 -3.849 -0.730 249 HG2 ARG 32 HG2 ARG 32 17.416 -3.868 0.773 250 HG3 ARG 32 HG1 ARG 32 16.494 -4.933 1.832 251 HD2 ARG 32 HD2 ARG 32 17.938 -6.008 -0.563 252 HD3 ARG 32 HD1 ARG 32 18.789 -5.722 0.953 253 HE ARG 32 HE ARG 32 17.313 -7.327 2.003 254 HH11 ARG 32 HH11 ARG 32 17.329 -7.325 -1.501 255 HH12 ARG 32 HH12 ARG 32 16.677 -8.927 -1.633 256 HH21 ARG 32 HH21 ARG 32 16.418 -9.431 1.837 257 HH22 ARG 32 HH22 ARG 32 16.170 -10.120 0.258 258 H ASP 33 HN ASP 33 14.314 -5.321 3.017 259 HA ASP 33 HA ASP 33 13.677 -8.158 2.554 260 HB2 ASP 33 HB2 ASP 33 15.915 -7.227 3.755 261 HB3 ASP 33 HB1 ASP 33 14.857 -7.376 5.152 262 H ILE 34 HN ILE 34 12.552 -5.245 3.874 263 HA ILE 34 HA ILE 34 11.012 -6.266 6.049 264 HB ILE 34 HB ILE 34 10.635 -3.704 4.476 265 HG12 ILE 34 HG12 ILE 34 12.083 -4.205 7.084 266 HG13 ILE 34 HG11 ILE 34 12.853 -3.889 5.534 267 HG21 ILE 34 HG21 ILE 34 8.622 -4.191 5.671 268 HG22 ILE 34 HG22 ILE 34 9.478 -2.914 6.534 269 HG23 ILE 34 HG23 ILE 34 9.522 -4.569 7.140 270 HD11 ILE 34 HD11 ILE 34 11.193 -2.020 7.187 271 HD12 ILE 34 HD12 ILE 34 11.655 -1.680 5.522 272 HD13 ILE 34 HD13 ILE 34 12.897 -1.875 6.760 273 H LYS 35 HN LYS 35 9.678 -7.912 5.506 274 HA LYS 35 HA LYS 35 7.581 -7.368 3.500 275 HB2 LYS 35 HB2 LYS 35 8.726 -10.096 4.111 276 HB3 LYS 35 HB1 LYS 35 7.597 -9.679 2.835 277 HG2 LYS 35 HG2 LYS 35 9.283 -8.482 1.639 278 HG3 LYS 35 HG1 LYS 35 10.419 -8.654 2.978 279 HD2 LYS 35 HD2 LYS 35 9.246 -10.953 1.427 280 HD3 LYS 35 HD1 LYS 35 10.826 -10.241 1.102 281 HE2 LYS 35 HE2 LYS 35 9.971 -11.532 3.699 282 HE3 LYS 35 HE1 LYS 35 10.984 -12.279 2.470 283 HZ1 LYS 35 HZ1 LYS 35 11.667 -9.827 4.007 284 HZ2 LYS 35 HZ2 LYS 35 12.644 -10.569 2.837 285 HZ3 LYS 35 HZ3 LYS 35 12.293 -11.375 4.281 286 HA PRO 36 HA PRO 36 5.598 -8.503 7.509 287 HB2 PRO 36 HB2 PRO 36 4.245 -6.026 7.689 288 HB3 PRO 36 HB1 PRO 36 5.698 -6.503 8.583 289 HG2 PRO 36 HG2 PRO 36 5.536 -4.488 6.667 290 HG3 PRO 36 HG1 PRO 36 7.020 -5.209 7.314 291 HD2 PRO 36 HD2 PRO 36 5.614 -5.780 4.757 292 HD3 PRO 36 HD1 PRO 36 7.354 -5.788 5.122 293 H ILE 37 HN ILE 37 3.122 -7.947 8.075 294 HA ILE 37 HA ILE 37 1.602 -8.718 5.684 295 HB ILE 37 HB ILE 37 1.627 -10.311 7.607 296 HG12 ILE 37 HG12 ILE 37 -0.375 -9.772 5.919 297 HG13 ILE 37 HG11 ILE 37 -0.484 -11.026 7.143 298 HG21 ILE 37 HG21 ILE 37 0.448 -9.839 9.641 299 HG22 ILE 37 HG22 ILE 37 -0.022 -8.246 9.044 300 HG23 ILE 37 HG23 ILE 37 1.671 -8.594 9.389 301 HD11 ILE 37 HD11 ILE 37 -1.772 -9.619 8.564 302 HD12 ILE 37 HD12 ILE 37 -2.486 -9.557 6.952 303 HD13 ILE 37 HD13 ILE 37 -1.488 -8.221 7.530 304 H VAL 38 HN VAL 38 -0.281 -7.600 5.125 305 HA VAL 38 HA VAL 38 -0.489 -4.935 6.324 306 HB VAL 38 HB VAL 38 -1.678 -6.021 3.762 307 HG11 VAL 38 HG11 VAL 38 -1.679 -3.192 4.812 308 HG12 VAL 38 HG12 VAL 38 -3.074 -4.270 4.808 309 HG13 VAL 38 HG13 VAL 38 -2.361 -3.744 3.283 310 HG21 VAL 38 HG21 VAL 38 -0.052 -4.571 2.658 311 HG22 VAL 38 HG22 VAL 38 0.760 -5.741 3.698 312 HG23 VAL 38 HG23 VAL 38 0.576 -4.067 4.226 313 H GLU 39 HN GLU 39 -1.822 -4.854 7.984 314 HA GLU 39 HA GLU 39 -4.195 -6.538 8.065 315 HB2 GLU 39 HB2 GLU 39 -2.618 -4.974 10.028 316 HB3 GLU 39 HB1 GLU 39 -4.345 -5.099 10.333 317 HG2 GLU 39 HG2 GLU 39 -4.259 -7.315 10.755 318 HG3 GLU 39 HG1 GLU 39 -2.931 -7.587 9.632 319 H ILE 40 HN ILE 40 -6.085 -5.837 7.364 320 HA ILE 40 HA ILE 40 -6.638 -2.955 7.442 321 HB ILE 40 HB ILE 40 -5.933 -3.463 5.161 322 HG12 ILE 40 HG12 ILE 40 -7.930 -1.899 5.719 323 HG13 ILE 40 HG11 ILE 40 -7.608 -2.324 4.044 324 HG21 ILE 40 HG21 ILE 40 -8.069 -5.563 5.217 325 HG22 ILE 40 HG22 ILE 40 -6.340 -5.767 4.920 326 HG23 ILE 40 HG23 ILE 40 -7.354 -4.952 3.726 327 HD11 ILE 40 HD11 ILE 40 -9.397 -4.001 4.153 328 HD12 ILE 40 HD12 ILE 40 -9.975 -2.371 4.498 329 HD13 ILE 40 HD13 ILE 40 -9.726 -3.515 5.816 330 H GLN 41 HN GLN 41 -8.456 -2.544 8.446 331 HA GLN 41 HA GLN 41 -10.567 -4.591 8.467 332 HB2 GLN 41 HB2 GLN 41 -11.143 -3.643 10.770 333 HB3 GLN 41 HB1 GLN 41 -9.715 -4.659 10.656 334 HG2 GLN 41 HG2 GLN 41 -9.185 -1.803 10.292 335 HG3 GLN 41 HG1 GLN 41 -9.820 -2.234 11.878 336 HE21 GLN 41 HE21 GLN 41 -7.905 -1.774 12.921 337 HE22 GLN 41 HE22 GLN 41 -6.495 -2.768 12.773 338 H GLN 42 HN GLN 42 -12.692 -3.832 8.330 339 HA GLN 42 HA GLN 42 -12.934 -0.953 7.810 340 HB2 GLN 42 HB2 GLN 42 -14.000 -1.219 5.800 341 HB3 GLN 42 HB1 GLN 42 -12.911 -2.599 5.751 342 HG2 GLN 42 HG2 GLN 42 -14.789 -3.992 6.638 343 HG3 GLN 42 HG1 GLN 42 -15.838 -2.597 6.428 344 HE21 GLN 42 HE21 GLN 42 -16.555 -2.056 4.440 345 HE22 GLN 42 HE22 GLN 42 -16.248 -2.989 3.021 346 H LYS 43 HN LYS 43 -15.219 -0.261 7.728 347 HA LYS 43 HA LYS 43 -17.082 -1.753 9.392 348 HB2 LYS 43 HB2 LYS 43 -15.438 0.185 10.547 349 HB3 LYS 43 HB1 LYS 43 -16.947 1.034 10.247 350 HG2 LYS 43 HG2 LYS 43 -17.012 0.140 12.459 351 HG3 LYS 43 HG1 LYS 43 -18.134 -0.794 11.464 352 HD2 LYS 43 HD2 LYS 43 -16.518 -2.570 11.244 353 HD3 LYS 43 HD1 LYS 43 -15.307 -1.623 12.109 354 HE2 LYS 43 HE2 LYS 43 -16.521 -1.766 14.138 355 HE3 LYS 43 HE1 LYS 43 -17.945 -2.405 13.321 356 HZ1 LYS 43 HZ1 LYS 43 -16.573 -4.375 12.732 357 HZ2 LYS 43 HZ2 LYS 43 -16.855 -4.195 14.392 358 HZ3 LYS 43 HZ3 LYS 43 -15.356 -3.772 13.737 359 H GLY 44 HN GLY 44 -18.067 -1.833 7.289 360 HA2 GLY 44 HA2 GLY 44 -19.872 -1.121 6.006 361 HA3 GLY 44 HA1 GLY 44 -19.817 0.428 6.844 362 H ASP 45 HN ASP 45 -18.741 2.115 5.957 363 HA ASP 45 HA ASP 45 -17.476 1.601 3.347 364 HB2 ASP 45 HB2 ASP 45 -18.795 4.097 4.414 365 HB3 ASP 45 HB1 ASP 45 -17.911 4.031 2.899 366 H ASP 46 HN ASP 46 -16.908 2.630 6.537 367 HA ASP 46 HA ASP 46 -14.517 4.159 5.905 368 HB2 ASP 46 HB2 ASP 46 -16.072 3.551 8.363 369 HB3 ASP 46 HB1 ASP 46 -14.348 3.840 8.571 370 H PHE 47 HN PHE 47 -12.496 3.444 5.931 371 HA PHE 47 HA PHE 47 -12.019 0.642 6.737 372 HB2 PHE 47 HB2 PHE 47 -10.962 2.215 4.397 373 HB3 PHE 47 HB1 PHE 47 -10.113 0.808 5.008 374 HD1 PHE 47 HD1 PHE 47 -13.773 1.341 4.564 375 HD2 PHE 47 HD2 PHE 47 -10.283 -0.754 3.346 376 HE1 PHE 47 HE1 PHE 47 -15.151 -0.121 3.141 377 HE2 PHE 47 HE2 PHE 47 -11.646 -2.218 1.922 378 HZ PHE 47 HZ PHE 47 -14.083 -1.900 1.813 379 H VAL 48 HN VAL 48 -10.010 0.170 7.637 380 HA VAL 48 HA VAL 48 -8.285 2.423 8.374 381 HB VAL 48 HB VAL 48 -9.238 0.299 10.308 382 HG11 VAL 48 HG11 VAL 48 -7.905 1.606 11.969 383 HG12 VAL 48 HG12 VAL 48 -7.232 2.528 10.623 384 HG13 VAL 48 HG13 VAL 48 -6.934 0.794 10.741 385 HG21 VAL 48 HG21 VAL 48 -9.660 3.280 10.468 386 HG22 VAL 48 HG22 VAL 48 -10.380 2.030 11.484 387 HG23 VAL 48 HG23 VAL 48 -10.848 2.167 9.790 388 H VAL 49 HN VAL 49 -6.527 1.910 7.250 389 HA VAL 49 HA VAL 49 -5.639 -0.879 7.119 390 HB VAL 49 HB VAL 49 -4.429 1.480 5.680 391 HG11 VAL 49 HG11 VAL 49 -3.009 -0.478 5.769 392 HG12 VAL 49 HG12 VAL 49 -3.621 -0.256 4.130 393 HG13 VAL 49 HG13 VAL 49 -4.327 -1.490 5.174 394 HG21 VAL 49 HG21 VAL 49 -6.614 -0.370 4.731 395 HG22 VAL 49 HG22 VAL 49 -5.782 0.824 3.739 396 HG23 VAL 49 HG23 VAL 49 -6.787 1.350 5.089 397 H THR 50 HN THR 50 -3.859 -1.610 8.104 398 HA THR 50 HA THR 50 -2.209 0.326 9.589 399 HB THR 50 HB THR 50 -2.883 -2.525 10.350 400 HG1 THR 50 HG1 THR 50 -4.373 -0.457 10.603 401 HG21 THR 50 HG21 THR 50 -1.371 -0.424 11.911 402 HG22 THR 50 HG22 THR 50 -0.629 -1.784 11.062 403 HG23 THR 50 HG23 THR 50 -1.714 -2.074 12.421 404 H SER 51 HN SER 51 -0.211 0.465 8.822 405 HA SER 51 HA SER 51 0.907 -1.815 7.340 406 HB2 SER 51 HB2 SER 51 2.101 0.939 7.356 407 HB3 SER 51 HB1 SER 51 2.177 -0.296 6.099 408 HG SER 51 HG SER 51 -0.270 0.105 6.114 409 H LYS 52 HN LYS 52 2.535 -2.945 8.218 410 HA LYS 52 HA LYS 52 3.604 -2.052 10.774 411 HB2 LYS 52 HB2 LYS 52 3.763 -4.700 9.337 412 HB3 LYS 52 HB1 LYS 52 4.531 -4.383 10.889 413 HG2 LYS 52 HG2 LYS 52 2.265 -3.800 11.786 414 HG3 LYS 52 HG1 LYS 52 1.592 -4.380 10.262 415 HD2 LYS 52 HD2 LYS 52 2.332 -6.592 10.656 416 HD3 LYS 52 HD1 LYS 52 3.382 -6.074 11.981 417 HE2 LYS 52 HE2 LYS 52 1.568 -5.680 13.412 418 HE3 LYS 52 HE1 LYS 52 0.409 -5.680 12.085 419 HZ1 LYS 52 HZ1 LYS 52 0.205 -7.883 12.156 420 HZ2 LYS 52 HZ2 LYS 52 0.863 -7.752 13.712 421 HZ3 LYS 52 HZ3 LYS 52 1.863 -8.149 12.411 422 H THR 53 HN THR 53 5.620 -1.398 11.130 423 HA THR 53 HA THR 53 7.668 -1.875 9.085 424 HB THR 53 HB THR 53 8.373 0.358 8.953 425 HG1 THR 53 HG1 THR 53 6.665 1.429 10.875 426 HG21 THR 53 HG21 THR 53 6.462 1.687 8.330 427 HG22 THR 53 HG22 THR 53 5.387 0.646 9.264 428 HG23 THR 53 HG23 THR 53 6.192 0.019 7.825 429 HA PRO 54 HA PRO 54 10.347 -2.934 12.448 430 HB2 PRO 54 HB2 PRO 54 12.379 -1.129 11.221 431 HB3 PRO 54 HB1 PRO 54 12.493 -2.856 11.620 432 HG2 PRO 54 HG2 PRO 54 12.248 -2.078 9.116 433 HG3 PRO 54 HG1 PRO 54 11.392 -3.514 9.715 434 HD2 PRO 54 HD2 PRO 54 10.324 -0.783 9.167 435 HD3 PRO 54 HD1 PRO 54 9.582 -2.367 8.868 436 H ARG 55 HN ARG 55 9.668 0.391 11.765 437 HA ARG 55 HA ARG 55 10.873 1.227 14.298 438 HB2 ARG 55 HB2 ARG 55 9.957 2.749 11.876 439 HB3 ARG 55 HB1 ARG 55 10.219 3.564 13.413 440 HG2 ARG 55 HG2 ARG 55 12.510 2.039 13.037 441 HG3 ARG 55 HG1 ARG 55 12.140 2.684 11.439 442 HD2 ARG 55 HD2 ARG 55 12.322 4.334 13.957 443 HD3 ARG 55 HD1 ARG 55 13.626 4.137 12.790 444 HE ARG 55 HE ARG 55 11.055 5.203 11.876 445 HH11 ARG 55 HH11 ARG 55 14.455 5.677 12.551 446 HH12 ARG 55 HH12 ARG 55 14.540 7.181 11.691 447 HH21 ARG 55 HH21 ARG 55 11.163 7.177 10.748 448 HH22 ARG 55 HH22 ARG 55 12.663 8.053 10.692 449 H GLN 56 HN GLN 56 7.834 1.895 12.515 450 HA GLN 56 HA GLN 56 6.317 1.401 14.926 451 HB2 GLN 56 HB2 GLN 56 7.020 3.699 15.304 452 HB3 GLN 56 HB1 GLN 56 6.442 4.160 13.712 453 HG2 GLN 56 HG2 GLN 56 4.142 3.540 14.441 454 HG3 GLN 56 HG1 GLN 56 4.783 3.298 16.067 455 HE21 GLN 56 HE21 GLN 56 3.379 4.939 16.807 456 HE22 GLN 56 HE22 GLN 56 3.756 6.611 16.556 457 H THR 57 HN THR 57 4.198 0.962 14.547 458 HA THR 57 HA THR 57 3.424 0.396 11.849 459 HB THR 57 HB THR 57 1.187 0.208 13.570 460 HG1 THR 57 HG1 THR 57 1.976 -0.239 15.485 461 HG21 THR 57 HG21 THR 57 3.158 -1.929 12.777 462 HG22 THR 57 HG22 THR 57 1.806 -1.370 11.793 463 HG23 THR 57 HG23 THR 57 1.508 -2.187 13.329 464 H VAL 58 HN VAL 58 2.415 1.776 10.512 465 HA VAL 58 HA VAL 58 1.292 4.235 11.638 466 HB VAL 58 HB VAL 58 1.336 5.119 9.330 467 HG11 VAL 58 HG11 VAL 58 3.930 4.951 9.103 468 HG12 VAL 58 HG12 VAL 58 3.819 4.119 10.654 469 HG13 VAL 58 HG13 VAL 58 3.211 5.766 10.491 470 HG21 VAL 58 HG21 VAL 58 1.173 2.750 8.338 471 HG22 VAL 58 HG22 VAL 58 2.927 2.724 8.504 472 HG23 VAL 58 HG23 VAL 58 2.154 3.949 7.498 473 H THR 59 HN THR 59 -0.728 5.021 10.942 474 HA THR 59 HA THR 59 -2.557 2.920 9.992 475 HB THR 59 HB THR 59 -3.594 5.096 11.737 476 HG1 THR 59 HG1 THR 59 -1.997 4.557 13.098 477 HG21 THR 59 HG21 THR 59 -4.143 2.134 11.504 478 HG22 THR 59 HG22 THR 59 -5.117 3.431 10.812 479 HG23 THR 59 HG23 THR 59 -5.007 3.248 12.560 480 H ASN 60 HN ASN 60 -3.903 3.402 8.407 481 HA ASN 60 HA ASN 60 -4.215 6.212 7.505 482 HB2 ASN 60 HB2 ASN 60 -3.609 3.728 5.885 483 HB3 ASN 60 HB1 ASN 60 -4.347 5.155 5.162 484 HD21 ASN 60 HD21 ASN 60 -1.477 3.826 6.609 485 HD22 ASN 60 HD22 ASN 60 -0.405 5.086 6.118 486 H SER 61 HN SER 61 -6.382 6.722 7.421 487 HA SER 61 HA SER 61 -8.288 4.477 7.170 488 HB2 SER 61 HB2 SER 61 -8.847 6.890 8.902 489 HB3 SER 61 HB1 SER 61 -9.680 5.335 8.877 490 HG SER 61 HG SER 61 -7.155 4.827 9.388 491 H PHE 62 HN PHE 62 -10.207 4.890 6.024 492 HA PHE 62 HA PHE 62 -10.676 7.531 4.941 493 HB2 PHE 62 HB2 PHE 62 -10.628 6.642 2.565 494 HB3 PHE 62 HB1 PHE 62 -9.065 6.886 3.330 495 HD1 PHE 62 HD2 PHE 62 -11.471 4.398 2.129 496 HD2 PHE 62 HD1 PHE 62 -7.631 5.035 3.840 497 HE1 PHE 62 HE2 PHE 62 -10.852 2.079 1.589 498 HE2 PHE 62 HE1 PHE 62 -7.000 2.721 3.304 499 HZ PHE 62 HZ PHE 62 -8.611 1.241 2.174 500 H THR 63 HN THR 63 -12.550 7.452 3.361 501 HA THR 63 HA THR 63 -14.473 5.379 4.167 502 HB THR 63 HB THR 63 -15.276 8.196 3.482 503 HG1 THR 63 HG1 THR 63 -14.547 7.160 6.052 504 HG21 THR 63 HG21 THR 63 -17.210 7.587 4.951 505 HG22 THR 63 HG22 THR 63 -16.558 5.950 5.038 506 HG23 THR 63 HG23 THR 63 -17.077 6.611 3.487 507 H LEU 64 HN LEU 64 -15.349 4.287 2.512 508 HA LEU 64 HA LEU 64 -14.475 4.555 -0.120 509 HB2 LEU 64 HB2 LEU 64 -17.034 3.293 0.871 510 HB3 LEU 64 HB1 LEU 64 -16.327 3.043 -0.713 511 HG LEU 64 HG LEU 64 -15.175 2.187 1.934 512 HD11 LEU 64 HD11 LEU 64 -16.944 0.742 1.212 513 HD12 LEU 64 HD12 LEU 64 -15.409 -0.070 0.909 514 HD13 LEU 64 HD13 LEU 64 -16.292 0.677 -0.425 515 HD21 LEU 64 HD21 LEU 64 -13.399 1.145 0.580 516 HD22 LEU 64 HD22 LEU 64 -13.371 2.906 0.505 517 HD23 LEU 64 HD23 LEU 64 -14.028 1.976 -0.842 518 H GLY 65 HN GLY 65 -14.906 5.970 -1.638 519 HA2 GLY 65 HA2 GLY 65 -16.361 7.091 -3.123 520 HA3 GLY 65 HA1 GLY 65 -17.622 7.032 -1.905 521 H LYS 66 HN LYS 66 -15.091 7.997 -0.167 522 HA LYS 66 HA LYS 66 -15.476 10.835 -0.845 523 HB2 LYS 66 HB2 LYS 66 -15.652 9.454 1.808 524 HB3 LYS 66 HB1 LYS 66 -15.092 11.120 1.737 525 HG2 LYS 66 HG2 LYS 66 -17.316 11.456 2.074 526 HG3 LYS 66 HG1 LYS 66 -17.268 11.459 0.314 527 HD2 LYS 66 HD2 LYS 66 -18.980 10.000 0.577 528 HD3 LYS 66 HD1 LYS 66 -17.655 8.843 0.718 529 HE2 LYS 66 HE2 LYS 66 -19.208 8.444 2.501 530 HE3 LYS 66 HE1 LYS 66 -17.744 9.142 3.191 531 HZ1 LYS 66 HZ1 LYS 66 -20.291 10.563 2.636 532 HZ2 LYS 66 HZ2 LYS 66 -18.878 11.309 3.193 533 HZ3 LYS 66 HZ3 LYS 66 -19.668 10.166 4.156 534 H GLU 67 HN GLU 67 -13.756 12.248 -0.100 535 HA GLU 67 HA GLU 67 -11.158 11.059 -0.531 536 HB2 GLU 67 HB2 GLU 67 -11.784 13.197 -1.592 537 HB3 GLU 67 HB1 GLU 67 -11.962 13.923 -0.004 538 HG2 GLU 67 HG2 GLU 67 -9.456 13.044 0.216 539 HG3 GLU 67 HG1 GLU 67 -9.525 13.275 -1.529 540 H ALA 68 HN ALA 68 -9.643 10.699 1.038 541 HA ALA 68 HA ALA 68 -10.320 11.644 3.741 542 HB1 ALA 68 HB1 ALA 68 -10.791 9.222 3.382 543 HB2 ALA 68 HB2 ALA 68 -9.651 9.573 4.679 544 HB3 ALA 68 HB3 ALA 68 -9.063 8.988 3.124 545 H ASP 69 HN ASP 69 -8.625 12.160 5.103 546 HA ASP 69 HA ASP 69 -6.142 12.822 3.728 547 HB2 ASP 69 HB2 ASP 69 -7.613 13.897 6.006 548 HB3 ASP 69 HB1 ASP 69 -5.896 13.707 6.336 549 H ILE 70 HN ILE 70 -4.864 11.096 3.619 550 HA ILE 70 HA ILE 70 -4.401 9.570 6.082 551 HB ILE 70 HB ILE 70 -3.501 7.782 4.553 552 HG12 ILE 70 HG12 ILE 70 -4.777 8.025 2.235 553 HG13 ILE 70 HG11 ILE 70 -4.448 9.731 2.524 554 HG21 ILE 70 HG21 ILE 70 -5.787 7.012 3.855 555 HG22 ILE 70 HG22 ILE 70 -6.397 8.563 4.431 556 HG23 ILE 70 HG23 ILE 70 -5.619 7.450 5.555 557 HD11 ILE 70 HD11 ILE 70 -2.455 7.488 2.282 558 HD12 ILE 70 HD12 ILE 70 -2.044 9.118 2.812 559 HD13 ILE 70 HD13 ILE 70 -2.679 8.855 1.189 560 H THR 71 HN THR 71 -2.109 8.693 6.290 561 HA THR 71 HA THR 71 -0.228 10.638 5.112 562 HB THR 71 HB THR 71 -0.050 9.772 7.986 563 HG1 THR 71 HG1 THR 71 -1.814 11.424 6.967 564 HG21 THR 71 HG21 THR 71 1.542 11.603 8.182 565 HG22 THR 71 HG22 THR 71 1.287 12.034 6.491 566 HG23 THR 71 HG23 THR 71 2.051 10.500 6.903 567 H THR 72 HN THR 72 1.467 9.744 4.179 568 HA THR 72 HA THR 72 1.952 6.923 4.370 569 HB THR 72 HB THR 72 2.277 8.126 2.241 570 HG1 THR 72 HG1 THR 72 4.216 7.113 1.710 571 HG21 THR 72 HG21 THR 72 3.127 10.243 3.191 572 HG22 THR 72 HG22 THR 72 4.166 9.615 1.910 573 HG23 THR 72 HG23 THR 72 4.638 9.429 3.599 574 H MET 73 HN MET 73 3.995 5.983 4.975 575 HA MET 73 HA MET 73 4.923 6.923 7.488 576 HB2 MET 73 HB2 MET 73 6.499 5.020 7.378 577 HB3 MET 73 HB1 MET 73 4.838 4.558 7.038 578 HG2 MET 73 HG2 MET 73 5.408 4.723 4.594 579 HG3 MET 73 HG1 MET 73 7.094 4.875 5.084 580 HE1 MET 73 HE1 MET 73 4.445 1.184 5.832 581 HE2 MET 73 HE2 MET 73 3.884 2.809 5.426 582 HE3 MET 73 HE3 MET 73 4.504 2.462 7.042 583 H ASP 74 HN ASP 74 5.851 7.707 4.315 584 HA ASP 74 HA ASP 74 8.602 8.277 4.821 585 HB2 ASP 74 HB2 ASP 74 8.105 7.975 2.543 586 HB3 ASP 74 HB1 ASP 74 6.707 9.033 2.601 587 H GLY 75 HN GLY 75 5.634 9.924 5.407 588 HA2 GLY 75 HA2 GLY 75 5.596 11.652 7.079 589 HA3 GLY 75 HA1 GLY 75 7.166 12.184 6.507 590 H LYS 76 HN LYS 76 4.770 11.383 4.166 591 HA LYS 76 HA LYS 76 4.471 14.238 3.552 592 HB2 LYS 76 HB2 LYS 76 4.333 11.785 1.818 593 HB3 LYS 76 HB1 LYS 76 3.696 13.336 1.291 594 HG2 LYS 76 HG2 LYS 76 6.107 14.159 1.997 595 HG3 LYS 76 HG1 LYS 76 6.503 12.467 1.688 596 HD2 LYS 76 HD2 LYS 76 5.366 12.727 -0.540 597 HD3 LYS 76 HD1 LYS 76 5.287 14.459 -0.206 598 HE2 LYS 76 HE2 LYS 76 7.219 13.982 -1.569 599 HE3 LYS 76 HE1 LYS 76 7.742 14.497 0.034 600 HZ1 LYS 76 HZ1 LYS 76 7.680 11.722 -1.027 601 HZ2 LYS 76 HZ2 LYS 76 7.988 12.093 0.596 602 HZ3 LYS 76 HZ3 LYS 76 9.046 12.628 -0.613 603 H LYS 77 HN LYS 77 2.436 15.022 2.890 604 HA LYS 77 HA LYS 77 0.193 13.540 4.084 605 HB2 LYS 77 HB2 LYS 77 0.522 16.496 3.521 606 HB3 LYS 77 HB1 LYS 77 -0.936 15.761 4.162 607 HG2 LYS 77 HG2 LYS 77 1.737 15.617 5.524 608 HG3 LYS 77 HG1 LYS 77 0.531 16.859 5.862 609 HD2 LYS 77 HD2 LYS 77 -1.029 15.229 6.643 610 HD3 LYS 77 HD1 LYS 77 -0.016 13.900 6.079 611 HE2 LYS 77 HE2 LYS 77 0.231 14.085 8.451 612 HE3 LYS 77 HE1 LYS 77 1.725 14.624 7.696 613 HZ1 LYS 77 HZ1 LYS 77 0.985 16.069 9.525 614 HZ2 LYS 77 HZ2 LYS 77 -0.421 16.434 8.662 615 HZ3 LYS 77 HZ3 LYS 77 1.086 16.899 8.055 616 H LEU 78 HN LEU 78 -1.123 12.569 2.697 617 HA LEU 78 HA LEU 78 -1.606 13.866 0.109 618 HB2 LEU 78 HB2 LEU 78 -1.397 10.889 0.214 619 HB3 LEU 78 HB1 LEU 78 -1.218 11.969 -1.156 620 HG LEU 78 HG LEU 78 0.924 12.717 0.317 621 HD11 LEU 78 HD11 LEU 78 0.479 9.786 0.868 622 HD12 LEU 78 HD12 LEU 78 0.584 11.087 2.054 623 HD13 LEU 78 HD13 LEU 78 2.003 10.634 1.115 624 HD21 LEU 78 HD21 LEU 78 0.851 10.396 -1.612 625 HD22 LEU 78 HD22 LEU 78 2.249 11.405 -1.231 626 HD23 LEU 78 HD23 LEU 78 0.864 12.099 -2.068 627 H LYS 79 HN LYS 79 -3.637 13.621 -0.701 628 HA LYS 79 HA LYS 79 -5.552 12.328 1.112 629 HB2 LYS 79 HB2 LYS 79 -6.115 14.458 -0.962 630 HB3 LYS 79 HB1 LYS 79 -7.233 13.830 0.243 631 HG2 LYS 79 HG2 LYS 79 -5.757 14.751 2.019 632 HG3 LYS 79 HG1 LYS 79 -4.770 15.490 0.757 633 HD2 LYS 79 HD2 LYS 79 -7.721 16.000 1.037 634 HD3 LYS 79 HD1 LYS 79 -6.498 16.980 1.847 635 HE2 LYS 79 HE2 LYS 79 -5.736 17.894 -0.116 636 HE3 LYS 79 HE1 LYS 79 -6.260 16.518 -1.087 637 HZ1 LYS 79 HZ1 LYS 79 -8.536 17.220 -0.865 638 HZ2 LYS 79 HZ2 LYS 79 -7.616 18.519 -1.452 639 HZ3 LYS 79 HZ3 LYS 79 -8.095 18.490 0.168 640 H CYS 80 HN CYS 80 -6.254 10.436 0.414 641 HA CYS 80 HA CYS 80 -6.310 9.968 -2.490 642 HB2 CYS 80 HB2 CYS 80 -4.975 8.495 -0.726 643 HB3 CYS 80 HB1 CYS 80 -6.539 7.703 -0.567 644 H THR 81 HN THR 81 -8.174 9.641 -3.492 645 HA THR 81 HA THR 81 -10.625 9.557 -1.894 646 HB THR 81 HB THR 81 -10.559 9.780 -4.894 647 HG1 THR 81 HG1 THR 81 -9.096 11.359 -3.835 648 HG21 THR 81 HG21 THR 81 -12.722 9.511 -3.747 649 HG22 THR 81 HG22 THR 81 -12.591 11.085 -4.535 650 HG23 THR 81 HG23 THR 81 -12.384 10.953 -2.788 651 H VAL 82 HN VAL 82 -10.480 7.394 -1.249 652 HA VAL 82 HA VAL 82 -10.272 5.293 -3.230 653 HB VAL 82 HB VAL 82 -11.103 4.587 -0.484 654 HG11 VAL 82 HG11 VAL 82 -9.576 2.792 -0.799 655 HG12 VAL 82 HG12 VAL 82 -8.807 3.598 -2.164 656 HG13 VAL 82 HG13 VAL 82 -10.457 2.993 -2.314 657 HG21 VAL 82 HG21 VAL 82 -8.454 5.890 -1.074 658 HG22 VAL 82 HG22 VAL 82 -8.762 4.898 0.351 659 HG23 VAL 82 HG23 VAL 82 -9.666 6.395 0.103 660 H HIS 83 HN HIS 83 -11.842 3.951 -3.899 661 HA HIS 83 HA HIS 83 -14.465 3.997 -2.701 662 HB2 HIS 83 HB2 HIS 83 -15.692 4.657 -4.680 663 HB3 HIS 83 HB1 HIS 83 -14.538 5.921 -4.288 664 HD1 HIS 83 HD1 HIS 83 -15.801 4.124 -7.084 665 HD2 HIS 83 HD2 HIS 83 -12.050 5.542 -5.978 666 HE1 HIS 83 HE1 HIS 83 -14.465 4.226 -9.206 667 HE2 HIS 83 HE2 HIS 83 -12.270 5.275 -8.545 668 H LEU 84 HN LEU 84 -15.701 2.200 -3.217 669 HA LEU 84 HA LEU 84 -14.133 -0.001 -4.310 670 HB2 LEU 84 HB2 LEU 84 -15.311 -0.256 -2.145 671 HB3 LEU 84 HB1 LEU 84 -16.837 -0.003 -2.973 672 HG LEU 84 HG LEU 84 -16.101 -2.059 -4.401 673 HD11 LEU 84 HD11 LEU 84 -13.842 -2.215 -3.531 674 HD12 LEU 84 HD12 LEU 84 -14.761 -3.662 -3.122 675 HD13 LEU 84 HD13 LEU 84 -14.466 -2.429 -1.894 676 HD21 LEU 84 HD21 LEU 84 -17.185 -3.550 -2.778 677 HD22 LEU 84 HD22 LEU 84 -18.047 -2.022 -2.963 678 HD23 LEU 84 HD23 LEU 84 -17.038 -2.296 -1.545 679 H ALA 85 HN ALA 85 -14.245 -0.246 -6.443 680 HA ALA 85 HA ALA 85 -16.875 0.072 -7.725 681 HB1 ALA 85 HB1 ALA 85 -14.219 0.537 -9.059 682 HB2 ALA 85 HB2 ALA 85 -15.179 1.819 -8.325 683 HB3 ALA 85 HB3 ALA 85 -15.825 0.908 -9.691 684 H ASN 86 HN ASN 86 -17.643 -1.871 -8.108 685 HA ASN 86 HA ASN 86 -17.895 -3.965 -8.939 686 HB2 ASN 86 HB2 ASN 86 -15.412 -3.184 -10.458 687 HB3 ASN 86 HB1 ASN 86 -16.167 -4.762 -10.644 688 HD21 ASN 86 HD21 ASN 86 -16.392 -1.388 -11.320 689 HD22 ASN 86 HD22 ASN 86 -17.765 -1.476 -12.364 690 H GLY 87 HN GLY 87 -16.624 -3.592 -6.423 691 HA2 GLY 87 HA2 GLY 87 -15.750 -5.022 -4.832 692 HA3 GLY 87 HA1 GLY 87 -15.517 -6.225 -6.093 693 H LYS 88 HN LYS 88 -14.171 -3.360 -7.077 694 HA LYS 88 HA LYS 88 -11.510 -4.168 -6.113 695 HB2 LYS 88 HB2 LYS 88 -12.043 -2.573 -8.619 696 HB3 LYS 88 HB1 LYS 88 -10.568 -3.413 -8.156 697 HG2 LYS 88 HG2 LYS 88 -13.173 -4.769 -8.848 698 HG3 LYS 88 HG1 LYS 88 -11.817 -4.559 -9.956 699 HD2 LYS 88 HD2 LYS 88 -10.472 -6.051 -8.799 700 HD3 LYS 88 HD1 LYS 88 -11.396 -5.886 -7.308 701 HE2 LYS 88 HE2 LYS 88 -11.799 -8.051 -8.308 702 HE3 LYS 88 HE1 LYS 88 -13.267 -7.076 -8.359 703 HZ1 LYS 88 HZ1 LYS 88 -12.900 -8.230 -10.447 704 HZ2 LYS 88 HZ2 LYS 88 -11.384 -7.492 -10.626 705 HZ3 LYS 88 HZ3 LYS 88 -12.798 -6.558 -10.674 706 H LEU 89 HN LEU 89 -10.487 -2.736 -4.878 707 HA LEU 89 HA LEU 89 -11.731 -0.192 -4.345 708 HB2 LEU 89 HB2 LEU 89 -10.518 -1.871 -2.717 709 HB3 LEU 89 HB1 LEU 89 -9.083 -0.996 -3.217 710 HG LEU 89 HG LEU 89 -9.885 1.038 -2.303 711 HD11 LEU 89 HD11 LEU 89 -12.165 1.059 -2.932 712 HD12 LEU 89 HD12 LEU 89 -12.138 1.092 -1.169 713 HD13 LEU 89 HD13 LEU 89 -12.498 -0.411 -2.016 714 HD21 LEU 89 HD21 LEU 89 -10.617 -1.141 -0.360 715 HD22 LEU 89 HD22 LEU 89 -10.133 0.511 0.029 716 HD23 LEU 89 HD23 LEU 89 -8.971 -0.601 -0.698 717 H VAL 90 HN VAL 90 -11.219 1.659 -5.296 718 HA VAL 90 HA VAL 90 -8.712 1.758 -6.838 719 HB VAL 90 HB VAL 90 -11.245 3.311 -7.389 720 HG11 VAL 90 HG11 VAL 90 -8.628 3.059 -8.835 721 HG12 VAL 90 HG12 VAL 90 -9.433 4.519 -8.262 722 HG13 VAL 90 HG13 VAL 90 -10.096 3.620 -9.627 723 HG21 VAL 90 HG21 VAL 90 -10.208 0.768 -8.629 724 HG22 VAL 90 HG22 VAL 90 -11.430 1.790 -9.387 725 HG23 VAL 90 HG23 VAL 90 -11.757 1.033 -7.828 726 H CYS 91 HN CYS 91 -7.258 3.203 -6.268 727 HA CYS 91 HA CYS 91 -8.115 5.639 -4.858 728 HB2 CYS 91 HB2 CYS 91 -6.572 3.622 -3.714 729 HB3 CYS 91 HB1 CYS 91 -5.383 4.804 -4.246 730 H LYS 92 HN LYS 92 -8.164 6.531 -6.986 731 HA LYS 92 HA LYS 92 -5.594 6.737 -8.361 732 HB2 LYS 92 HB2 LYS 92 -7.570 6.089 -9.673 733 HB3 LYS 92 HB1 LYS 92 -8.381 7.572 -9.198 734 HG2 LYS 92 HG2 LYS 92 -7.031 8.893 -10.545 735 HG3 LYS 92 HG1 LYS 92 -5.776 7.656 -10.664 736 HD2 LYS 92 HD2 LYS 92 -7.106 7.925 -12.750 737 HD3 LYS 92 HD1 LYS 92 -7.169 6.298 -12.079 738 HE2 LYS 92 HE2 LYS 92 -9.349 6.771 -11.103 739 HE3 LYS 92 HE1 LYS 92 -9.274 8.422 -11.711 740 HZ1 LYS 92 HZ1 LYS 92 -9.215 7.517 -13.970 741 HZ2 LYS 92 HZ2 LYS 92 -10.623 7.077 -13.149 742 HZ3 LYS 92 HZ3 LYS 92 -9.379 5.951 -13.350 743 H SER 93 HN SER 93 -4.527 8.605 -8.663 744 HA SER 93 HA SER 93 -5.462 10.926 -7.120 745 HB2 SER 93 HB2 SER 93 -2.647 10.724 -8.072 746 HB3 SER 93 HB1 SER 93 -3.271 11.315 -6.533 747 HG SER 93 HG SER 93 -3.860 8.909 -6.320 748 H GLU 94 HN GLU 94 -3.750 12.823 -8.292 749 HA GLU 94 HA GLU 94 -5.205 13.315 -10.730 750 HB2 GLU 94 HB2 GLU 94 -4.670 15.092 -9.037 751 HB3 GLU 94 HB1 GLU 94 -2.983 14.949 -9.505 752 HG2 GLU 94 HG2 GLU 94 -3.679 15.519 -11.843 753 HG3 GLU 94 HG1 GLU 94 -5.278 15.883 -11.199 754 H LYS 95 HN LYS 95 -1.904 12.547 -9.784 755 HA LYS 95 HA LYS 95 -1.185 12.361 -12.634 756 HB2 LYS 95 HB2 LYS 95 0.054 13.970 -11.066 757 HB3 LYS 95 HB1 LYS 95 0.774 12.528 -10.357 758 HG2 LYS 95 HG2 LYS 95 1.702 11.912 -12.524 759 HG3 LYS 95 HG1 LYS 95 0.963 13.340 -13.249 760 HD2 LYS 95 HD2 LYS 95 2.316 14.784 -11.838 761 HD3 LYS 95 HD1 LYS 95 3.011 13.374 -11.033 762 HE2 LYS 95 HE2 LYS 95 4.024 12.648 -13.119 763 HE3 LYS 95 HE1 LYS 95 3.269 13.990 -13.977 764 HZ1 LYS 95 HZ1 LYS 95 5.420 14.118 -11.950 765 HZ2 LYS 95 HZ2 LYS 95 4.538 15.475 -12.429 766 HZ3 LYS 95 HZ3 LYS 95 5.467 14.633 -13.559 767 H PHE 96 HN PHE 96 -1.694 10.506 -9.818 768 HA PHE 96 HA PHE 96 -0.345 8.210 -11.073 769 HB2 PHE 96 HB2 PHE 96 -0.474 8.509 -8.085 770 HB3 PHE 96 HB1 PHE 96 0.589 7.490 -9.047 771 HD1 PHE 96 HD1 PHE 96 2.505 8.489 -10.238 772 HD2 PHE 96 HD2 PHE 96 0.091 10.761 -7.575 773 HE1 PHE 96 HE1 PHE 96 4.261 10.200 -10.112 774 HE2 PHE 96 HE2 PHE 96 1.844 12.477 -7.445 775 HZ PHE 96 HZ PHE 96 3.934 12.197 -8.717 776 H SER 97 HN SER 97 -1.122 6.139 -9.794 777 HA SER 97 HA SER 97 -3.791 6.267 -8.781 778 HB2 SER 97 HB2 SER 97 -4.134 6.410 -11.271 779 HB3 SER 97 HB1 SER 97 -3.405 4.810 -11.402 780 HG SER 97 HG SER 97 -5.647 4.623 -11.288 781 H HIS 98 HN HIS 98 -4.167 4.642 -7.471 782 HA HIS 98 HA HIS 98 -2.202 2.466 -7.379 783 HB2 HIS 98 HB2 HIS 98 -2.500 3.848 -5.332 784 HB3 HIS 98 HB1 HIS 98 -4.200 3.395 -5.291 785 HD2 HIS 98 HD2 HIS 98 -4.049 0.210 -5.515 786 HE1 HIS 98 HE1 HIS 98 -1.239 0.434 -2.378 787 HE2 HIS 98 HE2 HIS 98 -2.899 -1.047 -3.549 788 H GLU 99 HN GLU 99 -2.813 0.469 -8.017 789 HA GLU 99 HA GLU 99 -5.686 0.020 -8.436 790 HB2 GLU 99 HB2 GLU 99 -4.589 -0.408 -10.466 791 HB3 GLU 99 HB1 GLU 99 -3.244 -1.207 -9.662 792 HG2 GLU 99 HG2 GLU 99 -4.642 -3.098 -9.110 793 HG3 GLU 99 HG1 GLU 99 -6.041 -2.307 -9.827 794 H GLN 100 HN GLN 100 -6.790 -1.210 -7.097 795 HA GLN 100 HA GLN 100 -5.368 -3.284 -5.557 796 HB2 GLN 100 HB2 GLN 100 -7.672 -1.532 -4.677 797 HB3 GLN 100 HB1 GLN 100 -7.109 -2.936 -3.784 798 HG2 GLN 100 HG2 GLN 100 -4.844 -1.773 -3.739 799 HG3 GLN 100 HG1 GLN 100 -5.713 -0.328 -4.251 800 HE21 GLN 100 HE21 GLN 100 -5.161 -2.596 -1.697 801 HE22 GLN 100 HE22 GLN 100 -5.941 -1.690 -0.449 802 H GLU 101 HN GLU 101 -5.916 -5.147 -6.540 803 HA GLU 101 HA GLU 101 -8.781 -5.605 -7.039 804 HB2 GLU 101 HB2 GLU 101 -7.823 -5.376 -9.196 805 HB3 GLU 101 HB1 GLU 101 -6.429 -6.359 -8.767 806 HG2 GLU 101 HG2 GLU 101 -7.547 -8.321 -9.047 807 HG3 GLU 101 HG1 GLU 101 -9.106 -7.626 -8.618 808 H VAL 102 HN VAL 102 -9.608 -7.307 -6.033 809 HA VAL 102 HA VAL 102 -7.734 -9.251 -4.872 810 HB VAL 102 HB VAL 102 -10.507 -8.497 -3.935 811 HG11 VAL 102 HG11 VAL 102 -10.110 -10.015 -2.064 812 HG12 VAL 102 HG12 VAL 102 -8.567 -10.495 -2.772 813 HG13 VAL 102 HG13 VAL 102 -10.075 -10.882 -3.601 814 HG21 VAL 102 HG21 VAL 102 -8.808 -6.834 -3.400 815 HG22 VAL 102 HG22 VAL 102 -7.803 -8.087 -2.670 816 HG23 VAL 102 HG23 VAL 102 -9.357 -7.669 -1.948 817 H LYS 103 HN LYS 103 -7.689 -11.134 -5.829 818 HA LYS 103 HA LYS 103 -10.102 -12.092 -7.210 819 HB2 LYS 103 HB2 LYS 103 -7.206 -12.747 -7.804 820 HB3 LYS 103 HB1 LYS 103 -8.605 -13.321 -8.698 821 HG2 LYS 103 HG2 LYS 103 -9.084 -11.139 -9.511 822 HG3 LYS 103 HG1 LYS 103 -7.901 -10.417 -8.419 823 HD2 LYS 103 HD2 LYS 103 -6.976 -10.517 -10.647 824 HD3 LYS 103 HD1 LYS 103 -6.112 -11.643 -9.602 825 HE2 LYS 103 HE2 LYS 103 -6.589 -12.623 -11.794 826 HE3 LYS 103 HE1 LYS 103 -7.392 -13.498 -10.495 827 HZ1 LYS 103 HZ1 LYS 103 -8.739 -11.414 -12.116 828 HZ2 LYS 103 HZ2 LYS 103 -9.454 -12.520 -11.055 829 HZ3 LYS 103 HZ3 LYS 103 -8.778 -13.061 -12.504 830 H GLY 104 HN GLY 104 -11.060 -13.448 -5.812 831 HA2 GLY 104 HA2 GLY 104 -11.380 -15.382 -4.601 832 HA3 GLY 104 HA1 GLY 104 -9.792 -15.912 -5.141 833 H ASN 105 HN ASN 105 -8.153 -15.893 -3.737 834 HA ASN 105 HA ASN 105 -8.549 -14.467 -1.184 835 HB2 ASN 105 HB2 ASN 105 -7.219 -16.268 -0.094 836 HB3 ASN 105 HB1 ASN 105 -8.730 -16.860 -0.775 837 HD21 ASN 105 HD21 ASN 105 -5.272 -16.891 -1.011 838 HD22 ASN 105 HD22 ASN 105 -5.153 -18.190 -2.149 839 H GLU 106 HN GLU 106 -7.121 -14.017 -3.864 840 HA GLU 106 HA GLU 106 -4.515 -13.281 -2.709 841 HB2 GLU 106 HB2 GLU 106 -5.209 -14.287 -5.456 842 HB3 GLU 106 HB1 GLU 106 -3.733 -13.392 -5.155 843 HG2 GLU 106 HG2 GLU 106 -2.844 -15.065 -3.804 844 HG3 GLU 106 HG1 GLU 106 -4.413 -15.823 -3.554 845 H MET 107 HN MET 107 -4.163 -11.186 -2.620 846 HA MET 107 HA MET 107 -5.810 -9.411 -4.280 847 HB2 MET 107 HB2 MET 107 -6.006 -8.939 -1.910 848 HB3 MET 107 HB1 MET 107 -4.257 -8.859 -1.740 849 HG2 MET 107 HG2 MET 107 -4.135 -6.827 -2.928 850 HG3 MET 107 HG1 MET 107 -5.792 -6.985 -3.512 851 HE1 MET 107 HE1 MET 107 -4.602 -5.983 0.835 852 HE2 MET 107 HE2 MET 107 -3.470 -5.945 -0.524 853 HE3 MET 107 HE3 MET 107 -4.145 -7.480 0.024 854 H VAL 108 HN VAL 108 -4.918 -8.368 -5.913 855 HA VAL 108 HA VAL 108 -1.974 -8.243 -6.041 856 HB VAL 108 HB VAL 108 -2.465 -8.112 -8.609 857 HG11 VAL 108 HG11 VAL 108 -2.532 -10.633 -6.972 858 HG12 VAL 108 HG12 VAL 108 -1.129 -9.844 -7.691 859 HG13 VAL 108 HG13 VAL 108 -2.334 -10.609 -8.724 860 HG21 VAL 108 HG21 VAL 108 -4.858 -9.677 -7.664 861 HG22 VAL 108 HG22 VAL 108 -4.361 -9.423 -9.337 862 HG23 VAL 108 HG23 VAL 108 -4.911 -8.061 -8.359 863 H GLU 109 HN GLU 109 -1.152 -6.273 -6.092 864 HA GLU 109 HA GLU 109 -2.891 -4.090 -7.019 865 HB2 GLU 109 HB2 GLU 109 -0.819 -4.046 -4.825 866 HB3 GLU 109 HB1 GLU 109 -1.542 -2.605 -5.529 867 HG2 GLU 109 HG2 GLU 109 -3.536 -2.928 -4.542 868 HG3 GLU 109 HG1 GLU 109 -3.366 -4.682 -4.478 869 H THR 110 HN THR 110 -1.949 -2.380 -8.068 870 HA THR 110 HA THR 110 0.803 -2.698 -9.020 871 HB THR 110 HB THR 110 -1.389 -1.932 -10.944 872 HG1 THR 110 HG1 THR 110 -1.979 -3.961 -10.948 873 HG21 THR 110 HG21 THR 110 1.434 -2.933 -11.289 874 HG22 THR 110 HG22 THR 110 0.855 -1.296 -11.591 875 HG23 THR 110 HG23 THR 110 0.310 -2.630 -12.612 876 H ILE 111 HN ILE 111 1.654 -0.922 -8.076 877 HA ILE 111 HA ILE 111 0.134 1.597 -8.296 878 HB ILE 111 HB ILE 111 2.442 1.368 -6.426 879 HG12 ILE 111 HG12 ILE 111 -0.278 0.318 -5.657 880 HG13 ILE 111 HG11 ILE 111 1.014 -0.745 -6.203 881 HG21 ILE 111 HG21 ILE 111 1.032 2.840 -5.070 882 HG22 ILE 111 HG22 ILE 111 -0.286 2.650 -6.230 883 HG23 ILE 111 HG23 ILE 111 1.204 3.462 -6.711 884 HD11 ILE 111 HD11 ILE 111 0.830 -0.631 -3.762 885 HD12 ILE 111 HD12 ILE 111 1.186 1.093 -3.833 886 HD13 ILE 111 HD13 ILE 111 2.399 -0.080 -4.350 887 H THR 112 HN THR 112 1.451 3.555 -8.696 888 HA THR 112 HA THR 112 4.123 3.114 -9.755 889 HB THR 112 HB THR 112 1.993 4.406 -11.467 890 HG1 THR 112 HG1 THR 112 2.749 1.793 -11.157 891 HG21 THR 112 HG21 THR 112 3.692 4.461 -13.180 892 HG22 THR 112 HG22 THR 112 4.837 3.630 -12.125 893 HG23 THR 112 HG23 THR 112 4.309 5.269 -11.737 894 H PHE 113 HN PHE 113 5.227 4.524 -8.560 895 HA PHE 113 HA PHE 113 4.473 7.354 -8.704 896 HB2 PHE 113 HB2 PHE 113 5.069 5.853 -6.141 897 HB3 PHE 113 HB1 PHE 113 5.300 7.581 -6.285 898 HD1 PHE 113 HD1 PHE 113 2.748 4.904 -6.385 899 HD2 PHE 113 HD2 PHE 113 3.517 9.082 -6.112 900 HE1 PHE 113 HE1 PHE 113 0.399 5.299 -5.769 901 HE2 PHE 113 HE2 PHE 113 1.166 9.482 -5.503 902 HZ PHE 113 HZ PHE 113 -0.392 7.586 -5.322 903 H GLY 114 HN GLY 114 6.300 8.736 -8.621 904 HA2 GLY 114 HA2 GLY 114 8.523 9.284 -8.864 905 HA3 GLY 114 HA1 GLY 114 8.910 7.762 -8.071 906 H GLY 115 HN GLY 115 6.897 7.397 -10.766 907 HA2 GLY 115 HA2 GLY 115 7.285 6.846 -12.978 908 HA3 GLY 115 HA1 GLY 115 8.985 7.226 -12.751 909 H VAL 116 HN VAL 116 7.782 5.084 -10.366 910 HA VAL 116 HA VAL 116 8.953 2.831 -11.848 911 HB VAL 116 HB VAL 116 8.815 2.878 -8.853 912 HG11 VAL 116 HG11 VAL 116 10.884 1.707 -10.698 913 HG12 VAL 116 HG12 VAL 116 9.451 0.836 -10.155 914 HG13 VAL 116 HG13 VAL 116 10.652 1.374 -8.982 915 HG21 VAL 116 HG21 VAL 116 10.726 4.413 -10.568 916 HG22 VAL 116 HG22 VAL 116 11.231 3.774 -9.005 917 HG23 VAL 116 HG23 VAL 116 9.887 4.913 -9.099 918 H THR 117 HN THR 117 7.815 0.927 -11.938 919 HA THR 117 HA THR 117 5.084 1.034 -10.861 920 HB THR 117 HB THR 117 6.090 -0.925 -12.923 921 HG1 THR 117 HG1 THR 117 6.260 1.469 -13.452 922 HG21 THR 117 HG21 THR 117 3.686 -0.960 -13.540 923 HG22 THR 117 HG22 THR 117 3.350 0.091 -12.166 924 HG23 THR 117 HG23 THR 117 3.990 -1.532 -11.902 925 H LEU 118 HN LEU 118 5.298 0.281 -8.816 926 HA LEU 118 HA LEU 118 6.739 -2.207 -8.350 927 HB2 LEU 118 HB2 LEU 118 7.068 -0.380 -6.782 928 HB3 LEU 118 HB1 LEU 118 5.359 -0.329 -6.436 929 HG LEU 118 HG LEU 118 5.451 -2.355 -5.239 930 HD11 LEU 118 HD11 LEU 118 7.371 -3.816 -5.123 931 HD12 LEU 118 HD12 LEU 118 8.282 -2.736 -6.180 932 HD13 LEU 118 HD13 LEU 118 6.885 -3.608 -6.805 933 HD21 LEU 118 HD21 LEU 118 6.328 -0.414 -4.053 934 HD22 LEU 118 HD22 LEU 118 7.956 -0.818 -4.606 935 HD23 LEU 118 HD23 LEU 118 7.099 -1.906 -3.517 936 H ILE 119 HN ILE 119 5.571 -3.892 -9.052 937 HA ILE 119 HA ILE 119 2.729 -4.066 -8.513 938 HB ILE 119 HB ILE 119 4.533 -6.179 -9.716 939 HG12 ILE 119 HG12 ILE 119 3.159 -3.792 -10.897 940 HG13 ILE 119 HG11 ILE 119 4.767 -4.418 -11.222 941 HG21 ILE 119 HG21 ILE 119 2.454 -7.080 -10.636 942 HG22 ILE 119 HG22 ILE 119 1.541 -5.809 -9.818 943 HG23 ILE 119 HG23 ILE 119 2.404 -7.023 -8.873 944 HD11 ILE 119 HD11 ILE 119 3.496 -4.797 -13.157 945 HD12 ILE 119 HD12 ILE 119 2.138 -5.445 -12.237 946 HD13 ILE 119 HD13 ILE 119 3.638 -6.365 -12.364 947 H ARG 120 HN ARG 120 1.802 -5.323 -6.946 948 HA ARG 120 HA ARG 120 3.604 -6.882 -5.229 949 HB2 ARG 120 HB2 ARG 120 1.562 -4.849 -4.333 950 HB3 ARG 120 HB1 ARG 120 2.265 -6.047 -3.264 951 HG2 ARG 120 HG2 ARG 120 4.430 -5.089 -3.470 952 HG3 ARG 120 HG1 ARG 120 3.894 -4.026 -4.774 953 HD2 ARG 120 HD2 ARG 120 4.105 -3.116 -2.331 954 HD3 ARG 120 HD1 ARG 120 2.751 -2.628 -3.349 955 HE ARG 120 HE ARG 120 2.620 -4.634 -1.191 956 HH11 ARG 120 HH11 ARG 120 1.070 -2.308 -3.283 957 HH12 ARG 120 HH12 ARG 120 -0.508 -2.527 -2.581 958 HH21 ARG 120 HH21 ARG 120 0.514 -4.931 -0.278 959 HH22 ARG 120 HH22 ARG 120 -0.827 -4.035 -0.927 960 H ARG 121 HN ARG 121 2.685 -8.608 -4.172 961 HA ARG 121 HA ARG 121 -0.096 -9.265 -4.816 962 HB2 ARG 121 HB2 ARG 121 2.335 -11.041 -4.958 963 HB3 ARG 121 HB1 ARG 121 0.704 -11.677 -4.870 964 HG2 ARG 121 HG2 ARG 121 0.203 -11.091 -7.007 965 HG3 ARG 121 HG1 ARG 121 1.254 -9.672 -6.979 966 HD2 ARG 121 HD2 ARG 121 1.949 -12.542 -7.456 967 HD3 ARG 121 HD1 ARG 121 2.382 -11.114 -8.403 968 HE ARG 121 HE ARG 121 3.624 -10.585 -6.120 969 HH11 ARG 121 HH11 ARG 121 3.527 -13.539 -8.024 970 HH12 ARG 121 HH12 ARG 121 5.063 -14.109 -7.454 971 HH21 ARG 121 HH21 ARG 121 5.635 -11.374 -5.345 972 HH22 ARG 121 HH22 ARG 121 6.268 -12.875 -5.939 973 H SER 122 HN SER 122 -1.226 -9.997 -3.159 974 HA SER 122 HA SER 122 0.187 -10.587 -0.665 975 HB2 SER 122 HB2 SER 122 -2.377 -9.142 -0.396 976 HB3 SER 122 HB1 SER 122 -0.869 -8.967 0.511 977 HG SER 122 HG SER 122 -1.743 -7.644 -1.756 978 H LYS 123 HN LYS 123 -0.439 -12.392 0.263 979 HA LYS 123 HA LYS 123 -2.820 -13.762 -0.765 980 HB2 LYS 123 HB2 LYS 123 -1.828 -15.735 0.484 981 HB3 LYS 123 HB1 LYS 123 -0.880 -15.140 -0.874 982 HG2 LYS 123 HG2 LYS 123 0.776 -14.294 0.472 983 HG3 LYS 123 HG1 LYS 123 -0.306 -14.083 1.849 984 HD2 LYS 123 HD2 LYS 123 1.263 -15.876 2.274 985 HD3 LYS 123 HD1 LYS 123 -0.371 -16.523 2.138 986 HE2 LYS 123 HE2 LYS 123 0.049 -17.274 -0.101 987 HE3 LYS 123 HE1 LYS 123 1.634 -16.496 -0.114 988 HZ1 LYS 123 HZ1 LYS 123 1.185 -19.071 0.521 989 HZ2 LYS 123 HZ2 LYS 123 1.229 -18.361 2.055 990 HZ3 LYS 123 HZ3 LYS 123 2.547 -18.193 1.003 991 H ARG 124 HN ARG 124 -4.515 -14.341 0.534 992 HA ARG 124 HA ARG 124 -4.889 -12.908 2.961 993 HB2 ARG 124 HB2 ARG 124 -6.582 -13.910 1.174 994 HB3 ARG 124 HB1 ARG 124 -6.594 -15.252 2.309 995 HG2 ARG 124 HG2 ARG 124 -7.385 -13.870 4.063 996 HG3 ARG 124 HG1 ARG 124 -7.129 -12.408 3.111 997 HD2 ARG 124 HD2 ARG 124 -9.489 -13.050 3.169 998 HD3 ARG 124 HD1 ARG 124 -8.832 -13.109 1.534 999 HE ARG 124 HE ARG 124 -8.738 -15.630 2.916 1000 HH11 ARG 124 HH11 ARG 124 -10.726 -13.529 0.934 1001 HH12 ARG 124 HH12 ARG 124 -11.682 -14.829 0.300 1002 HH21 ARG 124 HH21 ARG 124 -10.005 -17.332 2.099 1003 HH22 ARG 124 HH22 ARG 124 -11.271 -16.997 0.961 1004 H VAL 125 HN VAL 125 -4.997 -13.683 5.065 1005 HA VAL 125 HA VAL 125 -4.191 -16.422 5.595 1006 HB VAL 125 HB VAL 125 -2.018 -15.516 5.485 1007 HG11 VAL 125 HG11 VAL 125 -2.896 -13.215 7.226 1008 HG12 VAL 125 HG12 VAL 125 -2.693 -13.134 5.477 1009 HG13 VAL 125 HG13 VAL 125 -1.303 -13.456 6.512 1010 HG21 VAL 125 HG21 VAL 125 -2.364 -16.885 7.462 1011 HG22 VAL 125 HG22 VAL 125 -2.856 -15.462 8.380 1012 HG23 VAL 125 HG23 VAL 125 -1.200 -15.602 7.793 Start of MODEL 13 1 H1 ALA 1 HT1 ALA 1 -14.695 -9.919 1.520 2 H2 ALA 1 HT2 ALA 1 -14.302 -9.449 -0.054 3 H3 ALA 1 HT3 ALA 1 -15.878 -9.249 0.519 4 HA ALA 1 HA ALA 1 -14.823 -7.142 0.522 5 HB1 ALA 1 HB1 ALA 1 -14.735 -7.987 3.393 6 HB2 ALA 1 HB2 ALA 1 -16.260 -7.963 2.509 7 HB3 ALA 1 HB3 ALA 1 -15.324 -6.480 2.690 8 H PHE 2 HN PHE 2 -13.162 -5.773 1.639 9 HA PHE 2 HA PHE 2 -10.579 -7.017 1.260 10 HB2 PHE 2 HB2 PHE 2 -11.574 -4.235 1.647 11 HB3 PHE 2 HB1 PHE 2 -9.881 -4.577 1.972 12 HD1 PHE 2 HD1 PHE 2 -12.338 -5.552 -0.687 13 HD2 PHE 2 HD2 PHE 2 -8.496 -3.987 0.263 14 HE1 PHE 2 HE1 PHE 2 -11.828 -5.351 -3.091 15 HE2 PHE 2 HE2 PHE 2 -7.989 -3.773 -2.129 16 HZ PHE 2 HZ PHE 2 -9.650 -4.460 -3.808 17 H SER 3 HN SER 3 -12.616 -6.037 3.904 18 HA SER 3 HA SER 3 -10.859 -5.725 5.996 19 HB2 SER 3 HB2 SER 3 -13.573 -5.877 5.759 20 HB3 SER 3 HB1 SER 3 -13.223 -7.351 6.657 21 HG SER 3 HG SER 3 -12.374 -6.183 8.290 22 H GLY 4 HN GLY 4 -9.251 -6.951 6.607 23 HA2 GLY 4 HA2 GLY 4 -9.322 -9.427 7.701 24 HA3 GLY 4 HA1 GLY 4 -9.114 -9.755 5.984 25 H THR 5 HN THR 5 -7.063 -10.637 6.314 26 HA THR 5 HA THR 5 -4.980 -8.613 6.671 27 HB THR 5 HB THR 5 -3.675 -10.580 7.809 28 HG1 THR 5 HG1 THR 5 -5.174 -12.208 7.802 29 HG21 THR 5 HG21 THR 5 -4.112 -8.442 8.879 30 HG22 THR 5 HG22 THR 5 -4.385 -9.754 10.022 31 HG23 THR 5 HG23 THR 5 -5.756 -8.948 9.262 32 H TRP 6 HN TRP 6 -3.781 -8.601 4.899 33 HA TRP 6 HA TRP 6 -3.486 -11.133 3.417 34 HB2 TRP 6 HB2 TRP 6 -3.171 -8.418 2.166 35 HB3 TRP 6 HB1 TRP 6 -3.471 -9.960 1.378 36 HD1 TRP 6 HD1 TRP 6 -5.298 -7.324 3.521 37 HE1 TRP 6 HE1 TRP 6 -7.806 -7.429 2.954 38 HE3 TRP 6 HE3 TRP 6 -5.258 -11.415 0.442 39 HZ2 TRP 6 HZ2 TRP 6 -9.544 -9.051 1.419 40 HZ3 TRP 6 HZ3 TRP 6 -7.389 -12.181 -0.524 41 HH2 TRP 6 HH2 TRP 6 -9.486 -11.023 -0.045 42 H GLN 7 HN GLN 7 -1.511 -11.917 3.194 43 HA GLN 7 HA GLN 7 0.757 -10.296 4.075 44 HB2 GLN 7 HB2 GLN 7 0.161 -13.176 3.880 45 HB3 GLN 7 HB1 GLN 7 1.791 -12.746 3.383 46 HG2 GLN 7 HG2 GLN 7 0.591 -11.902 5.997 47 HG3 GLN 7 HG1 GLN 7 1.520 -13.383 5.790 48 HE21 GLN 7 HE21 GLN 7 2.988 -12.555 7.338 49 HE22 GLN 7 HE22 GLN 7 4.178 -11.382 6.883 50 H VAL 8 HN VAL 8 2.119 -9.391 2.683 51 HA VAL 8 HA VAL 8 1.661 -9.824 -0.157 52 HB VAL 8 HB VAL 8 3.438 -7.730 1.091 53 HG11 VAL 8 HG11 VAL 8 2.160 -8.012 -1.623 54 HG12 VAL 8 HG12 VAL 8 3.882 -8.055 -1.235 55 HG13 VAL 8 HG13 VAL 8 2.974 -6.554 -1.049 56 HG21 VAL 8 HG21 VAL 8 0.505 -7.590 0.407 57 HG22 VAL 8 HG22 VAL 8 1.519 -6.196 0.784 58 HG23 VAL 8 HG23 VAL 8 1.234 -7.432 2.007 59 H TYR 9 HN TYR 9 3.139 -10.408 -1.614 60 HA TYR 9 HA TYR 9 5.905 -10.932 -0.891 61 HB2 TYR 9 HB2 TYR 9 5.831 -13.258 -1.726 62 HB3 TYR 9 HB1 TYR 9 4.781 -13.061 -0.331 63 HD1 TYR 9 HD1 TYR 9 2.292 -12.963 -0.678 64 HD2 TYR 9 HD2 TYR 9 4.972 -13.951 -3.828 65 HE1 TYR 9 HE1 TYR 9 0.421 -13.906 -1.970 66 HE2 TYR 9 HE2 TYR 9 3.114 -14.884 -5.125 67 HH TYR 9 HH TYR 9 -0.042 -14.311 -4.538 68 H ALA 10 HN ALA 10 7.260 -10.767 -2.751 69 HA ALA 10 HA ALA 10 6.305 -10.932 -5.405 70 HB1 ALA 10 HB1 ALA 10 6.051 -8.712 -6.084 71 HB2 ALA 10 HB2 ALA 10 6.795 -8.078 -4.617 72 HB3 ALA 10 HB3 ALA 10 5.184 -8.795 -4.552 73 H GLN 11 HN GLN 11 7.851 -9.536 -6.900 74 HA GLN 11 HA GLN 11 10.549 -9.295 -5.898 75 HB2 GLN 11 HB2 GLN 11 11.444 -10.885 -7.632 76 HB3 GLN 11 HB1 GLN 11 10.584 -11.647 -6.302 77 HG2 GLN 11 HG2 GLN 11 8.603 -11.879 -7.722 78 HG3 GLN 11 HG1 GLN 11 9.472 -11.111 -9.046 79 HE21 GLN 11 HE21 GLN 11 9.063 -13.987 -7.181 80 HE22 GLN 11 HE22 GLN 11 10.024 -15.019 -8.181 81 H GLU 12 HN GLU 12 8.876 -7.369 -6.886 82 HA GLU 12 HA GLU 12 9.718 -6.880 -9.660 83 HB2 GLU 12 HB2 GLU 12 7.257 -6.574 -8.400 84 HB3 GLU 12 HB1 GLU 12 7.882 -4.934 -8.522 85 HG2 GLU 12 HG2 GLU 12 6.545 -5.431 -10.451 86 HG3 GLU 12 HG1 GLU 12 8.235 -5.280 -10.929 87 H ASN 13 HN ASN 13 9.276 -4.066 -9.515 88 HA ASN 13 HA ASN 13 11.846 -3.184 -8.631 89 HB2 ASN 13 HB2 ASN 13 9.667 -1.251 -9.305 90 HB3 ASN 13 HB1 ASN 13 11.385 -1.167 -9.681 91 HD21 ASN 13 HD21 ASN 13 8.279 -2.274 -10.678 92 HD22 ASN 13 HD22 ASN 13 8.750 -2.865 -12.235 93 H TYR 14 HN TYR 14 11.501 -3.892 -6.395 94 HA TYR 14 HA TYR 14 9.738 -2.276 -4.769 95 HB2 TYR 14 HB2 TYR 14 9.935 -4.669 -4.315 96 HB3 TYR 14 HB1 TYR 14 11.656 -4.481 -4.005 97 HD1 TYR 14 HD2 TYR 14 12.435 -3.376 -1.971 98 HD2 TYR 14 HD1 TYR 14 8.296 -4.025 -2.675 99 HE1 TYR 14 HE2 TYR 14 11.980 -2.958 0.399 100 HE2 TYR 14 HE1 TYR 14 7.818 -3.611 -0.295 101 HH TYR 14 HH TYR 14 9.409 -3.873 1.961 102 H GLU 15 HN GLU 15 13.217 -3.080 -4.525 103 HA GLU 15 HA GLU 15 13.753 -0.997 -2.719 104 HB2 GLU 15 HB2 GLU 15 16.119 -1.461 -3.136 105 HB3 GLU 15 HB1 GLU 15 15.197 -2.933 -2.871 106 HG2 GLU 15 HG2 GLU 15 15.113 -3.157 -5.402 107 HG3 GLU 15 HG1 GLU 15 16.330 -1.885 -5.448 108 H GLU 16 HN GLU 16 13.636 -1.083 -6.187 109 HA GLU 16 HA GLU 16 15.065 1.346 -6.620 110 HB2 GLU 16 HB2 GLU 16 14.793 -0.315 -8.420 111 HB3 GLU 16 HB1 GLU 16 13.054 -0.036 -8.412 112 HG2 GLU 16 HG2 GLU 16 13.240 2.031 -9.405 113 HG3 GLU 16 HG1 GLU 16 14.896 2.262 -8.850 114 H PHE 17 HN PHE 17 11.724 0.529 -5.979 115 HA PHE 17 HA PHE 17 10.649 3.075 -6.631 116 HB2 PHE 17 HB2 PHE 17 9.131 1.232 -6.632 117 HB3 PHE 17 HB1 PHE 17 9.588 0.762 -4.995 118 HD1 PHE 17 HD1 PHE 17 8.600 4.032 -6.489 119 HD2 PHE 17 HD2 PHE 17 7.747 0.991 -3.643 120 HE1 PHE 17 HE1 PHE 17 6.715 5.358 -5.640 121 HE2 PHE 17 HE2 PHE 17 5.855 2.314 -2.781 122 HZ PHE 17 HZ PHE 17 5.339 4.506 -3.781 123 H LEU 18 HN LEU 18 11.920 1.599 -3.699 124 HA LEU 18 HA LEU 18 11.097 3.542 -1.863 125 HB2 LEU 18 HB2 LEU 18 13.698 2.022 -1.743 126 HB3 LEU 18 HB1 LEU 18 12.814 2.716 -0.400 127 HG LEU 18 HG LEU 18 12.174 0.244 -1.977 128 HD11 LEU 18 HD11 LEU 18 12.067 -0.741 0.258 129 HD12 LEU 18 HD12 LEU 18 12.496 0.825 0.950 130 HD13 LEU 18 HD13 LEU 18 13.640 -0.024 -0.092 131 HD21 LEU 18 HD21 LEU 18 10.062 1.329 -1.900 132 HD22 LEU 18 HD22 LEU 18 10.313 1.847 -0.235 133 HD23 LEU 18 HD23 LEU 18 10.065 0.138 -0.600 134 H LYS 19 HN LYS 19 13.748 3.464 -4.124 135 HA LYS 19 HA LYS 19 15.161 5.701 -3.049 136 HB2 LYS 19 HB2 LYS 19 15.325 4.838 -5.924 137 HB3 LYS 19 HB1 LYS 19 16.584 5.530 -4.909 138 HG2 LYS 19 HG2 LYS 19 15.938 3.199 -3.606 139 HG3 LYS 19 HG1 LYS 19 15.813 2.762 -5.305 140 HD2 LYS 19 HD2 LYS 19 18.068 3.602 -5.694 141 HD3 LYS 19 HD1 LYS 19 18.193 4.070 -3.999 142 HE2 LYS 19 HE2 LYS 19 18.060 1.790 -3.290 143 HE3 LYS 19 HE1 LYS 19 17.695 1.252 -4.927 144 HZ1 LYS 19 HZ1 LYS 19 19.993 2.433 -5.387 145 HZ2 LYS 19 HZ2 LYS 19 19.904 0.826 -4.873 146 HZ3 LYS 19 HZ3 LYS 19 20.250 2.048 -3.753 147 H ALA 20 HN ALA 20 12.366 5.355 -5.002 148 HA ALA 20 HA ALA 20 12.562 8.033 -6.116 149 HB1 ALA 20 HB1 ALA 20 10.606 7.530 -7.373 150 HB2 ALA 20 HB2 ALA 20 10.238 6.139 -6.354 151 HB3 ALA 20 HB3 ALA 20 11.636 6.099 -7.428 152 H LEU 21 HN LEU 21 11.876 6.946 -3.185 153 HA LEU 21 HA LEU 21 9.688 8.864 -2.733 154 HB2 LEU 21 HB2 LEU 21 10.493 6.520 -1.010 155 HB3 LEU 21 HB1 LEU 21 9.116 7.575 -0.760 156 HG LEU 21 HG LEU 21 9.368 5.942 -3.267 157 HD11 LEU 21 HD11 LEU 21 7.798 4.990 -0.913 158 HD12 LEU 21 HD12 LEU 21 9.513 4.609 -1.037 159 HD13 LEU 21 HD13 LEU 21 8.403 4.085 -2.301 160 HD21 LEU 21 HD21 LEU 21 7.729 7.815 -3.104 161 HD22 LEU 21 HD22 LEU 21 6.954 6.952 -1.775 162 HD23 LEU 21 HD23 LEU 21 7.000 6.234 -3.385 163 H ALA 22 HN ALA 22 12.748 9.059 -2.785 164 HA ALA 22 HA ALA 22 14.413 10.181 -1.723 165 HB1 ALA 22 HB1 ALA 22 12.562 11.919 -1.758 166 HB2 ALA 22 HB2 ALA 22 13.852 12.160 -0.582 167 HB3 ALA 22 HB3 ALA 22 12.294 11.518 -0.061 168 H LEU 23 HN LEU 23 13.882 7.648 -0.725 169 HA LEU 23 HA LEU 23 14.047 7.889 2.185 170 HB2 LEU 23 HB2 LEU 23 13.766 5.479 0.391 171 HB3 LEU 23 HB1 LEU 23 13.874 5.405 2.141 172 HG LEU 23 HG LEU 23 11.700 6.907 0.687 173 HD11 LEU 23 HD11 LEU 23 10.245 5.005 1.285 174 HD12 LEU 23 HD12 LEU 23 11.683 4.101 1.769 175 HD13 LEU 23 HD13 LEU 23 11.478 4.600 0.091 176 HD21 LEU 23 HD21 LEU 23 12.124 7.641 2.968 177 HD22 LEU 23 HD22 LEU 23 11.956 5.982 3.541 178 HD23 LEU 23 HD23 LEU 23 10.570 6.819 2.841 179 HA PRO 24 HA PRO 24 18.392 7.251 2.315 180 HB2 PRO 24 HB2 PRO 24 18.281 5.513 4.624 181 HB3 PRO 24 HB1 PRO 24 18.737 7.221 4.545 182 HG2 PRO 24 HG2 PRO 24 16.488 6.318 5.769 183 HG3 PRO 24 HG1 PRO 24 16.670 7.947 5.093 184 HD2 PRO 24 HD2 PRO 24 15.260 5.581 3.959 185 HD3 PRO 24 HD1 PRO 24 14.824 7.298 3.896 186 H GLU 25 HN GLU 25 19.857 5.970 1.425 187 HA GLU 25 HA GLU 25 19.246 3.606 0.123 188 HB2 GLU 25 HB2 GLU 25 21.105 5.064 -0.478 189 HB3 GLU 25 HB1 GLU 25 21.919 4.680 1.029 190 HG2 GLU 25 HG2 GLU 25 23.021 3.258 -0.310 191 HG3 GLU 25 HG1 GLU 25 21.653 2.223 0.085 192 H ASP 26 HN ASP 26 20.804 4.104 3.269 193 HA ASP 26 HA ASP 26 21.479 1.387 3.685 194 HB2 ASP 26 HB2 ASP 26 21.966 1.984 5.956 195 HB3 ASP 26 HB1 ASP 26 22.502 3.303 4.927 196 H LEU 27 HN LEU 27 18.611 3.268 4.443 197 HA LEU 27 HA LEU 27 17.353 1.229 5.981 198 HB2 LEU 27 HB2 LEU 27 16.743 3.594 6.178 199 HB3 LEU 27 HB1 LEU 27 16.176 3.597 4.517 200 HG LEU 27 HG LEU 27 14.693 1.580 5.553 201 HD11 LEU 27 HD11 LEU 27 14.996 3.605 7.759 202 HD12 LEU 27 HD12 LEU 27 15.544 1.926 7.807 203 HD13 LEU 27 HD13 LEU 27 13.818 2.291 7.706 204 HD21 LEU 27 HD21 LEU 27 14.042 4.517 5.541 205 HD22 LEU 27 HD22 LEU 27 12.863 3.208 5.644 206 HD23 LEU 27 HD23 LEU 27 13.856 3.387 4.197 207 H ILE 28 HN ILE 28 17.318 2.183 2.606 208 HA ILE 28 HA ILE 28 15.270 0.506 1.666 209 HB ILE 28 HB ILE 28 17.708 1.619 0.264 210 HG12 ILE 28 HG12 ILE 28 14.825 2.501 0.111 211 HG13 ILE 28 HG11 ILE 28 15.974 3.186 1.253 212 HG21 ILE 28 HG21 ILE 28 15.242 0.490 -1.044 213 HG22 ILE 28 HG22 ILE 28 16.758 -0.393 -0.885 214 HG23 ILE 28 HG23 ILE 28 16.698 1.092 -1.833 215 HD11 ILE 28 HD11 ILE 28 17.313 4.044 -0.541 216 HD12 ILE 28 HD12 ILE 28 15.640 4.543 -0.773 217 HD13 ILE 28 HD13 ILE 28 16.308 3.227 -1.736 218 H LYS 29 HN LYS 29 18.633 -0.111 2.404 219 HA LYS 29 HA LYS 29 18.883 -2.580 1.030 220 HB2 LYS 29 HB2 LYS 29 20.385 -1.460 3.395 221 HB3 LYS 29 HB1 LYS 29 20.809 -2.968 2.602 222 HG2 LYS 29 HG2 LYS 29 21.142 -1.713 0.495 223 HG3 LYS 29 HG1 LYS 29 20.854 -0.221 1.389 224 HD2 LYS 29 HD2 LYS 29 22.722 -0.863 2.923 225 HD3 LYS 29 HD1 LYS 29 23.065 -2.211 1.844 226 HE2 LYS 29 HE2 LYS 29 23.624 -0.755 0.055 227 HE3 LYS 29 HE1 LYS 29 23.007 0.648 0.929 228 HZ1 LYS 29 HZ1 LYS 29 25.285 -0.980 1.894 229 HZ2 LYS 29 HZ2 LYS 29 24.791 0.538 2.449 230 HZ3 LYS 29 HZ3 LYS 29 25.478 0.385 0.913 231 H MET 30 HN MET 30 17.433 -1.712 4.068 232 HA MET 30 HA MET 30 17.500 -4.444 5.070 233 HB2 MET 30 HB2 MET 30 15.771 -2.284 6.229 234 HB3 MET 30 HB1 MET 30 16.544 -3.636 7.041 235 HG2 MET 30 HG2 MET 30 18.626 -2.584 7.047 236 HG3 MET 30 HG1 MET 30 18.130 -1.417 5.826 237 HE1 MET 30 HE1 MET 30 19.147 0.514 7.207 238 HE2 MET 30 HE2 MET 30 19.624 -0.507 8.561 239 HE3 MET 30 HE3 MET 30 18.675 0.949 8.848 240 H ALA 31 HN ALA 31 15.199 -2.152 3.783 241 HA ALA 31 HA ALA 31 12.822 -3.541 4.071 242 HB1 ALA 31 HB1 ALA 31 12.917 -1.226 3.480 243 HB2 ALA 31 HB2 ALA 31 12.022 -2.107 2.244 244 HB3 ALA 31 HB3 ALA 31 13.687 -1.612 1.943 245 H ARG 32 HN ARG 32 15.325 -4.005 1.664 246 HA ARG 32 HA ARG 32 13.821 -5.270 -0.315 247 HB2 ARG 32 HB2 ARG 32 15.869 -6.083 -1.211 248 HB3 ARG 32 HB1 ARG 32 16.190 -4.496 -0.534 249 HG2 ARG 32 HG2 ARG 32 17.117 -5.619 1.486 250 HG3 ARG 32 HG1 ARG 32 16.913 -7.164 0.657 251 HD2 ARG 32 HD2 ARG 32 18.418 -6.473 -1.097 252 HD3 ARG 32 HD1 ARG 32 18.533 -4.852 -0.409 253 HE ARG 32 HE ARG 32 19.380 -7.039 1.309 254 HH11 ARG 32 HH11 ARG 32 20.296 -4.522 -0.946 255 HH12 ARG 32 HH12 ARG 32 21.959 -4.493 -0.444 256 HH21 ARG 32 HH21 ARG 32 21.592 -7.006 1.977 257 HH22 ARG 32 HH22 ARG 32 22.694 -5.900 1.219 258 H ASP 33 HN ASP 33 14.591 -6.412 2.813 259 HA ASP 33 HA ASP 33 13.778 -9.139 2.025 260 HB2 ASP 33 HB2 ASP 33 16.193 -8.685 2.976 261 HB3 ASP 33 HB1 ASP 33 15.354 -8.629 4.521 262 H ILE 34 HN ILE 34 12.323 -6.626 3.043 263 HA ILE 34 HA ILE 34 11.032 -7.917 5.353 264 HB ILE 34 HB ILE 34 11.248 -4.954 4.814 265 HG12 ILE 34 HG12 ILE 34 12.903 -6.904 6.289 266 HG13 ILE 34 HG11 ILE 34 13.345 -5.351 5.600 267 HG21 ILE 34 HG21 ILE 34 10.087 -6.427 7.179 268 HG22 ILE 34 HG22 ILE 34 9.170 -5.543 5.960 269 HG23 ILE 34 HG23 ILE 34 10.262 -4.675 7.043 270 HD11 ILE 34 HD11 ILE 34 13.664 -5.062 7.862 271 HD12 ILE 34 HD12 ILE 34 12.208 -5.964 8.289 272 HD13 ILE 34 HD13 ILE 34 12.073 -4.348 7.591 273 H LYS 35 HN LYS 35 9.149 -8.704 4.897 274 HA LYS 35 HA LYS 35 7.368 -7.294 3.015 275 HB2 LYS 35 HB2 LYS 35 7.582 -10.268 3.534 276 HB3 LYS 35 HB1 LYS 35 6.411 -9.509 2.471 277 HG2 LYS 35 HG2 LYS 35 8.007 -8.982 0.868 278 HG3 LYS 35 HG1 LYS 35 9.344 -9.139 2.011 279 HD2 LYS 35 HD2 LYS 35 8.892 -11.578 2.131 280 HD3 LYS 35 HD1 LYS 35 7.647 -11.376 0.895 281 HE2 LYS 35 HE2 LYS 35 9.285 -10.629 -0.699 282 HE3 LYS 35 HE1 LYS 35 10.546 -10.621 0.535 283 HZ1 LYS 35 HZ1 LYS 35 10.291 -13.025 0.732 284 HZ2 LYS 35 HZ2 LYS 35 10.708 -12.581 -0.845 285 HZ3 LYS 35 HZ3 LYS 35 9.114 -13.016 -0.483 286 HA PRO 36 HA PRO 36 5.425 -7.383 7.203 287 HB2 PRO 36 HB2 PRO 36 4.323 -4.804 6.460 288 HB3 PRO 36 HB1 PRO 36 5.434 -5.190 7.789 289 HG2 PRO 36 HG2 PRO 36 6.156 -3.721 5.624 290 HG3 PRO 36 HG1 PRO 36 7.287 -4.712 6.565 291 HD2 PRO 36 HD2 PRO 36 6.008 -5.294 3.936 292 HD3 PRO 36 HD1 PRO 36 7.646 -5.673 4.504 293 H ILE 37 HN ILE 37 3.365 -7.964 7.655 294 HA ILE 37 HA ILE 37 1.598 -8.398 5.457 295 HB ILE 37 HB ILE 37 1.755 -10.002 7.337 296 HG12 ILE 37 HG12 ILE 37 -0.380 -9.476 5.865 297 HG13 ILE 37 HG11 ILE 37 -0.424 -10.672 7.154 298 HG21 ILE 37 HG21 ILE 37 0.646 -9.507 9.473 299 HG22 ILE 37 HG22 ILE 37 0.427 -7.838 8.956 300 HG23 ILE 37 HG23 ILE 37 2.051 -8.483 9.190 301 HD11 ILE 37 HD11 ILE 37 -1.469 -9.062 8.636 302 HD12 ILE 37 HD12 ILE 37 -2.399 -9.230 7.148 303 HD13 ILE 37 HD13 ILE 37 -1.364 -7.822 7.387 304 H VAL 38 HN VAL 38 -0.241 -7.315 4.942 305 HA VAL 38 HA VAL 38 -0.465 -4.646 6.157 306 HB VAL 38 HB VAL 38 -1.784 -5.706 3.644 307 HG11 VAL 38 HG11 VAL 38 -2.352 -3.402 3.176 308 HG12 VAL 38 HG12 VAL 38 -1.544 -2.875 4.650 309 HG13 VAL 38 HG13 VAL 38 -3.005 -3.854 4.751 310 HG21 VAL 38 HG21 VAL 38 0.561 -3.831 3.910 311 HG22 VAL 38 HG22 VAL 38 -0.131 -4.461 2.415 312 HG23 VAL 38 HG23 VAL 38 0.698 -5.546 3.530 313 H GLU 39 HN GLU 39 -1.810 -4.533 7.824 314 HA GLU 39 HA GLU 39 -4.117 -6.297 7.970 315 HB2 GLU 39 HB2 GLU 39 -2.788 -4.402 9.879 316 HB3 GLU 39 HB1 GLU 39 -4.430 -4.951 10.179 317 HG2 GLU 39 HG2 GLU 39 -3.789 -7.032 10.711 318 HG3 GLU 39 HG1 GLU 39 -2.495 -7.042 9.518 319 H ILE 40 HN ILE 40 -6.114 -5.710 7.463 320 HA ILE 40 HA ILE 40 -6.752 -2.851 7.284 321 HB ILE 40 HB ILE 40 -6.158 -3.536 5.020 322 HG12 ILE 40 HG12 ILE 40 -8.194 -1.991 5.607 323 HG13 ILE 40 HG11 ILE 40 -7.903 -2.474 3.942 324 HG21 ILE 40 HG21 ILE 40 -7.493 -5.190 3.786 325 HG22 ILE 40 HG22 ILE 40 -8.306 -5.618 5.291 326 HG23 ILE 40 HG23 ILE 40 -6.572 -5.889 5.117 327 HD11 ILE 40 HD11 ILE 40 -9.848 -3.839 5.784 328 HD12 ILE 40 HD12 ILE 40 -9.642 -4.114 4.054 329 HD13 ILE 40 HD13 ILE 40 -10.277 -2.573 4.634 330 H GLN 41 HN GLN 41 -8.619 -2.352 8.194 331 HA GLN 41 HA GLN 41 -10.620 -4.476 8.617 332 HB2 GLN 41 HB2 GLN 41 -10.156 -2.307 10.643 333 HB3 GLN 41 HB1 GLN 41 -10.913 -3.876 10.865 334 HG2 GLN 41 HG2 GLN 41 -8.820 -4.991 10.811 335 HG3 GLN 41 HG1 GLN 41 -7.997 -3.532 10.264 336 HE21 GLN 41 HE21 GLN 41 -10.434 -3.388 12.720 337 HE22 GLN 41 HE22 GLN 41 -9.370 -3.072 14.045 338 H GLN 42 HN GLN 42 -12.751 -3.840 8.312 339 HA GLN 42 HA GLN 42 -13.192 -0.976 7.797 340 HB2 GLN 42 HB2 GLN 42 -14.429 -1.372 5.840 341 HB3 GLN 42 HB1 GLN 42 -13.030 -2.425 5.684 342 HG2 GLN 42 HG2 GLN 42 -14.500 -4.258 6.633 343 HG3 GLN 42 HG1 GLN 42 -15.852 -3.161 6.374 344 HE21 GLN 42 HE21 GLN 42 -16.582 -2.785 4.317 345 HE22 GLN 42 HE22 GLN 42 -16.019 -3.663 2.940 346 H LYS 43 HN LYS 43 -15.723 -0.675 7.548 347 HA LYS 43 HA LYS 43 -17.274 -2.317 9.368 348 HB2 LYS 43 HB2 LYS 43 -16.003 -0.576 10.753 349 HB3 LYS 43 HB1 LYS 43 -17.001 0.635 9.957 350 HG2 LYS 43 HG2 LYS 43 -19.013 -0.549 10.834 351 HG3 LYS 43 HG1 LYS 43 -17.929 -1.604 11.742 352 HD2 LYS 43 HD2 LYS 43 -18.612 0.075 13.251 353 HD3 LYS 43 HD1 LYS 43 -16.965 0.489 12.774 354 HE2 LYS 43 HE2 LYS 43 -19.232 1.649 11.229 355 HE3 LYS 43 HE1 LYS 43 -18.882 2.301 12.827 356 HZ1 LYS 43 HZ1 LYS 43 -16.482 2.426 11.912 357 HZ2 LYS 43 HZ2 LYS 43 -17.599 3.614 11.468 358 HZ3 LYS 43 HZ3 LYS 43 -17.225 2.360 10.391 359 H GLY 44 HN GLY 44 -17.374 -1.808 6.613 360 HA2 GLY 44 HA2 GLY 44 -19.594 -1.721 5.520 361 HA3 GLY 44 HA1 GLY 44 -19.835 -0.197 6.367 362 H ASP 45 HN ASP 45 -18.840 1.643 5.643 363 HA ASP 45 HA ASP 45 -17.635 1.430 2.969 364 HB2 ASP 45 HB2 ASP 45 -19.023 3.773 4.288 365 HB3 ASP 45 HB1 ASP 45 -18.277 3.816 2.697 366 H ASP 46 HN ASP 46 -17.091 2.327 6.225 367 HA ASP 46 HA ASP 46 -14.744 3.943 5.612 368 HB2 ASP 46 HB2 ASP 46 -14.593 4.345 7.985 369 HB3 ASP 46 HB1 ASP 46 -16.265 4.573 7.486 370 H PHE 47 HN PHE 47 -12.701 3.283 5.755 371 HA PHE 47 HA PHE 47 -12.205 0.516 6.659 372 HB2 PHE 47 HB2 PHE 47 -11.058 1.966 4.270 373 HB3 PHE 47 HB1 PHE 47 -10.371 0.485 4.915 374 HD1 PHE 47 HD1 PHE 47 -13.897 1.512 4.227 375 HD2 PHE 47 HD2 PHE 47 -10.722 -1.188 3.414 376 HE1 PHE 47 HE1 PHE 47 -15.386 0.203 2.775 377 HE2 PHE 47 HE2 PHE 47 -12.207 -2.500 1.962 378 HZ PHE 47 HZ PHE 47 -14.543 -1.810 1.646 379 H VAL 48 HN VAL 48 -10.145 0.113 7.548 380 HA VAL 48 HA VAL 48 -8.493 2.454 8.170 381 HB VAL 48 HB VAL 48 -9.283 0.330 10.176 382 HG11 VAL 48 HG11 VAL 48 -7.945 1.693 11.760 383 HG12 VAL 48 HG12 VAL 48 -7.380 2.654 10.391 384 HG13 VAL 48 HG13 VAL 48 -6.983 0.939 10.489 385 HG21 VAL 48 HG21 VAL 48 -10.242 2.245 11.429 386 HG22 VAL 48 HG22 VAL 48 -11.058 1.934 9.897 387 HG23 VAL 48 HG23 VAL 48 -9.921 3.274 10.034 388 H VAL 49 HN VAL 49 -6.720 2.002 7.034 389 HA VAL 49 HA VAL 49 -5.728 -0.754 6.945 390 HB VAL 49 HB VAL 49 -4.700 1.608 5.377 391 HG11 VAL 49 HG11 VAL 49 -4.440 -1.355 4.882 392 HG12 VAL 49 HG12 VAL 49 -3.186 -0.340 5.595 393 HG13 VAL 49 HG13 VAL 49 -3.712 -0.061 3.933 394 HG21 VAL 49 HG21 VAL 49 -6.040 0.652 3.503 395 HG22 VAL 49 HG22 VAL 49 -7.013 1.337 4.805 396 HG23 VAL 49 HG23 VAL 49 -6.820 -0.412 4.669 397 H THR 50 HN THR 50 -4.011 -1.380 8.044 398 HA THR 50 HA THR 50 -2.415 0.687 9.397 399 HB THR 50 HB THR 50 -3.066 -2.126 10.280 400 HG1 THR 50 HG1 THR 50 -4.283 0.259 10.608 401 HG21 THR 50 HG21 THR 50 -0.804 -1.495 10.966 402 HG22 THR 50 HG22 THR 50 -1.893 -1.552 12.352 403 HG23 THR 50 HG23 THR 50 -1.427 0.002 11.662 404 H SER 51 HN SER 51 -0.447 0.891 8.620 405 HA SER 51 HA SER 51 0.880 -1.477 7.486 406 HB2 SER 51 HB2 SER 51 1.505 1.441 6.937 407 HB3 SER 51 HB1 SER 51 2.181 0.037 6.111 408 HG SER 51 HG SER 51 -0.329 -0.316 5.832 409 H LYS 52 HN LYS 52 2.371 -2.308 8.740 410 HA LYS 52 HA LYS 52 3.520 -0.724 10.902 411 HB2 LYS 52 HB2 LYS 52 2.580 -3.286 10.854 412 HB3 LYS 52 HB1 LYS 52 4.304 -3.553 10.647 413 HG2 LYS 52 HG2 LYS 52 4.535 -1.954 12.676 414 HG3 LYS 52 HG1 LYS 52 2.842 -2.356 12.954 415 HD2 LYS 52 HD2 LYS 52 4.130 -3.872 14.246 416 HD3 LYS 52 HD1 LYS 52 3.510 -4.778 12.864 417 HE2 LYS 52 HE2 LYS 52 5.636 -4.585 11.739 418 HE3 LYS 52 HE1 LYS 52 6.262 -3.557 13.023 419 HZ1 LYS 52 HZ1 LYS 52 6.180 -5.370 14.547 420 HZ2 LYS 52 HZ2 LYS 52 6.987 -5.903 13.158 421 HZ3 LYS 52 HZ3 LYS 52 5.383 -6.363 13.430 422 H THR 53 HN THR 53 5.578 -0.035 10.911 423 HA THR 53 HA THR 53 7.406 -1.172 8.917 424 HB THR 53 HB THR 53 8.244 0.952 8.279 425 HG1 THR 53 HG1 THR 53 6.512 2.479 9.845 426 HG21 THR 53 HG21 THR 53 6.311 2.096 7.360 427 HG22 THR 53 HG22 THR 53 5.245 1.243 8.480 428 HG23 THR 53 HG23 THR 53 6.107 0.351 7.220 429 HA PRO 54 HA PRO 54 10.365 -1.401 12.188 430 HB2 PRO 54 HB2 PRO 54 12.417 -0.495 10.250 431 HB3 PRO 54 HB1 PRO 54 12.279 -2.045 11.107 432 HG2 PRO 54 HG2 PRO 54 11.794 -1.928 8.526 433 HG3 PRO 54 HG1 PRO 54 10.758 -2.901 9.584 434 HD2 PRO 54 HD2 PRO 54 10.273 -0.139 8.509 435 HD3 PRO 54 HD1 PRO 54 9.189 -1.552 8.501 436 H ARG 55 HN ARG 55 9.361 1.476 11.048 437 HA ARG 55 HA ARG 55 11.217 2.977 12.762 438 HB2 ARG 55 HB2 ARG 55 10.509 4.919 11.054 439 HB3 ARG 55 HB1 ARG 55 11.921 3.899 10.813 440 HG2 ARG 55 HG2 ARG 55 10.533 2.422 9.367 441 HG3 ARG 55 HG1 ARG 55 9.220 3.591 9.514 442 HD2 ARG 55 HD2 ARG 55 11.961 4.286 8.479 443 HD3 ARG 55 HD1 ARG 55 10.622 3.801 7.441 444 HE ARG 55 HE ARG 55 9.839 5.933 9.128 445 HH11 ARG 55 HH11 ARG 55 11.785 5.279 6.284 446 HH12 ARG 55 HH12 ARG 55 11.595 6.876 5.637 447 HH21 ARG 55 HH21 ARG 55 9.581 8.024 8.254 448 HH22 ARG 55 HH22 ARG 55 10.332 8.423 6.734 449 H GLN 56 HN GLN 56 7.998 3.190 11.196 450 HA GLN 56 HA GLN 56 6.767 3.771 13.728 451 HB2 GLN 56 HB2 GLN 56 7.626 6.015 13.096 452 HB3 GLN 56 HB1 GLN 56 6.704 5.921 11.601 453 HG2 GLN 56 HG2 GLN 56 4.660 5.588 13.129 454 HG3 GLN 56 HG1 GLN 56 5.707 6.184 14.412 455 HE21 GLN 56 HE21 GLN 56 7.142 8.027 12.702 456 HE22 GLN 56 HE22 GLN 56 6.058 9.331 12.362 457 H THR 57 HN THR 57 4.811 2.904 13.722 458 HA THR 57 HA THR 57 3.689 1.855 11.286 459 HB THR 57 HB THR 57 2.593 1.851 14.107 460 HG1 THR 57 HG1 THR 57 4.662 0.747 13.679 461 HG21 THR 57 HG21 THR 57 1.219 -0.054 13.303 462 HG22 THR 57 HG22 THR 57 1.798 0.253 11.666 463 HG23 THR 57 HG23 THR 57 0.821 1.461 12.495 464 H VAL 58 HN VAL 58 2.407 2.967 9.984 465 HA VAL 58 HA VAL 58 1.015 5.316 11.067 466 HB VAL 58 HB VAL 58 2.593 5.744 9.227 467 HG11 VAL 58 HG11 VAL 58 0.724 4.080 7.544 468 HG12 VAL 58 HG12 VAL 58 2.347 3.607 8.049 469 HG13 VAL 58 HG13 VAL 58 2.126 4.985 6.970 470 HG21 VAL 58 HG21 VAL 58 0.770 7.275 9.503 471 HG22 VAL 58 HG22 VAL 58 -0.316 6.217 8.600 472 HG23 VAL 58 HG23 VAL 58 1.026 7.015 7.777 473 H THR 59 HN THR 59 -1.146 5.630 10.796 474 HA THR 59 HA THR 59 -2.691 3.325 9.820 475 HB THR 59 HB THR 59 -3.587 5.457 11.775 476 HG1 THR 59 HG1 THR 59 -2.169 4.306 12.948 477 HG21 THR 59 HG21 THR 59 -5.408 3.868 12.260 478 HG22 THR 59 HG22 THR 59 -4.801 2.802 10.995 479 HG23 THR 59 HG23 THR 59 -5.431 4.396 10.577 480 H ASN 60 HN ASN 60 -3.887 3.607 8.083 481 HA ASN 60 HA ASN 60 -4.466 6.365 7.166 482 HB2 ASN 60 HB2 ASN 60 -3.834 3.831 5.633 483 HB3 ASN 60 HB1 ASN 60 -4.600 5.224 4.874 484 HD21 ASN 60 HD21 ASN 60 -1.709 4.048 6.437 485 HD22 ASN 60 HD22 ASN 60 -0.664 5.299 5.861 486 H SER 61 HN SER 61 -6.618 6.825 7.073 487 HA SER 61 HA SER 61 -8.507 4.565 6.993 488 HB2 SER 61 HB2 SER 61 -9.201 7.069 8.492 489 HB3 SER 61 HB1 SER 61 -9.798 5.425 8.715 490 HG SER 61 HG SER 61 -7.171 6.307 9.308 491 H PHE 62 HN PHE 62 -10.487 4.916 5.892 492 HA PHE 62 HA PHE 62 -10.982 7.444 4.620 493 HB2 PHE 62 HB2 PHE 62 -10.890 6.462 2.296 494 HB3 PHE 62 HB1 PHE 62 -9.338 6.757 3.064 495 HD1 PHE 62 HD1 PHE 62 -11.715 4.170 1.989 496 HD2 PHE 62 HD2 PHE 62 -7.858 4.966 3.606 497 HE1 PHE 62 HE1 PHE 62 -11.044 1.854 1.523 498 HE2 PHE 62 HE2 PHE 62 -7.185 2.649 3.143 499 HZ PHE 62 HZ PHE 62 -8.777 1.089 2.099 500 H THR 63 HN THR 63 -12.815 7.201 2.965 501 HA THR 63 HA THR 63 -14.668 5.079 3.791 502 HB THR 63 HB THR 63 -15.654 7.851 3.176 503 HG1 THR 63 HG1 THR 63 -14.082 7.284 5.216 504 HG21 THR 63 HG21 THR 63 -17.536 7.125 4.587 505 HG22 THR 63 HG22 THR 63 -16.740 5.569 4.828 506 HG23 THR 63 HG23 THR 63 -17.285 6.042 3.218 507 H LEU 64 HN LEU 64 -15.742 4.116 2.141 508 HA LEU 64 HA LEU 64 -14.799 4.259 -0.456 509 HB2 LEU 64 HB2 LEU 64 -17.420 3.217 0.595 510 HB3 LEU 64 HB1 LEU 64 -16.881 2.984 -1.056 511 HG LEU 64 HG LEU 64 -15.587 1.902 1.445 512 HD11 LEU 64 HD11 LEU 64 -16.091 -0.267 0.412 513 HD12 LEU 64 HD12 LEU 64 -16.918 0.559 -0.908 514 HD13 LEU 64 HD13 LEU 64 -17.549 0.667 0.736 515 HD21 LEU 64 HD21 LEU 64 -14.062 0.750 -0.210 516 HD22 LEU 64 HD22 LEU 64 -13.787 2.474 0.024 517 HD23 LEU 64 HD23 LEU 64 -14.642 1.907 -1.410 518 H GLY 65 HN GLY 65 -14.866 5.934 -1.774 519 HA2 GLY 65 HA2 GLY 65 -16.012 7.176 -3.424 520 HA3 GLY 65 HA1 GLY 65 -17.491 6.999 -2.498 521 H LYS 66 HN LYS 66 -14.961 7.914 -0.471 522 HA LYS 66 HA LYS 66 -15.618 10.761 -0.832 523 HB2 LYS 66 HB2 LYS 66 -15.575 9.192 1.745 524 HB3 LYS 66 HB1 LYS 66 -15.519 10.948 1.696 525 HG2 LYS 66 HG2 LYS 66 -17.694 11.145 1.025 526 HG3 LYS 66 HG1 LYS 66 -17.698 9.583 0.207 527 HD2 LYS 66 HD2 LYS 66 -19.106 9.417 2.129 528 HD3 LYS 66 HD1 LYS 66 -17.638 8.499 2.456 529 HE2 LYS 66 HE2 LYS 66 -18.069 9.712 4.431 530 HE3 LYS 66 HE1 LYS 66 -16.761 10.571 3.616 531 HZ1 LYS 66 HZ1 LYS 66 -19.620 11.345 3.400 532 HZ2 LYS 66 HZ2 LYS 66 -18.277 12.214 2.860 533 HZ3 LYS 66 HZ3 LYS 66 -18.540 12.019 4.517 534 H GLU 67 HN GLU 67 -13.960 12.197 -0.548 535 HA GLU 67 HA GLU 67 -11.323 11.223 -0.848 536 HB2 GLU 67 HB2 GLU 67 -12.180 13.451 -1.646 537 HB3 GLU 67 HB1 GLU 67 -12.141 13.999 0.025 538 HG2 GLU 67 HG2 GLU 67 -9.673 13.325 -0.003 539 HG3 GLU 67 HG1 GLU 67 -9.845 13.258 -1.757 540 H ALA 68 HN ALA 68 -9.785 10.775 0.634 541 HA ALA 68 HA ALA 68 -10.397 11.436 3.429 542 HB1 ALA 68 HB1 ALA 68 -9.242 8.853 2.412 543 HB2 ALA 68 HB2 ALA 68 -10.880 9.091 3.017 544 HB3 ALA 68 HB3 ALA 68 -9.503 9.277 4.104 545 H ASP 69 HN ASP 69 -8.832 12.405 4.507 546 HA ASP 69 HA ASP 69 -6.278 12.856 3.261 547 HB2 ASP 69 HB2 ASP 69 -7.318 14.666 4.526 548 HB3 ASP 69 HB1 ASP 69 -7.336 13.670 5.971 549 H ILE 70 HN ILE 70 -4.798 11.385 3.332 550 HA ILE 70 HA ILE 70 -4.545 9.767 5.767 551 HB ILE 70 HB ILE 70 -3.608 7.950 4.266 552 HG12 ILE 70 HG12 ILE 70 -4.853 8.143 1.936 553 HG13 ILE 70 HG11 ILE 70 -4.581 9.863 2.212 554 HG21 ILE 70 HG21 ILE 70 -5.783 7.762 5.304 555 HG22 ILE 70 HG22 ILE 70 -5.823 7.094 3.673 556 HG23 ILE 70 HG23 ILE 70 -6.509 8.686 3.989 557 HD11 ILE 70 HD11 ILE 70 -2.194 9.475 2.399 558 HD12 ILE 70 HD12 ILE 70 -2.803 8.837 0.869 559 HD13 ILE 70 HD13 ILE 70 -2.446 7.741 2.205 560 H THR 71 HN THR 71 -2.273 8.781 5.935 561 HA THR 71 HA THR 71 -0.301 10.698 4.862 562 HB THR 71 HB THR 71 -0.288 9.816 7.746 563 HG1 THR 71 HG1 THR 71 -1.909 11.576 6.570 564 HG21 THR 71 HG21 THR 71 1.886 10.489 6.949 565 HG22 THR 71 HG22 THR 71 1.244 11.772 7.979 566 HG23 THR 71 HG23 THR 71 1.214 11.950 6.225 567 H THR 72 HN THR 72 1.642 9.829 4.321 568 HA THR 72 HA THR 72 1.801 6.941 4.391 569 HB THR 72 HB THR 72 2.464 8.181 2.336 570 HG1 THR 72 HG1 THR 72 4.466 6.966 2.073 571 HG21 THR 72 HG21 THR 72 3.542 10.109 3.385 572 HG22 THR 72 HG22 THR 72 4.638 9.302 2.264 573 HG23 THR 72 HG23 THR 72 4.824 9.066 4.000 574 H MET 73 HN MET 73 3.920 5.933 4.983 575 HA MET 73 HA MET 73 4.438 6.354 7.707 576 HB2 MET 73 HB2 MET 73 6.351 4.736 7.304 577 HB3 MET 73 HB1 MET 73 4.739 4.178 6.881 578 HG2 MET 73 HG2 MET 73 5.321 4.981 4.504 579 HG3 MET 73 HG1 MET 73 6.985 4.983 5.079 580 HE1 MET 73 HE1 MET 73 4.236 2.059 6.201 581 HE2 MET 73 HE2 MET 73 4.218 1.352 4.586 582 HE3 MET 73 HE3 MET 73 3.739 3.032 4.815 583 H ASP 74 HN ASP 74 5.964 7.807 4.928 584 HA ASP 74 HA ASP 74 8.332 8.516 6.447 585 HB2 ASP 74 HB2 ASP 74 8.415 7.981 3.990 586 HB3 ASP 74 HB1 ASP 74 7.601 9.512 3.691 587 H GLY 75 HN GLY 75 5.230 9.807 6.166 588 HA2 GLY 75 HA2 GLY 75 4.577 11.650 7.515 589 HA3 GLY 75 HA1 GLY 75 6.212 12.272 7.408 590 H LYS 76 HN LYS 76 4.241 11.265 4.665 591 HA LYS 76 HA LYS 76 4.243 14.060 3.768 592 HB2 LYS 76 HB2 LYS 76 4.226 11.520 2.125 593 HB3 LYS 76 HB1 LYS 76 4.121 13.141 1.474 594 HG2 LYS 76 HG2 LYS 76 6.453 11.962 2.965 595 HG3 LYS 76 HG1 LYS 76 6.364 12.285 1.234 596 HD2 LYS 76 HD2 LYS 76 5.910 14.715 1.932 597 HD3 LYS 76 HD1 LYS 76 6.526 14.224 3.508 598 HE2 LYS 76 HE2 LYS 76 8.344 15.158 2.249 599 HE3 LYS 76 HE1 LYS 76 8.597 13.421 2.394 600 HZ1 LYS 76 HZ1 LYS 76 7.764 13.135 0.154 601 HZ2 LYS 76 HZ2 LYS 76 9.055 14.224 0.155 602 HZ3 LYS 76 HZ3 LYS 76 7.467 14.795 0.010 603 H LYS 77 HN LYS 77 2.324 15.000 3.314 604 HA LYS 77 HA LYS 77 -0.088 13.555 3.973 605 HB2 LYS 77 HB2 LYS 77 0.592 16.396 3.342 606 HB3 LYS 77 HB1 LYS 77 -1.083 15.869 3.249 607 HG2 LYS 77 HG2 LYS 77 0.661 15.568 5.679 608 HG3 LYS 77 HG1 LYS 77 -0.469 16.898 5.413 609 HD2 LYS 77 HD2 LYS 77 -2.285 15.167 5.183 610 HD3 LYS 77 HD1 LYS 77 -1.110 13.963 5.718 611 HE2 LYS 77 HE2 LYS 77 -0.758 15.326 7.770 612 HE3 LYS 77 HE1 LYS 77 -2.081 16.367 7.252 613 HZ1 LYS 77 HZ1 LYS 77 -2.982 14.815 8.750 614 HZ2 LYS 77 HZ2 LYS 77 -2.215 13.506 8.006 615 HZ3 LYS 77 HZ3 LYS 77 -3.488 14.303 7.213 616 H LEU 78 HN LEU 78 -1.292 12.503 2.564 617 HA LEU 78 HA LEU 78 -1.310 13.376 -0.243 618 HB2 LEU 78 HB2 LEU 78 -1.335 10.462 0.509 619 HB3 LEU 78 HB1 LEU 78 -1.063 11.171 -1.069 620 HG LEU 78 HG LEU 78 0.902 11.712 1.118 621 HD11 LEU 78 HD11 LEU 78 0.536 9.303 1.189 622 HD12 LEU 78 HD12 LEU 78 2.131 9.702 0.553 623 HD13 LEU 78 HD13 LEU 78 0.844 9.201 -0.545 624 HD21 LEU 78 HD21 LEU 78 0.937 11.600 -1.875 625 HD22 LEU 78 HD22 LEU 78 2.427 11.472 -0.940 626 HD23 LEU 78 HD23 LEU 78 1.419 12.914 -0.798 627 H LYS 79 HN LYS 79 -3.250 12.906 -1.358 628 HA LYS 79 HA LYS 79 -5.493 12.182 0.423 629 HB2 LYS 79 HB2 LYS 79 -5.779 13.828 -2.080 630 HB3 LYS 79 HB1 LYS 79 -6.910 13.665 -0.749 631 HG2 LYS 79 HG2 LYS 79 -4.231 14.977 -0.437 632 HG3 LYS 79 HG1 LYS 79 -5.672 15.860 -0.935 633 HD2 LYS 79 HD2 LYS 79 -6.788 15.007 1.148 634 HD3 LYS 79 HD1 LYS 79 -5.209 14.408 1.656 635 HE2 LYS 79 HE2 LYS 79 -4.303 16.605 1.722 636 HE3 LYS 79 HE1 LYS 79 -5.706 17.276 0.896 637 HZ1 LYS 79 HZ1 LYS 79 -5.579 16.210 3.660 638 HZ2 LYS 79 HZ2 LYS 79 -7.032 16.581 2.872 639 HZ3 LYS 79 HZ3 LYS 79 -5.905 17.803 3.177 640 H CYS 80 HN CYS 80 -6.304 10.249 -0.048 641 HA CYS 80 HA CYS 80 -6.317 9.430 -2.885 642 HB2 CYS 80 HB2 CYS 80 -5.187 8.072 -0.609 643 HB3 CYS 80 HB1 CYS 80 -6.492 7.105 -1.278 644 H THR 81 HN THR 81 -8.349 9.742 -3.538 645 HA THR 81 HA THR 81 -10.606 9.343 -1.800 646 HB THR 81 HB THR 81 -10.725 9.635 -4.804 647 HG1 THR 81 HG1 THR 81 -10.184 11.686 -4.613 648 HG21 THR 81 HG21 THR 81 -12.848 10.813 -4.244 649 HG22 THR 81 HG22 THR 81 -12.591 10.390 -2.552 650 HG23 THR 81 HG23 THR 81 -12.839 9.119 -3.749 651 H VAL 82 HN VAL 82 -10.340 7.184 -1.186 652 HA VAL 82 HA VAL 82 -10.152 5.107 -3.139 653 HB VAL 82 HB VAL 82 -10.932 4.648 -0.289 654 HG11 VAL 82 HG11 VAL 82 -10.950 2.683 -1.592 655 HG12 VAL 82 HG12 VAL 82 -9.446 2.642 -0.672 656 HG13 VAL 82 HG13 VAL 82 -9.428 3.097 -2.379 657 HG21 VAL 82 HG21 VAL 82 -8.120 4.458 -0.545 658 HG22 VAL 82 HG22 VAL 82 -9.055 5.544 0.484 659 HG23 VAL 82 HG23 VAL 82 -8.606 6.044 -1.148 660 H HIS 83 HN HIS 83 -11.655 3.974 -4.052 661 HA HIS 83 HA HIS 83 -14.360 3.920 -2.972 662 HB2 HIS 83 HB2 HIS 83 -15.341 4.408 -5.188 663 HB3 HIS 83 HB1 HIS 83 -14.423 5.778 -4.565 664 HD1 HIS 83 HD1 HIS 83 -14.752 3.587 -7.468 665 HD2 HIS 83 HD2 HIS 83 -11.835 6.093 -5.891 666 HE1 HIS 83 HE1 HIS 83 -13.117 3.990 -9.338 667 HE2 HIS 83 HE2 HIS 83 -11.462 5.645 -8.406 668 H LEU 84 HN LEU 84 -15.577 2.159 -3.720 669 HA LEU 84 HA LEU 84 -13.904 0.001 -4.684 670 HB2 LEU 84 HB2 LEU 84 -15.537 -0.224 -2.741 671 HB3 LEU 84 HB1 LEU 84 -16.820 -0.168 -3.936 672 HG LEU 84 HG LEU 84 -16.163 -2.452 -3.171 673 HD11 LEU 84 HD11 LEU 84 -16.339 -3.492 -5.300 674 HD12 LEU 84 HD12 LEU 84 -15.827 -2.004 -6.100 675 HD13 LEU 84 HD13 LEU 84 -17.374 -2.066 -5.250 676 HD21 LEU 84 HD21 LEU 84 -14.163 -3.476 -4.086 677 HD22 LEU 84 HD22 LEU 84 -13.783 -2.158 -2.980 678 HD23 LEU 84 HD23 LEU 84 -13.666 -1.910 -4.723 679 H ALA 85 HN ALA 85 -14.068 -0.885 -6.594 680 HA ALA 85 HA ALA 85 -16.156 -0.007 -8.456 681 HB1 ALA 85 HB1 ALA 85 -14.457 0.507 -10.178 682 HB2 ALA 85 HB2 ALA 85 -13.200 0.298 -8.956 683 HB3 ALA 85 HB3 ALA 85 -14.390 1.592 -8.789 684 H ASN 86 HN ASN 86 -17.034 -1.852 -9.093 685 HA ASN 86 HA ASN 86 -17.326 -3.957 -9.878 686 HB2 ASN 86 HB2 ASN 86 -14.677 -3.258 -11.135 687 HB3 ASN 86 HB1 ASN 86 -15.485 -4.794 -11.449 688 HD21 ASN 86 HD21 ASN 86 -15.573 -1.364 -11.910 689 HD22 ASN 86 HD22 ASN 86 -16.814 -1.346 -13.109 690 H GLY 87 HN GLY 87 -15.962 -3.586 -7.273 691 HA2 GLY 87 HA2 GLY 87 -15.552 -5.291 -5.690 692 HA3 GLY 87 HA1 GLY 87 -15.054 -6.348 -6.998 693 H LYS 88 HN LYS 88 -13.592 -3.482 -7.595 694 HA LYS 88 HA LYS 88 -11.146 -4.337 -6.192 695 HB2 LYS 88 HB2 LYS 88 -11.481 -2.882 -8.821 696 HB3 LYS 88 HB1 LYS 88 -9.938 -3.059 -7.999 697 HG2 LYS 88 HG2 LYS 88 -9.942 -4.769 -9.590 698 HG3 LYS 88 HG1 LYS 88 -10.379 -5.573 -8.080 699 HD2 LYS 88 HD2 LYS 88 -12.818 -4.999 -8.881 700 HD3 LYS 88 HD1 LYS 88 -12.049 -4.972 -10.469 701 HE2 LYS 88 HE2 LYS 88 -11.448 -7.277 -8.705 702 HE3 LYS 88 HE1 LYS 88 -13.072 -7.187 -9.379 703 HZ1 LYS 88 HZ1 LYS 88 -11.642 -8.460 -10.817 704 HZ2 LYS 88 HZ2 LYS 88 -10.532 -7.185 -10.927 705 HZ3 LYS 88 HZ3 LYS 88 -12.081 -7.023 -11.593 706 H LEU 89 HN LEU 89 -9.965 -2.818 -5.048 707 HA LEU 89 HA LEU 89 -11.425 -0.369 -4.428 708 HB2 LEU 89 HB2 LEU 89 -10.340 -2.123 -2.758 709 HB3 LEU 89 HB1 LEU 89 -8.914 -1.139 -3.022 710 HG LEU 89 HG LEU 89 -9.864 0.740 -2.022 711 HD11 LEU 89 HD11 LEU 89 -12.368 0.620 -1.347 712 HD12 LEU 89 HD12 LEU 89 -12.469 -0.589 -2.628 713 HD13 LEU 89 HD13 LEU 89 -11.929 1.049 -2.998 714 HD21 LEU 89 HD21 LEU 89 -10.563 0.045 0.142 715 HD22 LEU 89 HD22 LEU 89 -9.389 -1.140 -0.437 716 HD23 LEU 89 HD23 LEU 89 -11.115 -1.511 -0.475 717 H VAL 90 HN VAL 90 -10.814 1.584 -5.099 718 HA VAL 90 HA VAL 90 -8.088 1.929 -6.164 719 HB VAL 90 HB VAL 90 -10.493 3.116 -7.520 720 HG11 VAL 90 HG11 VAL 90 -8.798 3.021 -9.470 721 HG12 VAL 90 HG12 VAL 90 -7.597 2.831 -8.190 722 HG13 VAL 90 HG13 VAL 90 -8.626 4.264 -8.232 723 HG21 VAL 90 HG21 VAL 90 -11.041 0.924 -7.917 724 HG22 VAL 90 HG22 VAL 90 -9.363 0.380 -7.825 725 HG23 VAL 90 HG23 VAL 90 -9.938 1.223 -9.266 726 H CYS 91 HN CYS 91 -7.143 3.886 -5.706 727 HA CYS 91 HA CYS 91 -8.854 6.038 -4.648 728 HB2 CYS 91 HB2 CYS 91 -7.422 6.531 -2.848 729 HB3 CYS 91 HB1 CYS 91 -7.595 4.785 -2.800 730 H LYS 92 HN LYS 92 -7.892 5.606 -7.218 731 HA LYS 92 HA LYS 92 -5.544 6.741 -8.036 732 HB2 LYS 92 HB2 LYS 92 -7.146 5.593 -9.512 733 HB3 LYS 92 HB1 LYS 92 -8.213 6.983 -9.409 734 HG2 LYS 92 HG2 LYS 92 -6.264 8.336 -10.342 735 HG3 LYS 92 HG1 LYS 92 -5.550 6.779 -10.750 736 HD2 LYS 92 HD2 LYS 92 -8.264 7.720 -11.638 737 HD3 LYS 92 HD1 LYS 92 -6.802 7.774 -12.619 738 HE2 LYS 92 HE2 LYS 92 -7.910 5.238 -11.431 739 HE3 LYS 92 HE1 LYS 92 -8.337 5.813 -13.040 740 HZ1 LYS 92 HZ1 LYS 92 -5.644 5.018 -12.076 741 HZ2 LYS 92 HZ2 LYS 92 -5.920 5.779 -13.565 742 HZ3 LYS 92 HZ3 LYS 92 -6.583 4.253 -13.256 743 H SER 93 HN SER 93 -4.716 8.683 -8.339 744 HA SER 93 HA SER 93 -6.258 10.983 -7.374 745 HB2 SER 93 HB2 SER 93 -3.287 10.995 -7.782 746 HB3 SER 93 HB1 SER 93 -4.254 11.891 -6.611 747 HG SER 93 HG SER 93 -4.667 9.374 -6.063 748 H GLU 94 HN GLU 94 -4.796 13.048 -8.565 749 HA GLU 94 HA GLU 94 -5.708 12.801 -11.295 750 HB2 GLU 94 HB2 GLU 94 -5.227 15.161 -11.518 751 HB3 GLU 94 HB1 GLU 94 -6.158 14.861 -10.059 752 HG2 GLU 94 HG2 GLU 94 -4.610 15.806 -8.822 753 HG3 GLU 94 HG1 GLU 94 -3.370 14.740 -9.458 754 H LYS 95 HN LYS 95 -2.750 12.582 -9.583 755 HA LYS 95 HA LYS 95 -1.249 12.673 -12.117 756 HB2 LYS 95 HB2 LYS 95 -0.722 14.320 -10.199 757 HB3 LYS 95 HB1 LYS 95 -0.014 12.933 -9.385 758 HG2 LYS 95 HG2 LYS 95 1.670 12.701 -10.963 759 HG3 LYS 95 HG1 LYS 95 0.819 13.681 -12.158 760 HD2 LYS 95 HD2 LYS 95 1.661 14.873 -9.547 761 HD3 LYS 95 HD1 LYS 95 2.833 14.687 -10.849 762 HE2 LYS 95 HE2 LYS 95 2.089 16.767 -11.378 763 HE3 LYS 95 HE1 LYS 95 0.865 15.837 -12.237 764 HZ1 LYS 95 HZ1 LYS 95 0.203 17.753 -10.614 765 HZ2 LYS 95 HZ2 LYS 95 0.366 16.555 -9.439 766 HZ3 LYS 95 HZ3 LYS 95 -0.741 16.349 -10.706 767 H PHE 96 HN PHE 96 -1.969 10.756 -9.280 768 HA PHE 96 HA PHE 96 -0.313 8.611 -10.427 769 HB2 PHE 96 HB2 PHE 96 -0.809 8.773 -7.478 770 HB3 PHE 96 HB1 PHE 96 0.491 7.961 -8.344 771 HD1 PHE 96 HD2 PHE 96 2.338 9.305 -9.325 772 HD2 PHE 96 HD1 PHE 96 -0.612 11.015 -6.781 773 HE1 PHE 96 HE2 PHE 96 3.796 11.248 -8.945 774 HE2 PHE 96 HE1 PHE 96 0.843 12.957 -6.392 775 HZ PHE 96 HZ PHE 96 3.052 13.078 -7.476 776 H SER 97 HN SER 97 -0.993 6.429 -9.218 777 HA SER 97 HA SER 97 -3.822 6.284 -8.701 778 HB2 SER 97 HB2 SER 97 -3.693 6.271 -11.189 779 HB3 SER 97 HB1 SER 97 -2.696 4.821 -11.103 780 HG SER 97 HG SER 97 -4.424 3.670 -10.782 781 H HIS 98 HN HIS 98 -4.392 4.506 -7.545 782 HA HIS 98 HA HIS 98 -2.347 2.438 -7.101 783 HB2 HIS 98 HB2 HIS 98 -2.579 4.003 -5.141 784 HB3 HIS 98 HB1 HIS 98 -4.259 3.507 -5.007 785 HD2 HIS 98 HD2 HIS 98 -3.901 0.266 -5.178 786 HE1 HIS 98 HE1 HIS 98 -1.194 0.840 -1.977 787 HE2 HIS 98 HE2 HIS 98 -2.568 -0.857 -3.243 788 H GLU 99 HN GLU 99 -3.073 0.473 -7.563 789 HA GLU 99 HA GLU 99 -6.002 0.117 -7.733 790 HB2 GLU 99 HB2 GLU 99 -5.435 -0.036 -9.937 791 HB3 GLU 99 HB1 GLU 99 -3.804 -0.586 -9.597 792 HG2 GLU 99 HG2 GLU 99 -4.720 -2.793 -8.999 793 HG3 GLU 99 HG1 GLU 99 -6.314 -2.220 -9.492 794 H GLN 100 HN GLN 100 -6.876 -1.456 -6.539 795 HA GLN 100 HA GLN 100 -5.142 -3.643 -5.581 796 HB2 GLN 100 HB2 GLN 100 -7.264 -2.115 -4.081 797 HB3 GLN 100 HB1 GLN 100 -6.677 -3.686 -3.558 798 HG2 GLN 100 HG2 GLN 100 -4.358 -2.658 -3.587 799 HG3 GLN 100 HG1 GLN 100 -5.174 -1.102 -3.719 800 HE21 GLN 100 HE21 GLN 100 -3.499 -2.348 -1.600 801 HE22 GLN 100 HE22 GLN 100 -4.461 -2.223 -0.160 802 H GLU 101 HN GLU 101 -5.788 -5.535 -6.420 803 HA GLU 101 HA GLU 101 -8.672 -5.927 -6.876 804 HB2 GLU 101 HB2 GLU 101 -7.527 -5.682 -9.007 805 HB3 GLU 101 HB1 GLU 101 -6.376 -6.933 -8.564 806 HG2 GLU 101 HG2 GLU 101 -8.050 -8.617 -8.640 807 HG3 GLU 101 HG1 GLU 101 -9.330 -7.418 -8.802 808 H VAL 102 HN VAL 102 -9.584 -7.690 -6.003 809 HA VAL 102 HA VAL 102 -7.807 -9.647 -4.714 810 HB VAL 102 HB VAL 102 -10.618 -8.799 -4.010 811 HG11 VAL 102 HG11 VAL 102 -9.069 -11.210 -3.165 812 HG12 VAL 102 HG12 VAL 102 -10.780 -11.054 -3.564 813 HG13 VAL 102 HG13 VAL 102 -10.171 -10.429 -2.032 814 HG21 VAL 102 HG21 VAL 102 -9.598 -8.206 -1.855 815 HG22 VAL 102 HG22 VAL 102 -8.875 -7.318 -3.199 816 HG23 VAL 102 HG23 VAL 102 -8.022 -8.687 -2.483 817 H LYS 103 HN LYS 103 -7.740 -11.619 -5.551 818 HA LYS 103 HA LYS 103 -9.929 -12.463 -7.323 819 HB2 LYS 103 HB2 LYS 103 -7.028 -13.321 -7.270 820 HB3 LYS 103 HB1 LYS 103 -8.255 -14.042 -8.296 821 HG2 LYS 103 HG2 LYS 103 -8.610 -11.787 -9.313 822 HG3 LYS 103 HG1 LYS 103 -7.208 -11.230 -8.399 823 HD2 LYS 103 HD2 LYS 103 -5.843 -12.981 -9.485 824 HD3 LYS 103 HD1 LYS 103 -7.245 -13.447 -10.447 825 HE2 LYS 103 HE2 LYS 103 -5.883 -10.749 -10.482 826 HE3 LYS 103 HE1 LYS 103 -5.723 -12.005 -11.712 827 HZ1 LYS 103 HZ1 LYS 103 -7.654 -9.993 -11.524 828 HZ2 LYS 103 HZ2 LYS 103 -8.450 -11.478 -11.323 829 HZ3 LYS 103 HZ3 LYS 103 -7.516 -11.201 -12.703 830 H GLY 104 HN GLY 104 -10.927 -12.957 -5.152 831 HA2 GLY 104 HA2 GLY 104 -11.849 -14.771 -4.031 832 HA3 GLY 104 HA1 GLY 104 -10.553 -15.784 -4.645 833 H ASN 105 HN ASN 105 -8.703 -16.053 -3.468 834 HA ASN 105 HA ASN 105 -8.801 -15.015 -0.716 835 HB2 ASN 105 HB2 ASN 105 -8.841 -17.524 -1.187 836 HB3 ASN 105 HB1 ASN 105 -7.171 -17.351 -1.709 837 HD21 ASN 105 HD21 ASN 105 -9.368 -17.298 0.979 838 HD22 ASN 105 HD22 ASN 105 -8.161 -17.387 2.217 839 H GLU 106 HN GLU 106 -7.274 -14.495 -3.607 840 HA GLU 106 HA GLU 106 -4.808 -13.563 -2.295 841 HB2 GLU 106 HB2 GLU 106 -5.306 -14.401 -5.151 842 HB3 GLU 106 HB1 GLU 106 -3.818 -13.650 -4.598 843 HG2 GLU 106 HG2 GLU 106 -3.242 -15.499 -3.274 844 HG3 GLU 106 HG1 GLU 106 -4.865 -16.181 -3.386 845 H MET 107 HN MET 107 -3.912 -11.556 -3.011 846 HA MET 107 HA MET 107 -5.795 -9.791 -4.415 847 HB2 MET 107 HB2 MET 107 -6.107 -9.293 -2.070 848 HB3 MET 107 HB1 MET 107 -4.369 -9.185 -1.819 849 HG2 MET 107 HG2 MET 107 -4.217 -7.167 -3.032 850 HG3 MET 107 HG1 MET 107 -5.844 -7.346 -3.682 851 HE1 MET 107 HE1 MET 107 -3.821 -5.840 -0.444 852 HE2 MET 107 HE2 MET 107 -4.025 -7.589 -0.374 853 HE3 MET 107 HE3 MET 107 -4.919 -6.551 0.740 854 H VAL 108 HN VAL 108 -4.858 -8.773 -6.039 855 HA VAL 108 HA VAL 108 -1.927 -8.478 -6.002 856 HB VAL 108 HB VAL 108 -2.389 -9.966 -7.774 857 HG11 VAL 108 HG11 VAL 108 -4.127 -9.794 -9.369 858 HG12 VAL 108 HG12 VAL 108 -4.523 -8.151 -8.868 859 HG13 VAL 108 HG13 VAL 108 -4.866 -9.510 -7.794 860 HG21 VAL 108 HG21 VAL 108 -2.260 -7.219 -9.011 861 HG22 VAL 108 HG22 VAL 108 -1.816 -8.737 -9.796 862 HG23 VAL 108 HG23 VAL 108 -0.884 -8.155 -8.416 863 H GLU 109 HN GLU 109 -1.350 -6.425 -5.651 864 HA GLU 109 HA GLU 109 -3.148 -4.345 -6.670 865 HB2 GLU 109 HB2 GLU 109 -2.953 -3.126 -4.775 866 HB3 GLU 109 HB1 GLU 109 -2.694 -4.718 -4.088 867 HG2 GLU 109 HG2 GLU 109 -0.248 -4.312 -4.210 868 HG3 GLU 109 HG1 GLU 109 -0.596 -2.673 -4.769 869 H THR 110 HN THR 110 -2.352 -2.556 -7.629 870 HA THR 110 HA THR 110 0.482 -2.638 -8.438 871 HB THR 110 HB THR 110 -1.635 -1.529 -10.245 872 HG1 THR 110 HG1 THR 110 -2.446 -3.451 -10.565 873 HG21 THR 110 HG21 THR 110 -0.075 -1.875 -11.944 874 HG22 THR 110 HG22 THR 110 0.823 -3.065 -11.008 875 HG23 THR 110 HG23 THR 110 0.917 -1.357 -10.578 876 H ILE 111 HN ILE 111 1.467 -0.901 -7.607 877 HA ILE 111 HA ILE 111 -0.089 1.600 -7.455 878 HB ILE 111 HB ILE 111 2.386 1.254 -5.810 879 HG12 ILE 111 HG12 ILE 111 -0.290 0.086 -5.000 880 HG13 ILE 111 HG11 ILE 111 1.105 -0.866 -5.502 881 HG21 ILE 111 HG21 ILE 111 1.111 2.642 -4.233 882 HG22 ILE 111 HG22 ILE 111 -0.276 2.585 -5.320 883 HG23 ILE 111 HG23 ILE 111 1.209 3.382 -5.832 884 HD11 ILE 111 HD11 ILE 111 0.806 0.832 -3.038 885 HD12 ILE 111 HD12 ILE 111 2.350 0.165 -3.576 886 HD13 ILE 111 HD13 ILE 111 1.026 -0.917 -3.140 887 H THR 112 HN THR 112 1.072 3.560 -7.990 888 HA THR 112 HA THR 112 3.695 3.227 -9.250 889 HB THR 112 HB THR 112 1.443 4.678 -10.655 890 HG1 THR 112 HG1 THR 112 2.138 2.015 -10.589 891 HG21 THR 112 HG21 THR 112 4.159 3.810 -11.650 892 HG22 THR 112 HG22 THR 112 3.774 5.438 -11.096 893 HG23 THR 112 HG23 THR 112 2.969 4.779 -12.523 894 H PHE 113 HN PHE 113 4.968 4.607 -8.204 895 HA PHE 113 HA PHE 113 4.160 7.396 -7.976 896 HB2 PHE 113 HB2 PHE 113 4.473 5.563 -5.671 897 HB3 PHE 113 HB1 PHE 113 5.281 7.118 -5.528 898 HD1 PHE 113 HD1 PHE 113 4.014 9.175 -5.380 899 HD2 PHE 113 HD2 PHE 113 2.051 5.415 -5.720 900 HE1 PHE 113 HE1 PHE 113 1.898 10.222 -4.695 901 HE2 PHE 113 HE2 PHE 113 -0.069 6.455 -5.038 902 HZ PHE 113 HZ PHE 113 -0.149 8.862 -4.530 903 H GLY 114 HN GLY 114 5.889 8.808 -7.907 904 HA2 GLY 114 HA2 GLY 114 8.043 9.527 -8.205 905 HA3 GLY 114 HA1 GLY 114 8.573 8.032 -7.448 906 H GLY 115 HN GLY 115 6.534 7.656 -10.130 907 HA2 GLY 115 HA2 GLY 115 6.933 7.202 -12.366 908 HA3 GLY 115 HA1 GLY 115 8.624 7.618 -12.123 909 H VAL 116 HN VAL 116 7.320 5.391 -9.868 910 HA VAL 116 HA VAL 116 8.532 3.160 -11.357 911 HB VAL 116 HB VAL 116 8.555 3.516 -8.358 912 HG11 VAL 116 HG11 VAL 116 10.156 1.612 -8.440 913 HG12 VAL 116 HG12 VAL 116 9.780 1.425 -10.152 914 HG13 VAL 116 HG13 VAL 116 8.519 1.194 -8.937 915 HG21 VAL 116 HG21 VAL 116 10.623 4.082 -10.448 916 HG22 VAL 116 HG22 VAL 116 11.078 3.691 -8.791 917 HG23 VAL 116 HG23 VAL 116 10.072 5.102 -9.117 918 H THR 117 HN THR 117 7.257 1.476 -11.695 919 HA THR 117 HA THR 117 4.639 1.420 -10.425 920 HB THR 117 HB THR 117 5.588 -0.490 -12.553 921 HG1 THR 117 HG1 THR 117 4.634 1.105 -14.038 922 HG21 THR 117 HG21 THR 117 3.240 -0.620 -13.103 923 HG22 THR 117 HG22 THR 117 2.864 0.683 -11.974 924 HG23 THR 117 HG23 THR 117 3.428 -0.878 -11.371 925 H LEU 118 HN LEU 118 4.959 0.592 -8.397 926 HA LEU 118 HA LEU 118 6.510 -1.850 -8.076 927 HB2 LEU 118 HB2 LEU 118 6.771 -0.136 -6.382 928 HB3 LEU 118 HB1 LEU 118 5.048 -0.142 -6.059 929 HG LEU 118 HG LEU 118 5.154 -2.287 -5.028 930 HD11 LEU 118 HD11 LEU 118 7.995 -2.418 -6.018 931 HD12 LEU 118 HD12 LEU 118 6.647 -3.427 -6.541 932 HD13 LEU 118 HD13 LEU 118 7.271 -3.569 -4.895 933 HD21 LEU 118 HD21 LEU 118 6.469 -1.858 -3.143 934 HD22 LEU 118 HD22 LEU 118 6.058 -0.265 -3.783 935 HD23 LEU 118 HD23 LEU 118 7.659 -0.948 -4.077 936 H ILE 119 HN ILE 119 5.478 -3.570 -8.861 937 HA ILE 119 HA ILE 119 2.654 -3.988 -8.204 938 HB ILE 119 HB ILE 119 4.395 -5.620 -10.061 939 HG12 ILE 119 HG12 ILE 119 2.679 -3.191 -10.538 940 HG13 ILE 119 HG11 ILE 119 4.341 -3.471 -11.033 941 HG21 ILE 119 HG21 ILE 119 2.518 -6.894 -9.349 942 HG22 ILE 119 HG22 ILE 119 2.146 -6.307 -10.970 943 HG23 ILE 119 HG23 ILE 119 1.423 -5.527 -9.563 944 HD11 ILE 119 HD11 ILE 119 3.618 -5.040 -12.708 945 HD12 ILE 119 HD12 ILE 119 2.755 -3.517 -12.900 946 HD13 ILE 119 HD13 ILE 119 1.949 -4.899 -12.163 947 H ARG 120 HN ARG 120 2.031 -5.444 -6.736 948 HA ARG 120 HA ARG 120 3.911 -7.532 -5.913 949 HB2 ARG 120 HB2 ARG 120 2.622 -5.482 -4.125 950 HB3 ARG 120 HB1 ARG 120 3.122 -7.051 -3.505 951 HG2 ARG 120 HG2 ARG 120 5.290 -6.499 -3.506 952 HG3 ARG 120 HG1 ARG 120 5.168 -5.685 -5.070 953 HD2 ARG 120 HD2 ARG 120 5.778 -4.136 -3.254 954 HD3 ARG 120 HD1 ARG 120 4.251 -3.715 -4.018 955 HE ARG 120 HE ARG 120 4.598 -4.827 -1.323 956 HH11 ARG 120 HH11 ARG 120 2.526 -3.450 -3.787 957 HH12 ARG 120 HH12 ARG 120 1.196 -3.182 -2.697 958 HH21 ARG 120 HH21 ARG 120 2.843 -4.399 0.119 959 HH22 ARG 120 HH22 ARG 120 1.379 -3.698 -0.512 960 H ARG 121 HN ARG 121 2.893 -9.251 -4.680 961 HA ARG 121 HA ARG 121 0.022 -9.497 -5.246 962 HB2 ARG 121 HB2 ARG 121 0.661 -12.066 -5.235 963 HB3 ARG 121 HB1 ARG 121 0.777 -11.117 -6.703 964 HG2 ARG 121 HG2 ARG 121 3.252 -10.828 -5.478 965 HG3 ARG 121 HG1 ARG 121 2.817 -12.523 -5.249 966 HD2 ARG 121 HD2 ARG 121 4.022 -12.281 -7.315 967 HD3 ARG 121 HD1 ARG 121 2.343 -12.692 -7.659 968 HE ARG 121 HE ARG 121 2.502 -9.928 -7.708 969 HH11 ARG 121 HH11 ARG 121 3.867 -12.645 -9.466 970 HH12 ARG 121 HH12 ARG 121 4.062 -11.755 -10.943 971 HH21 ARG 121 HH21 ARG 121 2.714 -8.776 -9.696 972 HH22 ARG 121 HH22 ARG 121 3.397 -9.565 -11.081 973 H SER 122 HN SER 122 -1.194 -10.413 -3.613 974 HA SER 122 HA SER 122 0.248 -11.033 -1.138 975 HB2 SER 122 HB2 SER 122 -2.240 -9.793 -0.487 976 HB3 SER 122 HB1 SER 122 -0.608 -9.242 -0.110 977 HG SER 122 HG SER 122 -1.742 -8.813 -2.659 978 H LYS 123 HN LYS 123 -0.780 -12.443 0.279 979 HA LYS 123 HA LYS 123 -3.048 -13.940 -0.864 980 HB2 LYS 123 HB2 LYS 123 -2.028 -15.936 0.354 981 HB3 LYS 123 HB1 LYS 123 -1.184 -15.385 -1.088 982 HG2 LYS 123 HG2 LYS 123 0.618 -14.623 0.088 983 HG3 LYS 123 HG1 LYS 123 -0.320 -14.287 1.544 984 HD2 LYS 123 HD2 LYS 123 -0.470 -16.662 2.023 985 HD3 LYS 123 HD1 LYS 123 0.373 -17.042 0.521 986 HE2 LYS 123 HE2 LYS 123 2.346 -15.816 1.353 987 HE3 LYS 123 HE1 LYS 123 1.495 -15.524 2.872 988 HZ1 LYS 123 HZ1 LYS 123 1.368 -17.929 3.196 989 HZ2 LYS 123 HZ2 LYS 123 2.973 -17.410 3.064 990 HZ3 LYS 123 HZ3 LYS 123 2.224 -18.179 1.758 991 H ARG 124 HN ARG 124 -4.675 -14.517 0.557 992 HA ARG 124 HA ARG 124 -4.889 -12.984 2.934 993 HB2 ARG 124 HB2 ARG 124 -6.718 -14.096 1.326 994 HB3 ARG 124 HB1 ARG 124 -6.647 -15.343 2.563 995 HG2 ARG 124 HG2 ARG 124 -7.248 -13.802 4.267 996 HG3 ARG 124 HG1 ARG 124 -7.098 -12.436 3.166 997 HD2 ARG 124 HD2 ARG 124 -9.412 -12.873 3.402 998 HD3 ARG 124 HD1 ARG 124 -8.942 -13.466 1.808 999 HE ARG 124 HE ARG 124 -8.718 -15.649 3.416 1000 HH11 ARG 124 HH11 ARG 124 -11.276 -13.362 2.794 1001 HH12 ARG 124 HH12 ARG 124 -12.549 -14.517 3.018 1002 HH21 ARG 124 HH21 ARG 124 -10.386 -17.193 3.719 1003 HH22 ARG 124 HH22 ARG 124 -12.041 -16.704 3.542 1004 H VAL 125 HN VAL 125 -4.876 -13.634 5.072 1005 HA VAL 125 HA VAL 125 -4.033 -16.348 5.688 1006 HB VAL 125 HB VAL 125 -1.907 -15.278 5.410 1007 HG11 VAL 125 HG11 VAL 125 -2.834 -13.162 7.344 1008 HG12 VAL 125 HG12 VAL 125 -2.628 -12.949 5.609 1009 HG13 VAL 125 HG13 VAL 125 -1.228 -13.283 6.626 1010 HG21 VAL 125 HG21 VAL 125 -1.796 -16.782 7.182 1011 HG22 VAL 125 HG22 VAL 125 -2.728 -15.736 8.250 1012 HG23 VAL 125 HG23 VAL 125 -1.071 -15.310 7.830 Start of MODEL 14 1 H1 ALA 1 HT1 ALA 1 -14.644 -10.592 0.672 2 H2 ALA 1 HT2 ALA 1 -13.451 -10.749 1.860 3 H3 ALA 1 HT3 ALA 1 -13.012 -10.595 0.236 4 HA ALA 1 HA ALA 1 -14.034 -8.372 0.203 5 HB1 ALA 1 HB1 ALA 1 -15.463 -8.931 2.241 6 HB2 ALA 1 HB2 ALA 1 -14.751 -7.321 2.169 7 HB3 ALA 1 HB3 ALA 1 -14.030 -8.556 3.199 8 H PHE 2 HN PHE 2 -12.824 -6.422 1.248 9 HA PHE 2 HA PHE 2 -10.008 -6.983 0.995 10 HB2 PHE 2 HB2 PHE 2 -11.690 -4.534 1.285 11 HB3 PHE 2 HB1 PHE 2 -9.988 -4.418 1.714 12 HD1 PHE 2 HD2 PHE 2 -8.250 -4.878 0.001 13 HD2 PHE 2 HD1 PHE 2 -12.388 -4.646 -0.974 14 HE1 PHE 2 HE2 PHE 2 -7.675 -4.582 -2.378 15 HE2 PHE 2 HE1 PHE 2 -11.811 -4.339 -3.354 16 HZ PHE 2 HZ PHE 2 -9.454 -4.322 -4.052 17 H SER 3 HN SER 3 -12.262 -6.415 3.569 18 HA SER 3 HA SER 3 -10.557 -5.768 5.676 19 HB2 SER 3 HB2 SER 3 -12.867 -7.515 6.286 20 HB3 SER 3 HB1 SER 3 -12.451 -5.925 6.931 21 HG SER 3 HG SER 3 -14.353 -6.267 5.342 22 H GLY 4 HN GLY 4 -8.721 -6.933 5.993 23 HA2 GLY 4 HA2 GLY 4 -8.749 -9.377 7.318 24 HA3 GLY 4 HA1 GLY 4 -8.479 -9.729 5.615 25 H THR 5 HN THR 5 -6.403 -10.566 6.412 26 HA THR 5 HA THR 5 -4.450 -8.381 6.684 27 HB THR 5 HB THR 5 -3.035 -10.108 7.911 28 HG1 THR 5 HG1 THR 5 -3.903 -11.988 8.353 29 HG21 THR 5 HG21 THR 5 -5.577 -9.200 9.259 30 HG22 THR 5 HG22 THR 5 -4.142 -8.201 9.016 31 HG23 THR 5 HG23 THR 5 -4.062 -9.620 10.059 32 H TRP 6 HN TRP 6 -3.253 -8.258 4.882 33 HA TRP 6 HA TRP 6 -2.753 -10.762 3.403 34 HB2 TRP 6 HB2 TRP 6 -2.568 -8.017 2.187 35 HB3 TRP 6 HB1 TRP 6 -2.801 -9.566 1.379 36 HD1 TRP 6 HD1 TRP 6 -4.740 -7.020 3.538 37 HE1 TRP 6 HE1 TRP 6 -7.253 -7.262 3.021 38 HE3 TRP 6 HE3 TRP 6 -4.549 -11.103 0.463 39 HZ2 TRP 6 HZ2 TRP 6 -8.929 -8.963 1.514 40 HZ3 TRP 6 HZ3 TRP 6 -6.647 -11.970 -0.480 41 HH2 TRP 6 HH2 TRP 6 -8.792 -10.921 0.038 42 H GLN 7 HN GLN 7 -0.728 -11.456 3.381 43 HA GLN 7 HA GLN 7 1.433 -9.631 4.114 44 HB2 GLN 7 HB2 GLN 7 1.067 -12.066 5.032 45 HB3 GLN 7 HB1 GLN 7 1.836 -12.541 3.524 46 HG2 GLN 7 HG2 GLN 7 3.734 -11.009 4.136 47 HG3 GLN 7 HG1 GLN 7 2.990 -10.853 5.723 48 HE21 GLN 7 HE21 GLN 7 2.062 -13.574 5.853 49 HE22 GLN 7 HE22 GLN 7 3.456 -14.571 6.083 50 H VAL 8 HN VAL 8 2.047 -8.474 2.452 51 HA VAL 8 HA VAL 8 1.843 -9.332 -0.247 52 HB VAL 8 HB VAL 8 1.524 -7.027 0.218 53 HG11 VAL 8 HG11 VAL 8 4.227 -7.183 1.499 54 HG12 VAL 8 HG12 VAL 8 2.712 -6.578 2.170 55 HG13 VAL 8 HG13 VAL 8 3.567 -5.648 0.937 56 HG21 VAL 8 HG21 VAL 8 2.519 -7.546 -1.936 57 HG22 VAL 8 HG22 VAL 8 4.135 -7.408 -1.236 58 HG23 VAL 8 HG23 VAL 8 3.093 -5.990 -1.335 59 H TYR 9 HN TYR 9 3.274 -10.043 -1.662 60 HA TYR 9 HA TYR 9 6.110 -10.208 -0.955 61 HB2 TYR 9 HB2 TYR 9 6.247 -12.564 -1.601 62 HB3 TYR 9 HB1 TYR 9 5.129 -12.369 -0.261 63 HD1 TYR 9 HD1 TYR 9 2.606 -12.275 -0.848 64 HD2 TYR 9 HD2 TYR 9 5.587 -13.723 -3.519 65 HE1 TYR 9 HE1 TYR 9 0.879 -13.488 -2.112 66 HE2 TYR 9 HE2 TYR 9 3.863 -14.931 -4.790 67 HH TYR 9 HH TYR 9 1.476 -15.910 -4.163 68 H ALA 10 HN ALA 10 7.413 -9.850 -2.704 69 HA ALA 10 HA ALA 10 6.793 -10.392 -5.379 70 HB1 ALA 10 HB1 ALA 10 6.452 -7.469 -4.734 71 HB2 ALA 10 HB2 ALA 10 5.097 -8.580 -4.925 72 HB3 ALA 10 HB3 ALA 10 6.186 -8.278 -6.279 73 H GLN 11 HN GLN 11 8.382 -9.465 -6.861 74 HA GLN 11 HA GLN 11 10.723 -8.302 -5.536 75 HB2 GLN 11 HB2 GLN 11 10.549 -10.977 -6.425 76 HB3 GLN 11 HB1 GLN 11 11.565 -10.132 -7.588 77 HG2 GLN 11 HG2 GLN 11 11.978 -10.354 -4.611 78 HG3 GLN 11 HG1 GLN 11 12.961 -11.078 -5.884 79 HE21 GLN 11 HE21 GLN 11 12.278 -8.226 -4.066 80 HE22 GLN 11 HE22 GLN 11 13.564 -7.255 -4.700 81 H GLU 12 HN GLU 12 8.734 -7.064 -7.160 82 HA GLU 12 HA GLU 12 10.387 -6.336 -9.485 83 HB2 GLU 12 HB2 GLU 12 7.396 -6.493 -9.300 84 HB3 GLU 12 HB1 GLU 12 8.216 -5.627 -10.580 85 HG2 GLU 12 HG2 GLU 12 9.043 -7.536 -11.544 86 HG3 GLU 12 HG1 GLU 12 8.904 -8.480 -10.063 87 H ASN 13 HN ASN 13 10.597 -4.303 -9.948 88 HA ASN 13 HA ASN 13 11.311 -2.207 -9.191 89 HB2 ASN 13 HB2 ASN 13 8.326 -1.917 -9.520 90 HB3 ASN 13 HB1 ASN 13 9.523 -0.640 -9.700 91 HD21 ASN 13 HD21 ASN 13 7.514 -2.152 -11.457 92 HD22 ASN 13 HD22 ASN 13 8.416 -2.470 -12.904 93 H TYR 14 HN TYR 14 11.240 -3.575 -6.833 94 HA TYR 14 HA TYR 14 9.580 -2.024 -5.006 95 HB2 TYR 14 HB2 TYR 14 9.577 -4.438 -4.685 96 HB3 TYR 14 HB1 TYR 14 11.332 -4.450 -4.545 97 HD1 TYR 14 HD2 TYR 14 8.209 -3.358 -2.889 98 HD2 TYR 14 HD1 TYR 14 12.399 -3.978 -2.483 99 HE1 TYR 14 HE2 TYR 14 8.015 -3.058 -0.457 100 HE2 TYR 14 HE1 TYR 14 12.218 -3.679 -0.061 101 HH TYR 14 HH TYR 14 10.006 -4.061 1.680 102 H GLU 15 HN GLU 15 12.985 -3.062 -5.205 103 HA GLU 15 HA GLU 15 13.912 -1.298 -3.221 104 HB2 GLU 15 HB2 GLU 15 16.162 -1.799 -4.055 105 HB3 GLU 15 HB1 GLU 15 15.200 -3.259 -3.857 106 HG2 GLU 15 HG2 GLU 15 15.256 -3.740 -6.039 107 HG3 GLU 15 HG1 GLU 15 15.069 -2.057 -6.522 108 H GLU 16 HN GLU 16 13.386 -0.878 -6.656 109 HA GLU 16 HA GLU 16 14.888 1.558 -6.805 110 HB2 GLU 16 HB2 GLU 16 13.927 -0.188 -8.674 111 HB3 GLU 16 HB1 GLU 16 12.797 1.154 -8.826 112 HG2 GLU 16 HG2 GLU 16 14.668 1.398 -10.358 113 HG3 GLU 16 HG1 GLU 16 14.643 2.695 -9.165 114 H PHE 17 HN PHE 17 11.577 0.654 -6.181 115 HA PHE 17 HA PHE 17 10.472 3.261 -6.386 116 HB2 PHE 17 HB2 PHE 17 9.026 1.304 -6.528 117 HB3 PHE 17 HB1 PHE 17 9.496 0.806 -4.907 118 HD1 PHE 17 HD1 PHE 17 8.350 4.045 -6.369 119 HD2 PHE 17 HD2 PHE 17 7.730 1.006 -3.462 120 HE1 PHE 17 HE1 PHE 17 6.470 5.321 -5.444 121 HE2 PHE 17 HE2 PHE 17 5.847 2.279 -2.522 122 HZ PHE 17 HZ PHE 17 5.213 4.440 -3.513 123 H LEU 18 HN LEU 18 11.946 1.388 -3.812 124 HA LEU 18 HA LEU 18 11.249 2.959 -1.621 125 HB2 LEU 18 HB2 LEU 18 13.850 1.496 -2.056 126 HB3 LEU 18 HB1 LEU 18 13.226 2.046 -0.515 127 HG LEU 18 HG LEU 18 12.261 -0.230 -2.221 128 HD11 LEU 18 HD11 LEU 18 12.939 -0.036 0.707 129 HD12 LEU 18 HD12 LEU 18 14.044 -0.583 -0.554 130 HD13 LEU 18 HD13 LEU 18 12.578 -1.501 -0.209 131 HD21 LEU 18 HD21 LEU 18 10.411 -0.418 -0.476 132 HD22 LEU 18 HD22 LEU 18 10.218 0.808 -1.728 133 HD23 LEU 18 HD23 LEU 18 10.742 1.277 -0.109 134 H LYS 19 HN LYS 19 13.733 3.390 -4.049 135 HA LYS 19 HA LYS 19 15.036 5.546 -2.668 136 HB2 LYS 19 HB2 LYS 19 15.358 5.183 -5.607 137 HB3 LYS 19 HB1 LYS 19 16.563 5.580 -4.393 138 HG2 LYS 19 HG2 LYS 19 15.798 3.045 -3.688 139 HG3 LYS 19 HG1 LYS 19 15.738 3.000 -5.447 140 HD2 LYS 19 HD2 LYS 19 18.017 3.704 -5.611 141 HD3 LYS 19 HD1 LYS 19 18.104 4.010 -3.878 142 HE2 LYS 19 HE2 LYS 19 19.179 1.886 -4.565 143 HE3 LYS 19 HE1 LYS 19 17.882 1.678 -3.387 144 HZ1 LYS 19 HZ1 LYS 19 17.457 1.354 -6.310 145 HZ2 LYS 19 HZ2 LYS 19 16.437 0.876 -5.044 146 HZ3 LYS 19 HZ3 LYS 19 17.901 0.069 -5.295 147 H ALA 20 HN ALA 20 12.263 5.251 -4.651 148 HA ALA 20 HA ALA 20 12.346 7.937 -5.673 149 HB1 ALA 20 HB1 ALA 20 11.251 6.124 -6.930 150 HB2 ALA 20 HB2 ALA 20 10.159 7.468 -6.599 151 HB3 ALA 20 HB3 ALA 20 10.043 5.987 -5.648 152 H LEU 21 HN LEU 21 11.218 6.372 -2.853 153 HA LEU 21 HA LEU 21 9.424 8.527 -2.093 154 HB2 LEU 21 HB2 LEU 21 10.356 6.114 -0.533 155 HB3 LEU 21 HB1 LEU 21 9.067 7.202 -0.064 156 HG LEU 21 HG LEU 21 8.601 6.080 -2.698 157 HD11 LEU 21 HD11 LEU 21 8.072 3.799 -1.798 158 HD12 LEU 21 HD12 LEU 21 9.034 4.218 -0.381 159 HD13 LEU 21 HD13 LEU 21 9.787 4.164 -1.974 160 HD21 LEU 21 HD21 LEU 21 6.461 5.459 -1.599 161 HD22 LEU 21 HD22 LEU 21 6.873 7.163 -1.437 162 HD23 LEU 21 HD23 LEU 21 7.115 6.069 -0.078 163 H ALA 22 HN ALA 22 12.600 8.367 -2.301 164 HA ALA 22 HA ALA 22 14.379 9.412 -1.362 165 HB1 ALA 22 HB1 ALA 22 13.896 11.447 0.027 166 HB2 ALA 22 HB2 ALA 22 12.179 11.068 -0.115 167 HB3 ALA 22 HB3 ALA 22 13.124 11.440 -1.558 168 H LEU 23 HN LEU 23 13.553 7.037 -0.247 169 HA LEU 23 HA LEU 23 13.566 7.292 2.638 170 HB2 LEU 23 HB2 LEU 23 13.448 4.951 0.754 171 HB3 LEU 23 HB1 LEU 23 13.604 4.735 2.484 172 HG LEU 23 HG LEU 23 11.331 6.233 1.192 173 HD11 LEU 23 HD11 LEU 23 11.578 3.359 2.026 174 HD12 LEU 23 HD12 LEU 23 11.146 4.000 0.440 175 HD13 LEU 23 HD13 LEU 23 10.028 4.167 1.795 176 HD21 LEU 23 HD21 LEU 23 11.721 5.166 3.984 177 HD22 LEU 23 HD22 LEU 23 10.259 5.939 3.372 178 HD23 LEU 23 HD23 LEU 23 11.755 6.862 3.504 179 HA PRO 24 HA PRO 24 17.874 6.698 3.370 180 HB2 PRO 24 HB2 PRO 24 17.489 4.570 5.326 181 HB3 PRO 24 HB1 PRO 24 17.942 6.260 5.602 182 HG2 PRO 24 HG2 PRO 24 15.555 5.230 6.356 183 HG3 PRO 24 HG1 PRO 24 15.810 6.938 5.935 184 HD2 PRO 24 HD2 PRO 24 14.607 4.743 4.303 185 HD3 PRO 24 HD1 PRO 24 14.139 6.452 4.421 186 H GLU 25 HN GLU 25 19.350 5.697 2.252 187 HA GLU 25 HA GLU 25 18.959 3.450 0.676 188 HB2 GLU 25 HB2 GLU 25 21.654 4.305 1.735 189 HB3 GLU 25 HB1 GLU 25 21.294 3.548 0.193 190 HG2 GLU 25 HG2 GLU 25 21.533 5.659 -0.547 191 HG3 GLU 25 HG1 GLU 25 19.838 5.760 -0.078 192 H ASP 26 HN ASP 26 20.216 3.717 3.937 193 HA ASP 26 HA ASP 26 21.162 1.076 4.176 194 HB2 ASP 26 HB2 ASP 26 21.334 3.251 5.773 195 HB3 ASP 26 HB1 ASP 26 20.088 2.347 6.623 196 H LEU 27 HN LEU 27 18.008 2.520 4.832 197 HA LEU 27 HA LEU 27 16.840 0.178 5.956 198 HB2 LEU 27 HB2 LEU 27 15.860 2.325 6.424 199 HB3 LEU 27 HB1 LEU 27 15.631 2.656 4.718 200 HG LEU 27 HG LEU 27 14.260 0.242 5.722 201 HD11 LEU 27 HD11 LEU 27 13.397 2.997 6.569 202 HD12 LEU 27 HD12 LEU 27 13.972 1.709 7.629 203 HD13 LEU 27 HD13 LEU 27 12.455 1.516 6.753 204 HD21 LEU 27 HD21 LEU 27 13.265 2.601 4.125 205 HD22 LEU 27 HD22 LEU 27 12.522 1.007 4.265 206 HD23 LEU 27 HD23 LEU 27 14.056 1.193 3.418 207 H ILE 28 HN ILE 28 17.149 1.473 2.725 208 HA ILE 28 HA ILE 28 15.344 -0.212 1.391 209 HB ILE 28 HB ILE 28 17.867 1.099 0.344 210 HG12 ILE 28 HG12 ILE 28 15.003 2.054 0.188 211 HG13 ILE 28 HG11 ILE 28 16.132 2.578 1.431 212 HG21 ILE 28 HG21 ILE 28 15.683 0.742 -1.533 213 HG22 ILE 28 HG22 ILE 28 16.302 -0.792 -0.923 214 HG23 ILE 28 HG23 ILE 28 17.394 0.353 -1.702 215 HD11 ILE 28 HD11 ILE 28 15.919 3.356 -1.386 216 HD12 ILE 28 HD12 ILE 28 17.560 3.112 -0.788 217 HD13 ILE 28 HD13 ILE 28 16.490 4.264 0.017 218 H LYS 29 HN LYS 29 18.534 -0.744 2.627 219 HA LYS 29 HA LYS 29 19.108 -3.102 1.097 220 HB2 LYS 29 HB2 LYS 29 20.336 -2.188 3.704 221 HB3 LYS 29 HB1 LYS 29 20.997 -3.384 2.606 222 HG2 LYS 29 HG2 LYS 29 21.543 -1.760 0.995 223 HG3 LYS 29 HG1 LYS 29 20.542 -0.536 1.784 224 HD2 LYS 29 HD2 LYS 29 22.080 -0.790 3.792 225 HD3 LYS 29 HD1 LYS 29 23.152 -1.696 2.719 226 HE2 LYS 29 HE2 LYS 29 23.460 0.196 1.302 227 HE3 LYS 29 HE1 LYS 29 22.160 1.080 2.099 228 HZ1 LYS 29 HZ1 LYS 29 23.553 0.982 4.163 229 HZ2 LYS 29 HZ2 LYS 29 24.188 1.940 2.916 230 HZ3 LYS 29 HZ3 LYS 29 24.823 0.399 3.202 231 H MET 30 HN MET 30 17.352 -2.383 3.993 232 HA MET 30 HA MET 30 17.408 -5.167 4.890 233 HB2 MET 30 HB2 MET 30 15.781 -2.993 6.170 234 HB3 MET 30 HB1 MET 30 16.479 -4.425 6.911 235 HG2 MET 30 HG2 MET 30 17.958 -1.973 5.986 236 HG3 MET 30 HG1 MET 30 17.643 -2.453 7.651 237 HE1 MET 30 HE1 MET 30 20.547 -1.708 6.355 238 HE2 MET 30 HE2 MET 30 21.523 -2.891 7.224 239 HE3 MET 30 HE3 MET 30 20.235 -2.022 8.061 240 H ALA 31 HN ALA 31 15.122 -2.701 3.839 241 HA ALA 31 HA ALA 31 12.750 -4.118 4.045 242 HB1 ALA 31 HB1 ALA 31 11.817 -2.474 2.553 243 HB2 ALA 31 HB2 ALA 31 13.420 -2.045 1.957 244 HB3 ALA 31 HB3 ALA 31 12.975 -1.687 3.625 245 H ARG 32 HN ARG 32 15.218 -4.309 1.587 246 HA ARG 32 HA ARG 32 13.764 -5.455 -0.500 247 HB2 ARG 32 HB2 ARG 32 15.866 -6.177 -1.394 248 HB3 ARG 32 HB1 ARG 32 16.142 -4.628 -0.602 249 HG2 ARG 32 HG2 ARG 32 17.009 -5.830 1.363 250 HG3 ARG 32 HG1 ARG 32 16.798 -7.353 0.500 251 HD2 ARG 32 HD2 ARG 32 18.539 -5.069 -0.418 252 HD3 ARG 32 HD1 ARG 32 19.118 -6.498 0.436 253 HE ARG 32 HE ARG 32 17.651 -6.954 -2.039 254 HH11 ARG 32 HH11 ARG 32 20.754 -6.717 -0.434 255 HH12 ARG 32 HH12 ARG 32 21.610 -7.568 -1.679 256 HH21 ARG 32 HH21 ARG 32 18.765 -8.096 -3.675 257 HH22 ARG 32 HH22 ARG 32 20.473 -8.361 -3.524 258 H ASP 33 HN ASP 33 14.939 -6.832 2.482 259 HA ASP 33 HA ASP 33 14.199 -9.526 1.586 260 HB2 ASP 33 HB2 ASP 33 15.954 -8.494 3.793 261 HB3 ASP 33 HB1 ASP 33 15.232 -10.094 3.930 262 H ILE 34 HN ILE 34 13.504 -7.057 3.967 263 HA ILE 34 HA ILE 34 11.729 -8.518 5.584 264 HB ILE 34 HB ILE 34 11.725 -5.543 5.037 265 HG12 ILE 34 HG12 ILE 34 13.148 -7.173 7.142 266 HG13 ILE 34 HG11 ILE 34 13.901 -6.302 5.819 267 HG21 ILE 34 HG21 ILE 34 10.664 -7.000 7.459 268 HG22 ILE 34 HG22 ILE 34 9.659 -6.473 6.111 269 HG23 ILE 34 HG23 ILE 34 10.517 -5.280 7.086 270 HD11 ILE 34 HD11 ILE 34 13.154 -4.201 6.775 271 HD12 ILE 34 HD12 ILE 34 14.133 -5.112 7.923 272 HD13 ILE 34 HD13 ILE 34 12.378 -5.070 8.097 273 H LYS 35 HN LYS 35 9.677 -9.096 5.341 274 HA LYS 35 HA LYS 35 8.118 -7.866 3.172 275 HB2 LYS 35 HB2 LYS 35 8.190 -10.792 3.940 276 HB3 LYS 35 HB1 LYS 35 7.031 -10.087 2.827 277 HG2 LYS 35 HG2 LYS 35 10.013 -10.095 2.415 278 HG3 LYS 35 HG1 LYS 35 8.887 -11.252 1.700 279 HD2 LYS 35 HD2 LYS 35 7.830 -9.539 0.418 280 HD3 LYS 35 HD1 LYS 35 8.679 -8.271 1.301 281 HE2 LYS 35 HE2 LYS 35 9.877 -10.291 -0.581 282 HE3 LYS 35 HE1 LYS 35 9.708 -8.557 -0.856 283 HZ1 LYS 35 HZ1 LYS 35 11.160 -8.289 1.181 284 HZ2 LYS 35 HZ2 LYS 35 11.919 -8.884 -0.210 285 HZ3 LYS 35 HZ3 LYS 35 11.507 -9.943 1.041 286 HA PRO 36 HA PRO 36 5.904 -7.355 7.173 287 HB2 PRO 36 HB2 PRO 36 4.997 -4.843 5.976 288 HB3 PRO 36 HB1 PRO 36 5.922 -5.101 7.464 289 HG2 PRO 36 HG2 PRO 36 6.989 -3.966 5.275 290 HG3 PRO 36 HG1 PRO 36 7.932 -4.949 6.412 291 HD2 PRO 36 HD2 PRO 36 6.824 -5.706 3.743 292 HD3 PRO 36 HD1 PRO 36 8.391 -6.113 4.473 293 H ILE 37 HN ILE 37 3.665 -7.254 7.634 294 HA ILE 37 HA ILE 37 2.001 -8.071 5.366 295 HB ILE 37 HB ILE 37 2.158 -9.660 7.228 296 HG12 ILE 37 HG12 ILE 37 -0.071 -9.018 5.871 297 HG13 ILE 37 HG11 ILE 37 -0.009 -10.314 7.060 298 HG21 ILE 37 HG21 ILE 37 2.562 -8.407 9.140 299 HG22 ILE 37 HG22 ILE 37 0.920 -9.011 9.375 300 HG23 ILE 37 HG23 ILE 37 1.180 -7.346 8.857 301 HD11 ILE 37 HD11 ILE 37 -1.957 -8.644 7.148 302 HD12 ILE 37 HD12 ILE 37 -0.790 -7.538 7.868 303 HD13 ILE 37 HD13 ILE 37 -1.155 -9.071 8.659 304 H VAL 38 HN VAL 38 0.058 -7.056 4.911 305 HA VAL 38 HA VAL 38 -0.208 -4.366 6.042 306 HB VAL 38 HB VAL 38 -1.646 -5.547 3.661 307 HG11 VAL 38 HG11 VAL 38 -2.175 -3.256 3.078 308 HG12 VAL 38 HG12 VAL 38 -1.273 -2.665 4.475 309 HG13 VAL 38 HG13 VAL 38 -2.746 -3.607 4.711 310 HG21 VAL 38 HG21 VAL 38 -0.011 -4.068 2.374 311 HG22 VAL 38 HG22 VAL 38 0.604 -5.586 3.024 312 HG23 VAL 38 HG23 VAL 38 0.959 -4.065 3.846 313 H GLU 39 HN GLU 39 -1.529 -4.216 7.750 314 HA GLU 39 HA GLU 39 -3.744 -6.096 8.028 315 HB2 GLU 39 HB2 GLU 39 -2.151 -4.436 9.837 316 HB3 GLU 39 HB1 GLU 39 -3.877 -4.355 10.170 317 HG2 GLU 39 HG2 GLU 39 -4.020 -6.633 10.627 318 HG3 GLU 39 HG1 GLU 39 -2.484 -6.976 9.829 319 H ILE 40 HN ILE 40 -5.696 -5.602 7.327 320 HA ILE 40 HA ILE 40 -6.502 -2.782 7.324 321 HB ILE 40 HB ILE 40 -5.849 -3.272 5.038 322 HG12 ILE 40 HG12 ILE 40 -8.030 -1.947 5.660 323 HG13 ILE 40 HG11 ILE 40 -7.664 -2.318 3.982 324 HG21 ILE 40 HG21 ILE 40 -5.966 -5.530 4.692 325 HG22 ILE 40 HG22 ILE 40 -7.365 -4.963 3.775 326 HG23 ILE 40 HG23 ILE 40 -7.584 -5.661 5.378 327 HD11 ILE 40 HD11 ILE 40 -10.050 -2.667 4.776 328 HD12 ILE 40 HD12 ILE 40 -9.434 -4.081 5.625 329 HD13 ILE 40 HD13 ILE 40 -9.295 -3.978 3.870 330 H GLN 41 HN GLN 41 -8.433 -2.411 8.132 331 HA GLN 41 HA GLN 41 -10.362 -4.610 8.346 332 HB2 GLN 41 HB2 GLN 41 -10.952 -3.772 10.636 333 HB3 GLN 41 HB1 GLN 41 -9.371 -4.531 10.526 334 HG2 GLN 41 HG2 GLN 41 -8.362 -2.272 10.372 335 HG3 GLN 41 HG1 GLN 41 -9.964 -1.588 10.645 336 HE21 GLN 41 HE21 GLN 41 -10.935 -1.824 12.677 337 HE22 GLN 41 HE22 GLN 41 -10.008 -2.238 14.079 338 H GLN 42 HN GLN 42 -12.508 -3.972 8.126 339 HA GLN 42 HA GLN 42 -12.872 -1.124 7.547 340 HB2 GLN 42 HB2 GLN 42 -13.982 -1.497 5.625 341 HB3 GLN 42 HB1 GLN 42 -12.945 -2.917 5.627 342 HG2 GLN 42 HG2 GLN 42 -14.682 -4.239 5.638 343 HG3 GLN 42 HG1 GLN 42 -15.353 -3.472 7.060 344 HE21 GLN 42 HE21 GLN 42 -16.670 -4.506 4.630 345 HE22 GLN 42 HE22 GLN 42 -17.564 -3.170 4.002 346 H LYS 43 HN LYS 43 -15.376 -0.737 7.314 347 HA LYS 43 HA LYS 43 -17.087 -2.026 9.178 348 HB2 LYS 43 HB2 LYS 43 -15.708 -0.852 10.830 349 HB3 LYS 43 HB1 LYS 43 -15.929 0.660 9.956 350 HG2 LYS 43 HG2 LYS 43 -18.338 0.574 10.458 351 HG3 LYS 43 HG1 LYS 43 -18.077 -0.914 11.371 352 HD2 LYS 43 HD2 LYS 43 -18.183 0.965 12.894 353 HD3 LYS 43 HD1 LYS 43 -16.545 0.317 12.869 354 HE2 LYS 43 HE2 LYS 43 -15.991 2.111 11.182 355 HE3 LYS 43 HE1 LYS 43 -17.568 2.813 11.533 356 HZ1 LYS 43 HZ1 LYS 43 -15.557 3.698 12.789 357 HZ2 LYS 43 HZ2 LYS 43 -15.618 2.263 13.684 358 HZ3 LYS 43 HZ3 LYS 43 -16.937 3.322 13.695 359 H GLY 44 HN GLY 44 -18.589 -2.012 7.548 360 HA2 GLY 44 HA2 GLY 44 -20.388 -1.113 6.403 361 HA3 GLY 44 HA1 GLY 44 -19.979 0.461 7.074 362 H ASP 45 HN ASP 45 -18.507 1.783 6.004 363 HA ASP 45 HA ASP 45 -17.592 0.881 3.371 364 HB2 ASP 45 HB2 ASP 45 -19.092 3.438 3.951 365 HB3 ASP 45 HB1 ASP 45 -18.126 3.206 2.502 366 H ASP 46 HN ASP 46 -16.845 2.193 6.324 367 HA ASP 46 HA ASP 46 -14.633 3.841 5.331 368 HB2 ASP 46 HB2 ASP 46 -16.203 4.639 7.166 369 HB3 ASP 46 HB1 ASP 46 -15.446 3.444 8.205 370 H PHE 47 HN PHE 47 -12.616 3.143 5.326 371 HA PHE 47 HA PHE 47 -12.042 0.556 6.609 372 HB2 PHE 47 HB2 PHE 47 -10.913 1.832 4.122 373 HB3 PHE 47 HB1 PHE 47 -10.198 0.420 4.880 374 HD1 PHE 47 HD2 PHE 47 -13.740 1.340 4.176 375 HD2 PHE 47 HD1 PHE 47 -10.540 -1.374 3.522 376 HE1 PHE 47 HE2 PHE 47 -15.241 -0.104 2.864 377 HE2 PHE 47 HE1 PHE 47 -12.032 -2.826 2.209 378 HZ PHE 47 HZ PHE 47 -14.387 -2.191 1.876 379 H VAL 48 HN VAL 48 -10.061 0.226 7.585 380 HA VAL 48 HA VAL 48 -8.411 2.595 8.107 381 HB VAL 48 HB VAL 48 -8.911 0.512 10.228 382 HG11 VAL 48 HG11 VAL 48 -8.099 2.344 11.706 383 HG12 VAL 48 HG12 VAL 48 -7.764 3.297 10.260 384 HG13 VAL 48 HG13 VAL 48 -6.907 1.781 10.534 385 HG21 VAL 48 HG21 VAL 48 -10.398 2.210 11.328 386 HG22 VAL 48 HG22 VAL 48 -11.073 1.448 9.888 387 HG23 VAL 48 HG23 VAL 48 -10.420 3.084 9.796 388 H VAL 49 HN VAL 49 -6.659 2.111 6.988 389 HA VAL 49 HA VAL 49 -5.651 -0.631 6.976 390 HB VAL 49 HB VAL 49 -4.710 1.748 5.375 391 HG11 VAL 49 HG11 VAL 49 -2.961 0.097 5.670 392 HG12 VAL 49 HG12 VAL 49 -3.543 0.075 4.005 393 HG13 VAL 49 HG13 VAL 49 -4.046 -1.186 5.132 394 HG21 VAL 49 HG21 VAL 49 -6.363 -0.582 4.432 395 HG22 VAL 49 HG22 VAL 49 -5.949 0.884 3.539 396 HG23 VAL 49 HG23 VAL 49 -7.044 0.967 4.919 397 H THR 50 HN THR 50 -4.024 -1.252 8.177 398 HA THR 50 HA THR 50 -2.436 0.782 9.584 399 HB THR 50 HB THR 50 -2.914 -2.124 10.277 400 HG1 THR 50 HG1 THR 50 -3.935 0.230 11.532 401 HG21 THR 50 HG21 THR 50 -0.776 -1.354 11.114 402 HG22 THR 50 HG22 THR 50 -1.914 -1.512 12.453 403 HG23 THR 50 HG23 THR 50 -1.533 0.082 11.801 404 H SER 51 HN SER 51 -0.504 1.104 8.643 405 HA SER 51 HA SER 51 0.784 -1.126 7.258 406 HB2 SER 51 HB2 SER 51 1.748 1.729 7.321 407 HB3 SER 51 HB1 SER 51 2.121 0.475 6.138 408 HG SER 51 HG SER 51 -0.551 0.907 6.331 409 H LYS 52 HN LYS 52 1.621 -2.333 8.857 410 HA LYS 52 HA LYS 52 3.194 -1.183 11.005 411 HB2 LYS 52 HB2 LYS 52 2.304 -3.971 10.312 412 HB3 LYS 52 HB1 LYS 52 3.503 -3.682 11.563 413 HG2 LYS 52 HG2 LYS 52 1.897 -2.313 12.790 414 HG3 LYS 52 HG1 LYS 52 0.700 -2.592 11.525 415 HD2 LYS 52 HD2 LYS 52 0.707 -4.967 11.991 416 HD3 LYS 52 HD1 LYS 52 1.995 -4.750 13.178 417 HE2 LYS 52 HE2 LYS 52 0.547 -3.505 14.621 418 HE3 LYS 52 HE1 LYS 52 -0.707 -3.436 13.385 419 HZ1 LYS 52 HZ1 LYS 52 -1.044 -5.787 13.576 420 HZ2 LYS 52 HZ2 LYS 52 -1.147 -5.100 15.121 421 HZ3 LYS 52 HZ3 LYS 52 0.246 -5.937 14.665 422 H THR 53 HN THR 53 5.312 -0.818 10.808 423 HA THR 53 HA THR 53 6.895 -2.532 9.017 424 HB THR 53 HB THR 53 7.934 -0.719 7.918 425 HG1 THR 53 HG1 THR 53 6.625 1.375 9.157 426 HG21 THR 53 HG21 THR 53 5.102 0.274 8.192 427 HG22 THR 53 HG22 THR 53 5.523 -1.179 7.276 428 HG23 THR 53 HG23 THR 53 6.172 0.386 6.787 429 HA PRO 54 HA PRO 54 9.953 -2.333 12.220 430 HB2 PRO 54 HB2 PRO 54 12.190 -2.098 10.390 431 HB3 PRO 54 HB1 PRO 54 11.604 -3.540 11.240 432 HG2 PRO 54 HG2 PRO 54 11.463 -3.213 8.545 433 HG3 PRO 54 HG1 PRO 54 10.365 -4.240 9.484 434 HD2 PRO 54 HD2 PRO 54 9.910 -1.501 8.402 435 HD3 PRO 54 HD1 PRO 54 8.796 -2.881 8.498 436 H ARG 55 HN ARG 55 9.165 0.356 10.683 437 HA ARG 55 HA ARG 55 11.234 1.921 12.061 438 HB2 ARG 55 HB2 ARG 55 10.917 1.776 9.258 439 HB3 ARG 55 HB1 ARG 55 10.332 3.358 9.750 440 HG2 ARG 55 HG2 ARG 55 12.923 2.423 10.848 441 HG3 ARG 55 HG1 ARG 55 12.862 2.931 9.161 442 HD2 ARG 55 HD2 ARG 55 13.418 4.886 10.288 443 HD3 ARG 55 HD1 ARG 55 11.677 5.032 10.055 444 HE ARG 55 HE ARG 55 12.624 3.914 12.585 445 HH11 ARG 55 HH11 ARG 55 11.303 6.635 10.840 446 HH12 ARG 55 HH12 ARG 55 10.792 7.469 12.271 447 HH21 ARG 55 HH21 ARG 55 11.965 5.007 14.478 448 HH22 ARG 55 HH22 ARG 55 11.179 6.552 14.344 449 H GLN 56 HN GLN 56 8.120 2.247 10.350 450 HA GLN 56 HA GLN 56 7.014 3.581 12.669 451 HB2 GLN 56 HB2 GLN 56 8.134 5.368 11.287 452 HB3 GLN 56 HB1 GLN 56 6.998 4.986 9.998 453 HG2 GLN 56 HG2 GLN 56 5.140 5.593 11.443 454 HG3 GLN 56 HG1 GLN 56 6.261 5.943 12.757 455 HE21 GLN 56 HE21 GLN 56 7.628 7.771 12.579 456 HE22 GLN 56 HE22 GLN 56 7.232 9.075 11.516 457 H THR 57 HN THR 57 5.035 2.884 12.967 458 HA THR 57 HA THR 57 3.633 1.504 10.824 459 HB THR 57 HB THR 57 2.946 1.840 13.751 460 HG1 THR 57 HG1 THR 57 4.832 0.486 13.100 461 HG21 THR 57 HG21 THR 57 1.210 0.223 13.447 462 HG22 THR 57 HG22 THR 57 1.697 -0.069 11.779 463 HG23 THR 57 HG23 THR 57 0.985 1.479 12.226 464 H VAL 58 HN VAL 58 2.562 2.854 9.484 465 HA VAL 58 HA VAL 58 1.238 5.192 10.665 466 HB VAL 58 HB VAL 58 1.024 6.137 8.474 467 HG11 VAL 58 HG11 VAL 58 3.756 4.967 8.947 468 HG12 VAL 58 HG12 VAL 58 3.140 6.520 9.510 469 HG13 VAL 58 HG13 VAL 58 3.415 6.253 7.788 470 HG21 VAL 58 HG21 VAL 58 1.711 5.052 6.441 471 HG22 VAL 58 HG22 VAL 58 0.533 4.028 7.263 472 HG23 VAL 58 HG23 VAL 58 2.249 3.633 7.334 473 H THR 59 HN THR 59 -0.939 5.691 10.235 474 HA THR 59 HA THR 59 -2.569 3.354 9.490 475 HB THR 59 HB THR 59 -3.282 5.513 11.489 476 HG1 THR 59 HG1 THR 59 -1.756 4.200 12.418 477 HG21 THR 59 HG21 THR 59 -5.160 4.021 12.048 478 HG22 THR 59 HG22 THR 59 -4.694 2.963 10.718 479 HG23 THR 59 HG23 THR 59 -5.245 4.604 10.385 480 H ASN 60 HN ASN 60 -3.905 3.643 7.836 481 HA ASN 60 HA ASN 60 -4.469 6.415 6.929 482 HB2 ASN 60 HB2 ASN 60 -3.850 3.902 5.393 483 HB3 ASN 60 HB1 ASN 60 -4.821 5.171 4.659 484 HD21 ASN 60 HD21 ASN 60 -2.072 5.465 6.849 485 HD22 ASN 60 HD22 ASN 60 -1.055 6.320 5.739 486 H SER 61 HN SER 61 -6.622 6.924 6.857 487 HA SER 61 HA SER 61 -8.533 4.675 6.894 488 HB2 SER 61 HB2 SER 61 -9.362 7.237 8.141 489 HB3 SER 61 HB1 SER 61 -9.724 5.580 8.616 490 HG SER 61 HG SER 61 -7.191 5.772 9.011 491 H PHE 62 HN PHE 62 -10.524 4.990 5.764 492 HA PHE 62 HA PHE 62 -11.042 7.410 4.352 493 HB2 PHE 62 HB2 PHE 62 -10.768 6.440 2.050 494 HB3 PHE 62 HB1 PHE 62 -9.254 6.730 2.895 495 HD1 PHE 62 HD1 PHE 62 -11.581 4.146 1.697 496 HD2 PHE 62 HD2 PHE 62 -7.810 4.926 3.515 497 HE1 PHE 62 HE1 PHE 62 -10.908 1.817 1.281 498 HE2 PHE 62 HE2 PHE 62 -7.131 2.600 3.105 499 HZ PHE 62 HZ PHE 62 -8.671 1.041 1.983 500 H THR 63 HN THR 63 -12.911 7.184 2.900 501 HA THR 63 HA THR 63 -14.613 4.926 3.700 502 HB THR 63 HB THR 63 -15.739 7.613 2.978 503 HG1 THR 63 HG1 THR 63 -14.719 6.766 5.517 504 HG21 THR 63 HG21 THR 63 -17.269 5.704 3.128 505 HG22 THR 63 HG22 THR 63 -17.591 6.879 4.402 506 HG23 THR 63 HG23 THR 63 -16.719 5.391 4.774 507 H LEU 64 HN LEU 64 -15.604 3.838 2.126 508 HA LEU 64 HA LEU 64 -14.744 3.982 -0.517 509 HB2 LEU 64 HB2 LEU 64 -17.175 2.693 0.710 510 HB3 LEU 64 HB1 LEU 64 -16.743 2.498 -0.977 511 HG LEU 64 HG LEU 64 -15.136 1.597 1.412 512 HD11 LEU 64 HD11 LEU 64 -17.094 0.221 0.860 513 HD12 LEU 64 HD12 LEU 64 -15.578 -0.631 0.570 514 HD13 LEU 64 HD13 LEU 64 -16.487 0.038 -0.786 515 HD21 LEU 64 HD21 LEU 64 -13.585 2.335 -0.258 516 HD22 LEU 64 HD22 LEU 64 -14.481 1.505 -1.530 517 HD23 LEU 64 HD23 LEU 64 -13.637 0.573 -0.293 518 H GLY 65 HN GLY 65 -15.048 5.647 -1.836 519 HA2 GLY 65 HA2 GLY 65 -16.479 6.693 -3.433 520 HA3 GLY 65 HA1 GLY 65 -17.819 6.491 -2.318 521 H LYS 66 HN LYS 66 -15.101 7.607 -0.688 522 HA LYS 66 HA LYS 66 -15.794 10.415 -1.154 523 HB2 LYS 66 HB2 LYS 66 -16.023 8.929 1.423 524 HB3 LYS 66 HB1 LYS 66 -15.486 10.601 1.474 525 HG2 LYS 66 HG2 LYS 66 -17.531 11.225 0.204 526 HG3 LYS 66 HG1 LYS 66 -18.078 9.559 0.363 527 HD2 LYS 66 HD2 LYS 66 -17.444 11.407 2.663 528 HD3 LYS 66 HD1 LYS 66 -19.066 11.059 2.066 529 HE2 LYS 66 HE2 LYS 66 -18.641 8.645 2.559 530 HE3 LYS 66 HE1 LYS 66 -17.122 9.121 3.312 531 HZ1 LYS 66 HZ1 LYS 66 -19.081 8.819 4.836 532 HZ2 LYS 66 HZ2 LYS 66 -19.722 10.229 4.163 533 HZ3 LYS 66 HZ3 LYS 66 -18.250 10.284 4.985 534 H GLU 67 HN GLU 67 -14.173 11.905 -0.593 535 HA GLU 67 HA GLU 67 -11.498 10.843 -0.822 536 HB2 GLU 67 HB2 GLU 67 -12.054 12.839 -2.072 537 HB3 GLU 67 HB1 GLU 67 -12.552 13.667 -0.605 538 HG2 GLU 67 HG2 GLU 67 -10.203 13.487 0.214 539 HG3 GLU 67 HG1 GLU 67 -9.761 12.849 -1.371 540 H ALA 68 HN ALA 68 -10.070 10.561 0.797 541 HA ALA 68 HA ALA 68 -10.743 11.725 3.409 542 HB1 ALA 68 HB1 ALA 68 -10.193 9.672 4.528 543 HB2 ALA 68 HB2 ALA 68 -9.755 8.913 3.000 544 HB3 ALA 68 HB3 ALA 68 -11.434 9.351 3.316 545 H ASP 69 HN ASP 69 -9.060 12.250 4.717 546 HA ASP 69 HA ASP 69 -6.552 12.767 3.399 547 HB2 ASP 69 HB2 ASP 69 -7.714 14.370 4.966 548 HB3 ASP 69 HB1 ASP 69 -7.292 13.281 6.279 549 H ILE 70 HN ILE 70 -4.816 11.541 3.496 550 HA ILE 70 HA ILE 70 -4.538 9.641 5.710 551 HB ILE 70 HB ILE 70 -3.620 7.966 4.044 552 HG12 ILE 70 HG12 ILE 70 -4.925 8.317 1.760 553 HG13 ILE 70 HG11 ILE 70 -4.686 10.014 2.164 554 HG21 ILE 70 HG21 ILE 70 -5.691 7.491 5.051 555 HG22 ILE 70 HG22 ILE 70 -5.923 7.237 3.319 556 HG23 ILE 70 HG23 ILE 70 -6.521 8.708 4.082 557 HD11 ILE 70 HD11 ILE 70 -2.303 9.713 2.204 558 HD12 ILE 70 HD12 ILE 70 -2.929 9.061 0.689 559 HD13 ILE 70 HD13 ILE 70 -2.471 7.973 2.000 560 H THR 71 HN THR 71 -2.220 8.657 5.663 561 HA THR 71 HA THR 71 -0.323 10.717 4.730 562 HB THR 71 HB THR 71 -0.067 9.393 7.433 563 HG1 THR 71 HG1 THR 71 -1.938 10.947 7.039 564 HG21 THR 71 HG21 THR 71 2.021 10.218 6.465 565 HG22 THR 71 HG22 THR 71 1.534 11.220 7.836 566 HG23 THR 71 HG23 THR 71 1.283 11.796 6.187 567 H THR 72 HN THR 72 1.608 10.022 3.992 568 HA THR 72 HA THR 72 1.918 7.145 3.659 569 HB THR 72 HB THR 72 2.133 8.440 1.626 570 HG1 THR 72 HG1 THR 72 4.638 7.993 1.383 571 HG21 THR 72 HG21 THR 72 4.443 9.879 2.929 572 HG22 THR 72 HG22 THR 72 2.830 10.563 2.701 573 HG23 THR 72 HG23 THR 72 3.813 10.131 1.300 574 H MET 73 HN MET 73 4.164 6.279 3.834 575 HA MET 73 HA MET 73 5.163 6.707 6.460 576 HB2 MET 73 HB2 MET 73 5.113 4.578 4.942 577 HB3 MET 73 HB1 MET 73 6.656 5.185 4.365 578 HG2 MET 73 HG2 MET 73 7.717 4.759 6.324 579 HG3 MET 73 HG1 MET 73 6.260 4.984 7.294 580 HE1 MET 73 HE1 MET 73 4.325 1.673 6.795 581 HE2 MET 73 HE2 MET 73 4.212 2.916 5.544 582 HE3 MET 73 HE3 MET 73 4.264 3.381 7.245 583 H ASP 74 HN ASP 74 6.008 8.005 3.366 584 HA ASP 74 HA ASP 74 8.698 8.715 4.153 585 HB2 ASP 74 HB2 ASP 74 8.909 9.772 1.978 586 HB3 ASP 74 HB1 ASP 74 8.260 8.153 1.808 587 H GLY 75 HN GLY 75 5.779 9.908 4.962 588 HA2 GLY 75 HA2 GLY 75 5.349 11.764 6.275 589 HA3 GLY 75 HA1 GLY 75 6.978 12.329 5.954 590 H LYS 76 HN LYS 76 4.069 11.716 3.996 591 HA LYS 76 HA LYS 76 4.183 14.495 3.091 592 HB2 LYS 76 HB2 LYS 76 4.208 12.035 1.405 593 HB3 LYS 76 HB1 LYS 76 3.320 13.437 0.838 594 HG2 LYS 76 HG2 LYS 76 5.560 14.681 1.402 595 HG3 LYS 76 HG1 LYS 76 6.237 13.061 1.205 596 HD2 LYS 76 HD2 LYS 76 4.705 13.140 -0.980 597 HD3 LYS 76 HD1 LYS 76 5.003 14.868 -0.790 598 HE2 LYS 76 HE2 LYS 76 6.708 14.029 -2.216 599 HE3 LYS 76 HE1 LYS 76 7.447 14.338 -0.649 600 HZ1 LYS 76 HZ1 LYS 76 7.056 11.901 -0.181 601 HZ2 LYS 76 HZ2 LYS 76 8.248 12.264 -1.328 602 HZ3 LYS 76 HZ3 LYS 76 6.728 11.727 -1.835 603 H LYS 77 HN LYS 77 2.154 15.345 2.428 604 HA LYS 77 HA LYS 77 -0.087 14.030 3.736 605 HB2 LYS 77 HB2 LYS 77 0.090 16.233 4.461 606 HB3 LYS 77 HB1 LYS 77 0.601 16.814 2.885 607 HG2 LYS 77 HG2 LYS 77 -1.534 17.664 3.162 608 HG3 LYS 77 HG1 LYS 77 -1.726 16.277 2.092 609 HD2 LYS 77 HD2 LYS 77 -3.465 16.430 3.880 610 HD3 LYS 77 HD1 LYS 77 -2.555 14.919 3.885 611 HE2 LYS 77 HE2 LYS 77 -1.315 15.542 5.775 612 HE3 LYS 77 HE1 LYS 77 -1.750 17.241 5.607 613 HZ1 LYS 77 HZ1 LYS 77 -3.905 16.831 6.377 614 HZ2 LYS 77 HZ2 LYS 77 -2.918 15.929 7.413 615 HZ3 LYS 77 HZ3 LYS 77 -3.778 15.157 6.172 616 H LEU 78 HN LEU 78 -1.546 12.931 2.560 617 HA LEU 78 HA LEU 78 -2.035 13.755 -0.213 618 HB2 LEU 78 HB2 LEU 78 -1.833 10.852 0.504 619 HB3 LEU 78 HB1 LEU 78 -1.836 11.582 -1.087 620 HG LEU 78 HG LEU 78 0.440 12.220 0.722 621 HD11 LEU 78 HD11 LEU 78 0.173 9.619 -0.785 622 HD12 LEU 78 HD12 LEU 78 0.145 9.786 0.972 623 HD13 LEU 78 HD13 LEU 78 1.605 10.188 0.071 624 HD21 LEU 78 HD21 LEU 78 0.289 13.277 -1.450 625 HD22 LEU 78 HD22 LEU 78 0.133 11.705 -2.229 626 HD23 LEU 78 HD23 LEU 78 1.640 12.144 -1.428 627 H LYS 79 HN LYS 79 -4.088 13.205 -1.024 628 HA LYS 79 HA LYS 79 -5.982 12.085 0.931 629 HB2 LYS 79 HB2 LYS 79 -6.487 14.444 -0.896 630 HB3 LYS 79 HB1 LYS 79 -7.691 13.678 0.134 631 HG2 LYS 79 HG2 LYS 79 -6.517 14.370 2.107 632 HG3 LYS 79 HG1 LYS 79 -5.183 15.001 1.140 633 HD2 LYS 79 HD2 LYS 79 -7.022 16.460 0.028 634 HD3 LYS 79 HD1 LYS 79 -7.959 16.064 1.471 635 HE2 LYS 79 HE2 LYS 79 -5.163 17.088 1.736 636 HE3 LYS 79 HE1 LYS 79 -6.490 18.216 1.440 637 HZ1 LYS 79 HZ1 LYS 79 -6.180 18.042 3.780 638 HZ2 LYS 79 HZ2 LYS 79 -6.185 16.349 3.737 639 HZ3 LYS 79 HZ3 LYS 79 -7.608 17.213 3.412 640 H CYS 80 HN CYS 80 -6.895 10.306 0.134 641 HA CYS 80 HA CYS 80 -7.145 10.117 -2.801 642 HB2 CYS 80 HB2 CYS 80 -5.558 8.477 -1.854 643 HB3 CYS 80 HB1 CYS 80 -6.840 7.838 -0.829 644 H THR 81 HN THR 81 -9.011 9.258 -3.706 645 HA THR 81 HA THR 81 -11.353 9.235 -1.925 646 HB THR 81 HB THR 81 -11.585 10.962 -3.563 647 HG1 THR 81 HG1 THR 81 -13.071 8.634 -4.241 648 HG21 THR 81 HG21 THR 81 -11.630 10.022 -6.057 649 HG22 THR 81 HG22 THR 81 -10.454 8.907 -5.350 650 HG23 THR 81 HG23 THR 81 -10.165 10.646 -5.296 651 H VAL 82 HN VAL 82 -10.154 7.029 -1.673 652 HA VAL 82 HA VAL 82 -10.326 4.951 -3.479 653 HB VAL 82 HB VAL 82 -10.879 4.491 -0.562 654 HG11 VAL 82 HG11 VAL 82 -10.902 2.524 -1.913 655 HG12 VAL 82 HG12 VAL 82 -9.397 2.530 -0.992 656 HG13 VAL 82 HG13 VAL 82 -9.389 2.979 -2.699 657 HG21 VAL 82 HG21 VAL 82 -8.372 4.466 -0.277 658 HG22 VAL 82 HG22 VAL 82 -9.110 6.057 -0.456 659 HG23 VAL 82 HG23 VAL 82 -8.277 5.312 -1.820 660 H HIS 83 HN HIS 83 -11.867 3.570 -4.154 661 HA HIS 83 HA HIS 83 -14.424 3.406 -2.814 662 HB2 HIS 83 HB2 HIS 83 -15.740 3.994 -4.819 663 HB3 HIS 83 HB1 HIS 83 -14.791 5.345 -4.226 664 HD1 HIS 83 HD1 HIS 83 -15.363 3.258 -7.202 665 HD2 HIS 83 HD2 HIS 83 -12.568 6.044 -5.898 666 HE1 HIS 83 HE1 HIS 83 -14.052 3.901 -9.243 667 HE2 HIS 83 HE2 HIS 83 -12.501 5.725 -8.467 668 H LEU 84 HN LEU 84 -15.715 1.640 -3.549 669 HA LEU 84 HA LEU 84 -14.076 -0.495 -4.674 670 HB2 LEU 84 HB2 LEU 84 -15.263 -0.925 -2.583 671 HB3 LEU 84 HB1 LEU 84 -16.791 -0.539 -3.346 672 HG LEU 84 HG LEU 84 -16.455 -2.501 -4.864 673 HD11 LEU 84 HD11 LEU 84 -14.748 -4.029 -4.588 674 HD12 LEU 84 HD12 LEU 84 -14.387 -3.488 -2.949 675 HD13 LEU 84 HD13 LEU 84 -13.911 -2.497 -4.328 676 HD21 LEU 84 HD21 LEU 84 -16.974 -4.179 -3.108 677 HD22 LEU 84 HD22 LEU 84 -17.927 -2.701 -2.989 678 HD23 LEU 84 HD23 LEU 84 -16.573 -2.967 -1.890 679 H ALA 85 HN ALA 85 -14.071 -0.546 -6.817 680 HA ALA 85 HA ALA 85 -16.670 -0.377 -8.194 681 HB1 ALA 85 HB1 ALA 85 -14.015 0.653 -9.191 682 HB2 ALA 85 HB2 ALA 85 -15.378 1.633 -8.656 683 HB3 ALA 85 HB3 ALA 85 -15.520 0.643 -10.110 684 H ASN 86 HN ASN 86 -17.201 -2.221 -9.050 685 HA ASN 86 HA ASN 86 -17.158 -4.216 -10.116 686 HB2 ASN 86 HB2 ASN 86 -14.446 -3.316 -11.127 687 HB3 ASN 86 HB1 ASN 86 -15.380 -4.667 -11.760 688 HD21 ASN 86 HD21 ASN 86 -14.825 -1.323 -11.882 689 HD22 ASN 86 HD22 ASN 86 -16.084 -0.913 -12.993 690 H GLY 87 HN GLY 87 -16.329 -4.118 -7.414 691 HA2 GLY 87 HA2 GLY 87 -15.566 -5.650 -5.869 692 HA3 GLY 87 HA1 GLY 87 -15.126 -6.700 -7.204 693 H LYS 88 HN LYS 88 -13.794 -3.646 -7.559 694 HA LYS 88 HA LYS 88 -11.278 -4.486 -6.297 695 HB2 LYS 88 HB2 LYS 88 -10.200 -4.414 -8.257 696 HB3 LYS 88 HB1 LYS 88 -11.764 -4.285 -9.038 697 HG2 LYS 88 HG2 LYS 88 -10.761 -2.484 -9.961 698 HG3 LYS 88 HG1 LYS 88 -11.388 -1.715 -8.503 699 HD2 LYS 88 HD2 LYS 88 -9.138 -1.027 -8.697 700 HD3 LYS 88 HD1 LYS 88 -9.181 -2.244 -7.416 701 HE2 LYS 88 HE2 LYS 88 -7.275 -2.660 -8.814 702 HE3 LYS 88 HE1 LYS 88 -8.457 -3.933 -9.075 703 HZ1 LYS 88 HZ1 LYS 88 -7.329 -2.938 -11.101 704 HZ2 LYS 88 HZ2 LYS 88 -8.316 -1.581 -10.854 705 HZ3 LYS 88 HZ3 LYS 88 -9.016 -3.090 -11.157 706 H LEU 89 HN LEU 89 -10.129 -2.889 -5.238 707 HA LEU 89 HA LEU 89 -11.663 -0.486 -4.667 708 HB2 LEU 89 HB2 LEU 89 -10.029 -2.170 -3.148 709 HB3 LEU 89 HB1 LEU 89 -9.114 -0.682 -3.306 710 HG LEU 89 HG LEU 89 -11.058 0.564 -2.438 711 HD11 LEU 89 HD11 LEU 89 -12.718 -0.996 -1.157 712 HD12 LEU 89 HD12 LEU 89 -12.257 -2.149 -2.408 713 HD13 LEU 89 HD13 LEU 89 -12.975 -0.600 -2.855 714 HD21 LEU 89 HD21 LEU 89 -9.347 0.036 -0.889 715 HD22 LEU 89 HD22 LEU 89 -9.923 -1.626 -0.726 716 HD23 LEU 89 HD23 LEU 89 -10.890 -0.290 -0.096 717 H VAL 90 HN VAL 90 -11.300 1.322 -5.701 718 HA VAL 90 HA VAL 90 -8.749 1.641 -7.121 719 HB VAL 90 HB VAL 90 -11.340 3.132 -7.601 720 HG11 VAL 90 HG11 VAL 90 -9.631 4.493 -8.421 721 HG12 VAL 90 HG12 VAL 90 -10.155 3.578 -9.837 722 HG13 VAL 90 HG13 VAL 90 -8.680 3.118 -8.984 723 HG21 VAL 90 HG21 VAL 90 -11.521 1.738 -9.637 724 HG22 VAL 90 HG22 VAL 90 -11.671 0.810 -8.145 725 HG23 VAL 90 HG23 VAL 90 -10.163 0.772 -9.062 726 H CYS 91 HN CYS 91 -7.333 2.913 -6.205 727 HA CYS 91 HA CYS 91 -8.276 5.289 -4.744 728 HB2 CYS 91 HB2 CYS 91 -7.311 3.740 -3.132 729 HB3 CYS 91 HB1 CYS 91 -5.878 3.540 -4.129 730 H LYS 92 HN LYS 92 -8.162 6.445 -6.702 731 HA LYS 92 HA LYS 92 -5.492 6.698 -7.862 732 HB2 LYS 92 HB2 LYS 92 -7.387 6.219 -9.394 733 HB3 LYS 92 HB1 LYS 92 -8.144 7.732 -8.905 734 HG2 LYS 92 HG2 LYS 92 -6.152 8.939 -9.764 735 HG3 LYS 92 HG1 LYS 92 -5.531 7.402 -10.360 736 HD2 LYS 92 HD2 LYS 92 -6.564 8.227 -12.241 737 HD3 LYS 92 HD1 LYS 92 -7.859 7.253 -11.539 738 HE2 LYS 92 HE2 LYS 92 -8.771 9.368 -12.209 739 HE3 LYS 92 HE1 LYS 92 -8.731 9.310 -10.447 740 HZ1 LYS 92 HZ1 LYS 92 -6.613 10.614 -12.070 741 HZ2 LYS 92 HZ2 LYS 92 -6.855 10.731 -10.400 742 HZ3 LYS 92 HZ3 LYS 92 -7.958 11.444 -11.464 743 H SER 93 HN SER 93 -4.432 8.597 -8.019 744 HA SER 93 HA SER 93 -5.404 10.763 -6.285 745 HB2 SER 93 HB2 SER 93 -2.627 10.818 -7.286 746 HB3 SER 93 HB1 SER 93 -3.235 11.091 -5.652 747 HG SER 93 HG SER 93 -3.588 8.719 -5.648 748 H GLU 94 HN GLU 94 -3.831 12.858 -7.321 749 HA GLU 94 HA GLU 94 -5.325 13.430 -9.729 750 HB2 GLU 94 HB2 GLU 94 -3.235 15.081 -8.311 751 HB3 GLU 94 HB1 GLU 94 -4.276 15.645 -9.604 752 HG2 GLU 94 HG2 GLU 94 -6.235 15.169 -8.121 753 HG3 GLU 94 HG1 GLU 94 -5.086 14.842 -6.824 754 H LYS 95 HN LYS 95 -2.123 12.422 -8.878 755 HA LYS 95 HA LYS 95 -1.319 12.681 -11.700 756 HB2 LYS 95 HB2 LYS 95 -0.122 14.178 -10.072 757 HB3 LYS 95 HB1 LYS 95 0.518 12.732 -9.305 758 HG2 LYS 95 HG2 LYS 95 1.639 12.121 -11.389 759 HG3 LYS 95 HG1 LYS 95 1.006 13.578 -12.154 760 HD2 LYS 95 HD2 LYS 95 2.234 14.970 -10.600 761 HD3 LYS 95 HD1 LYS 95 2.801 13.546 -9.728 762 HE2 LYS 95 HE2 LYS 95 3.945 12.802 -11.796 763 HE3 LYS 95 HE1 LYS 95 3.462 14.305 -12.572 764 HZ1 LYS 95 HZ1 LYS 95 4.754 15.537 -11.008 765 HZ2 LYS 95 HZ2 LYS 95 5.741 14.336 -11.675 766 HZ3 LYS 95 HZ3 LYS 95 5.115 14.147 -10.117 767 H PHE 96 HN PHE 96 -1.662 10.543 -9.005 768 HA PHE 96 HA PHE 96 -0.374 8.401 -10.565 769 HB2 PHE 96 HB2 PHE 96 -0.439 8.383 -7.557 770 HB3 PHE 96 HB1 PHE 96 0.575 7.442 -8.642 771 HD1 PHE 96 HD1 PHE 96 0.034 10.796 -7.211 772 HD2 PHE 96 HD2 PHE 96 2.663 8.267 -9.400 773 HE1 PHE 96 HE1 PHE 96 1.837 12.444 -6.938 774 HE2 PHE 96 HE2 PHE 96 4.470 9.908 -9.130 775 HZ PHE 96 HZ PHE 96 4.060 12.004 -7.898 776 H SER 97 HN SER 97 -1.051 6.201 -9.227 777 HA SER 97 HA SER 97 -3.763 6.176 -8.355 778 HB2 SER 97 HB2 SER 97 -3.973 6.366 -10.870 779 HB3 SER 97 HB1 SER 97 -3.221 4.774 -10.975 780 HG SER 97 HG SER 97 -5.423 4.475 -10.957 781 H HIS 98 HN HIS 98 -4.282 4.343 -7.296 782 HA HIS 98 HA HIS 98 -2.276 2.183 -7.197 783 HB2 HIS 98 HB2 HIS 98 -2.382 3.592 -5.131 784 HB3 HIS 98 HB1 HIS 98 -4.083 3.179 -4.975 785 HD2 HIS 98 HD2 HIS 98 -3.831 -0.097 -5.308 786 HE1 HIS 98 HE1 HIS 98 -1.094 0.252 -2.113 787 HE2 HIS 98 HE2 HIS 98 -2.599 -1.337 -3.386 788 H GLU 99 HN GLU 99 -3.062 0.306 -7.927 789 HA GLU 99 HA GLU 99 -5.990 -0.057 -7.844 790 HB2 GLU 99 HB2 GLU 99 -6.002 -0.840 -9.977 791 HB3 GLU 99 HB1 GLU 99 -4.541 0.130 -10.087 792 HG2 GLU 99 HG2 GLU 99 -3.168 -1.693 -10.170 793 HG3 GLU 99 HG1 GLU 99 -4.294 -2.724 -9.288 794 H GLN 100 HN GLN 100 -6.778 -1.760 -6.757 795 HA GLN 100 HA GLN 100 -5.096 -4.105 -6.323 796 HB2 GLN 100 HB2 GLN 100 -5.792 -4.113 -3.875 797 HB3 GLN 100 HB1 GLN 100 -4.564 -2.947 -4.338 798 HG2 GLN 100 HG2 GLN 100 -6.193 -1.162 -4.325 799 HG3 GLN 100 HG1 GLN 100 -7.486 -2.311 -3.991 800 HE21 GLN 100 HE21 GLN 100 -4.377 -2.687 -2.519 801 HE22 GLN 100 HE22 GLN 100 -4.851 -2.222 -0.926 802 H GLU 101 HN GLU 101 -6.207 -5.945 -6.497 803 HA GLU 101 HA GLU 101 -9.127 -5.852 -6.166 804 HB2 GLU 101 HB2 GLU 101 -8.751 -5.837 -8.540 805 HB3 GLU 101 HB1 GLU 101 -7.572 -7.137 -8.417 806 HG2 GLU 101 HG2 GLU 101 -9.228 -8.742 -7.990 807 HG3 GLU 101 HG1 GLU 101 -10.440 -7.521 -7.612 808 H VAL 102 HN VAL 102 -10.026 -7.524 -5.113 809 HA VAL 102 HA VAL 102 -8.211 -9.530 -3.997 810 HB VAL 102 HB VAL 102 -10.940 -8.558 -3.143 811 HG11 VAL 102 HG11 VAL 102 -10.985 -10.933 -2.804 812 HG12 VAL 102 HG12 VAL 102 -10.741 -10.149 -1.244 813 HG13 VAL 102 HG13 VAL 102 -9.381 -10.906 -2.070 814 HG21 VAL 102 HG21 VAL 102 -9.726 -8.031 -1.049 815 HG22 VAL 102 HG22 VAL 102 -9.143 -7.139 -2.454 816 HG23 VAL 102 HG23 VAL 102 -8.228 -8.517 -1.842 817 H LYS 103 HN LYS 103 -8.142 -11.411 -5.007 818 HA LYS 103 HA LYS 103 -10.583 -12.406 -6.308 819 HB2 LYS 103 HB2 LYS 103 -7.693 -12.976 -6.994 820 HB3 LYS 103 HB1 LYS 103 -9.089 -13.676 -7.796 821 HG2 LYS 103 HG2 LYS 103 -9.767 -11.466 -8.569 822 HG3 LYS 103 HG1 LYS 103 -8.369 -10.757 -7.758 823 HD2 LYS 103 HD2 LYS 103 -6.938 -12.295 -9.151 824 HD3 LYS 103 HD1 LYS 103 -8.386 -12.661 -10.087 825 HE2 LYS 103 HE2 LYS 103 -8.600 -10.387 -10.783 826 HE3 LYS 103 HE1 LYS 103 -7.352 -9.864 -9.651 827 HZ1 LYS 103 HZ1 LYS 103 -5.784 -11.304 -10.944 828 HZ2 LYS 103 HZ2 LYS 103 -6.370 -9.956 -11.783 829 HZ3 LYS 103 HZ3 LYS 103 -7.002 -11.490 -12.105 830 H GLY 104 HN GLY 104 -11.337 -13.454 -4.471 831 HA2 GLY 104 HA2 GLY 104 -11.650 -15.405 -3.284 832 HA3 GLY 104 HA1 GLY 104 -10.213 -16.062 -4.052 833 H ASN 105 HN ASN 105 -8.281 -15.992 -3.005 834 HA ASN 105 HA ASN 105 -8.316 -14.834 -0.290 835 HB2 ASN 105 HB2 ASN 105 -8.235 -17.466 -0.746 836 HB3 ASN 105 HB1 ASN 105 -6.516 -17.122 -0.900 837 HD21 ASN 105 HD21 ASN 105 -5.855 -18.119 0.929 838 HD22 ASN 105 HD22 ASN 105 -6.286 -17.595 2.520 839 H GLU 106 HN GLU 106 -7.186 -14.214 -3.186 840 HA GLU 106 HA GLU 106 -4.569 -13.306 -2.194 841 HB2 GLU 106 HB2 GLU 106 -5.264 -14.505 -4.863 842 HB3 GLU 106 HB1 GLU 106 -3.826 -13.521 -4.637 843 HG2 GLU 106 HG2 GLU 106 -2.917 -15.073 -3.080 844 HG3 GLU 106 HG1 GLU 106 -4.427 -15.977 -3.014 845 H MET 107 HN MET 107 -4.099 -11.240 -2.481 846 HA MET 107 HA MET 107 -5.975 -9.594 -4.035 847 HB2 MET 107 HB2 MET 107 -5.831 -9.162 -1.560 848 HB3 MET 107 HB1 MET 107 -4.150 -8.706 -1.796 849 HG2 MET 107 HG2 MET 107 -5.730 -7.233 -3.634 850 HG3 MET 107 HG1 MET 107 -6.464 -7.095 -2.037 851 HE1 MET 107 HE1 MET 107 -3.465 -5.676 0.071 852 HE2 MET 107 HE2 MET 107 -3.846 -7.380 -0.160 853 HE3 MET 107 HE3 MET 107 -5.143 -6.218 0.107 854 H VAL 108 HN VAL 108 -5.192 -8.943 -5.894 855 HA VAL 108 HA VAL 108 -2.285 -8.705 -6.213 856 HB VAL 108 HB VAL 108 -2.954 -8.615 -8.721 857 HG11 VAL 108 HG11 VAL 108 -1.693 -10.433 -7.884 858 HG12 VAL 108 HG12 VAL 108 -3.049 -11.139 -8.763 859 HG13 VAL 108 HG13 VAL 108 -3.075 -11.083 -7.000 860 HG21 VAL 108 HG21 VAL 108 -5.000 -9.829 -9.274 861 HG22 VAL 108 HG22 VAL 108 -5.366 -8.365 -8.364 862 HG23 VAL 108 HG23 VAL 108 -5.416 -9.934 -7.563 863 H GLU 109 HN GLU 109 -1.499 -6.693 -6.120 864 HA GLU 109 HA GLU 109 -3.156 -4.567 -7.258 865 HB2 GLU 109 HB2 GLU 109 -2.807 -3.116 -5.445 866 HB3 GLU 109 HB1 GLU 109 -3.274 -4.655 -4.740 867 HG2 GLU 109 HG2 GLU 109 -0.727 -5.041 -4.524 868 HG3 GLU 109 HG1 GLU 109 -0.628 -3.292 -4.745 869 H THR 110 HN THR 110 -2.113 -2.788 -8.070 870 HA THR 110 HA THR 110 0.796 -2.908 -8.362 871 HB THR 110 HB THR 110 -1.146 -2.502 -10.645 872 HG1 THR 110 HG1 THR 110 -0.491 -4.715 -9.806 873 HG21 THR 110 HG21 THR 110 1.043 -2.466 -11.988 874 HG22 THR 110 HG22 THR 110 1.822 -2.118 -10.446 875 HG23 THR 110 HG23 THR 110 0.613 -1.011 -11.088 876 H ILE 111 HN ILE 111 1.669 -1.021 -7.861 877 HA ILE 111 HA ILE 111 -0.097 1.357 -7.882 878 HB ILE 111 HB ILE 111 2.292 1.307 -6.095 879 HG12 ILE 111 HG12 ILE 111 -0.262 -0.015 -5.194 880 HG13 ILE 111 HG11 ILE 111 1.065 -0.945 -5.887 881 HG21 ILE 111 HG21 ILE 111 0.857 2.621 -4.655 882 HG22 ILE 111 HG22 ILE 111 -0.525 2.303 -5.704 883 HG23 ILE 111 HG23 ILE 111 0.825 3.269 -6.294 884 HD11 ILE 111 HD11 ILE 111 2.546 -0.022 -4.129 885 HD12 ILE 111 HD12 ILE 111 1.230 -1.021 -3.514 886 HD13 ILE 111 HD13 ILE 111 1.131 0.736 -3.399 887 H THR 112 HN THR 112 1.061 3.425 -8.229 888 HA THR 112 HA THR 112 3.718 3.185 -9.425 889 HB THR 112 HB THR 112 1.563 4.762 -10.835 890 HG1 THR 112 HG1 THR 112 1.198 2.402 -10.848 891 HG21 THR 112 HG21 THR 112 3.984 5.360 -11.128 892 HG22 THR 112 HG22 THR 112 3.150 4.901 -12.617 893 HG23 THR 112 HG23 THR 112 4.229 3.756 -11.820 894 H PHE 113 HN PHE 113 4.914 4.540 -8.251 895 HA PHE 113 HA PHE 113 4.003 7.288 -7.914 896 HB2 PHE 113 HB2 PHE 113 4.314 5.351 -5.684 897 HB3 PHE 113 HB1 PHE 113 5.002 6.948 -5.436 898 HD1 PHE 113 HD2 PHE 113 1.912 5.052 -5.934 899 HD2 PHE 113 HD1 PHE 113 3.601 8.885 -5.191 900 HE1 PHE 113 HE2 PHE 113 -0.308 5.901 -5.295 901 HE2 PHE 113 HE1 PHE 113 1.385 9.742 -4.549 902 HZ PHE 113 HZ PHE 113 -0.572 8.250 -4.602 903 H GLY 114 HN GLY 114 5.659 8.760 -7.712 904 HA2 GLY 114 HA2 GLY 114 7.792 9.591 -7.875 905 HA3 GLY 114 HA1 GLY 114 8.339 8.103 -7.125 906 H GLY 115 HN GLY 115 6.523 7.737 -10.017 907 HA2 GLY 115 HA2 GLY 115 7.173 7.408 -12.221 908 HA3 GLY 115 HA1 GLY 115 8.827 7.787 -11.767 909 H VAL 116 HN VAL 116 7.316 5.476 -9.752 910 HA VAL 116 HA VAL 116 8.616 3.293 -11.246 911 HB VAL 116 HB VAL 116 8.454 3.375 -8.238 912 HG11 VAL 116 HG11 VAL 116 10.172 1.679 -8.353 913 HG12 VAL 116 HG12 VAL 116 10.237 1.834 -10.111 914 HG13 VAL 116 HG13 VAL 116 8.785 1.206 -9.333 915 HG21 VAL 116 HG21 VAL 116 10.631 4.450 -10.009 916 HG22 VAL 116 HG22 VAL 116 10.899 3.993 -8.328 917 HG23 VAL 116 HG23 VAL 116 9.762 5.282 -8.720 918 H THR 117 HN THR 117 7.335 1.641 -11.703 919 HA THR 117 HA THR 117 4.655 1.560 -10.554 920 HB THR 117 HB THR 117 5.574 -0.413 -12.592 921 HG1 THR 117 HG1 THR 117 5.911 2.207 -12.896 922 HG21 THR 117 HG21 THR 117 3.282 -0.521 -11.772 923 HG22 THR 117 HG22 THR 117 3.296 -0.025 -13.464 924 HG23 THR 117 HG23 THR 117 3.031 1.173 -12.199 925 H LEU 118 HN LEU 118 4.869 0.669 -8.544 926 HA LEU 118 HA LEU 118 6.481 -1.707 -8.202 927 HB2 LEU 118 HB2 LEU 118 6.552 -0.023 -6.454 928 HB3 LEU 118 HB1 LEU 118 4.817 -0.141 -6.234 929 HG LEU 118 HG LEU 118 4.972 -2.278 -5.227 930 HD11 LEU 118 HD11 LEU 118 6.536 -3.323 -6.745 931 HD12 LEU 118 HD12 LEU 118 7.089 -3.527 -5.083 932 HD13 LEU 118 HD13 LEU 118 7.848 -2.323 -6.126 933 HD21 LEU 118 HD21 LEU 118 7.451 -1.054 -4.116 934 HD22 LEU 118 HD22 LEU 118 6.088 -1.808 -3.288 935 HD23 LEU 118 HD23 LEU 118 5.914 -0.195 -3.973 936 H ILE 119 HN ILE 119 5.617 -3.451 -9.070 937 HA ILE 119 HA ILE 119 2.811 -4.081 -8.721 938 HB ILE 119 HB ILE 119 5.069 -5.404 -10.236 939 HG12 ILE 119 HG12 ILE 119 3.299 -5.008 -12.098 940 HG13 ILE 119 HG11 ILE 119 2.567 -3.895 -10.953 941 HG21 ILE 119 HG21 ILE 119 3.384 -7.044 -11.045 942 HG22 ILE 119 HG22 ILE 119 2.241 -6.418 -9.854 943 HG23 ILE 119 HG23 ILE 119 3.732 -7.199 -9.323 944 HD11 ILE 119 HD11 ILE 119 4.693 -2.660 -10.883 945 HD12 ILE 119 HD12 ILE 119 3.951 -2.688 -12.482 946 HD13 ILE 119 HD13 ILE 119 5.329 -3.736 -12.125 947 H ARG 120 HN ARG 120 2.104 -5.292 -7.048 948 HA ARG 120 HA ARG 120 3.973 -7.187 -5.831 949 HB2 ARG 120 HB2 ARG 120 2.923 -6.379 -3.573 950 HB3 ARG 120 HB1 ARG 120 4.286 -5.525 -4.276 951 HG2 ARG 120 HG2 ARG 120 2.756 -3.869 -5.227 952 HG3 ARG 120 HG1 ARG 120 1.395 -4.723 -4.500 953 HD2 ARG 120 HD2 ARG 120 3.557 -4.062 -2.637 954 HD3 ARG 120 HD1 ARG 120 2.742 -2.662 -3.333 955 HE ARG 120 HE ARG 120 0.696 -4.274 -2.547 956 HH11 ARG 120 HH11 ARG 120 3.512 -3.002 -0.890 957 HH12 ARG 120 HH12 ARG 120 2.708 -2.876 0.636 958 HH21 ARG 120 HH21 ARG 120 -0.361 -4.117 -0.583 959 HH22 ARG 120 HH22 ARG 120 0.488 -3.526 0.819 960 H ARG 121 HN ARG 121 2.948 -8.766 -4.442 961 HA ARG 121 HA ARG 121 0.119 -9.218 -5.067 962 HB2 ARG 121 HB2 ARG 121 2.438 -11.139 -5.123 963 HB3 ARG 121 HB1 ARG 121 0.789 -11.702 -4.874 964 HG2 ARG 121 HG2 ARG 121 0.444 -11.670 -7.039 965 HG3 ARG 121 HG1 ARG 121 0.801 -9.949 -7.091 966 HD2 ARG 121 HD2 ARG 121 2.941 -12.047 -7.095 967 HD3 ARG 121 HD1 ARG 121 2.199 -11.450 -8.581 968 HE ARG 121 HE ARG 121 3.230 -9.409 -6.820 969 HH11 ARG 121 HH11 ARG 121 3.909 -11.559 -9.492 970 HH12 ARG 121 HH12 ARG 121 5.167 -10.558 -10.151 971 HH21 ARG 121 HH21 ARG 121 4.897 -8.066 -7.705 972 HH22 ARG 121 HH22 ARG 121 5.725 -8.595 -9.139 973 H SER 122 HN SER 122 -1.072 -9.479 -3.303 974 HA SER 122 HA SER 122 0.332 -10.109 -0.804 975 HB2 SER 122 HB2 SER 122 -2.129 -8.396 -0.929 976 HB3 SER 122 HB1 SER 122 -0.935 -8.517 0.360 977 HG SER 122 HG SER 122 -0.988 -6.749 -1.577 978 H LYS 123 HN LYS 123 -0.119 -12.078 -0.264 979 HA LYS 123 HA LYS 123 -2.687 -13.277 -0.883 980 HB2 LYS 123 HB2 LYS 123 -1.675 -15.346 -0.030 981 HB3 LYS 123 HB1 LYS 123 -0.662 -14.589 -1.248 982 HG2 LYS 123 HG2 LYS 123 1.018 -14.764 0.163 983 HG3 LYS 123 HG1 LYS 123 0.242 -13.534 1.155 984 HD2 LYS 123 HD2 LYS 123 -1.036 -15.356 2.289 985 HD3 LYS 123 HD1 LYS 123 -0.058 -16.528 1.408 986 HE2 LYS 123 HE2 LYS 123 1.948 -15.729 2.462 987 HE3 LYS 123 HE1 LYS 123 1.067 -14.400 3.214 988 HZ1 LYS 123 HZ1 LYS 123 -0.095 -15.891 4.601 989 HZ2 LYS 123 HZ2 LYS 123 1.539 -16.332 4.689 990 HZ3 LYS 123 HZ3 LYS 123 0.471 -17.249 3.755 991 H ARG 124 HN ARG 124 -4.110 -14.124 0.696 992 HA ARG 124 HA ARG 124 -4.140 -12.603 3.139 993 HB2 ARG 124 HB2 ARG 124 -6.066 -13.934 1.575 994 HB3 ARG 124 HB1 ARG 124 -6.029 -14.754 3.130 995 HG2 ARG 124 HG2 ARG 124 -6.341 -12.589 4.251 996 HG3 ARG 124 HG1 ARG 124 -6.492 -11.827 2.668 997 HD2 ARG 124 HD2 ARG 124 -8.697 -12.219 3.451 998 HD3 ARG 124 HD1 ARG 124 -8.382 -13.409 2.192 999 HE ARG 124 HE ARG 124 -8.118 -15.074 3.914 1000 HH11 ARG 124 HH11 ARG 124 -9.514 -12.026 4.947 1001 HH12 ARG 124 HH12 ARG 124 -10.194 -12.687 6.397 1002 HH21 ARG 124 HH21 ARG 124 -9.041 -15.937 5.817 1003 HH22 ARG 124 HH22 ARG 124 -9.934 -14.903 6.886 1004 H VAL 125 HN VAL 125 -4.554 -13.655 5.192 1005 HA VAL 125 HA VAL 125 -3.543 -14.696 6.917 1006 HB VAL 125 HB VAL 125 -4.165 -17.092 7.067 1007 HG11 VAL 125 HG11 VAL 125 -5.728 -15.448 7.804 1008 HG12 VAL 125 HG12 VAL 125 -6.622 -16.662 6.890 1009 HG13 VAL 125 HG13 VAL 125 -6.234 -15.109 6.148 1010 HG21 VAL 125 HG21 VAL 125 -3.957 -17.882 4.834 1011 HG22 VAL 125 HG22 VAL 125 -5.053 -16.640 4.224 1012 HG23 VAL 125 HG23 VAL 125 -5.673 -17.944 5.236 Start of MODEL 15 1 H1 ALA 1 HT1 ALA 1 -14.435 -10.154 -0.215 2 H2 ALA 1 HT2 ALA 1 -13.089 -10.694 0.650 3 H3 ALA 1 HT3 ALA 1 -12.884 -9.672 -0.680 4 HA ALA 1 HA ALA 1 -14.148 -7.936 0.503 5 HB1 ALA 1 HB1 ALA 1 -13.799 -9.824 2.836 6 HB2 ALA 1 HB2 ALA 1 -15.330 -9.395 2.068 7 HB3 ALA 1 HB3 ALA 1 -14.400 -8.169 2.928 8 H PHE 2 HN PHE 2 -12.852 -6.295 1.200 9 HA PHE 2 HA PHE 2 -10.027 -6.761 1.120 10 HB2 PHE 2 HB2 PHE 2 -11.766 -4.340 1.422 11 HB3 PHE 2 HB1 PHE 2 -10.044 -4.227 1.767 12 HD1 PHE 2 HD2 PHE 2 -12.449 -5.256 -0.876 13 HD2 PHE 2 HD1 PHE 2 -8.522 -3.885 0.041 14 HE1 PHE 2 HE2 PHE 2 -11.987 -4.958 -3.276 15 HE2 PHE 2 HE1 PHE 2 -8.070 -3.577 -2.355 16 HZ PHE 2 HZ PHE 2 -9.797 -4.124 -4.020 17 H SER 3 HN SER 3 -12.408 -6.211 3.610 18 HA SER 3 HA SER 3 -10.708 -5.564 5.747 19 HB2 SER 3 HB2 SER 3 -12.965 -7.119 6.616 20 HB3 SER 3 HB1 SER 3 -12.703 -5.378 6.752 21 HG SER 3 HG SER 3 -14.438 -6.616 5.214 22 H GLY 4 HN GLY 4 -8.910 -6.852 5.920 23 HA2 GLY 4 HA2 GLY 4 -9.122 -9.282 7.311 24 HA3 GLY 4 HA1 GLY 4 -8.832 -9.630 5.614 25 H THR 5 HN THR 5 -6.838 -10.575 6.160 26 HA THR 5 HA THR 5 -4.744 -8.581 6.682 27 HB THR 5 HB THR 5 -3.490 -10.571 7.722 28 HG1 THR 5 HG1 THR 5 -4.635 -12.365 7.800 29 HG21 THR 5 HG21 THR 5 -4.222 -8.627 8.992 30 HG22 THR 5 HG22 THR 5 -4.475 -10.101 9.934 31 HG23 THR 5 HG23 THR 5 -5.838 -9.314 9.141 32 H TRP 6 HN TRP 6 -3.447 -8.394 4.984 33 HA TRP 6 HA TRP 6 -3.043 -10.747 3.240 34 HB2 TRP 6 HB2 TRP 6 -2.775 -7.890 2.361 35 HB3 TRP 6 HB1 TRP 6 -3.018 -9.330 1.374 36 HD1 TRP 6 HD1 TRP 6 -4.924 -6.903 3.641 37 HE1 TRP 6 HE1 TRP 6 -7.439 -7.118 3.138 38 HE3 TRP 6 HE3 TRP 6 -4.781 -10.983 0.566 39 HZ2 TRP 6 HZ2 TRP 6 -9.135 -8.827 1.667 40 HZ3 TRP 6 HZ3 TRP 6 -6.898 -11.861 -0.325 41 HH2 TRP 6 HH2 TRP 6 -9.029 -10.803 0.210 42 H GLN 7 HN GLN 7 -1.050 -11.484 2.995 43 HA GLN 7 HA GLN 7 1.193 -9.886 4.020 44 HB2 GLN 7 HB2 GLN 7 0.693 -12.282 4.822 45 HB3 GLN 7 HB1 GLN 7 1.288 -12.800 3.250 46 HG2 GLN 7 HG2 GLN 7 3.443 -11.836 3.693 47 HG3 GLN 7 HG1 GLN 7 2.863 -11.152 5.212 48 HE21 GLN 7 HE21 GLN 7 2.517 -12.502 6.963 49 HE22 GLN 7 HE22 GLN 7 3.168 -14.105 7.031 50 H VAL 8 HN VAL 8 2.205 -8.752 2.535 51 HA VAL 8 HA VAL 8 2.004 -9.370 -0.270 52 HB VAL 8 HB VAL 8 3.122 -7.093 1.297 53 HG11 VAL 8 HG11 VAL 8 3.679 -7.495 -1.636 54 HG12 VAL 8 HG12 VAL 8 4.884 -7.599 -0.353 55 HG13 VAL 8 HG13 VAL 8 4.073 -6.067 -0.679 56 HG21 VAL 8 HG21 VAL 8 1.287 -7.235 -1.079 57 HG22 VAL 8 HG22 VAL 8 1.634 -5.812 -0.093 58 HG23 VAL 8 HG23 VAL 8 0.765 -7.177 0.605 59 H TYR 9 HN TYR 9 3.509 -10.057 -1.684 60 HA TYR 9 HA TYR 9 6.275 -10.451 -0.838 61 HB2 TYR 9 HB2 TYR 9 6.290 -12.806 -1.584 62 HB3 TYR 9 HB1 TYR 9 5.199 -12.572 -0.229 63 HD1 TYR 9 HD2 TYR 9 2.689 -12.358 -0.745 64 HD2 TYR 9 HD1 TYR 9 5.532 -13.812 -3.558 65 HE1 TYR 9 HE2 TYR 9 0.875 -13.415 -2.026 66 HE2 TYR 9 HE1 TYR 9 3.726 -14.875 -4.838 67 HH TYR 9 HH TYR 9 0.534 -14.128 -4.483 68 H ALA 10 HN ALA 10 7.695 -10.185 -2.543 69 HA ALA 10 HA ALA 10 7.152 -10.637 -5.258 70 HB1 ALA 10 HB1 ALA 10 6.370 -8.702 -6.134 71 HB2 ALA 10 HB2 ALA 10 7.193 -7.698 -4.940 72 HB3 ALA 10 HB3 ALA 10 5.687 -8.510 -4.518 73 H GLN 11 HN GLN 11 8.838 -9.818 -6.678 74 HA GLN 11 HA GLN 11 11.209 -8.797 -5.277 75 HB2 GLN 11 HB2 GLN 11 10.923 -11.279 -6.890 76 HB3 GLN 11 HB1 GLN 11 12.375 -10.334 -7.163 77 HG2 GLN 11 HG2 GLN 11 13.091 -11.767 -5.549 78 HG3 GLN 11 HG1 GLN 11 12.565 -10.401 -4.564 79 HE21 GLN 11 HE21 GLN 11 12.215 -11.681 -2.762 80 HE22 GLN 11 HE22 GLN 11 10.891 -12.792 -2.653 81 H GLU 12 HN GLU 12 9.246 -7.428 -6.802 82 HA GLU 12 HA GLU 12 10.391 -6.888 -9.411 83 HB2 GLU 12 HB2 GLU 12 7.837 -6.497 -8.115 84 HB3 GLU 12 HB1 GLU 12 8.352 -5.030 -8.900 85 HG2 GLU 12 HG2 GLU 12 7.255 -5.993 -10.627 86 HG3 GLU 12 HG1 GLU 12 8.844 -6.710 -10.888 87 H ASN 13 HN ASN 13 9.708 -4.169 -9.530 88 HA ASN 13 HA ASN 13 12.019 -2.810 -8.810 89 HB2 ASN 13 HB2 ASN 13 10.418 -0.780 -9.233 90 HB3 ASN 13 HB1 ASN 13 10.764 -1.894 -10.564 91 HD21 ASN 13 HD21 ASN 13 8.972 -2.311 -11.654 92 HD22 ASN 13 HD22 ASN 13 7.393 -2.481 -10.997 93 H TYR 14 HN TYR 14 10.743 -4.048 -6.408 94 HA TYR 14 HA TYR 14 9.496 -2.207 -4.748 95 HB2 TYR 14 HB2 TYR 14 9.659 -4.636 -4.323 96 HB3 TYR 14 HB1 TYR 14 11.369 -4.439 -3.953 97 HD1 TYR 14 HD1 TYR 14 12.073 -3.346 -1.886 98 HD2 TYR 14 HD2 TYR 14 7.953 -3.942 -2.754 99 HE1 TYR 14 HE1 TYR 14 11.521 -2.888 0.455 100 HE2 TYR 14 HE2 TYR 14 7.391 -3.487 -0.405 101 HH TYR 14 HH TYR 14 9.284 -3.698 2.007 102 H GLU 15 HN GLU 15 12.947 -3.153 -4.551 103 HA GLU 15 HA GLU 15 13.589 -1.009 -2.831 104 HB2 GLU 15 HB2 GLU 15 15.956 -1.611 -3.283 105 HB3 GLU 15 HB1 GLU 15 14.960 -2.969 -2.789 106 HG2 GLU 15 HG2 GLU 15 14.818 -3.732 -5.090 107 HG3 GLU 15 HG1 GLU 15 15.773 -2.346 -5.618 108 H GLU 16 HN GLU 16 13.368 -1.217 -6.280 109 HA GLU 16 HA GLU 16 15.017 1.048 -6.842 110 HB2 GLU 16 HB2 GLU 16 14.602 -0.593 -8.590 111 HB3 GLU 16 HB1 GLU 16 12.871 -0.300 -8.498 112 HG2 GLU 16 HG2 GLU 16 12.999 1.678 -9.622 113 HG3 GLU 16 HG1 GLU 16 14.650 1.999 -9.102 114 H PHE 17 HN PHE 17 11.548 0.513 -6.424 115 HA PHE 17 HA PHE 17 10.755 3.172 -6.991 116 HB2 PHE 17 HB2 PHE 17 9.116 1.428 -7.129 117 HB3 PHE 17 HB1 PHE 17 9.406 0.930 -5.464 118 HD1 PHE 17 HD1 PHE 17 8.776 4.291 -6.987 119 HD2 PHE 17 HD2 PHE 17 7.471 1.266 -4.309 120 HE1 PHE 17 HE1 PHE 17 6.939 5.738 -6.254 121 HE2 PHE 17 HE2 PHE 17 5.631 2.706 -3.569 122 HZ PHE 17 HZ PHE 17 5.361 4.948 -4.537 123 H LEU 18 HN LEU 18 11.861 1.536 -4.095 124 HA LEU 18 HA LEU 18 11.048 3.394 -2.176 125 HB2 LEU 18 HB2 LEU 18 13.556 1.716 -2.185 126 HB3 LEU 18 HB1 LEU 18 12.900 2.544 -0.792 127 HG LEU 18 HG LEU 18 11.906 0.082 -2.160 128 HD11 LEU 18 HD11 LEU 18 12.431 0.894 0.686 129 HD12 LEU 18 HD12 LEU 18 13.322 -0.274 -0.287 130 HD13 LEU 18 HD13 LEU 18 11.673 -0.630 0.226 131 HD21 LEU 18 HD21 LEU 18 9.796 0.266 -0.898 132 HD22 LEU 18 HD22 LEU 18 9.953 1.500 -2.148 133 HD23 LEU 18 HD23 LEU 18 10.227 1.918 -0.456 134 H LYS 19 HN LYS 19 13.812 3.380 -4.331 135 HA LYS 19 HA LYS 19 15.173 5.535 -3.097 136 HB2 LYS 19 HB2 LYS 19 15.432 4.850 -6.011 137 HB3 LYS 19 HB1 LYS 19 16.657 5.456 -4.908 138 HG2 LYS 19 HG2 LYS 19 15.939 3.078 -3.754 139 HG3 LYS 19 HG1 LYS 19 15.842 2.725 -5.478 140 HD2 LYS 19 HD2 LYS 19 18.100 3.374 -5.824 141 HD3 LYS 19 HD1 LYS 19 18.220 4.049 -4.199 142 HE2 LYS 19 HE2 LYS 19 17.858 1.774 -3.281 143 HE3 LYS 19 HE1 LYS 19 17.886 1.142 -4.926 144 HZ1 LYS 19 HZ1 LYS 19 20.036 0.868 -3.941 145 HZ2 LYS 19 HZ2 LYS 19 20.112 2.497 -3.493 146 HZ3 LYS 19 HZ3 LYS 19 20.163 2.062 -5.135 147 H ALA 20 HN ALA 20 12.461 5.405 -5.268 148 HA ALA 20 HA ALA 20 12.792 8.068 -6.296 149 HB1 ALA 20 HB1 ALA 20 11.547 6.105 -7.413 150 HB2 ALA 20 HB2 ALA 20 10.825 7.709 -7.518 151 HB3 ALA 20 HB3 ALA 20 10.208 6.540 -6.351 152 H LEU 21 HN LEU 21 11.445 6.667 -3.494 153 HA LEU 21 HA LEU 21 9.780 8.991 -2.922 154 HB2 LEU 21 HB2 LEU 21 10.281 6.523 -1.264 155 HB3 LEU 21 HB1 LEU 21 9.070 7.752 -0.956 156 HG LEU 21 HG LEU 21 8.772 6.689 -3.613 157 HD11 LEU 21 HD11 LEU 21 7.965 4.435 -2.818 158 HD12 LEU 21 HD12 LEU 21 8.879 4.735 -1.337 159 HD13 LEU 21 HD13 LEU 21 9.711 4.668 -2.888 160 HD21 LEU 21 HD21 LEU 21 6.501 6.424 -2.931 161 HD22 LEU 21 HD22 LEU 21 7.109 7.939 -2.266 162 HD23 LEU 21 HD23 LEU 21 6.947 6.525 -1.226 163 H ALA 22 HN ALA 22 12.912 8.511 -2.849 164 HA ALA 22 HA ALA 22 14.691 9.400 -1.754 165 HB1 ALA 22 HB1 ALA 22 13.742 11.539 -2.002 166 HB2 ALA 22 HB2 ALA 22 14.195 11.434 -0.301 167 HB3 ALA 22 HB3 ALA 22 12.512 11.230 -0.778 168 H LEU 23 HN LEU 23 13.565 7.105 -0.750 169 HA LEU 23 HA LEU 23 13.322 7.315 2.125 170 HB2 LEU 23 HB2 LEU 23 13.273 5.026 0.177 171 HB3 LEU 23 HB1 LEU 23 13.320 4.747 1.909 172 HG LEU 23 HG LEU 23 11.192 6.435 0.608 173 HD11 LEU 23 HD11 LEU 23 9.726 4.489 0.751 174 HD12 LEU 23 HD12 LEU 23 11.102 3.497 1.240 175 HD13 LEU 23 HD13 LEU 23 11.065 4.222 -0.368 176 HD21 LEU 23 HD21 LEU 23 11.195 4.959 3.224 177 HD22 LEU 23 HD22 LEU 23 9.988 6.103 2.639 178 HD23 LEU 23 HD23 LEU 23 11.608 6.663 3.050 179 HA PRO 24 HA PRO 24 17.504 6.735 3.268 180 HB2 PRO 24 HB2 PRO 24 17.299 5.013 5.392 181 HB3 PRO 24 HB1 PRO 24 16.899 6.740 5.484 182 HG2 PRO 24 HG2 PRO 24 15.093 4.398 5.226 183 HG3 PRO 24 HG1 PRO 24 14.881 5.895 6.152 184 HD2 PRO 24 HD2 PRO 24 13.659 5.454 3.770 185 HD3 PRO 24 HD1 PRO 24 14.114 7.064 4.347 186 H GLU 25 HN GLU 25 19.032 5.623 2.329 187 HA GLU 25 HA GLU 25 18.742 3.266 0.915 188 HB2 GLU 25 HB2 GLU 25 21.068 4.812 1.965 189 HB3 GLU 25 HB1 GLU 25 21.367 3.207 1.317 190 HG2 GLU 25 HG2 GLU 25 19.717 5.031 -0.316 191 HG3 GLU 25 HG1 GLU 25 21.434 5.397 -0.173 192 H ASP 26 HN ASP 26 19.658 3.734 4.279 193 HA ASP 26 HA ASP 26 20.584 1.148 4.844 194 HB2 ASP 26 HB2 ASP 26 20.963 2.837 6.476 195 HB3 ASP 26 HB1 ASP 26 19.252 3.238 6.566 196 H LEU 27 HN LEU 27 17.332 2.550 5.040 197 HA LEU 27 HA LEU 27 16.091 0.178 5.984 198 HB2 LEU 27 HB2 LEU 27 15.164 2.466 6.229 199 HB3 LEU 27 HB1 LEU 27 14.835 2.478 4.506 200 HG LEU 27 HG LEU 27 13.680 0.141 5.782 201 HD11 LEU 27 HD11 LEU 27 13.644 1.673 7.707 202 HD12 LEU 27 HD12 LEU 27 12.041 1.213 7.141 203 HD13 LEU 27 HD13 LEU 27 12.692 2.807 6.752 204 HD21 LEU 27 HD21 LEU 27 12.153 2.385 4.520 205 HD22 LEU 27 HD22 LEU 27 11.876 0.646 4.431 206 HD23 LEU 27 HD23 LEU 27 13.207 1.371 3.533 207 H ILE 28 HN ILE 28 16.583 1.563 2.789 208 HA ILE 28 HA ILE 28 14.965 -0.221 1.344 209 HB ILE 28 HB ILE 28 17.497 1.143 0.387 210 HG12 ILE 28 HG12 ILE 28 14.652 2.144 0.218 211 HG13 ILE 28 HG11 ILE 28 15.802 2.673 1.441 212 HG21 ILE 28 HG21 ILE 28 15.125 0.054 -1.116 213 HG22 ILE 28 HG22 ILE 28 16.790 -0.523 -1.185 214 HG23 ILE 28 HG23 ILE 28 16.380 1.067 -1.826 215 HD11 ILE 28 HD11 ILE 28 17.274 3.346 -0.564 216 HD12 ILE 28 HD12 ILE 28 15.883 4.346 -0.142 217 HD13 ILE 28 HD13 ILE 28 15.780 3.222 -1.498 218 H LYS 29 HN LYS 29 18.029 -0.676 2.873 219 HA LYS 29 HA LYS 29 18.790 -2.933 1.236 220 HB2 LYS 29 HB2 LYS 29 19.926 -1.745 3.762 221 HB3 LYS 29 HB1 LYS 29 20.556 -3.216 3.037 222 HG2 LYS 29 HG2 LYS 29 21.181 -2.027 1.042 223 HG3 LYS 29 HG1 LYS 29 20.405 -0.559 1.637 224 HD2 LYS 29 HD2 LYS 29 22.818 -0.428 1.950 225 HD3 LYS 29 HD1 LYS 29 21.999 -0.482 3.511 226 HE2 LYS 29 HE2 LYS 29 22.769 -3.098 2.418 227 HE3 LYS 29 HE1 LYS 29 24.116 -2.035 2.817 228 HZ1 LYS 29 HZ1 LYS 29 23.488 -3.448 4.688 229 HZ2 LYS 29 HZ2 LYS 29 21.928 -2.799 4.683 230 HZ3 LYS 29 HZ3 LYS 29 23.248 -1.816 5.059 231 H MET 30 HN MET 30 17.006 -2.404 4.185 232 HA MET 30 HA MET 30 17.108 -5.284 4.755 233 HB2 MET 30 HB2 MET 30 16.012 -4.665 6.928 234 HB3 MET 30 HB1 MET 30 17.630 -4.017 6.703 235 HG2 MET 30 HG2 MET 30 16.760 -1.849 6.207 236 HG3 MET 30 HG1 MET 30 15.108 -2.460 6.188 237 HE1 MET 30 HE1 MET 30 14.981 -0.112 7.843 238 HE2 MET 30 HE2 MET 30 16.743 -0.045 7.853 239 HE3 MET 30 HE3 MET 30 15.850 -0.044 9.378 240 H ALA 31 HN ALA 31 14.834 -2.640 4.201 241 HA ALA 31 HA ALA 31 12.458 -4.084 4.519 242 HB1 ALA 31 HB1 ALA 31 11.363 -2.269 3.421 243 HB2 ALA 31 HB2 ALA 31 12.865 -1.763 2.644 244 HB3 ALA 31 HB3 ALA 31 12.677 -1.599 4.388 245 H ARG 32 HN ARG 32 14.744 -4.048 1.955 246 HA ARG 32 HA ARG 32 13.144 -4.876 -0.188 247 HB2 ARG 32 HB2 ARG 32 15.196 -5.534 -1.256 248 HB3 ARG 32 HB1 ARG 32 15.506 -4.062 -0.351 249 HG2 ARG 32 HG2 ARG 32 16.630 -5.254 1.361 250 HG3 ARG 32 HG1 ARG 32 16.135 -6.805 0.687 251 HD2 ARG 32 HD2 ARG 32 18.139 -4.846 -0.370 252 HD3 ARG 32 HD1 ARG 32 18.358 -6.557 0.003 253 HE ARG 32 HE ARG 32 17.387 -5.422 -2.454 254 HH11 ARG 32 HH11 ARG 32 17.252 -8.292 -0.429 255 HH12 ARG 32 HH12 ARG 32 16.817 -9.336 -1.744 256 HH21 ARG 32 HH21 ARG 32 16.797 -6.786 -4.158 257 HH22 ARG 32 HH22 ARG 32 16.558 -8.483 -3.861 258 H ASP 33 HN ASP 33 14.400 -6.583 2.567 259 HA ASP 33 HA ASP 33 13.504 -9.138 1.416 260 HB2 ASP 33 HB2 ASP 33 15.528 -8.477 3.532 261 HB3 ASP 33 HB1 ASP 33 14.805 -10.078 3.456 262 H ILE 34 HN ILE 34 13.052 -6.893 4.042 263 HA ILE 34 HA ILE 34 11.423 -8.555 5.673 264 HB ILE 34 HB ILE 34 11.404 -5.538 5.490 265 HG12 ILE 34 HG12 ILE 34 13.000 -7.327 7.322 266 HG13 ILE 34 HG11 ILE 34 13.656 -6.433 5.961 267 HG21 ILE 34 HG21 ILE 34 9.454 -6.443 6.629 268 HG22 ILE 34 HG22 ILE 34 10.514 -5.605 7.766 269 HG23 ILE 34 HG23 ILE 34 10.502 -7.370 7.703 270 HD11 ILE 34 HD11 ILE 34 12.387 -5.226 8.408 271 HD12 ILE 34 HD12 ILE 34 13.070 -4.337 7.047 272 HD13 ILE 34 HD13 ILE 34 14.115 -5.321 8.071 273 H LYS 35 HN LYS 35 9.351 -9.147 5.383 274 HA LYS 35 HA LYS 35 7.782 -7.630 3.416 275 HB2 LYS 35 HB2 LYS 35 7.737 -10.598 3.972 276 HB3 LYS 35 HB1 LYS 35 6.565 -9.773 2.953 277 HG2 LYS 35 HG2 LYS 35 9.537 -9.827 2.454 278 HG3 LYS 35 HG1 LYS 35 8.363 -10.892 1.678 279 HD2 LYS 35 HD2 LYS 35 7.981 -9.340 0.129 280 HD3 LYS 35 HD1 LYS 35 7.460 -8.213 1.380 281 HE2 LYS 35 HE2 LYS 35 9.276 -7.283 0.030 282 HE3 LYS 35 HE1 LYS 35 9.755 -7.490 1.711 283 HZ1 LYS 35 HZ1 LYS 35 10.455 -9.288 -0.536 284 HZ2 LYS 35 HZ2 LYS 35 10.874 -9.551 1.077 285 HZ3 LYS 35 HZ3 LYS 35 11.504 -8.218 0.247 286 HA PRO 36 HA PRO 36 5.594 -7.124 7.398 287 HB2 PRO 36 HB2 PRO 36 4.488 -4.730 6.681 288 HB3 PRO 36 HB1 PRO 36 6.099 -4.884 7.413 289 HG2 PRO 36 HG2 PRO 36 5.358 -4.508 4.553 290 HG3 PRO 36 HG1 PRO 36 6.688 -3.785 5.481 291 HD2 PRO 36 HD2 PRO 36 7.073 -5.855 3.802 292 HD3 PRO 36 HD1 PRO 36 8.023 -5.636 5.283 293 H ILE 37 HN ILE 37 3.452 -7.422 7.864 294 HA ILE 37 HA ILE 37 1.817 -8.235 5.611 295 HB ILE 37 HB ILE 37 2.088 -9.658 7.684 296 HG12 ILE 37 HG12 ILE 37 0.075 -9.486 5.918 297 HG13 ILE 37 HG11 ILE 37 0.108 -10.672 7.219 298 HG21 ILE 37 HG21 ILE 37 0.256 -7.587 8.888 299 HG22 ILE 37 HG22 ILE 37 1.922 -7.917 9.367 300 HG23 ILE 37 HG23 ILE 37 0.674 -9.137 9.618 301 HD11 ILE 37 HD11 ILE 37 -2.053 -9.368 6.819 302 HD12 ILE 37 HD12 ILE 37 -1.218 -8.007 7.574 303 HD13 ILE 37 HD13 ILE 37 -1.469 -9.503 8.476 304 H VAL 38 HN VAL 38 -0.129 -7.301 5.067 305 HA VAL 38 HA VAL 38 -0.500 -4.589 6.094 306 HB VAL 38 HB VAL 38 -1.797 -5.912 3.703 307 HG11 VAL 38 HG11 VAL 38 -3.199 -4.148 4.390 308 HG12 VAL 38 HG12 VAL 38 -2.213 -3.478 3.087 309 HG13 VAL 38 HG13 VAL 38 -1.830 -3.102 4.767 310 HG21 VAL 38 HG21 VAL 38 0.472 -3.928 3.774 311 HG22 VAL 38 HG22 VAL 38 -0.245 -4.670 2.342 312 HG23 VAL 38 HG23 VAL 38 0.656 -5.660 3.493 313 H GLU 39 HN GLU 39 -1.676 -4.652 7.922 314 HA GLU 39 HA GLU 39 -4.015 -6.372 8.068 315 HB2 GLU 39 HB2 GLU 39 -2.328 -4.911 9.984 316 HB3 GLU 39 HB1 GLU 39 -4.046 -4.890 10.362 317 HG2 GLU 39 HG2 GLU 39 -4.160 -7.165 10.658 318 HG3 GLU 39 HG1 GLU 39 -2.742 -7.467 9.655 319 H ILE 40 HN ILE 40 -5.906 -5.684 7.370 320 HA ILE 40 HA ILE 40 -6.476 -2.808 7.551 321 HB ILE 40 HB ILE 40 -5.870 -3.235 5.255 322 HG12 ILE 40 HG12 ILE 40 -7.955 -1.799 5.923 323 HG13 ILE 40 HG11 ILE 40 -7.616 -2.125 4.231 324 HG21 ILE 40 HG21 ILE 40 -6.229 -5.596 5.105 325 HG22 ILE 40 HG22 ILE 40 -7.139 -4.784 3.825 326 HG23 ILE 40 HG23 ILE 40 -7.972 -5.377 5.261 327 HD11 ILE 40 HD11 ILE 40 -10.013 -2.333 4.883 328 HD12 ILE 40 HD12 ILE 40 -9.566 -3.712 5.885 329 HD13 ILE 40 HD13 ILE 40 -9.335 -3.781 4.137 330 H GLN 41 HN GLN 41 -8.344 -2.306 8.434 331 HA GLN 41 HA GLN 41 -10.454 -4.348 8.578 332 HB2 GLN 41 HB2 GLN 41 -10.918 -3.646 10.913 333 HB3 GLN 41 HB1 GLN 41 -9.333 -4.383 10.728 334 HG2 GLN 41 HG2 GLN 41 -8.327 -2.135 10.685 335 HG3 GLN 41 HG1 GLN 41 -9.921 -1.436 10.952 336 HE21 GLN 41 HE21 GLN 41 -10.892 -1.643 12.952 337 HE22 GLN 41 HE22 GLN 41 -10.012 -2.114 14.361 338 H GLN 42 HN GLN 42 -12.480 -3.591 8.171 339 HA GLN 42 HA GLN 42 -12.818 -0.673 8.040 340 HB2 GLN 42 HB2 GLN 42 -14.170 -0.876 6.073 341 HB3 GLN 42 HB1 GLN 42 -12.620 -1.657 5.786 342 HG2 GLN 42 HG2 GLN 42 -13.548 -3.637 5.510 343 HG3 GLN 42 HG1 GLN 42 -14.670 -3.447 6.836 344 HE21 GLN 42 HE21 GLN 42 -15.069 -4.529 4.154 345 HE22 GLN 42 HE22 GLN 42 -16.357 -3.606 3.474 346 H LYS 43 HN LYS 43 -15.455 -0.632 7.319 347 HA LYS 43 HA LYS 43 -17.146 -2.254 8.880 348 HB2 LYS 43 HB2 LYS 43 -15.894 -0.692 10.604 349 HB3 LYS 43 HB1 LYS 43 -17.058 0.501 10.046 350 HG2 LYS 43 HG2 LYS 43 -18.127 -0.398 11.871 351 HG3 LYS 43 HG1 LYS 43 -18.807 -1.346 10.547 352 HD2 LYS 43 HD2 LYS 43 -18.260 -2.997 12.073 353 HD3 LYS 43 HD1 LYS 43 -16.825 -2.964 11.049 354 HE2 LYS 43 HE2 LYS 43 -15.680 -1.557 12.664 355 HE3 LYS 43 HE1 LYS 43 -17.120 -1.507 13.674 356 HZ1 LYS 43 HZ1 LYS 43 -16.912 -3.798 14.159 357 HZ2 LYS 43 HZ2 LYS 43 -15.372 -3.131 14.379 358 HZ3 LYS 43 HZ3 LYS 43 -15.716 -4.024 12.985 359 H GLY 44 HN GLY 44 -17.746 -1.989 6.532 360 HA2 GLY 44 HA2 GLY 44 -19.743 -1.429 5.393 361 HA3 GLY 44 HA1 GLY 44 -19.884 0.012 6.389 362 H ASP 45 HN ASP 45 -18.205 1.711 6.009 363 HA ASP 45 HA ASP 45 -17.282 1.722 3.209 364 HB2 ASP 45 HB2 ASP 45 -18.561 4.057 4.648 365 HB3 ASP 45 HB1 ASP 45 -17.899 4.091 3.021 366 H ASP 46 HN ASP 46 -16.795 2.703 6.513 367 HA ASP 46 HA ASP 46 -14.426 4.245 5.917 368 HB2 ASP 46 HB2 ASP 46 -15.866 3.490 8.438 369 HB3 ASP 46 HB1 ASP 46 -14.237 4.152 8.512 370 H PHE 47 HN PHE 47 -12.469 3.462 5.692 371 HA PHE 47 HA PHE 47 -11.907 0.736 6.674 372 HB2 PHE 47 HB2 PHE 47 -10.884 2.269 4.298 373 HB3 PHE 47 HB1 PHE 47 -9.996 0.897 4.941 374 HD1 PHE 47 HD1 PHE 47 -13.616 1.522 4.313 375 HD2 PHE 47 HD2 PHE 47 -10.196 -0.881 3.541 376 HE1 PHE 47 HE1 PHE 47 -14.988 0.006 2.944 377 HE2 PHE 47 HE2 PHE 47 -11.563 -2.401 2.171 378 HZ PHE 47 HZ PHE 47 -13.965 -1.960 1.871 379 H VAL 48 HN VAL 48 -9.890 0.309 7.582 380 HA VAL 48 HA VAL 48 -8.177 2.585 8.284 381 HB VAL 48 HB VAL 48 -9.164 0.491 10.240 382 HG11 VAL 48 HG11 VAL 48 -6.858 0.916 10.706 383 HG12 VAL 48 HG12 VAL 48 -7.820 1.784 11.903 384 HG13 VAL 48 HG13 VAL 48 -7.095 2.658 10.553 385 HG21 VAL 48 HG21 VAL 48 -9.583 3.480 10.156 386 HG22 VAL 48 HG22 VAL 48 -10.071 2.419 11.479 387 HG23 VAL 48 HG23 VAL 48 -10.808 2.239 9.888 388 H VAL 49 HN VAL 49 -6.389 2.050 7.203 389 HA VAL 49 HA VAL 49 -5.526 -0.749 7.104 390 HB VAL 49 HB VAL 49 -4.310 1.564 5.594 391 HG11 VAL 49 HG11 VAL 49 -2.940 -0.455 5.711 392 HG12 VAL 49 HG12 VAL 49 -3.542 -0.203 4.070 393 HG13 VAL 49 HG13 VAL 49 -4.291 -1.416 5.106 394 HG21 VAL 49 HG21 VAL 49 -6.816 1.214 5.207 395 HG22 VAL 49 HG22 VAL 49 -6.359 -0.317 4.459 396 HG23 VAL 49 HG23 VAL 49 -5.765 1.203 3.790 397 H THR 50 HN THR 50 -3.848 -1.467 8.218 398 HA THR 50 HA THR 50 -2.173 0.487 9.650 399 HB THR 50 HB THR 50 -2.813 -2.377 10.368 400 HG1 THR 50 HG1 THR 50 -4.060 0.023 10.897 401 HG21 THR 50 HG21 THR 50 -0.626 -1.740 11.183 402 HG22 THR 50 HG22 THR 50 -1.760 -1.827 12.530 403 HG23 THR 50 HG23 THR 50 -1.284 -0.259 11.876 404 H SER 51 HN SER 51 -0.128 0.627 8.959 405 HA SER 51 HA SER 51 0.999 -1.638 7.455 406 HB2 SER 51 HB2 SER 51 2.027 1.205 7.528 407 HB3 SER 51 HB1 SER 51 2.457 -0.065 6.383 408 HG SER 51 HG SER 51 -0.073 0.069 6.111 409 H LYS 52 HN LYS 52 2.880 -2.601 8.079 410 HA LYS 52 HA LYS 52 3.887 -1.866 10.733 411 HB2 LYS 52 HB2 LYS 52 3.706 -4.433 9.220 412 HB3 LYS 52 HB1 LYS 52 5.005 -4.246 10.387 413 HG2 LYS 52 HG2 LYS 52 3.406 -5.204 11.698 414 HG3 LYS 52 HG1 LYS 52 3.054 -3.496 11.970 415 HD2 LYS 52 HD2 LYS 52 1.324 -3.625 10.189 416 HD3 LYS 52 HD1 LYS 52 1.632 -5.358 10.074 417 HE2 LYS 52 HE2 LYS 52 0.846 -4.002 12.640 418 HE3 LYS 52 HE1 LYS 52 -0.331 -4.679 11.516 419 HZ1 LYS 52 HZ1 LYS 52 0.211 -6.784 12.075 420 HZ2 LYS 52 HZ2 LYS 52 0.704 -6.053 13.521 421 HZ3 LYS 52 HZ3 LYS 52 1.850 -6.428 12.340 422 H THR 53 HN THR 53 5.941 -1.256 11.055 423 HA THR 53 HA THR 53 7.959 -1.652 8.988 424 HB THR 53 HB THR 53 8.554 0.622 8.707 425 HG1 THR 53 HG1 THR 53 6.704 1.773 10.405 426 HG21 THR 53 HG21 THR 53 6.460 0.071 7.507 427 HG22 THR 53 HG22 THR 53 6.583 1.780 7.924 428 HG23 THR 53 HG23 THR 53 5.544 0.713 8.871 429 HA PRO 54 HA PRO 54 10.552 -1.962 12.608 430 HB2 PRO 54 HB2 PRO 54 12.974 -1.218 11.668 431 HB3 PRO 54 HB1 PRO 54 12.194 -2.708 11.098 432 HG2 PRO 54 HG2 PRO 54 12.307 -0.028 9.800 433 HG3 PRO 54 HG1 PRO 54 12.563 -1.634 9.091 434 HD2 PRO 54 HD2 PRO 54 10.222 -0.308 8.866 435 HD3 PRO 54 HD1 PRO 54 10.330 -2.073 8.939 436 H ARG 55 HN ARG 55 9.734 0.856 11.156 437 HA ARG 55 HA ARG 55 11.239 2.700 12.843 438 HB2 ARG 55 HB2 ARG 55 9.323 3.067 10.536 439 HB3 ARG 55 HB1 ARG 55 10.089 4.396 11.395 440 HG2 ARG 55 HG2 ARG 55 12.227 3.802 10.584 441 HG3 ARG 55 HG1 ARG 55 11.638 2.243 9.994 442 HD2 ARG 55 HD2 ARG 55 11.974 4.083 8.264 443 HD3 ARG 55 HD1 ARG 55 10.437 3.224 8.244 444 HE ARG 55 HE ARG 55 9.401 5.138 9.234 445 HH11 ARG 55 HH11 ARG 55 12.735 5.660 8.283 446 HH12 ARG 55 HH12 ARG 55 12.568 7.384 8.179 447 HH21 ARG 55 HH21 ARG 55 9.184 7.406 9.112 448 HH22 ARG 55 HH22 ARG 55 10.556 8.374 8.663 449 H GLN 56 HN GLN 56 7.929 2.780 11.666 450 HA GLN 56 HA GLN 56 6.744 2.666 14.278 451 HB2 GLN 56 HB2 GLN 56 7.541 4.997 14.207 452 HB3 GLN 56 HB1 GLN 56 6.662 5.248 12.706 453 HG2 GLN 56 HG2 GLN 56 4.555 4.919 13.843 454 HG3 GLN 56 HG1 GLN 56 5.396 4.545 15.345 455 HE21 GLN 56 HE21 GLN 56 4.352 6.209 16.420 456 HE22 GLN 56 HE22 GLN 56 4.766 7.868 16.160 457 H THR 57 HN THR 57 4.650 2.002 14.122 458 HA THR 57 HA THR 57 3.704 1.234 11.531 459 HB THR 57 HB THR 57 1.629 0.575 12.937 460 HG1 THR 57 HG1 THR 57 2.417 1.969 14.740 461 HG21 THR 57 HG21 THR 57 3.100 -1.308 14.040 462 HG22 THR 57 HG22 THR 57 4.360 -0.611 13.020 463 HG23 THR 57 HG23 THR 57 2.877 -1.231 12.295 464 H VAL 58 HN VAL 58 2.600 2.509 10.193 465 HA VAL 58 HA VAL 58 1.271 4.859 11.295 466 HB VAL 58 HB VAL 58 1.074 5.627 8.936 467 HG11 VAL 58 HG11 VAL 58 3.759 5.046 10.143 468 HG12 VAL 58 HG12 VAL 58 2.850 6.559 10.128 469 HG13 VAL 58 HG13 VAL 58 3.588 5.958 8.644 470 HG21 VAL 58 HG21 VAL 58 1.108 3.535 7.759 471 HG22 VAL 58 HG22 VAL 58 2.721 3.165 8.376 472 HG23 VAL 58 HG23 VAL 58 2.495 4.495 7.242 473 H THR 59 HN THR 59 -0.855 5.401 10.788 474 HA THR 59 HA THR 59 -2.507 3.121 9.923 475 HB THR 59 HB THR 59 -3.482 5.265 11.793 476 HG1 THR 59 HG1 THR 59 -1.512 4.102 12.569 477 HG21 THR 59 HG21 THR 59 -4.288 2.383 11.377 478 HG22 THR 59 HG22 THR 59 -5.148 3.793 10.757 479 HG23 THR 59 HG23 THR 59 -5.045 3.519 12.497 480 H ASN 60 HN ASN 60 -3.685 3.479 8.174 481 HA ASN 60 HA ASN 60 -4.198 6.275 7.341 482 HB2 ASN 60 HB2 ASN 60 -3.747 3.763 5.722 483 HB3 ASN 60 HB1 ASN 60 -4.453 5.215 5.025 484 HD21 ASN 60 HD21 ASN 60 -1.576 3.769 6.327 485 HD22 ASN 60 HD22 ASN 60 -0.486 4.997 5.793 486 H SER 61 HN SER 61 -6.331 6.849 7.259 487 HA SER 61 HA SER 61 -8.314 4.678 7.164 488 HB2 SER 61 HB2 SER 61 -9.704 6.364 8.632 489 HB3 SER 61 HB1 SER 61 -8.536 5.278 9.387 490 HG SER 61 HG SER 61 -7.200 6.929 9.757 491 H PHE 62 HN PHE 62 -10.205 5.065 6.016 492 HA PHE 62 HA PHE 62 -10.713 7.672 4.897 493 HB2 PHE 62 HB2 PHE 62 -10.686 6.695 2.513 494 HB3 PHE 62 HB1 PHE 62 -9.152 7.151 3.237 495 HD1 PHE 62 HD1 PHE 62 -11.266 4.361 2.171 496 HD2 PHE 62 HD2 PHE 62 -7.512 5.501 3.817 497 HE1 PHE 62 HE1 PHE 62 -10.386 2.106 1.714 498 HE2 PHE 62 HE2 PHE 62 -6.626 3.253 3.366 499 HZ PHE 62 HZ PHE 62 -8.059 1.549 2.312 500 H THR 63 HN THR 63 -12.588 7.527 3.290 501 HA THR 63 HA THR 63 -14.457 5.416 4.133 502 HB THR 63 HB THR 63 -15.377 8.179 3.393 503 HG1 THR 63 HG1 THR 63 -14.770 7.314 6.053 504 HG21 THR 63 HG21 THR 63 -17.316 7.583 4.727 505 HG22 THR 63 HG22 THR 63 -16.552 6.073 5.215 506 HG23 THR 63 HG23 THR 63 -17.016 6.323 3.531 507 H LEU 64 HN LEU 64 -15.306 4.285 2.493 508 HA LEU 64 HA LEU 64 -14.475 4.523 -0.139 509 HB2 LEU 64 HB2 LEU 64 -16.972 3.240 0.953 510 HB3 LEU 64 HB1 LEU 64 -16.395 3.024 -0.682 511 HG LEU 64 HG LEU 64 -15.051 2.101 1.857 512 HD11 LEU 64 HD11 LEU 64 -16.710 0.564 1.342 513 HD12 LEU 64 HD12 LEU 64 -15.275 -0.114 0.573 514 HD13 LEU 64 HD13 LEU 64 -16.476 0.741 -0.398 515 HD21 LEU 64 HD21 LEU 64 -14.050 1.975 -0.985 516 HD22 LEU 64 HD22 LEU 64 -13.326 1.142 0.391 517 HD23 LEU 64 HD23 LEU 64 -13.346 2.904 0.339 518 H GLY 65 HN GLY 65 -14.917 5.911 -1.679 519 HA2 GLY 65 HA2 GLY 65 -16.363 7.021 -3.175 520 HA3 GLY 65 HA1 GLY 65 -17.645 6.913 -1.982 521 H LYS 66 HN LYS 66 -14.916 7.963 -0.423 522 HA LYS 66 HA LYS 66 -15.426 10.789 -1.014 523 HB2 LYS 66 HB2 LYS 66 -15.824 9.387 1.574 524 HB3 LYS 66 HB1 LYS 66 -15.045 10.962 1.647 525 HG2 LYS 66 HG2 LYS 66 -16.977 11.874 0.333 526 HG3 LYS 66 HG1 LYS 66 -17.761 10.307 0.524 527 HD2 LYS 66 HD2 LYS 66 -16.752 11.776 2.927 528 HD3 LYS 66 HD1 LYS 66 -18.288 12.234 2.197 529 HE2 LYS 66 HE2 LYS 66 -19.168 10.031 2.520 530 HE3 LYS 66 HE1 LYS 66 -17.599 9.434 3.055 531 HZ1 LYS 66 HZ1 LYS 66 -19.148 11.524 4.480 532 HZ2 LYS 66 HZ2 LYS 66 -17.735 10.761 5.012 533 HZ3 LYS 66 HZ3 LYS 66 -19.176 9.882 4.887 534 H GLU 67 HN GLU 67 -13.692 12.165 -0.634 535 HA GLU 67 HA GLU 67 -11.115 10.877 -0.728 536 HB2 GLU 67 HB2 GLU 67 -11.734 12.862 -2.144 537 HB3 GLU 67 HB1 GLU 67 -11.732 13.833 -0.679 538 HG2 GLU 67 HG2 GLU 67 -9.497 13.969 -0.615 539 HG3 GLU 67 HG1 GLU 67 -9.288 12.282 -1.080 540 H ALA 68 HN ALA 68 -9.836 10.528 0.984 541 HA ALA 68 HA ALA 68 -10.436 12.041 3.438 542 HB1 ALA 68 HB1 ALA 68 -9.400 9.233 3.490 543 HB2 ALA 68 HB2 ALA 68 -11.128 9.567 3.371 544 HB3 ALA 68 HB3 ALA 68 -10.214 10.140 4.763 545 H ASP 69 HN ASP 69 -8.699 12.460 4.819 546 HA ASP 69 HA ASP 69 -6.168 12.778 3.446 547 HB2 ASP 69 HB2 ASP 69 -6.904 14.683 4.678 548 HB3 ASP 69 HB1 ASP 69 -7.206 13.719 6.117 549 H ILE 70 HN ILE 70 -4.570 11.414 3.615 550 HA ILE 70 HA ILE 70 -4.417 9.692 5.989 551 HB ILE 70 HB ILE 70 -3.446 7.905 4.473 552 HG12 ILE 70 HG12 ILE 70 -4.608 8.085 2.127 553 HG13 ILE 70 HG11 ILE 70 -4.467 9.816 2.416 554 HG21 ILE 70 HG21 ILE 70 -6.353 8.650 4.242 555 HG22 ILE 70 HG22 ILE 70 -5.602 7.622 5.465 556 HG23 ILE 70 HG23 ILE 70 -5.682 7.082 3.786 557 HD11 ILE 70 HD11 ILE 70 -2.047 9.553 2.697 558 HD12 ILE 70 HD12 ILE 70 -2.583 8.957 1.126 559 HD13 ILE 70 HD13 ILE 70 -2.203 7.818 2.422 560 H THR 71 HN THR 71 -2.155 8.759 6.274 561 HA THR 71 HA THR 71 -0.181 10.702 5.260 562 HB THR 71 HB THR 71 -0.073 9.631 8.060 563 HG1 THR 71 HG1 THR 71 -2.064 10.868 7.588 564 HG21 THR 71 HG21 THR 71 1.390 11.528 8.446 565 HG22 THR 71 HG22 THR 71 1.090 12.134 6.817 566 HG23 THR 71 HG23 THR 71 1.975 10.624 7.048 567 H THR 72 HN THR 72 1.686 9.890 4.539 568 HA THR 72 HA THR 72 2.037 7.006 4.617 569 HB THR 72 HB THR 72 2.388 8.143 2.470 570 HG1 THR 72 HG1 THR 72 3.628 6.334 2.594 571 HG21 THR 72 HG21 THR 72 3.172 10.304 3.162 572 HG22 THR 72 HG22 THR 72 4.436 9.559 2.182 573 HG23 THR 72 HG23 THR 72 4.590 9.595 3.938 574 H MET 73 HN MET 73 4.093 6.052 5.226 575 HA MET 73 HA MET 73 5.042 6.958 7.731 576 HB2 MET 73 HB2 MET 73 6.754 5.160 7.468 577 HB3 MET 73 HB1 MET 73 5.100 4.612 7.248 578 HG2 MET 73 HG2 MET 73 6.761 5.398 4.898 579 HG3 MET 73 HG1 MET 73 6.950 3.810 5.634 580 HE1 MET 73 HE1 MET 73 4.262 2.885 6.544 581 HE2 MET 73 HE2 MET 73 5.152 1.849 5.427 582 HE3 MET 73 HE3 MET 73 3.449 2.199 5.136 583 H ASP 74 HN ASP 74 5.899 7.807 4.548 584 HA ASP 74 HA ASP 74 8.621 8.507 4.995 585 HB2 ASP 74 HB2 ASP 74 8.326 8.392 2.744 586 HB3 ASP 74 HB1 ASP 74 6.638 8.869 2.831 587 H GLY 75 HN GLY 75 5.593 9.999 5.717 588 HA2 GLY 75 HA2 GLY 75 5.449 11.698 7.378 589 HA3 GLY 75 HA1 GLY 75 7.043 12.260 6.907 590 H LYS 76 HN LYS 76 4.751 11.535 4.440 591 HA LYS 76 HA LYS 76 4.388 14.413 3.960 592 HB2 LYS 76 HB2 LYS 76 4.842 12.113 2.139 593 HB3 LYS 76 HB1 LYS 76 3.787 13.404 1.576 594 HG2 LYS 76 HG2 LYS 76 5.741 14.951 2.347 595 HG3 LYS 76 HG1 LYS 76 6.694 13.474 2.210 596 HD2 LYS 76 HD2 LYS 76 4.958 14.602 0.037 597 HD3 LYS 76 HD1 LYS 76 6.700 14.863 0.160 598 HE2 LYS 76 HE2 LYS 76 7.035 12.418 0.053 599 HE3 LYS 76 HE1 LYS 76 5.297 12.211 -0.171 600 HZ1 LYS 76 HZ1 LYS 76 5.430 13.425 -2.228 601 HZ2 LYS 76 HZ2 LYS 76 6.550 12.160 -2.269 602 HZ3 LYS 76 HZ3 LYS 76 7.071 13.742 -1.994 603 H LYS 77 HN LYS 77 2.377 15.164 3.295 604 HA LYS 77 HA LYS 77 0.153 13.508 4.203 605 HB2 LYS 77 HB2 LYS 77 0.561 16.442 3.794 606 HB3 LYS 77 HB1 LYS 77 -1.079 15.801 3.719 607 HG2 LYS 77 HG2 LYS 77 0.823 15.455 6.027 608 HG3 LYS 77 HG1 LYS 77 -0.491 16.637 5.948 609 HD2 LYS 77 HD2 LYS 77 -2.021 14.630 5.545 610 HD3 LYS 77 HD1 LYS 77 -0.659 13.636 6.076 611 HE2 LYS 77 HE2 LYS 77 -0.614 14.840 8.206 612 HE3 LYS 77 HE1 LYS 77 -1.963 15.841 7.675 613 HZ1 LYS 77 HZ1 LYS 77 -2.012 12.907 8.127 614 HZ2 LYS 77 HZ2 LYS 77 -3.305 13.810 7.498 615 HZ3 LYS 77 HZ3 LYS 77 -2.763 14.093 9.078 616 H LEU 78 HN LEU 78 -1.099 12.472 2.837 617 HA LEU 78 HA LEU 78 -1.336 13.464 0.082 618 HB2 LEU 78 HB2 LEU 78 -1.203 10.547 0.827 619 HB3 LEU 78 HB1 LEU 78 -1.199 11.231 -0.785 620 HG LEU 78 HG LEU 78 1.031 11.990 1.027 621 HD11 LEU 78 HD11 LEU 78 2.277 9.990 0.530 622 HD12 LEU 78 HD12 LEU 78 0.906 9.330 -0.363 623 HD13 LEU 78 HD13 LEU 78 0.787 9.569 1.378 624 HD21 LEU 78 HD21 LEU 78 1.057 11.203 -1.874 625 HD22 LEU 78 HD22 LEU 78 2.271 12.114 -0.978 626 HD23 LEU 78 HD23 LEU 78 0.701 12.842 -1.323 627 H LYS 79 HN LYS 79 -3.271 12.348 -1.008 628 HA LYS 79 HA LYS 79 -5.353 11.627 0.894 629 HB2 LYS 79 HB2 LYS 79 -6.968 13.171 -0.205 630 HB3 LYS 79 HB1 LYS 79 -5.720 13.983 0.727 631 HG2 LYS 79 HG2 LYS 79 -4.548 14.596 -1.281 632 HG3 LYS 79 HG1 LYS 79 -5.666 13.641 -2.264 633 HD2 LYS 79 HD2 LYS 79 -7.486 15.160 -1.166 634 HD3 LYS 79 HD1 LYS 79 -6.125 16.238 -0.850 635 HE2 LYS 79 HE2 LYS 79 -5.743 16.631 -3.082 636 HE3 LYS 79 HE1 LYS 79 -6.499 15.120 -3.588 637 HZ1 LYS 79 HZ1 LYS 79 -7.796 17.159 -4.090 638 HZ2 LYS 79 HZ2 LYS 79 -8.004 17.392 -2.427 639 HZ3 LYS 79 HZ3 LYS 79 -8.641 16.012 -3.176 640 H CYS 80 HN CYS 80 -6.409 9.931 0.214 641 HA CYS 80 HA CYS 80 -6.455 9.404 -2.680 642 HB2 CYS 80 HB2 CYS 80 -5.482 7.750 -0.515 643 HB3 CYS 80 HB1 CYS 80 -6.795 6.944 -1.358 644 H THR 81 HN THR 81 -8.410 9.602 -3.474 645 HA THR 81 HA THR 81 -10.776 9.452 -1.831 646 HB THR 81 HB THR 81 -10.731 11.140 -3.548 647 HG1 THR 81 HG1 THR 81 -12.484 9.000 -4.244 648 HG21 THR 81 HG21 THR 81 -10.871 9.950 -5.996 649 HG22 THR 81 HG22 THR 81 -9.723 8.908 -5.146 650 HG23 THR 81 HG23 THR 81 -9.403 10.637 -5.295 651 H VAL 82 HN VAL 82 -9.979 7.199 -1.356 652 HA VAL 82 HA VAL 82 -10.173 5.089 -3.177 653 HB VAL 82 HB VAL 82 -10.845 4.641 -0.300 654 HG11 VAL 82 HG11 VAL 82 -9.476 2.645 -0.664 655 HG12 VAL 82 HG12 VAL 82 -9.152 3.171 -2.317 656 HG13 VAL 82 HG13 VAL 82 -10.795 2.756 -1.830 657 HG21 VAL 82 HG21 VAL 82 -8.274 4.534 -0.003 658 HG22 VAL 82 HG22 VAL 82 -9.085 6.098 0.080 659 HG23 VAL 82 HG23 VAL 82 -8.239 5.621 -1.390 660 H HIS 83 HN HIS 83 -11.752 3.993 -4.006 661 HA HIS 83 HA HIS 83 -14.343 3.840 -2.715 662 HB2 HIS 83 HB2 HIS 83 -15.558 4.484 -4.788 663 HB3 HIS 83 HB1 HIS 83 -14.630 5.812 -4.111 664 HD1 HIS 83 HD1 HIS 83 -14.889 3.637 -7.126 665 HD2 HIS 83 HD2 HIS 83 -12.451 6.678 -5.681 666 HE1 HIS 83 HE1 HIS 83 -13.515 4.397 -9.093 667 HE2 HIS 83 HE2 HIS 83 -12.169 6.343 -8.227 668 H LEU 84 HN LEU 84 -15.496 2.011 -3.297 669 HA LEU 84 HA LEU 84 -13.867 -0.079 -4.479 670 HB2 LEU 84 HB2 LEU 84 -15.169 -0.469 -2.407 671 HB3 LEU 84 HB1 LEU 84 -16.650 -0.201 -3.302 672 HG LEU 84 HG LEU 84 -16.013 -2.168 -4.751 673 HD11 LEU 84 HD11 LEU 84 -13.683 -2.341 -4.367 674 HD12 LEU 84 HD12 LEU 84 -14.424 -3.773 -3.654 675 HD13 LEU 84 HD13 LEU 84 -13.904 -2.440 -2.619 676 HD21 LEU 84 HD21 LEU 84 -16.475 -2.609 -1.806 677 HD22 LEU 84 HD22 LEU 84 -16.703 -3.829 -3.060 678 HD23 LEU 84 HD23 LEU 84 -17.703 -2.377 -3.049 679 H ALA 85 HN ALA 85 -13.824 -0.208 -6.609 680 HA ALA 85 HA ALA 85 -16.355 0.104 -8.083 681 HB1 ALA 85 HB1 ALA 85 -13.672 0.769 -9.246 682 HB2 ALA 85 HB2 ALA 85 -14.632 1.962 -8.376 683 HB3 ALA 85 HB3 ALA 85 -15.269 1.216 -9.841 684 H ASN 86 HN ASN 86 -16.971 -1.771 -8.851 685 HA ASN 86 HA ASN 86 -16.999 -3.795 -9.857 686 HB2 ASN 86 HB2 ASN 86 -14.284 -2.952 -10.910 687 HB3 ASN 86 HB1 ASN 86 -15.180 -4.364 -11.459 688 HD21 ASN 86 HD21 ASN 86 -14.820 -0.961 -11.666 689 HD22 ASN 86 HD22 ASN 86 -16.047 -0.679 -12.845 690 H GLY 87 HN GLY 87 -16.146 -3.617 -7.177 691 HA2 GLY 87 HA2 GLY 87 -15.455 -5.143 -5.584 692 HA3 GLY 87 HA1 GLY 87 -14.988 -6.223 -6.888 693 H LYS 88 HN LYS 88 -13.574 -3.270 -7.424 694 HA LYS 88 HA LYS 88 -11.095 -4.132 -6.087 695 HB2 LYS 88 HB2 LYS 88 -11.176 -2.419 -8.570 696 HB3 LYS 88 HB1 LYS 88 -9.825 -3.339 -7.916 697 HG2 LYS 88 HG2 LYS 88 -12.315 -4.511 -9.148 698 HG3 LYS 88 HG1 LYS 88 -10.738 -4.368 -9.932 699 HD2 LYS 88 HD2 LYS 88 -9.795 -6.018 -8.622 700 HD3 LYS 88 HD1 LYS 88 -10.963 -5.798 -7.319 701 HE2 LYS 88 HE2 LYS 88 -11.348 -7.907 -8.480 702 HE3 LYS 88 HE1 LYS 88 -12.707 -6.805 -8.716 703 HZ1 LYS 88 HZ1 LYS 88 -10.508 -7.154 -10.682 704 HZ2 LYS 88 HZ2 LYS 88 -11.964 -6.314 -10.902 705 HZ3 LYS 88 HZ3 LYS 88 -11.977 -7.997 -10.747 706 H LEU 89 HN LEU 89 -9.879 -2.587 -5.040 707 HA LEU 89 HA LEU 89 -11.357 -0.192 -4.346 708 HB2 LEU 89 HB2 LEU 89 -9.847 -1.891 -2.853 709 HB3 LEU 89 HB1 LEU 89 -8.692 -0.610 -3.171 710 HG LEU 89 HG LEU 89 -9.958 0.991 -2.044 711 HD11 LEU 89 HD11 LEU 89 -12.123 0.823 -2.837 712 HD12 LEU 89 HD12 LEU 89 -12.299 0.315 -1.157 713 HD13 LEU 89 HD13 LEU 89 -12.243 -0.891 -2.441 714 HD21 LEU 89 HD21 LEU 89 -10.398 0.043 0.154 715 HD22 LEU 89 HD22 LEU 89 -8.890 -0.574 -0.524 716 HD23 LEU 89 HD23 LEU 89 -10.339 -1.580 -0.531 717 H VAL 90 HN VAL 90 -10.969 1.743 -5.153 718 HA VAL 90 HA VAL 90 -8.412 2.196 -6.555 719 HB VAL 90 HB VAL 90 -11.157 3.042 -7.477 720 HG11 VAL 90 HG11 VAL 90 -8.417 3.621 -8.545 721 HG12 VAL 90 HG12 VAL 90 -9.713 4.751 -8.147 722 HG13 VAL 90 HG13 VAL 90 -9.855 3.706 -9.561 723 HG21 VAL 90 HG21 VAL 90 -10.636 0.640 -7.795 724 HG22 VAL 90 HG22 VAL 90 -9.254 1.109 -8.784 725 HG23 VAL 90 HG23 VAL 90 -10.892 1.513 -9.304 726 H CYS 91 HN CYS 91 -7.397 4.026 -5.937 727 HA CYS 91 HA CYS 91 -9.029 6.223 -4.865 728 HB2 CYS 91 HB2 CYS 91 -7.637 6.599 -3.016 729 HB3 CYS 91 HB1 CYS 91 -7.886 4.859 -3.038 730 H LYS 92 HN LYS 92 -7.990 5.770 -7.427 731 HA LYS 92 HA LYS 92 -5.610 6.861 -8.180 732 HB2 LYS 92 HB2 LYS 92 -7.056 5.870 -9.813 733 HB3 LYS 92 HB1 LYS 92 -8.313 7.062 -9.513 734 HG2 LYS 92 HG2 LYS 92 -7.128 8.755 -10.615 735 HG3 LYS 92 HG1 LYS 92 -5.619 7.845 -10.572 736 HD2 LYS 92 HD2 LYS 92 -6.471 7.764 -12.802 737 HD3 LYS 92 HD1 LYS 92 -6.681 6.166 -12.083 738 HE2 LYS 92 HE2 LYS 92 -9.031 6.677 -11.625 739 HE3 LYS 92 HE1 LYS 92 -8.819 8.284 -12.326 740 HZ1 LYS 92 HZ1 LYS 92 -9.821 6.773 -13.907 741 HZ2 LYS 92 HZ2 LYS 92 -8.516 5.703 -13.767 742 HZ3 LYS 92 HZ3 LYS 92 -8.286 7.236 -14.442 743 H SER 93 HN SER 93 -4.718 8.799 -8.411 744 HA SER 93 HA SER 93 -6.161 11.072 -7.270 745 HB2 SER 93 HB2 SER 93 -3.197 10.894 -7.786 746 HB3 SER 93 HB1 SER 93 -4.047 11.970 -6.682 747 HG SER 93 HG SER 93 -4.685 9.522 -5.968 748 H GLU 94 HN GLU 94 -4.746 13.154 -8.299 749 HA GLU 94 HA GLU 94 -5.893 13.428 -10.886 750 HB2 GLU 94 HB2 GLU 94 -5.767 15.342 -9.432 751 HB3 GLU 94 HB1 GLU 94 -4.023 15.176 -9.282 752 HG2 GLU 94 HG2 GLU 94 -4.826 15.463 -12.046 753 HG3 GLU 94 HG1 GLU 94 -5.407 16.798 -11.052 754 H LYS 95 HN LYS 95 -2.619 12.904 -9.678 755 HA LYS 95 HA LYS 95 -1.720 12.696 -12.473 756 HB2 LYS 95 HB2 LYS 95 -0.544 13.900 -10.095 757 HB3 LYS 95 HB1 LYS 95 0.567 12.841 -10.961 758 HG2 LYS 95 HG2 LYS 95 0.303 14.068 -12.959 759 HG3 LYS 95 HG1 LYS 95 -1.031 15.000 -12.289 760 HD2 LYS 95 HD2 LYS 95 0.505 15.983 -10.648 761 HD3 LYS 95 HD1 LYS 95 1.839 15.079 -11.370 762 HE2 LYS 95 HE2 LYS 95 1.759 17.413 -12.154 763 HE3 LYS 95 HE1 LYS 95 1.551 16.254 -13.462 764 HZ1 LYS 95 HZ1 LYS 95 -0.366 17.193 -13.971 765 HZ2 LYS 95 HZ2 LYS 95 -0.123 18.354 -12.771 766 HZ3 LYS 95 HZ3 LYS 95 -0.975 16.935 -12.411 767 H PHE 96 HN PHE 96 -2.097 10.932 -9.575 768 HA PHE 96 HA PHE 96 -0.487 8.767 -10.742 769 HB2 PHE 96 HB2 PHE 96 -0.870 9.024 -7.779 770 HB3 PHE 96 HB1 PHE 96 0.372 8.140 -8.661 771 HD1 PHE 96 HD2 PHE 96 2.288 9.310 -9.624 772 HD2 PHE 96 HD1 PHE 96 -0.657 11.373 -7.343 773 HE1 PHE 96 HE2 PHE 96 3.805 11.233 -9.409 774 HE2 PHE 96 HE1 PHE 96 0.861 13.306 -7.126 775 HZ PHE 96 HZ PHE 96 3.088 13.232 -8.166 776 H SER 97 HN SER 97 -1.088 6.619 -9.437 777 HA SER 97 HA SER 97 -3.885 6.422 -8.819 778 HB2 SER 97 HB2 SER 97 -3.984 4.494 -10.659 779 HB3 SER 97 HB1 SER 97 -4.392 6.162 -11.051 780 HG SER 97 HG SER 97 -2.117 6.375 -11.671 781 H HIS 98 HN HIS 98 -4.397 4.556 -7.714 782 HA HIS 98 HA HIS 98 -2.244 2.606 -7.277 783 HB2 HIS 98 HB2 HIS 98 -2.406 4.190 -5.350 784 HB3 HIS 98 HB1 HIS 98 -4.077 3.692 -5.123 785 HD2 HIS 98 HD2 HIS 98 -3.619 0.436 -5.320 786 HE1 HIS 98 HE1 HIS 98 -0.918 1.113 -2.137 787 HE2 HIS 98 HE2 HIS 98 -2.150 -0.649 -3.475 788 H GLU 99 HN GLU 99 -2.937 0.752 -8.046 789 HA GLU 99 HA GLU 99 -5.814 0.169 -8.086 790 HB2 GLU 99 HB2 GLU 99 -4.918 -0.182 -10.207 791 HB3 GLU 99 HB1 GLU 99 -3.426 -0.860 -9.572 792 HG2 GLU 99 HG2 GLU 99 -4.782 -2.831 -8.804 793 HG3 GLU 99 HG1 GLU 99 -6.122 -2.169 -9.742 794 H GLN 100 HN GLN 100 -6.740 -1.395 -6.895 795 HA GLN 100 HA GLN 100 -5.033 -3.320 -5.462 796 HB2 GLN 100 HB2 GLN 100 -7.404 -1.844 -4.292 797 HB3 GLN 100 HB1 GLN 100 -6.482 -3.104 -3.486 798 HG2 GLN 100 HG2 GLN 100 -4.903 -1.688 -2.838 799 HG3 GLN 100 HG1 GLN 100 -4.817 -0.917 -4.423 800 HE21 GLN 100 HE21 GLN 100 -6.030 0.918 -4.817 801 HE22 GLN 100 HE22 GLN 100 -6.845 1.782 -3.565 802 H GLU 101 HN GLU 101 -5.572 -5.184 -6.518 803 HA GLU 101 HA GLU 101 -8.447 -5.713 -6.905 804 HB2 GLU 101 HB2 GLU 101 -7.418 -5.696 -9.046 805 HB3 GLU 101 HB1 GLU 101 -6.050 -6.644 -8.479 806 HG2 GLU 101 HG2 GLU 101 -7.234 -8.618 -8.506 807 HG3 GLU 101 HG1 GLU 101 -8.796 -7.812 -8.384 808 H VAL 102 HN VAL 102 -9.344 -7.297 -5.771 809 HA VAL 102 HA VAL 102 -7.581 -9.225 -4.434 810 HB VAL 102 HB VAL 102 -10.333 -8.229 -3.679 811 HG11 VAL 102 HG11 VAL 102 -10.141 -9.732 -1.718 812 HG12 VAL 102 HG12 VAL 102 -8.717 -10.465 -2.456 813 HG13 VAL 102 HG13 VAL 102 -10.290 -10.604 -3.243 814 HG21 VAL 102 HG21 VAL 102 -7.746 -8.174 -2.148 815 HG22 VAL 102 HG22 VAL 102 -9.271 -7.420 -1.686 816 HG23 VAL 102 HG23 VAL 102 -8.375 -6.821 -3.083 817 H LYS 103 HN LYS 103 -7.589 -11.190 -5.227 818 HA LYS 103 HA LYS 103 -9.975 -12.140 -6.670 819 HB2 LYS 103 HB2 LYS 103 -7.599 -11.819 -7.834 820 HB3 LYS 103 HB1 LYS 103 -7.298 -13.391 -7.115 821 HG2 LYS 103 HG2 LYS 103 -9.709 -12.875 -8.820 822 HG3 LYS 103 HG1 LYS 103 -8.151 -13.316 -9.517 823 HD2 LYS 103 HD2 LYS 103 -9.527 -14.953 -7.394 824 HD3 LYS 103 HD1 LYS 103 -9.772 -15.223 -9.118 825 HE2 LYS 103 HE2 LYS 103 -7.356 -15.608 -9.385 826 HE3 LYS 103 HE1 LYS 103 -7.137 -15.368 -7.653 827 HZ1 LYS 103 HZ1 LYS 103 -8.538 -17.283 -7.242 828 HZ2 LYS 103 HZ2 LYS 103 -7.238 -17.707 -8.234 829 HZ3 LYS 103 HZ3 LYS 103 -8.776 -17.503 -8.902 830 H GLY 104 HN GLY 104 -10.703 -12.687 -4.483 831 HA2 GLY 104 HA2 GLY 104 -11.314 -14.439 -3.102 832 HA3 GLY 104 HA1 GLY 104 -10.124 -15.446 -3.912 833 H ASN 105 HN ASN 105 -8.436 -16.032 -2.771 834 HA ASN 105 HA ASN 105 -7.935 -14.730 -0.206 835 HB2 ASN 105 HB2 ASN 105 -8.146 -17.307 -0.684 836 HB3 ASN 105 HB1 ASN 105 -6.461 -17.159 -1.173 837 HD21 ASN 105 HD21 ASN 105 -4.900 -16.860 0.374 838 HD22 ASN 105 HD22 ASN 105 -5.220 -16.952 2.070 839 H GLU 106 HN GLU 106 -7.033 -14.053 -3.179 840 HA GLU 106 HA GLU 106 -4.263 -13.400 -2.417 841 HB2 GLU 106 HB2 GLU 106 -5.319 -14.220 -5.127 842 HB3 GLU 106 HB1 GLU 106 -3.715 -13.554 -4.859 843 HG2 GLU 106 HG2 GLU 106 -3.177 -15.453 -3.407 844 HG3 GLU 106 HG1 GLU 106 -4.776 -16.129 -3.723 845 H MET 107 HN MET 107 -3.648 -11.312 -2.728 846 HA MET 107 HA MET 107 -5.493 -9.577 -4.228 847 HB2 MET 107 HB2 MET 107 -5.855 -9.118 -1.870 848 HB3 MET 107 HB1 MET 107 -4.126 -8.952 -1.601 849 HG2 MET 107 HG2 MET 107 -4.039 -6.932 -2.854 850 HG3 MET 107 HG1 MET 107 -5.685 -7.152 -3.438 851 HE1 MET 107 HE1 MET 107 -3.548 -7.136 -0.391 852 HE2 MET 107 HE2 MET 107 -4.519 -6.421 0.898 853 HE3 MET 107 HE3 MET 107 -3.678 -5.382 -0.255 854 H VAL 108 HN VAL 108 -4.524 -8.204 -5.649 855 HA VAL 108 HA VAL 108 -1.598 -8.003 -5.504 856 HB VAL 108 HB VAL 108 -1.958 -9.588 -7.246 857 HG11 VAL 108 HG11 VAL 108 -4.281 -9.337 -7.710 858 HG12 VAL 108 HG12 VAL 108 -3.406 -9.058 -9.218 859 HG13 VAL 108 HG13 VAL 108 -4.045 -7.694 -8.306 860 HG21 VAL 108 HG21 VAL 108 -1.495 -6.859 -8.434 861 HG22 VAL 108 HG22 VAL 108 -1.144 -8.384 -9.248 862 HG23 VAL 108 HG23 VAL 108 -0.274 -7.949 -7.776 863 H GLU 109 HN GLU 109 -0.922 -5.952 -5.471 864 HA GLU 109 HA GLU 109 -2.785 -3.945 -6.519 865 HB2 GLU 109 HB2 GLU 109 -2.256 -2.452 -4.807 866 HB3 GLU 109 HB1 GLU 109 -2.374 -4.000 -3.988 867 HG2 GLU 109 HG2 GLU 109 0.313 -3.316 -4.914 868 HG3 GLU 109 HG1 GLU 109 -0.347 -2.236 -3.686 869 H THR 110 HN THR 110 -1.993 -2.262 -7.685 870 HA THR 110 HA THR 110 0.836 -2.380 -8.471 871 HB THR 110 HB THR 110 -1.300 -1.746 -10.492 872 HG1 THR 110 HG1 THR 110 -1.914 -3.776 -10.233 873 HG21 THR 110 HG21 THR 110 0.372 -2.130 -12.091 874 HG22 THR 110 HG22 THR 110 1.367 -3.037 -10.952 875 HG23 THR 110 HG23 THR 110 1.214 -1.288 -10.788 876 H ILE 111 HN ILE 111 1.689 -0.499 -7.835 877 HA ILE 111 HA ILE 111 -0.010 1.912 -8.016 878 HB ILE 111 HB ILE 111 2.426 1.894 -6.293 879 HG12 ILE 111 HG12 ILE 111 -0.167 0.820 -5.215 880 HG13 ILE 111 HG11 ILE 111 1.042 -0.262 -5.903 881 HG21 ILE 111 HG21 ILE 111 -0.301 2.989 -5.685 882 HG22 ILE 111 HG22 ILE 111 0.827 3.845 -6.734 883 HG23 ILE 111 HG23 ILE 111 1.263 3.511 -5.060 884 HD11 ILE 111 HD11 ILE 111 1.601 1.656 -3.658 885 HD12 ILE 111 HD12 ILE 111 2.639 0.358 -4.249 886 HD13 ILE 111 HD13 ILE 111 1.127 -0.026 -3.428 887 H THR 112 HN THR 112 1.148 3.923 -8.547 888 HA THR 112 HA THR 112 3.753 3.566 -9.842 889 HB THR 112 HB THR 112 1.467 5.051 -11.151 890 HG1 THR 112 HG1 THR 112 2.622 2.546 -11.881 891 HG21 THR 112 HG21 THR 112 3.687 5.928 -11.691 892 HG22 THR 112 HG22 THR 112 2.964 5.132 -13.090 893 HG23 THR 112 HG23 THR 112 4.218 4.312 -12.157 894 H PHE 113 HN PHE 113 5.055 4.920 -8.758 895 HA PHE 113 HA PHE 113 4.271 7.724 -8.542 896 HB2 PHE 113 HB2 PHE 113 4.821 5.931 -6.213 897 HB3 PHE 113 HB1 PHE 113 5.325 7.613 -6.135 898 HD1 PHE 113 HD2 PHE 113 3.628 9.413 -6.252 899 HD2 PHE 113 HD1 PHE 113 2.547 5.308 -5.980 900 HE1 PHE 113 HE2 PHE 113 1.364 10.064 -5.544 901 HE2 PHE 113 HE1 PHE 113 0.280 5.952 -5.270 902 HZ PHE 113 HZ PHE 113 -0.310 8.326 -5.040 903 H GLY 114 HN GLY 114 6.002 9.142 -8.510 904 HA2 GLY 114 HA2 GLY 114 8.129 9.873 -8.950 905 HA3 GLY 114 HA1 GLY 114 8.682 8.460 -8.065 906 H GLY 115 HN GLY 115 6.699 7.896 -10.824 907 HA2 GLY 115 HA2 GLY 115 7.237 7.346 -13.016 908 HA3 GLY 115 HA1 GLY 115 8.924 7.689 -12.665 909 H VAL 116 HN VAL 116 7.387 5.623 -10.407 910 HA VAL 116 HA VAL 116 8.477 3.247 -11.777 911 HB VAL 116 HB VAL 116 8.554 3.693 -8.787 912 HG11 VAL 116 HG11 VAL 116 10.192 1.764 -8.955 913 HG12 VAL 116 HG12 VAL 116 9.607 1.544 -10.605 914 HG13 VAL 116 HG13 VAL 116 8.493 1.385 -9.245 915 HG21 VAL 116 HG21 VAL 116 10.045 5.249 -10.067 916 HG22 VAL 116 HG22 VAL 116 10.890 3.828 -10.683 917 HG23 VAL 116 HG23 VAL 116 10.881 4.168 -8.954 918 H THR 117 HN THR 117 7.014 1.725 -12.089 919 HA THR 117 HA THR 117 4.498 1.831 -10.617 920 HB THR 117 HB THR 117 5.250 0.194 -13.051 921 HG1 THR 117 HG1 THR 117 5.099 2.396 -13.559 922 HG21 THR 117 HG21 THR 117 3.432 -0.735 -11.553 923 HG22 THR 117 HG22 THR 117 2.962 -0.417 -13.222 924 HG23 THR 117 HG23 THR 117 2.493 0.706 -11.943 925 H LEU 118 HN LEU 118 5.191 1.011 -8.652 926 HA LEU 118 HA LEU 118 6.636 -1.410 -8.411 927 HB2 LEU 118 HB2 LEU 118 6.746 0.197 -6.621 928 HB3 LEU 118 HB1 LEU 118 5.013 0.109 -6.377 929 HG LEU 118 HG LEU 118 5.160 -2.123 -5.518 930 HD11 LEU 118 HD11 LEU 118 7.308 -3.310 -5.305 931 HD12 LEU 118 HD12 LEU 118 8.094 -2.016 -6.215 932 HD13 LEU 118 HD13 LEU 118 6.867 -3.017 -6.991 933 HD21 LEU 118 HD21 LEU 118 5.823 -0.118 -4.080 934 HD22 LEU 118 HD22 LEU 118 7.473 -0.725 -4.235 935 HD23 LEU 118 HD23 LEU 118 6.229 -1.728 -3.489 936 H ILE 119 HN ILE 119 5.958 -3.357 -8.677 937 HA ILE 119 HA ILE 119 3.092 -3.956 -8.366 938 HB ILE 119 HB ILE 119 5.048 -5.508 -10.058 939 HG12 ILE 119 HG12 ILE 119 3.299 -3.148 -10.702 940 HG13 ILE 119 HG11 ILE 119 4.973 -3.436 -11.154 941 HG21 ILE 119 HG21 ILE 119 2.994 -6.447 -11.035 942 HG22 ILE 119 HG22 ILE 119 2.029 -5.485 -9.919 943 HG23 ILE 119 HG23 ILE 119 3.090 -6.755 -9.300 944 HD11 ILE 119 HD11 ILE 119 2.494 -4.621 -12.336 945 HD12 ILE 119 HD12 ILE 119 4.095 -5.301 -12.620 946 HD13 ILE 119 HD13 ILE 119 3.736 -3.648 -13.127 947 H ARG 120 HN ARG 120 2.520 -5.433 -6.900 948 HA ARG 120 HA ARG 120 4.360 -7.498 -6.090 949 HB2 ARG 120 HB2 ARG 120 3.655 -6.743 -3.591 950 HB3 ARG 120 HB1 ARG 120 5.171 -6.288 -4.353 951 HG2 ARG 120 HG2 ARG 120 4.332 -4.135 -4.916 952 HG3 ARG 120 HG1 ARG 120 2.691 -4.582 -4.443 953 HD2 ARG 120 HD2 ARG 120 4.727 -4.915 -2.350 954 HD3 ARG 120 HD1 ARG 120 4.451 -3.248 -2.854 955 HE ARG 120 HE ARG 120 1.989 -4.619 -2.404 956 HH11 ARG 120 HH11 ARG 120 4.673 -3.212 -0.640 957 HH12 ARG 120 HH12 ARG 120 3.684 -2.675 0.675 958 HH21 ARG 120 HH21 ARG 120 0.681 -3.869 -0.728 959 HH22 ARG 120 HH22 ARG 120 1.399 -3.047 0.632 960 H ARG 121 HN ARG 121 3.385 -9.018 -4.625 961 HA ARG 121 HA ARG 121 0.487 -9.154 -5.098 962 HB2 ARG 121 HB2 ARG 121 2.655 -11.213 -5.279 963 HB3 ARG 121 HB1 ARG 121 1.013 -11.709 -4.895 964 HG2 ARG 121 HG2 ARG 121 1.369 -11.941 -7.231 965 HG3 ARG 121 HG1 ARG 121 0.249 -10.612 -6.962 966 HD2 ARG 121 HD2 ARG 121 1.946 -10.153 -8.713 967 HD3 ARG 121 HD1 ARG 121 1.957 -9.000 -7.380 968 HE ARG 121 HE ARG 121 3.822 -10.839 -6.664 969 HH11 ARG 121 HH11 ARG 121 3.309 -8.841 -9.487 970 HH12 ARG 121 HH12 ARG 121 5.003 -8.733 -9.881 971 HH21 ARG 121 HH21 ARG 121 6.052 -10.720 -7.201 972 HH22 ARG 121 HH22 ARG 121 6.559 -9.795 -8.585 973 H SER 122 HN SER 122 -0.735 -10.259 -3.476 974 HA SER 122 HA SER 122 0.615 -10.584 -0.900 975 HB2 SER 122 HB2 SER 122 -0.537 -8.297 -1.166 976 HB3 SER 122 HB1 SER 122 -2.046 -9.196 -1.083 977 HG SER 122 HG SER 122 -0.045 -8.867 0.860 978 H LYS 123 HN LYS 123 -0.154 -12.171 0.360 979 HA LYS 123 HA LYS 123 -2.400 -13.749 -0.712 980 HB2 LYS 123 HB2 LYS 123 -1.252 -15.666 0.546 981 HB3 LYS 123 HB1 LYS 123 -0.473 -15.109 -0.930 982 HG2 LYS 123 HG2 LYS 123 1.318 -14.246 0.178 983 HG3 LYS 123 HG1 LYS 123 0.387 -13.872 1.629 984 HD2 LYS 123 HD2 LYS 123 1.805 -15.630 2.259 985 HD3 LYS 123 HD1 LYS 123 0.246 -16.398 1.962 986 HE2 LYS 123 HE2 LYS 123 1.011 -17.046 -0.283 987 HE3 LYS 123 HE1 LYS 123 2.570 -16.296 0.045 988 HZ1 LYS 123 HZ1 LYS 123 2.333 -18.801 0.382 989 HZ2 LYS 123 HZ2 LYS 123 1.512 -18.408 1.805 990 HZ3 LYS 123 HZ3 LYS 123 3.113 -17.912 1.591 991 H ARG 124 HN ARG 124 -4.083 -14.133 0.651 992 HA ARG 124 HA ARG 124 -4.200 -12.696 3.099 993 HB2 ARG 124 HB2 ARG 124 -6.097 -13.647 1.470 994 HB3 ARG 124 HB1 ARG 124 -6.083 -14.947 2.656 995 HG2 ARG 124 HG2 ARG 124 -6.489 -13.344 4.436 996 HG3 ARG 124 HG1 ARG 124 -6.499 -12.031 3.259 997 HD2 ARG 124 HD2 ARG 124 -8.756 -12.611 3.760 998 HD3 ARG 124 HD1 ARG 124 -8.405 -13.148 2.122 999 HE ARG 124 HE ARG 124 -7.911 -15.376 3.485 1000 HH11 ARG 124 HH11 ARG 124 -10.581 -13.136 3.737 1001 HH12 ARG 124 HH12 ARG 124 -11.716 -14.342 4.246 1002 HH21 ARG 124 HH21 ARG 124 -9.383 -16.969 4.177 1003 HH22 ARG 124 HH22 ARG 124 -11.029 -16.535 4.513 1004 H VAL 125 HN VAL 125 -4.102 -13.407 5.185 1005 HA VAL 125 HA VAL 125 -3.096 -16.144 5.570 1006 HB VAL 125 HB VAL 125 -1.753 -15.085 7.535 1007 HG11 VAL 125 HG11 VAL 125 -1.072 -15.031 4.627 1008 HG12 VAL 125 HG12 VAL 125 -0.502 -16.121 5.889 1009 HG13 VAL 125 HG13 VAL 125 0.089 -14.458 5.823 1010 HG21 VAL 125 HG21 VAL 125 -1.014 -12.823 7.195 1011 HG22 VAL 125 HG22 VAL 125 -2.777 -12.832 7.251 1012 HG23 VAL 125 HG23 VAL 125 -1.943 -12.700 5.702 Start of MODEL 16 1 H1 ALA 1 HT1 ALA 1 -14.756 -10.590 1.674 2 H2 ALA 1 HT2 ALA 1 -13.319 -10.621 2.568 3 H3 ALA 1 HT3 ALA 1 -13.265 -10.516 0.884 4 HA ALA 1 HA ALA 1 -14.173 -8.346 0.884 5 HB1 ALA 1 HB1 ALA 1 -14.755 -7.201 2.963 6 HB2 ALA 1 HB2 ALA 1 -14.384 -8.661 3.879 7 HB3 ALA 1 HB3 ALA 1 -15.735 -8.651 2.743 8 H PHE 2 HN PHE 2 -12.977 -6.352 1.585 9 HA PHE 2 HA PHE 2 -10.177 -6.822 1.524 10 HB2 PHE 2 HB2 PHE 2 -11.896 -4.379 1.813 11 HB3 PHE 2 HB1 PHE 2 -10.148 -4.265 2.003 12 HD1 PHE 2 HD1 PHE 2 -12.756 -5.478 -0.370 13 HD2 PHE 2 HD2 PHE 2 -8.808 -3.967 0.147 14 HE1 PHE 2 HE1 PHE 2 -12.506 -5.310 -2.816 15 HE2 PHE 2 HE2 PHE 2 -8.556 -3.791 -2.295 16 HZ PHE 2 HZ PHE 2 -10.402 -4.465 -3.781 17 H SER 3 HN SER 3 -12.475 -6.220 4.062 18 HA SER 3 HA SER 3 -10.727 -5.452 6.123 19 HB2 SER 3 HB2 SER 3 -12.853 -6.970 7.222 20 HB3 SER 3 HB1 SER 3 -12.746 -5.213 7.080 21 HG SER 3 HG SER 3 -14.560 -6.524 5.981 22 H GLY 4 HN GLY 4 -8.979 -6.643 6.707 23 HA2 GLY 4 HA2 GLY 4 -9.071 -9.032 8.040 24 HA3 GLY 4 HA1 GLY 4 -8.883 -9.485 6.352 25 H THR 5 HN THR 5 -6.868 -10.379 6.712 26 HA THR 5 HA THR 5 -4.752 -8.374 7.062 27 HB THR 5 HB THR 5 -3.422 -10.359 8.055 28 HG1 THR 5 HG1 THR 5 -4.613 -12.121 8.244 29 HG21 THR 5 HG21 THR 5 -4.070 -9.732 10.293 30 HG22 THR 5 HG22 THR 5 -5.618 -9.119 9.709 31 HG23 THR 5 HG23 THR 5 -4.125 -8.298 9.264 32 H TRP 6 HN TRP 6 -3.542 -8.250 5.311 33 HA TRP 6 HA TRP 6 -3.275 -10.640 3.598 34 HB2 TRP 6 HB2 TRP 6 -3.028 -7.800 2.654 35 HB3 TRP 6 HB1 TRP 6 -3.261 -9.251 1.690 36 HD1 TRP 6 HD1 TRP 6 -5.174 -6.859 3.991 37 HE1 TRP 6 HE1 TRP 6 -7.682 -7.035 3.448 38 HE3 TRP 6 HE3 TRP 6 -5.025 -10.832 0.766 39 HZ2 TRP 6 HZ2 TRP 6 -9.380 -8.674 1.870 40 HZ3 TRP 6 HZ3 TRP 6 -7.137 -11.650 -0.200 41 HH2 TRP 6 HH2 TRP 6 -9.264 -10.587 0.342 42 H GLN 7 HN GLN 7 -1.307 -11.420 3.329 43 HA GLN 7 HA GLN 7 0.992 -9.854 4.237 44 HB2 GLN 7 HB2 GLN 7 0.322 -12.664 4.188 45 HB3 GLN 7 HB1 GLN 7 1.826 -12.405 3.316 46 HG2 GLN 7 HG2 GLN 7 1.296 -11.419 6.108 47 HG3 GLN 7 HG1 GLN 7 2.111 -12.931 5.722 48 HE21 GLN 7 HE21 GLN 7 4.035 -12.357 6.661 49 HE22 GLN 7 HE22 GLN 7 5.079 -11.137 6.012 50 H VAL 8 HN VAL 8 2.340 -8.926 2.828 51 HA VAL 8 HA VAL 8 1.777 -9.280 -0.013 52 HB VAL 8 HB VAL 8 3.458 -7.152 1.291 53 HG11 VAL 8 HG11 VAL 8 2.231 -7.380 -1.441 54 HG12 VAL 8 HG12 VAL 8 3.947 -7.382 -1.029 55 HG13 VAL 8 HG13 VAL 8 2.985 -5.923 -0.797 56 HG21 VAL 8 HG21 VAL 8 1.132 -7.161 2.129 57 HG22 VAL 8 HG22 VAL 8 0.571 -6.959 0.470 58 HG23 VAL 8 HG23 VAL 8 1.551 -5.704 1.227 59 H TYR 9 HN TYR 9 3.299 -9.730 -1.553 60 HA TYR 9 HA TYR 9 6.082 -10.117 -0.818 61 HB2 TYR 9 HB2 TYR 9 6.213 -12.407 -1.557 62 HB3 TYR 9 HB1 TYR 9 4.952 -12.311 -0.337 63 HD1 TYR 9 HD2 TYR 9 2.571 -12.620 -0.971 64 HD2 TYR 9 HD1 TYR 9 5.691 -12.934 -3.863 65 HE1 TYR 9 HE2 TYR 9 1.033 -13.695 -2.517 66 HE2 TYR 9 HE1 TYR 9 4.133 -14.021 -5.419 67 HH TYR 9 HH TYR 9 2.009 -15.346 -5.267 68 H ALA 10 HN ALA 10 7.431 -9.756 -2.562 69 HA ALA 10 HA ALA 10 6.663 -9.951 -5.269 70 HB1 ALA 10 HB1 ALA 10 6.803 -7.094 -4.329 71 HB2 ALA 10 HB2 ALA 10 5.280 -7.963 -4.510 72 HB3 ALA 10 HB3 ALA 10 6.315 -7.698 -5.915 73 H GLN 11 HN GLN 11 8.301 -9.030 -6.730 74 HA GLN 11 HA GLN 11 10.849 -8.383 -5.440 75 HB2 GLN 11 HB2 GLN 11 11.950 -9.931 -7.171 76 HB3 GLN 11 HB1 GLN 11 11.176 -10.682 -5.784 77 HG2 GLN 11 HG2 GLN 11 9.131 -10.960 -7.271 78 HG3 GLN 11 HG1 GLN 11 10.195 -10.545 -8.614 79 HE21 GLN 11 HE21 GLN 11 9.468 -12.900 -6.153 80 HE22 GLN 11 HE22 GLN 11 10.399 -14.189 -6.829 81 H GLU 12 HN GLU 12 8.926 -6.797 -6.808 82 HA GLU 12 HA GLU 12 9.998 -6.210 -9.442 83 HB2 GLU 12 HB2 GLU 12 7.911 -4.687 -7.901 84 HB3 GLU 12 HB1 GLU 12 8.209 -4.642 -9.634 85 HG2 GLU 12 HG2 GLU 12 7.387 -7.151 -8.234 86 HG3 GLU 12 HG1 GLU 12 6.215 -5.975 -8.809 87 H ASN 13 HN ASN 13 9.534 -3.390 -9.304 88 HA ASN 13 HA ASN 13 12.080 -2.498 -8.376 89 HB2 ASN 13 HB2 ASN 13 9.857 -0.587 -9.024 90 HB3 ASN 13 HB1 ASN 13 11.576 -0.457 -9.385 91 HD21 ASN 13 HD21 ASN 13 8.517 -1.604 -10.429 92 HD22 ASN 13 HD22 ASN 13 9.018 -2.197 -11.972 93 H TYR 14 HN TYR 14 11.390 -3.501 -6.200 94 HA TYR 14 HA TYR 14 9.715 -1.953 -4.486 95 HB2 TYR 14 HB2 TYR 14 10.002 -4.379 -4.207 96 HB3 TYR 14 HB1 TYR 14 11.707 -4.138 -3.838 97 HD1 TYR 14 HD1 TYR 14 12.352 -2.992 -1.722 98 HD2 TYR 14 HD2 TYR 14 8.324 -4.095 -2.543 99 HE1 TYR 14 HE1 TYR 14 11.811 -2.780 0.658 100 HE2 TYR 14 HE2 TYR 14 7.774 -3.882 -0.155 101 HH TYR 14 HH TYR 14 9.600 -4.063 2.161 102 H GLU 15 HN GLU 15 13.209 -2.703 -4.226 103 HA GLU 15 HA GLU 15 13.662 -0.649 -2.350 104 HB2 GLU 15 HB2 GLU 15 15.843 -1.336 -2.299 105 HB3 GLU 15 HB1 GLU 15 15.068 -2.775 -2.934 106 HG2 GLU 15 HG2 GLU 15 15.970 -2.522 -5.000 107 HG3 GLU 15 HG1 GLU 15 16.113 -0.772 -4.855 108 H GLU 16 HN GLU 16 13.598 -0.707 -5.796 109 HA GLU 16 HA GLU 16 15.009 1.706 -6.256 110 HB2 GLU 16 HB2 GLU 16 14.497 -0.074 -7.968 111 HB3 GLU 16 HB1 GLU 16 12.833 0.489 -7.966 112 HG2 GLU 16 HG2 GLU 16 14.047 1.389 -9.847 113 HG3 GLU 16 HG1 GLU 16 13.572 2.681 -8.745 114 H PHE 17 HN PHE 17 11.621 0.905 -5.675 115 HA PHE 17 HA PHE 17 10.625 3.535 -6.117 116 HB2 PHE 17 HB2 PHE 17 9.078 1.700 -6.293 117 HB3 PHE 17 HB1 PHE 17 9.469 1.141 -4.669 118 HD1 PHE 17 HD2 PHE 17 8.435 4.422 -6.149 119 HD2 PHE 17 HD1 PHE 17 7.713 1.418 -3.224 120 HE1 PHE 17 HE2 PHE 17 6.543 5.723 -5.282 121 HE2 PHE 17 HE1 PHE 17 5.817 2.721 -2.349 122 HZ PHE 17 HZ PHE 17 5.232 4.875 -3.380 123 H LEU 18 HN LEU 18 11.896 1.806 -3.358 124 HA LEU 18 HA LEU 18 11.064 3.514 -1.308 125 HB2 LEU 18 HB2 LEU 18 13.696 2.064 -1.441 126 HB3 LEU 18 HB1 LEU 18 12.875 2.621 0.002 127 HG LEU 18 HG LEU 18 12.066 0.356 -1.807 128 HD11 LEU 18 HD11 LEU 18 13.861 0.079 -0.040 129 HD12 LEU 18 HD12 LEU 18 12.504 -1.044 0.007 130 HD13 LEU 18 HD13 LEU 18 12.574 0.301 1.144 131 HD21 LEU 18 HD21 LEU 18 10.158 0.050 -0.257 132 HD22 LEU 18 HD22 LEU 18 10.049 1.518 -1.229 133 HD23 LEU 18 HD23 LEU 18 10.537 1.615 0.463 134 H LYS 19 HN LYS 19 13.601 3.839 -3.666 135 HA LYS 19 HA LYS 19 14.995 5.955 -2.359 136 HB2 LYS 19 HB2 LYS 19 15.059 5.626 -5.334 137 HB3 LYS 19 HB1 LYS 19 16.358 6.047 -4.228 138 HG2 LYS 19 HG2 LYS 19 15.370 3.402 -3.676 139 HG3 LYS 19 HG1 LYS 19 15.848 3.556 -5.367 140 HD2 LYS 19 HD2 LYS 19 18.054 4.153 -4.788 141 HD3 LYS 19 HD1 LYS 19 17.615 4.475 -3.109 142 HE2 LYS 19 HE2 LYS 19 18.526 2.410 -2.814 143 HE3 LYS 19 HE1 LYS 19 16.887 1.912 -3.228 144 HZ1 LYS 19 HZ1 LYS 19 18.371 0.614 -4.510 145 HZ2 LYS 19 HZ2 LYS 19 19.258 1.970 -5.007 146 HZ3 LYS 19 HZ3 LYS 19 17.685 1.740 -5.576 147 H ALA 20 HN ALA 20 12.146 5.763 -4.302 148 HA ALA 20 HA ALA 20 12.204 8.515 -5.129 149 HB1 ALA 20 HB1 ALA 20 10.026 8.090 -6.106 150 HB2 ALA 20 HB2 ALA 20 9.914 6.554 -5.250 151 HB3 ALA 20 HB3 ALA 20 11.128 6.775 -6.509 152 H LEU 21 HN LEU 21 11.206 6.826 -2.359 153 HA LEU 21 HA LEU 21 9.375 8.929 -1.513 154 HB2 LEU 21 HB2 LEU 21 10.246 6.403 -0.120 155 HB3 LEU 21 HB1 LEU 21 8.987 7.489 0.435 156 HG LEU 21 HG LEU 21 8.533 6.552 -2.287 157 HD11 LEU 21 HD11 LEU 21 8.823 4.553 -0.064 158 HD12 LEU 21 HD12 LEU 21 9.549 4.527 -1.672 159 HD13 LEU 21 HD13 LEU 21 7.818 4.268 -1.485 160 HD21 LEU 21 HD21 LEU 21 6.329 5.949 -1.223 161 HD22 LEU 21 HD22 LEU 21 6.795 7.649 -1.129 162 HD23 LEU 21 HD23 LEU 21 6.977 6.607 0.282 163 H ALA 22 HN ALA 22 12.541 8.735 -1.707 164 HA ALA 22 HA ALA 22 14.314 9.753 -0.742 165 HB1 ALA 22 HB1 ALA 22 12.702 11.672 -0.650 166 HB2 ALA 22 HB2 ALA 22 13.975 11.715 0.567 167 HB3 ALA 22 HB3 ALA 22 12.347 11.212 1.013 168 H LEU 23 HN LEU 23 13.323 7.249 0.268 169 HA LEU 23 HA LEU 23 13.588 7.306 3.138 170 HB2 LEU 23 HB2 LEU 23 13.406 5.030 1.169 171 HB3 LEU 23 HB1 LEU 23 13.529 4.803 2.906 172 HG LEU 23 HG LEU 23 11.313 6.392 1.623 173 HD11 LEU 23 HD11 LEU 23 9.911 4.380 1.991 174 HD12 LEU 23 HD12 LEU 23 11.377 3.466 2.353 175 HD13 LEU 23 HD13 LEU 23 11.141 4.162 0.748 176 HD21 LEU 23 HD21 LEU 23 11.672 6.871 3.978 177 HD22 LEU 23 HD22 LEU 23 11.618 5.149 4.356 178 HD23 LEU 23 HD23 LEU 23 10.175 5.966 3.759 179 HA PRO 24 HA PRO 24 17.928 6.714 3.438 180 HB2 PRO 24 HB2 PRO 24 17.751 4.662 5.486 181 HB3 PRO 24 HB1 PRO 24 18.203 6.366 5.658 182 HG2 PRO 24 HG2 PRO 24 15.922 5.336 6.677 183 HG3 PRO 24 HG1 PRO 24 16.099 7.028 6.169 184 HD2 PRO 24 HD2 PRO 24 14.812 4.748 4.726 185 HD3 PRO 24 HD1 PRO 24 14.294 6.441 4.855 186 H GLU 25 HN GLU 25 19.229 5.694 2.092 187 HA GLU 25 HA GLU 25 18.667 3.379 0.704 188 HB2 GLU 25 HB2 GLU 25 21.411 4.443 1.369 189 HB3 GLU 25 HB1 GLU 25 21.028 3.333 0.060 190 HG2 GLU 25 HG2 GLU 25 21.033 5.238 -1.142 191 HG3 GLU 25 HG1 GLU 25 19.370 5.337 -0.566 192 H ASP 26 HN ASP 26 20.253 3.737 3.805 193 HA ASP 26 HA ASP 26 21.322 1.140 4.008 194 HB2 ASP 26 HB2 ASP 26 20.564 3.237 6.014 195 HB3 ASP 26 HB1 ASP 26 21.020 1.630 6.559 196 H LEU 27 HN LEU 27 18.229 2.499 5.127 197 HA LEU 27 HA LEU 27 17.270 0.027 6.172 198 HB2 LEU 27 HB2 LEU 27 16.514 2.407 6.742 199 HB3 LEU 27 HB1 LEU 27 15.570 2.328 5.268 200 HG LEU 27 HG LEU 27 14.715 0.062 6.419 201 HD11 LEU 27 HD11 LEU 27 15.468 1.894 8.687 202 HD12 LEU 27 HD12 LEU 27 16.065 0.258 8.400 203 HD13 LEU 27 HD13 LEU 27 14.373 0.519 8.832 204 HD21 LEU 27 HD21 LEU 27 12.749 1.260 7.055 205 HD22 LEU 27 HD22 LEU 27 13.395 2.014 5.595 206 HD23 LEU 27 HD23 LEU 27 13.643 2.777 7.168 207 H ILE 28 HN ILE 28 17.125 1.650 3.090 208 HA ILE 28 HA ILE 28 15.052 0.285 1.854 209 HB ILE 28 HB ILE 28 17.569 1.523 0.774 210 HG12 ILE 28 HG12 ILE 28 14.674 2.352 0.529 211 HG13 ILE 28 HG11 ILE 28 15.753 2.938 1.788 212 HG21 ILE 28 HG21 ILE 28 16.100 -0.403 -0.582 213 HG22 ILE 28 HG22 ILE 28 17.239 0.744 -1.286 214 HG23 ILE 28 HG23 ILE 28 15.520 1.133 -1.224 215 HD11 ILE 28 HD11 ILE 28 16.915 4.268 0.353 216 HD12 ILE 28 HD12 ILE 28 15.317 4.314 -0.394 217 HD13 ILE 28 HD13 ILE 28 16.569 3.255 -1.046 218 H LYS 29 HN LYS 29 18.501 -0.610 2.055 219 HA LYS 29 HA LYS 29 18.315 -2.918 0.451 220 HB2 LYS 29 HB2 LYS 29 20.243 -1.857 2.471 221 HB3 LYS 29 HB1 LYS 29 20.435 -3.503 1.888 222 HG2 LYS 29 HG2 LYS 29 21.773 -1.736 0.721 223 HG3 LYS 29 HG1 LYS 29 20.816 -2.785 -0.311 224 HD2 LYS 29 HD2 LYS 29 19.149 -1.051 -0.573 225 HD3 LYS 29 HD1 LYS 29 20.016 -0.019 0.569 226 HE2 LYS 29 HE2 LYS 29 20.628 0.798 -1.543 227 HE3 LYS 29 HE1 LYS 29 21.991 -0.200 -1.043 228 HZ1 LYS 29 HZ1 LYS 29 21.108 -1.997 -2.417 229 HZ2 LYS 29 HZ2 LYS 29 21.428 -0.615 -3.337 230 HZ3 LYS 29 HZ3 LYS 29 19.831 -1.002 -2.924 231 H MET 30 HN MET 30 17.568 -2.312 3.789 232 HA MET 30 HA MET 30 17.481 -5.122 4.503 233 HB2 MET 30 HB2 MET 30 16.333 -2.780 6.034 234 HB3 MET 30 HB1 MET 30 16.704 -4.376 6.666 235 HG2 MET 30 HG2 MET 30 19.023 -3.992 6.545 236 HG3 MET 30 HG1 MET 30 18.807 -2.561 5.541 237 HE1 MET 30 HE1 MET 30 20.749 -2.075 7.756 238 HE2 MET 30 HE2 MET 30 20.099 -0.628 8.527 239 HE3 MET 30 HE3 MET 30 20.045 -0.789 6.772 240 H ALA 31 HN ALA 31 15.242 -2.502 3.836 241 HA ALA 31 HA ALA 31 12.820 -3.753 4.359 242 HB1 ALA 31 HB1 ALA 31 11.829 -2.059 2.910 243 HB2 ALA 31 HB2 ALA 31 13.423 -1.677 2.260 244 HB3 ALA 31 HB3 ALA 31 13.064 -1.358 3.957 245 H ARG 32 HN ARG 32 14.869 -3.980 1.506 246 HA ARG 32 HA ARG 32 12.890 -5.159 -0.166 247 HB2 ARG 32 HB2 ARG 32 14.664 -5.588 -1.729 248 HB3 ARG 32 HB1 ARG 32 14.898 -3.995 -1.035 249 HG2 ARG 32 HG2 ARG 32 16.678 -4.748 0.328 250 HG3 ARG 32 HG1 ARG 32 16.349 -6.437 -0.075 251 HD2 ARG 32 HD2 ARG 32 16.907 -4.540 -2.295 252 HD3 ARG 32 HD1 ARG 32 18.258 -5.059 -1.285 253 HE ARG 32 HE ARG 32 17.197 -7.405 -1.872 254 HH11 ARG 32 HH11 ARG 32 17.755 -4.662 -4.008 255 HH12 ARG 32 HH12 ARG 32 17.994 -5.666 -5.407 256 HH21 ARG 32 HH21 ARG 32 17.553 -8.689 -3.701 257 HH22 ARG 32 HH22 ARG 32 17.887 -7.945 -5.230 258 H ASP 33 HN ASP 33 14.325 -6.395 2.534 259 HA ASP 33 HA ASP 33 13.985 -9.160 1.552 260 HB2 ASP 33 HB2 ASP 33 16.329 -8.607 2.262 261 HB3 ASP 33 HB1 ASP 33 15.713 -8.280 3.882 262 H ILE 34 HN ILE 34 12.364 -6.896 2.995 263 HA ILE 34 HA ILE 34 11.246 -8.587 5.130 264 HB ILE 34 HB ILE 34 11.059 -5.583 4.861 265 HG12 ILE 34 HG12 ILE 34 12.929 -7.352 6.419 266 HG13 ILE 34 HG11 ILE 34 13.332 -6.051 5.312 267 HG21 ILE 34 HG21 ILE 34 10.329 -7.375 7.173 268 HG22 ILE 34 HG22 ILE 34 9.190 -6.591 6.077 269 HG23 ILE 34 HG23 ILE 34 10.209 -5.615 7.136 270 HD11 ILE 34 HD11 ILE 34 13.783 -5.154 7.390 271 HD12 ILE 34 HD12 ILE 34 12.359 -5.886 8.129 272 HD13 ILE 34 HD13 ILE 34 12.178 -4.525 7.021 273 H LYS 35 HN LYS 35 9.120 -9.055 5.127 274 HA LYS 35 HA LYS 35 7.478 -7.996 2.911 275 HB2 LYS 35 HB2 LYS 35 7.387 -10.724 4.233 276 HB3 LYS 35 HB1 LYS 35 6.199 -10.148 3.075 277 HG2 LYS 35 HG2 LYS 35 7.879 -10.035 1.344 278 HG3 LYS 35 HG1 LYS 35 9.139 -10.484 2.498 279 HD2 LYS 35 HD2 LYS 35 8.046 -12.650 2.839 280 HD3 LYS 35 HD1 LYS 35 6.782 -12.199 1.697 281 HE2 LYS 35 HE2 LYS 35 8.463 -11.996 -0.073 282 HE3 LYS 35 HE1 LYS 35 9.716 -12.476 1.068 283 HZ1 LYS 35 HZ1 LYS 35 8.443 -14.584 1.372 284 HZ2 LYS 35 HZ2 LYS 35 9.114 -14.380 -0.167 285 HZ3 LYS 35 HZ3 LYS 35 7.461 -14.121 0.073 286 HA PRO 36 HA PRO 36 5.650 -6.534 6.908 287 HB2 PRO 36 HB2 PRO 36 4.541 -4.296 5.717 288 HB3 PRO 36 HB1 PRO 36 6.111 -4.335 6.541 289 HG2 PRO 36 HG2 PRO 36 5.503 -4.356 3.651 290 HG3 PRO 36 HG1 PRO 36 6.894 -3.688 4.525 291 HD2 PRO 36 HD2 PRO 36 6.992 -6.005 3.100 292 HD3 PRO 36 HD1 PRO 36 8.038 -5.656 4.488 293 H ILE 37 HN ILE 37 3.674 -7.054 7.555 294 HA ILE 37 HA ILE 37 1.770 -7.943 5.561 295 HB ILE 37 HB ILE 37 2.315 -9.301 7.607 296 HG12 ILE 37 HG12 ILE 37 0.056 -9.211 6.171 297 HG13 ILE 37 HG11 ILE 37 0.284 -10.325 7.513 298 HG21 ILE 37 HG21 ILE 37 1.017 -8.670 9.686 299 HG22 ILE 37 HG22 ILE 37 0.853 -7.062 8.978 300 HG23 ILE 37 HG23 ILE 37 2.455 -7.712 9.332 301 HD11 ILE 37 HD11 ILE 37 -1.083 -9.082 8.933 302 HD12 ILE 37 HD12 ILE 37 -1.914 -9.030 7.378 303 HD13 ILE 37 HD13 ILE 37 -0.975 -7.641 7.923 304 H VAL 38 HN VAL 38 -0.266 -7.100 5.266 305 HA VAL 38 HA VAL 38 -0.569 -4.354 6.267 306 HB VAL 38 HB VAL 38 -2.077 -5.686 4.013 307 HG11 VAL 38 HG11 VAL 38 -1.835 -2.769 4.741 308 HG12 VAL 38 HG12 VAL 38 -3.234 -3.791 5.078 309 HG13 VAL 38 HG13 VAL 38 -2.772 -3.451 3.410 310 HG21 VAL 38 HG21 VAL 38 0.328 -5.518 3.536 311 HG22 VAL 38 HG22 VAL 38 0.257 -3.784 3.851 312 HG23 VAL 38 HG23 VAL 38 -0.635 -4.471 2.493 313 H GLU 39 HN GLU 39 -1.653 -4.348 8.149 314 HA GLU 39 HA GLU 39 -3.924 -6.147 8.487 315 HB2 GLU 39 HB2 GLU 39 -2.198 -4.579 10.299 316 HB3 GLU 39 HB1 GLU 39 -3.901 -4.631 10.743 317 HG2 GLU 39 HG2 GLU 39 -3.886 -6.885 11.126 318 HG3 GLU 39 HG1 GLU 39 -2.539 -7.171 10.025 319 H ILE 40 HN ILE 40 -5.738 -5.509 7.638 320 HA ILE 40 HA ILE 40 -6.435 -2.656 7.808 321 HB ILE 40 HB ILE 40 -5.853 -3.225 5.506 322 HG12 ILE 40 HG12 ILE 40 -7.859 -1.678 6.204 323 HG13 ILE 40 HG11 ILE 40 -7.566 -2.058 4.514 324 HG21 ILE 40 HG21 ILE 40 -6.285 -5.542 5.395 325 HG22 ILE 40 HG22 ILE 40 -7.336 -4.760 4.212 326 HG23 ILE 40 HG23 ILE 40 -7.996 -5.311 5.751 327 HD11 ILE 40 HD11 ILE 40 -9.559 -3.497 6.245 328 HD12 ILE 40 HD12 ILE 40 -9.347 -3.660 4.501 329 HD13 ILE 40 HD13 ILE 40 -9.946 -2.147 5.182 330 H GLN 41 HN GLN 41 -8.349 -2.164 8.639 331 HA GLN 41 HA GLN 41 -10.365 -4.284 8.908 332 HB2 GLN 41 HB2 GLN 41 -10.916 -3.332 11.169 333 HB3 GLN 41 HB1 GLN 41 -9.366 -4.155 11.077 334 HG2 GLN 41 HG2 GLN 41 -8.410 -2.358 11.938 335 HG3 GLN 41 HG1 GLN 41 -8.854 -1.465 10.483 336 HE21 GLN 41 HE21 GLN 41 -8.651 -0.558 13.250 337 HE22 GLN 41 HE22 GLN 41 -10.205 0.084 13.651 338 H GLN 42 HN GLN 42 -12.493 -3.596 8.655 339 HA GLN 42 HA GLN 42 -12.815 -0.746 8.005 340 HB2 GLN 42 HB2 GLN 42 -14.095 -1.192 6.128 341 HB3 GLN 42 HB1 GLN 42 -12.858 -2.443 6.049 342 HG2 GLN 42 HG2 GLN 42 -14.330 -4.094 6.732 343 HG3 GLN 42 HG1 GLN 42 -15.488 -2.949 7.361 344 HE21 GLN 42 HE21 GLN 42 -14.317 -4.535 4.569 345 HE22 GLN 42 HE22 GLN 42 -15.579 -4.020 3.525 346 H LYS 43 HN LYS 43 -15.363 -0.430 7.710 347 HA LYS 43 HA LYS 43 -17.014 -1.723 9.657 348 HB2 LYS 43 HB2 LYS 43 -15.655 0.821 10.309 349 HB3 LYS 43 HB1 LYS 43 -17.379 0.773 10.646 350 HG2 LYS 43 HG2 LYS 43 -17.106 -0.530 12.422 351 HG3 LYS 43 HG1 LYS 43 -15.997 -1.605 11.571 352 HD2 LYS 43 HD2 LYS 43 -14.292 0.340 11.877 353 HD3 LYS 43 HD1 LYS 43 -15.404 0.873 13.141 354 HE2 LYS 43 HE2 LYS 43 -13.769 -0.492 14.194 355 HE3 LYS 43 HE1 LYS 43 -15.253 -1.443 14.109 356 HZ1 LYS 43 HZ1 LYS 43 -14.296 -2.433 12.017 357 HZ2 LYS 43 HZ2 LYS 43 -13.520 -2.863 13.451 358 HZ3 LYS 43 HZ3 LYS 43 -12.819 -1.711 12.432 359 H GLY 44 HN GLY 44 -17.661 -1.797 7.225 360 HA2 GLY 44 HA2 GLY 44 -19.702 -1.360 6.108 361 HA3 GLY 44 HA1 GLY 44 -19.766 0.210 6.894 362 H ASP 45 HN ASP 45 -18.365 1.887 6.119 363 HA ASP 45 HA ASP 45 -17.387 1.406 3.383 364 HB2 ASP 45 HB2 ASP 45 -18.766 3.881 4.448 365 HB3 ASP 45 HB1 ASP 45 -17.967 3.791 2.884 366 H ASP 46 HN ASP 46 -16.763 2.561 6.530 367 HA ASP 46 HA ASP 46 -14.448 4.133 5.758 368 HB2 ASP 46 HB2 ASP 46 -15.755 3.494 8.392 369 HB3 ASP 46 HB1 ASP 46 -14.157 4.231 8.325 370 H PHE 47 HN PHE 47 -12.395 3.477 5.834 371 HA PHE 47 HA PHE 47 -11.855 0.742 6.806 372 HB2 PHE 47 HB2 PHE 47 -10.891 2.147 4.327 373 HB3 PHE 47 HB1 PHE 47 -10.001 0.805 5.020 374 HD1 PHE 47 HD2 PHE 47 -13.671 1.301 4.552 375 HD2 PHE 47 HD1 PHE 47 -10.198 -0.948 3.586 376 HE1 PHE 47 HE2 PHE 47 -15.061 -0.298 3.300 377 HE2 PHE 47 HE1 PHE 47 -11.575 -2.545 2.328 378 HZ PHE 47 HZ PHE 47 -14.009 -2.221 2.180 379 H VAL 48 HN VAL 48 -9.876 0.377 7.747 380 HA VAL 48 HA VAL 48 -8.167 2.707 8.285 381 HB VAL 48 HB VAL 48 -8.927 0.611 10.337 382 HG11 VAL 48 HG11 VAL 48 -7.160 3.044 10.583 383 HG12 VAL 48 HG12 VAL 48 -6.601 1.374 10.521 384 HG13 VAL 48 HG13 VAL 48 -7.576 1.928 11.885 385 HG21 VAL 48 HG21 VAL 48 -10.772 2.051 10.217 386 HG22 VAL 48 HG22 VAL 48 -9.757 3.468 9.954 387 HG23 VAL 48 HG23 VAL 48 -9.802 2.702 11.541 388 H VAL 49 HN VAL 49 -6.518 2.177 7.016 389 HA VAL 49 HA VAL 49 -5.526 -0.568 6.946 390 HB VAL 49 HB VAL 49 -4.555 1.831 5.393 391 HG11 VAL 49 HG11 VAL 49 -2.997 -0.136 5.680 392 HG12 VAL 49 HG12 VAL 49 -3.372 0.319 4.018 393 HG13 VAL 49 HG13 VAL 49 -4.162 -1.078 4.748 394 HG21 VAL 49 HG21 VAL 49 -5.865 0.928 3.525 395 HG22 VAL 49 HG22 VAL 49 -6.891 1.366 4.890 396 HG23 VAL 49 HG23 VAL 49 -6.502 -0.326 4.588 397 H THR 50 HN THR 50 -4.122 -1.149 8.425 398 HA THR 50 HA THR 50 -2.311 0.832 9.592 399 HB THR 50 HB THR 50 -2.931 -1.984 10.497 400 HG1 THR 50 HG1 THR 50 -4.134 0.489 10.977 401 HG21 THR 50 HG21 THR 50 -1.871 -1.287 12.603 402 HG22 THR 50 HG22 THR 50 -1.462 0.266 11.873 403 HG23 THR 50 HG23 THR 50 -0.747 -1.219 11.246 404 H SER 51 HN SER 51 -0.506 1.020 8.432 405 HA SER 51 HA SER 51 0.714 -1.359 7.250 406 HB2 SER 51 HB2 SER 51 1.823 1.406 6.960 407 HB3 SER 51 HB1 SER 51 1.855 0.071 5.812 408 HG SER 51 HG SER 51 -0.654 0.532 6.106 409 H LYS 52 HN LYS 52 1.743 -2.437 8.781 410 HA LYS 52 HA LYS 52 3.274 -1.074 10.837 411 HB2 LYS 52 HB2 LYS 52 2.445 -3.927 10.389 412 HB3 LYS 52 HB1 LYS 52 3.656 -3.508 11.591 413 HG2 LYS 52 HG2 LYS 52 2.092 -2.189 12.815 414 HG3 LYS 52 HG1 LYS 52 0.893 -2.335 11.534 415 HD2 LYS 52 HD2 LYS 52 0.623 -4.674 11.957 416 HD3 LYS 52 HD1 LYS 52 1.982 -4.677 13.082 417 HE2 LYS 52 HE2 LYS 52 0.758 -3.207 14.584 418 HE3 LYS 52 HE1 LYS 52 -0.596 -3.159 13.458 419 HZ1 LYS 52 HZ1 LYS 52 -0.863 -4.732 15.338 420 HZ2 LYS 52 HZ2 LYS 52 0.409 -5.648 14.706 421 HZ3 LYS 52 HZ3 LYS 52 -1.021 -5.455 13.813 422 H THR 53 HN THR 53 5.379 -0.831 10.804 423 HA THR 53 HA THR 53 6.994 -2.531 9.046 424 HB THR 53 HB THR 53 8.202 -0.688 8.168 425 HG1 THR 53 HG1 THR 53 6.826 1.352 9.425 426 HG21 THR 53 HG21 THR 53 6.578 0.521 6.952 427 HG22 THR 53 HG22 THR 53 5.383 0.382 8.248 428 HG23 THR 53 HG23 THR 53 5.834 -1.040 7.296 429 HA PRO 54 HA PRO 54 9.777 -2.748 12.480 430 HB2 PRO 54 HB2 PRO 54 12.118 -2.381 10.757 431 HB3 PRO 54 HB1 PRO 54 11.561 -3.839 11.596 432 HG2 PRO 54 HG2 PRO 54 11.468 -3.614 8.941 433 HG3 PRO 54 HG1 PRO 54 10.251 -4.521 9.859 434 HD2 PRO 54 HD2 PRO 54 10.070 -1.755 8.723 435 HD3 PRO 54 HD1 PRO 54 8.865 -3.060 8.714 436 H ARG 55 HN ARG 55 9.047 0.097 11.412 437 HA ARG 55 HA ARG 55 10.928 1.450 13.149 438 HB2 ARG 55 HB2 ARG 55 11.459 1.412 10.422 439 HB3 ARG 55 HB1 ARG 55 10.708 2.979 10.691 440 HG2 ARG 55 HG2 ARG 55 12.355 3.576 12.312 441 HG3 ARG 55 HG1 ARG 55 13.017 1.942 12.319 442 HD2 ARG 55 HD2 ARG 55 14.523 3.028 10.971 443 HD3 ARG 55 HD1 ARG 55 13.395 2.395 9.778 444 HE ARG 55 HE ARG 55 12.345 4.730 9.956 445 HH11 ARG 55 HH11 ARG 55 15.768 4.104 10.351 446 HH12 ARG 55 HH12 ARG 55 16.250 5.656 9.755 447 HH21 ARG 55 HH21 ARG 55 12.984 6.770 9.151 448 HH22 ARG 55 HH22 ARG 55 14.669 7.180 9.074 449 H GLN 56 HN GLN 56 8.221 1.885 10.872 450 HA GLN 56 HA GLN 56 6.908 3.517 12.897 451 HB2 GLN 56 HB2 GLN 56 8.095 5.191 11.624 452 HB3 GLN 56 HB1 GLN 56 7.530 4.503 10.111 453 HG2 GLN 56 HG2 GLN 56 6.278 6.474 10.529 454 HG3 GLN 56 HG1 GLN 56 5.212 5.095 10.777 455 HE21 GLN 56 HE21 GLN 56 7.654 6.184 13.051 456 HE22 GLN 56 HE22 GLN 56 6.544 6.690 14.274 457 H THR 57 HN THR 57 4.949 2.706 13.128 458 HA THR 57 HA THR 57 3.684 1.336 10.873 459 HB THR 57 HB THR 57 3.588 -0.010 12.816 460 HG1 THR 57 HG1 THR 57 1.076 1.342 12.676 461 HG21 THR 57 HG21 THR 57 4.152 1.463 14.578 462 HG22 THR 57 HG22 THR 57 2.540 0.862 14.965 463 HG23 THR 57 HG23 THR 57 2.741 2.478 14.286 464 H VAL 58 HN VAL 58 2.564 2.658 9.581 465 HA VAL 58 HA VAL 58 1.304 5.039 10.727 466 HB VAL 58 HB VAL 58 0.814 5.707 8.416 467 HG11 VAL 58 HG11 VAL 58 3.681 4.937 8.355 468 HG12 VAL 58 HG12 VAL 58 3.118 5.979 9.658 469 HG13 VAL 58 HG13 VAL 58 2.918 6.479 7.979 470 HG21 VAL 58 HG21 VAL 58 0.523 3.502 7.433 471 HG22 VAL 58 HG22 VAL 58 2.239 3.173 7.655 472 HG23 VAL 58 HG23 VAL 58 1.723 4.437 6.540 473 H THR 59 HN THR 59 -0.878 5.643 10.172 474 HA THR 59 HA THR 59 -2.669 3.345 9.757 475 HB THR 59 HB THR 59 -3.323 5.633 11.608 476 HG1 THR 59 HG1 THR 59 -1.451 4.451 12.369 477 HG21 THR 59 HG21 THR 59 -4.901 3.923 12.537 478 HG22 THR 59 HG22 THR 59 -4.451 2.867 11.198 479 HG23 THR 59 HG23 THR 59 -5.242 4.409 10.877 480 H ASN 60 HN ASN 60 -3.620 3.678 7.863 481 HA ASN 60 HA ASN 60 -4.288 6.449 7.047 482 HB2 ASN 60 HB2 ASN 60 -3.811 3.929 5.422 483 HB3 ASN 60 HB1 ASN 60 -4.476 5.408 4.738 484 HD21 ASN 60 HD21 ASN 60 -1.646 3.847 5.982 485 HD22 ASN 60 HD22 ASN 60 -0.521 5.067 5.504 486 H SER 61 HN SER 61 -6.446 6.950 6.986 487 HA SER 61 HA SER 61 -8.337 4.692 6.907 488 HB2 SER 61 HB2 SER 61 -8.839 7.227 8.471 489 HB3 SER 61 HB1 SER 61 -9.733 5.706 8.536 490 HG SER 61 HG SER 61 -7.137 5.276 9.071 491 H PHE 62 HN PHE 62 -10.206 4.976 5.704 492 HA PHE 62 HA PHE 62 -10.735 7.526 4.457 493 HB2 PHE 62 HB2 PHE 62 -10.618 6.542 2.136 494 HB3 PHE 62 HB1 PHE 62 -9.064 6.790 2.919 495 HD1 PHE 62 HD1 PHE 62 -11.526 4.257 1.876 496 HD2 PHE 62 HD2 PHE 62 -7.632 4.972 3.438 497 HE1 PHE 62 HE1 PHE 62 -10.924 1.912 1.450 498 HE2 PHE 62 HE2 PHE 62 -7.031 2.627 3.021 499 HZ PHE 62 HZ PHE 62 -8.676 1.093 2.027 500 H THR 63 HN THR 63 -12.624 7.294 2.894 501 HA THR 63 HA THR 63 -14.451 5.199 3.845 502 HB THR 63 HB THR 63 -15.404 7.899 2.923 503 HG1 THR 63 HG1 THR 63 -14.914 7.186 5.647 504 HG21 THR 63 HG21 THR 63 -16.571 5.818 4.772 505 HG22 THR 63 HG22 THR 63 -17.031 6.069 3.088 506 HG23 THR 63 HG23 THR 63 -17.353 7.322 4.286 507 H LEU 64 HN LEU 64 -15.451 4.034 2.303 508 HA LEU 64 HA LEU 64 -14.528 4.050 -0.337 509 HB2 LEU 64 HB2 LEU 64 -17.016 2.823 0.845 510 HB3 LEU 64 HB1 LEU 64 -16.439 2.500 -0.777 511 HG LEU 64 HG LEU 64 -15.076 1.772 1.810 512 HD11 LEU 64 HD11 LEU 64 -15.336 -0.514 0.947 513 HD12 LEU 64 HD12 LEU 64 -16.202 0.127 -0.450 514 HD13 LEU 64 HD13 LEU 64 -16.887 0.294 1.165 515 HD21 LEU 64 HD21 LEU 64 -13.378 0.701 0.319 516 HD22 LEU 64 HD22 LEU 64 -13.343 2.464 0.335 517 HD23 LEU 64 HD23 LEU 64 -14.077 1.609 -1.023 518 H GLY 65 HN GLY 65 -14.858 5.475 -1.839 519 HA2 GLY 65 HA2 GLY 65 -16.264 6.446 -3.480 520 HA3 GLY 65 HA1 GLY 65 -17.594 6.387 -2.337 521 H LYS 66 HN LYS 66 -14.794 7.543 -0.867 522 HA LYS 66 HA LYS 66 -15.434 10.334 -1.512 523 HB2 LYS 66 HB2 LYS 66 -15.393 9.054 1.201 524 HB3 LYS 66 HB1 LYS 66 -14.992 10.756 1.023 525 HG2 LYS 66 HG2 LYS 66 -17.175 11.148 -0.015 526 HG3 LYS 66 HG1 LYS 66 -17.572 9.444 0.206 527 HD2 LYS 66 HD2 LYS 66 -17.402 9.682 2.613 528 HD3 LYS 66 HD1 LYS 66 -16.896 11.361 2.435 529 HE2 LYS 66 HE2 LYS 66 -19.093 11.785 1.288 530 HE3 LYS 66 HE1 LYS 66 -19.575 10.160 1.774 531 HZ1 LYS 66 HZ1 LYS 66 -20.348 11.892 3.315 532 HZ2 LYS 66 HZ2 LYS 66 -18.745 12.304 3.657 533 HZ3 LYS 66 HZ3 LYS 66 -19.328 10.776 4.070 534 H GLU 67 HN GLU 67 -13.759 11.845 -0.890 535 HA GLU 67 HA GLU 67 -11.103 10.685 -1.212 536 HB2 GLU 67 HB2 GLU 67 -11.767 12.600 -2.645 537 HB3 GLU 67 HB1 GLU 67 -11.965 13.584 -1.201 538 HG2 GLU 67 HG2 GLU 67 -9.605 13.381 -0.703 539 HG3 GLU 67 HG1 GLU 67 -9.381 12.314 -2.087 540 H ALA 68 HN ALA 68 -9.978 10.208 0.556 541 HA ALA 68 HA ALA 68 -10.550 11.759 2.986 542 HB1 ALA 68 HB1 ALA 68 -9.524 8.936 2.835 543 HB2 ALA 68 HB2 ALA 68 -11.211 9.382 3.078 544 HB3 ALA 68 HB3 ALA 68 -10.001 9.822 4.283 545 H ASP 69 HN ASP 69 -8.933 12.523 4.195 546 HA ASP 69 HA ASP 69 -6.373 12.856 2.936 547 HB2 ASP 69 HB2 ASP 69 -7.160 14.752 4.114 548 HB3 ASP 69 HB1 ASP 69 -7.572 13.802 5.534 549 H ILE 70 HN ILE 70 -4.688 11.571 3.195 550 HA ILE 70 HA ILE 70 -4.535 9.941 5.626 551 HB ILE 70 HB ILE 70 -3.496 8.114 4.177 552 HG12 ILE 70 HG12 ILE 70 -4.720 8.178 1.840 553 HG13 ILE 70 HG11 ILE 70 -4.616 9.924 2.071 554 HG21 ILE 70 HG21 ILE 70 -5.830 7.342 3.415 555 HG22 ILE 70 HG22 ILE 70 -6.400 8.819 4.197 556 HG23 ILE 70 HG23 ILE 70 -5.539 7.600 5.136 557 HD11 ILE 70 HD11 ILE 70 -2.178 9.712 2.331 558 HD12 ILE 70 HD12 ILE 70 -2.742 9.113 0.768 559 HD13 ILE 70 HD13 ILE 70 -2.318 7.976 2.049 560 H THR 71 HN THR 71 -2.309 9.075 6.008 561 HA THR 71 HA THR 71 -0.312 10.984 4.960 562 HB THR 71 HB THR 71 -0.379 9.936 7.788 563 HG1 THR 71 HG1 THR 71 -2.076 11.486 7.223 564 HG21 THR 71 HG21 THR 71 1.873 10.477 6.915 565 HG22 THR 71 HG22 THR 71 1.379 11.576 8.204 566 HG23 THR 71 HG23 THR 71 1.310 12.102 6.523 567 H THR 72 HN THR 72 1.460 10.129 4.140 568 HA THR 72 HA THR 72 1.783 7.281 4.047 569 HB THR 72 HB THR 72 2.235 8.571 2.057 570 HG1 THR 72 HG1 THR 72 4.741 8.021 2.030 571 HG21 THR 72 HG21 THR 72 4.078 10.064 3.863 572 HG22 THR 72 HG22 THR 72 2.883 10.681 2.721 573 HG23 THR 72 HG23 THR 72 4.404 10.002 2.132 574 H MET 73 HN MET 73 4.319 6.682 4.144 575 HA MET 73 HA MET 73 4.983 6.896 6.955 576 HB2 MET 73 HB2 MET 73 5.043 4.821 5.368 577 HB3 MET 73 HB1 MET 73 6.618 5.451 4.912 578 HG2 MET 73 HG2 MET 73 7.510 5.096 7.022 579 HG3 MET 73 HG1 MET 73 5.921 4.995 7.783 580 HE1 MET 73 HE1 MET 73 4.226 3.136 7.329 581 HE2 MET 73 HE2 MET 73 4.583 1.552 6.638 582 HE3 MET 73 HE3 MET 73 4.424 2.963 5.586 583 H ASP 74 HN ASP 74 6.003 8.281 3.958 584 HA ASP 74 HA ASP 74 8.610 9.012 4.994 585 HB2 ASP 74 HB2 ASP 74 8.946 10.114 2.796 586 HB3 ASP 74 HB1 ASP 74 8.554 8.407 2.681 587 H GLY 75 HN GLY 75 5.603 10.248 5.445 588 HA2 GLY 75 HA2 GLY 75 5.105 12.145 6.704 589 HA3 GLY 75 HA1 GLY 75 6.737 12.723 6.433 590 H LYS 76 HN LYS 76 4.228 11.864 4.079 591 HA LYS 76 HA LYS 76 4.191 14.666 3.195 592 HB2 LYS 76 HB2 LYS 76 4.360 12.137 1.587 593 HB3 LYS 76 HB1 LYS 76 3.612 13.571 0.905 594 HG2 LYS 76 HG2 LYS 76 5.873 14.696 1.709 595 HG3 LYS 76 HG1 LYS 76 6.461 13.041 1.555 596 HD2 LYS 76 HD2 LYS 76 5.088 13.295 -0.751 597 HD3 LYS 76 HD1 LYS 76 5.618 14.958 -0.512 598 HE2 LYS 76 HE2 LYS 76 7.319 13.943 -1.787 599 HE3 LYS 76 HE1 LYS 76 7.944 14.006 -0.139 600 HZ1 LYS 76 HZ1 LYS 76 7.146 11.671 0.125 601 HZ2 LYS 76 HZ2 LYS 76 8.407 11.858 -0.994 602 HZ3 LYS 76 HZ3 LYS 76 6.821 11.648 -1.538 603 H LYS 77 HN LYS 77 2.157 15.339 2.219 604 HA LYS 77 HA LYS 77 -0.089 13.840 3.368 605 HB2 LYS 77 HB2 LYS 77 0.447 16.721 2.927 606 HB3 LYS 77 HB1 LYS 77 -1.217 16.188 2.735 607 HG2 LYS 77 HG2 LYS 77 0.476 15.767 5.189 608 HG3 LYS 77 HG1 LYS 77 -0.765 17.004 4.992 609 HD2 LYS 77 HD2 LYS 77 -2.453 15.260 4.675 610 HD3 LYS 77 HD1 LYS 77 -1.218 14.022 4.882 611 HE2 LYS 77 HE2 LYS 77 -1.469 14.099 7.076 612 HE3 LYS 77 HE1 LYS 77 -1.072 15.818 7.083 613 HZ1 LYS 77 HZ1 LYS 77 -3.785 14.698 6.584 614 HZ2 LYS 77 HZ2 LYS 77 -3.375 16.335 6.704 615 HZ3 LYS 77 HZ3 LYS 77 -3.249 15.339 8.058 616 H LEU 78 HN LEU 78 -1.237 12.655 2.039 617 HA LEU 78 HA LEU 78 -1.673 13.631 -0.704 618 HB2 LEU 78 HB2 LEU 78 -1.411 10.708 -0.074 619 HB3 LEU 78 HB1 LEU 78 -1.328 11.503 -1.631 620 HG LEU 78 HG LEU 78 0.786 11.936 0.469 621 HD11 LEU 78 HD11 LEU 78 0.686 9.544 0.064 622 HD12 LEU 78 HD12 LEU 78 2.125 10.237 -0.689 623 HD13 LEU 78 HD13 LEU 78 0.728 9.820 -1.680 624 HD21 LEU 78 HD21 LEU 78 0.815 12.215 -2.534 625 HD22 LEU 78 HD22 LEU 78 2.146 12.578 -1.435 626 HD23 LEU 78 HD23 LEU 78 0.672 13.545 -1.383 627 H LYS 79 HN LYS 79 -3.638 12.668 -1.708 628 HA LYS 79 HA LYS 79 -5.613 11.808 0.289 629 HB2 LYS 79 HB2 LYS 79 -6.169 13.760 -1.940 630 HB3 LYS 79 HB1 LYS 79 -7.307 13.199 -0.731 631 HG2 LYS 79 HG2 LYS 79 -5.943 14.289 1.013 632 HG3 LYS 79 HG1 LYS 79 -4.893 14.923 -0.253 633 HD2 LYS 79 HD2 LYS 79 -7.857 15.434 -0.108 634 HD3 LYS 79 HD1 LYS 79 -6.636 16.521 0.554 635 HE2 LYS 79 HE2 LYS 79 -5.785 17.031 -1.575 636 HE3 LYS 79 HE1 LYS 79 -6.590 15.654 -2.323 637 HZ1 LYS 79 HZ1 LYS 79 -8.024 17.970 -1.151 638 HZ2 LYS 79 HZ2 LYS 79 -8.693 16.707 -2.064 639 HZ3 LYS 79 HZ3 LYS 79 -7.647 17.820 -2.795 640 H CYS 80 HN CYS 80 -6.318 9.866 -0.255 641 HA CYS 80 HA CYS 80 -6.473 9.182 -3.112 642 HB2 CYS 80 HB2 CYS 80 -5.485 7.721 -0.822 643 HB3 CYS 80 HB1 CYS 80 -6.777 6.821 -1.606 644 H THR 81 HN THR 81 -8.441 9.351 -3.906 645 HA THR 81 HA THR 81 -10.789 9.239 -2.231 646 HB THR 81 HB THR 81 -10.765 10.903 -3.964 647 HG1 THR 81 HG1 THR 81 -12.514 8.759 -4.666 648 HG21 THR 81 HG21 THR 81 -9.438 10.383 -5.701 649 HG22 THR 81 HG22 THR 81 -10.900 9.679 -6.399 650 HG23 THR 81 HG23 THR 81 -9.747 8.654 -5.534 651 H VAL 82 HN VAL 82 -9.976 6.997 -1.729 652 HA VAL 82 HA VAL 82 -10.180 4.855 -3.492 653 HB VAL 82 HB VAL 82 -10.856 4.519 -0.599 654 HG11 VAL 82 HG11 VAL 82 -9.271 2.911 -2.599 655 HG12 VAL 82 HG12 VAL 82 -10.896 2.558 -2.010 656 HG13 VAL 82 HG13 VAL 82 -9.519 2.469 -0.907 657 HG21 VAL 82 HG21 VAL 82 -9.001 5.624 -0.003 658 HG22 VAL 82 HG22 VAL 82 -8.437 5.733 -1.670 659 HG23 VAL 82 HG23 VAL 82 -8.109 4.282 -0.724 660 H HIS 83 HN HIS 83 -11.761 3.816 -4.364 661 HA HIS 83 HA HIS 83 -14.390 3.732 -3.116 662 HB2 HIS 83 HB2 HIS 83 -15.519 4.286 -5.243 663 HB3 HIS 83 HB1 HIS 83 -14.518 5.619 -4.686 664 HD1 HIS 83 HD1 HIS 83 -14.846 3.140 -7.448 665 HD2 HIS 83 HD2 HIS 83 -12.304 6.216 -6.296 666 HE1 HIS 83 HE1 HIS 83 -13.371 3.584 -9.434 667 HE2 HIS 83 HE2 HIS 83 -11.970 5.565 -8.774 668 H LEU 84 HN LEU 84 -15.641 1.916 -3.773 669 HA LEU 84 HA LEU 84 -13.968 -0.279 -4.677 670 HB2 LEU 84 HB2 LEU 84 -15.351 -0.557 -2.673 671 HB3 LEU 84 HB1 LEU 84 -16.797 -0.269 -3.622 672 HG LEU 84 HG LEU 84 -15.954 -2.324 -5.012 673 HD11 LEU 84 HD11 LEU 84 -14.807 -3.987 -3.610 674 HD12 LEU 84 HD12 LEU 84 -14.613 -2.766 -2.349 675 HD13 LEU 84 HD13 LEU 84 -13.814 -2.560 -3.908 676 HD21 LEU 84 HD21 LEU 84 -17.211 -3.827 -3.478 677 HD22 LEU 84 HD22 LEU 84 -18.051 -2.321 -3.851 678 HD23 LEU 84 HD23 LEU 84 -17.248 -2.519 -2.295 679 H ALA 85 HN ALA 85 -13.814 -0.605 -6.776 680 HA ALA 85 HA ALA 85 -16.237 -0.323 -8.437 681 HB1 ALA 85 HB1 ALA 85 -14.579 1.456 -8.881 682 HB2 ALA 85 HB2 ALA 85 -14.853 0.416 -10.277 683 HB3 ALA 85 HB3 ALA 85 -13.397 0.218 -9.301 684 H ASN 86 HN ASN 86 -16.890 -2.180 -9.237 685 HA ASN 86 HA ASN 86 -16.977 -4.314 -9.991 686 HB2 ASN 86 HB2 ASN 86 -14.145 -3.689 -10.857 687 HB3 ASN 86 HB1 ASN 86 -15.001 -5.156 -11.304 688 HD21 ASN 86 HD21 ASN 86 -14.532 -1.837 -11.953 689 HD22 ASN 86 HD22 ASN 86 -15.637 -1.710 -13.276 690 H GLY 87 HN GLY 87 -16.313 -3.892 -7.259 691 HA2 GLY 87 HA2 GLY 87 -15.823 -5.245 -5.459 692 HA3 GLY 87 HA1 GLY 87 -15.414 -6.521 -6.597 693 H LYS 88 HN LYS 88 -13.782 -3.653 -7.242 694 HA LYS 88 HA LYS 88 -11.385 -4.614 -5.822 695 HB2 LYS 88 HB2 LYS 88 -11.321 -3.003 -8.373 696 HB3 LYS 88 HB1 LYS 88 -10.033 -3.958 -7.655 697 HG2 LYS 88 HG2 LYS 88 -12.548 -5.091 -8.861 698 HG3 LYS 88 HG1 LYS 88 -10.988 -4.973 -9.675 699 HD2 LYS 88 HD2 LYS 88 -10.006 -6.569 -8.296 700 HD3 LYS 88 HD1 LYS 88 -11.228 -6.379 -7.040 701 HE2 LYS 88 HE2 LYS 88 -11.521 -8.488 -8.202 702 HE3 LYS 88 HE1 LYS 88 -12.887 -7.418 -8.511 703 HZ1 LYS 88 HZ1 LYS 88 -11.845 -6.825 -10.638 704 HZ2 LYS 88 HZ2 LYS 88 -12.215 -8.470 -10.537 705 HZ3 LYS 88 HZ3 LYS 88 -10.613 -7.953 -10.346 706 H LEU 89 HN LEU 89 -9.838 -2.829 -5.280 707 HA LEU 89 HA LEU 89 -11.385 -0.446 -4.543 708 HB2 LEU 89 HB2 LEU 89 -9.921 -2.104 -2.938 709 HB3 LEU 89 HB1 LEU 89 -8.782 -0.803 -3.244 710 HG LEU 89 HG LEU 89 -10.145 0.796 -2.233 711 HD11 LEU 89 HD11 LEU 89 -12.270 0.582 -3.072 712 HD12 LEU 89 HD12 LEU 89 -12.506 0.017 -1.418 713 HD13 LEU 89 HD13 LEU 89 -12.341 -1.147 -2.730 714 HD21 LEU 89 HD21 LEU 89 -10.508 -1.745 -0.671 715 HD22 LEU 89 HD22 LEU 89 -10.693 -0.112 -0.031 716 HD23 LEU 89 HD23 LEU 89 -9.117 -0.664 -0.602 717 H VAL 90 HN VAL 90 -10.894 1.481 -5.335 718 HA VAL 90 HA VAL 90 -8.284 1.849 -6.659 719 HB VAL 90 HB VAL 90 -10.932 2.739 -7.805 720 HG11 VAL 90 HG11 VAL 90 -9.232 4.241 -8.481 721 HG12 VAL 90 HG12 VAL 90 -9.523 3.164 -9.848 722 HG13 VAL 90 HG13 VAL 90 -8.108 2.924 -8.823 723 HG21 VAL 90 HG21 VAL 90 -10.567 1.047 -9.560 724 HG22 VAL 90 HG22 VAL 90 -10.783 0.325 -7.967 725 HG23 VAL 90 HG23 VAL 90 -9.170 0.447 -8.669 726 H CYS 91 HN CYS 91 -7.314 3.708 -6.047 727 HA CYS 91 HA CYS 91 -9.021 5.957 -5.211 728 HB2 CYS 91 HB2 CYS 91 -7.607 6.516 -3.394 729 HB3 CYS 91 HB1 CYS 91 -7.900 4.788 -3.266 730 H LYS 92 HN LYS 92 -7.996 5.400 -7.732 731 HA LYS 92 HA LYS 92 -5.603 6.494 -8.502 732 HB2 LYS 92 HB2 LYS 92 -7.000 5.295 -10.075 733 HB3 LYS 92 HB1 LYS 92 -8.245 6.531 -9.968 734 HG2 LYS 92 HG2 LYS 92 -7.015 8.064 -11.209 735 HG3 LYS 92 HG1 LYS 92 -5.493 7.219 -10.925 736 HD2 LYS 92 HD2 LYS 92 -6.136 6.816 -13.185 737 HD3 LYS 92 HD1 LYS 92 -6.389 5.320 -12.283 738 HE2 LYS 92 HE2 LYS 92 -8.779 5.905 -12.064 739 HE3 LYS 92 HE1 LYS 92 -8.497 7.338 -13.049 740 HZ1 LYS 92 HZ1 LYS 92 -7.816 5.906 -14.869 741 HZ2 LYS 92 HZ2 LYS 92 -9.390 5.540 -14.366 742 HZ3 LYS 92 HZ3 LYS 92 -8.105 4.531 -13.922 743 H SER 93 HN SER 93 -4.778 8.426 -8.804 744 HA SER 93 HA SER 93 -6.411 10.750 -8.076 745 HB2 SER 93 HB2 SER 93 -3.397 10.601 -8.081 746 HB3 SER 93 HB1 SER 93 -4.429 11.749 -7.233 747 HG SER 93 HG SER 93 -5.104 9.305 -6.435 748 H GLU 94 HN GLU 94 -5.054 12.815 -9.106 749 HA GLU 94 HA GLU 94 -5.581 12.543 -11.913 750 HB2 GLU 94 HB2 GLU 94 -5.372 14.876 -12.043 751 HB3 GLU 94 HB1 GLU 94 -6.040 14.591 -10.443 752 HG2 GLU 94 HG2 GLU 94 -3.557 14.636 -9.686 753 HG3 GLU 94 HG1 GLU 94 -3.292 15.468 -11.216 754 H LYS 95 HN LYS 95 -2.756 12.391 -9.914 755 HA LYS 95 HA LYS 95 -1.055 12.487 -12.320 756 HB2 LYS 95 HB2 LYS 95 -0.649 14.159 -10.455 757 HB3 LYS 95 HB1 LYS 95 -0.137 12.799 -9.465 758 HG2 LYS 95 HG2 LYS 95 1.621 12.297 -11.119 759 HG3 LYS 95 HG1 LYS 95 1.139 13.730 -12.028 760 HD2 LYS 95 HD2 LYS 95 1.683 15.144 -10.128 761 HD3 LYS 95 HD1 LYS 95 2.102 13.729 -9.164 762 HE2 LYS 95 HE2 LYS 95 3.957 13.225 -10.597 763 HE3 LYS 95 HE1 LYS 95 3.482 14.480 -11.737 764 HZ1 LYS 95 HZ1 LYS 95 3.838 16.093 -9.868 765 HZ2 LYS 95 HZ2 LYS 95 5.235 15.354 -10.465 766 HZ3 LYS 95 HZ3 LYS 95 4.568 14.832 -9.003 767 H PHE 96 HN PHE 96 -2.019 10.531 -9.598 768 HA PHE 96 HA PHE 96 -0.227 8.402 -10.561 769 HB2 PHE 96 HB2 PHE 96 -1.031 8.598 -7.675 770 HB3 PHE 96 HB1 PHE 96 0.324 7.734 -8.390 771 HD1 PHE 96 HD2 PHE 96 2.356 8.927 -9.039 772 HD2 PHE 96 HD1 PHE 96 -0.881 10.907 -7.113 773 HE1 PHE 96 HE2 PHE 96 3.841 10.815 -8.494 774 HE2 PHE 96 HE1 PHE 96 0.593 12.800 -6.575 775 HZ PHE 96 HZ PHE 96 2.958 12.754 -7.259 776 H SER 97 HN SER 97 -0.990 6.219 -9.503 777 HA SER 97 HA SER 97 -3.842 5.990 -9.182 778 HB2 SER 97 HB2 SER 97 -4.000 4.303 -11.082 779 HB3 SER 97 HB1 SER 97 -3.863 5.995 -11.559 780 HG SER 97 HG SER 97 -2.289 3.965 -12.222 781 H HIS 98 HN HIS 98 -4.325 4.337 -7.896 782 HA HIS 98 HA HIS 98 -2.279 2.273 -7.448 783 HB2 HIS 98 HB2 HIS 98 -2.603 3.838 -5.503 784 HB3 HIS 98 HB1 HIS 98 -4.273 3.298 -5.407 785 HD2 HIS 98 HD2 HIS 98 -3.733 0.041 -5.601 786 HE1 HIS 98 HE1 HIS 98 -1.276 0.774 -2.235 787 HE2 HIS 98 HE2 HIS 98 -2.498 -0.998 -3.556 788 H GLU 99 HN GLU 99 -2.897 0.371 -8.132 789 HA GLU 99 HA GLU 99 -5.778 -0.174 -8.429 790 HB2 GLU 99 HB2 GLU 99 -4.737 -0.488 -10.508 791 HB3 GLU 99 HB1 GLU 99 -3.313 -1.227 -9.785 792 HG2 GLU 99 HG2 GLU 99 -4.638 -3.205 -9.226 793 HG3 GLU 99 HG1 GLU 99 -6.050 -2.464 -9.983 794 H GLN 100 HN GLN 100 -6.762 -1.712 -7.226 795 HA GLN 100 HA GLN 100 -5.097 -3.704 -5.851 796 HB2 GLN 100 HB2 GLN 100 -7.050 -1.802 -4.624 797 HB3 GLN 100 HB1 GLN 100 -6.875 -3.406 -3.934 798 HG2 GLN 100 HG2 GLN 100 -4.353 -2.855 -3.897 799 HG3 GLN 100 HG1 GLN 100 -4.888 -1.186 -4.075 800 HE21 GLN 100 HE21 GLN 100 -3.496 -2.462 -1.867 801 HE22 GLN 100 HE22 GLN 100 -4.516 -2.246 -0.480 802 H GLU 101 HN GLU 101 -5.785 -5.689 -6.329 803 HA GLU 101 HA GLU 101 -8.657 -6.058 -6.876 804 HB2 GLU 101 HB2 GLU 101 -7.694 -6.238 -9.005 805 HB3 GLU 101 HB1 GLU 101 -6.282 -7.088 -8.397 806 HG2 GLU 101 HG2 GLU 101 -7.449 -9.103 -8.162 807 HG3 GLU 101 HG1 GLU 101 -9.015 -8.309 -8.286 808 H VAL 102 HN VAL 102 -9.607 -7.433 -5.560 809 HA VAL 102 HA VAL 102 -7.973 -9.391 -4.113 810 HB VAL 102 HB VAL 102 -10.754 -8.354 -3.519 811 HG11 VAL 102 HG11 VAL 102 -10.756 -9.767 -1.552 812 HG12 VAL 102 HG12 VAL 102 -9.184 -10.428 -2.001 813 HG13 VAL 102 HG13 VAL 102 -10.597 -10.753 -3.008 814 HG21 VAL 102 HG21 VAL 102 -8.184 -8.137 -1.968 815 HG22 VAL 102 HG22 VAL 102 -9.749 -7.485 -1.487 816 HG23 VAL 102 HG23 VAL 102 -8.926 -6.844 -2.911 817 H LYS 103 HN LYS 103 -7.963 -11.345 -4.880 818 HA LYS 103 HA LYS 103 -10.295 -12.315 -6.398 819 HB2 LYS 103 HB2 LYS 103 -7.847 -11.839 -7.439 820 HB3 LYS 103 HB1 LYS 103 -7.632 -13.501 -6.918 821 HG2 LYS 103 HG2 LYS 103 -9.411 -14.251 -8.320 822 HG3 LYS 103 HG1 LYS 103 -9.887 -12.588 -8.687 823 HD2 LYS 103 HD2 LYS 103 -7.795 -12.211 -9.845 824 HD3 LYS 103 HD1 LYS 103 -7.221 -13.818 -9.399 825 HE2 LYS 103 HE2 LYS 103 -8.982 -14.834 -10.734 826 HE3 LYS 103 HE1 LYS 103 -9.615 -13.240 -11.138 827 HZ1 LYS 103 HZ1 LYS 103 -7.348 -12.788 -12.107 828 HZ2 LYS 103 HZ2 LYS 103 -8.311 -13.891 -12.953 829 HZ3 LYS 103 HZ3 LYS 103 -7.054 -14.448 -11.972 830 H GLY 104 HN GLY 104 -11.263 -13.387 -4.685 831 HA2 GLY 104 HA2 GLY 104 -11.694 -15.276 -3.441 832 HA3 GLY 104 HA1 GLY 104 -10.256 -15.994 -4.145 833 H ASN 105 HN ASN 105 -8.332 -15.925 -3.058 834 HA ASN 105 HA ASN 105 -8.459 -14.883 -0.305 835 HB2 ASN 105 HB2 ASN 105 -7.047 -16.744 0.382 836 HB3 ASN 105 HB1 ASN 105 -8.483 -17.355 -0.430 837 HD21 ASN 105 HD21 ASN 105 -5.074 -17.203 -0.433 838 HD22 ASN 105 HD22 ASN 105 -4.804 -18.147 -1.859 839 H GLU 106 HN GLU 106 -7.291 -13.968 -3.066 840 HA GLU 106 HA GLU 106 -4.680 -13.175 -1.958 841 HB2 GLU 106 HB2 GLU 106 -5.365 -14.258 -4.663 842 HB3 GLU 106 HB1 GLU 106 -4.047 -13.099 -4.510 843 HG2 GLU 106 HG2 GLU 106 -2.759 -14.539 -3.252 844 HG3 GLU 106 HG1 GLU 106 -4.142 -15.515 -2.757 845 H MET 107 HN MET 107 -3.898 -11.137 -2.631 846 HA MET 107 HA MET 107 -5.825 -9.388 -3.976 847 HB2 MET 107 HB2 MET 107 -6.186 -9.018 -1.595 848 HB3 MET 107 HB1 MET 107 -4.463 -8.760 -1.352 849 HG2 MET 107 HG2 MET 107 -4.521 -6.748 -2.660 850 HG3 MET 107 HG1 MET 107 -6.202 -7.039 -3.100 851 HE1 MET 107 HE1 MET 107 -3.896 -5.395 -0.125 852 HE2 MET 107 HE2 MET 107 -3.951 -7.155 -0.067 853 HE3 MET 107 HE3 MET 107 -4.770 -6.209 1.180 854 H VAL 108 HN VAL 108 -4.749 -8.806 -5.724 855 HA VAL 108 HA VAL 108 -1.878 -8.242 -5.498 856 HB VAL 108 HB VAL 108 -1.771 -8.434 -7.939 857 HG11 VAL 108 HG11 VAL 108 -2.218 -10.850 -8.094 858 HG12 VAL 108 HG12 VAL 108 -3.105 -10.767 -6.574 859 HG13 VAL 108 HG13 VAL 108 -1.378 -10.413 -6.607 860 HG21 VAL 108 HG21 VAL 108 -4.725 -9.030 -7.749 861 HG22 VAL 108 HG22 VAL 108 -3.731 -9.357 -9.171 862 HG23 VAL 108 HG23 VAL 108 -3.950 -7.700 -8.611 863 H GLU 109 HN GLU 109 -1.102 -6.236 -5.784 864 HA GLU 109 HA GLU 109 -2.987 -4.217 -6.789 865 HB2 GLU 109 HB2 GLU 109 -2.592 -2.745 -5.056 866 HB3 GLU 109 HB1 GLU 109 -2.625 -4.292 -4.230 867 HG2 GLU 109 HG2 GLU 109 -0.133 -4.315 -4.338 868 HG3 GLU 109 HG1 GLU 109 -0.208 -2.667 -4.961 869 H THR 110 HN THR 110 -2.138 -2.452 -7.833 870 HA THR 110 HA THR 110 0.703 -2.594 -8.619 871 HB THR 110 HB THR 110 -1.490 -1.734 -10.506 872 HG1 THR 110 HG1 THR 110 -1.942 -3.755 -10.866 873 HG21 THR 110 HG21 THR 110 0.142 -1.887 -12.197 874 HG22 THR 110 HG22 THR 110 1.242 -2.804 -11.166 875 HG23 THR 110 HG23 THR 110 0.955 -1.094 -10.847 876 H ILE 111 HN ILE 111 1.559 -0.850 -7.659 877 HA ILE 111 HA ILE 111 -0.029 1.635 -7.694 878 HB ILE 111 HB ILE 111 2.376 1.381 -5.946 879 HG12 ILE 111 HG12 ILE 111 -0.302 0.220 -5.158 880 HG13 ILE 111 HG11 ILE 111 1.060 -0.757 -5.696 881 HG21 ILE 111 HG21 ILE 111 1.249 2.901 -4.567 882 HG22 ILE 111 HG22 ILE 111 -0.315 2.539 -5.298 883 HG23 ILE 111 HG23 ILE 111 0.900 3.435 -6.211 884 HD11 ILE 111 HD11 ILE 111 1.025 1.038 -3.282 885 HD12 ILE 111 HD12 ILE 111 2.387 0.047 -3.817 886 HD13 ILE 111 HD13 ILE 111 0.892 -0.721 -3.278 887 H THR 112 HN THR 112 1.105 3.622 -8.107 888 HA THR 112 HA THR 112 3.792 3.421 -9.236 889 HB THR 112 HB THR 112 1.544 4.774 -10.740 890 HG1 THR 112 HG1 THR 112 2.533 2.181 -10.788 891 HG21 THR 112 HG21 THR 112 3.157 5.168 -12.446 892 HG22 THR 112 HG22 THR 112 4.353 4.150 -11.640 893 HG23 THR 112 HG23 THR 112 3.888 5.697 -10.927 894 H PHE 113 HN PHE 113 4.901 4.825 -8.039 895 HA PHE 113 HA PHE 113 3.888 7.546 -7.773 896 HB2 PHE 113 HB2 PHE 113 4.172 5.627 -5.533 897 HB3 PHE 113 HB1 PHE 113 4.829 7.231 -5.260 898 HD1 PHE 113 HD1 PHE 113 3.367 9.183 -5.191 899 HD2 PHE 113 HD2 PHE 113 1.806 5.261 -5.726 900 HE1 PHE 113 HE1 PHE 113 1.117 10.005 -4.643 901 HE2 PHE 113 HE2 PHE 113 -0.454 6.079 -5.180 902 HZ PHE 113 HZ PHE 113 -0.798 8.459 -4.634 903 H GLY 114 HN GLY 114 5.505 9.066 -7.444 904 HA2 GLY 114 HA2 GLY 114 7.625 9.955 -7.540 905 HA3 GLY 114 HA1 GLY 114 8.179 8.471 -6.781 906 H GLY 115 HN GLY 115 6.487 8.130 -9.738 907 HA2 GLY 115 HA2 GLY 115 7.206 7.774 -11.913 908 HA3 GLY 115 HA1 GLY 115 8.824 8.254 -11.429 909 H VAL 116 HN VAL 116 7.289 5.831 -9.513 910 HA VAL 116 HA VAL 116 8.780 3.726 -10.935 911 HB VAL 116 HB VAL 116 8.506 3.719 -7.941 912 HG11 VAL 116 HG11 VAL 116 9.091 1.621 -8.958 913 HG12 VAL 116 HG12 VAL 116 10.493 2.262 -8.100 914 HG13 VAL 116 HG13 VAL 116 10.404 2.381 -9.857 915 HG21 VAL 116 HG21 VAL 116 10.871 4.574 -7.871 916 HG22 VAL 116 HG22 VAL 116 9.635 5.761 -8.290 917 HG23 VAL 116 HG23 VAL 116 10.655 5.067 -9.550 918 H THR 117 HN THR 117 7.695 1.864 -11.235 919 HA THR 117 HA THR 117 4.947 1.757 -10.246 920 HB THR 117 HB THR 117 6.223 0.063 -12.401 921 HG1 THR 117 HG1 THR 117 6.181 2.309 -12.953 922 HG21 THR 117 HG21 THR 117 3.316 0.612 -11.780 923 HG22 THR 117 HG22 THR 117 4.177 -0.862 -11.347 924 HG23 THR 117 HG23 THR 117 3.934 -0.449 -13.046 925 H LEU 118 HN LEU 118 5.037 0.877 -8.245 926 HA LEU 118 HA LEU 118 6.583 -1.572 -7.858 927 HB2 LEU 118 HB2 LEU 118 6.796 0.190 -6.172 928 HB3 LEU 118 HB1 LEU 118 5.075 0.116 -5.869 929 HG LEU 118 HG LEU 118 5.227 -1.983 -4.806 930 HD11 LEU 118 HD11 LEU 118 8.017 -2.168 -5.919 931 HD12 LEU 118 HD12 LEU 118 6.630 -3.167 -6.346 932 HD13 LEU 118 HD13 LEU 118 7.342 -3.290 -4.738 933 HD21 LEU 118 HD21 LEU 118 6.078 -0.107 -3.457 934 HD22 LEU 118 HD22 LEU 118 7.712 -0.484 -4.004 935 HD23 LEU 118 HD23 LEU 118 6.819 -1.647 -3.026 936 H ILE 119 HN ILE 119 5.508 -3.253 -8.695 937 HA ILE 119 HA ILE 119 2.645 -3.558 -8.227 938 HB ILE 119 HB ILE 119 4.471 -5.487 -9.675 939 HG12 ILE 119 HG12 ILE 119 3.150 -2.951 -10.641 940 HG13 ILE 119 HG11 ILE 119 4.820 -3.468 -10.839 941 HG21 ILE 119 HG21 ILE 119 2.348 -6.084 -10.833 942 HG22 ILE 119 HG22 ILE 119 1.494 -4.996 -9.738 943 HG23 ILE 119 HG23 ILE 119 2.328 -6.414 -9.100 944 HD11 ILE 119 HD11 ILE 119 3.719 -3.620 -12.949 945 HD12 ILE 119 HD12 ILE 119 2.396 -4.556 -12.258 946 HD13 ILE 119 HD13 ILE 119 4.009 -5.261 -12.371 947 H ARG 120 HN ARG 120 1.972 -4.529 -6.405 948 HA ARG 120 HA ARG 120 3.791 -6.491 -5.156 949 HB2 ARG 120 HB2 ARG 120 1.720 -4.867 -3.688 950 HB3 ARG 120 HB1 ARG 120 3.022 -5.824 -3.002 951 HG2 ARG 120 HG2 ARG 120 4.660 -4.252 -3.694 952 HG3 ARG 120 HG1 ARG 120 3.498 -3.387 -4.702 953 HD2 ARG 120 HD2 ARG 120 3.697 -2.065 -2.790 954 HD3 ARG 120 HD1 ARG 120 2.203 -2.964 -2.544 955 HE ARG 120 HE ARG 120 4.728 -3.851 -1.321 956 HH11 ARG 120 HH11 ARG 120 1.336 -2.967 -1.068 957 HH12 ARG 120 HH12 ARG 120 1.262 -3.298 0.640 958 HH21 ARG 120 HH21 ARG 120 4.614 -4.297 0.922 959 HH22 ARG 120 HH22 ARG 120 3.116 -4.085 1.763 960 H ARG 121 HN ARG 121 3.028 -8.384 -4.417 961 HA ARG 121 HA ARG 121 0.230 -9.016 -5.040 962 HB2 ARG 121 HB2 ARG 121 2.773 -10.538 -5.329 963 HB3 ARG 121 HB1 ARG 121 1.327 -11.441 -4.891 964 HG2 ARG 121 HG2 ARG 121 0.549 -11.343 -6.951 965 HG3 ARG 121 HG1 ARG 121 0.794 -9.598 -7.020 966 HD2 ARG 121 HD2 ARG 121 3.052 -11.542 -7.357 967 HD3 ARG 121 HD1 ARG 121 2.055 -11.014 -8.714 968 HE ARG 121 HE ARG 121 3.223 -8.929 -7.067 969 HH11 ARG 121 HH11 ARG 121 3.409 -10.830 -9.996 970 HH12 ARG 121 HH12 ARG 121 4.452 -9.710 -10.813 971 HH21 ARG 121 HH21 ARG 121 4.582 -7.432 -8.147 972 HH22 ARG 121 HH22 ARG 121 5.111 -7.769 -9.770 973 H SER 122 HN SER 122 -1.002 -9.854 -3.430 974 HA SER 122 HA SER 122 0.382 -10.494 -0.928 975 HB2 SER 122 HB2 SER 122 -0.507 -8.239 -0.688 976 HB3 SER 122 HB1 SER 122 -2.111 -8.798 -1.163 977 HG SER 122 HG SER 122 -0.735 -9.921 1.027 978 H LYS 123 HN LYS 123 -0.516 -11.977 0.381 979 HA LYS 123 HA LYS 123 -2.752 -13.561 -0.703 980 HB2 LYS 123 HB2 LYS 123 -0.350 -14.493 0.883 981 HB3 LYS 123 HB1 LYS 123 -1.671 -15.515 0.352 982 HG2 LYS 123 HG2 LYS 123 -0.532 -14.090 -1.847 983 HG3 LYS 123 HG1 LYS 123 0.710 -14.981 -0.966 984 HD2 LYS 123 HD2 LYS 123 -0.874 -16.975 -1.080 985 HD3 LYS 123 HD1 LYS 123 -1.792 -16.051 -2.267 986 HE2 LYS 123 HE2 LYS 123 0.470 -15.793 -3.485 987 HE3 LYS 123 HE1 LYS 123 0.998 -17.124 -2.457 988 HZ1 LYS 123 HZ1 LYS 123 0.210 -17.955 -4.557 989 HZ2 LYS 123 HZ2 LYS 123 -1.278 -17.169 -4.371 990 HZ3 LYS 123 HZ3 LYS 123 -0.856 -18.448 -3.337 991 H ARG 124 HN ARG 124 -4.401 -14.009 0.739 992 HA ARG 124 HA ARG 124 -4.540 -12.441 3.101 993 HB2 ARG 124 HB2 ARG 124 -6.399 -13.587 1.545 994 HB3 ARG 124 HB1 ARG 124 -6.333 -14.777 2.833 995 HG2 ARG 124 HG2 ARG 124 -6.860 -13.114 4.473 996 HG3 ARG 124 HG1 ARG 124 -6.792 -11.844 3.251 997 HD2 ARG 124 HD2 ARG 124 -9.089 -12.582 3.839 998 HD3 ARG 124 HD1 ARG 124 -8.704 -12.718 2.130 999 HE ARG 124 HE ARG 124 -8.347 -15.103 3.762 1000 HH11 ARG 124 HH11 ARG 124 -10.413 -13.322 1.566 1001 HH12 ARG 124 HH12 ARG 124 -11.241 -14.732 0.992 1002 HH21 ARG 124 HH21 ARG 124 -9.436 -16.969 3.015 1003 HH22 ARG 124 HH22 ARG 124 -10.686 -16.813 1.817 1004 H VAL 125 HN VAL 125 -4.380 -13.000 5.218 1005 HA VAL 125 HA VAL 125 -3.488 -15.710 5.884 1006 HB VAL 125 HB VAL 125 -1.772 -14.542 7.473 1007 HG11 VAL 125 HG11 VAL 125 -1.367 -14.937 4.517 1008 HG12 VAL 125 HG12 VAL 125 -1.064 -16.089 5.819 1009 HG13 VAL 125 HG13 VAL 125 -0.050 -14.656 5.656 1010 HG21 VAL 125 HG21 VAL 125 -0.735 -12.548 6.353 1011 HG22 VAL 125 HG22 VAL 125 -2.316 -12.252 7.074 1012 HG23 VAL 125 HG23 VAL 125 -2.170 -12.459 5.329 Start of MODEL 17 1 H1 ALA 1 HT1 ALA 1 -13.585 -9.095 -0.961 2 H2 ALA 1 HT2 ALA 1 -14.606 -10.173 -0.154 3 H3 ALA 1 HT3 ALA 1 -12.929 -10.376 -0.074 4 HA ALA 1 HA ALA 1 -14.325 -7.992 0.956 5 HB1 ALA 1 HB1 ALA 1 -14.018 -8.950 3.198 6 HB2 ALA 1 HB2 ALA 1 -13.443 -10.446 2.467 7 HB3 ALA 1 HB3 ALA 1 -15.105 -9.921 2.206 8 H PHE 2 HN PHE 2 -12.974 -6.434 1.584 9 HA PHE 2 HA PHE 2 -10.121 -6.839 1.183 10 HB2 PHE 2 HB2 PHE 2 -11.913 -4.470 1.467 11 HB3 PHE 2 HB1 PHE 2 -10.197 -4.280 1.813 12 HD1 PHE 2 HD2 PHE 2 -12.456 -5.660 -0.820 13 HD2 PHE 2 HD1 PHE 2 -8.791 -3.708 0.104 14 HE1 PHE 2 HE2 PHE 2 -12.005 -5.373 -3.230 15 HE2 PHE 2 HE1 PHE 2 -8.345 -3.405 -2.294 16 HZ PHE 2 HZ PHE 2 -9.946 -4.249 -3.960 17 H SER 3 HN SER 3 -12.382 -6.285 3.800 18 HA SER 3 HA SER 3 -10.527 -5.603 5.812 19 HB2 SER 3 HB2 SER 3 -13.155 -5.576 5.787 20 HB3 SER 3 HB1 SER 3 -12.986 -7.205 6.437 21 HG SER 3 HG SER 3 -12.052 -6.414 8.233 22 H GLY 4 HN GLY 4 -8.779 -6.829 6.175 23 HA2 GLY 4 HA2 GLY 4 -8.877 -9.282 7.458 24 HA3 GLY 4 HA1 GLY 4 -8.673 -9.630 5.745 25 H THR 5 HN THR 5 -6.624 -10.583 6.559 26 HA THR 5 HA THR 5 -4.559 -8.493 6.811 27 HB THR 5 HB THR 5 -3.203 -10.381 7.876 28 HG1 THR 5 HG1 THR 5 -4.298 -12.222 7.773 29 HG21 THR 5 HG21 THR 5 -4.119 -9.919 10.090 30 HG22 THR 5 HG22 THR 5 -5.609 -9.326 9.362 31 HG23 THR 5 HG23 THR 5 -4.101 -8.447 9.118 32 H TRP 6 HN TRP 6 -3.323 -8.324 5.047 33 HA TRP 6 HA TRP 6 -2.936 -10.743 3.416 34 HB2 TRP 6 HB2 TRP 6 -2.627 -7.941 2.376 35 HB3 TRP 6 HB1 TRP 6 -2.891 -9.429 1.475 36 HD1 TRP 6 HD1 TRP 6 -4.792 -6.946 3.724 37 HE1 TRP 6 HE1 TRP 6 -7.304 -7.111 3.174 38 HE3 TRP 6 HE3 TRP 6 -4.666 -10.930 0.519 39 HZ2 TRP 6 HZ2 TRP 6 -9.004 -8.727 1.609 40 HZ3 TRP 6 HZ3 TRP 6 -6.782 -11.730 -0.445 41 HH2 TRP 6 HH2 TRP 6 -8.903 -10.652 0.089 42 H GLN 7 HN GLN 7 -0.986 -11.490 3.160 43 HA GLN 7 HA GLN 7 1.296 -9.937 4.131 44 HB2 GLN 7 HB2 GLN 7 1.012 -12.212 5.044 45 HB3 GLN 7 HB1 GLN 7 1.063 -12.877 3.417 46 HG2 GLN 7 HG2 GLN 7 3.182 -13.161 4.626 47 HG3 GLN 7 HG1 GLN 7 3.362 -12.197 3.158 48 HE21 GLN 7 HE21 GLN 7 4.038 -10.111 3.310 49 HE22 GLN 7 HE22 GLN 7 4.527 -9.365 4.794 50 H VAL 8 HN VAL 8 2.082 -8.710 2.606 51 HA VAL 8 HA VAL 8 1.911 -9.368 -0.172 52 HB VAL 8 HB VAL 8 1.536 -7.093 0.434 53 HG11 VAL 8 HG11 VAL 8 2.841 -7.027 2.490 54 HG12 VAL 8 HG12 VAL 8 3.249 -5.682 1.424 55 HG13 VAL 8 HG13 VAL 8 4.331 -7.067 1.547 56 HG21 VAL 8 HG21 VAL 8 4.180 -7.359 -0.987 57 HG22 VAL 8 HG22 VAL 8 3.108 -5.959 -1.042 58 HG23 VAL 8 HG23 VAL 8 2.581 -7.501 -1.722 59 H TYR 9 HN TYR 9 3.433 -9.933 -1.564 60 HA TYR 9 HA TYR 9 6.243 -10.035 -0.822 61 HB2 TYR 9 HB2 TYR 9 6.497 -12.411 -1.293 62 HB3 TYR 9 HB1 TYR 9 5.313 -12.201 -0.010 63 HD1 TYR 9 HD2 TYR 9 2.782 -11.990 -0.963 64 HD2 TYR 9 HD1 TYR 9 6.002 -13.965 -2.923 65 HE1 TYR 9 HE2 TYR 9 1.164 -13.344 -2.238 66 HE2 TYR 9 HE1 TYR 9 4.395 -15.328 -4.196 67 HH TYR 9 HH TYR 9 1.043 -14.641 -4.260 68 H ALA 10 HN ALA 10 7.537 -9.744 -2.601 69 HA ALA 10 HA ALA 10 6.909 -10.470 -5.244 70 HB1 ALA 10 HB1 ALA 10 6.292 -8.410 -6.277 71 HB2 ALA 10 HB2 ALA 10 6.518 -7.517 -4.773 72 HB3 ALA 10 HB3 ALA 10 5.186 -8.664 -4.925 73 H GLN 11 HN GLN 11 8.424 -9.430 -6.842 74 HA GLN 11 HA GLN 11 10.756 -8.218 -5.580 75 HB2 GLN 11 HB2 GLN 11 12.211 -9.750 -7.042 76 HB3 GLN 11 HB1 GLN 11 11.516 -10.416 -5.572 77 HG2 GLN 11 HG2 GLN 11 9.904 -10.764 -8.005 78 HG3 GLN 11 HG1 GLN 11 11.443 -11.623 -7.977 79 HE21 GLN 11 HE21 GLN 11 8.728 -12.669 -7.901 80 HE22 GLN 11 HE22 GLN 11 8.612 -13.604 -6.453 81 H GLU 12 HN GLU 12 8.703 -7.135 -7.216 82 HA GLU 12 HA GLU 12 10.265 -6.381 -9.594 83 HB2 GLU 12 HB2 GLU 12 7.285 -6.393 -9.170 84 HB3 GLU 12 HB1 GLU 12 8.045 -5.517 -10.477 85 HG2 GLU 12 HG2 GLU 12 9.002 -7.604 -11.312 86 HG3 GLU 12 HG1 GLU 12 8.173 -8.486 -10.030 87 H ASN 13 HN ASN 13 10.356 -4.251 -10.132 88 HA ASN 13 HA ASN 13 11.281 -2.229 -9.223 89 HB2 ASN 13 HB2 ASN 13 8.318 -1.776 -9.572 90 HB3 ASN 13 HB1 ASN 13 9.598 -0.579 -9.749 91 HD21 ASN 13 HD21 ASN 13 7.509 -2.167 -11.470 92 HD22 ASN 13 HD22 ASN 13 8.400 -2.480 -12.920 93 H TYR 14 HN TYR 14 11.465 -3.336 -6.945 94 HA TYR 14 HA TYR 14 9.666 -2.011 -5.055 95 HB2 TYR 14 HB2 TYR 14 9.911 -4.461 -4.890 96 HB3 TYR 14 HB1 TYR 14 11.637 -4.263 -4.616 97 HD1 TYR 14 HD1 TYR 14 12.462 -3.397 -2.504 98 HD2 TYR 14 HD2 TYR 14 8.305 -3.990 -3.149 99 HE1 TYR 14 HE1 TYR 14 12.071 -3.228 -0.094 100 HE2 TYR 14 HE2 TYR 14 7.895 -3.826 -0.733 101 HH TYR 14 HH TYR 14 10.095 -4.207 1.533 102 H GLU 15 HN GLU 15 13.130 -2.826 -5.229 103 HA GLU 15 HA GLU 15 13.907 -1.001 -3.236 104 HB2 GLU 15 HB2 GLU 15 16.198 -1.363 -3.978 105 HB3 GLU 15 HB1 GLU 15 15.324 -2.887 -3.915 106 HG2 GLU 15 HG2 GLU 15 15.099 -2.914 -6.299 107 HG3 GLU 15 HG1 GLU 15 15.800 -1.302 -6.430 108 H GLU 16 HN GLU 16 13.496 -0.639 -6.686 109 HA GLU 16 HA GLU 16 14.754 1.919 -6.840 110 HB2 GLU 16 HB2 GLU 16 13.249 0.151 -8.659 111 HB3 GLU 16 HB1 GLU 16 13.160 1.869 -9.023 112 HG2 GLU 16 HG2 GLU 16 15.799 0.614 -8.475 113 HG3 GLU 16 HG1 GLU 16 15.043 0.414 -10.058 114 H PHE 17 HN PHE 17 11.533 0.785 -6.137 115 HA PHE 17 HA PHE 17 10.275 3.322 -6.497 116 HB2 PHE 17 HB2 PHE 17 8.943 1.287 -6.650 117 HB3 PHE 17 HB1 PHE 17 9.364 0.858 -4.992 118 HD1 PHE 17 HD2 PHE 17 8.315 4.114 -6.433 119 HD2 PHE 17 HD1 PHE 17 7.370 0.904 -3.816 120 HE1 PHE 17 HE2 PHE 17 6.351 5.343 -5.642 121 HE2 PHE 17 HE1 PHE 17 5.395 2.132 -3.015 122 HZ PHE 17 HZ PHE 17 4.883 4.357 -3.929 123 H LEU 18 HN LEU 18 11.794 1.590 -3.871 124 HA LEU 18 HA LEU 18 10.995 3.219 -1.738 125 HB2 LEU 18 HB2 LEU 18 13.680 1.871 -2.014 126 HB3 LEU 18 HB1 LEU 18 12.884 2.343 -0.530 127 HG LEU 18 HG LEU 18 12.163 0.068 -2.360 128 HD11 LEU 18 HD11 LEU 18 13.046 0.297 0.500 129 HD12 LEU 18 HD12 LEU 18 13.849 -0.537 -0.830 130 HD13 LEU 18 HD13 LEU 18 12.341 -1.171 -0.174 131 HD21 LEU 18 HD21 LEU 18 10.276 -0.347 -0.802 132 HD22 LEU 18 HD22 LEU 18 10.079 1.094 -1.797 133 HD23 LEU 18 HD23 LEU 18 10.559 1.246 -0.106 134 H LYS 19 HN LYS 19 13.628 3.526 -4.063 135 HA LYS 19 HA LYS 19 14.869 5.774 -2.845 136 HB2 LYS 19 HB2 LYS 19 14.949 5.210 -5.797 137 HB3 LYS 19 HB1 LYS 19 16.196 5.919 -4.779 138 HG2 LYS 19 HG2 LYS 19 15.692 3.361 -3.741 139 HG3 LYS 19 HG1 LYS 19 15.776 3.186 -5.493 140 HD2 LYS 19 HD2 LYS 19 17.944 4.101 -5.584 141 HD3 LYS 19 HD1 LYS 19 17.846 4.694 -3.923 142 HE2 LYS 19 HE2 LYS 19 17.825 2.420 -3.085 143 HE3 LYS 19 HE1 LYS 19 17.825 1.787 -4.731 144 HZ1 LYS 19 HZ1 LYS 19 19.986 3.256 -3.343 145 HZ2 LYS 19 HZ2 LYS 19 19.987 2.981 -5.016 146 HZ3 LYS 19 HZ3 LYS 19 20.021 1.673 -3.944 147 H ALA 20 HN ALA 20 12.263 5.373 -5.139 148 HA ALA 20 HA ALA 20 12.139 8.120 -5.872 149 HB1 ALA 20 HB1 ALA 20 10.120 7.533 -7.060 150 HB2 ALA 20 HB2 ALA 20 10.025 5.998 -6.203 151 HB3 ALA 20 HB3 ALA 20 11.343 6.295 -7.335 152 H LEU 21 HN LEU 21 11.208 6.452 -3.125 153 HA LEU 21 HA LEU 21 9.083 8.351 -2.449 154 HB2 LEU 21 HB2 LEU 21 10.104 5.888 -1.029 155 HB3 LEU 21 HB1 LEU 21 8.813 6.911 -0.429 156 HG LEU 21 HG LEU 21 8.633 5.556 -3.109 157 HD11 LEU 21 HD11 LEU 21 7.354 3.791 -2.010 158 HD12 LEU 21 HD12 LEU 21 7.737 4.497 -0.438 159 HD13 LEU 21 HD13 LEU 21 9.024 3.828 -1.444 160 HD21 LEU 21 HD21 LEU 21 6.532 6.546 -1.187 161 HD22 LEU 21 HD22 LEU 21 6.260 5.890 -2.803 162 HD23 LEU 21 HD23 LEU 21 7.104 7.427 -2.605 163 H ALA 22 HN ALA 22 12.267 8.380 -2.470 164 HA ALA 22 HA ALA 22 13.920 9.523 -1.421 165 HB1 ALA 22 HB1 ALA 22 11.837 10.998 0.160 166 HB2 ALA 22 HB2 ALA 22 12.120 11.329 -1.550 167 HB3 ALA 22 HB3 ALA 22 13.418 11.562 -0.379 168 H LEU 23 HN LEU 23 13.025 7.056 -0.373 169 HA LEU 23 HA LEU 23 13.015 7.247 2.505 170 HB2 LEU 23 HB2 LEU 23 13.055 4.948 0.560 171 HB3 LEU 23 HB1 LEU 23 13.169 4.704 2.293 172 HG LEU 23 HG LEU 23 10.878 6.190 1.022 173 HD11 LEU 23 HD11 LEU 23 10.730 4.048 0.061 174 HD12 LEU 23 HD12 LEU 23 9.608 4.053 1.422 175 HD13 LEU 23 HD13 LEU 23 11.175 3.254 1.571 176 HD21 LEU 23 HD21 LEU 23 11.143 6.651 3.352 177 HD22 LEU 23 HD22 LEU 23 11.322 4.935 3.719 178 HD23 LEU 23 HD23 LEU 23 9.773 5.559 3.154 179 HA PRO 24 HA PRO 24 17.313 6.931 3.394 180 HB2 PRO 24 HB2 PRO 24 17.001 4.584 5.122 181 HB3 PRO 24 HB1 PRO 24 17.417 6.246 5.563 182 HG2 PRO 24 HG2 PRO 24 15.058 5.137 6.201 183 HG3 PRO 24 HG1 PRO 24 15.252 6.869 5.866 184 HD2 PRO 24 HD2 PRO 24 14.151 4.717 4.115 185 HD3 PRO 24 HD1 PRO 24 13.621 6.397 4.318 186 H GLU 25 HN GLU 25 18.879 6.201 2.170 187 HA GLU 25 HA GLU 25 18.763 4.055 0.429 188 HB2 GLU 25 HB2 GLU 25 21.011 5.653 1.591 189 HB3 GLU 25 HB1 GLU 25 21.375 4.248 0.599 190 HG2 GLU 25 HG2 GLU 25 19.780 6.658 -0.222 191 HG3 GLU 25 HG1 GLU 25 21.409 6.235 -0.752 192 H ASP 26 HN ASP 26 19.805 4.133 3.770 193 HA ASP 26 HA ASP 26 20.992 1.541 3.714 194 HB2 ASP 26 HB2 ASP 26 21.503 3.385 5.394 195 HB3 ASP 26 HB1 ASP 26 19.978 2.967 6.171 196 H LEU 27 HN LEU 27 17.891 2.839 4.881 197 HA LEU 27 HA LEU 27 16.850 0.425 5.862 198 HB2 LEU 27 HB2 LEU 27 16.031 2.947 5.972 199 HB3 LEU 27 HB1 LEU 27 15.039 2.435 4.622 200 HG LEU 27 HG LEU 27 14.396 0.471 6.295 201 HD11 LEU 27 HD11 LEU 27 15.293 2.724 8.071 202 HD12 LEU 27 HD12 LEU 27 15.823 1.042 8.103 203 HD13 LEU 27 HD13 LEU 27 14.177 1.459 8.582 204 HD21 LEU 27 HD21 LEU 27 12.783 1.915 5.320 205 HD22 LEU 27 HD22 LEU 27 13.336 3.283 6.285 206 HD23 LEU 27 HD23 LEU 27 12.516 1.930 7.063 207 H ILE 28 HN ILE 28 17.035 1.753 2.659 208 HA ILE 28 HA ILE 28 15.106 0.163 1.377 209 HB ILE 28 HB ILE 28 17.591 1.532 0.350 210 HG12 ILE 28 HG12 ILE 28 14.663 2.213 0.082 211 HG13 ILE 28 HG11 ILE 28 15.723 2.886 1.310 212 HG21 ILE 28 HG21 ILE 28 15.380 0.595 -1.440 213 HG22 ILE 28 HG22 ILE 28 16.742 -0.461 -1.062 214 HG23 ILE 28 HG23 ILE 28 17.019 1.090 -1.856 215 HD11 ILE 28 HD11 ILE 28 17.113 3.847 -0.490 216 HD12 ILE 28 HD12 ILE 28 15.463 4.464 -0.457 217 HD13 ILE 28 HD13 ILE 28 15.935 3.265 -1.664 218 H LYS 29 HN LYS 29 18.285 -0.600 2.521 219 HA LYS 29 HA LYS 29 18.598 -2.905 0.799 220 HB2 LYS 29 HB2 LYS 29 20.201 -1.851 3.128 221 HB3 LYS 29 HB1 LYS 29 20.599 -3.341 2.280 222 HG2 LYS 29 HG2 LYS 29 21.500 -2.250 0.540 223 HG3 LYS 29 HG1 LYS 29 20.240 -1.015 0.530 224 HD2 LYS 29 HD2 LYS 29 22.435 -0.060 1.052 225 HD3 LYS 29 HD1 LYS 29 21.309 0.112 2.399 226 HE2 LYS 29 HE2 LYS 29 22.329 -1.930 3.403 227 HE3 LYS 29 HE1 LYS 29 23.536 -1.892 2.120 228 HZ1 LYS 29 HZ1 LYS 29 24.030 0.447 2.913 229 HZ2 LYS 29 HZ2 LYS 29 24.509 -0.809 3.936 230 HZ3 LYS 29 HZ3 LYS 29 23.115 0.084 4.295 231 H MET 30 HN MET 30 17.263 -2.149 3.891 232 HA MET 30 HA MET 30 17.192 -4.948 4.679 233 HB2 MET 30 HB2 MET 30 16.239 -2.441 6.067 234 HB3 MET 30 HB1 MET 30 16.177 -4.058 6.760 235 HG2 MET 30 HG2 MET 30 18.185 -3.641 7.589 236 HG3 MET 30 HG1 MET 30 18.792 -3.809 5.949 237 HE1 MET 30 HE1 MET 30 17.788 0.243 7.917 238 HE2 MET 30 HE2 MET 30 17.790 -1.282 8.810 239 HE3 MET 30 HE3 MET 30 16.580 -0.987 7.562 240 H ALA 31 HN ALA 31 15.047 -2.381 3.616 241 HA ALA 31 HA ALA 31 12.590 -3.651 4.127 242 HB1 ALA 31 HB1 ALA 31 11.653 -2.059 2.509 243 HB2 ALA 31 HB2 ALA 31 13.280 -1.646 1.972 244 HB3 ALA 31 HB3 ALA 31 12.771 -1.266 3.616 245 H ARG 32 HN ARG 32 14.938 -4.117 1.605 246 HA ARG 32 HA ARG 32 13.224 -5.365 -0.283 247 HB2 ARG 32 HB2 ARG 32 15.209 -6.033 -1.443 248 HB3 ARG 32 HB1 ARG 32 15.505 -4.427 -0.797 249 HG2 ARG 32 HG2 ARG 32 16.686 -5.518 1.124 250 HG3 ARG 32 HG1 ARG 32 16.557 -7.040 0.242 251 HD2 ARG 32 HD2 ARG 32 17.834 -6.142 -1.590 252 HD3 ARG 32 HD1 ARG 32 17.844 -4.543 -0.844 253 HE ARG 32 HE ARG 32 19.004 -6.157 1.022 254 HH11 ARG 32 HH11 ARG 32 19.615 -5.532 -2.375 255 HH12 ARG 32 HH12 ARG 32 21.335 -5.714 -2.232 256 HH21 ARG 32 HH21 ARG 32 21.273 -6.425 1.212 257 HH22 ARG 32 HH22 ARG 32 22.276 -6.235 -0.190 258 H ASP 33 HN ASP 33 14.415 -6.343 2.716 259 HA ASP 33 HA ASP 33 13.944 -9.184 2.104 260 HB2 ASP 33 HB2 ASP 33 16.120 -8.974 3.011 261 HB3 ASP 33 HB1 ASP 33 15.593 -7.802 4.211 262 H ILE 34 HN ILE 34 13.167 -6.525 4.265 263 HA ILE 34 HA ILE 34 11.409 -8.008 5.957 264 HB ILE 34 HB ILE 34 11.378 -5.018 5.545 265 HG12 ILE 34 HG12 ILE 34 13.263 -6.763 7.075 266 HG13 ILE 34 HG11 ILE 34 13.610 -5.355 6.091 267 HG21 ILE 34 HG21 ILE 34 9.477 -5.846 6.795 268 HG22 ILE 34 HG22 ILE 34 10.569 -5.000 7.892 269 HG23 ILE 34 HG23 ILE 34 10.538 -6.761 7.862 270 HD11 ILE 34 HD11 ILE 34 14.007 -4.767 8.348 271 HD12 ILE 34 HD12 ILE 34 12.446 -5.405 8.853 272 HD13 ILE 34 HD13 ILE 34 12.523 -3.958 7.851 273 H LYS 35 HN LYS 35 9.456 -8.697 5.476 274 HA LYS 35 HA LYS 35 7.908 -7.261 3.422 275 HB2 LYS 35 HB2 LYS 35 7.540 -10.165 4.158 276 HB3 LYS 35 HB1 LYS 35 6.919 -9.317 2.745 277 HG2 LYS 35 HG2 LYS 35 9.140 -9.120 1.832 278 HG3 LYS 35 HG1 LYS 35 9.833 -9.830 3.291 279 HD2 LYS 35 HD2 LYS 35 8.576 -11.909 2.816 280 HD3 LYS 35 HD1 LYS 35 8.016 -11.190 1.303 281 HE2 LYS 35 HE2 LYS 35 9.914 -12.595 0.836 282 HE3 LYS 35 HE1 LYS 35 10.379 -10.909 0.615 283 HZ1 LYS 35 HZ1 LYS 35 12.065 -12.170 1.805 284 HZ2 LYS 35 HZ2 LYS 35 10.956 -12.546 3.024 285 HZ3 LYS 35 HZ3 LYS 35 11.434 -10.941 2.781 286 HA PRO 36 HA PRO 36 5.765 -6.727 7.487 287 HB2 PRO 36 HB2 PRO 36 4.569 -4.371 6.728 288 HB3 PRO 36 HB1 PRO 36 6.162 -4.473 7.508 289 HG2 PRO 36 HG2 PRO 36 5.481 -4.090 4.646 290 HG3 PRO 36 HG1 PRO 36 6.802 -3.390 5.605 291 HD2 PRO 36 HD2 PRO 36 7.176 -5.438 3.875 292 HD3 PRO 36 HD1 PRO 36 8.141 -5.230 5.345 293 H ILE 37 HN ILE 37 3.714 -7.307 7.959 294 HA ILE 37 HA ILE 37 2.041 -8.057 5.735 295 HB ILE 37 HB ILE 37 2.303 -9.537 7.722 296 HG12 ILE 37 HG12 ILE 37 0.169 -9.220 6.111 297 HG13 ILE 37 HG11 ILE 37 0.255 -10.452 7.364 298 HG21 ILE 37 HG21 ILE 37 2.357 -8.007 9.528 299 HG22 ILE 37 HG22 ILE 37 0.908 -8.990 9.732 300 HG23 ILE 37 HG23 ILE 37 0.776 -7.346 9.107 301 HD11 ILE 37 HD11 ILE 37 -1.132 -9.230 8.807 302 HD12 ILE 37 HD12 ILE 37 -1.875 -9.100 7.210 303 HD13 ILE 37 HD13 ILE 37 -0.945 -7.752 7.862 304 H VAL 38 HN VAL 38 0.137 -7.144 5.145 305 HA VAL 38 HA VAL 38 -0.289 -4.427 6.149 306 HB VAL 38 HB VAL 38 -1.721 -5.738 3.837 307 HG11 VAL 38 HG11 VAL 38 -1.712 -3.223 3.145 308 HG12 VAL 38 HG12 VAL 38 -1.437 -2.948 4.865 309 HG13 VAL 38 HG13 VAL 38 -2.880 -3.804 4.329 310 HG21 VAL 38 HG21 VAL 38 0.818 -4.107 3.721 311 HG22 VAL 38 HG22 VAL 38 -0.064 -4.782 2.349 312 HG23 VAL 38 HG23 VAL 38 0.726 -5.856 3.503 313 H GLU 39 HN GLU 39 -1.479 -4.458 7.974 314 HA GLU 39 HA GLU 39 -3.750 -6.273 8.194 315 HB2 GLU 39 HB2 GLU 39 -2.085 -4.731 10.034 316 HB3 GLU 39 HB1 GLU 39 -3.802 -4.640 10.401 317 HG2 GLU 39 HG2 GLU 39 -3.976 -6.890 10.834 318 HG3 GLU 39 HG1 GLU 39 -2.539 -7.286 9.892 319 H ILE 40 HN ILE 40 -5.570 -5.655 7.281 320 HA ILE 40 HA ILE 40 -6.324 -2.819 7.510 321 HB ILE 40 HB ILE 40 -5.669 -3.271 5.204 322 HG12 ILE 40 HG12 ILE 40 -7.716 -1.803 5.896 323 HG13 ILE 40 HG11 ILE 40 -7.410 -2.134 4.196 324 HG21 ILE 40 HG21 ILE 40 -5.998 -5.542 4.849 325 HG22 ILE 40 HG22 ILE 40 -7.219 -4.772 3.829 326 HG23 ILE 40 HG23 ILE 40 -7.679 -5.479 5.379 327 HD11 ILE 40 HD11 ILE 40 -9.806 -2.302 4.984 328 HD12 ILE 40 HD12 ILE 40 -9.323 -3.771 5.834 329 HD13 ILE 40 HD13 ILE 40 -9.179 -3.677 4.078 330 H GLN 41 HN GLN 41 -8.155 -2.473 8.498 331 HA GLN 41 HA GLN 41 -10.202 -4.574 8.534 332 HB2 GLN 41 HB2 GLN 41 -10.673 -3.942 10.927 333 HB3 GLN 41 HB1 GLN 41 -9.151 -4.782 10.676 334 HG2 GLN 41 HG2 GLN 41 -8.202 -3.167 11.858 335 HG3 GLN 41 HG1 GLN 41 -8.468 -2.122 10.463 336 HE21 GLN 41 HE21 GLN 41 -8.382 -1.402 13.268 337 HE22 GLN 41 HE22 GLN 41 -9.914 -0.694 13.641 338 H GLN 42 HN GLN 42 -12.299 -3.805 8.376 339 HA GLN 42 HA GLN 42 -12.619 -0.899 8.463 340 HB2 GLN 42 HB2 GLN 42 -13.635 -0.741 6.362 341 HB3 GLN 42 HB1 GLN 42 -12.202 -1.733 6.115 342 HG2 GLN 42 HG2 GLN 42 -13.396 -3.459 5.474 343 HG3 GLN 42 HG1 GLN 42 -14.555 -3.289 6.780 344 HE21 GLN 42 HE21 GLN 42 -15.111 -3.940 4.031 345 HE22 GLN 42 HE22 GLN 42 -16.140 -2.688 3.435 346 H LYS 43 HN LYS 43 -15.159 -0.666 7.620 347 HA LYS 43 HA LYS 43 -16.738 -2.286 9.510 348 HB2 LYS 43 HB2 LYS 43 -16.995 0.676 8.930 349 HB3 LYS 43 HB1 LYS 43 -18.142 -0.250 9.887 350 HG2 LYS 43 HG2 LYS 43 -16.534 -0.629 11.596 351 HG3 LYS 43 HG1 LYS 43 -15.232 0.017 10.595 352 HD2 LYS 43 HD2 LYS 43 -16.297 2.224 10.643 353 HD3 LYS 43 HD1 LYS 43 -17.594 1.572 11.645 354 HE2 LYS 43 HE2 LYS 43 -16.011 2.726 13.051 355 HE3 LYS 43 HE1 LYS 43 -15.916 0.994 13.371 356 HZ1 LYS 43 HZ1 LYS 43 -13.942 0.862 12.032 357 HZ2 LYS 43 HZ2 LYS 43 -13.727 2.062 13.203 358 HZ3 LYS 43 HZ3 LYS 43 -14.065 2.494 11.604 359 H GLY 44 HN GLY 44 -17.505 0.240 7.132 360 HA2 GLY 44 HA2 GLY 44 -18.921 -1.762 5.497 361 HA3 GLY 44 HA1 GLY 44 -19.748 -0.293 5.998 362 H ASP 45 HN ASP 45 -18.086 1.685 5.629 363 HA ASP 45 HA ASP 45 -17.122 1.482 2.864 364 HB2 ASP 45 HB2 ASP 45 -17.709 4.101 3.021 365 HB3 ASP 45 HB1 ASP 45 -18.850 2.902 2.443 366 H ASP 46 HN ASP 46 -16.523 2.462 6.084 367 HA ASP 46 HA ASP 46 -14.209 4.082 5.361 368 HB2 ASP 46 HB2 ASP 46 -15.923 4.644 7.215 369 HB3 ASP 46 HB1 ASP 46 -15.064 3.441 8.165 370 H PHE 47 HN PHE 47 -12.274 3.237 5.226 371 HA PHE 47 HA PHE 47 -11.794 0.573 6.393 372 HB2 PHE 47 HB2 PHE 47 -10.550 1.990 4.037 373 HB3 PHE 47 HB1 PHE 47 -9.851 0.543 4.742 374 HD1 PHE 47 HD2 PHE 47 -13.341 1.526 3.848 375 HD2 PHE 47 HD1 PHE 47 -10.149 -1.237 3.362 376 HE1 PHE 47 HE2 PHE 47 -14.766 0.145 2.401 377 HE2 PHE 47 HE1 PHE 47 -11.563 -2.624 1.908 378 HZ PHE 47 HZ PHE 47 -13.878 -1.936 1.422 379 H VAL 48 HN VAL 48 -9.875 0.137 7.459 380 HA VAL 48 HA VAL 48 -8.227 2.453 8.211 381 HB VAL 48 HB VAL 48 -9.156 0.240 10.064 382 HG11 VAL 48 HG11 VAL 48 -7.176 2.465 10.462 383 HG12 VAL 48 HG12 VAL 48 -6.934 0.731 10.688 384 HG13 VAL 48 HG13 VAL 48 -7.965 1.630 11.801 385 HG21 VAL 48 HG21 VAL 48 -9.753 3.199 10.027 386 HG22 VAL 48 HG22 VAL 48 -10.200 2.093 11.329 387 HG23 VAL 48 HG23 VAL 48 -10.885 1.882 9.718 388 H VAL 49 HN VAL 49 -6.489 2.027 7.010 389 HA VAL 49 HA VAL 49 -5.436 -0.696 6.849 390 HB VAL 49 HB VAL 49 -4.402 1.781 5.464 391 HG11 VAL 49 HG11 VAL 49 -3.251 0.267 3.999 392 HG12 VAL 49 HG12 VAL 49 -4.019 -1.125 4.759 393 HG13 VAL 49 HG13 VAL 49 -2.849 -0.166 5.661 394 HG21 VAL 49 HG21 VAL 49 -6.181 -0.311 4.240 395 HG22 VAL 49 HG22 VAL 49 -5.716 1.256 3.581 396 HG23 VAL 49 HG23 VAL 49 -6.811 1.171 4.957 397 H THR 50 HN THR 50 -3.911 -1.369 8.176 398 HA THR 50 HA THR 50 -2.345 0.635 9.642 399 HB THR 50 HB THR 50 -2.832 -2.268 10.332 400 HG1 THR 50 HG1 THR 50 -4.696 -0.818 10.441 401 HG21 THR 50 HG21 THR 50 -0.816 -1.645 11.370 402 HG22 THR 50 HG22 THR 50 -2.043 -1.426 12.619 403 HG23 THR 50 HG23 THR 50 -1.408 -0.028 11.752 404 H SER 51 HN SER 51 -0.473 0.996 8.626 405 HA SER 51 HA SER 51 0.939 -1.214 7.340 406 HB2 SER 51 HB2 SER 51 1.751 1.695 7.458 407 HB3 SER 51 HB1 SER 51 2.305 0.470 6.315 408 HG SER 51 HG SER 51 -0.344 0.569 6.197 409 H LYS 52 HN LYS 52 2.155 -2.396 8.618 410 HA LYS 52 HA LYS 52 3.266 -1.321 11.078 411 HB2 LYS 52 HB2 LYS 52 3.572 -4.124 10.018 412 HB3 LYS 52 HB1 LYS 52 3.658 -3.582 11.686 413 HG2 LYS 52 HG2 LYS 52 1.303 -3.150 11.738 414 HG3 LYS 52 HG1 LYS 52 1.165 -3.486 10.013 415 HD2 LYS 52 HD2 LYS 52 0.408 -5.446 11.059 416 HD3 LYS 52 HD1 LYS 52 2.063 -5.810 10.564 417 HE2 LYS 52 HE2 LYS 52 2.878 -5.576 12.759 418 HE3 LYS 52 HE1 LYS 52 1.399 -4.791 13.311 419 HZ1 LYS 52 HZ1 LYS 52 1.268 -6.967 14.102 420 HZ2 LYS 52 HZ2 LYS 52 1.830 -7.640 12.658 421 HZ3 LYS 52 HZ3 LYS 52 0.271 -6.978 12.728 422 H THR 53 HN THR 53 5.313 -0.648 11.294 423 HA THR 53 HA THR 53 7.360 -1.695 9.485 424 HB THR 53 HB THR 53 8.211 0.408 8.827 425 HG1 THR 53 HG1 THR 53 6.416 2.056 10.128 426 HG21 THR 53 HG21 THR 53 6.423 1.492 7.661 427 HG22 THR 53 HG22 THR 53 5.221 0.824 8.768 428 HG23 THR 53 HG23 THR 53 6.103 -0.243 7.667 429 HA PRO 54 HA PRO 54 9.924 -1.936 13.083 430 HB2 PRO 54 HB2 PRO 54 12.074 -0.885 11.285 431 HB3 PRO 54 HB1 PRO 54 12.059 -2.344 12.300 432 HG2 PRO 54 HG2 PRO 54 11.774 -2.571 9.703 433 HG3 PRO 54 HG1 PRO 54 10.773 -3.540 10.806 434 HD2 PRO 54 HD2 PRO 54 10.032 -1.086 9.257 435 HD3 PRO 54 HD1 PRO 54 9.099 -2.571 9.548 436 H ARG 55 HN ARG 55 9.857 0.981 11.167 437 HA ARG 55 HA ARG 55 11.180 2.611 13.136 438 HB2 ARG 55 HB2 ARG 55 9.884 3.098 10.488 439 HB3 ARG 55 HB1 ARG 55 10.121 4.459 11.574 440 HG2 ARG 55 HG2 ARG 55 12.529 3.903 11.679 441 HG3 ARG 55 HG1 ARG 55 12.244 2.637 10.482 442 HD2 ARG 55 HD2 ARG 55 13.078 4.668 9.423 443 HD3 ARG 55 HD1 ARG 55 11.439 4.301 8.894 444 HE ARG 55 HE ARG 55 10.808 6.012 10.715 445 HH11 ARG 55 HH11 ARG 55 13.671 6.172 8.723 446 HH12 ARG 55 HH12 ARG 55 13.756 7.902 8.757 447 HH21 ARG 55 HH21 ARG 55 10.904 8.295 10.749 448 HH22 ARG 55 HH22 ARG 55 12.171 9.116 9.896 449 H GLN 56 HN GLN 56 7.884 2.627 11.763 450 HA GLN 56 HA GLN 56 6.627 2.851 14.298 451 HB2 GLN 56 HB2 GLN 56 7.588 5.145 14.058 452 HB3 GLN 56 HB1 GLN 56 6.643 5.346 12.590 453 HG2 GLN 56 HG2 GLN 56 4.589 4.993 13.952 454 HG3 GLN 56 HG1 GLN 56 5.608 5.002 15.392 455 HE21 GLN 56 HE21 GLN 56 3.482 6.815 14.677 456 HE22 GLN 56 HE22 GLN 56 4.185 8.392 14.618 457 H THR 57 HN THR 57 4.668 1.972 14.033 458 HA THR 57 HA THR 57 3.671 1.461 11.393 459 HB THR 57 HB THR 57 3.423 -0.207 13.185 460 HG1 THR 57 HG1 THR 57 1.743 0.265 11.393 461 HG21 THR 57 HG21 THR 57 2.621 0.258 15.214 462 HG22 THR 57 HG22 THR 57 1.143 0.937 14.532 463 HG23 THR 57 HG23 THR 57 2.568 1.955 14.737 464 H VAL 58 HN VAL 58 2.251 2.642 10.256 465 HA VAL 58 HA VAL 58 0.950 4.898 11.629 466 HB VAL 58 HB VAL 58 0.689 5.946 9.440 467 HG11 VAL 58 HG11 VAL 58 3.486 5.053 10.095 468 HG12 VAL 58 HG12 VAL 58 2.672 6.521 10.640 469 HG13 VAL 58 HG13 VAL 58 3.100 6.325 8.939 470 HG21 VAL 58 HG21 VAL 58 2.042 3.459 8.434 471 HG22 VAL 58 HG22 VAL 58 1.935 4.949 7.497 472 HG23 VAL 58 HG23 VAL 58 0.464 4.098 7.972 473 H THR 59 HN THR 59 -1.201 5.519 10.882 474 HA THR 59 HA THR 59 -2.813 3.206 10.038 475 HB THR 59 HB THR 59 -3.796 5.256 12.027 476 HG1 THR 59 HG1 THR 59 -1.836 3.689 12.543 477 HG21 THR 59 HG21 THR 59 -5.523 3.936 10.964 478 HG22 THR 59 HG22 THR 59 -5.340 3.417 12.638 479 HG23 THR 59 HG23 THR 59 -4.656 2.448 11.336 480 H ASN 60 HN ASN 60 -3.793 3.614 8.204 481 HA ASN 60 HA ASN 60 -4.411 6.414 7.475 482 HB2 ASN 60 HB2 ASN 60 -3.635 4.001 5.862 483 HB3 ASN 60 HB1 ASN 60 -4.537 5.319 5.112 484 HD21 ASN 60 HD21 ASN 60 -1.741 4.366 4.734 485 HD22 ASN 60 HD22 ASN 60 -0.758 5.767 5.000 486 H SER 61 HN SER 61 -6.549 6.930 7.357 487 HA SER 61 HA SER 61 -8.480 4.714 7.068 488 HB2 SER 61 HB2 SER 61 -9.995 6.471 8.377 489 HB3 SER 61 HB1 SER 61 -8.960 5.326 9.232 490 HG SER 61 HG SER 61 -8.797 8.068 9.027 491 H PHE 62 HN PHE 62 -10.272 5.047 5.753 492 HA PHE 62 HA PHE 62 -10.752 7.607 4.553 493 HB2 PHE 62 HB2 PHE 62 -10.453 6.721 2.199 494 HB3 PHE 62 HB1 PHE 62 -8.974 7.069 3.085 495 HD1 PHE 62 HD1 PHE 62 -11.181 4.357 1.883 496 HD2 PHE 62 HD2 PHE 62 -7.390 5.376 3.527 497 HE1 PHE 62 HE1 PHE 62 -10.357 2.098 1.372 498 HE2 PHE 62 HE2 PHE 62 -6.569 3.118 3.023 499 HZ PHE 62 HZ PHE 62 -8.045 1.482 1.928 500 H THR 63 HN THR 63 -12.573 7.564 3.067 501 HA THR 63 HA THR 63 -14.409 5.348 3.688 502 HB THR 63 HB THR 63 -15.294 8.143 3.015 503 HG1 THR 63 HG1 THR 63 -14.511 7.085 5.554 504 HG21 THR 63 HG21 THR 63 -16.969 6.350 2.943 505 HG22 THR 63 HG22 THR 63 -17.298 7.482 4.255 506 HG23 THR 63 HG23 THR 63 -16.571 5.912 4.605 507 H LEU 64 HN LEU 64 -15.222 4.263 2.035 508 HA LEU 64 HA LEU 64 -14.361 4.645 -0.601 509 HB2 LEU 64 HB2 LEU 64 -16.726 3.112 0.462 510 HB3 LEU 64 HB1 LEU 64 -16.170 3.027 -1.200 511 HG LEU 64 HG LEU 64 -14.695 2.110 1.262 512 HD11 LEU 64 HD11 LEU 64 -16.004 0.755 -1.071 513 HD12 LEU 64 HD12 LEU 64 -16.254 0.481 0.654 514 HD13 LEU 64 HD13 LEU 64 -14.756 -0.042 -0.113 515 HD21 LEU 64 HD21 LEU 64 -13.759 2.245 -1.601 516 HD22 LEU 64 HD22 LEU 64 -12.935 1.374 -0.310 517 HD23 LEU 64 HD23 LEU 64 -13.087 3.129 -0.231 518 H GLY 65 HN GLY 65 -14.958 5.990 -2.142 519 HA2 GLY 65 HA2 GLY 65 -16.582 7.012 -3.548 520 HA3 GLY 65 HA1 GLY 65 -17.737 6.932 -2.225 521 H LYS 66 HN LYS 66 -15.068 7.941 -0.739 522 HA LYS 66 HA LYS 66 -15.575 10.784 -1.324 523 HB2 LYS 66 HB2 LYS 66 -15.288 9.393 1.330 524 HB3 LYS 66 HB1 LYS 66 -14.972 11.111 1.158 525 HG2 LYS 66 HG2 LYS 66 -17.233 11.487 0.401 526 HG3 LYS 66 HG1 LYS 66 -17.570 9.757 0.480 527 HD2 LYS 66 HD2 LYS 66 -18.472 10.708 2.453 528 HD3 LYS 66 HD1 LYS 66 -16.991 9.879 2.935 529 HE2 LYS 66 HE2 LYS 66 -15.796 11.969 2.986 530 HE3 LYS 66 HE1 LYS 66 -17.197 12.829 2.359 531 HZ1 LYS 66 HZ1 LYS 66 -17.237 11.350 4.925 532 HZ2 LYS 66 HZ2 LYS 66 -18.375 12.470 4.356 533 HZ3 LYS 66 HZ3 LYS 66 -16.832 12.987 4.817 534 H GLU 67 HN GLU 67 -13.773 12.125 -0.181 535 HA GLU 67 HA GLU 67 -11.187 10.945 -0.946 536 HB2 GLU 67 HB2 GLU 67 -11.707 12.865 -2.306 537 HB3 GLU 67 HB1 GLU 67 -12.177 13.805 -0.900 538 HG2 GLU 67 HG2 GLU 67 -9.758 13.537 -0.130 539 HG3 GLU 67 HG1 GLU 67 -9.426 13.003 -1.774 540 H ALA 68 HN ALA 68 -9.719 10.667 0.685 541 HA ALA 68 HA ALA 68 -10.208 12.124 3.199 542 HB1 ALA 68 HB1 ALA 68 -9.761 10.133 4.493 543 HB2 ALA 68 HB2 ALA 68 -9.474 9.203 3.021 544 HB3 ALA 68 HB3 ALA 68 -11.087 9.825 3.371 545 H ASP 69 HN ASP 69 -8.469 12.923 4.181 546 HA ASP 69 HA ASP 69 -5.943 12.764 2.802 547 HB2 ASP 69 HB2 ASP 69 -5.170 14.455 4.347 548 HB3 ASP 69 HB1 ASP 69 -6.764 14.904 3.764 549 H ILE 70 HN ILE 70 -4.524 11.240 3.150 550 HA ILE 70 HA ILE 70 -4.455 9.924 5.790 551 HB ILE 70 HB ILE 70 -3.466 7.951 4.436 552 HG12 ILE 70 HG12 ILE 70 -4.767 7.858 2.173 553 HG13 ILE 70 HG11 ILE 70 -4.722 9.615 2.282 554 HG21 ILE 70 HG21 ILE 70 -5.678 6.998 4.132 555 HG22 ILE 70 HG22 ILE 70 -6.400 8.602 4.226 556 HG23 ILE 70 HG23 ILE 70 -5.599 7.913 5.638 557 HD11 ILE 70 HD11 ILE 70 -2.903 8.630 0.919 558 HD12 ILE 70 HD12 ILE 70 -2.293 7.841 2.376 559 HD13 ILE 70 HD13 ILE 70 -2.332 9.601 2.275 560 H THR 71 HN THR 71 -2.180 8.662 5.925 561 HA THR 71 HA THR 71 -0.171 10.666 5.065 562 HB THR 71 HB THR 71 -0.051 9.181 7.688 563 HG1 THR 71 HG1 THR 71 -1.767 10.505 7.961 564 HG21 THR 71 HG21 THR 71 1.556 10.983 8.258 565 HG22 THR 71 HG22 THR 71 1.414 11.596 6.613 566 HG23 THR 71 HG23 THR 71 2.098 9.996 6.899 567 H THR 72 HN THR 72 1.765 9.957 4.344 568 HA THR 72 HA THR 72 2.015 7.125 3.739 569 HB THR 72 HB THR 72 2.497 8.767 1.971 570 HG1 THR 72 HG1 THR 72 4.898 8.036 1.731 571 HG21 THR 72 HG21 THR 72 4.456 9.764 3.986 572 HG22 THR 72 HG22 THR 72 3.321 10.665 2.980 573 HG23 THR 72 HG23 THR 72 4.780 9.977 2.268 574 H MET 73 HN MET 73 4.568 6.492 3.829 575 HA MET 73 HA MET 73 5.133 6.452 6.676 576 HB2 MET 73 HB2 MET 73 5.258 4.484 4.957 577 HB3 MET 73 HB1 MET 73 6.856 5.136 4.624 578 HG2 MET 73 HG2 MET 73 7.124 3.427 6.224 579 HG3 MET 73 HG1 MET 73 7.341 4.960 7.067 580 HE1 MET 73 HE1 MET 73 3.641 2.273 7.241 581 HE2 MET 73 HE2 MET 73 4.820 2.392 5.936 582 HE3 MET 73 HE3 MET 73 3.593 3.641 6.133 583 H ASP 74 HN ASP 74 6.293 8.060 3.849 584 HA ASP 74 HA ASP 74 8.883 8.640 5.008 585 HB2 ASP 74 HB2 ASP 74 9.321 9.865 2.919 586 HB3 ASP 74 HB1 ASP 74 8.763 8.227 2.621 587 H GLY 75 HN GLY 75 5.817 10.001 5.234 588 HA2 GLY 75 HA2 GLY 75 5.396 11.748 6.781 589 HA3 GLY 75 HA1 GLY 75 7.010 12.360 6.492 590 H LYS 76 HN LYS 76 4.178 11.696 4.432 591 HA LYS 76 HA LYS 76 4.126 14.515 3.670 592 HB2 LYS 76 HB2 LYS 76 4.400 12.135 1.872 593 HB3 LYS 76 HB1 LYS 76 3.518 13.545 1.317 594 HG2 LYS 76 HG2 LYS 76 5.731 14.764 2.136 595 HG3 LYS 76 HG1 LYS 76 6.410 13.172 1.790 596 HD2 LYS 76 HD2 LYS 76 5.122 13.377 -0.448 597 HD3 LYS 76 HD1 LYS 76 5.067 15.098 -0.067 598 HE2 LYS 76 HE2 LYS 76 7.474 15.196 0.043 599 HE3 LYS 76 HE1 LYS 76 7.587 13.454 -0.194 600 HZ1 LYS 76 HZ1 LYS 76 6.582 15.439 -2.153 601 HZ2 LYS 76 HZ2 LYS 76 6.538 13.768 -2.384 602 HZ3 LYS 76 HZ3 LYS 76 8.024 14.565 -2.258 603 H LYS 77 HN LYS 77 2.030 15.200 2.946 604 HA LYS 77 HA LYS 77 -0.115 13.440 3.901 605 HB2 LYS 77 HB2 LYS 77 0.024 16.431 3.513 606 HB3 LYS 77 HB1 LYS 77 -1.485 15.588 3.820 607 HG2 LYS 77 HG2 LYS 77 0.906 15.555 5.651 608 HG3 LYS 77 HG1 LYS 77 -0.513 16.583 5.846 609 HD2 LYS 77 HD2 LYS 77 -1.910 14.536 5.972 610 HD3 LYS 77 HD1 LYS 77 -0.432 13.569 5.930 611 HE2 LYS 77 HE2 LYS 77 0.341 14.687 7.967 612 HE3 LYS 77 HE1 LYS 77 -1.149 15.628 8.012 613 HZ1 LYS 77 HZ1 LYS 77 -2.405 13.641 8.352 614 HZ2 LYS 77 HZ2 LYS 77 -1.155 13.660 9.488 615 HZ3 LYS 77 HZ3 LYS 77 -1.045 12.659 8.126 616 H LEU 78 HN LEU 78 -1.338 12.441 2.477 617 HA LEU 78 HA LEU 78 -1.718 13.665 -0.171 618 HB2 LEU 78 HB2 LEU 78 -1.434 10.692 0.148 619 HB3 LEU 78 HB1 LEU 78 -1.309 11.647 -1.315 620 HG LEU 78 HG LEU 78 0.790 12.632 0.119 621 HD11 LEU 78 HD11 LEU 78 0.473 11.052 1.936 622 HD12 LEU 78 HD12 LEU 78 1.978 10.715 1.081 623 HD13 LEU 78 HD13 LEU 78 0.561 9.703 0.803 624 HD21 LEU 78 HD21 LEU 78 0.728 10.273 -1.758 625 HD22 LEU 78 HD22 LEU 78 2.196 11.122 -1.272 626 HD23 LEU 78 HD23 LEU 78 0.947 11.971 -2.183 627 H LYS 79 HN LYS 79 -3.714 13.135 -1.198 628 HA LYS 79 HA LYS 79 -5.741 12.170 0.699 629 HB2 LYS 79 HB2 LYS 79 -6.079 13.907 -1.755 630 HB3 LYS 79 HB1 LYS 79 -7.370 13.413 -0.669 631 HG2 LYS 79 HG2 LYS 79 -6.492 14.697 1.116 632 HG3 LYS 79 HG1 LYS 79 -4.988 14.994 0.245 633 HD2 LYS 79 HD2 LYS 79 -6.230 16.281 -1.436 634 HD3 LYS 79 HD1 LYS 79 -7.720 15.999 -0.536 635 HE2 LYS 79 HE2 LYS 79 -6.887 17.234 1.343 636 HE3 LYS 79 HE1 LYS 79 -5.295 17.378 0.596 637 HZ1 LYS 79 HZ1 LYS 79 -6.631 19.406 0.391 638 HZ2 LYS 79 HZ2 LYS 79 -7.794 18.563 -0.499 639 HZ3 LYS 79 HZ3 LYS 79 -6.232 18.760 -1.117 640 H CYS 80 HN CYS 80 -6.524 10.212 0.368 641 HA CYS 80 HA CYS 80 -6.142 8.961 -2.243 642 HB2 CYS 80 HB2 CYS 80 -5.403 7.618 -0.410 643 HB3 CYS 80 HB1 CYS 80 -6.926 7.843 0.445 644 H THR 81 HN THR 81 -7.686 9.288 -3.663 645 HA THR 81 HA THR 81 -10.468 9.450 -2.796 646 HB THR 81 HB THR 81 -9.564 9.675 -5.662 647 HG1 THR 81 HG1 THR 81 -8.333 11.285 -4.983 648 HG21 THR 81 HG21 THR 81 -11.960 9.632 -5.258 649 HG22 THR 81 HG22 THR 81 -11.483 11.246 -5.776 650 HG23 THR 81 HG23 THR 81 -11.816 10.929 -4.075 651 H VAL 82 HN VAL 82 -10.713 7.286 -2.186 652 HA VAL 82 HA VAL 82 -10.461 5.268 -4.313 653 HB VAL 82 HB VAL 82 -9.101 4.968 -2.240 654 HG11 VAL 82 HG11 VAL 82 -10.597 5.930 -0.651 655 HG12 VAL 82 HG12 VAL 82 -10.241 4.262 -0.199 656 HG13 VAL 82 HG13 VAL 82 -11.785 4.664 -0.948 657 HG21 VAL 82 HG21 VAL 82 -11.180 2.869 -2.819 658 HG22 VAL 82 HG22 VAL 82 -9.736 2.600 -1.843 659 HG23 VAL 82 HG23 VAL 82 -9.582 3.022 -3.550 660 H HIS 83 HN HIS 83 -12.028 3.579 -4.400 661 HA HIS 83 HA HIS 83 -14.523 3.729 -3.035 662 HB2 HIS 83 HB2 HIS 83 -15.952 4.209 -4.957 663 HB3 HIS 83 HB1 HIS 83 -14.842 5.546 -4.693 664 HD1 HIS 83 HD1 HIS 83 -16.140 3.472 -7.304 665 HD2 HIS 83 HD2 HIS 83 -12.503 5.348 -6.561 666 HE1 HIS 83 HE1 HIS 83 -14.962 3.560 -9.515 667 HE2 HIS 83 HE2 HIS 83 -12.849 4.851 -9.073 668 H LEU 84 HN LEU 84 -15.932 1.921 -3.691 669 HA LEU 84 HA LEU 84 -14.304 -0.302 -4.670 670 HB2 LEU 84 HB2 LEU 84 -15.417 -0.631 -2.529 671 HB3 LEU 84 HB1 LEU 84 -16.973 -0.260 -3.258 672 HG LEU 84 HG LEU 84 -16.328 -2.321 -4.810 673 HD11 LEU 84 HD11 LEU 84 -14.960 -3.007 -2.221 674 HD12 LEU 84 HD12 LEU 84 -14.118 -2.583 -3.710 675 HD13 LEU 84 HD13 LEU 84 -15.128 -4.027 -3.648 676 HD21 LEU 84 HD21 LEU 84 -18.340 -2.184 -3.495 677 HD22 LEU 84 HD22 LEU 84 -17.444 -2.517 -2.017 678 HD23 LEU 84 HD23 LEU 84 -17.594 -3.761 -3.255 679 H ALA 85 HN ALA 85 -14.417 -0.746 -6.734 680 HA ALA 85 HA ALA 85 -16.996 -0.479 -8.116 681 HB1 ALA 85 HB1 ALA 85 -15.695 0.154 -10.153 682 HB2 ALA 85 HB2 ALA 85 -14.257 0.278 -9.135 683 HB3 ALA 85 HB3 ALA 85 -15.632 1.350 -8.857 684 H ASN 86 HN ASN 86 -17.677 -2.355 -8.856 685 HA ASN 86 HA ASN 86 -17.761 -4.472 -9.680 686 HB2 ASN 86 HB2 ASN 86 -14.899 -4.080 -10.576 687 HB3 ASN 86 HB1 ASN 86 -16.078 -5.201 -11.236 688 HD21 ASN 86 HD21 ASN 86 -14.451 -2.697 -12.142 689 HD22 ASN 86 HD22 ASN 86 -15.615 -1.804 -13.060 690 H GLY 87 HN GLY 87 -16.661 -3.880 -6.967 691 HA2 GLY 87 HA2 GLY 87 -16.161 -5.351 -5.227 692 HA3 GLY 87 HA1 GLY 87 -15.691 -6.562 -6.413 693 H LYS 88 HN LYS 88 -14.203 -3.868 -7.421 694 HA LYS 88 HA LYS 88 -11.724 -4.574 -6.021 695 HB2 LYS 88 HB2 LYS 88 -12.247 -3.288 -8.697 696 HB3 LYS 88 HB1 LYS 88 -10.658 -3.263 -7.944 697 HG2 LYS 88 HG2 LYS 88 -10.509 -5.080 -9.340 698 HG3 LYS 88 HG1 LYS 88 -10.960 -5.829 -7.807 699 HD2 LYS 88 HD2 LYS 88 -13.380 -5.579 -8.648 700 HD3 LYS 88 HD1 LYS 88 -12.650 -5.336 -10.237 701 HE2 LYS 88 HE2 LYS 88 -11.413 -7.507 -9.844 702 HE3 LYS 88 HE1 LYS 88 -12.467 -7.750 -8.451 703 HZ1 LYS 88 HZ1 LYS 88 -13.394 -8.880 -10.303 704 HZ2 LYS 88 HZ2 LYS 88 -13.276 -7.514 -11.292 705 HZ3 LYS 88 HZ3 LYS 88 -14.371 -7.529 -10.001 706 H LEU 89 HN LEU 89 -10.218 -2.719 -5.600 707 HA LEU 89 HA LEU 89 -11.776 -0.362 -4.755 708 HB2 LEU 89 HB2 LEU 89 -10.154 -2.041 -3.244 709 HB3 LEU 89 HB1 LEU 89 -9.148 -0.637 -3.542 710 HG LEU 89 HG LEU 89 -10.838 0.816 -2.568 711 HD11 LEU 89 HD11 LEU 89 -12.428 -1.681 -2.589 712 HD12 LEU 89 HD12 LEU 89 -12.929 -0.014 -2.879 713 HD13 LEU 89 HD13 LEU 89 -12.652 -0.580 -1.233 714 HD21 LEU 89 HD21 LEU 89 -10.731 -0.039 -0.242 715 HD22 LEU 89 HD22 LEU 89 -9.176 -0.005 -1.068 716 HD23 LEU 89 HD23 LEU 89 -10.035 -1.531 -0.868 717 H VAL 90 HN VAL 90 -11.328 1.503 -5.763 718 HA VAL 90 HA VAL 90 -8.762 1.658 -7.207 719 HB VAL 90 HB VAL 90 -11.280 3.092 -8.032 720 HG11 VAL 90 HG11 VAL 90 -10.109 3.439 -10.123 721 HG12 VAL 90 HG12 VAL 90 -8.730 2.512 -9.533 722 HG13 VAL 90 HG13 VAL 90 -9.144 4.051 -8.779 723 HG21 VAL 90 HG21 VAL 90 -11.437 1.375 -9.842 724 HG22 VAL 90 HG22 VAL 90 -11.766 0.747 -8.227 725 HG23 VAL 90 HG23 VAL 90 -10.208 0.437 -8.993 726 H CYS 91 HN CYS 91 -7.512 2.844 -5.871 727 HA CYS 91 HA CYS 91 -8.578 5.406 -4.909 728 HB2 CYS 91 HB2 CYS 91 -7.511 4.083 -3.142 729 HB3 CYS 91 HB1 CYS 91 -6.038 3.949 -4.101 730 H LYS 92 HN LYS 92 -8.427 6.735 -6.623 731 HA LYS 92 HA LYS 92 -5.843 6.792 -8.034 732 HB2 LYS 92 HB2 LYS 92 -7.932 6.294 -9.378 733 HB3 LYS 92 HB1 LYS 92 -8.455 7.940 -9.047 734 HG2 LYS 92 HG2 LYS 92 -6.011 8.453 -10.006 735 HG3 LYS 92 HG1 LYS 92 -6.352 6.950 -10.865 736 HD2 LYS 92 HD2 LYS 92 -8.253 9.274 -10.793 737 HD3 LYS 92 HD1 LYS 92 -7.023 9.081 -12.040 738 HE2 LYS 92 HE2 LYS 92 -7.989 6.929 -12.670 739 HE3 LYS 92 HE1 LYS 92 -9.211 7.102 -11.413 740 HZ1 LYS 92 HZ1 LYS 92 -8.871 8.868 -13.772 741 HZ2 LYS 92 HZ2 LYS 92 -10.010 9.101 -12.549 742 HZ3 LYS 92 HZ3 LYS 92 -10.107 7.740 -13.543 743 H SER 93 HN SER 93 -4.755 8.672 -8.303 744 HA SER 93 HA SER 93 -5.719 10.951 -6.719 745 HB2 SER 93 HB2 SER 93 -2.835 10.505 -7.459 746 HB3 SER 93 HB1 SER 93 -3.510 11.394 -6.096 747 HG SER 93 HG SER 93 -4.374 9.083 -5.616 748 H GLU 94 HN GLU 94 -4.228 12.957 -7.588 749 HA GLU 94 HA GLU 94 -5.283 13.494 -10.205 750 HB2 GLU 94 HB2 GLU 94 -3.308 15.278 -8.818 751 HB3 GLU 94 HB1 GLU 94 -4.665 15.715 -9.844 752 HG2 GLU 94 HG2 GLU 94 -5.544 16.311 -7.849 753 HG3 GLU 94 HG1 GLU 94 -6.027 14.615 -7.850 754 H LYS 95 HN LYS 95 -2.236 12.477 -8.896 755 HA LYS 95 HA LYS 95 -1.029 12.729 -11.573 756 HB2 LYS 95 HB2 LYS 95 -0.081 14.151 -9.682 757 HB3 LYS 95 HB1 LYS 95 0.489 12.646 -8.970 758 HG2 LYS 95 HG2 LYS 95 1.827 12.217 -10.984 759 HG3 LYS 95 HG1 LYS 95 1.268 13.745 -11.670 760 HD2 LYS 95 HD2 LYS 95 2.276 14.935 -9.771 761 HD3 LYS 95 HD1 LYS 95 2.869 13.400 -9.134 762 HE2 LYS 95 HE2 LYS 95 4.195 13.081 -11.165 763 HE3 LYS 95 HE1 LYS 95 3.599 14.611 -11.802 764 HZ1 LYS 95 HZ1 LYS 95 5.763 14.924 -10.834 765 HZ2 LYS 95 HZ2 LYS 95 5.264 14.249 -9.370 766 HZ3 LYS 95 HZ3 LYS 95 4.619 15.726 -9.880 767 H PHE 96 HN PHE 96 -1.924 10.563 -9.083 768 HA PHE 96 HA PHE 96 -0.409 8.424 -10.412 769 HB2 PHE 96 HB2 PHE 96 -0.863 8.453 -7.435 770 HB3 PHE 96 HB1 PHE 96 0.255 7.459 -8.361 771 HD1 PHE 96 HD2 PHE 96 2.347 8.397 -9.203 772 HD2 PHE 96 HD1 PHE 96 -0.295 10.689 -6.778 773 HE1 PHE 96 HE2 PHE 96 4.153 10.020 -8.779 774 HE2 PHE 96 HE1 PHE 96 1.499 12.316 -6.353 775 HZ PHE 96 HZ PHE 96 3.725 11.983 -7.353 776 H SER 97 HN SER 97 -1.246 6.208 -9.594 777 HA SER 97 HA SER 97 -4.074 6.163 -8.974 778 HB2 SER 97 HB2 SER 97 -3.627 4.415 -11.236 779 HB3 SER 97 HB1 SER 97 -4.850 5.668 -11.021 780 HG SER 97 HG SER 97 -3.238 7.199 -11.675 781 H HIS 98 HN HIS 98 -4.521 4.446 -7.722 782 HA HIS 98 HA HIS 98 -2.503 2.310 -7.585 783 HB2 HIS 98 HB2 HIS 98 -2.832 3.721 -5.524 784 HB3 HIS 98 HB1 HIS 98 -4.474 3.106 -5.437 785 HD2 HIS 98 HD2 HIS 98 -3.611 -0.083 -6.043 786 HE1 HIS 98 HE1 HIS 98 -1.513 0.445 -2.417 787 HE2 HIS 98 HE2 HIS 98 -2.701 -1.222 -3.903 788 H GLU 99 HN GLU 99 -3.091 0.364 -8.189 789 HA GLU 99 HA GLU 99 -5.933 -0.169 -8.704 790 HB2 GLU 99 HB2 GLU 99 -4.558 -0.507 -10.626 791 HB3 GLU 99 HB1 GLU 99 -3.388 -1.444 -9.705 792 HG2 GLU 99 HG2 GLU 99 -5.138 -3.175 -9.365 793 HG3 GLU 99 HG1 GLU 99 -6.189 -2.252 -10.438 794 H GLN 100 HN GLN 100 -7.032 -1.425 -7.343 795 HA GLN 100 HA GLN 100 -5.562 -3.396 -5.721 796 HB2 GLN 100 HB2 GLN 100 -7.720 -1.468 -4.917 797 HB3 GLN 100 HB1 GLN 100 -7.444 -2.941 -4.009 798 HG2 GLN 100 HG2 GLN 100 -5.246 -0.978 -4.544 799 HG3 GLN 100 HG1 GLN 100 -6.343 -0.800 -3.177 800 HE21 GLN 100 HE21 GLN 100 -6.588 -3.669 -2.774 801 HE22 GLN 100 HE22 GLN 100 -5.103 -4.193 -2.069 802 H GLU 101 HN GLU 101 -6.266 -5.432 -6.015 803 HA GLU 101 HA GLU 101 -9.090 -5.931 -6.549 804 HB2 GLU 101 HB2 GLU 101 -8.222 -5.751 -8.792 805 HB3 GLU 101 HB1 GLU 101 -6.870 -6.806 -8.403 806 HG2 GLU 101 HG2 GLU 101 -8.354 -8.690 -8.155 807 HG3 GLU 101 HG1 GLU 101 -9.760 -7.655 -8.396 808 H VAL 102 HN VAL 102 -9.808 -7.854 -5.729 809 HA VAL 102 HA VAL 102 -7.790 -9.584 -4.456 810 HB VAL 102 HB VAL 102 -10.637 -9.015 -3.591 811 HG11 VAL 102 HG11 VAL 102 -10.178 -10.485 -1.687 812 HG12 VAL 102 HG12 VAL 102 -8.612 -10.896 -2.383 813 HG13 VAL 102 HG13 VAL 102 -10.096 -11.363 -3.215 814 HG21 VAL 102 HG21 VAL 102 -9.034 -7.253 -3.031 815 HG22 VAL 102 HG22 VAL 102 -8.003 -8.440 -2.240 816 HG23 VAL 102 HG23 VAL 102 -9.601 -8.089 -1.586 817 H LYS 103 HN LYS 103 -7.637 -11.563 -5.252 818 HA LYS 103 HA LYS 103 -9.927 -12.650 -6.757 819 HB2 LYS 103 HB2 LYS 103 -6.974 -12.818 -7.186 820 HB3 LYS 103 HB1 LYS 103 -7.972 -14.186 -7.668 821 HG2 LYS 103 HG2 LYS 103 -9.358 -12.143 -8.780 822 HG3 LYS 103 HG1 LYS 103 -7.708 -11.516 -8.870 823 HD2 LYS 103 HD2 LYS 103 -6.981 -13.490 -10.054 824 HD3 LYS 103 HD1 LYS 103 -8.571 -14.231 -9.866 825 HE2 LYS 103 HE2 LYS 103 -8.448 -13.373 -12.084 826 HE3 LYS 103 HE1 LYS 103 -9.515 -12.310 -11.170 827 HZ1 LYS 103 HZ1 LYS 103 -7.817 -11.216 -12.655 828 HZ2 LYS 103 HZ2 LYS 103 -6.641 -11.710 -11.546 829 HZ3 LYS 103 HZ3 LYS 103 -7.876 -10.654 -11.059 830 H GLY 104 HN GLY 104 -10.810 -13.429 -4.778 831 HA2 GLY 104 HA2 GLY 104 -11.321 -15.294 -3.514 832 HA3 GLY 104 HA1 GLY 104 -9.876 -16.078 -4.128 833 H ASN 105 HN ASN 105 -8.026 -16.042 -2.959 834 HA ASN 105 HA ASN 105 -8.207 -14.799 -0.294 835 HB2 ASN 105 HB2 ASN 105 -6.683 -16.514 0.483 836 HB3 ASN 105 HB1 ASN 105 -8.039 -17.277 -0.338 837 HD21 ASN 105 HD21 ASN 105 -5.123 -17.996 0.169 838 HD22 ASN 105 HD22 ASN 105 -4.542 -18.488 -1.384 839 H GLU 106 HN GLU 106 -6.815 -14.267 -3.222 840 HA GLU 106 HA GLU 106 -4.436 -13.092 -1.955 841 HB2 GLU 106 HB2 GLU 106 -4.663 -14.239 -4.734 842 HB3 GLU 106 HB1 GLU 106 -3.261 -13.379 -4.114 843 HG2 GLU 106 HG2 GLU 106 -3.280 -15.141 -2.242 844 HG3 GLU 106 HG1 GLU 106 -4.319 -16.060 -3.332 845 H MET 107 HN MET 107 -3.923 -11.050 -2.354 846 HA MET 107 HA MET 107 -5.787 -9.496 -4.008 847 HB2 MET 107 HB2 MET 107 -5.890 -8.869 -1.676 848 HB3 MET 107 HB1 MET 107 -4.141 -8.735 -1.588 849 HG2 MET 107 HG2 MET 107 -4.125 -6.765 -2.863 850 HG3 MET 107 HG1 MET 107 -5.791 -7.001 -3.394 851 HE1 MET 107 HE1 MET 107 -3.472 -5.620 -0.460 852 HE2 MET 107 HE2 MET 107 -3.965 -7.241 0.029 853 HE3 MET 107 HE3 MET 107 -4.569 -5.836 0.907 854 H VAL 108 HN VAL 108 -4.943 -8.967 -5.901 855 HA VAL 108 HA VAL 108 -2.040 -8.583 -6.096 856 HB VAL 108 HB VAL 108 -2.589 -8.721 -8.645 857 HG11 VAL 108 HG11 VAL 108 -1.240 -10.347 -7.467 858 HG12 VAL 108 HG12 VAL 108 -2.345 -11.177 -8.561 859 HG13 VAL 108 HG13 VAL 108 -2.687 -11.129 -6.831 860 HG21 VAL 108 HG21 VAL 108 -4.975 -10.164 -7.478 861 HG22 VAL 108 HG22 VAL 108 -4.498 -10.156 -9.175 862 HG23 VAL 108 HG23 VAL 108 -5.031 -8.662 -8.404 863 H GLU 109 HN GLU 109 -1.547 -6.518 -5.825 864 HA GLU 109 HA GLU 109 -3.262 -4.526 -7.131 865 HB2 GLU 109 HB2 GLU 109 -2.604 -2.928 -5.448 866 HB3 GLU 109 HB1 GLU 109 -3.239 -4.373 -4.674 867 HG2 GLU 109 HG2 GLU 109 -0.300 -3.970 -5.061 868 HG3 GLU 109 HG1 GLU 109 -1.157 -3.266 -3.693 869 H THR 110 HN THR 110 -2.266 -2.602 -7.905 870 HA THR 110 HA THR 110 0.560 -2.823 -8.654 871 HB THR 110 HB THR 110 -1.492 -1.951 -10.672 872 HG1 THR 110 HG1 THR 110 -2.107 -3.969 -10.783 873 HG21 THR 110 HG21 THR 110 0.908 -3.278 -11.616 874 HG22 THR 110 HG22 THR 110 1.277 -1.880 -10.605 875 HG23 THR 110 HG23 THR 110 0.260 -1.690 -12.034 876 H ILE 111 HN ILE 111 1.480 -1.003 -7.918 877 HA ILE 111 HA ILE 111 -0.159 1.454 -7.906 878 HB ILE 111 HB ILE 111 2.255 1.300 -6.183 879 HG12 ILE 111 HG12 ILE 111 -0.317 -0.095 -5.417 880 HG13 ILE 111 HG11 ILE 111 1.155 -0.930 -5.905 881 HG21 ILE 111 HG21 ILE 111 0.894 2.617 -4.690 882 HG22 ILE 111 HG22 ILE 111 -0.535 2.318 -5.676 883 HG23 ILE 111 HG23 ILE 111 0.791 3.285 -6.318 884 HD11 ILE 111 HD11 ILE 111 0.985 -0.932 -3.511 885 HD12 ILE 111 HD12 ILE 111 0.784 0.822 -3.489 886 HD13 ILE 111 HD13 ILE 111 2.322 0.117 -3.992 887 H THR 112 HN THR 112 1.101 3.485 -8.157 888 HA THR 112 HA THR 112 3.694 3.266 -9.449 889 HB THR 112 HB THR 112 1.406 4.634 -10.874 890 HG1 THR 112 HG1 THR 112 2.357 2.029 -10.960 891 HG21 THR 112 HG21 THR 112 2.924 5.116 -12.592 892 HG22 THR 112 HG22 THR 112 4.096 3.933 -12.006 893 HG23 THR 112 HG23 THR 112 3.840 5.438 -11.118 894 H PHE 113 HN PHE 113 4.836 4.641 -8.261 895 HA PHE 113 HA PHE 113 3.897 7.397 -7.999 896 HB2 PHE 113 HB2 PHE 113 4.470 5.535 -5.726 897 HB3 PHE 113 HB1 PHE 113 4.891 7.232 -5.555 898 HD1 PHE 113 HD1 PHE 113 2.101 4.886 -6.140 899 HD2 PHE 113 HD2 PHE 113 3.246 8.833 -5.052 900 HE1 PHE 113 HE1 PHE 113 -0.217 5.359 -5.454 901 HE2 PHE 113 HE2 PHE 113 0.933 9.317 -4.364 902 HZ PHE 113 HZ PHE 113 -0.800 7.577 -4.560 903 H GLY 114 HN GLY 114 5.603 8.876 -7.933 904 HA2 GLY 114 HA2 GLY 114 7.735 9.658 -8.255 905 HA3 GLY 114 HA1 GLY 114 8.290 8.219 -7.414 906 H GLY 115 HN GLY 115 6.371 7.889 -10.267 907 HA2 GLY 115 HA2 GLY 115 6.894 7.342 -12.441 908 HA3 GLY 115 HA1 GLY 115 8.569 7.753 -12.109 909 H VAL 116 HN VAL 116 7.257 5.527 -9.880 910 HA VAL 116 HA VAL 116 8.480 3.295 -11.365 911 HB VAL 116 HB VAL 116 8.350 3.476 -8.361 912 HG11 VAL 116 HG11 VAL 116 8.607 1.252 -9.276 913 HG12 VAL 116 HG12 VAL 116 10.098 1.762 -8.480 914 HG13 VAL 116 HG13 VAL 116 9.986 1.784 -10.241 915 HG21 VAL 116 HG21 VAL 116 10.691 4.172 -8.373 916 HG22 VAL 116 HG22 VAL 116 9.671 5.363 -9.179 917 HG23 VAL 116 HG23 VAL 116 10.664 4.261 -10.135 918 H THR 117 HN THR 117 7.205 1.619 -11.767 919 HA THR 117 HA THR 117 4.547 1.560 -10.566 920 HB THR 117 HB THR 117 5.593 -0.103 -12.864 921 HG1 THR 117 HG1 THR 117 5.649 2.159 -13.362 922 HG21 THR 117 HG21 THR 117 2.796 0.537 -11.918 923 HG22 THR 117 HG22 THR 117 3.612 -1.022 -11.803 924 HG23 THR 117 HG23 THR 117 3.193 -0.364 -13.384 925 H LEU 118 HN LEU 118 4.990 0.678 -8.546 926 HA LEU 118 HA LEU 118 6.509 -1.757 -8.313 927 HB2 LEU 118 HB2 LEU 118 6.688 -0.192 -6.502 928 HB3 LEU 118 HB1 LEU 118 4.947 -0.144 -6.299 929 HG LEU 118 HG LEU 118 4.892 -2.299 -5.319 930 HD11 LEU 118 HD11 LEU 118 6.985 -3.672 -5.125 931 HD12 LEU 118 HD12 LEU 118 7.708 -2.589 -6.319 932 HD13 LEU 118 HD13 LEU 118 6.296 -3.556 -6.745 933 HD21 LEU 118 HD21 LEU 118 6.236 -2.059 -3.390 934 HD22 LEU 118 HD22 LEU 118 5.851 -0.426 -3.936 935 HD23 LEU 118 HD23 LEU 118 7.442 -1.117 -4.268 936 H ILE 119 HN ILE 119 5.681 -3.553 -9.004 937 HA ILE 119 HA ILE 119 2.825 -4.095 -8.667 938 HB ILE 119 HB ILE 119 4.911 -5.574 -10.284 939 HG12 ILE 119 HG12 ILE 119 2.832 -3.504 -10.937 940 HG13 ILE 119 HG11 ILE 119 4.522 -3.548 -11.401 941 HG21 ILE 119 HG21 ILE 119 1.951 -5.966 -10.535 942 HG22 ILE 119 HG22 ILE 119 2.850 -6.825 -9.281 943 HG23 ILE 119 HG23 ILE 119 3.265 -7.053 -10.980 944 HD11 ILE 119 HD11 ILE 119 2.807 -5.703 -12.444 945 HD12 ILE 119 HD12 ILE 119 4.137 -4.831 -13.212 946 HD13 ILE 119 HD13 ILE 119 2.544 -4.081 -13.082 947 H ARG 120 HN ARG 120 2.264 -5.155 -6.891 948 HA ARG 120 HA ARG 120 4.135 -7.155 -5.833 949 HB2 ARG 120 HB2 ARG 120 2.866 -6.376 -3.582 950 HB3 ARG 120 HB1 ARG 120 4.397 -5.706 -4.121 951 HG2 ARG 120 HG2 ARG 120 3.342 -3.783 -5.022 952 HG3 ARG 120 HG1 ARG 120 1.742 -4.502 -4.847 953 HD2 ARG 120 HD2 ARG 120 3.547 -3.907 -2.511 954 HD3 ARG 120 HD1 ARG 120 2.354 -2.765 -3.133 955 HE ARG 120 HE ARG 120 1.107 -5.253 -2.657 956 HH11 ARG 120 HH11 ARG 120 2.454 -2.521 -0.926 957 HH12 ARG 120 HH12 ARG 120 1.455 -2.740 0.469 958 HH21 ARG 120 HH21 ARG 120 -0.199 -5.578 -0.823 959 HH22 ARG 120 HH22 ARG 120 -0.063 -4.498 0.531 960 H ARG 121 HN ARG 121 3.093 -8.681 -4.334 961 HA ARG 121 HA ARG 121 0.325 -9.291 -5.062 962 HB2 ARG 121 HB2 ARG 121 2.775 -11.000 -5.062 963 HB3 ARG 121 HB1 ARG 121 1.239 -11.728 -4.611 964 HG2 ARG 121 HG2 ARG 121 0.669 -11.904 -6.720 965 HG3 ARG 121 HG1 ARG 121 0.883 -10.177 -6.966 966 HD2 ARG 121 HD2 ARG 121 3.202 -12.071 -6.938 967 HD3 ARG 121 HD1 ARG 121 2.274 -11.761 -8.405 968 HE ARG 121 HE ARG 121 3.259 -9.422 -7.009 969 HH11 ARG 121 HH11 ARG 121 3.767 -11.751 -9.561 970 HH12 ARG 121 HH12 ARG 121 4.838 -10.729 -10.464 971 HH21 ARG 121 HH21 ARG 121 4.700 -8.058 -8.200 972 HH22 ARG 121 HH22 ARG 121 5.361 -8.633 -9.706 973 H SER 122 HN SER 122 -0.935 -9.428 -3.309 974 HA SER 122 HA SER 122 0.386 -10.004 -0.750 975 HB2 SER 122 HB2 SER 122 -2.051 -8.268 -0.960 976 HB3 SER 122 HB1 SER 122 -0.866 -8.363 0.340 977 HG SER 122 HG SER 122 -0.679 -7.095 -2.170 978 H LYS 123 HN LYS 123 -0.092 -12.044 -0.361 979 HA LYS 123 HA LYS 123 -2.752 -13.079 -0.893 980 HB2 LYS 123 HB2 LYS 123 -1.728 -15.218 -0.003 981 HB3 LYS 123 HB1 LYS 123 -0.990 -14.569 -1.461 982 HG2 LYS 123 HG2 LYS 123 0.940 -13.964 -0.383 983 HG3 LYS 123 HG1 LYS 123 0.159 -13.817 1.190 984 HD2 LYS 123 HD2 LYS 123 1.507 -15.752 1.316 985 HD3 LYS 123 HD1 LYS 123 -0.140 -16.344 1.099 986 HE2 LYS 123 HE2 LYS 123 1.657 -15.919 -1.262 987 HE3 LYS 123 HE1 LYS 123 1.789 -17.385 -0.293 988 HZ1 LYS 123 HZ1 LYS 123 0.333 -17.864 -2.058 989 HZ2 LYS 123 HZ2 LYS 123 -0.548 -16.437 -1.860 990 HZ3 LYS 123 HZ3 LYS 123 -0.663 -17.673 -0.704 991 H ARG 124 HN ARG 124 -4.214 -13.723 0.672 992 HA ARG 124 HA ARG 124 -4.059 -12.386 3.178 993 HB2 ARG 124 HB2 ARG 124 -6.079 -13.618 1.689 994 HB3 ARG 124 HB1 ARG 124 -5.939 -14.584 3.158 995 HG2 ARG 124 HG2 ARG 124 -6.371 -12.696 4.535 996 HG3 ARG 124 HG1 ARG 124 -6.270 -11.594 3.159 997 HD2 ARG 124 HD2 ARG 124 -8.582 -11.952 3.725 998 HD3 ARG 124 HD1 ARG 124 -8.248 -12.709 2.175 999 HE ARG 124 HE ARG 124 -7.965 -14.805 3.723 1000 HH11 ARG 124 HH11 ARG 124 -10.352 -12.259 3.939 1001 HH12 ARG 124 HH12 ARG 124 -11.574 -13.278 4.627 1002 HH21 ARG 124 HH21 ARG 124 -9.574 -16.163 4.623 1003 HH22 ARG 124 HH22 ARG 124 -11.127 -15.502 5.023 1004 H VAL 125 HN VAL 125 -4.207 -13.399 5.255 1005 HA VAL 125 HA VAL 125 -3.473 -14.720 6.921 1006 HB VAL 125 HB VAL 125 -3.425 -17.026 4.994 1007 HG11 VAL 125 HG11 VAL 125 -4.033 -18.321 6.999 1008 HG12 VAL 125 HG12 VAL 125 -3.910 -16.847 7.962 1009 HG13 VAL 125 HG13 VAL 125 -2.479 -17.502 7.165 1010 HG21 VAL 125 HG21 VAL 125 -5.839 -16.224 6.578 1011 HG22 VAL 125 HG22 VAL 125 -5.729 -17.346 5.224 1012 HG23 VAL 125 HG23 VAL 125 -5.564 -15.610 4.950 Start of MODEL 18 1 H1 ALA 1 HT1 ALA 1 -13.562 -10.668 1.971 2 H2 ALA 1 HT2 ALA 1 -13.415 -10.112 0.387 3 H3 ALA 1 HT3 ALA 1 -14.948 -10.339 1.058 4 HA ALA 1 HA ALA 1 -14.463 -8.018 1.017 5 HB1 ALA 1 HB1 ALA 1 -14.114 -8.980 3.850 6 HB2 ALA 1 HB2 ALA 1 -15.651 -9.035 2.987 7 HB3 ALA 1 HB3 ALA 1 -14.869 -7.485 3.297 8 H PHE 2 HN PHE 2 -13.115 -6.243 1.773 9 HA PHE 2 HA PHE 2 -10.330 -6.817 1.415 10 HB2 PHE 2 HB2 PHE 2 -11.949 -4.333 1.818 11 HB3 PHE 2 HB1 PHE 2 -10.202 -4.263 2.016 12 HD1 PHE 2 HD1 PHE 2 -12.800 -5.414 -0.389 13 HD2 PHE 2 HD2 PHE 2 -8.870 -3.877 0.162 14 HE1 PHE 2 HE1 PHE 2 -12.540 -5.210 -2.826 15 HE2 PHE 2 HE2 PHE 2 -8.615 -3.666 -2.272 16 HZ PHE 2 HZ PHE 2 -10.448 -4.338 -3.763 17 H SER 3 HN SER 3 -12.424 -6.213 4.141 18 HA SER 3 HA SER 3 -10.458 -5.618 6.071 19 HB2 SER 3 HB2 SER 3 -12.331 -6.758 7.589 20 HB3 SER 3 HB1 SER 3 -12.552 -5.154 6.888 21 HG SER 3 HG SER 3 -13.940 -5.945 5.435 22 H GLY 4 HN GLY 4 -8.768 -6.883 6.500 23 HA2 GLY 4 HA2 GLY 4 -8.928 -9.390 7.654 24 HA3 GLY 4 HA1 GLY 4 -8.697 -9.667 5.934 25 H THR 5 HN THR 5 -6.671 -10.631 6.450 26 HA THR 5 HA THR 5 -4.590 -8.602 6.879 27 HB THR 5 HB THR 5 -3.294 -10.558 7.972 28 HG1 THR 5 HG1 THR 5 -5.110 -12.059 7.474 29 HG21 THR 5 HG21 THR 5 -3.803 -8.630 9.239 30 HG22 THR 5 HG22 THR 5 -4.359 -10.001 10.200 31 HG23 THR 5 HG23 THR 5 -5.520 -9.029 9.294 32 H TRP 6 HN TRP 6 -3.344 -8.498 5.125 33 HA TRP 6 HA TRP 6 -3.004 -10.954 3.523 34 HB2 TRP 6 HB2 TRP 6 -2.691 -8.176 2.417 35 HB3 TRP 6 HB1 TRP 6 -2.974 -9.676 1.544 36 HD1 TRP 6 HD1 TRP 6 -4.828 -7.129 3.772 37 HE1 TRP 6 HE1 TRP 6 -7.338 -7.252 3.209 38 HE3 TRP 6 HE3 TRP 6 -4.763 -11.165 0.633 39 HZ2 TRP 6 HZ2 TRP 6 -9.069 -8.865 1.669 40 HZ3 TRP 6 HZ3 TRP 6 -6.893 -11.949 -0.324 41 HH2 TRP 6 HH2 TRP 6 -8.999 -10.818 0.181 42 H GLN 7 HN GLN 7 -1.018 -11.731 3.324 43 HA GLN 7 HA GLN 7 1.238 -10.155 4.286 44 HB2 GLN 7 HB2 GLN 7 0.801 -12.627 4.859 45 HB3 GLN 7 HB1 GLN 7 1.342 -12.972 3.223 46 HG2 GLN 7 HG2 GLN 7 3.508 -12.074 3.666 47 HG3 GLN 7 HG1 GLN 7 2.979 -11.461 5.231 48 HE21 GLN 7 HE21 GLN 7 3.807 -14.309 3.408 49 HE22 GLN 7 HE22 GLN 7 4.028 -15.354 4.769 50 H VAL 8 HN VAL 8 1.965 -8.767 2.826 51 HA VAL 8 HA VAL 8 1.773 -9.279 0.003 52 HB VAL 8 HB VAL 8 1.330 -7.034 0.894 53 HG11 VAL 8 HG11 VAL 8 3.157 -5.615 1.662 54 HG12 VAL 8 HG12 VAL 8 4.265 -6.982 1.561 55 HG13 VAL 8 HG13 VAL 8 2.933 -7.010 2.717 56 HG21 VAL 8 HG21 VAL 8 3.703 -7.172 -0.954 57 HG22 VAL 8 HG22 VAL 8 2.650 -5.776 -0.738 58 HG23 VAL 8 HG23 VAL 8 2.005 -7.270 -1.418 59 H TYR 9 HN TYR 9 3.352 -9.626 -1.448 60 HA TYR 9 HA TYR 9 6.144 -9.714 -0.614 61 HB2 TYR 9 HB2 TYR 9 6.446 -11.963 -1.608 62 HB3 TYR 9 HB1 TYR 9 5.381 -12.002 -0.212 63 HD1 TYR 9 HD1 TYR 9 2.909 -12.284 -0.558 64 HD2 TYR 9 HD2 TYR 9 5.691 -12.652 -3.753 65 HE1 TYR 9 HE1 TYR 9 1.213 -13.470 -1.892 66 HE2 TYR 9 HE2 TYR 9 4.007 -13.838 -5.091 67 HH TYR 9 HH TYR 9 0.756 -13.856 -4.348 68 H ALA 10 HN ALA 10 7.482 -9.094 -2.307 69 HA ALA 10 HA ALA 10 6.508 -9.143 -5.015 70 HB1 ALA 10 HB1 ALA 10 7.042 -6.431 -3.841 71 HB2 ALA 10 HB2 ALA 10 5.428 -7.142 -3.899 72 HB3 ALA 10 HB3 ALA 10 6.311 -6.835 -5.397 73 H GLN 11 HN GLN 11 8.111 -8.470 -6.566 74 HA GLN 11 HA GLN 11 10.772 -7.954 -5.523 75 HB2 GLN 11 HB2 GLN 11 11.788 -9.773 -6.825 76 HB3 GLN 11 HB1 GLN 11 10.660 -10.392 -5.627 77 HG2 GLN 11 HG2 GLN 11 9.069 -10.087 -7.828 78 HG3 GLN 11 HG1 GLN 11 10.606 -10.586 -8.534 79 HE21 GLN 11 HE21 GLN 11 8.163 -12.047 -8.483 80 HE22 GLN 11 HE22 GLN 11 8.458 -13.512 -7.613 81 H GLU 12 HN GLU 12 8.695 -6.610 -7.129 82 HA GLU 12 HA GLU 12 10.369 -5.971 -9.465 83 HB2 GLU 12 HB2 GLU 12 7.362 -5.911 -9.335 84 HB3 GLU 12 HB1 GLU 12 8.320 -5.332 -10.682 85 HG2 GLU 12 HG2 GLU 12 9.116 -7.529 -11.151 86 HG3 GLU 12 HG1 GLU 12 8.361 -8.168 -9.691 87 H ASN 13 HN ASN 13 10.694 -3.940 -9.906 88 HA ASN 13 HA ASN 13 11.438 -1.875 -9.110 89 HB2 ASN 13 HB2 ASN 13 8.483 -1.346 -9.396 90 HB3 ASN 13 HB1 ASN 13 9.822 -0.242 -9.715 91 HD21 ASN 13 HD21 ASN 13 7.563 -2.046 -11.154 92 HD22 ASN 13 HD22 ASN 13 8.335 -2.373 -12.669 93 H TYR 14 HN TYR 14 11.422 -3.216 -6.868 94 HA TYR 14 HA TYR 14 9.693 -1.884 -4.940 95 HB2 TYR 14 HB2 TYR 14 9.944 -4.325 -4.810 96 HB3 TYR 14 HB1 TYR 14 11.679 -4.134 -4.587 97 HD1 TYR 14 HD1 TYR 14 8.388 -3.732 -3.020 98 HD2 TYR 14 HD2 TYR 14 12.594 -3.443 -2.461 99 HE1 TYR 14 HE1 TYR 14 8.045 -3.591 -0.592 100 HE2 TYR 14 HE2 TYR 14 12.265 -3.305 -0.027 101 HH TYR 14 HH TYR 14 10.188 -4.213 1.604 102 H GLU 15 HN GLU 15 13.143 -2.711 -5.142 103 HA GLU 15 HA GLU 15 13.946 -0.897 -3.150 104 HB2 GLU 15 HB2 GLU 15 16.251 -1.260 -4.127 105 HB3 GLU 15 HB1 GLU 15 15.404 -2.671 -3.520 106 HG2 GLU 15 HG2 GLU 15 15.260 -1.944 -6.400 107 HG3 GLU 15 HG1 GLU 15 16.644 -2.797 -5.739 108 H GLU 16 HN GLU 16 13.462 -0.555 -6.569 109 HA GLU 16 HA GLU 16 14.878 1.921 -6.799 110 HB2 GLU 16 HB2 GLU 16 14.275 0.279 -8.693 111 HB3 GLU 16 HB1 GLU 16 12.681 1.012 -8.645 112 HG2 GLU 16 HG2 GLU 16 13.356 2.859 -9.696 113 HG3 GLU 16 HG1 GLU 16 14.859 2.955 -8.780 114 H PHE 17 HN PHE 17 11.554 0.966 -6.153 115 HA PHE 17 HA PHE 17 10.470 3.592 -6.384 116 HB2 PHE 17 HB2 PHE 17 9.032 1.628 -6.608 117 HB3 PHE 17 HB1 PHE 17 9.387 1.159 -4.948 118 HD1 PHE 17 HD1 PHE 17 8.482 4.429 -6.495 119 HD2 PHE 17 HD2 PHE 17 7.487 1.385 -3.706 120 HE1 PHE 17 HE1 PHE 17 6.578 5.766 -5.724 121 HE2 PHE 17 HE2 PHE 17 5.576 2.717 -2.923 122 HZ PHE 17 HZ PHE 17 5.116 4.913 -3.929 123 H LEU 18 HN LEU 18 11.849 1.686 -3.776 124 HA LEU 18 HA LEU 18 11.069 3.282 -1.619 125 HB2 LEU 18 HB2 LEU 18 13.676 1.791 -1.910 126 HB3 LEU 18 HB1 LEU 18 12.967 2.349 -0.407 127 HG LEU 18 HG LEU 18 12.089 0.075 -2.160 128 HD11 LEU 18 HD11 LEU 18 12.076 -1.077 0.051 129 HD12 LEU 18 HD12 LEU 18 12.786 0.376 0.747 130 HD13 LEU 18 HD13 LEU 18 13.661 -0.528 -0.490 131 HD21 LEU 18 HD21 LEU 18 10.073 1.339 -1.727 132 HD22 LEU 18 HD22 LEU 18 10.463 1.418 -0.005 133 HD23 LEU 18 HD23 LEU 18 10.087 -0.133 -0.756 134 H LYS 19 HN LYS 19 13.670 3.618 -3.924 135 HA LYS 19 HA LYS 19 14.997 5.751 -2.590 136 HB2 LYS 19 HB2 LYS 19 15.119 5.097 -5.538 137 HB3 LYS 19 HB1 LYS 19 16.323 5.957 -4.587 138 HG2 LYS 19 HG2 LYS 19 15.976 3.479 -3.334 139 HG3 LYS 19 HG1 LYS 19 16.036 3.148 -5.064 140 HD2 LYS 19 HD2 LYS 19 18.196 3.840 -5.263 141 HD3 LYS 19 HD1 LYS 19 18.045 5.038 -3.976 142 HE2 LYS 19 HE2 LYS 19 17.970 3.164 -2.338 143 HE3 LYS 19 HE1 LYS 19 18.327 2.055 -3.660 144 HZ1 LYS 19 HZ1 LYS 19 20.058 4.340 -2.904 145 HZ2 LYS 19 HZ2 LYS 19 20.423 3.102 -3.997 146 HZ3 LYS 19 HZ3 LYS 19 20.290 2.760 -2.342 147 H ALA 20 HN ALA 20 12.254 5.555 -4.696 148 HA ALA 20 HA ALA 20 12.369 8.288 -5.572 149 HB1 ALA 20 HB1 ALA 20 10.180 7.860 -6.577 150 HB2 ALA 20 HB2 ALA 20 10.090 6.317 -5.728 151 HB3 ALA 20 HB3 ALA 20 11.318 6.570 -6.967 152 H LEU 21 HN LEU 21 11.424 6.786 -2.731 153 HA LEU 21 HA LEU 21 9.587 8.959 -2.019 154 HB2 LEU 21 HB2 LEU 21 10.230 6.392 -0.568 155 HB3 LEU 21 HB1 LEU 21 9.021 7.564 -0.080 156 HG LEU 21 HG LEU 21 8.679 6.556 -2.810 157 HD11 LEU 21 HD11 LEU 21 9.485 4.510 -1.836 158 HD12 LEU 21 HD12 LEU 21 7.738 4.401 -2.044 159 HD13 LEU 21 HD13 LEU 21 8.419 4.708 -0.447 160 HD21 LEU 21 HD21 LEU 21 6.917 6.938 -0.401 161 HD22 LEU 21 HD22 LEU 21 6.348 6.293 -1.941 162 HD23 LEU 21 HD23 LEU 21 6.998 7.933 -1.856 163 H ALA 22 HN ALA 22 12.709 8.638 -2.142 164 HA ALA 22 HA ALA 22 14.530 9.491 -1.095 165 HB1 ALA 22 HB1 ALA 22 12.781 11.461 -1.042 166 HB2 ALA 22 HB2 ALA 22 14.312 11.586 -0.176 167 HB3 ALA 22 HB3 ALA 22 12.839 11.174 0.698 168 H LEU 23 HN LEU 23 13.334 7.115 -0.102 169 HA LEU 23 HA LEU 23 13.340 7.173 2.765 170 HB2 LEU 23 HB2 LEU 23 13.345 4.948 0.745 171 HB3 LEU 23 HB1 LEU 23 13.368 4.645 2.471 172 HG LEU 23 HG LEU 23 11.205 6.209 1.067 173 HD11 LEU 23 HD11 LEU 23 11.054 3.998 0.236 174 HD12 LEU 23 HD12 LEU 23 9.835 4.142 1.503 175 HD13 LEU 23 HD13 LEU 23 11.355 3.308 1.830 176 HD21 LEU 23 HD21 LEU 23 11.308 5.015 3.830 177 HD22 LEU 23 HD22 LEU 23 9.956 5.898 3.120 178 HD23 LEU 23 HD23 LEU 23 11.475 6.729 3.446 179 HA PRO 24 HA PRO 24 17.611 6.656 3.650 180 HB2 PRO 24 HB2 PRO 24 17.565 4.922 5.752 181 HB3 PRO 24 HB1 PRO 24 17.067 6.621 5.890 182 HG2 PRO 24 HG2 PRO 24 15.384 4.181 5.597 183 HG3 PRO 24 HG1 PRO 24 15.148 5.596 6.640 184 HD2 PRO 24 HD2 PRO 24 13.815 5.279 4.313 185 HD3 PRO 24 HD1 PRO 24 14.277 6.873 4.942 186 H GLU 25 HN GLU 25 19.197 5.516 2.754 187 HA GLU 25 HA GLU 25 18.870 3.314 1.158 188 HB2 GLU 25 HB2 GLU 25 20.790 4.808 1.043 189 HB3 GLU 25 HB1 GLU 25 21.335 4.258 2.619 190 HG2 GLU 25 HG2 GLU 25 22.679 3.015 1.285 191 HG3 GLU 25 HG1 GLU 25 21.320 1.912 1.460 192 H ASP 26 HN ASP 26 19.873 3.426 4.543 193 HA ASP 26 HA ASP 26 20.593 0.763 4.899 194 HB2 ASP 26 HB2 ASP 26 19.534 2.862 6.759 195 HB3 ASP 26 HB1 ASP 26 19.750 1.212 7.331 196 H LEU 27 HN LEU 27 17.399 2.290 5.307 197 HA LEU 27 HA LEU 27 16.120 -0.110 6.114 198 HB2 LEU 27 HB2 LEU 27 15.202 2.127 6.588 199 HB3 LEU 27 HB1 LEU 27 14.906 2.353 4.873 200 HG LEU 27 HG LEU 27 13.655 -0.083 5.686 201 HD11 LEU 27 HD11 LEU 27 11.989 0.931 7.249 202 HD12 LEU 27 HD12 LEU 27 13.103 2.285 7.446 203 HD13 LEU 27 HD13 LEU 27 13.595 0.658 7.918 204 HD21 LEU 27 HD21 LEU 27 13.003 1.256 3.776 205 HD22 LEU 27 HD22 LEU 27 12.535 2.586 4.838 206 HD23 LEU 27 HD23 LEU 27 11.643 1.063 4.883 207 H ILE 28 HN ILE 28 16.590 1.490 3.037 208 HA ILE 28 HA ILE 28 14.841 -0.034 1.476 209 HB ILE 28 HB ILE 28 17.468 1.244 0.687 210 HG12 ILE 28 HG12 ILE 28 14.640 2.292 0.476 211 HG13 ILE 28 HG11 ILE 28 15.779 2.753 1.733 212 HG21 ILE 28 HG21 ILE 28 16.787 1.124 -1.570 213 HG22 ILE 28 HG22 ILE 28 15.163 0.597 -1.135 214 HG23 ILE 28 HG23 ILE 28 16.534 -0.489 -0.905 215 HD11 ILE 28 HD11 ILE 28 17.284 3.469 -0.223 216 HD12 ILE 28 HD12 ILE 28 15.910 4.481 0.222 217 HD13 ILE 28 HD13 ILE 28 15.801 3.409 -1.176 218 H LYS 29 HN LYS 29 18.202 -0.598 2.389 219 HA LYS 29 HA LYS 29 18.578 -2.884 0.776 220 HB2 LYS 29 HB2 LYS 29 20.016 -2.089 3.307 221 HB3 LYS 29 HB1 LYS 29 20.572 -3.285 2.143 222 HG2 LYS 29 HG2 LYS 29 20.874 -1.616 0.464 223 HG3 LYS 29 HG1 LYS 29 20.104 -0.386 1.472 224 HD2 LYS 29 HD2 LYS 29 22.430 -0.010 1.640 225 HD3 LYS 29 HD1 LYS 29 21.958 -0.799 3.146 226 HE2 LYS 29 HE2 LYS 29 22.690 -2.964 2.162 227 HE3 LYS 29 HE1 LYS 29 23.289 -2.075 0.761 228 HZ1 LYS 29 HZ1 LYS 29 24.808 -2.662 2.826 229 HZ2 LYS 29 HZ2 LYS 29 24.204 -1.181 3.379 230 HZ3 LYS 29 HZ3 LYS 29 25.035 -1.261 1.908 231 H MET 30 HN MET 30 17.232 -2.471 4.013 232 HA MET 30 HA MET 30 17.289 -5.349 4.437 233 HB2 MET 30 HB2 MET 30 16.513 -4.918 6.662 234 HB3 MET 30 HB1 MET 30 17.787 -3.771 6.295 235 HG2 MET 30 HG2 MET 30 16.063 -2.073 5.811 236 HG3 MET 30 HG1 MET 30 14.832 -3.229 6.312 237 HE1 MET 30 HE1 MET 30 18.430 -2.705 8.178 238 HE2 MET 30 HE2 MET 30 17.965 -1.217 9.003 239 HE3 MET 30 HE3 MET 30 17.962 -1.288 7.241 240 H ALA 31 HN ALA 31 14.944 -2.824 3.757 241 HA ALA 31 HA ALA 31 12.596 -4.298 4.207 242 HB1 ALA 31 HB1 ALA 31 12.533 -1.893 3.984 243 HB2 ALA 31 HB2 ALA 31 11.499 -2.618 2.753 244 HB3 ALA 31 HB3 ALA 31 13.090 -1.999 2.315 245 H ARG 32 HN ARG 32 14.905 -4.508 1.696 246 HA ARG 32 HA ARG 32 13.274 -5.523 -0.382 247 HB2 ARG 32 HB2 ARG 32 16.219 -5.700 0.205 248 HB3 ARG 32 HB1 ARG 32 15.507 -6.513 -1.180 249 HG2 ARG 32 HG2 ARG 32 14.975 -4.535 -2.239 250 HG3 ARG 32 HG1 ARG 32 15.026 -3.600 -0.741 251 HD2 ARG 32 HD2 ARG 32 16.966 -3.011 -1.949 252 HD3 ARG 32 HD1 ARG 32 17.495 -4.099 -0.672 253 HE ARG 32 HE ARG 32 17.158 -5.799 -2.702 254 HH11 ARG 32 HH11 ARG 32 18.754 -2.677 -2.556 255 HH12 ARG 32 HH12 ARG 32 19.915 -3.068 -3.783 256 HH21 ARG 32 HH21 ARG 32 18.694 -6.324 -4.313 257 HH22 ARG 32 HH22 ARG 32 19.884 -5.155 -4.784 258 H ASP 33 HN ASP 33 14.491 -6.909 2.513 259 HA ASP 33 HA ASP 33 13.805 -9.615 1.589 260 HB2 ASP 33 HB2 ASP 33 16.059 -9.407 2.535 261 HB3 ASP 33 HB1 ASP 33 15.389 -8.738 4.018 262 H ILE 34 HN ILE 34 13.214 -7.200 4.067 263 HA ILE 34 HA ILE 34 11.457 -8.715 5.676 264 HB ILE 34 HB ILE 34 11.373 -5.718 5.329 265 HG12 ILE 34 HG12 ILE 34 13.123 -7.288 7.226 266 HG13 ILE 34 HG11 ILE 34 13.690 -6.536 5.739 267 HG21 ILE 34 HG21 ILE 34 10.654 -7.492 7.663 268 HG22 ILE 34 HG22 ILE 34 9.524 -6.634 6.609 269 HG23 ILE 34 HG23 ILE 34 10.614 -5.727 7.657 270 HD11 ILE 34 HD11 ILE 34 12.634 -5.196 8.200 271 HD12 ILE 34 HD12 ILE 34 12.875 -4.355 6.672 272 HD13 ILE 34 HD13 ILE 34 14.250 -5.082 7.505 273 H LYS 35 HN LYS 35 9.367 -9.182 5.489 274 HA LYS 35 HA LYS 35 7.760 -7.753 3.489 275 HB2 LYS 35 HB2 LYS 35 8.003 -10.739 3.856 276 HB3 LYS 35 HB1 LYS 35 6.661 -9.989 3.000 277 HG2 LYS 35 HG2 LYS 35 8.178 -9.057 1.364 278 HG3 LYS 35 HG1 LYS 35 9.566 -9.691 2.256 279 HD2 LYS 35 HD2 LYS 35 7.405 -11.538 1.321 280 HD3 LYS 35 HD1 LYS 35 8.642 -10.984 0.190 281 HE2 LYS 35 HE2 LYS 35 9.180 -12.361 2.822 282 HE3 LYS 35 HE1 LYS 35 9.218 -13.141 1.240 283 HZ1 LYS 35 HZ1 LYS 35 11.026 -11.027 2.270 284 HZ2 LYS 35 HZ2 LYS 35 10.960 -11.458 0.635 285 HZ3 LYS 35 HZ3 LYS 35 11.431 -12.599 1.790 286 HA PRO 36 HA PRO 36 5.689 -7.847 7.608 287 HB2 PRO 36 HB2 PRO 36 4.778 -5.184 6.817 288 HB3 PRO 36 HB1 PRO 36 5.717 -5.661 8.243 289 HG2 PRO 36 HG2 PRO 36 6.776 -4.212 6.251 290 HG3 PRO 36 HG1 PRO 36 7.720 -5.382 7.196 291 HD2 PRO 36 HD2 PRO 36 6.548 -5.682 4.464 292 HD3 PRO 36 HD1 PRO 36 8.130 -6.207 5.075 293 H ILE 37 HN ILE 37 3.533 -8.161 8.015 294 HA ILE 37 HA ILE 37 1.890 -8.546 5.679 295 HB ILE 37 HB ILE 37 1.879 -10.267 7.376 296 HG12 ILE 37 HG12 ILE 37 -0.289 -9.379 6.088 297 HG13 ILE 37 HG11 ILE 37 -0.338 -10.754 7.189 298 HG21 ILE 37 HG21 ILE 37 2.378 -9.099 9.368 299 HG22 ILE 37 HG22 ILE 37 0.785 -9.819 9.594 300 HG23 ILE 37 HG23 ILE 37 0.933 -8.102 9.229 301 HD11 ILE 37 HD11 ILE 37 -1.291 -9.444 8.911 302 HD12 ILE 37 HD12 ILE 37 -2.176 -9.051 7.438 303 HD13 ILE 37 HD13 ILE 37 -0.952 -7.939 8.054 304 H VAL 38 HN VAL 38 0.135 -7.378 5.098 305 HA VAL 38 HA VAL 38 -0.114 -4.759 6.341 306 HB VAL 38 HB VAL 38 -1.584 -5.772 3.907 307 HG11 VAL 38 HG11 VAL 38 -1.815 -3.408 3.366 308 HG12 VAL 38 HG12 VAL 38 -0.919 -2.976 4.821 309 HG13 VAL 38 HG13 VAL 38 -2.497 -3.752 4.955 310 HG21 VAL 38 HG21 VAL 38 0.153 -4.742 2.552 311 HG22 VAL 38 HG22 VAL 38 0.837 -6.004 3.573 312 HG23 VAL 38 HG23 VAL 38 1.052 -4.308 4.004 313 H GLU 39 HN GLU 39 -1.454 -4.568 8.000 314 HA GLU 39 HA GLU 39 -3.784 -6.305 8.194 315 HB2 GLU 39 HB2 GLU 39 -2.132 -4.803 10.079 316 HB3 GLU 39 HB1 GLU 39 -3.857 -4.594 10.360 317 HG2 GLU 39 HG2 GLU 39 -4.191 -6.914 10.647 318 HG3 GLU 39 HG1 GLU 39 -2.579 -7.284 10.048 319 H ILE 40 HN ILE 40 -5.736 -5.665 7.600 320 HA ILE 40 HA ILE 40 -6.314 -2.798 7.537 321 HB ILE 40 HB ILE 40 -5.636 -3.437 5.260 322 HG12 ILE 40 HG12 ILE 40 -7.618 -1.812 5.883 323 HG13 ILE 40 HG11 ILE 40 -7.238 -2.181 4.206 324 HG21 ILE 40 HG21 ILE 40 -6.134 -5.710 5.069 325 HG22 ILE 40 HG22 ILE 40 -7.246 -4.909 3.949 326 HG23 ILE 40 HG23 ILE 40 -7.825 -5.467 5.520 327 HD11 ILE 40 HD11 ILE 40 -9.617 -2.227 4.534 328 HD12 ILE 40 HD12 ILE 40 -9.453 -3.376 5.859 329 HD13 ILE 40 HD13 ILE 40 -9.049 -3.865 4.212 330 H GLN 41 HN GLN 41 -8.202 -2.309 8.391 331 HA GLN 41 HA GLN 41 -10.231 -4.423 8.636 332 HB2 GLN 41 HB2 GLN 41 -10.759 -3.691 10.881 333 HB3 GLN 41 HB1 GLN 41 -9.051 -4.081 10.797 334 HG2 GLN 41 HG2 GLN 41 -8.666 -1.586 10.456 335 HG3 GLN 41 HG1 GLN 41 -10.343 -1.383 10.953 336 HE21 GLN 41 HE21 GLN 41 -9.928 -0.325 12.838 337 HE22 GLN 41 HE22 GLN 41 -9.154 -1.057 14.200 338 H GLN 42 HN GLN 42 -12.364 -3.745 8.550 339 HA GLN 42 HA GLN 42 -12.797 -0.914 7.903 340 HB2 GLN 42 HB2 GLN 42 -13.873 -1.319 5.916 341 HB3 GLN 42 HB1 GLN 42 -12.683 -2.611 5.883 342 HG2 GLN 42 HG2 GLN 42 -14.426 -4.108 6.862 343 HG3 GLN 42 HG1 GLN 42 -15.588 -2.812 6.609 344 HE21 GLN 42 HE21 GLN 42 -16.210 -2.272 4.524 345 HE22 GLN 42 HE22 GLN 42 -15.881 -3.294 3.175 346 H LYS 43 HN LYS 43 -15.191 -0.417 7.885 347 HA LYS 43 HA LYS 43 -16.803 -2.074 9.656 348 HB2 LYS 43 HB2 LYS 43 -15.345 -0.314 10.959 349 HB3 LYS 43 HB1 LYS 43 -16.530 0.833 10.353 350 HG2 LYS 43 HG2 LYS 43 -18.316 -0.520 11.422 351 HG3 LYS 43 HG1 LYS 43 -17.069 -1.563 12.099 352 HD2 LYS 43 HD2 LYS 43 -17.329 1.397 12.614 353 HD3 LYS 43 HD1 LYS 43 -17.855 0.120 13.709 354 HE2 LYS 43 HE2 LYS 43 -15.018 0.468 12.762 355 HE3 LYS 43 HE1 LYS 43 -15.636 1.132 14.270 356 HZ1 LYS 43 HZ1 LYS 43 -14.512 -0.964 14.642 357 HZ2 LYS 43 HZ2 LYS 43 -15.544 -1.752 13.559 358 HZ3 LYS 43 HZ3 LYS 43 -16.159 -1.118 15.002 359 H GLY 44 HN GLY 44 -17.178 -1.776 7.057 360 HA2 GLY 44 HA2 GLY 44 -19.363 -1.464 6.035 361 HA3 GLY 44 HA1 GLY 44 -19.455 0.084 6.868 362 H ASP 45 HN ASP 45 -18.861 1.840 5.788 363 HA ASP 45 HA ASP 45 -17.644 1.506 3.152 364 HB2 ASP 45 HB2 ASP 45 -18.864 3.938 4.483 365 HB3 ASP 45 HB1 ASP 45 -18.169 3.936 2.872 366 H ASP 46 HN ASP 46 -16.913 2.632 6.338 367 HA ASP 46 HA ASP 46 -14.555 4.090 5.508 368 HB2 ASP 46 HB2 ASP 46 -14.347 4.836 7.705 369 HB3 ASP 46 HB1 ASP 46 -16.084 4.707 7.496 370 H PHE 47 HN PHE 47 -12.503 3.447 5.628 371 HA PHE 47 HA PHE 47 -11.975 0.684 6.540 372 HB2 PHE 47 HB2 PHE 47 -10.949 2.163 4.120 373 HB3 PHE 47 HB1 PHE 47 -10.109 0.767 4.775 374 HD1 PHE 47 HD1 PHE 47 -13.754 1.358 4.341 375 HD2 PHE 47 HD2 PHE 47 -10.323 -0.860 3.187 376 HE1 PHE 47 HE1 PHE 47 -15.181 -0.123 2.976 377 HE2 PHE 47 HE2 PHE 47 -11.725 -2.346 1.824 378 HZ PHE 47 HZ PHE 47 -14.161 -1.980 1.714 379 H VAL 48 HN VAL 48 -9.869 0.285 7.350 380 HA VAL 48 HA VAL 48 -8.245 2.634 8.008 381 HB VAL 48 HB VAL 48 -8.944 0.439 9.969 382 HG11 VAL 48 HG11 VAL 48 -7.212 2.878 10.337 383 HG12 VAL 48 HG12 VAL 48 -6.627 1.224 10.163 384 HG13 VAL 48 HG13 VAL 48 -7.597 1.674 11.567 385 HG21 VAL 48 HG21 VAL 48 -9.929 2.318 11.297 386 HG22 VAL 48 HG22 VAL 48 -10.797 1.941 9.810 387 HG23 VAL 48 HG23 VAL 48 -9.735 3.344 9.877 388 H VAL 49 HN VAL 49 -6.515 2.221 6.805 389 HA VAL 49 HA VAL 49 -5.509 -0.525 6.589 390 HB VAL 49 HB VAL 49 -4.417 1.901 5.166 391 HG11 VAL 49 HG11 VAL 49 -3.600 0.260 3.550 392 HG12 VAL 49 HG12 VAL 49 -4.309 -1.044 4.503 393 HG13 VAL 49 HG13 VAL 49 -2.984 -0.086 5.166 394 HG21 VAL 49 HG21 VAL 49 -5.834 1.164 3.234 395 HG22 VAL 49 HG22 VAL 49 -6.734 1.831 4.596 396 HG23 VAL 49 HG23 VAL 49 -6.680 0.087 4.346 397 H THR 50 HN THR 50 -3.725 -1.207 7.597 398 HA THR 50 HA THR 50 -2.076 0.810 8.979 399 HB THR 50 HB THR 50 -2.749 -1.964 9.979 400 HG1 THR 50 HG1 THR 50 -4.401 -0.099 9.918 401 HG21 THR 50 HG21 THR 50 -0.826 -1.547 11.116 402 HG22 THR 50 HG22 THR 50 -1.918 -0.616 12.141 403 HG23 THR 50 HG23 THR 50 -0.958 0.199 10.911 404 H SER 51 HN SER 51 0.014 0.782 8.465 405 HA SER 51 HA SER 51 1.102 -1.622 7.157 406 HB2 SER 51 HB2 SER 51 1.975 1.263 6.954 407 HB3 SER 51 HB1 SER 51 2.781 -0.090 6.160 408 HG SER 51 HG SER 51 0.028 0.295 5.767 409 H LYS 52 HN LYS 52 2.948 -2.554 7.955 410 HA LYS 52 HA LYS 52 3.877 -1.556 10.554 411 HB2 LYS 52 HB2 LYS 52 4.214 -4.304 9.346 412 HB3 LYS 52 HB1 LYS 52 4.640 -3.825 10.979 413 HG2 LYS 52 HG2 LYS 52 2.296 -3.414 11.490 414 HG3 LYS 52 HG1 LYS 52 1.854 -3.864 9.840 415 HD2 LYS 52 HD2 LYS 52 2.787 -6.108 10.231 416 HD3 LYS 52 HD1 LYS 52 3.163 -5.649 11.893 417 HE2 LYS 52 HE2 LYS 52 0.743 -5.178 12.232 418 HE3 LYS 52 HE1 LYS 52 0.438 -5.830 10.628 419 HZ1 LYS 52 HZ1 LYS 52 1.633 -7.319 12.896 420 HZ2 LYS 52 HZ2 LYS 52 1.358 -7.950 11.355 421 HZ3 LYS 52 HZ3 LYS 52 0.047 -7.489 12.327 422 H THR 53 HN THR 53 5.980 -1.083 10.926 423 HA THR 53 HA THR 53 8.000 -1.629 8.857 424 HB THR 53 HB THR 53 8.708 0.622 8.663 425 HG1 THR 53 HG1 THR 53 6.949 1.848 10.369 426 HG21 THR 53 HG21 THR 53 6.749 1.925 7.991 427 HG22 THR 53 HG22 THR 53 5.695 0.776 8.818 428 HG23 THR 53 HG23 THR 53 6.635 0.263 7.413 429 HA PRO 54 HA PRO 54 10.604 -2.168 12.418 430 HB2 PRO 54 HB2 PRO 54 13.037 -1.330 11.560 431 HB3 PRO 54 HB1 PRO 54 12.274 -2.798 10.929 432 HG2 PRO 54 HG2 PRO 54 12.539 -0.127 9.703 433 HG3 PRO 54 HG1 PRO 54 12.542 -1.727 8.944 434 HD2 PRO 54 HD2 PRO 54 10.411 0.039 9.003 435 HD3 PRO 54 HD1 PRO 54 10.310 -1.693 8.653 436 H ARG 55 HN ARG 55 9.521 0.756 11.674 437 HA ARG 55 HA ARG 55 11.063 2.063 13.803 438 HB2 ARG 55 HB2 ARG 55 10.329 3.127 11.092 439 HB3 ARG 55 HB1 ARG 55 10.733 4.199 12.424 440 HG2 ARG 55 HG2 ARG 55 12.933 3.682 12.358 441 HG3 ARG 55 HG1 ARG 55 12.640 2.020 11.847 442 HD2 ARG 55 HD2 ARG 55 13.716 3.261 10.066 443 HD3 ARG 55 HD1 ARG 55 12.073 2.827 9.595 444 HE ARG 55 HE ARG 55 11.512 5.197 10.334 445 HH11 ARG 55 HH11 ARG 55 14.624 4.287 9.006 446 HH12 ARG 55 HH12 ARG 55 14.973 5.876 8.411 447 HH21 ARG 55 HH21 ARG 55 11.974 7.293 9.516 448 HH22 ARG 55 HH22 ARG 55 13.463 7.575 8.675 449 H GLN 56 HN GLN 56 8.197 2.686 11.752 450 HA GLN 56 HA GLN 56 6.546 2.919 14.130 451 HB2 GLN 56 HB2 GLN 56 7.498 5.154 13.915 452 HB3 GLN 56 HB1 GLN 56 6.983 5.235 12.238 453 HG2 GLN 56 HG2 GLN 56 4.609 4.970 13.132 454 HG3 GLN 56 HG1 GLN 56 5.302 5.317 14.716 455 HE21 GLN 56 HE21 GLN 56 4.215 7.253 14.946 456 HE22 GLN 56 HE22 GLN 56 4.599 8.656 14.011 457 H THR 57 HN THR 57 4.531 2.244 13.752 458 HA THR 57 HA THR 57 3.797 1.490 11.052 459 HB THR 57 HB THR 57 3.279 -0.201 12.622 460 HG1 THR 57 HG1 THR 57 1.529 0.299 11.163 461 HG21 THR 57 HG21 THR 57 1.892 0.198 14.644 462 HG22 THR 57 HG22 THR 57 1.978 1.929 14.317 463 HG23 THR 57 HG23 THR 57 3.447 1.028 14.687 464 H VAL 58 HN VAL 58 2.522 2.673 9.759 465 HA VAL 58 HA VAL 58 1.203 5.021 10.937 466 HB VAL 58 HB VAL 58 1.084 5.972 8.742 467 HG11 VAL 58 HG11 VAL 58 3.482 6.039 8.117 468 HG12 VAL 58 HG12 VAL 58 3.777 4.727 9.261 469 HG13 VAL 58 HG13 VAL 58 3.192 6.288 9.842 470 HG21 VAL 58 HG21 VAL 58 1.958 3.265 7.796 471 HG22 VAL 58 HG22 VAL 58 2.148 4.709 6.800 472 HG23 VAL 58 HG23 VAL 58 0.539 4.194 7.317 473 H THR 59 HN THR 59 -0.956 5.542 10.451 474 HA THR 59 HA THR 59 -2.591 3.268 9.550 475 HB THR 59 HB THR 59 -3.536 5.208 11.647 476 HG1 THR 59 HG1 THR 59 -1.691 4.245 12.517 477 HG21 THR 59 HG21 THR 59 -4.313 2.331 11.237 478 HG22 THR 59 HG22 THR 59 -5.079 3.648 10.350 479 HG23 THR 59 HG23 THR 59 -5.186 3.597 12.109 480 H ASN 60 HN ASN 60 -3.632 3.742 7.771 481 HA ASN 60 HA ASN 60 -4.341 6.566 7.187 482 HB2 ASN 60 HB2 ASN 60 -4.025 4.203 5.307 483 HB3 ASN 60 HB1 ASN 60 -4.465 5.837 4.829 484 HD21 ASN 60 HD21 ASN 60 -2.621 7.025 6.783 485 HD22 ASN 60 HD22 ASN 60 -1.042 6.827 6.106 486 H SER 61 HN SER 61 -6.544 7.052 6.993 487 HA SER 61 HA SER 61 -8.390 4.756 6.859 488 HB2 SER 61 HB2 SER 61 -9.022 7.181 8.520 489 HB3 SER 61 HB1 SER 61 -9.743 5.575 8.591 490 HG SER 61 HG SER 61 -8.379 5.297 10.174 491 H PHE 62 HN PHE 62 -10.361 5.114 5.753 492 HA PHE 62 HA PHE 62 -10.970 7.720 4.676 493 HB2 PHE 62 HB2 PHE 62 -10.893 6.877 2.289 494 HB3 PHE 62 HB1 PHE 62 -9.323 7.131 3.041 495 HD1 PHE 62 HD2 PHE 62 -11.767 4.573 1.993 496 HD2 PHE 62 HD1 PHE 62 -7.810 5.332 3.370 497 HE1 PHE 62 HE2 PHE 62 -11.129 2.269 1.422 498 HE2 PHE 62 HE1 PHE 62 -7.166 3.032 2.792 499 HZ PHE 62 HZ PHE 62 -8.823 1.497 1.823 500 H THR 63 HN THR 63 -12.798 7.297 2.879 501 HA THR 63 HA THR 63 -14.573 5.151 3.821 502 HB THR 63 HB THR 63 -15.559 7.940 3.188 503 HG1 THR 63 HG1 THR 63 -14.247 7.891 5.112 504 HG21 THR 63 HG21 THR 63 -16.871 5.592 4.560 505 HG22 THR 63 HG22 THR 63 -17.187 6.125 2.909 506 HG23 THR 63 HG23 THR 63 -17.610 7.166 4.268 507 H LEU 64 HN LEU 64 -15.651 4.112 2.222 508 HA LEU 64 HA LEU 64 -14.724 4.210 -0.396 509 HB2 LEU 64 HB2 LEU 64 -17.328 3.135 0.675 510 HB3 LEU 64 HB1 LEU 64 -16.739 2.841 -0.947 511 HG LEU 64 HG LEU 64 -15.494 1.900 1.630 512 HD11 LEU 64 HD11 LEU 64 -17.387 0.579 0.931 513 HD12 LEU 64 HD12 LEU 64 -15.909 -0.325 0.608 514 HD13 LEU 64 HD13 LEU 64 -16.756 0.477 -0.712 515 HD21 LEU 64 HD21 LEU 64 -13.701 2.531 0.173 516 HD22 LEU 64 HD22 LEU 64 -14.464 1.724 -1.195 517 HD23 LEU 64 HD23 LEU 64 -13.842 0.776 0.156 518 H GLY 65 HN GLY 65 -14.885 5.832 -1.768 519 HA2 GLY 65 HA2 GLY 65 -16.135 7.019 -3.394 520 HA3 GLY 65 HA1 GLY 65 -17.558 6.871 -2.376 521 H LYS 66 HN LYS 66 -14.855 7.789 -0.596 522 HA LYS 66 HA LYS 66 -15.479 10.639 -0.920 523 HB2 LYS 66 HB2 LYS 66 -15.570 8.980 1.545 524 HB3 LYS 66 HB1 LYS 66 -14.994 10.633 1.687 525 HG2 LYS 66 HG2 LYS 66 -17.060 11.499 0.866 526 HG3 LYS 66 HG1 LYS 66 -17.622 9.886 0.432 527 HD2 LYS 66 HD2 LYS 66 -18.709 10.486 2.454 528 HD3 LYS 66 HD1 LYS 66 -17.485 9.282 2.859 529 HE2 LYS 66 HE2 LYS 66 -17.379 10.986 4.515 530 HE3 LYS 66 HE1 LYS 66 -15.966 11.176 3.480 531 HZ1 LYS 66 HZ1 LYS 66 -17.198 12.920 2.274 532 HZ2 LYS 66 HZ2 LYS 66 -16.921 13.315 3.892 533 HZ3 LYS 66 HZ3 LYS 66 -18.451 12.794 3.399 534 H GLU 67 HN GLU 67 -13.804 12.034 -0.665 535 HA GLU 67 HA GLU 67 -11.149 10.902 -0.852 536 HB2 GLU 67 HB2 GLU 67 -12.077 12.834 -2.263 537 HB3 GLU 67 HB1 GLU 67 -11.886 13.823 -0.820 538 HG2 GLU 67 HG2 GLU 67 -9.487 13.279 -0.800 539 HG3 GLU 67 HG1 GLU 67 -9.702 12.360 -2.290 540 H ALA 68 HN ALA 68 -9.948 10.543 0.893 541 HA ALA 68 HA ALA 68 -10.402 12.265 3.239 542 HB1 ALA 68 HB1 ALA 68 -9.844 10.327 4.648 543 HB2 ALA 68 HB2 ALA 68 -9.743 9.325 3.199 544 HB3 ALA 68 HB3 ALA 68 -11.282 10.049 3.665 545 H ASP 69 HN ASP 69 -8.686 13.061 4.257 546 HA ASP 69 HA ASP 69 -6.158 13.032 2.922 547 HB2 ASP 69 HB2 ASP 69 -6.614 15.102 3.872 548 HB3 ASP 69 HB1 ASP 69 -7.287 14.403 5.336 549 H ILE 70 HN ILE 70 -4.618 11.653 3.202 550 HA ILE 70 HA ILE 70 -4.503 10.106 5.700 551 HB ILE 70 HB ILE 70 -3.559 8.209 4.289 552 HG12 ILE 70 HG12 ILE 70 -4.630 8.268 1.925 553 HG13 ILE 70 HG11 ILE 70 -4.563 10.019 2.117 554 HG21 ILE 70 HG21 ILE 70 -6.376 9.107 4.398 555 HG22 ILE 70 HG22 ILE 70 -5.618 7.658 5.061 556 HG23 ILE 70 HG23 ILE 70 -5.996 7.747 3.339 557 HD11 ILE 70 HD11 ILE 70 -2.164 9.921 2.378 558 HD12 ILE 70 HD12 ILE 70 -2.629 9.079 0.898 559 HD13 ILE 70 HD13 ILE 70 -2.201 8.157 2.343 560 H THR 71 HN THR 71 -2.245 9.141 6.059 561 HA THR 71 HA THR 71 -0.258 11.042 4.973 562 HB THR 71 HB THR 71 -0.182 10.090 7.822 563 HG1 THR 71 HG1 THR 71 -1.976 11.310 7.876 564 HG21 THR 71 HG21 THR 71 1.058 12.540 6.563 565 HG22 THR 71 HG22 THR 71 1.893 10.991 6.662 566 HG23 THR 71 HG23 THR 71 1.417 11.833 8.140 567 H THR 72 HN THR 72 1.489 10.189 4.156 568 HA THR 72 HA THR 72 1.958 7.334 4.388 569 HB THR 72 HB THR 72 2.116 8.237 2.159 570 HG1 THR 72 HG1 THR 72 4.383 7.727 1.709 571 HG21 THR 72 HG21 THR 72 2.567 10.553 2.691 572 HG22 THR 72 HG22 THR 72 3.779 9.947 1.561 573 HG23 THR 72 HG23 THR 72 4.179 10.131 3.268 574 H MET 73 HN MET 73 4.068 6.472 4.971 575 HA MET 73 HA MET 73 5.162 7.659 7.298 576 HB2 MET 73 HB2 MET 73 6.975 5.874 6.961 577 HB3 MET 73 HB1 MET 73 5.326 5.332 7.244 578 HG2 MET 73 HG2 MET 73 6.303 5.675 4.451 579 HG3 MET 73 HG1 MET 73 6.769 4.247 5.371 580 HE1 MET 73 HE1 MET 73 3.555 2.322 5.940 581 HE2 MET 73 HE2 MET 73 4.376 3.379 7.089 582 HE3 MET 73 HE3 MET 73 5.318 2.352 6.007 583 H ASP 74 HN ASP 74 5.737 8.269 4.023 584 HA ASP 74 HA ASP 74 8.497 9.017 4.281 585 HB2 ASP 74 HB2 ASP 74 8.455 8.923 2.051 586 HB3 ASP 74 HB1 ASP 74 6.751 8.515 2.139 587 H GLY 75 HN GLY 75 5.586 10.409 5.183 588 HA2 GLY 75 HA2 GLY 75 5.332 12.335 6.454 589 HA3 GLY 75 HA1 GLY 75 6.938 12.843 5.975 590 H LYS 76 HN LYS 76 4.386 11.911 3.760 591 HA LYS 76 HA LYS 76 4.251 14.710 2.872 592 HB2 LYS 76 HB2 LYS 76 4.409 12.160 1.350 593 HB3 LYS 76 HB1 LYS 76 3.427 13.450 0.671 594 HG2 LYS 76 HG2 LYS 76 5.595 14.880 1.196 595 HG3 LYS 76 HG1 LYS 76 6.363 13.295 1.066 596 HD2 LYS 76 HD2 LYS 76 4.461 14.263 -1.033 597 HD3 LYS 76 HD1 LYS 76 6.153 14.764 -1.047 598 HE2 LYS 76 HE2 LYS 76 5.169 11.910 -1.067 599 HE3 LYS 76 HE1 LYS 76 5.757 12.800 -2.470 600 HZ1 LYS 76 HZ1 LYS 76 7.561 11.534 -1.729 601 HZ2 LYS 76 HZ2 LYS 76 7.283 11.901 -0.097 602 HZ3 LYS 76 HZ3 LYS 76 7.874 13.091 -1.147 603 H LYS 77 HN LYS 77 2.258 15.559 2.338 604 HA LYS 77 HA LYS 77 0.015 14.185 3.602 605 HB2 LYS 77 HB2 LYS 77 0.454 17.026 2.727 606 HB3 LYS 77 HB1 LYS 77 -1.124 16.436 3.225 607 HG2 LYS 77 HG2 LYS 77 1.156 15.959 5.061 608 HG3 LYS 77 HG1 LYS 77 0.561 17.612 4.909 609 HD2 LYS 77 HD2 LYS 77 -0.588 16.576 6.735 610 HD3 LYS 77 HD1 LYS 77 -1.732 16.753 5.404 611 HE2 LYS 77 HE2 LYS 77 -1.391 14.405 4.804 612 HE3 LYS 77 HE1 LYS 77 -0.234 14.233 6.118 613 HZ1 LYS 77 HZ1 LYS 77 -2.202 15.034 7.554 614 HZ2 LYS 77 HZ2 LYS 77 -2.150 13.422 7.042 615 HZ3 LYS 77 HZ3 LYS 77 -3.157 14.536 6.244 616 H LEU 78 HN LEU 78 -1.097 12.897 2.377 617 HA LEU 78 HA LEU 78 -1.779 13.768 -0.350 618 HB2 LEU 78 HB2 LEU 78 -1.405 10.899 0.507 619 HB3 LEU 78 HB1 LEU 78 -1.668 11.500 -1.118 620 HG LEU 78 HG LEU 78 0.796 12.135 0.499 621 HD11 LEU 78 HD11 LEU 78 0.232 9.913 -1.437 622 HD12 LEU 78 HD12 LEU 78 0.878 9.806 0.198 623 HD13 LEU 78 HD13 LEU 78 1.866 10.479 -1.098 624 HD21 LEU 78 HD21 LEU 78 0.153 12.411 -2.434 625 HD22 LEU 78 HD22 LEU 78 1.713 12.756 -1.687 626 HD23 LEU 78 HD23 LEU 78 0.302 13.727 -1.270 627 H LYS 79 HN LYS 79 -3.822 12.916 -1.135 628 HA LYS 79 HA LYS 79 -5.687 12.017 0.937 629 HB2 LYS 79 HB2 LYS 79 -7.373 13.676 -0.079 630 HB3 LYS 79 HB1 LYS 79 -6.164 14.315 1.029 631 HG2 LYS 79 HG2 LYS 79 -4.985 15.363 -0.655 632 HG3 LYS 79 HG1 LYS 79 -5.650 14.314 -1.910 633 HD2 LYS 79 HD2 LYS 79 -7.920 15.435 -1.140 634 HD3 LYS 79 HD1 LYS 79 -6.825 16.720 -0.621 635 HE2 LYS 79 HE2 LYS 79 -6.037 17.080 -2.796 636 HE3 LYS 79 HE1 LYS 79 -6.674 15.540 -3.372 637 HZ1 LYS 79 HZ1 LYS 79 -8.075 17.261 -4.166 638 HZ2 LYS 79 HZ2 LYS 79 -8.229 17.954 -2.632 639 HZ3 LYS 79 HZ3 LYS 79 -8.930 16.445 -2.950 640 H CYS 80 HN CYS 80 -6.774 10.284 0.189 641 HA CYS 80 HA CYS 80 -7.058 10.122 -2.737 642 HB2 CYS 80 HB2 CYS 80 -5.496 8.422 -1.863 643 HB3 CYS 80 HB1 CYS 80 -6.781 7.777 -0.843 644 H THR 81 HN THR 81 -8.914 9.477 -3.622 645 HA THR 81 HA THR 81 -11.285 9.445 -1.906 646 HB THR 81 HB THR 81 -11.386 11.134 -3.599 647 HG1 THR 81 HG1 THR 81 -12.919 8.894 -4.482 648 HG21 THR 81 HG21 THR 81 -10.178 9.030 -5.242 649 HG22 THR 81 HG22 THR 81 -9.968 10.783 -5.301 650 HG23 THR 81 HG23 THR 81 -11.373 10.037 -6.064 651 H VAL 82 HN VAL 82 -10.123 7.234 -1.555 652 HA VAL 82 HA VAL 82 -10.315 5.133 -3.362 653 HB VAL 82 HB VAL 82 -10.778 4.733 -0.419 654 HG11 VAL 82 HG11 VAL 82 -9.498 2.675 -0.818 655 HG12 VAL 82 HG12 VAL 82 -9.365 3.105 -2.524 656 HG13 VAL 82 HG13 VAL 82 -10.946 2.767 -1.822 657 HG21 VAL 82 HG21 VAL 82 -8.285 4.669 -0.186 658 HG22 VAL 82 HG22 VAL 82 -8.949 6.272 -0.491 659 HG23 VAL 82 HG23 VAL 82 -8.176 5.377 -1.798 660 H HIS 83 HN HIS 83 -11.888 3.835 -4.034 661 HA HIS 83 HA HIS 83 -14.425 3.675 -2.643 662 HB2 HIS 83 HB2 HIS 83 -15.758 4.280 -4.635 663 HB3 HIS 83 HB1 HIS 83 -14.769 5.626 -4.086 664 HD1 HIS 83 HD1 HIS 83 -15.429 3.483 -7.000 665 HD2 HIS 83 HD2 HIS 83 -12.527 6.203 -5.797 666 HE1 HIS 83 HE1 HIS 83 -14.135 4.054 -9.080 667 HE2 HIS 83 HE2 HIS 83 -12.466 5.795 -8.347 668 H LEU 84 HN LEU 84 -15.641 1.830 -3.264 669 HA LEU 84 HA LEU 84 -13.977 -0.190 -4.567 670 HB2 LEU 84 HB2 LEU 84 -15.075 -0.482 -2.273 671 HB3 LEU 84 HB1 LEU 84 -16.591 -0.643 -3.143 672 HG LEU 84 HG LEU 84 -14.395 -2.413 -4.035 673 HD11 LEU 84 HD11 LEU 84 -14.015 -2.569 -1.689 674 HD12 LEU 84 HD12 LEU 84 -14.903 -4.009 -2.191 675 HD13 LEU 84 HD13 LEU 84 -15.742 -2.698 -1.363 676 HD21 LEU 84 HD21 LEU 84 -16.571 -2.571 -5.058 677 HD22 LEU 84 HD22 LEU 84 -17.333 -2.778 -3.481 678 HD23 LEU 84 HD23 LEU 84 -16.261 -4.029 -4.113 679 H ALA 85 HN ALA 85 -14.281 -0.618 -6.613 680 HA ALA 85 HA ALA 85 -16.970 -0.435 -7.792 681 HB1 ALA 85 HB1 ALA 85 -15.361 1.585 -8.268 682 HB2 ALA 85 HB2 ALA 85 -16.257 0.846 -9.595 683 HB3 ALA 85 HB3 ALA 85 -14.558 0.432 -9.345 684 H ASN 86 HN ASN 86 -17.354 -2.046 -9.308 685 HA ASN 86 HA ASN 86 -16.980 -3.911 -10.591 686 HB2 ASN 86 HB2 ASN 86 -15.362 -2.647 -11.752 687 HB3 ASN 86 HB1 ASN 86 -14.269 -2.633 -10.401 688 HD21 ASN 86 HD21 ASN 86 -12.524 -3.402 -11.118 689 HD22 ASN 86 HD22 ASN 86 -12.315 -4.927 -11.921 690 H GLY 87 HN GLY 87 -16.383 -3.629 -7.508 691 HA2 GLY 87 HA2 GLY 87 -16.319 -5.322 -5.898 692 HA3 GLY 87 HA1 GLY 87 -15.731 -6.438 -7.123 693 H LYS 88 HN LYS 88 -13.977 -3.714 -7.510 694 HA LYS 88 HA LYS 88 -11.857 -4.678 -5.698 695 HB2 LYS 88 HB2 LYS 88 -11.708 -3.525 -8.476 696 HB3 LYS 88 HB1 LYS 88 -10.304 -3.570 -7.422 697 HG2 LYS 88 HG2 LYS 88 -10.067 -5.489 -8.687 698 HG3 LYS 88 HG1 LYS 88 -10.821 -6.088 -7.210 699 HD2 LYS 88 HD2 LYS 88 -13.042 -5.691 -8.504 700 HD3 LYS 88 HD1 LYS 88 -12.009 -5.724 -9.933 701 HE2 LYS 88 HE2 LYS 88 -11.323 -7.904 -8.228 702 HE3 LYS 88 HE1 LYS 88 -13.067 -7.903 -8.484 703 HZ1 LYS 88 HZ1 LYS 88 -11.876 -9.198 -10.163 704 HZ2 LYS 88 HZ2 LYS 88 -11.014 -7.819 -10.643 705 HZ3 LYS 88 HZ3 LYS 88 -12.696 -7.895 -10.862 706 H LEU 89 HN LEU 89 -10.146 -2.778 -5.405 707 HA LEU 89 HA LEU 89 -11.723 -0.466 -4.514 708 HB2 LEU 89 HB2 LEU 89 -10.165 -2.066 -3.019 709 HB3 LEU 89 HB1 LEU 89 -8.970 -0.887 -3.516 710 HG LEU 89 HG LEU 89 -10.246 0.903 -2.511 711 HD11 LEU 89 HD11 LEU 89 -12.281 -1.245 -1.989 712 HD12 LEU 89 HD12 LEU 89 -12.491 0.276 -2.858 713 HD13 LEU 89 HD13 LEU 89 -12.256 0.285 -1.113 714 HD21 LEU 89 HD21 LEU 89 -8.691 -0.410 -1.105 715 HD22 LEU 89 HD22 LEU 89 -10.056 -1.408 -0.590 716 HD23 LEU 89 HD23 LEU 89 -10.021 0.309 -0.196 717 H VAL 90 HN VAL 90 -11.408 1.441 -5.420 718 HA VAL 90 HA VAL 90 -9.046 1.758 -7.156 719 HB VAL 90 HB VAL 90 -11.664 3.253 -7.322 720 HG11 VAL 90 HG11 VAL 90 -9.356 4.196 -8.186 721 HG12 VAL 90 HG12 VAL 90 -10.847 4.408 -9.101 722 HG13 VAL 90 HG13 VAL 90 -9.709 3.141 -9.555 723 HG21 VAL 90 HG21 VAL 90 -11.526 0.689 -7.918 724 HG22 VAL 90 HG22 VAL 90 -10.810 1.302 -9.408 725 HG23 VAL 90 HG23 VAL 90 -12.430 1.815 -8.927 726 H CYS 91 HN CYS 91 -7.547 3.075 -6.454 727 HA CYS 91 HA CYS 91 -8.307 5.456 -4.897 728 HB2 CYS 91 HB2 CYS 91 -7.316 3.870 -3.328 729 HB3 CYS 91 HB1 CYS 91 -5.941 3.630 -4.392 730 H LYS 92 HN LYS 92 -8.280 6.497 -6.957 731 HA LYS 92 HA LYS 92 -5.632 6.725 -8.184 732 HB2 LYS 92 HB2 LYS 92 -7.446 5.983 -9.667 733 HB3 LYS 92 HB1 LYS 92 -8.362 7.428 -9.276 734 HG2 LYS 92 HG2 LYS 92 -6.735 8.822 -10.357 735 HG3 LYS 92 HG1 LYS 92 -5.687 7.434 -10.640 736 HD2 LYS 92 HD2 LYS 92 -6.826 7.880 -12.687 737 HD3 LYS 92 HD1 LYS 92 -7.546 6.422 -11.999 738 HE2 LYS 92 HE2 LYS 92 -9.396 7.740 -11.118 739 HE3 LYS 92 HE1 LYS 92 -8.669 9.211 -11.764 740 HZ1 LYS 92 HZ1 LYS 92 -9.535 6.897 -13.409 741 HZ2 LYS 92 HZ2 LYS 92 -8.943 8.375 -13.982 742 HZ3 LYS 92 HZ3 LYS 92 -10.435 8.309 -13.187 743 H SER 93 HN SER 93 -4.714 8.674 -8.623 744 HA SER 93 HA SER 93 -5.828 11.001 -7.217 745 HB2 SER 93 HB2 SER 93 -2.923 10.667 -7.936 746 HB3 SER 93 HB1 SER 93 -3.639 11.645 -6.661 747 HG SER 93 HG SER 93 -4.298 9.106 -6.233 748 H GLU 94 HN GLU 94 -4.276 12.983 -8.353 749 HA GLU 94 HA GLU 94 -5.477 13.173 -10.966 750 HB2 GLU 94 HB2 GLU 94 -3.537 15.127 -9.741 751 HB3 GLU 94 HB1 GLU 94 -4.762 15.440 -10.959 752 HG2 GLU 94 HG2 GLU 94 -5.910 16.261 -9.208 753 HG3 GLU 94 HG1 GLU 94 -6.329 14.569 -8.953 754 H LYS 95 HN LYS 95 -2.278 12.575 -9.674 755 HA LYS 95 HA LYS 95 -1.223 12.502 -12.430 756 HB2 LYS 95 HB2 LYS 95 -0.203 14.125 -10.756 757 HB3 LYS 95 HB1 LYS 95 0.421 12.714 -9.912 758 HG2 LYS 95 HG2 LYS 95 1.642 12.068 -11.929 759 HG3 LYS 95 HG1 LYS 95 1.042 13.507 -12.749 760 HD2 LYS 95 HD2 LYS 95 2.148 14.903 -11.035 761 HD3 LYS 95 HD1 LYS 95 2.791 13.438 -10.291 762 HE2 LYS 95 HE2 LYS 95 4.037 12.924 -12.302 763 HE3 LYS 95 HE1 LYS 95 3.332 14.313 -13.124 764 HZ1 LYS 95 HZ1 LYS 95 5.224 14.335 -10.846 765 HZ2 LYS 95 HZ2 LYS 95 4.385 15.710 -11.353 766 HZ3 LYS 95 HZ3 LYS 95 5.471 14.951 -12.402 767 H PHE 96 HN PHE 96 -1.867 10.587 -9.627 768 HA PHE 96 HA PHE 96 -0.436 8.347 -10.882 769 HB2 PHE 96 HB2 PHE 96 -0.606 8.555 -7.894 770 HB3 PHE 96 HB1 PHE 96 0.514 7.621 -8.876 771 HD1 PHE 96 HD2 PHE 96 2.457 8.717 -9.921 772 HD2 PHE 96 HD1 PHE 96 -0.183 10.835 -7.339 773 HE1 PHE 96 HE2 PHE 96 4.133 10.493 -9.664 774 HE2 PHE 96 HE1 PHE 96 1.487 12.615 -7.078 775 HZ PHE 96 HZ PHE 96 3.651 12.450 -8.242 776 H SER 97 HN SER 97 -1.148 6.239 -9.576 777 HA SER 97 HA SER 97 -3.871 6.261 -8.704 778 HB2 SER 97 HB2 SER 97 -4.149 6.341 -11.175 779 HB3 SER 97 HB1 SER 97 -3.237 4.838 -11.301 780 HG SER 97 HG SER 97 -5.158 3.978 -11.104 781 H HIS 98 HN HIS 98 -4.239 4.639 -7.359 782 HA HIS 98 HA HIS 98 -2.217 2.515 -7.194 783 HB2 HIS 98 HB2 HIS 98 -2.517 4.005 -5.209 784 HB3 HIS 98 HB1 HIS 98 -4.178 3.443 -5.086 785 HD2 HIS 98 HD2 HIS 98 -3.746 0.233 -5.246 786 HE1 HIS 98 HE1 HIS 98 -0.977 0.860 -2.112 787 HE2 HIS 98 HE2 HIS 98 -2.286 -0.875 -3.401 788 H GLU 99 HN GLU 99 -2.805 0.528 -7.718 789 HA GLU 99 HA GLU 99 -5.654 -0.000 -8.185 790 HB2 GLU 99 HB2 GLU 99 -4.236 -0.445 -10.087 791 HB3 GLU 99 HB1 GLU 99 -3.166 -1.446 -9.114 792 HG2 GLU 99 HG2 GLU 99 -4.481 -2.945 -10.324 793 HG3 GLU 99 HG1 GLU 99 -5.163 -2.925 -8.695 794 H GLN 100 HN GLN 100 -6.747 -1.642 -7.195 795 HA GLN 100 HA GLN 100 -5.326 -3.410 -5.350 796 HB2 GLN 100 HB2 GLN 100 -7.050 -1.185 -4.557 797 HB3 GLN 100 HB1 GLN 100 -7.574 -2.725 -3.890 798 HG2 GLN 100 HG2 GLN 100 -4.765 -1.672 -3.659 799 HG3 GLN 100 HG1 GLN 100 -6.014 -1.409 -2.443 800 HE21 GLN 100 HE21 GLN 100 -3.463 -2.806 -2.240 801 HE22 GLN 100 HE22 GLN 100 -3.848 -4.421 -1.746 802 H GLU 101 HN GLU 101 -5.878 -5.250 -6.470 803 HA GLU 101 HA GLU 101 -8.759 -5.750 -6.820 804 HB2 GLU 101 HB2 GLU 101 -7.746 -5.644 -8.993 805 HB3 GLU 101 HB1 GLU 101 -6.425 -6.689 -8.490 806 HG2 GLU 101 HG2 GLU 101 -7.755 -8.596 -8.509 807 HG3 GLU 101 HG1 GLU 101 -9.252 -7.667 -8.430 808 H VAL 102 HN VAL 102 -9.594 -7.364 -5.671 809 HA VAL 102 HA VAL 102 -7.746 -9.254 -4.394 810 HB VAL 102 HB VAL 102 -10.582 -8.521 -3.642 811 HG11 VAL 102 HG11 VAL 102 -8.678 -10.414 -2.261 812 HG12 VAL 102 HG12 VAL 102 -10.082 -10.901 -3.211 813 HG13 VAL 102 HG13 VAL 102 -10.301 -9.980 -1.723 814 HG21 VAL 102 HG21 VAL 102 -7.926 -7.987 -2.322 815 HG22 VAL 102 HG22 VAL 102 -9.497 -7.661 -1.591 816 HG23 VAL 102 HG23 VAL 102 -9.005 -6.794 -3.048 817 H LYS 103 HN LYS 103 -7.668 -11.248 -5.116 818 HA LYS 103 HA LYS 103 -9.958 -12.301 -6.639 819 HB2 LYS 103 HB2 LYS 103 -7.053 -12.261 -7.228 820 HB3 LYS 103 HB1 LYS 103 -7.889 -13.768 -7.585 821 HG2 LYS 103 HG2 LYS 103 -9.169 -12.826 -9.232 822 HG3 LYS 103 HG1 LYS 103 -9.067 -11.209 -8.538 823 HD2 LYS 103 HD2 LYS 103 -6.867 -10.898 -9.340 824 HD3 LYS 103 HD1 LYS 103 -6.694 -12.612 -9.736 825 HE2 LYS 103 HE2 LYS 103 -8.106 -12.441 -11.588 826 HE3 LYS 103 HE1 LYS 103 -8.806 -10.922 -11.031 827 HZ1 LYS 103 HZ1 LYS 103 -7.131 -10.845 -12.921 828 HZ2 LYS 103 HZ2 LYS 103 -5.954 -11.120 -11.740 829 HZ3 LYS 103 HZ3 LYS 103 -6.934 -9.739 -11.652 830 H GLY 104 HN GLY 104 -10.918 -13.512 -5.102 831 HA2 GLY 104 HA2 GLY 104 -11.292 -15.335 -3.762 832 HA3 GLY 104 HA1 GLY 104 -9.783 -16.006 -4.374 833 H ASN 105 HN ASN 105 -8.016 -15.971 -3.103 834 HA ASN 105 HA ASN 105 -8.267 -14.606 -0.497 835 HB2 ASN 105 HB2 ASN 105 -6.907 -16.389 0.477 836 HB3 ASN 105 HB1 ASN 105 -8.342 -17.060 -0.285 837 HD21 ASN 105 HD21 ASN 105 -8.137 -18.310 -2.113 838 HD22 ASN 105 HD22 ASN 105 -6.617 -18.955 -2.632 839 H GLU 106 HN GLU 106 -6.983 -13.957 -3.243 840 HA GLU 106 HA GLU 106 -4.392 -13.150 -2.106 841 HB2 GLU 106 HB2 GLU 106 -4.971 -14.157 -4.887 842 HB3 GLU 106 HB1 GLU 106 -3.474 -13.353 -4.435 843 HG2 GLU 106 HG2 GLU 106 -3.086 -15.131 -2.756 844 HG3 GLU 106 HG1 GLU 106 -4.530 -15.953 -3.347 845 H MET 107 HN MET 107 -3.805 -11.089 -2.405 846 HA MET 107 HA MET 107 -5.670 -9.389 -3.933 847 HB2 MET 107 HB2 MET 107 -5.846 -8.709 -1.687 848 HB3 MET 107 HB1 MET 107 -4.124 -8.898 -1.399 849 HG2 MET 107 HG2 MET 107 -4.461 -6.955 -3.445 850 HG3 MET 107 HG1 MET 107 -5.544 -6.557 -2.114 851 HE1 MET 107 HE1 MET 107 -3.265 -5.865 0.851 852 HE2 MET 107 HE2 MET 107 -4.376 -7.187 0.491 853 HE3 MET 107 HE3 MET 107 -4.822 -5.527 0.089 854 H VAL 108 HN VAL 108 -4.855 -8.692 -5.768 855 HA VAL 108 HA VAL 108 -1.941 -8.374 -5.993 856 HB VAL 108 HB VAL 108 -2.621 -8.220 -8.543 857 HG11 VAL 108 HG11 VAL 108 -2.508 -10.823 -7.021 858 HG12 VAL 108 HG12 VAL 108 -1.123 -9.886 -7.588 859 HG13 VAL 108 HG13 VAL 108 -2.226 -10.623 -8.751 860 HG21 VAL 108 HG21 VAL 108 -4.826 -9.945 -7.423 861 HG22 VAL 108 HG22 VAL 108 -4.482 -9.640 -9.128 862 HG23 VAL 108 HG23 VAL 108 -5.038 -8.327 -8.094 863 H GLU 109 HN GLU 109 -1.408 -6.340 -5.535 864 HA GLU 109 HA GLU 109 -3.072 -4.206 -6.684 865 HB2 GLU 109 HB2 GLU 109 -2.712 -2.907 -4.841 866 HB3 GLU 109 HB1 GLU 109 -2.617 -4.496 -4.100 867 HG2 GLU 109 HG2 GLU 109 -0.127 -4.359 -4.372 868 HG3 GLU 109 HG1 GLU 109 -0.352 -2.673 -4.842 869 H THR 110 HN THR 110 -2.062 -2.378 -7.555 870 HA THR 110 HA THR 110 0.779 -2.615 -8.223 871 HB THR 110 HB THR 110 -1.365 -2.024 -10.274 872 HG1 THR 110 HG1 THR 110 -0.976 -4.306 -9.543 873 HG21 THR 110 HG21 THR 110 1.055 -0.967 -10.351 874 HG22 THR 110 HG22 THR 110 0.270 -1.571 -11.807 875 HG23 THR 110 HG23 THR 110 1.471 -2.560 -10.979 876 H ILE 111 HN ILE 111 1.744 -0.768 -7.696 877 HA ILE 111 HA ILE 111 0.103 1.686 -7.717 878 HB ILE 111 HB ILE 111 2.539 1.592 -6.022 879 HG12 ILE 111 HG12 ILE 111 -0.024 0.252 -5.142 880 HG13 ILE 111 HG11 ILE 111 1.410 -0.628 -5.660 881 HG21 ILE 111 HG21 ILE 111 -0.114 2.522 -5.077 882 HG22 ILE 111 HG22 ILE 111 0.663 3.436 -6.371 883 HG23 ILE 111 HG23 ILE 111 1.489 3.215 -4.828 884 HD11 ILE 111 HD11 ILE 111 1.041 1.086 -3.225 885 HD12 ILE 111 HD12 ILE 111 2.637 0.591 -3.803 886 HD13 ILE 111 HD13 ILE 111 1.455 -0.627 -3.319 887 H THR 112 HN THR 112 1.275 3.668 -8.199 888 HA THR 112 HA THR 112 3.896 3.377 -9.425 889 HB THR 112 HB THR 112 1.622 4.627 -10.977 890 HG1 THR 112 HG1 THR 112 2.498 2.020 -10.786 891 HG21 THR 112 HG21 THR 112 3.857 5.565 -11.407 892 HG22 THR 112 HG22 THR 112 3.251 4.670 -12.805 893 HG23 THR 112 HG23 THR 112 4.465 3.947 -11.748 894 H PHE 113 HN PHE 113 5.024 4.839 -8.357 895 HA PHE 113 HA PHE 113 4.079 7.601 -8.280 896 HB2 PHE 113 HB2 PHE 113 4.635 5.892 -5.885 897 HB3 PHE 113 HB1 PHE 113 5.035 7.599 -5.829 898 HD1 PHE 113 HD2 PHE 113 2.313 5.152 -6.052 899 HD2 PHE 113 HD1 PHE 113 3.322 9.269 -5.686 900 HE1 PHE 113 HE2 PHE 113 -0.008 5.664 -5.405 901 HE2 PHE 113 HE1 PHE 113 1.003 9.787 -5.038 902 HZ PHE 113 HZ PHE 113 -0.660 7.979 -4.892 903 H GLY 114 HN GLY 114 5.769 9.098 -8.217 904 HA2 GLY 114 HA2 GLY 114 7.900 9.898 -8.519 905 HA3 GLY 114 HA1 GLY 114 8.450 8.488 -7.628 906 H GLY 115 HN GLY 115 6.589 7.977 -10.476 907 HA2 GLY 115 HA2 GLY 115 7.178 7.376 -12.625 908 HA3 GLY 115 HA1 GLY 115 8.838 7.818 -12.261 909 H VAL 116 HN VAL 116 7.405 5.696 -10.000 910 HA VAL 116 HA VAL 116 8.713 3.392 -11.296 911 HB VAL 116 HB VAL 116 8.512 3.688 -8.308 912 HG11 VAL 116 HG11 VAL 116 10.293 2.049 -10.105 913 HG12 VAL 116 HG12 VAL 116 8.930 1.465 -9.151 914 HG13 VAL 116 HG13 VAL 116 10.371 2.081 -8.343 915 HG21 VAL 116 HG21 VAL 116 10.821 4.593 -10.028 916 HG22 VAL 116 HG22 VAL 116 10.832 4.488 -8.268 917 HG23 VAL 116 HG23 VAL 116 9.759 5.630 -9.077 918 H THR 117 HN THR 117 7.438 1.687 -11.613 919 HA THR 117 HA THR 117 4.767 1.709 -10.422 920 HB THR 117 HB THR 117 5.824 -0.068 -12.631 921 HG1 THR 117 HG1 THR 117 5.647 2.392 -12.936 922 HG21 THR 117 HG21 THR 117 2.955 0.637 -12.039 923 HG22 THR 117 HG22 THR 117 3.754 -0.756 -11.311 924 HG23 THR 117 HG23 THR 117 3.585 -0.659 -13.062 925 H LEU 118 HN LEU 118 5.274 0.957 -8.341 926 HA LEU 118 HA LEU 118 6.733 -1.496 -7.997 927 HB2 LEU 118 HB2 LEU 118 6.900 0.166 -6.262 928 HB3 LEU 118 HB1 LEU 118 5.163 0.187 -6.051 929 HG LEU 118 HG LEU 118 5.150 -1.942 -5.005 930 HD11 LEU 118 HD11 LEU 118 7.954 -2.205 -6.055 931 HD12 LEU 118 HD12 LEU 118 6.558 -3.243 -6.350 932 HD13 LEU 118 HD13 LEU 118 7.324 -3.229 -4.763 933 HD21 LEU 118 HD21 LEU 118 6.021 -0.042 -3.630 934 HD22 LEU 118 HD22 LEU 118 7.651 -0.622 -3.971 935 HD23 LEU 118 HD23 LEU 118 6.521 -1.639 -3.083 936 H ILE 119 HN ILE 119 5.892 -3.324 -8.562 937 HA ILE 119 HA ILE 119 3.019 -3.774 -8.369 938 HB ILE 119 HB ILE 119 5.229 -5.402 -9.640 939 HG12 ILE 119 HG12 ILE 119 3.314 -3.331 -10.584 940 HG13 ILE 119 HG11 ILE 119 4.962 -3.666 -11.100 941 HG21 ILE 119 HG21 ILE 119 3.397 -6.832 -8.791 942 HG22 ILE 119 HG22 ILE 119 3.480 -6.828 -10.552 943 HG23 ILE 119 HG23 ILE 119 2.242 -5.881 -9.724 944 HD11 ILE 119 HD11 ILE 119 2.455 -5.118 -11.908 945 HD12 ILE 119 HD12 ILE 119 4.084 -5.668 -12.298 946 HD13 ILE 119 HD13 ILE 119 3.506 -4.124 -12.919 947 H ARG 120 HN ARG 120 2.187 -4.780 -6.641 948 HA ARG 120 HA ARG 120 3.955 -6.535 -5.086 949 HB2 ARG 120 HB2 ARG 120 1.782 -4.760 -3.964 950 HB3 ARG 120 HB1 ARG 120 2.832 -5.826 -3.047 951 HG2 ARG 120 HG2 ARG 120 4.718 -4.363 -4.177 952 HG3 ARG 120 HG1 ARG 120 3.406 -3.188 -4.275 953 HD2 ARG 120 HD2 ARG 120 4.512 -4.509 -1.802 954 HD3 ARG 120 HD1 ARG 120 4.578 -2.801 -2.227 955 HE ARG 120 HE ARG 120 1.878 -3.646 -2.091 956 HH11 ARG 120 HH11 ARG 120 4.607 -3.018 0.019 957 HH12 ARG 120 HH12 ARG 120 3.619 -2.528 1.353 958 HH21 ARG 120 HH21 ARG 120 0.584 -3.007 -0.392 959 HH22 ARG 120 HH22 ARG 120 1.296 -2.513 1.121 960 H ARG 121 HN ARG 121 2.955 -8.279 -3.988 961 HA ARG 121 HA ARG 121 0.254 -8.970 -4.891 962 HB2 ARG 121 HB2 ARG 121 2.637 -10.842 -4.874 963 HB3 ARG 121 HB1 ARG 121 0.976 -11.312 -5.198 964 HG2 ARG 121 HG2 ARG 121 1.867 -11.170 -7.303 965 HG3 ARG 121 HG1 ARG 121 1.124 -9.586 -7.116 966 HD2 ARG 121 HD2 ARG 121 3.517 -9.747 -8.075 967 HD3 ARG 121 HD1 ARG 121 3.155 -8.515 -6.866 968 HE ARG 121 HE ARG 121 4.299 -9.814 -5.244 969 HH11 ARG 121 HH11 ARG 121 4.596 -11.052 -8.512 970 HH12 ARG 121 HH12 ARG 121 5.998 -12.006 -8.169 971 HH21 ARG 121 HH21 ARG 121 6.174 -11.071 -4.785 972 HH22 ARG 121 HH22 ARG 121 6.898 -12.023 -6.040 973 H SER 122 HN SER 122 -0.956 -9.557 -3.190 974 HA SER 122 HA SER 122 0.491 -10.367 -0.764 975 HB2 SER 122 HB2 SER 122 -2.176 -8.988 -0.722 976 HB3 SER 122 HB1 SER 122 -0.990 -9.144 0.575 977 HG SER 122 HG SER 122 -1.250 -7.165 -1.162 978 H LYS 123 HN LYS 123 -0.314 -12.021 0.459 979 HA LYS 123 HA LYS 123 -2.557 -13.525 -0.726 980 HB2 LYS 123 HB2 LYS 123 -1.384 -15.565 0.228 981 HB3 LYS 123 HB1 LYS 123 -0.600 -14.809 -1.151 982 HG2 LYS 123 HG2 LYS 123 1.230 -14.250 0.043 983 HG3 LYS 123 HG1 LYS 123 0.290 -13.832 1.474 984 HD2 LYS 123 HD2 LYS 123 1.723 -15.748 1.919 985 HD3 LYS 123 HD1 LYS 123 0.025 -16.219 1.991 986 HE2 LYS 123 HE2 LYS 123 0.148 -17.225 -0.172 987 HE3 LYS 123 HE1 LYS 123 1.770 -16.587 -0.436 988 HZ1 LYS 123 HZ1 LYS 123 2.609 -17.997 1.306 989 HZ2 LYS 123 HZ2 LYS 123 1.756 -18.953 0.201 990 HZ3 LYS 123 HZ3 LYS 123 1.053 -18.545 1.684 991 H ARG 124 HN ARG 124 -4.137 -14.204 0.639 992 HA ARG 124 HA ARG 124 -4.262 -13.008 3.236 993 HB2 ARG 124 HB2 ARG 124 -6.117 -13.822 1.438 994 HB3 ARG 124 HB1 ARG 124 -6.151 -15.169 2.565 995 HG2 ARG 124 HG2 ARG 124 -6.680 -13.702 4.385 996 HG3 ARG 124 HG1 ARG 124 -6.504 -12.287 3.348 997 HD2 ARG 124 HD2 ARG 124 -8.844 -12.875 3.690 998 HD3 ARG 124 HD1 ARG 124 -8.383 -13.021 1.997 999 HE ARG 124 HE ARG 124 -8.146 -15.491 3.440 1000 HH11 ARG 124 HH11 ARG 124 -10.445 -13.396 1.823 1001 HH12 ARG 124 HH12 ARG 124 -11.492 -14.696 1.349 1002 HH21 ARG 124 HH21 ARG 124 -9.535 -17.209 2.815 1003 HH22 ARG 124 HH22 ARG 124 -10.977 -16.859 1.914 1004 H VAL 125 HN VAL 125 -4.352 -14.078 5.245 1005 HA VAL 125 HA VAL 125 -3.098 -16.747 5.229 1006 HB VAL 125 HB VAL 125 -2.168 -16.131 7.492 1007 HG11 VAL 125 HG11 VAL 125 -1.231 -14.575 5.084 1008 HG12 VAL 125 HG12 VAL 125 -0.723 -16.194 5.568 1009 HG13 VAL 125 HG13 VAL 125 -0.294 -14.801 6.563 1010 HG21 VAL 125 HG21 VAL 125 -3.755 -14.166 7.762 1011 HG22 VAL 125 HG22 VAL 125 -2.686 -13.285 6.669 1012 HG23 VAL 125 HG23 VAL 125 -2.072 -13.889 8.207 Start of MODEL 19 1 H1 ALA 1 HT1 ALA 1 -13.471 -10.175 0.290 2 H2 ALA 1 HT2 ALA 1 -13.542 -8.858 -0.766 3 H3 ALA 1 HT3 ALA 1 -14.960 -9.465 -0.080 4 HA ALA 1 HA ALA 1 -14.315 -7.430 1.000 5 HB1 ALA 1 HB1 ALA 1 -15.435 -9.230 2.285 6 HB2 ALA 1 HB2 ALA 1 -14.412 -8.191 3.275 7 HB3 ALA 1 HB3 ALA 1 -13.849 -9.794 2.809 8 H PHE 2 HN PHE 2 -12.732 -6.074 1.475 9 HA PHE 2 HA PHE 2 -9.991 -6.939 1.261 10 HB2 PHE 2 HB2 PHE 2 -11.287 -4.249 1.681 11 HB3 PHE 2 HB1 PHE 2 -9.542 -4.471 1.653 12 HD1 PHE 2 HD1 PHE 2 -12.558 -5.262 -0.397 13 HD2 PHE 2 HD2 PHE 2 -8.438 -4.193 -0.351 14 HE1 PHE 2 HE1 PHE 2 -12.578 -5.091 -2.851 15 HE2 PHE 2 HE2 PHE 2 -8.464 -4.008 -2.810 16 HZ PHE 2 HZ PHE 2 -10.529 -4.470 -4.055 17 H SER 3 HN SER 3 -12.231 -6.128 3.786 18 HA SER 3 HA SER 3 -10.473 -5.512 5.867 19 HB2 SER 3 HB2 SER 3 -13.134 -5.529 5.683 20 HB3 SER 3 HB1 SER 3 -12.933 -7.094 6.471 21 HG SER 3 HG SER 3 -12.771 -5.979 8.234 22 H GLY 4 HN GLY 4 -8.754 -6.721 6.305 23 HA2 GLY 4 HA2 GLY 4 -8.903 -9.143 7.632 24 HA3 GLY 4 HA1 GLY 4 -8.648 -9.528 5.935 25 H THR 5 HN THR 5 -6.637 -10.405 6.315 26 HA THR 5 HA THR 5 -4.541 -8.409 6.773 27 HB THR 5 HB THR 5 -3.241 -10.303 7.880 28 HG1 THR 5 HG1 THR 5 -5.451 -11.631 7.343 29 HG21 THR 5 HG21 THR 5 -5.589 -8.980 9.226 30 HG22 THR 5 HG22 THR 5 -3.920 -8.413 9.167 31 HG23 THR 5 HG23 THR 5 -4.332 -9.850 10.103 32 H TRP 6 HN TRP 6 -3.295 -8.308 5.067 33 HA TRP 6 HA TRP 6 -2.903 -10.740 3.445 34 HB2 TRP 6 HB2 TRP 6 -2.686 -7.962 2.343 35 HB3 TRP 6 HB1 TRP 6 -2.942 -9.474 1.485 36 HD1 TRP 6 HD1 TRP 6 -4.827 -6.923 3.640 37 HE1 TRP 6 HE1 TRP 6 -7.337 -7.130 3.128 38 HE3 TRP 6 HE3 TRP 6 -4.694 -11.067 0.655 39 HZ2 TRP 6 HZ2 TRP 6 -9.042 -8.847 1.678 40 HZ3 TRP 6 HZ3 TRP 6 -6.806 -11.935 -0.250 41 HH2 TRP 6 HH2 TRP 6 -8.940 -10.846 0.251 42 H GLN 7 HN GLN 7 -0.883 -11.444 3.213 43 HA GLN 7 HA GLN 7 1.290 -9.695 4.130 44 HB2 GLN 7 HB2 GLN 7 0.896 -12.067 5.058 45 HB3 GLN 7 HB1 GLN 7 1.546 -12.632 3.526 46 HG2 GLN 7 HG2 GLN 7 3.265 -10.629 4.662 47 HG3 GLN 7 HG1 GLN 7 2.964 -11.919 5.824 48 HE21 GLN 7 HE21 GLN 7 4.420 -11.056 2.815 49 HE22 GLN 7 HE22 GLN 7 5.272 -12.541 2.563 50 H VAL 8 HN VAL 8 2.124 -8.556 2.539 51 HA VAL 8 HA VAL 8 2.021 -9.382 -0.202 52 HB VAL 8 HB VAL 8 3.674 -7.336 -0.418 53 HG11 VAL 8 HG11 VAL 8 1.404 -7.477 -1.318 54 HG12 VAL 8 HG12 VAL 8 1.780 -5.872 -0.689 55 HG13 VAL 8 HG13 VAL 8 0.765 -6.971 0.247 56 HG21 VAL 8 HG21 VAL 8 2.282 -6.656 2.161 57 HG22 VAL 8 HG22 VAL 8 3.481 -5.699 1.287 58 HG23 VAL 8 HG23 VAL 8 3.957 -7.207 2.068 59 H TYR 9 HN TYR 9 3.580 -10.072 -1.540 60 HA TYR 9 HA TYR 9 6.348 -10.230 -0.727 61 HB2 TYR 9 HB2 TYR 9 6.541 -12.646 -0.921 62 HB3 TYR 9 HB1 TYR 9 5.310 -12.280 0.277 63 HD1 TYR 9 HD1 TYR 9 2.874 -11.898 -1.129 64 HD2 TYR 9 HD2 TYR 9 6.037 -14.575 -2.081 65 HE1 TYR 9 HE1 TYR 9 1.293 -13.311 -2.346 66 HE2 TYR 9 HE2 TYR 9 4.455 -16.009 -3.295 67 HH TYR 9 HH TYR 9 1.356 -14.992 -4.163 68 H ALA 10 HN ALA 10 7.473 -9.676 -2.539 69 HA ALA 10 HA ALA 10 7.042 -10.847 -5.071 70 HB1 ALA 10 HB1 ALA 10 5.009 -9.430 -5.025 71 HB2 ALA 10 HB2 ALA 10 6.118 -9.004 -6.329 72 HB3 ALA 10 HB3 ALA 10 6.042 -8.009 -4.877 73 H GLN 11 HN GLN 11 8.728 -10.491 -6.400 74 HA GLN 11 HA GLN 11 10.764 -8.605 -5.470 75 HB2 GLN 11 HB2 GLN 11 12.331 -9.909 -6.910 76 HB3 GLN 11 HB1 GLN 11 11.611 -10.844 -5.613 77 HG2 GLN 11 HG2 GLN 11 10.444 -10.898 -8.370 78 HG3 GLN 11 HG1 GLN 11 11.836 -11.899 -7.952 79 HE21 GLN 11 HE21 GLN 11 11.583 -13.554 -6.441 80 HE22 GLN 11 HE22 GLN 11 10.025 -14.177 -6.024 81 H GLU 12 HN GLU 12 9.916 -6.728 -6.349 82 HA GLU 12 HA GLU 12 10.126 -6.516 -9.279 83 HB2 GLU 12 HB2 GLU 12 7.693 -6.462 -8.142 84 HB3 GLU 12 HB1 GLU 12 8.127 -4.791 -7.901 85 HG2 GLU 12 HG2 GLU 12 6.887 -4.930 -9.912 86 HG3 GLU 12 HG1 GLU 12 8.567 -4.639 -10.352 87 H ASN 13 HN ASN 13 9.201 -3.777 -8.921 88 HA ASN 13 HA ASN 13 11.713 -2.454 -8.571 89 HB2 ASN 13 HB2 ASN 13 10.051 -0.448 -8.953 90 HB3 ASN 13 HB1 ASN 13 10.418 -1.547 -10.286 91 HD21 ASN 13 HD21 ASN 13 8.617 -1.883 -11.380 92 HD22 ASN 13 HD22 ASN 13 7.030 -2.056 -10.740 93 H TYR 14 HN TYR 14 10.438 -3.732 -6.211 94 HA TYR 14 HA TYR 14 9.239 -1.926 -4.467 95 HB2 TYR 14 HB2 TYR 14 9.261 -4.346 -4.110 96 HB3 TYR 14 HB1 TYR 14 10.997 -4.298 -3.849 97 HD1 TYR 14 HD1 TYR 14 11.928 -3.434 -1.779 98 HD2 TYR 14 HD2 TYR 14 7.722 -3.637 -2.374 99 HE1 TYR 14 HE1 TYR 14 11.585 -3.139 0.625 100 HE2 TYR 14 HE2 TYR 14 7.365 -3.330 0.041 101 HH TYR 14 HH TYR 14 9.324 -3.932 2.262 102 H GLU 15 HN GLU 15 12.656 -2.969 -4.394 103 HA GLU 15 HA GLU 15 13.411 -1.068 -2.476 104 HB2 GLU 15 HB2 GLU 15 15.766 -1.573 -3.273 105 HB3 GLU 15 HB1 GLU 15 14.816 -2.930 -2.688 106 HG2 GLU 15 HG2 GLU 15 14.324 -3.557 -5.021 107 HG3 GLU 15 HG1 GLU 15 15.347 -2.227 -5.568 108 H GLU 16 HN GLU 16 13.089 -0.804 -5.933 109 HA GLU 16 HA GLU 16 14.682 1.578 -6.129 110 HB2 GLU 16 HB2 GLU 16 14.045 -0.131 -8.000 111 HB3 GLU 16 HB1 GLU 16 12.598 0.854 -8.152 112 HG2 GLU 16 HG2 GLU 16 14.178 2.840 -8.366 113 HG3 GLU 16 HG1 GLU 16 15.450 1.648 -8.612 114 H PHE 17 HN PHE 17 11.261 0.808 -5.792 115 HA PHE 17 HA PHE 17 10.273 3.429 -6.141 116 HB2 PHE 17 HB2 PHE 17 8.772 1.538 -6.292 117 HB3 PHE 17 HB1 PHE 17 9.124 1.071 -4.631 118 HD1 PHE 17 HD2 PHE 17 8.196 4.309 -6.246 119 HD2 PHE 17 HD1 PHE 17 7.281 1.379 -3.307 120 HE1 PHE 17 HE2 PHE 17 6.290 5.663 -5.498 121 HE2 PHE 17 HE1 PHE 17 5.373 2.726 -2.543 122 HZ PHE 17 HZ PHE 17 4.878 4.879 -3.637 123 H LEU 18 HN LEU 18 11.473 1.668 -3.361 124 HA LEU 18 HA LEU 18 10.663 3.400 -1.333 125 HB2 LEU 18 HB2 LEU 18 13.256 1.863 -1.444 126 HB3 LEU 18 HB1 LEU 18 12.470 2.479 -0.007 127 HG LEU 18 HG LEU 18 11.641 0.162 -1.732 128 HD11 LEU 18 HD11 LEU 18 12.338 0.522 1.169 129 HD12 LEU 18 HD12 LEU 18 13.171 -0.455 -0.042 130 HD13 LEU 18 HD13 LEU 18 11.573 -0.930 0.529 131 HD21 LEU 18 HD21 LEU 18 9.999 1.588 0.354 132 HD22 LEU 18 HD22 LEU 18 9.615 0.012 -0.334 133 HD23 LEU 18 HD23 LEU 18 9.626 1.442 -1.365 134 H LYS 19 HN LYS 19 13.294 3.611 -3.611 135 HA LYS 19 HA LYS 19 14.653 5.758 -2.299 136 HB2 LYS 19 HB2 LYS 19 14.932 4.953 -5.199 137 HB3 LYS 19 HB1 LYS 19 16.124 5.757 -4.185 138 HG2 LYS 19 HG2 LYS 19 15.876 3.562 -2.748 139 HG3 LYS 19 HG1 LYS 19 15.330 2.894 -4.281 140 HD2 LYS 19 HD2 LYS 19 17.402 3.498 -5.344 141 HD3 LYS 19 HD1 LYS 19 17.935 4.361 -3.899 142 HE2 LYS 19 HE2 LYS 19 17.933 2.275 -2.644 143 HE3 LYS 19 HE1 LYS 19 17.373 1.403 -4.070 144 HZ1 LYS 19 HZ1 LYS 19 20.004 2.706 -3.646 145 HZ2 LYS 19 HZ2 LYS 19 19.464 2.225 -5.180 146 HZ3 LYS 19 HZ3 LYS 19 19.681 1.071 -3.962 147 H ALA 20 HN ALA 20 11.901 5.538 -4.322 148 HA ALA 20 HA ALA 20 12.133 8.221 -5.384 149 HB1 ALA 20 HB1 ALA 20 11.047 6.512 -6.739 150 HB2 ALA 20 HB2 ALA 20 9.904 7.799 -6.353 151 HB3 ALA 20 HB3 ALA 20 9.831 6.266 -5.486 152 H LEU 21 HN LEU 21 10.958 6.732 -2.554 153 HA LEU 21 HA LEU 21 9.171 8.935 -1.892 154 HB2 LEU 21 HB2 LEU 21 9.880 6.449 -0.340 155 HB3 LEU 21 HB1 LEU 21 8.652 7.617 0.108 156 HG LEU 21 HG LEU 21 8.198 6.616 -2.568 157 HD11 LEU 21 HD11 LEU 21 9.215 4.589 -1.960 158 HD12 LEU 21 HD12 LEU 21 7.485 4.329 -1.739 159 HD13 LEU 21 HD13 LEU 21 8.519 4.628 -0.342 160 HD21 LEU 21 HD21 LEU 21 6.588 7.789 -1.071 161 HD22 LEU 21 HD22 LEU 21 6.555 6.343 -0.059 162 HD23 LEU 21 HD23 LEU 21 5.991 6.265 -1.727 163 H ALA 22 HN ALA 22 12.295 8.743 -1.970 164 HA ALA 22 HA ALA 22 14.050 9.753 -0.963 165 HB1 ALA 22 HB1 ALA 22 11.997 11.280 0.626 166 HB2 ALA 22 HB2 ALA 22 12.499 11.694 -1.013 167 HB3 ALA 22 HB3 ALA 22 13.666 11.747 0.308 168 H LEU 23 HN LEU 23 13.275 7.296 0.031 169 HA LEU 23 HA LEU 23 13.457 7.451 2.943 170 HB2 LEU 23 HB2 LEU 23 13.173 5.094 1.073 171 HB3 LEU 23 HB1 LEU 23 13.200 4.980 2.820 172 HG LEU 23 HG LEU 23 11.120 6.525 1.278 173 HD11 LEU 23 HD11 LEU 23 10.960 3.759 2.458 174 HD12 LEU 23 HD12 LEU 23 10.959 4.158 0.742 175 HD13 LEU 23 HD13 LEU 23 9.615 4.663 1.765 176 HD21 LEU 23 HD21 LEU 23 11.614 5.934 4.152 177 HD22 LEU 23 HD22 LEU 23 9.951 6.049 3.581 178 HD23 LEU 23 HD23 LEU 23 11.047 7.418 3.389 179 HA PRO 24 HA PRO 24 17.798 6.755 3.158 180 HB2 PRO 24 HB2 PRO 24 18.011 5.073 5.306 181 HB3 PRO 24 HB1 PRO 24 17.663 6.805 5.455 182 HG2 PRO 24 HG2 PRO 24 15.812 4.493 5.610 183 HG3 PRO 24 HG1 PRO 24 15.830 5.992 6.558 184 HD2 PRO 24 HD2 PRO 24 14.118 5.571 4.493 185 HD3 PRO 24 HD1 PRO 24 14.713 7.172 4.955 186 H GLU 25 HN GLU 25 19.030 5.557 1.876 187 HA GLU 25 HA GLU 25 18.273 3.209 0.642 188 HB2 GLU 25 HB2 GLU 25 20.076 4.758 -0.111 189 HB3 GLU 25 HB1 GLU 25 21.115 4.092 1.140 190 HG2 GLU 25 HG2 GLU 25 21.253 2.021 0.109 191 HG3 GLU 25 HG1 GLU 25 19.830 2.316 -0.885 192 H ASP 26 HN ASP 26 20.118 3.663 3.606 193 HA ASP 26 HA ASP 26 20.996 1.046 3.992 194 HB2 ASP 26 HB2 ASP 26 21.766 2.897 5.385 195 HB3 ASP 26 HB1 ASP 26 20.153 3.077 6.068 196 H LEU 27 HN LEU 27 17.907 2.564 4.902 197 HA LEU 27 HA LEU 27 16.888 0.223 6.188 198 HB2 LEU 27 HB2 LEU 27 16.108 2.570 6.608 199 HB3 LEU 27 HB1 LEU 27 15.337 2.542 5.033 200 HG LEU 27 HG LEU 27 14.350 0.277 6.302 201 HD11 LEU 27 HD11 LEU 27 13.446 1.189 8.412 202 HD12 LEU 27 HD12 LEU 27 14.512 2.582 8.229 203 HD13 LEU 27 HD13 LEU 27 15.194 0.966 8.433 204 HD21 LEU 27 HD21 LEU 27 13.174 3.035 6.008 205 HD22 LEU 27 HD22 LEU 27 12.260 1.577 6.386 206 HD23 LEU 27 HD23 LEU 27 13.091 1.718 4.837 207 H ILE 28 HN ILE 28 16.792 1.558 2.980 208 HA ILE 28 HA ILE 28 14.783 -0.038 1.836 209 HB ILE 28 HB ILE 28 17.191 1.302 0.608 210 HG12 ILE 28 HG12 ILE 28 14.280 2.103 0.606 211 HG13 ILE 28 HG11 ILE 28 15.458 2.706 1.760 212 HG21 ILE 28 HG21 ILE 28 16.276 0.967 -1.547 213 HG22 ILE 28 HG22 ILE 28 14.772 0.327 -0.889 214 HG23 ILE 28 HG23 ILE 28 16.261 -0.608 -0.756 215 HD11 ILE 28 HD11 ILE 28 15.748 4.376 0.328 216 HD12 ILE 28 HD12 ILE 28 14.945 3.506 -0.979 217 HD13 ILE 28 HD13 ILE 28 16.652 3.218 -0.649 218 H LYS 29 HN LYS 29 18.226 -0.544 2.316 219 HA LYS 29 HA LYS 29 18.472 -2.898 0.781 220 HB2 LYS 29 HB2 LYS 29 20.095 -1.885 3.122 221 HB3 LYS 29 HB1 LYS 29 20.545 -3.268 2.135 222 HG2 LYS 29 HG2 LYS 29 20.857 -1.920 0.216 223 HG3 LYS 29 HG1 LYS 29 20.108 -0.524 0.991 224 HD2 LYS 29 HD2 LYS 29 22.453 -0.151 1.024 225 HD3 LYS 29 HD1 LYS 29 21.981 -0.585 2.670 226 HE2 LYS 29 HE2 LYS 29 24.018 -1.739 2.100 227 HE3 LYS 29 HE1 LYS 29 22.707 -2.912 2.216 228 HZ1 LYS 29 HZ1 LYS 29 22.521 -2.784 -0.242 229 HZ2 LYS 29 HZ2 LYS 29 23.997 -3.400 0.293 230 HZ3 LYS 29 HZ3 LYS 29 23.905 -1.813 -0.266 231 H MET 30 HN MET 30 17.172 -2.304 3.934 232 HA MET 30 HA MET 30 17.318 -5.136 4.664 233 HB2 MET 30 HB2 MET 30 15.844 -3.105 6.287 234 HB3 MET 30 HB1 MET 30 16.724 -4.526 6.825 235 HG2 MET 30 HG2 MET 30 18.034 -2.060 5.714 236 HG3 MET 30 HG1 MET 30 17.753 -2.347 7.427 237 HE1 MET 30 HE1 MET 30 21.626 -2.801 6.992 238 HE2 MET 30 HE2 MET 30 20.381 -2.068 8.002 239 HE3 MET 30 HE3 MET 30 20.518 -1.618 6.300 240 H ALA 31 HN ALA 31 15.013 -2.617 3.876 241 HA ALA 31 HA ALA 31 12.623 -3.953 4.363 242 HB1 ALA 31 HB1 ALA 31 13.205 -1.861 2.267 243 HB2 ALA 31 HB2 ALA 31 12.783 -1.553 3.953 244 HB3 ALA 31 HB3 ALA 31 11.608 -2.307 2.872 245 H ARG 32 HN ARG 32 14.811 -4.217 1.648 246 HA ARG 32 HA ARG 32 13.025 -5.393 -0.180 247 HB2 ARG 32 HB2 ARG 32 14.902 -5.930 -1.479 248 HB3 ARG 32 HB1 ARG 32 15.359 -4.468 -0.621 249 HG2 ARG 32 HG2 ARG 32 16.531 -5.931 1.051 250 HG3 ARG 32 HG1 ARG 32 16.220 -7.286 -0.034 251 HD2 ARG 32 HD2 ARG 32 17.409 -6.017 -1.831 252 HD3 ARG 32 HD1 ARG 32 17.851 -4.820 -0.613 253 HE ARG 32 HE ARG 32 18.579 -7.473 0.162 254 HH11 ARG 32 HH11 ARG 32 19.568 -4.737 -1.782 255 HH12 ARG 32 HH12 ARG 32 21.246 -5.174 -1.768 256 HH21 ARG 32 HH21 ARG 32 20.784 -8.042 0.202 257 HH22 ARG 32 HH22 ARG 32 21.943 -7.044 -0.623 258 H ASP 33 HN ASP 33 14.552 -6.657 2.637 259 HA ASP 33 HA ASP 33 13.896 -9.414 1.866 260 HB2 ASP 33 HB2 ASP 33 16.206 -8.982 2.672 261 HB3 ASP 33 HB1 ASP 33 15.549 -8.414 4.205 262 H ILE 34 HN ILE 34 12.986 -6.810 3.898 263 HA ILE 34 HA ILE 34 11.505 -8.396 5.796 264 HB ILE 34 HB ILE 34 11.432 -5.414 5.305 265 HG12 ILE 34 HG12 ILE 34 12.986 -7.126 7.240 266 HG13 ILE 34 HG11 ILE 34 13.637 -6.075 5.995 267 HG21 ILE 34 HG21 ILE 34 9.414 -6.400 6.444 268 HG22 ILE 34 HG22 ILE 34 10.287 -5.182 7.375 269 HG23 ILE 34 HG23 ILE 34 10.491 -6.893 7.752 270 HD11 ILE 34 HD11 ILE 34 12.623 -4.153 7.245 271 HD12 ILE 34 HD12 ILE 34 13.955 -4.982 8.051 272 HD13 ILE 34 HD13 ILE 34 12.292 -5.290 8.552 273 H LYS 35 HN LYS 35 9.544 -9.170 5.503 274 HA LYS 35 HA LYS 35 7.854 -7.989 3.399 275 HB2 LYS 35 HB2 LYS 35 7.741 -10.812 4.497 276 HB3 LYS 35 HB1 LYS 35 6.787 -10.165 3.170 277 HG2 LYS 35 HG2 LYS 35 8.716 -9.970 1.783 278 HG3 LYS 35 HG1 LYS 35 9.784 -10.400 3.121 279 HD2 LYS 35 HD2 LYS 35 8.609 -12.602 3.245 280 HD3 LYS 35 HD1 LYS 35 7.748 -12.159 1.769 281 HE2 LYS 35 HE2 LYS 35 9.852 -11.984 0.572 282 HE3 LYS 35 HE1 LYS 35 10.745 -12.336 2.054 283 HZ1 LYS 35 HZ1 LYS 35 9.955 -14.527 2.073 284 HZ2 LYS 35 HZ2 LYS 35 10.398 -14.242 0.468 285 HZ3 LYS 35 HZ3 LYS 35 8.765 -14.220 0.910 286 HA PRO 36 HA PRO 36 5.745 -7.141 7.389 287 HB2 PRO 36 HB2 PRO 36 4.766 -4.718 6.680 288 HB3 PRO 36 HB1 PRO 36 6.430 -4.928 7.263 289 HG2 PRO 36 HG2 PRO 36 5.432 -4.620 4.478 290 HG3 PRO 36 HG1 PRO 36 6.871 -3.924 5.246 291 HD2 PRO 36 HD2 PRO 36 6.950 -6.112 3.623 292 HD3 PRO 36 HD1 PRO 36 8.123 -5.805 4.917 293 H ILE 37 HN ILE 37 3.601 -7.403 7.872 294 HA ILE 37 HA ILE 37 1.884 -8.038 5.611 295 HB ILE 37 HB ILE 37 2.133 -9.714 7.418 296 HG12 ILE 37 HG12 ILE 37 -0.028 -9.156 5.973 297 HG13 ILE 37 HG11 ILE 37 -0.002 -10.456 7.160 298 HG21 ILE 37 HG21 ILE 37 2.363 -8.164 9.301 299 HG22 ILE 37 HG22 ILE 37 1.125 -9.385 9.586 300 HG23 ILE 37 HG23 ILE 37 0.657 -7.741 9.151 301 HD11 ILE 37 HD11 ILE 37 -1.246 -9.214 8.708 302 HD12 ILE 37 HD12 ILE 37 -2.017 -8.919 7.150 303 HD13 ILE 37 HD13 ILE 37 -0.957 -7.698 7.853 304 H VAL 38 HN VAL 38 0.044 -6.961 5.160 305 HA VAL 38 HA VAL 38 -0.245 -4.365 6.482 306 HB VAL 38 HB VAL 38 -1.549 -5.332 3.929 307 HG11 VAL 38 HG11 VAL 38 -1.346 -2.582 5.159 308 HG12 VAL 38 HG12 VAL 38 -2.810 -3.550 4.979 309 HG13 VAL 38 HG13 VAL 38 -1.982 -2.929 3.550 310 HG21 VAL 38 HG21 VAL 38 0.116 -3.828 2.828 311 HG22 VAL 38 HG22 VAL 38 0.823 -5.254 3.589 312 HG23 VAL 38 HG23 VAL 38 0.931 -3.683 4.385 313 H GLU 39 HN GLU 39 -1.578 -4.357 8.151 314 HA GLU 39 HA GLU 39 -3.871 -6.138 8.206 315 HB2 GLU 39 HB2 GLU 39 -2.351 -4.567 10.162 316 HB3 GLU 39 HB1 GLU 39 -4.088 -4.548 10.428 317 HG2 GLU 39 HG2 GLU 39 -4.197 -6.837 10.748 318 HG3 GLU 39 HG1 GLU 39 -2.641 -7.112 9.973 319 H ILE 40 HN ILE 40 -5.742 -5.545 7.391 320 HA ILE 40 HA ILE 40 -6.427 -2.685 7.443 321 HB ILE 40 HB ILE 40 -5.755 -3.217 5.176 322 HG12 ILE 40 HG12 ILE 40 -7.862 -1.774 5.743 323 HG13 ILE 40 HG11 ILE 40 -7.497 -2.180 4.074 324 HG21 ILE 40 HG21 ILE 40 -7.795 -5.413 5.295 325 HG22 ILE 40 HG22 ILE 40 -6.052 -5.561 5.064 326 HG23 ILE 40 HG23 ILE 40 -7.051 -4.831 3.807 327 HD11 ILE 40 HD11 ILE 40 -9.144 -3.986 4.163 328 HD12 ILE 40 HD12 ILE 40 -9.853 -2.408 4.510 329 HD13 ILE 40 HD13 ILE 40 -9.525 -3.536 5.825 330 H GLN 41 HN GLN 41 -8.306 -2.249 8.351 331 HA GLN 41 HA GLN 41 -10.320 -4.380 8.499 332 HB2 GLN 41 HB2 GLN 41 -10.875 -3.737 10.777 333 HB3 GLN 41 HB1 GLN 41 -9.187 -4.207 10.677 334 HG2 GLN 41 HG2 GLN 41 -8.443 -1.993 10.893 335 HG3 GLN 41 HG1 GLN 41 -10.043 -1.337 10.546 336 HE21 GLN 41 HE21 GLN 41 -8.050 -2.919 12.924 337 HE22 GLN 41 HE22 GLN 41 -9.046 -2.548 14.291 338 H GLN 42 HN GLN 42 -12.410 -3.729 8.204 339 HA GLN 42 HA GLN 42 -12.761 -0.863 7.640 340 HB2 GLN 42 HB2 GLN 42 -14.049 -1.320 5.786 341 HB3 GLN 42 HB1 GLN 42 -12.917 -2.662 5.731 342 HG2 GLN 42 HG2 GLN 42 -14.639 -4.034 6.929 343 HG3 GLN 42 HG1 GLN 42 -15.762 -2.701 6.708 344 HE21 GLN 42 HE21 GLN 42 -16.562 -2.246 4.670 345 HE22 GLN 42 HE22 GLN 42 -16.401 -3.342 3.347 346 H LYS 43 HN LYS 43 -15.073 -0.206 7.724 347 HA LYS 43 HA LYS 43 -16.711 -1.550 9.719 348 HB2 LYS 43 HB2 LYS 43 -15.423 1.145 10.102 349 HB3 LYS 43 HB1 LYS 43 -16.984 0.802 10.834 350 HG2 LYS 43 HG2 LYS 43 -16.056 -1.004 12.113 351 HG3 LYS 43 HG1 LYS 43 -14.507 -0.849 11.287 352 HD2 LYS 43 HD2 LYS 43 -14.068 1.237 12.311 353 HD3 LYS 43 HD1 LYS 43 -15.729 1.388 12.881 354 HE2 LYS 43 HE2 LYS 43 -14.212 0.776 14.700 355 HE3 LYS 43 HE1 LYS 43 -15.402 -0.487 14.396 356 HZ1 LYS 43 HZ1 LYS 43 -12.607 -0.506 13.400 357 HZ2 LYS 43 HZ2 LYS 43 -13.748 -1.736 13.193 358 HZ3 LYS 43 HZ3 LYS 43 -13.169 -1.378 14.739 359 H GLY 44 HN GLY 44 -17.761 -1.778 7.554 360 HA2 GLY 44 HA2 GLY 44 -19.762 -1.220 6.460 361 HA3 GLY 44 HA1 GLY 44 -19.665 0.395 7.154 362 H ASP 45 HN ASP 45 -18.565 1.998 6.087 363 HA ASP 45 HA ASP 45 -17.541 1.257 3.426 364 HB2 ASP 45 HB2 ASP 45 -18.924 3.793 4.315 365 HB3 ASP 45 HB1 ASP 45 -18.098 3.632 2.773 366 H ASP 46 HN ASP 46 -16.805 2.550 6.464 367 HA ASP 46 HA ASP 46 -14.520 4.084 5.543 368 HB2 ASP 46 HB2 ASP 46 -16.032 4.557 7.638 369 HB3 ASP 46 HB1 ASP 46 -14.977 3.387 8.419 370 H PHE 47 HN PHE 47 -12.468 3.424 5.542 371 HA PHE 47 HA PHE 47 -11.921 0.693 6.514 372 HB2 PHE 47 HB2 PHE 47 -10.903 2.127 4.068 373 HB3 PHE 47 HB1 PHE 47 -10.079 0.727 4.733 374 HD1 PHE 47 HD2 PHE 47 -13.723 1.389 4.320 375 HD2 PHE 47 HD1 PHE 47 -10.353 -0.952 3.222 376 HE1 PHE 47 HE2 PHE 47 -15.194 -0.115 3.035 377 HE2 PHE 47 HE1 PHE 47 -11.813 -2.453 1.925 378 HZ PHE 47 HZ PHE 47 -14.234 -2.036 1.835 379 H VAL 48 HN VAL 48 -9.954 0.308 7.464 380 HA VAL 48 HA VAL 48 -8.301 2.645 8.118 381 HB VAL 48 HB VAL 48 -9.073 0.495 10.105 382 HG11 VAL 48 HG11 VAL 48 -7.993 2.151 11.702 383 HG12 VAL 48 HG12 VAL 48 -7.322 2.933 10.268 384 HG13 VAL 48 HG13 VAL 48 -6.909 1.256 10.636 385 HG21 VAL 48 HG21 VAL 48 -11.007 1.840 9.826 386 HG22 VAL 48 HG22 VAL 48 -10.052 3.322 9.771 387 HG23 VAL 48 HG23 VAL 48 -10.207 2.429 11.284 388 H VAL 49 HN VAL 49 -6.578 2.174 6.942 389 HA VAL 49 HA VAL 49 -5.551 -0.557 6.856 390 HB VAL 49 HB VAL 49 -4.566 1.908 5.422 391 HG11 VAL 49 HG11 VAL 49 -2.821 0.268 5.600 392 HG12 VAL 49 HG12 VAL 49 -3.447 0.250 3.952 393 HG13 VAL 49 HG13 VAL 49 -3.917 -1.017 5.086 394 HG21 VAL 49 HG21 VAL 49 -6.807 1.418 4.713 395 HG22 VAL 49 HG22 VAL 49 -6.420 -0.292 4.526 396 HG23 VAL 49 HG23 VAL 49 -5.692 0.898 3.449 397 H THR 50 HN THR 50 -4.218 -1.164 8.370 398 HA THR 50 HA THR 50 -2.603 0.818 9.782 399 HB THR 50 HB THR 50 -3.011 -2.117 10.390 400 HG1 THR 50 HG1 THR 50 -4.951 -0.981 10.634 401 HG21 THR 50 HG21 THR 50 -1.799 0.118 12.003 402 HG22 THR 50 HG22 THR 50 -0.970 -1.300 11.361 403 HG23 THR 50 HG23 THR 50 -2.178 -1.483 12.632 404 H SER 51 HN SER 51 -0.903 1.246 8.464 405 HA SER 51 HA SER 51 0.565 -0.897 7.193 406 HB2 SER 51 HB2 SER 51 1.542 1.930 7.303 407 HB3 SER 51 HB1 SER 51 1.603 0.774 5.968 408 HG SER 51 HG SER 51 -0.848 1.032 6.131 409 H LYS 52 HN LYS 52 1.750 -2.089 8.522 410 HA LYS 52 HA LYS 52 3.108 -0.828 10.781 411 HB2 LYS 52 HB2 LYS 52 3.094 -3.776 10.261 412 HB3 LYS 52 HB1 LYS 52 3.216 -2.924 11.793 413 HG2 LYS 52 HG2 LYS 52 0.827 -2.184 11.419 414 HG3 LYS 52 HG1 LYS 52 0.775 -3.354 10.097 415 HD2 LYS 52 HD2 LYS 52 1.284 -3.917 13.021 416 HD3 LYS 52 HD1 LYS 52 -0.131 -4.388 12.078 417 HE2 LYS 52 HE2 LYS 52 1.365 -5.790 10.661 418 HE3 LYS 52 HE1 LYS 52 2.698 -5.392 11.743 419 HZ1 LYS 52 HZ1 LYS 52 0.196 -6.800 12.533 420 HZ2 LYS 52 HZ2 LYS 52 1.499 -6.429 13.555 421 HZ3 LYS 52 HZ3 LYS 52 1.707 -7.527 12.291 422 H THR 53 HN THR 53 5.202 -0.349 10.675 423 HA THR 53 HA THR 53 6.928 -1.970 8.946 424 HB THR 53 HB THR 53 7.967 -0.164 7.906 425 HG1 THR 53 HG1 THR 53 6.763 1.896 9.330 426 HG21 THR 53 HG21 THR 53 5.602 -0.404 7.148 427 HG22 THR 53 HG22 THR 53 6.280 1.201 6.897 428 HG23 THR 53 HG23 THR 53 5.165 0.918 8.237 429 HA PRO 54 HA PRO 54 9.561 -2.104 12.470 430 HB2 PRO 54 HB2 PRO 54 11.929 -1.996 10.747 431 HB3 PRO 54 HB1 PRO 54 11.306 -3.342 11.715 432 HG2 PRO 54 HG2 PRO 54 11.236 -3.319 9.023 433 HG3 PRO 54 HG1 PRO 54 10.044 -4.167 10.024 434 HD2 PRO 54 HD2 PRO 54 9.788 -1.571 8.573 435 HD3 PRO 54 HD1 PRO 54 8.590 -2.849 8.848 436 H ARG 55 HN ARG 55 9.485 0.623 10.510 437 HA ARG 55 HA ARG 55 11.407 2.006 12.257 438 HB2 ARG 55 HB2 ARG 55 11.758 3.640 10.448 439 HB3 ARG 55 HB1 ARG 55 12.246 2.009 10.008 440 HG2 ARG 55 HG2 ARG 55 10.683 1.842 8.389 441 HG3 ARG 55 HG1 ARG 55 9.499 2.802 9.275 442 HD2 ARG 55 HD2 ARG 55 11.944 3.911 7.919 443 HD3 ARG 55 HD1 ARG 55 10.324 3.917 7.225 444 HE ARG 55 HE ARG 55 10.740 5.210 9.820 445 HH11 ARG 55 HH11 ARG 55 10.165 5.560 6.372 446 HH12 ARG 55 HH12 ARG 55 9.647 7.209 6.506 447 HH21 ARG 55 HH21 ARG 55 10.070 7.371 9.986 448 HH22 ARG 55 HH22 ARG 55 9.595 8.238 8.558 449 H GLN 56 HN GLN 56 8.306 2.291 10.577 450 HA GLN 56 HA GLN 56 7.254 3.926 12.684 451 HB2 GLN 56 HB2 GLN 56 8.414 5.664 11.448 452 HB3 GLN 56 HB1 GLN 56 7.666 5.135 9.946 453 HG2 GLN 56 HG2 GLN 56 6.486 7.046 10.579 454 HG3 GLN 56 HG1 GLN 56 5.442 5.704 11.038 455 HE21 GLN 56 HE21 GLN 56 5.589 8.462 12.033 456 HE22 GLN 56 HE22 GLN 56 5.822 8.327 13.741 457 H THR 57 HN THR 57 5.350 2.955 12.970 458 HA THR 57 HA THR 57 3.933 1.930 10.629 459 HB THR 57 HB THR 57 4.125 0.357 12.457 460 HG1 THR 57 HG1 THR 57 1.972 0.825 11.242 461 HG21 THR 57 HG21 THR 57 2.891 2.545 14.107 462 HG22 THR 57 HG22 THR 57 4.394 1.670 14.396 463 HG23 THR 57 HG23 THR 57 2.845 0.856 14.605 464 H VAL 58 HN VAL 58 2.300 3.008 9.733 465 HA VAL 58 HA VAL 58 1.089 5.187 11.318 466 HB VAL 58 HB VAL 58 0.634 6.340 9.161 467 HG11 VAL 58 HG11 VAL 58 3.553 5.799 9.688 468 HG12 VAL 58 HG12 VAL 58 2.551 6.935 10.590 469 HG13 VAL 58 HG13 VAL 58 2.877 7.211 8.879 470 HG21 VAL 58 HG21 VAL 58 0.757 4.412 7.670 471 HG22 VAL 58 HG22 VAL 58 2.481 4.250 8.010 472 HG23 VAL 58 HG23 VAL 58 1.879 5.676 7.165 473 H THR 59 HN THR 59 -1.108 5.754 10.808 474 HA THR 59 HA THR 59 -2.702 3.430 9.930 475 HB THR 59 HB THR 59 -3.866 5.639 11.595 476 HG1 THR 59 HG1 THR 59 -2.232 3.497 12.552 477 HG21 THR 59 HG21 THR 59 -4.341 2.659 11.603 478 HG22 THR 59 HG22 THR 59 -5.243 3.802 10.610 479 HG23 THR 59 HG23 THR 59 -5.331 3.903 12.370 480 H ASN 60 HN ASN 60 -3.763 3.712 8.069 481 HA ASN 60 HA ASN 60 -4.355 6.475 7.165 482 HB2 ASN 60 HB2 ASN 60 -3.661 3.992 5.564 483 HB3 ASN 60 HB1 ASN 60 -4.309 5.461 4.841 484 HD21 ASN 60 HD21 ASN 60 -1.542 3.938 6.250 485 HD22 ASN 60 HD22 ASN 60 -0.418 5.205 5.904 486 H SER 61 HN SER 61 -6.513 6.904 7.153 487 HA SER 61 HA SER 61 -8.352 4.621 6.787 488 HB2 SER 61 HB2 SER 61 -8.929 7.063 8.475 489 HB3 SER 61 HB1 SER 61 -9.888 5.587 8.349 490 HG SER 61 HG SER 61 -8.342 4.470 9.431 491 H PHE 62 HN PHE 62 -10.368 5.036 5.724 492 HA PHE 62 HA PHE 62 -10.858 7.585 4.507 493 HB2 PHE 62 HB2 PHE 62 -10.733 6.671 2.139 494 HB3 PHE 62 HB1 PHE 62 -9.197 7.003 2.924 495 HD1 PHE 62 HD1 PHE 62 -11.514 4.317 1.904 496 HD2 PHE 62 HD2 PHE 62 -7.614 5.302 3.287 497 HE1 PHE 62 HE1 PHE 62 -10.767 2.028 1.404 498 HE2 PHE 62 HE2 PHE 62 -6.857 3.014 2.798 499 HZ PHE 62 HZ PHE 62 -8.433 1.371 1.851 500 H THR 63 HN THR 63 -12.671 7.240 2.729 501 HA THR 63 HA THR 63 -14.503 5.157 3.720 502 HB THR 63 HB THR 63 -15.350 7.948 2.907 503 HG1 THR 63 HG1 THR 63 -14.538 6.866 5.371 504 HG21 THR 63 HG21 THR 63 -17.082 6.236 2.644 505 HG22 THR 63 HG22 THR 63 -17.474 7.328 3.973 506 HG23 THR 63 HG23 THR 63 -16.834 5.719 4.314 507 H LEU 64 HN LEU 64 -15.609 4.050 2.195 508 HA LEU 64 HA LEU 64 -14.645 3.916 -0.423 509 HB2 LEU 64 HB2 LEU 64 -17.203 2.946 0.830 510 HB3 LEU 64 HB1 LEU 64 -16.792 2.609 -0.839 511 HG LEU 64 HG LEU 64 -15.335 1.689 1.623 512 HD11 LEU 64 HD11 LEU 64 -17.224 0.335 1.226 513 HD12 LEU 64 HD12 LEU 64 -15.848 -0.555 0.576 514 HD13 LEU 64 HD13 LEU 64 -16.936 0.307 -0.513 515 HD21 LEU 64 HD21 LEU 64 -13.595 2.163 0.126 516 HD22 LEU 64 HD22 LEU 64 -14.523 1.606 -1.264 517 HD23 LEU 64 HD23 LEU 64 -13.914 0.442 -0.089 518 H GLY 65 HN GLY 65 -14.749 5.527 -1.825 519 HA2 GLY 65 HA2 GLY 65 -15.956 6.589 -3.560 520 HA3 GLY 65 HA1 GLY 65 -17.406 6.506 -2.576 521 H LYS 66 HN LYS 66 -14.733 7.591 -0.797 522 HA LYS 66 HA LYS 66 -15.295 10.393 -1.450 523 HB2 LYS 66 HB2 LYS 66 -15.682 9.047 1.176 524 HB3 LYS 66 HB1 LYS 66 -15.076 10.696 1.171 525 HG2 LYS 66 HG2 LYS 66 -17.025 11.444 -0.057 526 HG3 LYS 66 HG1 LYS 66 -17.622 9.786 -0.157 527 HD2 LYS 66 HD2 LYS 66 -18.809 10.798 1.609 528 HD3 LYS 66 HD1 LYS 66 -17.595 9.773 2.373 529 HE2 LYS 66 HE2 LYS 66 -16.135 11.816 2.544 530 HE3 LYS 66 HE1 LYS 66 -17.531 12.758 2.030 531 HZ1 LYS 66 HZ1 LYS 66 -17.273 12.703 4.448 532 HZ2 LYS 66 HZ2 LYS 66 -17.444 11.023 4.441 533 HZ3 LYS 66 HZ3 LYS 66 -18.734 12.007 3.961 534 H GLU 67 HN GLU 67 -13.642 11.837 -1.007 535 HA GLU 67 HA GLU 67 -11.004 10.683 -0.963 536 HB2 GLU 67 HB2 GLU 67 -11.639 12.591 -2.447 537 HB3 GLU 67 HB1 GLU 67 -11.807 13.600 -1.017 538 HG2 GLU 67 HG2 GLU 67 -9.454 13.299 -0.514 539 HG3 GLU 67 HG1 GLU 67 -9.275 12.237 -1.910 540 H ALA 68 HN ALA 68 -9.777 10.432 0.784 541 HA ALA 68 HA ALA 68 -10.450 12.021 3.167 542 HB1 ALA 68 HB1 ALA 68 -11.345 9.790 3.474 543 HB2 ALA 68 HB2 ALA 68 -9.986 10.061 4.567 544 HB3 ALA 68 HB3 ALA 68 -9.768 9.089 3.112 545 H ASP 69 HN ASP 69 -8.790 12.757 4.352 546 HA ASP 69 HA ASP 69 -6.217 12.863 3.109 547 HB2 ASP 69 HB2 ASP 69 -7.014 14.818 4.285 548 HB3 ASP 69 HB1 ASP 69 -7.239 13.891 5.762 549 H ILE 70 HN ILE 70 -4.543 11.587 3.452 550 HA ILE 70 HA ILE 70 -4.508 9.943 5.884 551 HB ILE 70 HB ILE 70 -3.437 8.113 4.461 552 HG12 ILE 70 HG12 ILE 70 -4.616 8.190 2.095 553 HG13 ILE 70 HG11 ILE 70 -4.479 9.931 2.334 554 HG21 ILE 70 HG21 ILE 70 -5.661 7.952 5.475 555 HG22 ILE 70 HG22 ILE 70 -5.566 7.114 3.929 556 HG23 ILE 70 HG23 ILE 70 -6.360 8.683 4.031 557 HD11 ILE 70 HD11 ILE 70 -2.043 9.634 2.686 558 HD12 ILE 70 HD12 ILE 70 -2.588 9.145 1.080 559 HD13 ILE 70 HD13 ILE 70 -2.232 7.925 2.300 560 H THR 71 HN THR 71 -2.268 9.064 6.326 561 HA THR 71 HA THR 71 -0.293 11.013 5.318 562 HB THR 71 HB THR 71 -0.256 9.951 8.127 563 HG1 THR 71 HG1 THR 71 -2.141 11.131 8.005 564 HG21 THR 71 HG21 THR 71 1.859 10.848 7.333 565 HG22 THR 71 HG22 THR 71 1.157 11.963 8.505 566 HG23 THR 71 HG23 THR 71 1.061 12.318 6.781 567 H THR 72 HN THR 72 1.240 10.066 4.257 568 HA THR 72 HA THR 72 1.765 7.264 4.420 569 HB THR 72 HB THR 72 2.074 8.301 2.281 570 HG1 THR 72 HG1 THR 72 4.601 8.049 2.200 571 HG21 THR 72 HG21 THR 72 4.324 10.000 3.287 572 HG22 THR 72 HG22 THR 72 2.660 10.572 3.402 573 HG23 THR 72 HG23 THR 72 3.348 10.181 1.829 574 H MET 73 HN MET 73 3.827 6.327 4.964 575 HA MET 73 HA MET 73 4.806 7.242 7.468 576 HB2 MET 73 HB2 MET 73 6.446 5.332 7.177 577 HB3 MET 73 HB1 MET 73 4.742 4.903 7.152 578 HG2 MET 73 HG2 MET 73 6.183 5.432 4.595 579 HG3 MET 73 HG1 MET 73 6.360 3.877 5.404 580 HE1 MET 73 HE1 MET 73 4.559 2.080 5.594 581 HE2 MET 73 HE2 MET 73 2.844 2.345 5.293 582 HE3 MET 73 HE3 MET 73 3.641 3.167 6.632 583 H ASP 74 HN ASP 74 5.585 8.191 4.345 584 HA ASP 74 HA ASP 74 8.373 8.716 4.982 585 HB2 ASP 74 HB2 ASP 74 8.722 9.296 2.739 586 HB3 ASP 74 HB1 ASP 74 7.592 7.959 2.676 587 H GLY 75 HN GLY 75 5.516 10.152 5.655 588 HA2 GLY 75 HA2 GLY 75 5.215 12.123 6.849 589 HA3 GLY 75 HA1 GLY 75 6.844 12.609 6.423 590 H LYS 76 HN LYS 76 4.169 11.734 4.265 591 HA LYS 76 HA LYS 76 4.140 14.512 3.317 592 HB2 LYS 76 HB2 LYS 76 4.383 11.983 1.767 593 HB3 LYS 76 HB1 LYS 76 3.457 13.301 1.071 594 HG2 LYS 76 HG2 LYS 76 5.621 14.679 1.737 595 HG3 LYS 76 HG1 LYS 76 6.362 13.085 1.573 596 HD2 LYS 76 HD2 LYS 76 4.644 14.412 -0.507 597 HD3 LYS 76 HD1 LYS 76 6.405 14.400 -0.516 598 HE2 LYS 76 HE2 LYS 76 4.594 11.988 -0.683 599 HE3 LYS 76 HE1 LYS 76 5.514 12.694 -2.010 600 HZ1 LYS 76 HZ1 LYS 76 6.594 11.361 0.416 601 HZ2 LYS 76 HZ2 LYS 76 7.546 12.211 -0.700 602 HZ3 LYS 76 HZ3 LYS 76 6.707 10.830 -1.190 603 H LYS 77 HN LYS 77 2.164 15.326 2.697 604 HA LYS 77 HA LYS 77 -0.116 13.857 3.753 605 HB2 LYS 77 HB2 LYS 77 0.463 16.716 3.159 606 HB3 LYS 77 HB1 LYS 77 -1.211 16.184 3.079 607 HG2 LYS 77 HG2 LYS 77 0.622 15.985 5.462 608 HG3 LYS 77 HG1 LYS 77 -0.742 17.084 5.259 609 HD2 LYS 77 HD2 LYS 77 -2.207 15.059 5.023 610 HD3 LYS 77 HD1 LYS 77 -0.822 14.087 5.521 611 HE2 LYS 77 HE2 LYS 77 -0.697 15.421 7.602 612 HE3 LYS 77 HE1 LYS 77 -2.158 16.274 7.107 613 HZ1 LYS 77 HZ1 LYS 77 -2.697 14.517 8.627 614 HZ2 LYS 77 HZ2 LYS 77 -1.920 13.367 7.661 615 HZ3 LYS 77 HZ3 LYS 77 -3.329 14.134 7.100 616 H LEU 78 HN LEU 78 -1.271 12.662 2.441 617 HA LEU 78 HA LEU 78 -1.699 13.585 -0.315 618 HB2 LEU 78 HB2 LEU 78 -1.356 10.686 0.429 619 HB3 LEU 78 HB1 LEU 78 -1.465 11.367 -1.177 620 HG LEU 78 HG LEU 78 0.843 11.905 0.690 621 HD11 LEU 78 HD11 LEU 78 0.648 9.503 0.134 622 HD12 LEU 78 HD12 LEU 78 2.101 10.259 -0.517 623 HD13 LEU 78 HD13 LEU 78 0.728 9.928 -1.574 624 HD21 LEU 78 HD21 LEU 78 0.726 13.602 -0.943 625 HD22 LEU 78 HD22 LEU 78 0.331 12.449 -2.217 626 HD23 LEU 78 HD23 LEU 78 1.949 12.463 -1.516 627 H LYS 79 HN LYS 79 -3.710 12.884 -1.223 628 HA LYS 79 HA LYS 79 -5.651 12.029 0.820 629 HB2 LYS 79 HB2 LYS 79 -6.085 13.938 -1.481 630 HB3 LYS 79 HB1 LYS 79 -7.337 13.372 -0.381 631 HG2 LYS 79 HG2 LYS 79 -6.233 14.428 1.482 632 HG3 LYS 79 HG1 LYS 79 -4.892 14.914 0.449 633 HD2 LYS 79 HD2 LYS 79 -6.630 16.169 -0.928 634 HD3 LYS 79 HD1 LYS 79 -7.718 15.910 0.438 635 HE2 LYS 79 HE2 LYS 79 -6.268 17.097 1.917 636 HE3 LYS 79 HE1 LYS 79 -4.999 17.167 0.695 637 HZ1 LYS 79 HZ1 LYS 79 -6.555 18.537 -0.658 638 HZ2 LYS 79 HZ2 LYS 79 -6.045 19.273 0.773 639 HZ3 LYS 79 HZ3 LYS 79 -7.593 18.601 0.675 640 H CYS 80 HN CYS 80 -6.619 10.183 0.425 641 HA CYS 80 HA CYS 80 -6.477 9.123 -2.309 642 HB2 CYS 80 HB2 CYS 80 -5.679 7.968 0.057 643 HB3 CYS 80 HB1 CYS 80 -7.271 7.258 -0.186 644 H THR 81 HN THR 81 -8.243 9.029 -3.457 645 HA THR 81 HA THR 81 -10.859 9.365 -2.189 646 HB THR 81 HB THR 81 -10.298 10.941 -3.961 647 HG1 THR 81 HG1 THR 81 -12.256 9.026 -4.757 648 HG21 THR 81 HG21 THR 81 -9.825 10.260 -6.210 649 HG22 THR 81 HG22 THR 81 -10.110 8.566 -5.798 650 HG23 THR 81 HG23 THR 81 -8.720 9.414 -5.121 651 H VAL 82 HN VAL 82 -9.722 6.969 -1.776 652 HA VAL 82 HA VAL 82 -10.047 4.914 -3.564 653 HB VAL 82 HB VAL 82 -10.744 4.475 -0.693 654 HG11 VAL 82 HG11 VAL 82 -9.193 2.487 -1.193 655 HG12 VAL 82 HG12 VAL 82 -9.403 2.943 -2.889 656 HG13 VAL 82 HG13 VAL 82 -10.805 2.506 -1.911 657 HG21 VAL 82 HG21 VAL 82 -8.932 5.774 -0.230 658 HG22 VAL 82 HG22 VAL 82 -8.162 5.463 -1.782 659 HG23 VAL 82 HG23 VAL 82 -8.122 4.236 -0.515 660 H HIS 83 HN HIS 83 -11.649 3.787 -4.386 661 HA HIS 83 HA HIS 83 -14.283 3.862 -3.136 662 HB2 HIS 83 HB2 HIS 83 -15.370 4.324 -5.334 663 HB3 HIS 83 HB1 HIS 83 -14.423 5.669 -4.740 664 HD1 HIS 83 HD1 HIS 83 -14.739 3.374 -7.608 665 HD2 HIS 83 HD2 HIS 83 -11.984 6.143 -6.177 666 HE1 HIS 83 HE1 HIS 83 -13.180 3.827 -9.525 667 HE2 HIS 83 HE2 HIS 83 -11.630 5.621 -8.680 668 H LEU 84 HN LEU 84 -15.563 2.110 -3.569 669 HA LEU 84 HA LEU 84 -14.124 -0.223 -4.524 670 HB2 LEU 84 HB2 LEU 84 -15.392 -0.273 -2.393 671 HB3 LEU 84 HB1 LEU 84 -16.875 -0.008 -3.297 672 HG LEU 84 HG LEU 84 -16.334 -2.171 -4.535 673 HD11 LEU 84 HD11 LEU 84 -13.989 -2.341 -3.899 674 HD12 LEU 84 HD12 LEU 84 -14.901 -3.746 -3.352 675 HD13 LEU 84 HD13 LEU 84 -14.450 -2.488 -2.203 676 HD21 LEU 84 HD21 LEU 84 -17.188 -3.552 -2.647 677 HD22 LEU 84 HD22 LEU 84 -18.119 -2.085 -2.945 678 HD23 LEU 84 HD23 LEU 84 -16.986 -2.153 -1.595 679 H ALA 85 HN ALA 85 -14.287 -0.890 -6.540 680 HA ALA 85 HA ALA 85 -16.767 -0.333 -8.024 681 HB1 ALA 85 HB1 ALA 85 -13.972 -0.148 -9.139 682 HB2 ALA 85 HB2 ALA 85 -14.970 1.232 -8.683 683 HB3 ALA 85 HB3 ALA 85 -15.476 0.176 -10.005 684 H ASN 86 HN ASN 86 -17.671 -2.286 -8.228 685 HA ASN 86 HA ASN 86 -18.023 -4.432 -8.865 686 HB2 ASN 86 HB2 ASN 86 -15.421 -4.187 -10.392 687 HB3 ASN 86 HB1 ASN 86 -16.680 -5.387 -10.653 688 HD21 ASN 86 HD21 ASN 86 -15.569 -2.254 -11.348 689 HD22 ASN 86 HD22 ASN 86 -16.874 -1.761 -12.366 690 H GLY 87 HN GLY 87 -16.631 -3.904 -6.421 691 HA2 GLY 87 HA2 GLY 87 -15.863 -5.326 -4.747 692 HA3 GLY 87 HA1 GLY 87 -15.569 -6.558 -5.967 693 H LYS 88 HN LYS 88 -14.205 -3.923 -7.213 694 HA LYS 88 HA LYS 88 -11.547 -4.608 -6.169 695 HB2 LYS 88 HB2 LYS 88 -11.292 -4.794 -8.426 696 HB3 LYS 88 HB1 LYS 88 -12.625 -3.707 -8.771 697 HG2 LYS 88 HG2 LYS 88 -11.150 -2.163 -9.330 698 HG3 LYS 88 HG1 LYS 88 -10.616 -2.115 -7.648 699 HD2 LYS 88 HD2 LYS 88 -9.059 -3.978 -8.140 700 HD3 LYS 88 HD1 LYS 88 -9.543 -3.888 -9.837 701 HE2 LYS 88 HE2 LYS 88 -8.472 -1.500 -8.365 702 HE3 LYS 88 HE1 LYS 88 -7.404 -2.672 -9.135 703 HZ1 LYS 88 HZ1 LYS 88 -9.560 -1.192 -10.552 704 HZ2 LYS 88 HZ2 LYS 88 -8.408 -2.213 -11.250 705 HZ3 LYS 88 HZ3 LYS 88 -7.924 -0.743 -10.563 706 H LEU 89 HN LEU 89 -10.199 -3.023 -5.308 707 HA LEU 89 HA LEU 89 -11.597 -0.557 -4.571 708 HB2 LEU 89 HB2 LEU 89 -10.331 -2.244 -2.946 709 HB3 LEU 89 HB1 LEU 89 -8.955 -1.257 -3.397 710 HG LEU 89 HG LEU 89 -9.883 0.676 -2.444 711 HD11 LEU 89 HD11 LEU 89 -12.458 -0.839 -2.543 712 HD12 LEU 89 HD12 LEU 89 -12.086 0.780 -3.142 713 HD13 LEU 89 HD13 LEU 89 -12.248 0.495 -1.408 714 HD21 LEU 89 HD21 LEU 89 -10.497 -1.685 -0.682 715 HD22 LEU 89 HD22 LEU 89 -10.481 -0.009 -0.131 716 HD23 LEU 89 HD23 LEU 89 -8.999 -0.750 -0.741 717 H VAL 90 HN VAL 90 -11.097 1.301 -5.516 718 HA VAL 90 HA VAL 90 -8.491 1.472 -6.897 719 HB VAL 90 HB VAL 90 -11.059 2.714 -7.869 720 HG11 VAL 90 HG11 VAL 90 -8.343 2.432 -9.158 721 HG12 VAL 90 HG12 VAL 90 -9.078 3.922 -8.560 722 HG13 VAL 90 HG13 VAL 90 -9.784 3.081 -9.939 723 HG21 VAL 90 HG21 VAL 90 -10.976 1.015 -9.676 724 HG22 VAL 90 HG22 VAL 90 -11.304 0.339 -8.080 725 HG23 VAL 90 HG23 VAL 90 -9.694 0.190 -8.788 726 H CYS 91 HN CYS 91 -7.309 3.216 -6.482 727 HA CYS 91 HA CYS 91 -8.636 5.644 -5.533 728 HB2 CYS 91 HB2 CYS 91 -7.637 4.494 -3.528 729 HB3 CYS 91 HB1 CYS 91 -6.056 4.639 -4.301 730 H LYS 92 HN LYS 92 -8.394 6.498 -7.556 731 HA LYS 92 HA LYS 92 -5.637 6.761 -8.509 732 HB2 LYS 92 HB2 LYS 92 -7.061 5.752 -10.157 733 HB3 LYS 92 HB1 LYS 92 -8.285 6.997 -9.947 734 HG2 LYS 92 HG2 LYS 92 -6.529 8.637 -10.775 735 HG3 LYS 92 HG1 LYS 92 -5.599 7.224 -11.268 736 HD2 LYS 92 HD2 LYS 92 -8.354 8.003 -12.198 737 HD3 LYS 92 HD1 LYS 92 -6.868 8.020 -13.148 738 HE2 LYS 92 HE2 LYS 92 -6.702 5.592 -12.942 739 HE3 LYS 92 HE1 LYS 92 -8.181 5.570 -11.976 740 HZ1 LYS 92 HZ1 LYS 92 -9.030 6.852 -14.142 741 HZ2 LYS 92 HZ2 LYS 92 -9.108 5.173 -13.973 742 HZ3 LYS 92 HZ3 LYS 92 -7.842 5.876 -14.850 743 H SER 93 HN SER 93 -4.733 8.721 -8.850 744 HA SER 93 HA SER 93 -6.216 11.010 -7.762 745 HB2 SER 93 HB2 SER 93 -3.583 11.814 -7.962 746 HB3 SER 93 HB1 SER 93 -4.332 11.158 -6.506 747 HG SER 93 HG SER 93 -3.290 9.338 -6.772 748 H GLU 94 HN GLU 94 -4.716 13.077 -8.844 749 HA GLU 94 HA GLU 94 -5.726 13.077 -11.536 750 HB2 GLU 94 HB2 GLU 94 -5.780 15.295 -11.328 751 HB3 GLU 94 HB1 GLU 94 -5.411 15.022 -9.637 752 HG2 GLU 94 HG2 GLU 94 -3.187 15.283 -11.596 753 HG3 GLU 94 HG1 GLU 94 -4.055 16.711 -11.049 754 H LYS 95 HN LYS 95 -2.885 12.093 -10.108 755 HA LYS 95 HA LYS 95 -1.444 12.316 -12.660 756 HB2 LYS 95 HB2 LYS 95 -0.731 13.941 -10.792 757 HB3 LYS 95 HB1 LYS 95 -0.037 12.522 -10.015 758 HG2 LYS 95 HG2 LYS 95 1.301 12.140 -12.065 759 HG3 LYS 95 HG1 LYS 95 0.677 13.659 -12.710 760 HD2 LYS 95 HD2 LYS 95 2.108 13.487 -10.065 761 HD3 LYS 95 HD1 LYS 95 2.956 13.749 -11.591 762 HE2 LYS 95 HE2 LYS 95 2.638 15.921 -10.993 763 HE3 LYS 95 HE1 LYS 95 1.116 15.655 -11.838 764 HZ1 LYS 95 HZ1 LYS 95 1.398 15.263 -8.916 765 HZ2 LYS 95 HZ2 LYS 95 -0.035 15.425 -9.815 766 HZ3 LYS 95 HZ3 LYS 95 0.991 16.754 -9.593 767 H PHE 96 HN PHE 96 -2.061 10.461 -9.745 768 HA PHE 96 HA PHE 96 -0.507 8.230 -10.894 769 HB2 PHE 96 HB2 PHE 96 -1.088 8.458 -7.956 770 HB3 PHE 96 HB1 PHE 96 0.199 7.572 -8.768 771 HD1 PHE 96 HD1 PHE 96 -0.888 10.829 -7.512 772 HD2 PHE 96 HD2 PHE 96 2.223 8.691 -9.480 773 HE1 PHE 96 HE1 PHE 96 0.648 12.709 -7.117 774 HE2 PHE 96 HE2 PHE 96 3.761 10.562 -9.083 775 HZ PHE 96 HZ PHE 96 2.978 12.576 -7.901 776 H SER 97 HN SER 97 -1.291 6.081 -9.725 777 HA SER 97 HA SER 97 -4.138 5.982 -9.273 778 HB2 SER 97 HB2 SER 97 -3.895 3.999 -11.196 779 HB3 SER 97 HB1 SER 97 -4.697 5.555 -11.398 780 HG SER 97 HG SER 97 -1.994 4.925 -12.005 781 H HIS 98 HN HIS 98 -4.584 4.458 -7.834 782 HA HIS 98 HA HIS 98 -2.615 2.304 -7.418 783 HB2 HIS 98 HB2 HIS 98 -2.972 3.951 -5.523 784 HB3 HIS 98 HB1 HIS 98 -4.618 3.348 -5.402 785 HD2 HIS 98 HD2 HIS 98 -4.115 0.170 -5.447 786 HE1 HIS 98 HE1 HIS 98 -1.298 0.929 -2.377 787 HE2 HIS 98 HE2 HIS 98 -2.607 -0.877 -3.590 788 H GLU 99 HN GLU 99 -3.281 0.408 -8.169 789 HA GLU 99 HA GLU 99 -6.196 -0.100 -8.345 790 HB2 GLU 99 HB2 GLU 99 -4.089 -1.637 -9.820 791 HB3 GLU 99 HB1 GLU 99 -5.790 -1.413 -10.234 792 HG2 GLU 99 HG2 GLU 99 -3.897 0.877 -10.117 793 HG3 GLU 99 HG1 GLU 99 -4.007 -0.143 -11.556 794 H GLN 100 HN GLN 100 -6.599 -1.060 -6.338 795 HA GLN 100 HA GLN 100 -5.025 -3.443 -5.670 796 HB2 GLN 100 HB2 GLN 100 -5.435 -1.584 -3.979 797 HB3 GLN 100 HB1 GLN 100 -7.113 -2.110 -3.949 798 HG2 GLN 100 HG2 GLN 100 -6.539 -4.209 -3.046 799 HG3 GLN 100 HG1 GLN 100 -4.828 -3.961 -3.376 800 HE21 GLN 100 HE21 GLN 100 -3.601 -2.682 -2.022 801 HE22 GLN 100 HE22 GLN 100 -4.185 -2.162 -0.476 802 H GLU 101 HN GLU 101 -5.804 -5.319 -6.403 803 HA GLU 101 HA GLU 101 -8.733 -5.649 -6.496 804 HB2 GLU 101 HB2 GLU 101 -7.522 -5.507 -8.741 805 HB3 GLU 101 HB1 GLU 101 -6.805 -7.061 -8.332 806 HG2 GLU 101 HG2 GLU 101 -9.050 -8.035 -8.145 807 HG3 GLU 101 HG1 GLU 101 -9.748 -6.481 -8.605 808 H VAL 102 HN VAL 102 -9.589 -7.518 -5.712 809 HA VAL 102 HA VAL 102 -7.704 -9.389 -4.446 810 HB VAL 102 HB VAL 102 -10.464 -8.577 -3.496 811 HG11 VAL 102 HG11 VAL 102 -10.127 -10.938 -3.087 812 HG12 VAL 102 HG12 VAL 102 -10.021 -10.050 -1.566 813 HG13 VAL 102 HG13 VAL 102 -8.551 -10.616 -2.363 814 HG21 VAL 102 HG21 VAL 102 -7.760 -8.199 -2.230 815 HG22 VAL 102 HG22 VAL 102 -9.309 -7.676 -1.567 816 HG23 VAL 102 HG23 VAL 102 -8.693 -6.946 -3.050 817 H LYS 103 HN LYS 103 -7.731 -11.353 -5.296 818 HA LYS 103 HA LYS 103 -10.245 -12.344 -6.462 819 HB2 LYS 103 HB2 LYS 103 -7.594 -12.085 -7.692 820 HB3 LYS 103 HB1 LYS 103 -8.313 -13.678 -7.876 821 HG2 LYS 103 HG2 LYS 103 -10.313 -12.669 -8.851 822 HG3 LYS 103 HG1 LYS 103 -9.594 -11.071 -8.663 823 HD2 LYS 103 HD2 LYS 103 -7.801 -11.666 -10.190 824 HD3 LYS 103 HD1 LYS 103 -8.440 -13.308 -10.323 825 HE2 LYS 103 HE2 LYS 103 -9.026 -11.726 -12.214 826 HE3 LYS 103 HE1 LYS 103 -10.379 -12.566 -11.456 827 HZ1 LYS 103 HZ1 LYS 103 -10.786 -10.177 -11.847 828 HZ2 LYS 103 HZ2 LYS 103 -9.535 -9.797 -10.769 829 HZ3 LYS 103 HZ3 LYS 103 -10.917 -10.610 -10.218 830 H GLY 104 HN GLY 104 -10.849 -13.656 -4.832 831 HA2 GLY 104 HA2 GLY 104 -10.914 -15.657 -3.692 832 HA3 GLY 104 HA1 GLY 104 -9.429 -16.123 -4.512 833 H ASN 105 HN ASN 105 -7.643 -16.236 -3.322 834 HA ASN 105 HA ASN 105 -7.645 -14.898 -0.689 835 HB2 ASN 105 HB2 ASN 105 -6.665 -17.553 -1.614 836 HB3 ASN 105 HB1 ASN 105 -5.713 -16.734 -0.385 837 HD21 ASN 105 HD21 ASN 105 -8.710 -18.283 -1.126 838 HD22 ASN 105 HD22 ASN 105 -9.289 -18.395 0.497 839 H GLU 106 HN GLU 106 -6.741 -14.042 -3.482 840 HA GLU 106 HA GLU 106 -4.028 -13.239 -2.678 841 HB2 GLU 106 HB2 GLU 106 -4.925 -14.092 -5.434 842 HB3 GLU 106 HB1 GLU 106 -3.368 -13.353 -5.081 843 HG2 GLU 106 HG2 GLU 106 -2.570 -15.220 -4.013 844 HG3 GLU 106 HG1 GLU 106 -4.182 -15.806 -3.604 845 H MET 107 HN MET 107 -3.733 -11.152 -2.624 846 HA MET 107 HA MET 107 -5.559 -9.391 -4.126 847 HB2 MET 107 HB2 MET 107 -5.756 -9.137 -1.679 848 HB3 MET 107 HB1 MET 107 -4.029 -8.831 -1.570 849 HG2 MET 107 HG2 MET 107 -4.233 -6.767 -2.713 850 HG3 MET 107 HG1 MET 107 -5.906 -7.105 -3.157 851 HE1 MET 107 HE1 MET 107 -3.543 -7.044 -0.143 852 HE2 MET 107 HE2 MET 107 -4.370 -6.024 1.037 853 HE3 MET 107 HE3 MET 107 -3.662 -5.307 -0.417 854 H VAL 108 HN VAL 108 -4.580 -8.547 -5.855 855 HA VAL 108 HA VAL 108 -1.700 -7.980 -5.636 856 HB VAL 108 HB VAL 108 -1.485 -8.450 -8.061 857 HG11 VAL 108 HG11 VAL 108 -0.890 -10.138 -6.386 858 HG12 VAL 108 HG12 VAL 108 -1.492 -10.874 -7.870 859 HG13 VAL 108 HG13 VAL 108 -2.535 -10.772 -6.452 860 HG21 VAL 108 HG21 VAL 108 -3.766 -8.134 -8.789 861 HG22 VAL 108 HG22 VAL 108 -4.311 -9.474 -7.780 862 HG23 VAL 108 HG23 VAL 108 -3.263 -9.782 -9.165 863 H GLU 109 HN GLU 109 -1.090 -5.963 -6.112 864 HA GLU 109 HA GLU 109 -2.980 -4.299 -7.630 865 HB2 GLU 109 HB2 GLU 109 -2.496 -2.388 -6.243 866 HB3 GLU 109 HB1 GLU 109 -3.098 -3.712 -5.241 867 HG2 GLU 109 HG2 GLU 109 -0.378 -4.087 -5.173 868 HG3 GLU 109 HG1 GLU 109 -0.543 -2.332 -5.182 869 H THR 110 HN THR 110 -2.112 -2.525 -8.686 870 HA THR 110 HA THR 110 0.767 -2.602 -9.247 871 HB THR 110 HB THR 110 -1.382 -2.113 -11.321 872 HG1 THR 110 HG1 THR 110 -0.486 -4.440 -10.310 873 HG21 THR 110 HG21 THR 110 0.914 -1.065 -11.586 874 HG22 THR 110 HG22 THR 110 0.363 -2.090 -12.911 875 HG23 THR 110 HG23 THR 110 1.537 -2.711 -11.747 876 H ILE 111 HN ILE 111 1.317 -0.797 -8.136 877 HA ILE 111 HA ILE 111 -0.350 1.603 -8.475 878 HB ILE 111 HB ILE 111 1.956 1.586 -6.575 879 HG12 ILE 111 HG12 ILE 111 -0.616 0.277 -5.737 880 HG13 ILE 111 HG11 ILE 111 0.688 -0.676 -6.438 881 HG21 ILE 111 HG21 ILE 111 -0.871 2.616 -6.463 882 HG22 ILE 111 HG22 ILE 111 0.599 3.558 -6.711 883 HG23 ILE 111 HG23 ILE 111 0.300 2.778 -5.157 884 HD11 ILE 111 HD11 ILE 111 2.184 0.140 -4.648 885 HD12 ILE 111 HD12 ILE 111 0.808 -0.789 -4.050 886 HD13 ILE 111 HD13 ILE 111 0.803 0.973 -3.927 887 H THR 112 HN THR 112 1.128 3.678 -8.444 888 HA THR 112 HA THR 112 3.762 3.392 -9.624 889 HB THR 112 HB THR 112 1.628 4.837 -11.220 890 HG1 THR 112 HG1 THR 112 2.314 2.200 -11.166 891 HG21 THR 112 HG21 THR 112 3.905 5.754 -11.368 892 HG22 THR 112 HG22 THR 112 3.395 5.025 -12.896 893 HG23 THR 112 HG23 THR 112 4.508 4.163 -11.831 894 H PHE 113 HN PHE 113 4.758 4.740 -8.228 895 HA PHE 113 HA PHE 113 3.804 7.505 -8.079 896 HB2 PHE 113 HB2 PHE 113 4.166 5.630 -5.790 897 HB3 PHE 113 HB1 PHE 113 4.640 7.307 -5.566 898 HD1 PHE 113 HD1 PHE 113 2.954 9.092 -5.670 899 HD2 PHE 113 HD2 PHE 113 1.865 4.988 -5.929 900 HE1 PHE 113 HE1 PHE 113 0.622 9.683 -5.163 901 HE2 PHE 113 HE2 PHE 113 -0.476 5.572 -5.436 902 HZ PHE 113 HZ PHE 113 -1.096 7.922 -5.041 903 H GLY 114 HN GLY 114 5.431 9.021 -7.877 904 HA2 GLY 114 HA2 GLY 114 7.545 9.883 -8.071 905 HA3 GLY 114 HA1 GLY 114 8.099 8.476 -7.176 906 H GLY 115 HN GLY 115 6.367 7.925 -10.088 907 HA2 GLY 115 HA2 GLY 115 7.109 7.517 -12.267 908 HA3 GLY 115 HA1 GLY 115 8.761 7.788 -11.736 909 H VAL 116 HN VAL 116 7.316 5.735 -9.544 910 HA VAL 116 HA VAL 116 8.381 3.386 -10.970 911 HB VAL 116 HB VAL 116 8.204 3.583 -7.977 912 HG11 VAL 116 HG11 VAL 116 9.892 1.807 -8.069 913 HG12 VAL 116 HG12 VAL 116 9.835 1.855 -9.832 914 HG13 VAL 116 HG13 VAL 116 8.414 1.348 -8.917 915 HG21 VAL 116 HG21 VAL 116 10.683 4.046 -8.094 916 HG22 VAL 116 HG22 VAL 116 9.622 5.388 -8.522 917 HG23 VAL 116 HG23 VAL 116 10.433 4.463 -9.789 918 H THR 117 HN THR 117 7.027 1.881 -11.457 919 HA THR 117 HA THR 117 4.304 1.885 -10.437 920 HB THR 117 HB THR 117 4.481 1.698 -12.789 921 HG1 THR 117 HG1 THR 117 3.995 -0.868 -11.638 922 HG21 THR 117 HG21 THR 117 6.586 1.139 -13.322 923 HG22 THR 117 HG22 THR 117 5.857 -0.460 -13.532 924 HG23 THR 117 HG23 THR 117 6.686 -0.047 -12.019 925 H LEU 118 HN LEU 118 5.229 1.190 -8.319 926 HA LEU 118 HA LEU 118 6.362 -1.321 -7.925 927 HB2 LEU 118 HB2 LEU 118 6.363 0.411 -6.184 928 HB3 LEU 118 HB1 LEU 118 4.635 0.190 -5.966 929 HG LEU 118 HG LEU 118 4.919 -1.996 -5.083 930 HD11 LEU 118 HD11 LEU 118 7.227 -3.008 -4.914 931 HD12 LEU 118 HD12 LEU 118 7.744 -1.787 -6.082 932 HD13 LEU 118 HD13 LEU 118 6.510 -2.963 -6.525 933 HD21 LEU 118 HD21 LEU 118 5.548 -0.040 -3.599 934 HD22 LEU 118 HD22 LEU 118 7.225 -0.491 -3.898 935 HD23 LEU 118 HD23 LEU 118 6.135 -1.627 -3.107 936 H ILE 119 HN ILE 119 5.595 -3.225 -8.269 937 HA ILE 119 HA ILE 119 2.672 -3.632 -8.220 938 HB ILE 119 HB ILE 119 4.694 -5.519 -9.425 939 HG12 ILE 119 HG12 ILE 119 3.296 -3.146 -10.660 940 HG13 ILE 119 HG11 ILE 119 5.023 -3.476 -10.614 941 HG21 ILE 119 HG21 ILE 119 2.647 -6.618 -9.122 942 HG22 ILE 119 HG22 ILE 119 2.611 -6.083 -10.803 943 HG23 ILE 119 HG23 ILE 119 1.713 -5.190 -9.576 944 HD11 ILE 119 HD11 ILE 119 4.377 -5.572 -12.008 945 HD12 ILE 119 HD12 ILE 119 4.497 -3.995 -12.785 946 HD13 ILE 119 HD13 ILE 119 2.913 -4.650 -12.360 947 H ARG 120 HN ARG 120 1.892 -4.582 -6.451 948 HA ARG 120 HA ARG 120 3.716 -6.324 -4.942 949 HB2 ARG 120 HB2 ARG 120 1.449 -4.613 -3.936 950 HB3 ARG 120 HB1 ARG 120 2.297 -5.801 -2.953 951 HG2 ARG 120 HG2 ARG 120 3.510 -3.366 -4.240 952 HG3 ARG 120 HG1 ARG 120 3.132 -3.563 -2.530 953 HD2 ARG 120 HD2 ARG 120 5.013 -5.377 -4.007 954 HD3 ARG 120 HD1 ARG 120 5.547 -3.905 -3.210 955 HE ARG 120 HE ARG 120 4.187 -5.274 -1.276 956 HH11 ARG 120 HH11 ARG 120 6.869 -6.029 -3.401 957 HH12 ARG 120 HH12 ARG 120 7.666 -7.063 -2.258 958 HH21 ARG 120 HH21 ARG 120 5.260 -6.635 0.258 959 HH22 ARG 120 HH22 ARG 120 6.744 -7.418 -0.185 960 H ARG 121 HN ARG 121 3.056 -8.216 -4.194 961 HA ARG 121 HA ARG 121 0.416 -9.175 -5.011 962 HB2 ARG 121 HB2 ARG 121 3.126 -10.403 -5.270 963 HB3 ARG 121 HB1 ARG 121 1.751 -11.462 -4.966 964 HG2 ARG 121 HG2 ARG 121 1.068 -11.297 -7.051 965 HG3 ARG 121 HG1 ARG 121 1.173 -9.540 -7.025 966 HD2 ARG 121 HD2 ARG 121 3.577 -11.302 -7.324 967 HD3 ARG 121 HD1 ARG 121 2.633 -10.752 -8.709 968 HE ARG 121 HE ARG 121 3.468 -8.638 -6.945 969 HH11 ARG 121 HH11 ARG 121 4.270 -10.563 -9.760 970 HH12 ARG 121 HH12 ARG 121 5.457 -9.447 -10.354 971 HH21 ARG 121 HH21 ARG 121 5.055 -7.139 -7.761 972 HH22 ARG 121 HH22 ARG 121 5.908 -7.522 -9.233 973 H SER 122 HN SER 122 -0.773 -9.712 -3.355 974 HA SER 122 HA SER 122 0.580 -10.447 -0.845 975 HB2 SER 122 HB2 SER 122 -0.797 -8.175 -1.124 976 HB3 SER 122 HB1 SER 122 -2.133 -9.247 -0.718 977 HG SER 122 HG SER 122 -0.936 -8.153 1.052 978 H LYS 123 HN LYS 123 -0.245 -12.082 0.366 979 HA LYS 123 HA LYS 123 -2.451 -13.600 -0.846 980 HB2 LYS 123 HB2 LYS 123 -1.288 -15.646 0.119 981 HB3 LYS 123 HB1 LYS 123 -0.521 -14.897 -1.276 982 HG2 LYS 123 HG2 LYS 123 1.360 -14.659 -0.142 983 HG3 LYS 123 HG1 LYS 123 0.532 -13.717 1.104 984 HD2 LYS 123 HD2 LYS 123 0.083 -15.630 2.392 985 HD3 LYS 123 HD1 LYS 123 0.399 -16.724 1.048 986 HE2 LYS 123 HE2 LYS 123 2.768 -16.132 1.124 987 HE3 LYS 123 HE1 LYS 123 2.453 -15.026 2.458 988 HZ1 LYS 123 HZ1 LYS 123 3.304 -17.112 3.274 989 HZ2 LYS 123 HZ2 LYS 123 2.071 -17.969 2.503 990 HZ3 LYS 123 HZ3 LYS 123 1.701 -16.926 3.784 991 H ARG 124 HN ARG 124 -4.006 -14.340 0.472 992 HA ARG 124 HA ARG 124 -4.121 -13.228 3.118 993 HB2 ARG 124 HB2 ARG 124 -6.039 -13.739 1.317 994 HB3 ARG 124 HB1 ARG 124 -6.120 -15.241 2.221 995 HG2 ARG 124 HG2 ARG 124 -6.573 -14.063 4.264 996 HG3 ARG 124 HG1 ARG 124 -6.333 -12.510 3.466 997 HD2 ARG 124 HD2 ARG 124 -8.690 -12.941 3.720 998 HD3 ARG 124 HD1 ARG 124 -8.266 -12.988 2.011 999 HE ARG 124 HE ARG 124 -8.114 -15.590 2.924 1000 HH11 ARG 124 HH11 ARG 124 -10.572 -13.104 2.632 1001 HH12 ARG 124 HH12 ARG 124 -11.880 -14.234 2.470 1002 HH21 ARG 124 HH21 ARG 124 -9.825 -17.083 2.723 1003 HH22 ARG 124 HH22 ARG 124 -11.454 -16.506 2.539 1004 H VAL 125 HN VAL 125 -4.216 -14.375 5.054 1005 HA VAL 125 HA VAL 125 -3.739 -17.224 5.035 1006 HB VAL 125 HB VAL 125 -1.462 -16.475 4.788 1007 HG11 VAL 125 HG11 VAL 125 -2.128 -14.576 7.005 1008 HG12 VAL 125 HG12 VAL 125 -1.476 -14.222 5.402 1009 HG13 VAL 125 HG13 VAL 125 -0.464 -15.011 6.613 1010 HG21 VAL 125 HG21 VAL 125 -1.823 -17.099 7.706 1011 HG22 VAL 125 HG22 VAL 125 -0.435 -17.481 6.685 1012 HG23 VAL 125 HG23 VAL 125 -1.973 -18.306 6.431 Start of MODEL 20 1 H1 ALA 1 HT1 ALA 1 -15.205 -9.763 1.167 2 H2 ALA 1 HT2 ALA 1 -14.028 -9.830 2.378 3 H3 ALA 1 HT3 ALA 1 -13.612 -10.163 0.774 4 HA ALA 1 HA ALA 1 -14.087 -7.913 0.130 5 HB1 ALA 1 HB1 ALA 1 -15.779 -7.164 1.512 6 HB2 ALA 1 HB2 ALA 1 -14.378 -6.320 2.176 7 HB3 ALA 1 HB3 ALA 1 -14.991 -7.767 2.972 8 H PHE 2 HN PHE 2 -12.708 -5.917 1.047 9 HA PHE 2 HA PHE 2 -10.016 -6.828 1.128 10 HB2 PHE 2 HB2 PHE 2 -11.322 -4.139 1.367 11 HB3 PHE 2 HB1 PHE 2 -9.601 -4.318 1.688 12 HD1 PHE 2 HD1 PHE 2 -12.100 -5.315 -0.925 13 HD2 PHE 2 HD2 PHE 2 -8.165 -3.924 -0.064 14 HE1 PHE 2 HE1 PHE 2 -11.636 -5.125 -3.338 15 HE2 PHE 2 HE2 PHE 2 -7.707 -3.730 -2.479 16 HZ PHE 2 HZ PHE 2 -9.439 -4.339 -4.112 17 H SER 3 HN SER 3 -12.343 -6.148 3.559 18 HA SER 3 HA SER 3 -10.754 -5.498 5.762 19 HB2 SER 3 HB2 SER 3 -12.944 -7.243 6.479 20 HB3 SER 3 HB1 SER 3 -12.773 -5.507 6.743 21 HG SER 3 HG SER 3 -14.569 -6.314 5.337 22 H GLY 4 HN GLY 4 -8.887 -6.693 6.043 23 HA2 GLY 4 HA2 GLY 4 -8.973 -9.128 7.375 24 HA3 GLY 4 HA1 GLY 4 -8.739 -9.495 5.672 25 H THR 5 HN THR 5 -6.734 -10.418 6.353 26 HA THR 5 HA THR 5 -4.647 -8.371 6.676 27 HB THR 5 HB THR 5 -3.353 -10.349 7.731 28 HG1 THR 5 HG1 THR 5 -4.645 -12.086 7.703 29 HG21 THR 5 HG21 THR 5 -3.807 -8.448 9.056 30 HG22 THR 5 HG22 THR 5 -4.397 -9.825 9.988 31 HG23 THR 5 HG23 THR 5 -5.534 -8.800 9.108 32 H TRP 6 HN TRP 6 -3.402 -8.248 4.937 33 HA TRP 6 HA TRP 6 -3.058 -10.666 3.273 34 HB2 TRP 6 HB2 TRP 6 -2.782 -7.847 2.281 35 HB3 TRP 6 HB1 TRP 6 -3.048 -9.323 1.352 36 HD1 TRP 6 HD1 TRP 6 -4.895 -6.819 3.563 37 HE1 TRP 6 HE1 TRP 6 -7.427 -7.070 3.163 38 HE3 TRP 6 HE3 TRP 6 -4.825 -11.016 0.663 39 HZ2 TRP 6 HZ2 TRP 6 -9.159 -8.843 1.813 40 HZ3 TRP 6 HZ3 TRP 6 -6.963 -11.946 -0.125 41 HH2 TRP 6 HH2 TRP 6 -9.085 -10.881 0.442 42 H GLN 7 HN GLN 7 -1.133 -11.498 3.205 43 HA GLN 7 HA GLN 7 1.187 -9.938 4.050 44 HB2 GLN 7 HB2 GLN 7 0.484 -12.469 4.669 45 HB3 GLN 7 HB1 GLN 7 1.417 -12.796 3.218 46 HG2 GLN 7 HG2 GLN 7 2.330 -11.640 5.816 47 HG3 GLN 7 HG1 GLN 7 2.956 -13.026 4.929 48 HE21 GLN 7 HE21 GLN 7 4.271 -12.659 3.100 49 HE22 GLN 7 HE22 GLN 7 5.077 -11.149 2.867 50 H VAL 8 HN VAL 8 2.078 -8.802 2.480 51 HA VAL 8 HA VAL 8 1.832 -9.598 -0.280 52 HB VAL 8 HB VAL 8 1.429 -7.303 0.181 53 HG11 VAL 8 HG11 VAL 8 2.559 -6.884 2.192 54 HG12 VAL 8 HG12 VAL 8 3.340 -5.847 0.997 55 HG13 VAL 8 HG13 VAL 8 4.120 -7.344 1.510 56 HG21 VAL 8 HG21 VAL 8 2.455 -7.704 -1.935 57 HG22 VAL 8 HG22 VAL 8 4.062 -7.697 -1.211 58 HG23 VAL 8 HG23 VAL 8 3.110 -6.210 -1.267 59 H TYR 9 HN TYR 9 3.372 -10.232 -1.657 60 HA TYR 9 HA TYR 9 6.179 -10.245 -0.905 61 HB2 TYR 9 HB2 TYR 9 6.469 -12.641 -1.223 62 HB3 TYR 9 HB1 TYR 9 5.269 -12.375 0.037 63 HD1 TYR 9 HD1 TYR 9 2.754 -12.340 -0.846 64 HD2 TYR 9 HD2 TYR 9 6.005 -14.193 -2.869 65 HE1 TYR 9 HE1 TYR 9 1.173 -13.767 -2.067 66 HE2 TYR 9 HE2 TYR 9 4.432 -15.628 -4.094 67 HH TYR 9 HH TYR 9 1.112 -15.030 -4.198 68 H ALA 10 HN ALA 10 7.431 -9.953 -2.709 69 HA ALA 10 HA ALA 10 6.840 -10.868 -5.287 70 HB1 ALA 10 HB1 ALA 10 6.172 -7.948 -4.894 71 HB2 ALA 10 HB2 ALA 10 5.000 -9.233 -5.199 72 HB3 ALA 10 HB3 ALA 10 6.197 -8.817 -6.428 73 H GLN 11 HN GLN 11 8.355 -10.111 -6.891 74 HA GLN 11 HA GLN 11 10.685 -8.736 -5.723 75 HB2 GLN 11 HB2 GLN 11 12.036 -10.200 -7.357 76 HB3 GLN 11 HB1 GLN 11 11.428 -10.943 -5.884 77 HG2 GLN 11 HG2 GLN 11 9.468 -11.749 -7.244 78 HG3 GLN 11 HG1 GLN 11 10.362 -11.235 -8.675 79 HE21 GLN 11 HE21 GLN 11 9.486 -13.892 -7.755 80 HE22 GLN 11 HE22 GLN 11 10.919 -14.864 -7.708 81 H GLU 12 HN GLU 12 9.332 -6.965 -6.702 82 HA GLU 12 HA GLU 12 9.951 -6.605 -9.560 83 HB2 GLU 12 HB2 GLU 12 7.694 -5.753 -7.821 84 HB3 GLU 12 HB1 GLU 12 8.173 -4.646 -9.085 85 HG2 GLU 12 HG2 GLU 12 7.462 -7.524 -9.552 86 HG3 GLU 12 HG1 GLU 12 6.335 -6.179 -9.718 87 H ASN 13 HN ASN 13 9.593 -3.789 -9.532 88 HA ASN 13 HA ASN 13 12.151 -2.921 -8.671 89 HB2 ASN 13 HB2 ASN 13 9.932 -1.017 -9.340 90 HB3 ASN 13 HB1 ASN 13 11.647 -0.908 -9.746 91 HD21 ASN 13 HD21 ASN 13 8.570 -1.842 -10.754 92 HD22 ASN 13 HD22 ASN 13 9.014 -2.596 -12.243 93 H TYR 14 HN TYR 14 11.405 -3.850 -6.431 94 HA TYR 14 HA TYR 14 9.810 -2.223 -4.746 95 HB2 TYR 14 HB2 TYR 14 10.212 -4.651 -4.453 96 HB3 TYR 14 HB1 TYR 14 11.882 -4.299 -4.034 97 HD1 TYR 14 HD2 TYR 14 12.422 -3.202 -1.897 98 HD2 TYR 14 HD1 TYR 14 8.429 -4.322 -2.867 99 HE1 TYR 14 HE2 TYR 14 11.794 -2.994 0.464 100 HE2 TYR 14 HE1 TYR 14 7.793 -4.120 -0.503 101 HH TYR 14 HH TYR 14 9.504 -4.286 1.888 102 H GLU 15 HN GLU 15 13.311 -2.898 -4.550 103 HA GLU 15 HA GLU 15 13.875 -0.880 -2.724 104 HB2 GLU 15 HB2 GLU 15 16.242 -1.148 -3.400 105 HB3 GLU 15 HB1 GLU 15 15.437 -2.674 -3.069 106 HG2 GLU 15 HG2 GLU 15 15.225 -3.119 -5.432 107 HG3 GLU 15 HG1 GLU 15 15.907 -1.539 -5.816 108 H GLU 16 HN GLU 16 13.758 -0.719 -6.246 109 HA GLU 16 HA GLU 16 14.944 1.850 -6.466 110 HB2 GLU 16 HB2 GLU 16 14.797 0.368 -8.398 111 HB3 GLU 16 HB1 GLU 16 13.039 0.432 -8.341 112 HG2 GLU 16 HG2 GLU 16 13.057 2.769 -8.908 113 HG3 GLU 16 HG1 GLU 16 14.815 2.820 -8.807 114 H PHE 17 HN PHE 17 11.623 0.724 -6.089 115 HA PHE 17 HA PHE 17 10.358 3.215 -6.480 116 HB2 PHE 17 HB2 PHE 17 9.111 1.138 -6.640 117 HB3 PHE 17 HB1 PHE 17 9.467 0.751 -4.956 118 HD1 PHE 17 HD1 PHE 17 8.328 3.946 -6.498 119 HD2 PHE 17 HD2 PHE 17 7.427 0.701 -3.904 120 HE1 PHE 17 HE1 PHE 17 6.222 5.035 -5.867 121 HE2 PHE 17 HE2 PHE 17 5.317 1.789 -3.260 122 HZ PHE 17 HZ PHE 17 4.712 3.962 -4.241 123 H LEU 18 HN LEU 18 11.729 1.611 -3.676 124 HA LEU 18 HA LEU 18 10.716 3.319 -1.696 125 HB2 LEU 18 HB2 LEU 18 13.425 1.995 -1.642 126 HB3 LEU 18 HB1 LEU 18 12.475 2.521 -0.268 127 HG LEU 18 HG LEU 18 12.023 0.141 -2.039 128 HD11 LEU 18 HD11 LEU 18 11.959 -1.010 0.119 129 HD12 LEU 18 HD12 LEU 18 12.283 0.521 0.930 130 HD13 LEU 18 HD13 LEU 18 13.485 -0.175 -0.159 131 HD21 LEU 18 HD21 LEU 18 9.907 -0.235 -0.891 132 HD22 LEU 18 HD22 LEU 18 9.864 1.254 -1.833 133 HD23 LEU 18 HD23 LEU 18 10.060 1.322 -0.082 134 H LYS 19 HN LYS 19 13.511 3.582 -3.807 135 HA LYS 19 HA LYS 19 14.636 5.865 -2.548 136 HB2 LYS 19 HB2 LYS 19 14.985 5.193 -5.461 137 HB3 LYS 19 HB1 LYS 19 16.117 5.999 -4.390 138 HG2 LYS 19 HG2 LYS 19 15.849 3.615 -3.150 139 HG3 LYS 19 HG1 LYS 19 15.638 3.143 -4.829 140 HD2 LYS 19 HD2 LYS 19 17.759 3.941 -5.437 141 HD3 LYS 19 HD1 LYS 19 17.925 4.875 -3.952 142 HE2 LYS 19 HE2 LYS 19 18.217 2.921 -2.642 143 HE3 LYS 19 HE1 LYS 19 17.705 1.879 -3.968 144 HZ1 LYS 19 HZ1 LYS 19 20.190 3.513 -3.942 145 HZ2 LYS 19 HZ2 LYS 19 19.704 2.459 -5.171 146 HZ3 LYS 19 HZ3 LYS 19 20.108 1.850 -3.648 147 H ALA 20 HN ALA 20 12.155 5.364 -4.926 148 HA ALA 20 HA ALA 20 12.041 8.109 -5.767 149 HB1 ALA 20 HB1 ALA 20 11.394 6.166 -7.214 150 HB2 ALA 20 HB2 ALA 20 10.213 7.471 -7.145 151 HB3 ALA 20 HB3 ALA 20 9.950 5.994 -6.217 152 H LEU 21 HN LEU 21 11.085 6.523 -3.031 153 HA LEU 21 HA LEU 21 8.832 8.336 -2.532 154 HB2 LEU 21 HB2 LEU 21 9.731 5.886 -1.014 155 HB3 LEU 21 HB1 LEU 21 8.308 6.844 -0.654 156 HG LEU 21 HG LEU 21 8.693 5.428 -3.281 157 HD11 LEU 21 HD11 LEU 21 8.731 3.819 -1.424 158 HD12 LEU 21 HD12 LEU 21 7.294 3.660 -2.432 159 HD13 LEU 21 HD13 LEU 21 7.187 4.463 -0.866 160 HD21 LEU 21 HD21 LEU 21 7.084 7.204 -3.383 161 HD22 LEU 21 HD22 LEU 21 6.313 6.646 -1.899 162 HD23 LEU 21 HD23 LEU 21 6.220 5.665 -3.361 163 H ALA 22 HN ALA 22 11.938 8.557 -2.370 164 HA ALA 22 HA ALA 22 13.462 9.761 -1.204 165 HB1 ALA 22 HB1 ALA 22 11.635 11.455 -1.221 166 HB2 ALA 22 HB2 ALA 22 12.726 11.586 0.161 167 HB3 ALA 22 HB3 ALA 22 11.131 10.858 0.361 168 H LEU 23 HN LEU 23 12.676 7.096 -0.310 169 HA LEU 23 HA LEU 23 12.806 7.221 2.577 170 HB2 LEU 23 HB2 LEU 23 12.807 4.862 0.691 171 HB3 LEU 23 HB1 LEU 23 12.738 4.751 2.442 172 HG LEU 23 HG LEU 23 10.647 6.107 0.737 173 HD11 LEU 23 HD11 LEU 23 10.676 3.383 2.006 174 HD12 LEU 23 HD12 LEU 23 10.593 3.763 0.286 175 HD13 LEU 23 HD13 LEU 23 9.243 4.171 1.345 176 HD21 LEU 23 HD21 LEU 23 9.318 5.973 2.845 177 HD22 LEU 23 HD22 LEU 23 10.692 7.074 2.914 178 HD23 LEU 23 HD23 LEU 23 10.796 5.487 3.678 179 HA PRO 24 HA PRO 24 17.152 6.845 3.006 180 HB2 PRO 24 HB2 PRO 24 17.041 4.842 5.102 181 HB3 PRO 24 HB1 PRO 24 17.336 6.580 5.256 182 HG2 PRO 24 HG2 PRO 24 15.097 5.332 6.173 183 HG3 PRO 24 HG1 PRO 24 15.175 7.045 5.718 184 HD2 PRO 24 HD2 PRO 24 14.078 4.734 4.188 185 HD3 PRO 24 HD1 PRO 24 13.489 6.402 4.301 186 H GLU 25 HN GLU 25 18.500 5.874 1.663 187 HA GLU 25 HA GLU 25 18.091 3.445 0.408 188 HB2 GLU 25 HB2 GLU 25 20.711 4.850 0.922 189 HB3 GLU 25 HB1 GLU 25 20.461 3.584 -0.272 190 HG2 GLU 25 HG2 GLU 25 20.204 5.345 -1.647 191 HG3 GLU 25 HG1 GLU 25 18.550 5.287 -1.044 192 H ASP 26 HN ASP 26 19.647 4.119 3.463 193 HA ASP 26 HA ASP 26 20.953 1.619 3.773 194 HB2 ASP 26 HB2 ASP 26 21.571 3.542 5.135 195 HB3 ASP 26 HB1 ASP 26 19.970 3.575 5.863 196 H LEU 27 HN LEU 27 17.712 2.762 4.546 197 HA LEU 27 HA LEU 27 16.962 0.345 5.910 198 HB2 LEU 27 HB2 LEU 27 15.957 2.712 6.167 199 HB3 LEU 27 HB1 LEU 27 15.058 2.338 4.710 200 HG LEU 27 HG LEU 27 14.398 0.178 6.119 201 HD11 LEU 27 HD11 LEU 27 15.726 0.667 8.054 202 HD12 LEU 27 HD12 LEU 27 14.022 0.823 8.473 203 HD13 LEU 27 HD13 LEU 27 14.996 2.263 8.205 204 HD21 LEU 27 HD21 LEU 27 13.159 2.917 6.334 205 HD22 LEU 27 HD22 LEU 27 12.374 1.430 6.864 206 HD23 LEU 27 HD23 LEU 27 12.780 1.655 5.163 207 H ILE 28 HN ILE 28 16.812 1.643 2.700 208 HA ILE 28 HA ILE 28 14.949 -0.060 1.509 209 HB ILE 28 HB ILE 28 17.353 1.362 0.358 210 HG12 ILE 28 HG12 ILE 28 14.404 1.998 0.193 211 HG13 ILE 28 HG11 ILE 28 15.490 2.699 1.384 212 HG21 ILE 28 HG21 ILE 28 16.960 -0.323 -1.223 213 HG22 ILE 28 HG22 ILE 28 16.073 1.074 -1.832 214 HG23 ILE 28 HG23 ILE 28 15.212 -0.229 -1.019 215 HD11 ILE 28 HD11 ILE 28 16.572 3.071 -1.237 216 HD12 ILE 28 HD12 ILE 28 16.091 4.273 -0.037 217 HD13 ILE 28 HD13 ILE 28 14.905 3.647 -1.182 218 H LYS 29 HN LYS 29 18.369 -0.516 2.204 219 HA LYS 29 HA LYS 29 18.681 -2.897 0.668 220 HB2 LYS 29 HB2 LYS 29 20.273 -1.737 2.957 221 HB3 LYS 29 HB1 LYS 29 20.733 -3.209 2.114 222 HG2 LYS 29 HG2 LYS 29 21.065 -2.023 0.076 223 HG3 LYS 29 HG1 LYS 29 20.365 -0.552 0.754 224 HD2 LYS 29 HD2 LYS 29 22.804 -0.408 0.691 225 HD3 LYS 29 HD1 LYS 29 22.205 -0.406 2.356 226 HE2 LYS 29 HE2 LYS 29 22.711 -2.815 2.505 227 HE3 LYS 29 HE1 LYS 29 23.360 -2.767 0.869 228 HZ1 LYS 29 HZ1 LYS 29 25.161 -2.621 2.366 229 HZ2 LYS 29 HZ2 LYS 29 24.422 -1.400 3.269 230 HZ3 LYS 29 HZ3 LYS 29 24.966 -1.078 1.701 231 H MET 30 HN MET 30 17.335 -2.245 3.783 232 HA MET 30 HA MET 30 17.515 -5.060 4.574 233 HB2 MET 30 HB2 MET 30 16.520 -2.624 6.062 234 HB3 MET 30 HB1 MET 30 16.501 -4.255 6.715 235 HG2 MET 30 HG2 MET 30 18.932 -4.357 6.559 236 HG3 MET 30 HG1 MET 30 18.958 -2.730 5.884 237 HE1 MET 30 HE1 MET 30 17.013 -0.958 7.618 238 HE2 MET 30 HE2 MET 30 18.668 -0.621 7.109 239 HE3 MET 30 HE3 MET 30 18.210 -0.426 8.800 240 H ALA 31 HN ALA 31 15.189 -2.582 3.739 241 HA ALA 31 HA ALA 31 12.805 -3.895 4.346 242 HB1 ALA 31 HB1 ALA 31 11.785 -2.365 2.682 243 HB2 ALA 31 HB2 ALA 31 13.409 -1.877 2.197 244 HB3 ALA 31 HB3 ALA 31 12.846 -1.555 3.834 245 H ARG 32 HN ARG 32 14.969 -4.321 1.671 246 HA ARG 32 HA ARG 32 13.268 -5.486 -0.200 247 HB2 ARG 32 HB2 ARG 32 15.265 -6.401 -1.216 248 HB3 ARG 32 HB1 ARG 32 15.589 -4.766 -0.646 249 HG2 ARG 32 HG2 ARG 32 16.835 -5.564 1.204 250 HG3 ARG 32 HG1 ARG 32 16.303 -7.223 0.927 251 HD2 ARG 32 HD2 ARG 32 17.475 -6.459 -1.464 252 HD3 ARG 32 HD1 ARG 32 18.523 -5.761 -0.228 253 HE ARG 32 HE ARG 32 17.973 -8.399 0.513 254 HH11 ARG 32 HH11 ARG 32 19.653 -6.649 -2.007 255 HH12 ARG 32 HH12 ARG 32 20.764 -7.934 -2.350 256 HH21 ARG 32 HH21 ARG 32 19.440 -10.104 0.069 257 HH22 ARG 32 HH22 ARG 32 20.643 -9.899 -1.164 258 H ASP 33 HN ASP 33 14.779 -6.891 2.655 259 HA ASP 33 HA ASP 33 13.785 -9.545 1.884 260 HB2 ASP 33 HB2 ASP 33 15.839 -8.634 3.887 261 HB3 ASP 33 HB1 ASP 33 15.121 -10.234 4.001 262 H ILE 34 HN ILE 34 12.671 -6.937 3.453 263 HA ILE 34 HA ILE 34 11.348 -8.417 5.599 264 HB ILE 34 HB ILE 34 11.435 -5.447 5.036 265 HG12 ILE 34 HG12 ILE 34 12.923 -7.263 6.917 266 HG13 ILE 34 HG11 ILE 34 13.581 -6.106 5.768 267 HG21 ILE 34 HG21 ILE 34 10.358 -6.829 7.493 268 HG22 ILE 34 HG22 ILE 34 9.345 -6.266 6.162 269 HG23 ILE 34 HG23 ILE 34 10.285 -5.108 7.106 270 HD11 ILE 34 HD11 ILE 34 12.841 -4.276 7.153 271 HD12 ILE 34 HD12 ILE 34 13.832 -5.390 8.092 272 HD13 ILE 34 HD13 ILE 34 12.076 -5.398 8.277 273 H LYS 35 HN LYS 35 9.339 -9.072 5.428 274 HA LYS 35 HA LYS 35 7.619 -7.843 3.386 275 HB2 LYS 35 HB2 LYS 35 7.720 -10.733 4.278 276 HB3 LYS 35 HB1 LYS 35 6.481 -10.058 3.227 277 HG2 LYS 35 HG2 LYS 35 9.427 -10.130 2.619 278 HG3 LYS 35 HG1 LYS 35 8.219 -11.239 1.968 279 HD2 LYS 35 HD2 LYS 35 7.105 -9.450 0.806 280 HD3 LYS 35 HD1 LYS 35 8.123 -8.245 1.592 281 HE2 LYS 35 HE2 LYS 35 9.247 -10.405 -0.162 282 HE3 LYS 35 HE1 LYS 35 8.716 -8.853 -0.796 283 HZ1 LYS 35 HZ1 LYS 35 10.913 -9.386 1.103 284 HZ2 LYS 35 HZ2 LYS 35 10.283 -7.837 0.864 285 HZ3 LYS 35 HZ3 LYS 35 11.008 -8.664 -0.421 286 HA PRO 36 HA PRO 36 5.578 -7.139 7.423 287 HB2 PRO 36 HB2 PRO 36 4.723 -4.617 6.303 288 HB3 PRO 36 HB1 PRO 36 5.826 -4.894 7.664 289 HG2 PRO 36 HG2 PRO 36 6.609 -3.837 5.279 290 HG3 PRO 36 HG1 PRO 36 7.679 -4.731 6.376 291 HD2 PRO 36 HD2 PRO 36 6.341 -5.659 3.878 292 HD3 PRO 36 HD1 PRO 36 7.958 -6.035 4.502 293 H ILE 37 HN ILE 37 3.583 -7.914 7.698 294 HA ILE 37 HA ILE 37 1.863 -8.164 5.433 295 HB ILE 37 HB ILE 37 1.925 -9.949 7.101 296 HG12 ILE 37 HG12 ILE 37 -0.247 -9.134 5.786 297 HG13 ILE 37 HG11 ILE 37 -0.276 -10.513 6.878 298 HG21 ILE 37 HG21 ILE 37 0.787 -9.588 9.307 299 HG22 ILE 37 HG22 ILE 37 0.867 -7.858 8.975 300 HG23 ILE 37 HG23 ILE 37 2.353 -8.798 9.121 301 HD11 ILE 37 HD11 ILE 37 -0.981 -7.749 7.798 302 HD12 ILE 37 HD12 ILE 37 -1.364 -9.299 8.552 303 HD13 ILE 37 HD13 ILE 37 -2.167 -8.824 7.056 304 H VAL 38 HN VAL 38 0.090 -7.023 4.913 305 HA VAL 38 HA VAL 38 -0.188 -4.429 6.236 306 HB VAL 38 HB VAL 38 -1.686 -5.390 3.800 307 HG11 VAL 38 HG11 VAL 38 -0.999 -2.609 4.722 308 HG12 VAL 38 HG12 VAL 38 -2.556 -3.396 4.971 309 HG13 VAL 38 HG13 VAL 38 -1.998 -3.043 3.334 310 HG21 VAL 38 HG21 VAL 38 0.781 -5.573 3.492 311 HG22 VAL 38 HG22 VAL 38 0.899 -3.844 3.832 312 HG23 VAL 38 HG23 VAL 38 0.008 -4.405 2.416 313 H GLU 39 HN GLU 39 -1.518 -4.348 7.930 314 HA GLU 39 HA GLU 39 -3.822 -6.113 8.085 315 HB2 GLU 39 HB2 GLU 39 -2.283 -4.442 10.001 316 HB3 GLU 39 HB1 GLU 39 -3.996 -4.641 10.339 317 HG2 GLU 39 HG2 GLU 39 -3.798 -6.851 10.801 318 HG3 GLU 39 HG1 GLU 39 -2.462 -7.068 9.675 319 H ILE 40 HN ILE 40 -5.729 -5.509 7.345 320 HA ILE 40 HA ILE 40 -6.378 -2.649 7.424 321 HB ILE 40 HB ILE 40 -5.713 -3.202 5.138 322 HG12 ILE 40 HG12 ILE 40 -7.715 -1.637 5.805 323 HG13 ILE 40 HG11 ILE 40 -7.368 -1.979 4.117 324 HG21 ILE 40 HG21 ILE 40 -6.271 -5.561 5.104 325 HG22 ILE 40 HG22 ILE 40 -7.017 -4.715 3.745 326 HG23 ILE 40 HG23 ILE 40 -7.990 -5.164 5.142 327 HD11 ILE 40 HD11 ILE 40 -9.814 -2.140 5.209 328 HD12 ILE 40 HD12 ILE 40 -9.276 -3.805 5.429 329 HD13 ILE 40 HD13 ILE 40 -9.305 -3.092 3.816 330 H GLN 41 HN GLN 41 -8.299 -2.188 8.260 331 HA GLN 41 HA GLN 41 -10.310 -4.314 8.436 332 HB2 GLN 41 HB2 GLN 41 -10.812 -3.720 10.755 333 HB3 GLN 41 HB1 GLN 41 -9.145 -4.253 10.596 334 HG2 GLN 41 HG2 GLN 41 -9.416 -1.383 10.305 335 HG3 GLN 41 HG1 GLN 41 -10.031 -1.966 11.852 336 HE21 GLN 41 HE21 GLN 41 -7.277 -1.303 9.954 337 HE22 GLN 41 HE22 GLN 41 -6.079 -1.784 11.108 338 H GLN 42 HN GLN 42 -12.442 -3.604 8.371 339 HA GLN 42 HA GLN 42 -12.826 -0.711 8.095 340 HB2 GLN 42 HB2 GLN 42 -14.234 -0.971 6.170 341 HB3 GLN 42 HB1 GLN 42 -12.669 -1.703 5.845 342 HG2 GLN 42 HG2 GLN 42 -13.534 -3.717 5.609 343 HG3 GLN 42 HG1 GLN 42 -14.642 -3.547 6.951 344 HE21 GLN 42 HE21 GLN 42 -14.952 -4.572 4.162 345 HE22 GLN 42 HE22 GLN 42 -16.309 -3.705 3.541 346 H LYS 43 HN LYS 43 -15.486 -0.739 7.450 347 HA LYS 43 HA LYS 43 -17.121 -2.368 9.033 348 HB2 LYS 43 HB2 LYS 43 -15.754 -0.908 10.756 349 HB3 LYS 43 HB1 LYS 43 -16.927 0.327 10.315 350 HG2 LYS 43 HG2 LYS 43 -18.737 -1.072 11.035 351 HG3 LYS 43 HG1 LYS 43 -17.632 -2.408 11.350 352 HD2 LYS 43 HD2 LYS 43 -16.484 -0.970 13.036 353 HD3 LYS 43 HD1 LYS 43 -17.738 0.247 12.782 354 HE2 LYS 43 HE2 LYS 43 -18.169 -2.581 13.743 355 HE3 LYS 43 HE1 LYS 43 -18.204 -1.134 14.748 356 HZ1 LYS 43 HZ1 LYS 43 -20.070 -1.748 12.520 357 HZ2 LYS 43 HZ2 LYS 43 -20.092 -0.336 13.445 358 HZ3 LYS 43 HZ3 LYS 43 -20.432 -1.824 14.170 359 H GLY 44 HN GLY 44 -17.799 -1.970 6.707 360 HA2 GLY 44 HA2 GLY 44 -19.948 -1.300 5.837 361 HA3 GLY 44 HA1 GLY 44 -19.783 0.206 6.728 362 H ASP 45 HN ASP 45 -18.493 1.848 5.914 363 HA ASP 45 HA ASP 45 -17.565 1.451 3.147 364 HB2 ASP 45 HB2 ASP 45 -18.777 3.977 4.285 365 HB3 ASP 45 HB1 ASP 45 -18.225 3.740 2.634 366 H ASP 46 HN ASP 46 -16.940 2.700 6.301 367 HA ASP 46 HA ASP 46 -14.601 4.199 5.468 368 HB2 ASP 46 HB2 ASP 46 -16.226 4.747 7.450 369 HB3 ASP 46 HB1 ASP 46 -15.224 3.598 8.334 370 H PHE 47 HN PHE 47 -12.579 3.491 5.491 371 HA PHE 47 HA PHE 47 -12.074 0.810 6.618 372 HB2 PHE 47 HB2 PHE 47 -10.976 2.136 4.136 373 HB3 PHE 47 HB1 PHE 47 -10.223 0.725 4.866 374 HD1 PHE 47 HD2 PHE 47 -13.775 1.622 4.199 375 HD2 PHE 47 HD1 PHE 47 -10.574 -1.091 3.521 376 HE1 PHE 47 HE2 PHE 47 -15.281 0.166 2.915 377 HE2 PHE 47 HE1 PHE 47 -12.083 -2.548 2.238 378 HZ PHE 47 HZ PHE 47 -14.438 -1.921 1.934 379 H VAL 48 HN VAL 48 -10.060 0.446 7.543 380 HA VAL 48 HA VAL 48 -8.406 2.805 8.099 381 HB VAL 48 HB VAL 48 -9.322 0.749 10.129 382 HG11 VAL 48 HG11 VAL 48 -7.045 2.666 10.133 383 HG12 VAL 48 HG12 VAL 48 -7.154 1.040 10.810 384 HG13 VAL 48 HG13 VAL 48 -7.929 2.394 11.635 385 HG21 VAL 48 HG21 VAL 48 -10.902 2.582 9.688 386 HG22 VAL 48 HG22 VAL 48 -9.634 3.749 10.062 387 HG23 VAL 48 HG23 VAL 48 -10.231 2.662 11.316 388 H VAL 49 HN VAL 49 -6.688 2.310 6.910 389 HA VAL 49 HA VAL 49 -5.671 -0.417 6.811 390 HB VAL 49 HB VAL 49 -4.594 2.048 5.438 391 HG11 VAL 49 HG11 VAL 49 -4.203 -0.864 4.752 392 HG12 VAL 49 HG12 VAL 49 -3.049 0.106 5.672 393 HG13 VAL 49 HG13 VAL 49 -3.422 0.528 4.001 394 HG21 VAL 49 HG21 VAL 49 -5.917 1.588 3.565 395 HG22 VAL 49 HG22 VAL 49 -7.024 1.377 4.922 396 HG23 VAL 49 HG23 VAL 49 -6.317 -0.033 4.128 397 H THR 50 HN THR 50 -4.255 -1.083 8.211 398 HA THR 50 HA THR 50 -2.643 0.863 9.696 399 HB THR 50 HB THR 50 -3.234 -2.035 10.281 400 HG1 THR 50 HG1 THR 50 -4.500 0.362 10.943 401 HG21 THR 50 HG21 THR 50 -1.150 -1.431 11.280 402 HG22 THR 50 HG22 THR 50 -2.373 -1.465 12.548 403 HG23 THR 50 HG23 THR 50 -1.820 0.079 11.897 404 H SER 51 HN SER 51 -0.795 1.214 8.592 405 HA SER 51 HA SER 51 0.589 -1.025 7.330 406 HB2 SER 51 HB2 SER 51 1.537 1.834 7.316 407 HB3 SER 51 HB1 SER 51 1.779 0.582 6.095 408 HG SER 51 HG SER 51 -0.779 0.822 6.224 409 H LYS 52 HN LYS 52 1.608 -2.174 8.847 410 HA LYS 52 HA LYS 52 3.087 -0.799 10.961 411 HB2 LYS 52 HB2 LYS 52 2.247 -3.670 10.603 412 HB3 LYS 52 HB1 LYS 52 3.322 -3.147 11.890 413 HG2 LYS 52 HG2 LYS 52 1.668 -2.040 13.014 414 HG3 LYS 52 HG1 LYS 52 0.718 -1.756 11.559 415 HD2 LYS 52 HD2 LYS 52 -0.489 -3.358 12.799 416 HD3 LYS 52 HD1 LYS 52 0.309 -4.265 11.513 417 HE2 LYS 52 HE2 LYS 52 2.086 -4.895 13.068 418 HE3 LYS 52 HE1 LYS 52 1.280 -3.996 14.352 419 HZ1 LYS 52 HZ1 LYS 52 0.783 -6.356 14.482 420 HZ2 LYS 52 HZ2 LYS 52 0.147 -6.334 12.911 421 HZ3 LYS 52 HZ3 LYS 52 -0.617 -5.470 14.146 422 H THR 53 HN THR 53 5.115 -0.346 10.574 423 HA THR 53 HA THR 53 6.721 -2.247 8.992 424 HB THR 53 HB THR 53 7.766 -0.546 7.856 425 HG1 THR 53 HG1 THR 53 7.302 1.753 9.028 426 HG21 THR 53 HG21 THR 53 5.176 0.830 8.568 427 HG22 THR 53 HG22 THR 53 5.352 -0.449 7.357 428 HG23 THR 53 HG23 THR 53 6.166 1.099 7.128 429 HA PRO 54 HA PRO 54 9.586 -2.471 12.347 430 HB2 PRO 54 HB2 PRO 54 11.888 -2.039 10.561 431 HB3 PRO 54 HB1 PRO 54 11.406 -3.502 11.440 432 HG2 PRO 54 HG2 PRO 54 11.216 -3.328 8.772 433 HG3 PRO 54 HG1 PRO 54 10.067 -4.262 9.749 434 HD2 PRO 54 HD2 PRO 54 9.729 -1.540 8.537 435 HD3 PRO 54 HD1 PRO 54 8.575 -2.885 8.648 436 H ARG 55 HN ARG 55 9.239 0.328 10.583 437 HA ARG 55 HA ARG 55 11.139 1.815 12.274 438 HB2 ARG 55 HB2 ARG 55 10.273 2.111 9.486 439 HB3 ARG 55 HB1 ARG 55 10.264 3.616 10.397 440 HG2 ARG 55 HG2 ARG 55 12.636 2.959 11.108 441 HG3 ARG 55 HG1 ARG 55 12.564 1.804 9.776 442 HD2 ARG 55 HD2 ARG 55 13.606 3.894 9.071 443 HD3 ARG 55 HD1 ARG 55 12.082 3.632 8.221 444 HE ARG 55 HE ARG 55 11.259 5.167 10.217 445 HH11 ARG 55 HH11 ARG 55 14.146 5.483 8.253 446 HH12 ARG 55 HH12 ARG 55 14.143 7.216 8.313 447 HH21 ARG 55 HH21 ARG 55 11.253 7.440 10.280 448 HH22 ARG 55 HH22 ARG 55 12.493 8.329 9.446 449 H GLN 56 HN GLN 56 7.971 2.333 10.709 450 HA GLN 56 HA GLN 56 6.905 3.286 13.246 451 HB2 GLN 56 HB2 GLN 56 6.180 5.404 12.434 452 HB3 GLN 56 HB1 GLN 56 7.882 5.273 12.020 453 HG2 GLN 56 HG2 GLN 56 5.672 4.640 10.088 454 HG3 GLN 56 HG1 GLN 56 6.366 6.249 10.269 455 HE21 GLN 56 HE21 GLN 56 8.449 6.648 9.555 456 HE22 GLN 56 HE22 GLN 56 9.286 5.564 8.501 457 H THR 57 HN THR 57 4.634 3.247 13.338 458 HA THR 57 HA THR 57 3.393 1.676 11.185 459 HB THR 57 HB THR 57 2.603 1.942 14.095 460 HG1 THR 57 HG1 THR 57 4.469 0.573 13.475 461 HG21 THR 57 HG21 THR 57 0.968 0.140 13.575 462 HG22 THR 57 HG22 THR 57 1.325 0.370 11.863 463 HG23 THR 57 HG23 THR 57 0.605 1.678 12.798 464 H VAL 58 HN VAL 58 2.228 2.924 9.856 465 HA VAL 58 HA VAL 58 0.924 5.299 11.002 466 HB VAL 58 HB VAL 58 0.639 6.070 8.642 467 HG11 VAL 58 HG11 VAL 58 3.492 5.571 9.488 468 HG12 VAL 58 HG12 VAL 58 2.457 6.862 10.102 469 HG13 VAL 58 HG13 VAL 58 2.918 6.836 8.404 470 HG21 VAL 58 HG21 VAL 58 2.430 3.717 8.057 471 HG22 VAL 58 HG22 VAL 58 2.074 5.018 6.922 472 HG23 VAL 58 HG23 VAL 58 0.779 3.958 7.485 473 H THR 59 HN THR 59 -1.216 5.814 10.494 474 HA THR 59 HA THR 59 -2.866 3.490 9.727 475 HB THR 59 HB THR 59 -3.772 5.727 11.538 476 HG1 THR 59 HG1 THR 59 -2.070 4.854 12.658 477 HG21 THR 59 HG21 THR 59 -5.492 4.283 10.546 478 HG22 THR 59 HG22 THR 59 -5.396 4.069 12.293 479 HG23 THR 59 HG23 THR 59 -4.686 2.867 11.214 480 H ASN 60 HN ASN 60 -3.803 3.811 7.818 481 HA ASN 60 HA ASN 60 -4.424 6.568 6.935 482 HB2 ASN 60 HB2 ASN 60 -3.893 4.017 5.389 483 HB3 ASN 60 HB1 ASN 60 -4.538 5.471 4.638 484 HD21 ASN 60 HD21 ASN 60 -1.753 3.967 6.049 485 HD22 ASN 60 HD22 ASN 60 -0.612 5.177 5.585 486 H SER 61 HN SER 61 -6.562 7.079 6.903 487 HA SER 61 HA SER 61 -8.502 4.857 6.837 488 HB2 SER 61 HB2 SER 61 -9.418 7.303 8.179 489 HB3 SER 61 HB1 SER 61 -9.573 5.622 8.679 490 HG SER 61 HG SER 61 -7.239 7.233 8.927 491 H PHE 62 HN PHE 62 -10.530 5.265 5.799 492 HA PHE 62 HA PHE 62 -11.075 7.738 4.499 493 HB2 PHE 62 HB2 PHE 62 -10.875 6.833 2.153 494 HB3 PHE 62 HB1 PHE 62 -9.339 7.130 2.957 495 HD1 PHE 62 HD2 PHE 62 -11.679 4.522 1.820 496 HD2 PHE 62 HD1 PHE 62 -7.840 5.352 3.455 497 HE1 PHE 62 HE2 PHE 62 -10.979 2.210 1.341 498 HE2 PHE 62 HE1 PHE 62 -7.136 3.048 2.983 499 HZ PHE 62 HZ PHE 62 -8.703 1.474 1.919 500 H THR 63 HN THR 63 -12.934 7.451 2.925 501 HA THR 63 HA THR 63 -14.623 5.187 3.756 502 HB THR 63 HB THR 63 -15.837 7.819 2.986 503 HG1 THR 63 HG1 THR 63 -14.788 7.133 5.561 504 HG21 THR 63 HG21 THR 63 -17.503 7.030 4.733 505 HG22 THR 63 HG22 THR 63 -16.628 5.500 4.736 506 HG23 THR 63 HG23 THR 63 -17.410 6.064 3.261 507 H LEU 64 HN LEU 64 -15.537 4.045 2.166 508 HA LEU 64 HA LEU 64 -14.636 4.060 -0.420 509 HB2 LEU 64 HB2 LEU 64 -17.283 3.093 0.658 510 HB3 LEU 64 HB1 LEU 64 -16.722 2.758 -0.971 511 HG LEU 64 HG LEU 64 -15.445 1.837 1.596 512 HD11 LEU 64 HD11 LEU 64 -17.392 0.545 1.022 513 HD12 LEU 64 HD12 LEU 64 -15.949 -0.405 0.665 514 HD13 LEU 64 HD13 LEU 64 -16.836 0.379 -0.644 515 HD21 LEU 64 HD21 LEU 64 -14.493 1.737 -1.242 516 HD22 LEU 64 HD22 LEU 64 -13.982 0.541 -0.052 517 HD23 LEU 64 HD23 LEU 64 -13.625 2.250 0.206 518 H GLY 65 HN GLY 65 -14.703 5.635 -1.870 519 HA2 GLY 65 HA2 GLY 65 -15.881 6.738 -3.607 520 HA3 GLY 65 HA1 GLY 65 -17.334 6.683 -2.628 521 H LYS 66 HN LYS 66 -15.186 7.692 -0.462 522 HA LYS 66 HA LYS 66 -15.606 10.517 -1.199 523 HB2 LYS 66 HB2 LYS 66 -15.900 9.100 1.421 524 HB3 LYS 66 HB1 LYS 66 -15.437 10.796 1.407 525 HG2 LYS 66 HG2 LYS 66 -17.770 10.797 1.637 526 HG3 LYS 66 HG1 LYS 66 -17.476 11.189 -0.056 527 HD2 LYS 66 HD2 LYS 66 -19.166 9.617 -0.204 528 HD3 LYS 66 HD1 LYS 66 -17.721 8.631 -0.425 529 HE2 LYS 66 HE2 LYS 66 -19.038 7.429 1.101 530 HE3 LYS 66 HE1 LYS 66 -17.818 8.228 2.095 531 HZ1 LYS 66 HZ1 LYS 66 -20.593 9.200 1.666 532 HZ2 LYS 66 HZ2 LYS 66 -19.427 9.937 2.644 533 HZ3 LYS 66 HZ3 LYS 66 -20.033 8.414 3.055 534 H GLU 67 HN GLU 67 -13.991 12.006 -0.696 535 HA GLU 67 HA GLU 67 -11.324 10.906 -0.753 536 HB2 GLU 67 HB2 GLU 67 -12.079 12.913 -2.097 537 HB3 GLU 67 HB1 GLU 67 -12.113 13.810 -0.583 538 HG2 GLU 67 HG2 GLU 67 -9.718 13.334 -0.278 539 HG3 GLU 67 HG1 GLU 67 -9.714 12.503 -1.835 540 H ALA 68 HN ALA 68 -9.979 10.701 0.930 541 HA ALA 68 HA ALA 68 -10.668 12.123 3.415 542 HB1 ALA 68 HB1 ALA 68 -11.458 9.862 3.689 543 HB2 ALA 68 HB2 ALA 68 -10.035 10.114 4.700 544 HB3 ALA 68 HB3 ALA 68 -9.892 9.220 3.186 545 H ASP 69 HN ASP 69 -8.909 12.462 4.845 546 HA ASP 69 HA ASP 69 -6.432 12.958 3.444 547 HB2 ASP 69 HB2 ASP 69 -7.404 14.668 4.955 548 HB3 ASP 69 HB1 ASP 69 -7.206 13.563 6.310 549 H ILE 70 HN ILE 70 -4.842 11.587 3.429 550 HA ILE 70 HA ILE 70 -4.509 9.755 5.696 551 HB ILE 70 HB ILE 70 -3.603 8.061 4.056 552 HG12 ILE 70 HG12 ILE 70 -4.848 8.397 1.750 553 HG13 ILE 70 HG11 ILE 70 -4.627 10.097 2.149 554 HG21 ILE 70 HG21 ILE 70 -5.754 7.747 5.075 555 HG22 ILE 70 HG22 ILE 70 -5.839 7.259 3.380 556 HG23 ILE 70 HG23 ILE 70 -6.509 8.808 3.886 557 HD11 ILE 70 HD11 ILE 70 -2.846 8.913 0.715 558 HD12 ILE 70 HD12 ILE 70 -2.317 8.191 2.237 559 HD13 ILE 70 HD13 ILE 70 -2.311 9.943 2.042 560 H THR 71 HN THR 71 -2.210 8.855 5.764 561 HA THR 71 HA THR 71 -0.307 10.789 4.632 562 HB THR 71 HB THR 71 -0.099 9.997 7.523 563 HG1 THR 71 HG1 THR 71 -2.105 11.201 6.985 564 HG21 THR 71 HG21 THR 71 1.479 11.741 7.682 565 HG22 THR 71 HG22 THR 71 0.952 12.463 6.162 566 HG23 THR 71 HG23 THR 71 1.851 10.948 6.149 567 H THR 72 HN THR 72 1.488 9.906 3.891 568 HA THR 72 HA THR 72 1.853 7.068 4.114 569 HB THR 72 HB THR 72 2.376 8.165 1.995 570 HG1 THR 72 HG1 THR 72 4.627 7.348 1.819 571 HG21 THR 72 HG21 THR 72 4.517 9.618 3.550 572 HG22 THR 72 HG22 THR 72 3.104 10.337 2.781 573 HG23 THR 72 HG23 THR 72 4.374 9.613 1.791 574 H MET 73 HN MET 73 4.017 6.160 4.771 575 HA MET 73 HA MET 73 4.660 7.140 7.386 576 HB2 MET 73 HB2 MET 73 6.259 5.252 7.472 577 HB3 MET 73 HB1 MET 73 4.626 4.762 7.052 578 HG2 MET 73 HG2 MET 73 5.412 4.870 4.624 579 HG3 MET 73 HG1 MET 73 7.044 4.918 5.291 580 HE1 MET 73 HE1 MET 73 3.748 2.853 4.878 581 HE2 MET 73 HE2 MET 73 3.858 2.964 6.633 582 HE3 MET 73 HE3 MET 73 4.082 1.409 5.838 583 H ASP 74 HN ASP 74 5.669 8.088 4.398 584 HA ASP 74 HA ASP 74 8.433 8.610 5.033 585 HB2 ASP 74 HB2 ASP 74 8.258 8.384 2.758 586 HB3 ASP 74 HB1 ASP 74 6.645 9.081 2.702 587 H GLY 75 HN GLY 75 5.399 10.406 5.004 588 HA2 GLY 75 HA2 GLY 75 5.272 12.154 6.766 589 HA3 GLY 75 HA1 GLY 75 6.831 12.708 6.175 590 H LYS 76 HN LYS 76 4.797 11.648 3.698 591 HA LYS 76 HA LYS 76 4.328 14.405 2.856 592 HB2 LYS 76 HB2 LYS 76 4.579 11.796 1.497 593 HB3 LYS 76 HB1 LYS 76 3.432 12.925 0.792 594 HG2 LYS 76 HG2 LYS 76 5.488 14.584 1.065 595 HG3 LYS 76 HG1 LYS 76 6.385 13.065 0.952 596 HD2 LYS 76 HD2 LYS 76 5.250 12.539 -1.140 597 HD3 LYS 76 HD1 LYS 76 4.314 14.027 -1.011 598 HE2 LYS 76 HE2 LYS 76 6.249 15.378 -1.297 599 HE3 LYS 76 HE1 LYS 76 7.314 13.983 -1.119 600 HZ1 LYS 76 HZ1 LYS 76 6.526 13.109 -3.199 601 HZ2 LYS 76 HZ2 LYS 76 7.040 14.701 -3.441 602 HZ3 LYS 76 HZ3 LYS 76 5.388 14.350 -3.356 603 H LYS 77 HN LYS 77 2.316 15.238 2.420 604 HA LYS 77 HA LYS 77 0.081 13.789 3.628 605 HB2 LYS 77 HB2 LYS 77 0.738 16.647 3.179 606 HB3 LYS 77 HB1 LYS 77 -0.964 16.210 3.104 607 HG2 LYS 77 HG2 LYS 77 0.886 15.677 5.421 608 HG3 LYS 77 HG1 LYS 77 -0.316 16.966 5.331 609 HD2 LYS 77 HD2 LYS 77 -2.068 15.217 5.043 610 HD3 LYS 77 HD1 LYS 77 -0.832 13.993 5.336 611 HE2 LYS 77 HE2 LYS 77 -0.380 15.026 7.527 612 HE3 LYS 77 HE1 LYS 77 -1.691 16.167 7.231 613 HZ1 LYS 77 HZ1 LYS 77 -3.203 14.232 7.034 614 HZ2 LYS 77 HZ2 LYS 77 -2.504 14.383 8.573 615 HZ3 LYS 77 HZ3 LYS 77 -1.922 13.218 7.490 616 H LEU 78 HN LEU 78 -1.256 12.728 2.361 617 HA LEU 78 HA LEU 78 -1.827 13.792 -0.316 618 HB2 LEU 78 HB2 LEU 78 -1.623 10.839 0.119 619 HB3 LEU 78 HB1 LEU 78 -1.511 11.744 -1.377 620 HG LEU 78 HG LEU 78 0.635 12.046 0.692 621 HD11 LEU 78 HD11 LEU 78 1.855 10.192 -0.218 622 HD12 LEU 78 HD12 LEU 78 0.578 9.869 -1.391 623 HD13 LEU 78 HD13 LEU 78 0.282 9.609 0.328 624 HD21 LEU 78 HD21 LEU 78 1.990 12.574 -1.219 625 HD22 LEU 78 HD22 LEU 78 0.505 13.525 -1.302 626 HD23 LEU 78 HD23 LEU 78 0.698 12.096 -2.319 627 H LYS 79 HN LYS 79 -3.928 13.336 -1.084 628 HA LYS 79 HA LYS 79 -5.721 12.098 0.903 629 HB2 LYS 79 HB2 LYS 79 -6.356 14.418 -0.926 630 HB3 LYS 79 HB1 LYS 79 -7.463 13.676 0.224 631 HG2 LYS 79 HG2 LYS 79 -6.095 14.410 2.070 632 HG3 LYS 79 HG1 LYS 79 -4.899 15.067 0.951 633 HD2 LYS 79 HD2 LYS 79 -6.770 16.529 0.046 634 HD3 LYS 79 HD1 LYS 79 -7.704 16.025 1.461 635 HE2 LYS 79 HE2 LYS 79 -4.943 17.155 1.728 636 HE3 LYS 79 HE1 LYS 79 -6.347 18.214 1.600 637 HZ1 LYS 79 HZ1 LYS 79 -6.035 17.944 3.872 638 HZ2 LYS 79 HZ2 LYS 79 -5.670 16.293 3.753 639 HZ3 LYS 79 HZ3 LYS 79 -7.260 16.834 3.526 640 H CYS 80 HN CYS 80 -6.874 10.416 0.161 641 HA CYS 80 HA CYS 80 -7.110 10.189 -2.768 642 HB2 CYS 80 HB2 CYS 80 -5.533 8.516 -1.827 643 HB3 CYS 80 HB1 CYS 80 -6.846 7.878 -0.834 644 H THR 81 HN THR 81 -8.975 9.301 -3.613 645 HA THR 81 HA THR 81 -11.311 9.400 -1.837 646 HB THR 81 HB THR 81 -11.396 11.061 -3.579 647 HG1 THR 81 HG1 THR 81 -13.132 8.864 -3.777 648 HG21 THR 81 HG21 THR 81 -10.822 8.755 -5.419 649 HG22 THR 81 HG22 THR 81 -9.856 10.210 -5.168 650 HG23 THR 81 HG23 THR 81 -11.418 10.315 -5.985 651 H VAL 82 HN VAL 82 -9.801 7.160 -1.777 652 HA VAL 82 HA VAL 82 -10.096 5.045 -3.414 653 HB VAL 82 HB VAL 82 -10.638 4.665 -0.485 654 HG11 VAL 82 HG11 VAL 82 -9.138 3.065 -2.550 655 HG12 VAL 82 HG12 VAL 82 -10.713 2.684 -1.849 656 HG13 VAL 82 HG13 VAL 82 -9.268 2.651 -0.841 657 HG21 VAL 82 HG21 VAL 82 -8.097 4.587 -0.272 658 HG22 VAL 82 HG22 VAL 82 -8.854 6.175 -0.378 659 HG23 VAL 82 HG23 VAL 82 -8.066 5.480 -1.793 660 H HIS 83 HN HIS 83 -11.672 3.890 -4.259 661 HA HIS 83 HA HIS 83 -14.227 3.732 -2.861 662 HB2 HIS 83 HB2 HIS 83 -15.461 4.217 -4.981 663 HB3 HIS 83 HB1 HIS 83 -14.570 5.597 -4.356 664 HD1 HIS 83 HD1 HIS 83 -15.043 3.588 -7.353 665 HD2 HIS 83 HD2 HIS 83 -12.116 6.128 -5.847 666 HE1 HIS 83 HE1 HIS 83 -13.592 4.189 -9.318 667 HE2 HIS 83 HE2 HIS 83 -11.899 5.818 -8.404 668 H LEU 84 HN LEU 84 -15.436 1.927 -3.305 669 HA LEU 84 HA LEU 84 -13.930 -0.257 -4.508 670 HB2 LEU 84 HB2 LEU 84 -14.969 -0.489 -2.250 671 HB3 LEU 84 HB1 LEU 84 -16.546 -0.349 -3.005 672 HG LEU 84 HG LEU 84 -15.708 -2.381 -4.440 673 HD11 LEU 84 HD11 LEU 84 -13.445 -2.447 -3.635 674 HD12 LEU 84 HD12 LEU 84 -14.296 -3.894 -3.097 675 HD13 LEU 84 HD13 LEU 84 -14.003 -2.569 -1.966 676 HD21 LEU 84 HD21 LEU 84 -16.596 -2.602 -1.572 677 HD22 LEU 84 HD22 LEU 84 -16.655 -3.908 -2.756 678 HD23 LEU 84 HD23 LEU 84 -17.632 -2.461 -2.990 679 H ALA 85 HN ALA 85 -14.194 -0.598 -6.580 680 HA ALA 85 HA ALA 85 -16.889 -0.296 -7.738 681 HB1 ALA 85 HB1 ALA 85 -14.251 0.293 -9.084 682 HB2 ALA 85 HB2 ALA 85 -15.399 1.497 -8.499 683 HB3 ALA 85 HB3 ALA 85 -15.847 0.425 -9.825 684 H ASN 86 HN ASN 86 -17.674 -2.183 -8.350 685 HA ASN 86 HA ASN 86 -17.879 -4.314 -9.110 686 HB2 ASN 86 HB2 ASN 86 -15.233 -3.811 -10.494 687 HB3 ASN 86 HB1 ASN 86 -16.380 -5.085 -10.879 688 HD21 ASN 86 HD21 ASN 86 -15.486 -1.833 -11.352 689 HD22 ASN 86 HD22 ASN 86 -16.774 -1.385 -12.414 690 H GLY 87 HN GLY 87 -16.636 -3.879 -6.565 691 HA2 GLY 87 HA2 GLY 87 -15.794 -5.288 -4.929 692 HA3 GLY 87 HA1 GLY 87 -15.512 -6.500 -6.171 693 H LYS 88 HN LYS 88 -14.199 -3.595 -7.095 694 HA LYS 88 HA LYS 88 -11.514 -4.419 -6.218 695 HB2 LYS 88 HB2 LYS 88 -11.900 -4.489 -8.638 696 HB3 LYS 88 HB1 LYS 88 -12.381 -2.797 -8.618 697 HG2 LYS 88 HG2 LYS 88 -10.280 -2.117 -8.736 698 HG3 LYS 88 HG1 LYS 88 -9.785 -3.178 -7.413 699 HD2 LYS 88 HD2 LYS 88 -9.650 -5.050 -8.942 700 HD3 LYS 88 HD1 LYS 88 -10.177 -4.022 -10.278 701 HE2 LYS 88 HE2 LYS 88 -8.136 -2.565 -9.575 702 HE3 LYS 88 HE1 LYS 88 -7.578 -4.050 -8.806 703 HZ1 LYS 88 HZ1 LYS 88 -6.702 -3.893 -11.039 704 HZ2 LYS 88 HZ2 LYS 88 -8.257 -3.702 -11.679 705 HZ3 LYS 88 HZ3 LYS 88 -7.818 -5.173 -10.965 706 H LEU 89 HN LEU 89 -10.199 -2.896 -5.201 707 HA LEU 89 HA LEU 89 -11.548 -0.440 -4.398 708 HB2 LEU 89 HB2 LEU 89 -10.241 -2.135 -2.849 709 HB3 LEU 89 HB1 LEU 89 -8.854 -1.200 -3.373 710 HG LEU 89 HG LEU 89 -9.718 0.793 -2.417 711 HD11 LEU 89 HD11 LEU 89 -11.997 0.796 -2.912 712 HD12 LEU 89 HD12 LEU 89 -11.940 0.654 -1.156 713 HD13 LEU 89 HD13 LEU 89 -12.260 -0.770 -2.144 714 HD21 LEU 89 HD21 LEU 89 -10.192 0.043 -0.029 715 HD22 LEU 89 HD22 LEU 89 -8.649 -0.428 -0.740 716 HD23 LEU 89 HD23 LEU 89 -9.966 -1.597 -0.633 717 H VAL 90 HN VAL 90 -11.179 1.360 -5.438 718 HA VAL 90 HA VAL 90 -8.708 1.580 -7.023 719 HB VAL 90 HB VAL 90 -11.235 3.150 -7.484 720 HG11 VAL 90 HG11 VAL 90 -8.912 2.546 -9.311 721 HG12 VAL 90 HG12 VAL 90 -9.142 4.048 -8.420 722 HG13 VAL 90 HG13 VAL 90 -10.293 3.583 -9.670 723 HG21 VAL 90 HG21 VAL 90 -10.443 0.472 -8.592 724 HG22 VAL 90 HG22 VAL 90 -11.588 1.534 -9.410 725 HG23 VAL 90 HG23 VAL 90 -11.950 0.925 -7.795 726 H CYS 91 HN CYS 91 -7.273 2.963 -6.272 727 HA CYS 91 HA CYS 91 -8.208 5.382 -4.877 728 HB2 CYS 91 HB2 CYS 91 -7.117 3.947 -3.242 729 HB3 CYS 91 HB1 CYS 91 -5.733 3.730 -4.306 730 H LYS 92 HN LYS 92 -8.214 6.538 -6.812 731 HA LYS 92 HA LYS 92 -5.602 6.823 -8.114 732 HB2 LYS 92 HB2 LYS 92 -7.646 6.120 -9.464 733 HB3 LYS 92 HB1 LYS 92 -8.262 7.743 -9.208 734 HG2 LYS 92 HG2 LYS 92 -5.567 7.824 -10.219 735 HG3 LYS 92 HG1 LYS 92 -6.611 6.870 -11.273 736 HD2 LYS 92 HD2 LYS 92 -7.210 9.662 -10.299 737 HD3 LYS 92 HD1 LYS 92 -6.526 9.268 -11.874 738 HE2 LYS 92 HE2 LYS 92 -8.584 7.841 -12.255 739 HE3 LYS 92 HE1 LYS 92 -9.259 8.593 -10.813 740 HZ1 LYS 92 HZ1 LYS 92 -8.434 9.973 -13.301 741 HZ2 LYS 92 HZ2 LYS 92 -8.929 10.769 -11.893 742 HZ3 LYS 92 HZ3 LYS 92 -10.015 9.776 -12.733 743 H SER 93 HN SER 93 -4.568 8.744 -8.092 744 HA SER 93 HA SER 93 -5.865 10.953 -6.650 745 HB2 SER 93 HB2 SER 93 -3.185 11.600 -6.865 746 HB3 SER 93 HB1 SER 93 -3.937 10.830 -5.468 747 HG SER 93 HG SER 93 -3.136 8.923 -6.059 748 H GLU 94 HN GLU 94 -4.541 13.118 -7.401 749 HA GLU 94 HA GLU 94 -5.487 13.579 -10.064 750 HB2 GLU 94 HB2 GLU 94 -4.786 15.860 -9.696 751 HB3 GLU 94 HB1 GLU 94 -5.700 15.254 -8.324 752 HG2 GLU 94 HG2 GLU 94 -2.773 14.959 -8.186 753 HG3 GLU 94 HG1 GLU 94 -3.428 16.589 -8.107 754 H LYS 95 HN LYS 95 -2.643 12.342 -8.846 755 HA LYS 95 HA LYS 95 -1.239 12.979 -11.345 756 HB2 LYS 95 HB2 LYS 95 -0.483 14.321 -9.289 757 HB3 LYS 95 HB1 LYS 95 0.183 12.804 -8.703 758 HG2 LYS 95 HG2 LYS 95 1.562 12.640 -10.718 759 HG3 LYS 95 HG1 LYS 95 0.931 14.193 -11.260 760 HD2 LYS 95 HD2 LYS 95 1.815 15.195 -9.149 761 HD3 LYS 95 HD1 LYS 95 2.583 13.649 -8.796 762 HE2 LYS 95 HE2 LYS 95 3.071 15.060 -11.399 763 HE3 LYS 95 HE1 LYS 95 3.978 15.497 -9.953 764 HZ1 LYS 95 HZ1 LYS 95 3.839 12.741 -11.041 765 HZ2 LYS 95 HZ2 LYS 95 4.863 13.310 -9.817 766 HZ3 LYS 95 HZ3 LYS 95 5.070 13.837 -11.410 767 H PHE 96 HN PHE 96 -2.045 10.620 -8.937 768 HA PHE 96 HA PHE 96 -0.451 8.638 -10.419 769 HB2 PHE 96 HB2 PHE 96 -0.856 8.501 -7.437 770 HB3 PHE 96 HB1 PHE 96 0.246 7.551 -8.425 771 HD1 PHE 96 HD1 PHE 96 -0.331 10.782 -6.810 772 HD2 PHE 96 HD2 PHE 96 2.358 8.462 -9.153 773 HE1 PHE 96 HE1 PHE 96 1.448 12.399 -6.353 774 HE2 PHE 96 HE2 PHE 96 4.156 10.078 -8.693 775 HZ PHE 96 HZ PHE 96 3.705 12.052 -7.290 776 H SER 97 HN SER 97 -1.153 6.330 -9.506 777 HA SER 97 HA SER 97 -3.970 6.127 -8.931 778 HB2 SER 97 HB2 SER 97 -3.999 4.465 -11.056 779 HB3 SER 97 HB1 SER 97 -4.485 6.160 -11.149 780 HG SER 97 HG SER 97 -1.921 6.232 -11.465 781 H HIS 98 HN HIS 98 -4.151 4.563 -7.503 782 HA HIS 98 HA HIS 98 -2.161 2.394 -7.444 783 HB2 HIS 98 HB2 HIS 98 -2.421 3.798 -5.405 784 HB3 HIS 98 HB1 HIS 98 -4.104 3.316 -5.309 785 HD2 HIS 98 HD2 HIS 98 -3.616 0.040 -5.673 786 HE1 HIS 98 HE1 HIS 98 -1.219 0.548 -2.234 787 HE2 HIS 98 HE2 HIS 98 -2.312 -1.135 -3.764 788 H GLU 99 HN GLU 99 -2.754 0.442 -8.074 789 HA GLU 99 HA GLU 99 -5.633 -0.121 -8.319 790 HB2 GLU 99 HB2 GLU 99 -4.878 -0.362 -10.469 791 HB3 GLU 99 HB1 GLU 99 -3.259 -0.821 -9.969 792 HG2 GLU 99 HG2 GLU 99 -3.918 -3.049 -9.540 793 HG3 GLU 99 HG1 GLU 99 -5.627 -2.640 -9.663 794 H GLN 100 HN GLN 100 -6.482 -1.595 -7.007 795 HA GLN 100 HA GLN 100 -4.711 -3.670 -5.902 796 HB2 GLN 100 HB2 GLN 100 -5.793 -1.566 -4.438 797 HB3 GLN 100 HB1 GLN 100 -6.873 -2.914 -4.107 798 HG2 GLN 100 HG2 GLN 100 -5.120 -4.225 -3.231 799 HG3 GLN 100 HG1 GLN 100 -3.890 -3.123 -3.845 800 HE21 GLN 100 HE21 GLN 100 -2.930 -2.731 -1.910 801 HE22 GLN 100 HE22 GLN 100 -3.704 -1.856 -0.632 802 H GLU 101 HN GLU 101 -5.456 -5.656 -6.379 803 HA GLU 101 HA GLU 101 -8.353 -5.972 -6.849 804 HB2 GLU 101 HB2 GLU 101 -6.878 -5.988 -8.920 805 HB3 GLU 101 HB1 GLU 101 -6.183 -7.481 -8.306 806 HG2 GLU 101 HG2 GLU 101 -8.244 -8.620 -8.502 807 HG3 GLU 101 HG1 GLU 101 -9.120 -7.120 -8.806 808 H VAL 102 HN VAL 102 -9.309 -7.480 -5.655 809 HA VAL 102 HA VAL 102 -7.612 -9.441 -4.256 810 HB VAL 102 HB VAL 102 -10.366 -8.429 -3.528 811 HG11 VAL 102 HG11 VAL 102 -10.296 -9.840 -1.612 812 HG12 VAL 102 HG12 VAL 102 -8.647 -10.348 -1.975 813 HG13 VAL 102 HG13 VAL 102 -9.975 -10.852 -3.021 814 HG21 VAL 102 HG21 VAL 102 -8.699 -6.806 -2.999 815 HG22 VAL 102 HG22 VAL 102 -7.652 -8.035 -2.289 816 HG23 VAL 102 HG23 VAL 102 -9.171 -7.606 -1.500 817 H LYS 103 HN LYS 103 -7.639 -11.375 -5.130 818 HA LYS 103 HA LYS 103 -10.081 -12.322 -6.464 819 HB2 LYS 103 HB2 LYS 103 -7.242 -13.197 -7.025 820 HB3 LYS 103 HB1 LYS 103 -8.681 -13.627 -7.933 821 HG2 LYS 103 HG2 LYS 103 -8.842 -11.546 -8.926 822 HG3 LYS 103 HG1 LYS 103 -7.872 -10.769 -7.674 823 HD2 LYS 103 HD2 LYS 103 -6.294 -10.858 -9.312 824 HD3 LYS 103 HD1 LYS 103 -6.036 -12.452 -8.600 825 HE2 LYS 103 HE2 LYS 103 -6.139 -12.810 -10.917 826 HE3 LYS 103 HE1 LYS 103 -7.703 -13.328 -10.293 827 HZ1 LYS 103 HZ1 LYS 103 -8.764 -11.710 -11.395 828 HZ2 LYS 103 HZ2 LYS 103 -7.382 -11.668 -12.365 829 HZ3 LYS 103 HZ3 LYS 103 -7.570 -10.548 -11.107 830 H GLY 104 HN GLY 104 -10.991 -13.356 -4.729 831 HA2 GLY 104 HA2 GLY 104 -11.374 -15.232 -3.439 832 HA3 GLY 104 HA1 GLY 104 -9.866 -15.904 -4.047 833 H ASN 105 HN ASN 105 -8.079 -15.818 -2.828 834 HA ASN 105 HA ASN 105 -8.253 -14.355 -0.270 835 HB2 ASN 105 HB2 ASN 105 -7.032 -17.062 -0.847 836 HB3 ASN 105 HB1 ASN 105 -6.729 -16.159 0.633 837 HD21 ASN 105 HD21 ASN 105 -8.928 -18.148 -1.090 838 HD22 ASN 105 HD22 ASN 105 -10.131 -18.265 0.147 839 H GLU 106 HN GLU 106 -6.999 -13.981 -3.108 840 HA GLU 106 HA GLU 106 -4.338 -13.190 -2.117 841 HB2 GLU 106 HB2 GLU 106 -5.099 -14.266 -4.834 842 HB3 GLU 106 HB1 GLU 106 -3.548 -13.519 -4.488 843 HG2 GLU 106 HG2 GLU 106 -2.969 -15.255 -2.970 844 HG3 GLU 106 HG1 GLU 106 -4.596 -15.938 -3.041 845 H MET 107 HN MET 107 -3.675 -11.134 -2.579 846 HA MET 107 HA MET 107 -5.511 -9.494 -4.196 847 HB2 MET 107 HB2 MET 107 -5.806 -8.941 -1.851 848 HB3 MET 107 HB1 MET 107 -4.074 -8.726 -1.656 849 HG2 MET 107 HG2 MET 107 -4.069 -6.762 -2.982 850 HG3 MET 107 HG1 MET 107 -5.722 -7.047 -3.524 851 HE1 MET 107 HE1 MET 107 -4.587 -6.354 0.807 852 HE2 MET 107 HE2 MET 107 -3.711 -5.265 -0.271 853 HE3 MET 107 HE3 MET 107 -3.591 -7.011 -0.495 854 H VAL 108 HN VAL 108 -4.453 -9.114 -6.035 855 HA VAL 108 HA VAL 108 -1.578 -8.571 -5.963 856 HB VAL 108 HB VAL 108 -2.175 -10.221 -7.605 857 HG11 VAL 108 HG11 VAL 108 -4.158 -8.231 -8.697 858 HG12 VAL 108 HG12 VAL 108 -4.537 -9.724 -7.839 859 HG13 VAL 108 HG13 VAL 108 -3.763 -9.789 -9.422 860 HG21 VAL 108 HG21 VAL 108 -1.544 -7.543 -8.821 861 HG22 VAL 108 HG22 VAL 108 -1.529 -9.046 -9.746 862 HG23 VAL 108 HG23 VAL 108 -0.426 -8.837 -8.384 863 H GLU 109 HN GLU 109 -0.876 -6.514 -6.027 864 HA GLU 109 HA GLU 109 -2.750 -4.511 -7.087 865 HB2 GLU 109 HB2 GLU 109 -2.389 -3.063 -5.335 866 HB3 GLU 109 HB1 GLU 109 -2.350 -4.620 -4.513 867 HG2 GLU 109 HG2 GLU 109 0.217 -4.440 -4.946 868 HG3 GLU 109 HG1 GLU 109 -0.136 -2.718 -5.106 869 H THR 110 HN THR 110 -1.878 -2.632 -7.948 870 HA THR 110 HA THR 110 0.936 -2.733 -8.767 871 HB THR 110 HB THR 110 -1.395 -2.161 -10.611 872 HG1 THR 110 HG1 THR 110 -0.741 -4.432 -10.056 873 HG21 THR 110 HG21 THR 110 0.474 -0.698 -11.112 874 HG22 THR 110 HG22 THR 110 0.318 -1.932 -12.362 875 HG23 THR 110 HG23 THR 110 1.573 -2.075 -11.132 876 H ILE 111 HN ILE 111 1.781 -0.969 -7.860 877 HA ILE 111 HA ILE 111 0.171 1.503 -7.893 878 HB ILE 111 HB ILE 111 2.482 1.240 -6.030 879 HG12 ILE 111 HG12 ILE 111 -0.220 0.121 -5.279 880 HG13 ILE 111 HG11 ILE 111 1.101 -0.897 -5.858 881 HG21 ILE 111 HG21 ILE 111 1.092 3.310 -6.352 882 HG22 ILE 111 HG22 ILE 111 1.251 2.749 -4.689 883 HG23 ILE 111 HG23 ILE 111 -0.237 2.443 -5.583 884 HD11 ILE 111 HD11 ILE 111 0.970 -0.879 -3.424 885 HD12 ILE 111 HD12 ILE 111 1.181 0.874 -3.421 886 HD13 ILE 111 HD13 ILE 111 2.483 -0.173 -3.991 887 H THR 112 HN THR 112 1.104 3.316 -8.751 888 HA THR 112 HA THR 112 3.928 3.122 -9.540 889 HB THR 112 HB THR 112 1.761 4.400 -11.215 890 HG1 THR 112 HG1 THR 112 1.592 2.158 -11.356 891 HG21 THR 112 HG21 THR 112 3.508 4.692 -12.879 892 HG22 THR 112 HG22 THR 112 4.675 3.892 -11.827 893 HG23 THR 112 HG23 THR 112 4.000 5.455 -11.366 894 H PHE 113 HN PHE 113 4.911 4.463 -8.203 895 HA PHE 113 HA PHE 113 3.949 7.240 -8.024 896 HB2 PHE 113 HB2 PHE 113 4.326 5.318 -5.815 897 HB3 PHE 113 HB1 PHE 113 5.101 6.874 -5.573 898 HD1 PHE 113 HD1 PHE 113 1.848 5.252 -6.268 899 HD2 PHE 113 HD2 PHE 113 3.866 8.736 -4.895 900 HE1 PHE 113 HE1 PHE 113 -0.293 6.176 -5.475 901 HE2 PHE 113 HE2 PHE 113 1.728 9.667 -4.101 902 HZ PHE 113 HZ PHE 113 -0.354 8.381 -4.384 903 H GLY 114 HN GLY 114 5.608 8.760 -7.981 904 HA2 GLY 114 HA2 GLY 114 7.733 9.596 -8.248 905 HA3 GLY 114 HA1 GLY 114 8.318 8.139 -7.463 906 H GLY 115 HN GLY 115 6.371 7.602 -10.189 907 HA2 GLY 115 HA2 GLY 115 6.866 7.179 -12.419 908 HA3 GLY 115 HA1 GLY 115 8.538 7.623 -12.113 909 H VAL 116 HN VAL 116 7.353 5.379 -9.836 910 HA VAL 116 HA VAL 116 8.615 3.197 -11.354 911 HB VAL 116 HB VAL 116 8.534 3.517 -8.356 912 HG11 VAL 116 HG11 VAL 116 9.930 1.510 -10.118 913 HG12 VAL 116 HG12 VAL 116 8.576 1.201 -9.030 914 HG13 VAL 116 HG13 VAL 116 10.151 1.652 -8.373 915 HG21 VAL 116 HG21 VAL 116 10.730 4.070 -10.336 916 HG22 VAL 116 HG22 VAL 116 11.016 3.847 -8.611 917 HG23 VAL 116 HG23 VAL 116 10.010 5.180 -9.171 918 H THR 117 HN THR 117 7.295 1.606 -11.871 919 HA THR 117 HA THR 117 4.709 1.380 -10.563 920 HB THR 117 HB THR 117 5.829 -0.058 -12.981 921 HG1 THR 117 HG1 THR 117 3.930 2.061 -12.741 922 HG21 THR 117 HG21 THR 117 4.072 -1.327 -11.733 923 HG22 THR 117 HG22 THR 117 3.603 -0.880 -13.374 924 HG23 THR 117 HG23 THR 117 2.976 0.028 -11.997 925 H LEU 118 HN LEU 118 5.048 0.421 -8.617 926 HA LEU 118 HA LEU 118 6.605 -2.047 -8.502 927 HB2 LEU 118 HB2 LEU 118 7.023 -0.481 -6.722 928 HB3 LEU 118 HB1 LEU 118 5.316 -0.382 -6.343 929 HG LEU 118 HG LEU 118 5.304 -2.673 -5.526 930 HD11 LEU 118 HD11 LEU 118 6.999 -3.579 -7.069 931 HD12 LEU 118 HD12 LEU 118 7.314 -4.011 -5.392 932 HD13 LEU 118 HD13 LEU 118 8.254 -2.736 -6.165 933 HD21 LEU 118 HD21 LEU 118 7.660 -1.220 -4.346 934 HD22 LEU 118 HD22 LEU 118 6.618 -2.397 -3.549 935 HD23 LEU 118 HD23 LEU 118 5.975 -0.821 -4.010 936 H ILE 119 HN ILE 119 5.567 -3.809 -9.113 937 HA ILE 119 HA ILE 119 2.713 -4.112 -8.528 938 HB ILE 119 HB ILE 119 4.522 -5.839 -10.235 939 HG12 ILE 119 HG12 ILE 119 2.444 -3.768 -10.981 940 HG13 ILE 119 HG11 ILE 119 4.182 -3.618 -11.205 941 HG21 ILE 119 HG21 ILE 119 1.562 -5.938 -9.691 942 HG22 ILE 119 HG22 ILE 119 2.761 -7.207 -9.435 943 HG23 ILE 119 HG23 ILE 119 2.314 -6.732 -11.075 944 HD11 ILE 119 HD11 ILE 119 3.044 -4.143 -13.288 945 HD12 ILE 119 HD12 ILE 119 2.400 -5.618 -12.569 946 HD13 ILE 119 HD13 ILE 119 4.138 -5.442 -12.811 947 H ARG 120 HN ARG 120 2.139 -5.162 -6.721 948 HA ARG 120 HA ARG 120 4.026 -7.170 -5.665 949 HB2 ARG 120 HB2 ARG 120 2.185 -5.532 -3.948 950 HB3 ARG 120 HB1 ARG 120 3.553 -6.512 -3.444 951 HG2 ARG 120 HG2 ARG 120 5.039 -4.908 -4.656 952 HG3 ARG 120 HG1 ARG 120 3.619 -3.887 -4.904 953 HD2 ARG 120 HD2 ARG 120 4.928 -4.660 -2.310 954 HD3 ARG 120 HD1 ARG 120 4.713 -3.046 -2.985 955 HE ARG 120 HE ARG 120 2.163 -3.950 -2.694 956 HH11 ARG 120 HH11 ARG 120 4.889 -3.719 -0.499 957 HH12 ARG 120 HH12 ARG 120 3.897 -3.472 0.897 958 HH21 ARG 120 HH21 ARG 120 0.869 -3.634 -0.894 959 HH22 ARG 120 HH22 ARG 120 1.594 -3.424 0.677 960 H ARG 121 HN ARG 121 3.167 -8.962 -4.611 961 HA ARG 121 HA ARG 121 0.338 -9.494 -5.173 962 HB2 ARG 121 HB2 ARG 121 2.797 -11.159 -5.415 963 HB3 ARG 121 HB1 ARG 121 1.291 -11.960 -4.977 964 HG2 ARG 121 HG2 ARG 121 0.601 -11.906 -7.058 965 HG3 ARG 121 HG1 ARG 121 0.845 -10.167 -7.151 966 HD2 ARG 121 HD2 ARG 121 3.107 -12.116 -7.428 967 HD3 ARG 121 HD1 ARG 121 2.125 -11.615 -8.804 968 HE ARG 121 HE ARG 121 3.245 -9.458 -7.247 969 HH11 ARG 121 HH11 ARG 121 3.602 -11.571 -10.012 970 HH12 ARG 121 HH12 ARG 121 4.768 -10.562 -10.803 971 HH21 ARG 121 HH21 ARG 121 4.794 -8.103 -8.309 972 HH22 ARG 121 HH22 ARG 121 5.434 -8.602 -9.842 973 H SER 122 HN SER 122 -0.892 -9.862 -3.468 974 HA SER 122 HA SER 122 0.450 -10.535 -0.941 975 HB2 SER 122 HB2 SER 122 -0.883 -8.245 -1.335 976 HB3 SER 122 HB1 SER 122 -2.236 -9.264 -0.866 977 HG SER 122 HG SER 122 -0.364 -8.148 0.672 978 H LYS 123 HN LYS 123 -0.436 -12.036 0.388 979 HA LYS 123 HA LYS 123 -2.735 -13.545 -0.644 980 HB2 LYS 123 HB2 LYS 123 -1.562 -15.599 0.344 981 HB3 LYS 123 HB1 LYS 123 -0.929 -14.967 -1.168 982 HG2 LYS 123 HG2 LYS 123 1.073 -14.812 -0.256 983 HG3 LYS 123 HG1 LYS 123 0.446 -13.666 0.929 984 HD2 LYS 123 HD2 LYS 123 -0.222 -15.529 2.370 985 HD3 LYS 123 HD1 LYS 123 0.420 -16.669 1.186 986 HE2 LYS 123 HE2 LYS 123 2.650 -15.706 1.471 987 HE3 LYS 123 HE1 LYS 123 2.005 -14.569 2.649 988 HZ1 LYS 123 HZ1 LYS 123 3.065 -16.431 3.740 989 HZ2 LYS 123 HZ2 LYS 123 2.049 -17.522 2.937 990 HZ3 LYS 123 HZ3 LYS 123 1.402 -16.437 4.062 991 H ARG 124 HN ARG 124 -4.254 -14.030 0.832 992 HA ARG 124 HA ARG 124 -4.260 -12.660 3.289 993 HB2 ARG 124 HB2 ARG 124 -6.205 -13.609 1.783 994 HB3 ARG 124 HB1 ARG 124 -6.048 -15.000 2.845 995 HG2 ARG 124 HG2 ARG 124 -6.528 -13.675 4.771 996 HG3 ARG 124 HG1 ARG 124 -6.479 -12.188 3.821 997 HD2 ARG 124 HD2 ARG 124 -8.740 -12.567 3.985 998 HD3 ARG 124 HD1 ARG 124 -8.369 -13.333 2.442 999 HE ARG 124 HE ARG 124 -8.215 -15.454 3.879 1000 HH11 ARG 124 HH11 ARG 124 -10.399 -12.787 4.459 1001 HH12 ARG 124 HH12 ARG 124 -11.574 -13.756 5.296 1002 HH21 ARG 124 HH21 ARG 124 -9.753 -16.750 4.984 1003 HH22 ARG 124 HH22 ARG 124 -11.202 -16.018 5.606 1004 H VAL 125 HN VAL 125 -4.152 -13.377 5.384 1005 HA VAL 125 HA VAL 125 -3.125 -16.076 5.864 1006 HB VAL 125 HB VAL 125 -1.121 -14.773 5.774 1007 HG11 VAL 125 HG11 VAL 125 -2.356 -12.569 6.126 1008 HG12 VAL 125 HG12 VAL 125 -0.742 -12.712 6.821 1009 HG13 VAL 125 HG13 VAL 125 -2.160 -12.874 7.852 1010 HG21 VAL 125 HG21 VAL 125 -1.679 -14.933 8.721 1011 HG22 VAL 125 HG22 VAL 125 -0.165 -15.223 7.863 1012 HG23 VAL 125 HG23 VAL 125 -1.488 -16.379 7.727
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