NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
21992 | 2ita | 7320 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 1H MET 1 1H MET 1 30.017 -2.939 -11.527 2 2H MET 1 2H MET 1 30.515 -1.374 -12.024 3 3H MET 1 3H MET 1 30.125 -1.671 -10.379 4 HA MET 1 HA MET 1 32.278 -3.091 -11.774 5 1HB MET 1 HB2 MET 1 33.808 -1.421 -10.798 6 2HB MET 1 HB1 MET 1 32.708 -0.700 -11.964 7 1HG MET 1 HG2 MET 1 31.491 0.402 -10.331 8 2HG MET 1 HG1 MET 1 32.059 -0.665 -9.047 9 1HE MET 1 HE1 MET 1 34.298 -0.958 -8.428 10 2HE MET 1 HE2 MET 1 34.979 0.475 -7.657 11 3HE MET 1 HE3 MET 1 35.679 -0.135 -9.157 12 H ALA 2 HN ALA 2 33.419 -4.413 -10.430 13 HA ALA 2 HA ALA 2 32.428 -4.631 -7.665 14 1HB ALA 2 HB1 ALA 2 32.923 -6.964 -7.730 15 2HB ALA 2 HB2 ALA 2 33.753 -6.802 -9.277 16 3HB ALA 2 HB3 ALA 2 32.008 -6.571 -9.185 17 H ASP 3 HN ASP 3 33.885 -4.911 -5.973 18 HA ASP 3 HA ASP 3 36.646 -5.271 -6.213 19 1HB ASP 3 HB2 ASP 3 37.447 -2.974 -5.716 20 2HB ASP 3 HB1 ASP 3 36.699 -3.103 -7.305 21 H LYS 4 HN LYS 4 34.061 -3.689 -4.410 22 HA LYS 4 HA LYS 4 35.423 -3.973 -1.885 23 1HB LYS 4 HB2 LYS 4 33.349 -2.382 -2.845 24 2HB LYS 4 HB1 LYS 4 32.566 -3.465 -1.702 25 1HG LYS 4 HG2 LYS 4 34.242 -2.802 -0.002 26 2HG LYS 4 HG1 LYS 4 34.888 -1.631 -1.153 27 1HD LYS 4 HD2 LYS 4 32.214 -1.054 -1.187 28 2HD LYS 4 HD1 LYS 4 32.470 -1.517 0.496 29 1HE LYS 4 HE2 LYS 4 33.957 0.210 0.882 30 2HE LYS 4 HE1 LYS 4 34.363 0.378 -0.825 31 1HZ LYS 4 HZ1 LYS 4 31.657 1.013 0.174 32 2HZ LYS 4 HZ2 LYS 4 32.403 1.527 -1.254 33 3HZ LYS 4 HZ3 LYS 4 32.902 2.157 0.235 34 H THR 5 HN THR 5 35.299 -5.611 -0.502 35 HA THR 5 HA THR 5 34.916 -7.744 0.230 36 HB THR 5 HB THR 5 32.309 -8.099 0.502 37 HG1 THR 5 HG1 THR 5 32.478 -5.302 0.095 38 1HG2 THR 5 HG21 THR 5 34.156 -6.322 1.968 39 2HG2 THR 5 HG22 THR 5 33.250 -7.731 2.520 40 3HG2 THR 5 HG23 THR 5 32.436 -6.178 2.328 41 H ILE 6 HN ILE 6 35.349 -7.685 -2.576 42 HA ILE 6 HA ILE 6 33.403 -9.183 -3.982 43 HB ILE 6 HB ILE 6 34.981 -9.439 -5.731 44 1HG1 ILE 6 HG12 ILE 6 36.871 -10.291 -4.383 45 2HG1 ILE 6 HG11 ILE 6 37.376 -9.027 -5.499 46 1HG2 ILE 6 HG21 ILE 6 34.685 -6.899 -4.383 47 2HG2 ILE 6 HG22 ILE 6 34.613 -7.282 -6.103 48 3HG2 ILE 6 HG23 ILE 6 36.168 -6.967 -5.333 49 1HD1 ILE 6 HD11 ILE 6 38.494 -8.559 -3.512 50 2HD1 ILE 6 HD12 ILE 6 37.066 -8.880 -2.527 51 3HD1 ILE 6 HD13 ILE 6 37.138 -7.432 -3.531 52 H PHE 7 HN PHE 7 33.040 -11.308 -4.164 53 HA PHE 7 HA PHE 7 34.826 -13.126 -2.686 54 1HB PHE 7 HB2 PHE 7 32.127 -12.686 -2.286 55 2HB PHE 7 HB1 PHE 7 32.142 -14.141 -3.276 56 HD1 PHE 7 HD1 PHE 7 34.892 -15.088 -2.129 57 HD2 PHE 7 HD2 PHE 7 31.238 -13.808 -0.358 58 HE1 PHE 7 HE1 PHE 7 35.389 -16.440 -0.135 59 HE2 PHE 7 HE2 PHE 7 31.731 -15.156 1.640 60 HZ PHE 7 HZ PHE 7 33.808 -16.474 1.754 61 H ASN 8 HN ASN 8 33.684 -15.522 -3.679 62 HA ASN 8 HA ASN 8 33.965 -15.443 -6.569 63 1HB ASN 8 HB2 ASN 8 36.285 -15.682 -5.525 64 2HB ASN 8 HB1 ASN 8 35.764 -17.276 -4.987 65 1HD2 ASN 8 HD21 ASN 8 35.848 -15.280 -7.918 66 2HD2 ASN 8 HD22 ASN 8 36.274 -16.568 -8.988 67 H ASP 9 HN ASP 9 32.261 -16.559 -7.249 68 HA ASP 9 HA ASP 9 31.137 -18.668 -5.601 69 1HB ASP 9 HB2 ASP 9 30.218 -17.329 -8.145 70 2HB ASP 9 HB1 ASP 9 29.380 -18.711 -7.447 71 H HIS 10 HN HIS 10 31.157 -18.792 -9.126 72 HA HIS 10 HA HIS 10 32.172 -21.512 -8.971 73 1HB HIS 10 HB2 HIS 10 30.888 -19.904 -11.171 74 2HB HIS 10 HB1 HIS 10 31.632 -21.469 -11.477 75 HD1 HIS 10 HD1 HIS 10 29.460 -20.521 -8.517 76 HD2 HIS 10 HD2 HIS 10 29.424 -23.028 -11.831 77 HE1 HIS 10 HE1 HIS 10 27.400 -21.943 -8.262 78 HE2 HIS 10 HE2 HIS 10 27.353 -23.391 -10.324 79 H LEU 11 HN LEU 11 32.780 -19.386 -11.711 80 HA LEU 11 HA LEU 11 35.653 -19.493 -11.124 81 1HB LEU 11 HB2 LEU 11 36.206 -20.200 -13.283 82 2HB LEU 11 HB1 LEU 11 34.885 -21.236 -12.789 83 HG LEU 11 HG LEU 11 34.352 -20.752 -14.982 84 1HD1 LEU 11 HD11 LEU 11 32.471 -20.223 -13.478 85 2HD1 LEU 11 HD12 LEU 11 32.424 -19.340 -15.004 86 3HD1 LEU 11 HD13 LEU 11 32.950 -18.525 -13.533 87 1HD2 LEU 11 HD21 LEU 11 34.665 -17.829 -14.911 88 2HD2 LEU 11 HD22 LEU 11 35.056 -18.986 -16.184 89 3HD2 LEU 11 HD23 LEU 11 36.158 -18.765 -14.824 90 H ASN 12 HN ASN 12 33.157 -17.482 -11.462 91 HA ASN 12 HA ASN 12 34.632 -15.481 -13.028 92 1HB ASN 12 HB2 ASN 12 32.437 -14.262 -13.077 93 2HB ASN 12 HB1 ASN 12 32.417 -15.824 -13.889 94 1HD2 ASN 12 HD21 ASN 12 30.456 -13.998 -12.316 95 2HD2 ASN 12 HD22 ASN 12 29.600 -15.128 -11.327 96 H THR 13 HN THR 13 33.952 -13.143 -12.189 97 HA THR 13 HA THR 13 35.339 -12.674 -9.852 98 HB THR 13 HB THR 13 35.087 -10.751 -11.082 99 HG1 THR 13 HG1 THR 13 34.466 -10.301 -8.911 100 1HG2 THR 13 HG21 THR 13 32.442 -11.797 -11.751 101 2HG2 THR 13 HG22 THR 13 33.567 -10.836 -12.712 102 3HG2 THR 13 HG23 THR 13 32.505 -10.046 -11.547 103 H ASN 14 HN ASN 14 31.953 -11.668 -9.786 104 HA ASN 14 HA ASN 14 30.868 -13.490 -8.037 105 1HB ASN 14 HB2 ASN 14 31.066 -12.141 -5.860 106 2HB ASN 14 HB1 ASN 14 32.471 -13.080 -6.357 107 1HD2 ASN 14 HD21 ASN 14 31.264 -10.012 -5.579 108 2HD2 ASN 14 HD22 ASN 14 32.688 -9.098 -5.925 109 HA PRO 15 HA PRO 15 28.289 -9.805 -9.345 110 1HB PRO 15 HB2 PRO 15 26.876 -11.529 -11.187 111 2HB PRO 15 HB1 PRO 15 27.840 -10.095 -11.541 112 1HG PRO 15 HG2 PRO 15 28.565 -12.637 -12.254 113 2HG PRO 15 HG1 PRO 15 29.717 -11.316 -11.993 114 1HD PRO 15 HD2 PRO 15 28.952 -13.559 -10.164 115 2HD PRO 15 HD1 PRO 15 30.547 -12.840 -10.462 116 H LYS 16 HN LYS 16 27.717 -13.045 -8.320 117 HA LYS 16 HA LYS 16 24.894 -12.592 -7.782 118 1HB LYS 16 HB2 LYS 16 26.309 -14.832 -8.450 119 2HB LYS 16 HB1 LYS 16 26.156 -15.024 -6.709 120 1HG LYS 16 HG2 LYS 16 23.906 -14.663 -8.676 121 2HG LYS 16 HG1 LYS 16 24.345 -16.150 -7.835 122 1HD LYS 16 HD2 LYS 16 24.028 -14.271 -5.809 123 2HD LYS 16 HD1 LYS 16 22.718 -13.927 -6.940 124 1HE LYS 16 HE2 LYS 16 21.723 -15.516 -5.620 125 2HE LYS 16 HE1 LYS 16 22.412 -16.533 -6.884 126 1HZ LYS 16 HZ1 LYS 16 24.362 -16.202 -4.923 127 2HZ LYS 16 HZ2 LYS 16 23.522 -17.613 -5.323 128 3HZ LYS 16 HZ3 LYS 16 22.921 -16.587 -4.122 129 H THR 17 HN THR 17 27.744 -13.539 -5.824 130 HA THR 17 HA THR 17 26.463 -13.239 -3.351 131 HB THR 17 HB THR 17 29.398 -13.055 -4.057 132 HG1 THR 17 HG1 THR 17 27.933 -15.194 -2.920 133 1HG2 THR 17 HG21 THR 17 28.692 -12.066 -1.788 134 2HG2 THR 17 HG22 THR 17 29.991 -13.259 -1.829 135 3HG2 THR 17 HG23 THR 17 28.368 -13.742 -1.336 136 H ASN 18 HN ASN 18 27.934 -10.954 -5.506 137 HA ASN 18 HA ASN 18 28.423 -8.902 -3.694 138 1HB ASN 18 HB2 ASN 18 29.210 -8.991 -6.062 139 2HB ASN 18 HB1 ASN 18 27.577 -8.570 -6.563 140 1HD2 ASN 18 HD21 ASN 18 27.263 -6.509 -6.950 141 2HD2 ASN 18 HD22 ASN 18 28.130 -5.191 -6.243 142 H LEU 19 HN LEU 19 25.719 -9.031 -6.003 143 HA LEU 19 HA LEU 19 24.222 -7.092 -4.537 144 1HB LEU 19 HB2 LEU 19 23.992 -7.123 -6.909 145 2HB LEU 19 HB1 LEU 19 23.584 -8.826 -6.913 146 HG LEU 19 HG LEU 19 21.738 -7.150 -5.357 147 1HD1 LEU 19 HD11 LEU 19 22.181 -5.565 -7.116 148 2HD1 LEU 19 HD12 LEU 19 20.595 -6.291 -7.372 149 3HD1 LEU 19 HD13 LEU 19 21.973 -6.815 -8.342 150 1HD2 LEU 19 HD21 LEU 19 20.113 -8.586 -6.267 151 2HD2 LEU 19 HD22 LEU 19 21.524 -9.605 -5.976 152 3HD2 LEU 19 HD23 LEU 19 21.158 -9.051 -7.610 153 H ARG 20 HN ARG 20 24.143 -10.595 -4.903 154 HA ARG 20 HA ARG 20 21.678 -10.993 -3.646 155 1HB ARG 20 HB2 ARG 20 22.958 -12.673 -5.033 156 2HB ARG 20 HB1 ARG 20 23.926 -12.985 -3.596 157 1HG ARG 20 HG2 ARG 20 22.098 -14.603 -3.894 158 2HG ARG 20 HG1 ARG 20 21.976 -13.699 -2.381 159 1HD ARG 20 HD2 ARG 20 20.580 -12.596 -4.754 160 2HD ARG 20 HD1 ARG 20 19.898 -14.047 -4.017 161 HE ARG 20 HE ARG 20 19.927 -11.375 -2.909 162 1HH1 ARG 20 HH11 ARG 20 19.637 -14.787 -2.206 163 2HH1 ARG 20 HH12 ARG 20 18.772 -14.534 -0.727 164 1HH2 ARG 20 HH21 ARG 20 18.788 -11.048 -0.967 165 2HH2 ARG 20 HH22 ARG 20 18.290 -12.413 -0.025 166 H LEU 21 HN LEU 21 24.957 -10.842 -2.265 167 HA LEU 21 HA LEU 21 23.916 -11.547 0.336 168 1HB LEU 21 HB2 LEU 21 26.037 -11.864 0.965 169 2HB LEU 21 HB1 LEU 21 26.393 -11.759 -0.741 170 HG LEU 21 HG LEU 21 28.001 -10.440 0.393 171 1HD1 LEU 21 HD11 LEU 21 26.066 -9.225 -1.347 172 2HD1 LEU 21 HD12 LEU 21 27.816 -9.014 -1.284 173 3HD1 LEU 21 HD13 LEU 21 26.769 -8.027 -0.261 174 1HD2 LEU 21 HD21 LEU 21 27.628 -9.451 2.341 175 2HD2 LEU 21 HD22 LEU 21 25.962 -10.026 2.267 176 3HD2 LEU 21 HD23 LEU 21 26.373 -8.429 1.639 177 H TRP 22 HN TRP 22 24.169 -8.711 -1.514 178 HA TRP 22 HA TRP 22 24.113 -6.902 0.751 179 1HB TRP 22 HB2 TRP 22 25.139 -6.444 -1.600 180 2HB TRP 22 HB1 TRP 22 23.477 -6.128 -2.085 181 HD1 TRP 22 HD1 TRP 22 26.043 -4.840 0.521 182 HE1 TRP 22 HE1 TRP 22 25.562 -2.346 0.940 183 HE3 TRP 22 HE3 TRP 22 21.859 -4.323 -2.369 184 HZ2 TRP 22 HZ2 TRP 22 23.661 -0.415 0.148 185 HZ3 TRP 22 HZ3 TRP 22 20.768 -2.119 -2.485 186 HH2 TRP 22 HH2 TRP 22 21.652 -0.207 -1.250 187 H VAL 23 HN VAL 23 21.944 -8.143 -1.746 188 HA VAL 23 HA VAL 23 19.651 -6.687 -1.004 189 HB VAL 23 HB VAL 23 19.796 -9.400 -2.325 190 1HG1 VAL 23 HG11 VAL 23 17.585 -9.373 -1.919 191 2HG1 VAL 23 HG12 VAL 23 17.534 -8.223 -3.254 192 3HG1 VAL 23 HG13 VAL 23 17.563 -7.639 -1.589 193 1HG2 VAL 23 HG21 VAL 23 19.141 -7.074 -3.967 194 2HG2 VAL 23 HG22 VAL 23 20.263 -8.400 -4.274 195 3HG2 VAL 23 HG23 VAL 23 20.770 -7.026 -3.292 196 H ALA 24 HN ALA 24 21.090 -9.640 0.158 197 HA ALA 24 HA ALA 24 18.851 -10.417 1.791 198 1HB ALA 24 HB1 ALA 24 20.327 -12.173 2.605 199 2HB ALA 24 HB2 ALA 24 21.701 -11.407 1.802 200 3HB ALA 24 HB3 ALA 24 20.380 -12.080 0.845 201 H PHE 25 HN PHE 25 21.695 -8.500 2.114 202 HA PHE 25 HA PHE 25 22.038 -8.521 4.890 203 1HB PHE 25 HB2 PHE 25 23.858 -7.435 4.187 204 2HB PHE 25 HB1 PHE 25 23.123 -7.118 2.625 205 HD1 PHE 25 HD1 PHE 25 23.114 -4.935 1.981 206 HD2 PHE 25 HD2 PHE 25 22.789 -5.840 6.124 207 HE1 PHE 25 HE1 PHE 25 23.061 -2.530 2.498 208 HE2 PHE 25 HE2 PHE 25 22.728 -3.437 6.650 209 HZ PHE 25 HZ PHE 25 22.866 -1.778 4.835 210 H GLN 26 HN GLN 26 20.060 -6.423 2.825 211 HA GLN 26 HA GLN 26 19.006 -5.014 5.161 212 1HB GLN 26 HB2 GLN 26 17.718 -3.712 3.473 213 2HB GLN 26 HB1 GLN 26 19.456 -3.648 3.215 214 1HG GLN 26 HG2 GLN 26 18.462 -5.861 1.774 215 2HG GLN 26 HG1 GLN 26 17.413 -4.485 1.431 216 1HE2 GLN 26 HE21 GLN 26 20.841 -4.420 2.198 217 2HE2 GLN 26 HE22 GLN 26 21.364 -3.784 0.680 218 H MET 27 HN MET 27 18.171 -7.450 2.857 219 HA MET 27 HA MET 27 15.392 -7.601 3.150 220 1HB MET 27 HB2 MET 27 15.967 -9.038 1.493 221 2HB MET 27 HB1 MET 27 17.591 -9.201 2.132 222 1HG MET 27 HG2 MET 27 16.636 -11.346 2.064 223 2HG MET 27 HG1 MET 27 16.753 -10.858 3.752 224 1HE MET 27 HE1 MET 27 13.609 -11.441 5.189 225 2HE MET 27 HE2 MET 27 15.373 -11.507 5.170 226 3HE MET 27 HE3 MET 27 14.433 -12.848 4.513 227 H MET 28 HN MET 28 18.021 -8.727 5.093 228 HA MET 28 HA MET 28 16.271 -10.250 6.837 229 1HB MET 28 HB2 MET 28 18.738 -10.740 5.918 230 2HB MET 28 HB1 MET 28 19.161 -9.931 7.427 231 1HG MET 28 HG2 MET 28 17.743 -11.552 8.647 232 2HG MET 28 HG1 MET 28 17.452 -12.392 7.127 233 1HE MET 28 HE1 MET 28 21.279 -10.995 7.762 234 2HE MET 28 HE2 MET 28 21.483 -11.942 9.235 235 3HE MET 28 HE3 MET 28 20.184 -10.756 9.125 236 H LYS 29 HN LYS 29 18.360 -7.411 6.953 237 HA LYS 29 HA LYS 29 17.590 -6.894 9.724 238 1HB LYS 29 HB2 LYS 29 19.555 -5.624 7.829 239 2HB LYS 29 HB1 LYS 29 19.101 -4.836 9.333 240 1HG LYS 29 HG2 LYS 29 20.416 -6.160 10.545 241 2HG LYS 29 HG1 LYS 29 19.860 -7.614 9.715 242 1HD LYS 29 HD2 LYS 29 22.287 -7.180 9.429 243 2HD LYS 29 HD1 LYS 29 21.401 -7.235 7.906 244 1HE LYS 29 HE2 LYS 29 21.706 -5.018 7.488 245 2HE LYS 29 HE1 LYS 29 21.696 -4.587 9.198 246 1HZ LYS 29 HZ1 LYS 29 23.905 -4.829 9.357 247 2HZ LYS 29 HZ2 LYS 29 23.896 -4.654 7.676 248 3HZ LYS 29 HZ3 LYS 29 23.950 -6.197 8.364 249 H GLY 30 HN GLY 30 17.649 -5.134 6.657 250 1HA GLY 30 HA2 GLY 30 16.052 -2.982 7.319 251 2HA GLY 30 HA1 GLY 30 16.171 -3.687 5.711 252 H ALA 31 HN ALA 31 15.166 -6.286 6.698 253 HA ALA 31 HA ALA 31 12.381 -5.787 6.267 254 1HB ALA 31 HB1 ALA 31 13.350 -7.735 5.283 255 2HB ALA 31 HB2 ALA 31 12.197 -8.267 6.511 256 3HB ALA 31 HB3 ALA 31 13.931 -8.310 6.852 257 H GLY 32 HN GLY 32 14.412 -6.319 9.038 258 1HA GLY 32 HA2 GLY 32 12.157 -6.907 10.780 259 2HA GLY 32 HA1 GLY 32 13.847 -6.838 11.251 260 H TRP 33 HN TRP 33 13.559 -4.106 9.569 261 HA TRP 33 HA TRP 33 13.238 -2.520 11.964 262 1HB TRP 33 HB2 TRP 33 15.033 -1.931 10.450 263 2HB TRP 33 HB1 TRP 33 13.903 -1.762 9.112 264 HD1 TRP 33 HD1 TRP 33 13.876 0.736 8.547 265 HE1 TRP 33 HE1 TRP 33 13.578 2.920 9.875 266 HE3 TRP 33 HE3 TRP 33 13.816 -1.191 13.284 267 HZ2 TRP 33 HZ2 TRP 33 13.347 3.722 12.569 268 HZ3 TRP 33 HZ3 TRP 33 13.552 0.354 15.179 269 HH2 TRP 33 HH2 TRP 33 13.325 2.759 14.829 270 H ALA 34 HN ALA 34 11.925 -1.984 8.691 271 HA ALA 34 HA ALA 34 9.704 -0.508 9.663 272 1HB ALA 34 HB1 ALA 34 10.005 0.128 7.525 273 2HB ALA 34 HB2 ALA 34 8.924 -1.219 7.167 274 3HB ALA 34 HB3 ALA 34 10.672 -1.433 7.044 275 H GLY 35 HN GLY 35 10.232 -3.886 8.953 276 1HA GLY 35 HA2 GLY 35 7.594 -4.767 8.715 277 2HA GLY 35 HA1 GLY 35 8.922 -5.733 9.347 278 H GLY 36 HN GLY 36 9.594 -4.462 11.640 279 1HA GLY 36 HA2 GLY 36 7.335 -5.129 13.329 280 2HA GLY 36 HA1 GLY 36 8.966 -4.757 13.863 281 H VAL 37 HN VAL 37 9.057 -2.225 12.346 282 HA VAL 37 HA VAL 37 7.867 -0.572 14.351 283 HB VAL 37 HB VAL 37 9.242 0.213 11.776 284 1HG1 VAL 37 HG11 VAL 37 8.613 1.878 14.212 285 2HG1 VAL 37 HG12 VAL 37 7.770 1.970 12.667 286 3HG1 VAL 37 HG13 VAL 37 9.472 2.418 12.770 287 1HG2 VAL 37 HG21 VAL 37 10.577 0.619 14.366 288 2HG2 VAL 37 HG22 VAL 37 11.235 0.087 12.820 289 3HG2 VAL 37 HG23 VAL 37 10.396 -1.061 13.862 290 H PHE 38 HN PHE 38 7.473 -0.853 10.837 291 HA PHE 38 HA PHE 38 5.170 0.791 10.819 292 1HB PHE 38 HB2 PHE 38 6.760 0.505 8.898 293 2HB PHE 38 HB1 PHE 38 6.060 -1.090 8.643 294 HD1 PHE 38 HD1 PHE 38 4.409 2.128 9.502 295 HD2 PHE 38 HD2 PHE 38 4.938 -0.964 6.628 296 HE1 PHE 38 HE1 PHE 38 2.645 3.128 8.109 297 HE2 PHE 38 HE2 PHE 38 3.177 0.030 5.228 298 HZ PHE 38 HZ PHE 38 2.029 2.080 5.967 299 H PHE 39 HN PHE 39 5.552 -2.691 10.097 300 HA PHE 39 HA PHE 39 2.747 -3.151 10.087 301 1HB PHE 39 HB2 PHE 39 5.032 -4.597 9.372 302 2HB PHE 39 HB1 PHE 39 4.310 -5.529 10.680 303 HD1 PHE 39 HD1 PHE 39 1.648 -5.756 10.448 304 HD2 PHE 39 HD2 PHE 39 4.372 -5.108 7.243 305 HE1 PHE 39 HE1 PHE 39 0.014 -6.703 8.873 306 HE2 PHE 39 HE2 PHE 39 2.742 -6.054 5.661 307 HZ PHE 39 HZ PHE 39 0.559 -6.854 6.476 308 H GLY 40 HN GLY 40 5.279 -3.603 12.539 309 1HA GLY 40 HA2 GLY 40 3.706 -4.904 14.463 310 2HA GLY 40 HA1 GLY 40 5.101 -3.894 14.821 311 H THR 41 HN THR 41 3.875 -1.559 13.495 312 HA THR 41 HA THR 41 2.325 -0.644 15.766 313 HB THR 41 HB THR 41 3.259 0.739 13.255 314 HG1 THR 41 HG1 THR 41 4.694 1.753 14.726 315 1HG2 THR 41 HG21 THR 41 1.242 1.606 15.013 316 2HG2 THR 41 HG22 THR 41 2.032 2.513 13.723 317 3HG2 THR 41 HG23 THR 41 2.681 2.563 15.362 318 H LEU 42 HN LEU 42 1.859 -1.041 12.250 319 HA LEU 42 HA LEU 42 -0.775 -0.137 12.160 320 1HB LEU 42 HB2 LEU 42 0.596 -2.172 10.422 321 2HB LEU 42 HB1 LEU 42 -1.002 -1.525 10.103 322 HG LEU 42 HG LEU 42 1.645 -0.122 9.936 323 1HD1 LEU 42 HD11 LEU 42 0.556 -1.363 8.000 324 2HD1 LEU 42 HD12 LEU 42 1.037 0.309 7.716 325 3HD1 LEU 42 HD13 LEU 42 -0.656 -0.084 8.012 326 1HD2 LEU 42 HD21 LEU 42 -1.080 1.129 10.211 327 2HD2 LEU 42 HD22 LEU 42 0.316 1.969 9.535 328 3HD2 LEU 42 HD23 LEU 42 0.346 1.411 11.208 329 H LEU 43 HN LEU 43 0.512 -3.348 12.835 330 HA LEU 43 HA LEU 43 -2.052 -4.560 13.012 331 1HB LEU 43 HB2 LEU 43 -0.823 -6.417 12.963 332 2HB LEU 43 HB1 LEU 43 0.630 -5.438 13.002 333 HG LEU 43 HG LEU 43 -0.804 -6.372 15.486 334 1HD1 LEU 43 HD11 LEU 43 0.329 -8.091 13.780 335 2HD1 LEU 43 HD12 LEU 43 0.392 -8.291 15.532 336 3HD1 LEU 43 HD13 LEU 43 1.764 -7.587 14.675 337 1HD2 LEU 43 HD21 LEU 43 1.134 -4.426 15.081 338 2HD2 LEU 43 HD22 LEU 43 2.027 -5.831 15.669 339 3HD2 LEU 43 HD23 LEU 43 0.690 -5.175 16.616 340 H LEU 44 HN LEU 44 0.067 -2.770 15.141 341 HA LEU 44 HA LEU 44 -1.235 -3.593 17.548 342 1HB LEU 44 HB2 LEU 44 1.091 -2.369 17.090 343 2HB LEU 44 HB1 LEU 44 0.115 -0.952 17.410 344 HG LEU 44 HG LEU 44 -0.288 -1.574 19.631 345 1HD1 LEU 44 HD11 LEU 44 0.563 -4.334 18.800 346 2HD1 LEU 44 HD12 LEU 44 -0.999 -3.815 19.435 347 3HD1 LEU 44 HD13 LEU 44 0.416 -3.848 20.490 348 1HD2 LEU 44 HD21 LEU 44 2.505 -2.267 18.787 349 2HD2 LEU 44 HD22 LEU 44 2.018 -2.281 20.483 350 3HD2 LEU 44 HD23 LEU 44 1.911 -0.790 19.547 351 H ILE 45 HN ILE 45 -1.626 -0.891 15.321 352 HA ILE 45 HA ILE 45 -3.724 0.268 16.962 353 HB ILE 45 HB ILE 45 -2.243 1.129 14.524 354 1HG1 ILE 45 HG12 ILE 45 -3.103 2.899 16.772 355 2HG1 ILE 45 HG11 ILE 45 -1.855 1.696 17.081 356 1HG2 ILE 45 HG21 ILE 45 -5.041 1.887 15.217 357 2HG2 ILE 45 HG22 ILE 45 -4.307 1.607 13.634 358 3HG2 ILE 45 HG23 ILE 45 -3.962 3.098 14.514 359 1HD1 ILE 45 HD11 ILE 45 -1.778 4.108 15.348 360 2HD1 ILE 45 HD12 ILE 45 -0.771 2.720 14.933 361 3HD1 ILE 45 HD13 ILE 45 -0.589 3.504 16.503 362 H GLY 46 HN GLY 46 -3.439 -1.086 13.681 363 1HA GLY 46 HA2 GLY 46 -6.154 -0.841 13.012 364 2HA GLY 46 HA1 GLY 46 -5.005 -1.930 12.245 365 H PHE 47 HN PHE 47 -4.374 -3.181 14.857 366 HA PHE 47 HA PHE 47 -6.556 -5.056 14.787 367 1HB PHE 47 HB2 PHE 47 -4.023 -5.622 14.884 368 2HB PHE 47 HB1 PHE 47 -4.184 -5.292 16.611 369 HD1 PHE 47 HD1 PHE 47 -5.696 -7.330 13.888 370 HD2 PHE 47 HD2 PHE 47 -4.839 -6.985 18.042 371 HE1 PHE 47 HE1 PHE 47 -6.513 -9.624 14.243 372 HE2 PHE 47 HE2 PHE 47 -5.654 -9.277 18.406 373 HZ PHE 47 HZ PHE 47 -6.491 -10.600 16.505 374 H PHE 48 HN PHE 48 -5.206 -2.635 16.893 375 HA PHE 48 HA PHE 48 -6.760 -3.326 19.202 376 1HB PHE 48 HB2 PHE 48 -4.956 -1.070 18.413 377 2HB PHE 48 HB1 PHE 48 -6.039 -0.855 19.783 378 HD1 PHE 48 HD1 PHE 48 -4.422 -4.047 18.867 379 HD2 PHE 48 HD2 PHE 48 -4.425 -0.699 21.496 380 HE1 PHE 48 HE1 PHE 48 -2.817 -5.201 20.334 381 HE2 PHE 48 HE2 PHE 48 -2.820 -1.847 22.966 382 HZ PHE 48 HZ PHE 48 -2.015 -4.102 22.386 383 H ARG 49 HN ARG 49 -7.106 -1.208 16.451 384 HA ARG 49 HA ARG 49 -9.332 0.209 17.566 385 1HB ARG 49 HB2 ARG 49 -9.244 1.586 15.718 386 2HB ARG 49 HB1 ARG 49 -7.575 1.052 15.843 387 1HG ARG 49 HG2 ARG 49 -7.808 0.646 13.652 388 2HG ARG 49 HG1 ARG 49 -8.573 -0.846 14.205 389 1HD ARG 49 HD2 ARG 49 -10.767 0.271 14.099 390 2HD ARG 49 HD1 ARG 49 -9.978 1.723 13.481 391 HE ARG 49 HE ARG 49 -9.324 -0.504 11.879 392 1HH1 ARG 49 HH11 ARG 49 -11.962 1.666 12.582 393 2HH1 ARG 49 HH12 ARG 49 -12.682 1.502 11.016 394 1HH2 ARG 49 HH21 ARG 49 -10.269 -0.724 9.815 395 2HH2 ARG 49 HH22 ARG 49 -11.721 0.143 9.445 396 H VAL 50 HN VAL 50 -8.878 -2.568 15.500 397 HA VAL 50 HA VAL 50 -11.610 -2.614 14.593 398 HB VAL 50 HB VAL 50 -11.078 -4.866 13.723 399 1HG1 VAL 50 HG11 VAL 50 -10.586 -3.442 12.045 400 2HG1 VAL 50 HG12 VAL 50 -8.931 -3.947 12.383 401 3HG1 VAL 50 HG13 VAL 50 -9.547 -2.438 13.057 402 1HG2 VAL 50 HG21 VAL 50 -8.728 -5.660 13.850 403 2HG2 VAL 50 HG22 VAL 50 -9.558 -5.660 15.406 404 3HG2 VAL 50 HG23 VAL 50 -8.401 -4.385 15.024 405 H VAL 51 HN VAL 51 -9.718 -4.072 17.166 406 HA VAL 51 HA VAL 51 -11.744 -5.902 17.990 407 HB VAL 51 HB VAL 51 -9.418 -4.785 19.572 408 1HG1 VAL 51 HG11 VAL 51 -9.754 -6.895 20.922 409 2HG1 VAL 51 HG12 VAL 51 -11.319 -7.051 20.124 410 3HG1 VAL 51 HG13 VAL 51 -10.978 -5.644 21.130 411 1HG2 VAL 51 HG21 VAL 51 -9.383 -7.560 18.575 412 2HG2 VAL 51 HG22 VAL 51 -8.079 -6.379 18.696 413 3HG2 VAL 51 HG23 VAL 51 -9.220 -6.297 17.354 414 H GLY 52 HN GLY 52 -10.973 -2.575 18.660 415 1HA GLY 52 HA2 GLY 52 -13.018 -2.443 20.742 416 2HA GLY 52 HA1 GLY 52 -11.897 -1.159 20.311 417 H ARG 53 HN ARG 53 -13.335 -2.711 17.646 418 HA ARG 53 HA ARG 53 -15.248 -0.498 17.364 419 1HB ARG 53 HB2 ARG 53 -13.383 -0.303 15.794 420 2HB ARG 53 HB1 ARG 53 -13.693 -1.928 15.202 421 1HG ARG 53 HG2 ARG 53 -15.044 -1.076 13.673 422 2HG ARG 53 HG1 ARG 53 -16.114 -0.516 14.959 423 1HD ARG 53 HD2 ARG 53 -13.736 1.149 14.457 424 2HD ARG 53 HD1 ARG 53 -14.929 1.111 13.160 425 HE ARG 53 HE ARG 53 -15.152 2.523 15.580 426 1HH1 ARG 53 HH11 ARG 53 -17.069 0.526 13.450 427 2HH1 ARG 53 HH12 ARG 53 -18.568 1.263 13.907 428 1HH2 ARG 53 HH21 ARG 53 -17.124 3.492 16.179 429 2HH2 ARG 53 HH22 ARG 53 -18.600 2.946 15.455 430 H MET 54 HN MET 54 -14.856 -3.903 17.459 431 HA MET 54 HA MET 54 -17.689 -4.207 16.785 432 1HB MET 54 HB2 MET 54 -15.517 -5.979 15.660 433 2HB MET 54 HB1 MET 54 -17.247 -6.196 15.433 434 1HG MET 54 HG2 MET 54 -15.800 -3.717 14.555 435 2HG MET 54 HG1 MET 54 -15.971 -5.140 13.527 436 1HE MET 54 HE1 MET 54 -19.828 -5.380 13.043 437 2HE MET 54 HE2 MET 54 -18.919 -6.166 14.335 438 3HE MET 54 HE3 MET 54 -18.255 -6.100 12.702 439 H LEU 55 HN LEU 55 -16.331 -4.221 19.347 440 HA LEU 55 HA LEU 55 -17.277 -6.827 20.227 441 1HB LEU 55 HB2 LEU 55 -14.488 -6.171 20.079 442 2HB LEU 55 HB1 LEU 55 -14.950 -6.396 21.757 443 HG LEU 55 HG LEU 55 -16.064 -8.495 20.124 444 1HD1 LEU 55 HD11 LEU 55 -13.801 -9.579 19.690 445 2HD1 LEU 55 HD12 LEU 55 -13.120 -7.961 19.864 446 3HD1 LEU 55 HD13 LEU 55 -14.298 -8.290 18.593 447 1HD2 LEU 55 HD21 LEU 55 -15.920 -8.987 22.363 448 2HD2 LEU 55 HD22 LEU 55 -14.340 -8.224 22.542 449 3HD2 LEU 55 HD23 LEU 55 -14.476 -9.795 21.753 450 HA PRO 56 HA PRO 56 -16.958 -3.958 24.110 451 1HB PRO 56 HB2 PRO 56 -16.108 -1.375 22.982 452 2HB PRO 56 HB1 PRO 56 -15.535 -2.208 24.430 453 1HG PRO 56 HG2 PRO 56 -14.047 -1.991 22.190 454 2HG PRO 56 HG1 PRO 56 -13.934 -3.379 23.285 455 1HD PRO 56 HD2 PRO 56 -15.269 -3.159 20.628 456 2HD PRO 56 HD1 PRO 56 -14.433 -4.537 21.369 457 H ILE 57 HN ILE 57 -17.863 -3.060 20.922 458 HA ILE 57 HA ILE 57 -19.717 -1.056 21.467 459 HB ILE 57 HB ILE 57 -20.058 -0.984 19.276 460 1HG1 ILE 57 HG12 ILE 57 -21.469 -3.369 19.711 461 2HG1 ILE 57 HG11 ILE 57 -21.512 -2.361 18.281 462 1HG2 ILE 57 HG21 ILE 57 -18.206 -3.333 19.056 463 2HG2 ILE 57 HG22 ILE 57 -17.695 -1.680 19.401 464 3HG2 ILE 57 HG23 ILE 57 -18.474 -2.060 17.865 465 1HD1 ILE 57 HD11 ILE 57 -19.708 -4.726 18.737 466 2HD1 ILE 57 HD12 ILE 57 -19.683 -3.684 17.314 467 3HD1 ILE 57 HD13 ILE 57 -21.111 -4.653 17.670 468 H GLN 58 HN GLN 58 -20.229 -4.551 21.079 469 HA GLN 58 HA GLN 58 -22.903 -4.264 22.198 470 1HB GLN 58 HB2 GLN 58 -22.268 -7.013 21.746 471 2HB GLN 58 HB1 GLN 58 -23.452 -6.008 20.924 472 1HG GLN 58 HG2 GLN 58 -21.759 -5.247 19.388 473 2HG GLN 58 HG1 GLN 58 -20.544 -6.223 20.213 474 1HE2 GLN 58 HE21 GLN 58 -20.487 -6.868 17.793 475 2HE2 GLN 58 HE22 GLN 58 -21.420 -8.264 17.382 476 H GLU 59 HN GLU 59 -19.878 -5.909 22.822 477 HA GLU 59 HA GLU 59 -20.576 -7.297 25.134 478 1HB GLU 59 HB2 GLU 59 -18.408 -7.224 23.551 479 2HB GLU 59 HB1 GLU 59 -17.820 -6.217 24.869 480 1HG GLU 59 HG2 GLU 59 -18.901 -8.338 26.210 481 2HG GLU 59 HG1 GLU 59 -18.257 -9.100 24.756 482 H ASN 60 HN ASN 60 -19.611 -4.017 24.533 483 HA ASN 60 HA ASN 60 -19.849 -3.464 27.390 484 1HB ASN 60 HB2 ASN 60 -17.802 -2.772 25.585 485 2HB ASN 60 HB1 ASN 60 -18.665 -1.278 25.938 486 1HD2 ASN 60 HD21 ASN 60 -18.654 -0.459 28.020 487 2HD2 ASN 60 HD22 ASN 60 -17.551 -1.014 29.227 488 H GLN 61 HN GLN 61 -21.430 -3.221 24.501 489 HA GLN 61 HA GLN 61 -23.185 -2.038 23.696 490 1HB GLN 61 HB2 GLN 61 -23.628 -1.562 26.653 491 2HB GLN 61 HB1 GLN 61 -24.816 -1.242 25.396 492 1HG GLN 61 HG2 GLN 61 -25.547 -3.309 25.660 493 2HG GLN 61 HG1 GLN 61 -24.024 -3.877 24.979 494 1HE2 GLN 61 HE21 GLN 61 -25.434 -5.408 26.759 495 2HE2 GLN 61 HE22 GLN 61 -24.568 -5.511 28.251 496 H ALA 62 HN ALA 62 -20.585 -0.626 24.195 497 HA ALA 62 HA ALA 62 -21.645 2.118 24.125 498 1HB ALA 62 HB1 ALA 62 -19.121 2.492 25.074 499 2HB ALA 62 HB2 ALA 62 -19.582 0.986 25.870 500 3HB ALA 62 HB3 ALA 62 -20.574 2.430 26.072 501 HA PRO 63 HA PRO 63 -19.471 2.203 20.268 502 1HB PRO 63 HB2 PRO 63 -19.674 4.847 19.721 503 2HB PRO 63 HB1 PRO 63 -21.037 3.731 19.588 504 1HG PRO 63 HG2 PRO 63 -20.381 5.669 21.761 505 2HG PRO 63 HG1 PRO 63 -21.956 5.236 21.078 506 1HD PRO 63 HD2 PRO 63 -20.978 4.258 23.452 507 2HD PRO 63 HD1 PRO 63 -22.185 3.428 22.453 508 H ALA 64 HN ALA 64 -18.593 5.445 21.263 509 HA ALA 64 HA ALA 64 -15.794 4.744 21.005 510 1HB ALA 64 HB1 ALA 64 -15.923 7.448 21.569 511 2HB ALA 64 HB2 ALA 64 -17.388 7.126 20.643 512 3HB ALA 64 HB3 ALA 64 -15.813 6.705 19.973 513 HA PRO 65 HA PRO 65 -16.667 6.392 25.717 514 1HB PRO 65 HB2 PRO 65 -17.857 3.669 26.099 515 2HB PRO 65 HB1 PRO 65 -18.163 5.163 26.995 516 1HG PRO 65 HG2 PRO 65 -19.884 4.327 25.144 517 2HG PRO 65 HG1 PRO 65 -19.504 6.050 25.317 518 1HD PRO 65 HD2 PRO 65 -18.668 4.120 23.237 519 2HD PRO 65 HD1 PRO 65 -18.932 5.869 23.108 520 H ASN 66 HN ASN 66 -15.783 3.339 24.220 521 HA ASN 66 HA ASN 66 -13.495 3.159 26.070 522 1HB ASN 66 HB2 ASN 66 -13.551 0.663 25.467 523 2HB ASN 66 HB1 ASN 66 -14.797 1.259 26.558 524 1HD2 ASN 66 HD21 ASN 66 -16.267 -0.321 26.081 525 2HD2 ASN 66 HD22 ASN 66 -17.064 -0.441 24.553 526 H ILE 67 HN ILE 67 -11.523 3.195 25.182 527 HA ILE 67 HA ILE 67 -11.308 2.784 22.273 528 HB ILE 67 HB ILE 67 -9.662 4.530 22.109 529 1HG1 ILE 67 HG12 ILE 67 -8.721 4.164 24.436 530 2HG1 ILE 67 HG11 ILE 67 -8.870 5.843 23.933 531 1HG2 ILE 67 HG21 ILE 67 -12.314 5.115 23.266 532 2HG2 ILE 67 HG22 ILE 67 -11.613 5.597 21.720 533 3HG2 ILE 67 HG23 ILE 67 -11.168 6.454 23.196 534 1HD1 ILE 67 HD11 ILE 67 -11.277 5.177 25.228 535 2HD1 ILE 67 HD12 ILE 67 -9.996 6.253 25.787 536 3HD1 ILE 67 HD13 ILE 67 -9.963 4.545 26.220 537 H THR 68 HN THR 68 -8.473 3.087 22.174 538 HA THR 68 HA THR 68 -7.713 0.459 23.057 539 HB THR 68 HB THR 68 -5.613 0.895 21.887 540 HG1 THR 68 HG1 THR 68 -5.164 2.886 21.036 541 1HG2 THR 68 HG21 THR 68 -6.380 1.112 19.684 542 2HG2 THR 68 HG22 THR 68 -7.781 2.064 20.177 543 3HG2 THR 68 HG23 THR 68 -7.697 0.346 20.569 544 H GLY 69 HN GLY 69 -5.748 3.405 23.347 545 1HA GLY 69 HA2 GLY 69 -4.422 4.164 25.060 546 2HA GLY 69 HA1 GLY 69 -5.730 3.652 26.116 547 H ALA 70 HN ALA 70 -4.069 1.349 24.104 548 HA ALA 70 HA ALA 70 -2.579 0.379 26.452 549 1HB ALA 70 HB1 ALA 70 -4.351 -1.175 24.596 550 2HB ALA 70 HB2 ALA 70 -4.369 -1.121 26.359 551 3HB ALA 70 HB3 ALA 70 -3.064 -1.957 25.515 Start of MODEL 2 1 1H MET 1 1H MET 1 26.224 -12.315 -2.589 2 2H MET 1 2H MET 1 25.005 -13.472 -2.934 3 3H MET 1 3H MET 1 24.689 -11.799 -3.154 4 HA MET 1 HA MET 1 26.770 -13.273 -4.612 5 1HB MET 1 HB2 MET 1 23.911 -13.408 -4.839 6 2HB MET 1 HB1 MET 1 24.564 -12.626 -6.272 7 1HG MET 1 HG2 MET 1 25.321 -15.329 -5.192 8 2HG MET 1 HG1 MET 1 24.374 -14.994 -6.640 9 1HE MET 1 HE1 MET 1 25.000 -13.824 -8.476 10 2HE MET 1 HE2 MET 1 26.241 -14.754 -9.318 11 3HE MET 1 HE3 MET 1 26.563 -13.090 -8.835 12 H ALA 2 HN ALA 2 24.439 -10.570 -4.702 13 HA ALA 2 HA ALA 2 26.555 -8.714 -5.354 14 1HB ALA 2 HB1 ALA 2 26.093 -8.278 -7.520 15 2HB ALA 2 HB2 ALA 2 24.365 -8.575 -7.324 16 3HB ALA 2 HB3 ALA 2 25.478 -9.932 -7.499 17 H ASP 3 HN ASP 3 25.797 -6.473 -5.406 18 HA ASP 3 HA ASP 3 23.172 -6.069 -4.152 19 1HB ASP 3 HB2 ASP 3 25.786 -4.870 -3.206 20 2HB ASP 3 HB1 ASP 3 24.196 -4.386 -2.627 21 H LYS 4 HN LYS 4 22.721 -3.583 -4.064 22 HA LYS 4 HA LYS 4 22.664 -2.656 -6.720 23 1HB LYS 4 HB2 LYS 4 21.816 -0.540 -5.748 24 2HB LYS 4 HB1 LYS 4 20.978 -1.958 -5.132 25 1HG LYS 4 HG2 LYS 4 22.400 -1.864 -3.108 26 2HG LYS 4 HG1 LYS 4 23.112 -0.370 -3.720 27 1HD LYS 4 HD2 LYS 4 20.143 -0.620 -3.457 28 2HD LYS 4 HD1 LYS 4 21.128 -0.263 -2.036 29 1HE LYS 4 HE2 LYS 4 20.887 1.343 -4.570 30 2HE LYS 4 HE1 LYS 4 20.409 1.817 -2.941 31 1HZ LYS 4 HZ1 LYS 4 22.922 1.426 -2.457 32 2HZ LYS 4 HZ2 LYS 4 22.408 2.879 -3.154 33 3HZ LYS 4 HZ3 LYS 4 23.093 1.672 -4.123 34 H THR 5 HN THR 5 24.054 -1.515 -7.888 35 HA THR 5 HA THR 5 25.655 0.559 -7.321 36 HB THR 5 HB THR 5 26.890 -0.455 -5.593 37 HG1 THR 5 HG1 THR 5 28.746 0.008 -6.417 38 1HG2 THR 5 HG21 THR 5 27.972 -2.788 -6.913 39 2HG2 THR 5 HG22 THR 5 26.222 -2.882 -6.723 40 3HG2 THR 5 HG23 THR 5 27.248 -2.623 -5.313 41 H ILE 6 HN ILE 6 26.207 -2.692 -8.668 42 HA ILE 6 HA ILE 6 27.322 -1.517 -11.091 43 HB ILE 6 HB ILE 6 27.709 -3.905 -11.755 44 1HG1 ILE 6 HG12 ILE 6 26.977 -4.550 -8.897 45 2HG1 ILE 6 HG11 ILE 6 25.848 -4.759 -10.234 46 1HG2 ILE 6 HG21 ILE 6 29.436 -2.533 -10.685 47 2HG2 ILE 6 HG22 ILE 6 29.577 -4.232 -10.238 48 3HG2 ILE 6 HG23 ILE 6 28.879 -3.078 -9.102 49 1HD1 ILE 6 HD11 ILE 6 27.344 -6.350 -11.278 50 2HD1 ILE 6 HD12 ILE 6 26.974 -6.841 -9.625 51 3HD1 ILE 6 HD13 ILE 6 28.531 -6.101 -9.997 52 H PHE 7 HN PHE 7 26.635 -2.994 -13.125 53 HA PHE 7 HA PHE 7 23.695 -3.113 -13.174 54 1HB PHE 7 HB2 PHE 7 23.945 -2.278 -15.604 55 2HB PHE 7 HB1 PHE 7 24.089 -1.102 -14.305 56 HD1 PHE 7 HD1 PHE 7 26.022 0.187 -14.060 57 HD2 PHE 7 HD2 PHE 7 26.058 -3.196 -16.639 58 HE1 PHE 7 HE1 PHE 7 28.225 0.870 -14.917 59 HE2 PHE 7 HE2 PHE 7 28.260 -2.521 -17.502 60 HZ PHE 7 HZ PHE 7 29.347 -0.486 -16.641 61 H ASN 8 HN ASN 8 25.664 -5.225 -12.857 62 HA ASN 8 HA ASN 8 26.311 -7.238 -13.718 63 1HB ASN 8 HB2 ASN 8 23.430 -6.897 -14.417 64 2HB ASN 8 HB1 ASN 8 24.281 -8.309 -15.036 65 1HD2 ASN 8 HD21 ASN 8 24.377 -6.534 -11.965 66 2HD2 ASN 8 HD22 ASN 8 24.080 -7.911 -10.965 67 H ASP 9 HN ASP 9 24.219 -6.703 -16.498 68 HA ASP 9 HA ASP 9 26.625 -6.656 -18.198 69 1HB ASP 9 HB2 ASP 9 25.348 -8.732 -18.444 70 2HB ASP 9 HB1 ASP 9 23.896 -7.810 -18.819 71 H HIS 10 HN HIS 10 23.188 -6.004 -18.861 72 HA HIS 10 HA HIS 10 23.694 -3.900 -20.634 73 1HB HIS 10 HB2 HIS 10 21.283 -4.853 -19.147 74 2HB HIS 10 HB1 HIS 10 21.213 -3.294 -19.962 75 HD1 HIS 10 HD1 HIS 10 19.314 -5.179 -21.102 76 HD2 HIS 10 HD2 HIS 10 23.297 -5.200 -22.287 77 HE1 HIS 10 HE1 HIS 10 19.340 -6.299 -23.353 78 HE2 HIS 10 HE2 HIS 10 21.748 -6.216 -24.091 79 H LEU 11 HN LEU 11 23.758 -1.700 -20.422 80 HA LEU 11 HA LEU 11 24.662 -0.675 -17.941 81 1HB LEU 11 HB2 LEU 11 24.409 1.572 -19.235 82 2HB LEU 11 HB1 LEU 11 25.627 0.412 -19.710 83 HG LEU 11 HG LEU 11 24.406 -0.262 -21.623 84 1HD1 LEU 11 HD11 LEU 11 22.166 0.288 -22.118 85 2HD1 LEU 11 HD12 LEU 11 22.085 1.467 -20.810 86 3HD1 LEU 11 HD13 LEU 11 22.172 -0.255 -20.440 87 1HD2 LEU 11 HD21 LEU 11 25.413 2.199 -21.391 88 2HD2 LEU 11 HD22 LEU 11 23.739 2.615 -21.762 89 3HD2 LEU 11 HD23 LEU 11 24.666 1.607 -22.874 90 H ASN 12 HN ASN 12 22.751 1.815 -19.035 91 HA ASN 12 HA ASN 12 21.257 2.099 -16.763 92 1HB ASN 12 HB2 ASN 12 21.379 3.340 -19.335 93 2HB ASN 12 HB1 ASN 12 19.688 3.139 -18.891 94 1HD2 ASN 12 HD21 ASN 12 22.732 4.048 -17.305 95 2HD2 ASN 12 HD22 ASN 12 22.085 5.418 -16.473 96 H THR 13 HN THR 13 20.349 0.361 -19.712 97 HA THR 13 HA THR 13 17.694 -0.126 -19.273 98 HB THR 13 HB THR 13 18.532 -2.562 -20.230 99 HG1 THR 13 HG1 THR 13 20.341 -0.715 -21.342 100 1HG2 THR 13 HG21 THR 13 18.573 -1.046 -22.499 101 2HG2 THR 13 HG22 THR 13 17.599 -0.067 -21.403 102 3HG2 THR 13 HG23 THR 13 17.134 -1.732 -21.746 103 H ASN 14 HN ASN 14 19.766 -2.923 -18.704 104 HA ASN 14 HA ASN 14 19.555 -4.616 -17.181 105 1HB ASN 14 HB2 ASN 14 20.331 -2.184 -15.896 106 2HB ASN 14 HB1 ASN 14 19.326 -3.106 -14.785 107 1HD2 ASN 14 HD21 ASN 14 20.032 -5.687 -15.648 108 2HD2 ASN 14 HD22 ASN 14 21.676 -5.971 -15.196 109 HA PRO 15 HA PRO 15 14.940 -4.385 -16.881 110 1HB PRO 15 HB2 PRO 15 15.369 -7.305 -17.170 111 2HB PRO 15 HB1 PRO 15 14.245 -6.243 -18.025 112 1HG PRO 15 HG2 PRO 15 16.424 -7.187 -19.238 113 2HG PRO 15 HG1 PRO 15 15.857 -5.533 -19.532 114 1HD PRO 15 HD2 PRO 15 18.123 -6.487 -17.827 115 2HD PRO 15 HD1 PRO 15 18.026 -5.061 -18.880 116 H LYS 16 HN LYS 16 17.354 -6.299 -15.241 117 HA LYS 16 HA LYS 16 15.529 -7.062 -13.107 118 1HB LYS 16 HB2 LYS 16 17.394 -8.532 -14.120 119 2HB LYS 16 HB1 LYS 16 18.489 -7.576 -13.132 120 1HG LYS 16 HG2 LYS 16 17.747 -9.748 -12.129 121 2HG LYS 16 HG1 LYS 16 17.475 -8.322 -11.126 122 1HD LYS 16 HD2 LYS 16 15.180 -8.356 -11.474 123 2HD LYS 16 HD1 LYS 16 15.318 -9.328 -12.940 124 1HE LYS 16 HE2 LYS 16 14.430 -10.455 -10.806 125 2HE LYS 16 HE1 LYS 16 15.654 -11.299 -11.753 126 1HZ LYS 16 HZ1 LYS 16 17.341 -10.535 -10.215 127 2HZ LYS 16 HZ2 LYS 16 16.131 -11.369 -9.377 128 3HZ LYS 16 HZ3 LYS 16 16.187 -9.680 -9.320 129 H THR 17 HN THR 17 17.720 -4.486 -13.746 130 HA THR 17 HA THR 17 18.128 -4.017 -10.911 131 HB THR 17 HB THR 17 19.062 -2.230 -13.141 132 HG1 THR 17 HG1 THR 17 20.305 -4.548 -12.082 133 1HG2 THR 17 HG21 THR 17 20.395 -2.776 -10.516 134 2HG2 THR 17 HG22 THR 17 19.208 -1.488 -10.726 135 3HG2 THR 17 HG23 THR 17 20.704 -1.471 -11.661 136 H ASN 18 HN ASN 18 16.838 -2.115 -13.647 137 HA ASN 18 HA ASN 18 16.027 0.035 -12.182 138 1HB ASN 18 HB2 ASN 18 14.641 0.686 -13.987 139 2HB ASN 18 HB1 ASN 18 16.077 -0.092 -14.636 140 1HD2 ASN 18 HD21 ASN 18 15.874 -2.263 -15.419 141 2HD2 ASN 18 HD22 ASN 18 14.355 -2.816 -16.028 142 H LEU 19 HN LEU 19 13.620 -2.433 -13.212 143 HA LEU 19 HA LEU 19 11.716 -1.383 -11.377 144 1HB LEU 19 HB2 LEU 19 10.802 -2.275 -13.336 145 2HB LEU 19 HB1 LEU 19 11.784 -3.725 -13.245 146 HG LEU 19 HG LEU 19 9.989 -3.451 -10.962 147 1HD1 LEU 19 HD11 LEU 19 8.799 -3.665 -13.724 148 2HD1 LEU 19 HD12 LEU 19 8.532 -2.368 -12.559 149 3HD1 LEU 19 HD13 LEU 19 7.940 -3.995 -12.219 150 1HD2 LEU 19 HD21 LEU 19 9.990 -5.663 -12.976 151 2HD2 LEU 19 HD22 LEU 19 9.734 -5.735 -11.232 152 3HD2 LEU 19 HD23 LEU 19 11.354 -5.460 -11.877 153 H ARG 20 HN ARG 20 13.740 -4.248 -11.550 154 HA ARG 20 HA ARG 20 12.664 -5.389 -9.220 155 1HB ARG 20 HB2 ARG 20 13.551 -7.056 -10.424 156 2HB ARG 20 HB1 ARG 20 14.814 -6.043 -11.094 157 1HG ARG 20 HG2 ARG 20 15.757 -7.807 -9.732 158 2HG ARG 20 HG1 ARG 20 16.074 -6.233 -9.006 159 1HD ARG 20 HD2 ARG 20 14.909 -8.470 -7.806 160 2HD ARG 20 HD1 ARG 20 15.071 -6.855 -7.130 161 HE ARG 20 HE ARG 20 12.806 -6.515 -7.468 162 1HH1 ARG 20 HH11 ARG 20 13.882 -9.333 -9.251 163 2HH1 ARG 20 HH12 ARG 20 12.281 -9.870 -9.632 164 1HH2 ARG 20 HH21 ARG 20 10.671 -7.262 -7.977 165 2HH2 ARG 20 HH22 ARG 20 10.471 -8.698 -8.914 166 H LEU 21 HN LEU 21 15.388 -3.148 -9.703 167 HA LEU 21 HA LEU 21 16.296 -3.664 -6.998 168 1HB LEU 21 HB2 LEU 21 18.171 -2.614 -7.543 169 2HB LEU 21 HB1 LEU 21 17.569 -2.610 -9.179 170 HG LEU 21 HG LEU 21 18.391 -0.431 -8.709 171 1HD1 LEU 21 HD11 LEU 21 15.848 0.668 -8.368 172 2HD1 LEU 21 HD12 LEU 21 15.597 -0.856 -9.217 173 3HD1 LEU 21 HD13 LEU 21 16.691 0.351 -9.884 174 1HD2 LEU 21 HD21 LEU 21 17.582 -0.985 -6.081 175 2HD2 LEU 21 HD22 LEU 21 16.672 0.439 -6.588 176 3HD2 LEU 21 HD23 LEU 21 18.433 0.442 -6.674 177 H TRP 22 HN TRP 22 13.980 -1.628 -8.491 178 HA TRP 22 HA TRP 22 13.846 0.231 -6.271 179 1HB TRP 22 HB2 TRP 22 13.253 0.775 -8.714 180 2HB TRP 22 HB1 TRP 22 11.768 -0.129 -8.434 181 HD1 TRP 22 HD1 TRP 22 13.530 3.120 -7.429 182 HE1 TRP 22 HE1 TRP 22 11.792 4.708 -6.389 183 HE3 TRP 22 HE3 TRP 22 9.546 -0.076 -7.201 184 HZ2 TRP 22 HZ2 TRP 22 9.089 4.616 -5.578 185 HZ3 TRP 22 HZ3 TRP 22 7.421 0.752 -6.278 186 HH2 TRP 22 HH2 TRP 22 7.199 3.050 -5.482 187 H VAL 23 HN VAL 23 11.924 -2.383 -7.662 188 HA VAL 23 HA VAL 23 9.965 -2.450 -5.648 189 HB VAL 23 HB VAL 23 9.603 -3.433 -7.857 190 1HG1 VAL 23 HG11 VAL 23 10.767 -5.166 -8.703 191 2HG1 VAL 23 HG12 VAL 23 11.147 -5.824 -7.107 192 3HG1 VAL 23 HG13 VAL 23 12.025 -4.418 -7.714 193 1HG2 VAL 23 HG21 VAL 23 9.007 -5.850 -6.690 194 2HG2 VAL 23 HG22 VAL 23 7.982 -4.415 -6.669 195 3HG2 VAL 23 HG23 VAL 23 9.062 -4.749 -5.315 196 H ALA 24 HN ALA 24 13.118 -3.841 -5.957 197 HA ALA 24 HA ALA 24 12.814 -5.582 -3.660 198 1HB ALA 24 HB1 ALA 24 14.243 -6.318 -5.468 199 2HB ALA 24 HB2 ALA 24 15.216 -6.057 -4.021 200 3HB ALA 24 HB3 ALA 24 15.230 -4.862 -5.322 201 H PHE 25 HN PHE 25 13.920 -2.401 -4.401 202 HA PHE 25 HA PHE 25 15.602 -1.866 -2.246 203 1HB PHE 25 HB2 PHE 25 15.784 -0.027 -3.515 204 2HB PHE 25 HB1 PHE 25 14.261 -0.365 -4.326 205 HD1 PHE 25 HD1 PHE 25 15.481 0.931 -1.041 206 HD2 PHE 25 HD2 PHE 25 12.616 1.214 -4.176 207 HE1 PHE 25 HE1 PHE 25 14.466 2.880 0.068 208 HE2 PHE 25 HE2 PHE 25 11.595 3.163 -3.072 209 HZ PHE 25 HZ PHE 25 12.520 3.998 -0.949 210 H GLN 26 HN GLN 26 12.094 -1.723 -2.515 211 HA GLN 26 HA GLN 26 11.827 -0.806 0.248 212 1HB GLN 26 HB2 GLN 26 9.387 -0.852 -0.249 213 2HB GLN 26 HB1 GLN 26 10.302 0.175 -1.345 214 1HG GLN 26 HG2 GLN 26 10.279 -2.346 -2.531 215 2HG GLN 26 HG1 GLN 26 8.645 -2.099 -1.913 216 1HE2 GLN 26 HE21 GLN 26 10.923 0.315 -3.103 217 2HE2 GLN 26 HE22 GLN 26 9.951 0.845 -4.428 218 H MET 27 HN MET 27 11.493 -3.655 -1.694 219 HA MET 27 HA MET 27 10.037 -5.280 0.122 220 1HB MET 27 HB2 MET 27 10.002 -6.473 -1.791 221 2HB MET 27 HB1 MET 27 11.277 -5.468 -2.459 222 1HG MET 27 HG2 MET 27 12.952 -6.898 -1.825 223 2HG MET 27 HG1 MET 27 11.951 -7.712 -0.617 224 1HE MET 27 HE1 MET 27 13.291 -9.632 -1.637 225 2HE MET 27 HE2 MET 27 12.635 -10.645 -2.922 226 3HE MET 27 HE3 MET 27 11.745 -10.449 -1.411 227 H MET 28 HN MET 28 13.400 -4.607 -0.383 228 HA MET 28 HA MET 28 14.198 -6.615 1.548 229 1HB MET 28 HB2 MET 28 15.245 -5.877 -0.798 230 2HB MET 28 HB1 MET 28 16.175 -4.816 0.260 231 1HG MET 28 HG2 MET 28 16.225 -7.352 1.465 232 2HG MET 28 HG1 MET 28 16.505 -7.617 -0.255 233 1HE MET 28 HE1 MET 28 18.719 -4.446 -0.587 234 2HE MET 28 HE2 MET 28 17.661 -5.586 -1.420 235 3HE MET 28 HE3 MET 28 19.390 -5.911 -1.303 236 H LYS 29 HN LYS 29 14.085 -3.134 1.210 237 HA LYS 29 HA LYS 29 15.371 -2.800 3.827 238 1HB LYS 29 HB2 LYS 29 16.182 -1.385 1.992 239 2HB LYS 29 HB1 LYS 29 14.560 -0.747 1.763 240 1HG LYS 29 HG2 LYS 29 14.797 -0.056 4.271 241 2HG LYS 29 HG1 LYS 29 16.522 -0.197 3.930 242 1HD LYS 29 HD2 LYS 29 15.773 2.089 3.577 243 2HD LYS 29 HD1 LYS 29 16.263 1.361 2.045 244 1HE LYS 29 HE2 LYS 29 14.109 2.716 2.038 245 2HE LYS 29 HE1 LYS 29 14.037 1.101 1.333 246 1HZ LYS 29 HZ1 LYS 29 13.342 1.504 4.166 247 2HZ LYS 29 HZ2 LYS 29 12.839 0.287 3.107 248 3HZ LYS 29 HZ3 LYS 29 12.206 1.848 2.961 249 H GLY 30 HN GLY 30 12.365 -2.353 2.138 250 1HA GLY 30 HA2 GLY 30 11.073 -1.038 4.366 251 2HA GLY 30 HA1 GLY 30 10.335 -1.508 2.840 252 H ALA 31 HN ALA 31 11.804 -4.221 3.576 253 HA ALA 31 HA ALA 31 9.425 -5.374 4.776 254 1HB ALA 31 HB1 ALA 31 10.254 -6.493 2.845 255 2HB ALA 31 HB2 ALA 31 10.563 -7.536 4.238 256 3HB ALA 31 HB3 ALA 31 11.883 -6.596 3.527 257 H GLY 32 HN GLY 32 12.945 -5.493 5.369 258 1HA GLY 32 HA2 GLY 32 12.617 -6.768 7.915 259 2HA GLY 32 HA1 GLY 32 14.112 -6.122 7.259 260 H TRP 33 HN TRP 33 13.271 -3.449 6.877 261 HA TRP 33 HA TRP 33 13.556 -2.503 9.577 262 1HB TRP 33 HB2 TRP 33 14.683 -1.513 7.518 263 2HB TRP 33 HB1 TRP 33 13.121 -0.805 7.122 264 HD1 TRP 33 HD1 TRP 33 13.853 -0.841 10.802 265 HE1 TRP 33 HE1 TRP 33 14.468 1.532 11.586 266 HE3 TRP 33 HE3 TRP 33 14.393 1.408 6.242 267 HZ2 TRP 33 HZ2 TRP 33 15.100 4.028 10.426 268 HZ3 TRP 33 HZ3 TRP 33 15.004 3.790 6.166 269 HH2 TRP 33 HH2 TRP 33 15.349 5.071 8.215 270 H ALA 34 HN ALA 34 11.272 -1.446 7.042 271 HA ALA 34 HA ALA 34 9.445 -0.319 8.854 272 1HB ALA 34 HB1 ALA 34 9.496 -0.909 5.980 273 2HB ALA 34 HB2 ALA 34 8.938 0.528 6.835 274 3HB ALA 34 HB3 ALA 34 7.885 -0.882 6.699 275 H GLY 35 HN GLY 35 9.136 -3.364 6.998 276 1HA GLY 35 HA2 GLY 35 6.853 -4.443 7.769 277 2HA GLY 35 HA1 GLY 35 8.320 -5.407 7.816 278 H GLY 36 HN GLY 36 9.645 -4.322 9.966 279 1HA GLY 36 HA2 GLY 36 8.113 -5.441 12.144 280 2HA GLY 36 HA1 GLY 36 9.775 -4.877 12.212 281 H VAL 37 HN VAL 37 9.363 -2.212 11.316 282 HA VAL 37 HA VAL 37 8.472 -1.042 13.758 283 HB VAL 37 HB VAL 37 9.202 0.368 11.193 284 1HG1 VAL 37 HG11 VAL 37 9.962 2.021 13.166 285 2HG1 VAL 37 HG12 VAL 37 8.589 1.236 13.947 286 3HG1 VAL 37 HG13 VAL 37 8.367 2.079 12.415 287 1HG2 VAL 37 HG21 VAL 37 11.185 0.238 13.354 288 2HG2 VAL 37 HG22 VAL 37 11.395 0.099 11.609 289 3HG2 VAL 37 HG23 VAL 37 10.866 -1.297 12.548 290 H PHE 38 HN PHE 38 7.445 -0.726 10.389 291 HA PHE 38 HA PHE 38 5.179 0.792 10.938 292 1HB PHE 38 HB2 PHE 38 6.498 -0.093 8.655 293 2HB PHE 38 HB1 PHE 38 4.891 -0.800 8.535 294 HD1 PHE 38 HD1 PHE 38 6.040 2.472 9.893 295 HD2 PHE 38 HD2 PHE 38 3.710 0.424 6.981 296 HE1 PHE 38 HE1 PHE 38 5.161 4.625 9.091 297 HE2 PHE 38 HE2 PHE 38 2.825 2.573 6.172 298 HZ PHE 38 HZ PHE 38 3.552 4.678 7.227 299 H PHE 39 HN PHE 39 5.339 -2.671 10.006 300 HA PHE 39 HA PHE 39 2.607 -3.156 10.397 301 1HB PHE 39 HB2 PHE 39 4.557 -4.617 9.336 302 2HB PHE 39 HB1 PHE 39 4.567 -5.340 10.941 303 HD1 PHE 39 HD1 PHE 39 3.363 -7.270 11.144 304 HD2 PHE 39 HD2 PHE 39 1.996 -4.271 8.451 305 HE1 PHE 39 HE1 PHE 39 1.465 -8.703 10.516 306 HE2 PHE 39 HE2 PHE 39 0.096 -5.698 7.818 307 HZ PHE 39 HZ PHE 39 -0.172 -7.918 8.852 308 H GLY 40 HN GLY 40 5.339 -3.486 12.656 309 1HA GLY 40 HA2 GLY 40 4.003 -4.671 14.786 310 2HA GLY 40 HA1 GLY 40 5.334 -3.531 14.963 311 H THR 41 HN THR 41 3.920 -1.383 13.627 312 HA THR 41 HA THR 41 2.446 -0.397 15.904 313 HB THR 41 HB THR 41 2.856 0.931 13.237 314 HG1 THR 41 HG1 THR 41 4.693 1.886 14.237 315 1HG2 THR 41 HG21 THR 41 2.573 2.994 14.356 316 2HG2 THR 41 HG22 THR 41 2.557 2.208 15.935 317 3HG2 THR 41 HG23 THR 41 1.218 1.962 14.813 318 H LEU 42 HN LEU 42 1.752 -0.901 12.434 319 HA LEU 42 HA LEU 42 -0.931 -0.199 12.534 320 1HB LEU 42 HB2 LEU 42 0.248 -2.285 10.721 321 2HB LEU 42 HB1 LEU 42 -1.228 -1.372 10.460 322 HG LEU 42 HG LEU 42 1.570 -0.238 10.479 323 1HD1 LEU 42 HD11 LEU 42 -0.352 -0.407 8.177 324 2HD1 LEU 42 HD12 LEU 42 0.857 -1.648 8.505 325 3HD1 LEU 42 HD13 LEU 42 1.363 0.003 8.145 326 1HD2 LEU 42 HD21 LEU 42 0.052 1.698 9.420 327 2HD2 LEU 42 HD22 LEU 42 0.437 1.606 11.139 328 3HD2 LEU 42 HD23 LEU 42 -1.111 1.001 10.548 329 H LEU 43 HN LEU 43 0.603 -3.265 13.256 330 HA LEU 43 HA LEU 43 -1.845 -4.688 13.489 331 1HB LEU 43 HB2 LEU 43 -0.454 -6.424 13.458 332 2HB LEU 43 HB1 LEU 43 0.909 -5.326 13.499 333 HG LEU 43 HG LEU 43 -0.464 -6.342 15.985 334 1HD1 LEU 43 HD11 LEU 43 0.407 -8.324 15.339 335 2HD1 LEU 43 HD12 LEU 43 1.890 -7.620 15.985 336 3HD1 LEU 43 HD13 LEU 43 1.579 -7.580 14.250 337 1HD2 LEU 43 HD21 LEU 43 2.312 -5.592 16.191 338 2HD2 LEU 43 HD22 LEU 43 0.916 -5.005 17.097 339 3HD2 LEU 43 HD23 LEU 43 1.338 -4.266 15.552 340 H LEU 44 HN LEU 44 0.166 -2.718 15.576 341 HA LEU 44 HA LEU 44 -1.123 -3.547 17.994 342 1HB LEU 44 HB2 LEU 44 1.161 -2.234 17.501 343 2HB LEU 44 HB1 LEU 44 0.123 -0.859 17.818 344 HG LEU 44 HG LEU 44 -0.173 -1.418 20.046 345 1HD1 LEU 44 HD11 LEU 44 -0.985 -3.605 19.982 346 2HD1 LEU 44 HD12 LEU 44 0.515 -3.732 20.905 347 3HD1 LEU 44 HD13 LEU 44 0.474 -4.222 19.210 348 1HD2 LEU 44 HD21 LEU 44 1.927 -1.273 20.835 349 2HD2 LEU 44 HD22 LEU 44 2.358 -1.187 19.127 350 3HD2 LEU 44 HD23 LEU 44 2.457 -2.725 19.985 351 H ILE 45 HN ILE 45 -1.407 -0.681 15.938 352 HA ILE 45 HA ILE 45 -3.655 0.349 17.413 353 HB ILE 45 HB ILE 45 -2.114 1.243 15.005 354 1HG1 ILE 45 HG12 ILE 45 -2.809 2.890 17.411 355 2HG1 ILE 45 HG11 ILE 45 -1.542 1.670 17.519 356 1HG2 ILE 45 HG21 ILE 45 -3.769 3.305 15.249 357 2HG2 ILE 45 HG22 ILE 45 -4.872 2.019 15.750 358 3HG2 ILE 45 HG23 ILE 45 -4.094 1.950 14.164 359 1HD1 ILE 45 HD11 ILE 45 -0.408 3.632 17.023 360 2HD1 ILE 45 HD12 ILE 45 -1.618 4.148 15.848 361 3HD1 ILE 45 HD13 ILE 45 -0.532 2.811 15.467 362 H GLY 46 HN GLY 46 -3.133 -1.009 14.175 363 1HA GLY 46 HA2 GLY 46 -5.778 -0.727 13.276 364 2HA GLY 46 HA1 GLY 46 -4.578 -1.828 12.610 365 H PHE 47 HN PHE 47 -4.123 -3.229 15.092 366 HA PHE 47 HA PHE 47 -6.303 -5.046 14.847 367 1HB PHE 47 HB2 PHE 47 -3.847 -5.652 15.249 368 2HB PHE 47 HB1 PHE 47 -4.145 -5.219 16.933 369 HD1 PHE 47 HD1 PHE 47 -5.023 -6.787 18.404 370 HD2 PHE 47 HD2 PHE 47 -5.376 -7.430 14.211 371 HE1 PHE 47 HE1 PHE 47 -5.901 -9.045 18.829 372 HE2 PHE 47 HE2 PHE 47 -6.256 -9.689 14.629 373 HZ PHE 47 HZ PHE 47 -6.521 -10.500 16.940 374 H PHE 48 HN PHE 48 -5.273 -2.606 17.106 375 HA PHE 48 HA PHE 48 -7.121 -3.325 19.166 376 1HB PHE 48 HB2 PHE 48 -5.173 -1.134 18.684 377 2HB PHE 48 HB1 PHE 48 -6.525 -0.757 19.745 378 HD1 PHE 48 HD1 PHE 48 -6.859 -3.441 21.055 379 HD2 PHE 48 HD2 PHE 48 -3.388 -1.132 20.194 380 HE1 PHE 48 HE1 PHE 48 -5.686 -4.510 22.933 381 HE2 PHE 48 HE2 PHE 48 -2.209 -2.200 22.072 382 HZ PHE 48 HZ PHE 48 -3.358 -3.890 23.444 383 H ARG 49 HN ARG 49 -7.117 -1.192 16.402 384 HA ARG 49 HA ARG 49 -9.437 0.258 17.129 385 1HB ARG 49 HB2 ARG 49 -9.278 1.314 15.065 386 2HB ARG 49 HB1 ARG 49 -7.614 0.864 15.401 387 1HG ARG 49 HG2 ARG 49 -7.602 0.009 13.348 388 2HG ARG 49 HG1 ARG 49 -8.554 -1.313 14.025 389 1HD ARG 49 HD2 ARG 49 -9.583 -0.387 11.999 390 2HD ARG 49 HD1 ARG 49 -10.609 -0.179 13.415 391 HE ARG 49 HE ARG 49 -10.055 2.138 13.431 392 1HH1 ARG 49 HH11 ARG 49 -8.880 0.431 10.612 393 2HH1 ARG 49 HH12 ARG 49 -8.710 1.870 9.667 394 1HH2 ARG 49 HH21 ARG 49 -9.826 4.020 12.182 395 2HH2 ARG 49 HH22 ARG 49 -9.243 3.904 10.555 396 H VAL 50 HN VAL 50 -8.897 -2.787 15.534 397 HA VAL 50 HA VAL 50 -11.568 -3.015 14.487 398 HB VAL 50 HB VAL 50 -9.629 -5.277 14.922 399 1HG1 VAL 50 HG11 VAL 50 -12.000 -4.856 13.128 400 2HG1 VAL 50 HG12 VAL 50 -11.762 -6.099 14.356 401 3HG1 VAL 50 HG13 VAL 50 -10.821 -6.142 12.864 402 1HG2 VAL 50 HG21 VAL 50 -9.639 -4.268 12.226 403 2HG2 VAL 50 HG22 VAL 50 -8.281 -4.544 13.317 404 3HG2 VAL 50 HG23 VAL 50 -9.149 -3.011 13.361 405 H VAL 51 HN VAL 51 -9.913 -3.948 17.437 406 HA VAL 51 HA VAL 51 -11.784 -5.856 18.311 407 HB VAL 51 HB VAL 51 -9.461 -5.253 19.305 408 1HG1 VAL 51 HG11 VAL 51 -10.592 -2.884 19.888 409 2HG1 VAL 51 HG12 VAL 51 -9.232 -3.565 20.777 410 3HG1 VAL 51 HG13 VAL 51 -10.871 -3.746 21.401 411 1HG2 VAL 51 HG21 VAL 51 -10.268 -7.037 20.404 412 2HG2 VAL 51 HG22 VAL 51 -11.882 -6.340 20.549 413 3HG2 VAL 51 HG23 VAL 51 -10.613 -5.873 21.683 414 H GLY 52 HN GLY 52 -11.837 -2.393 18.288 415 1HA GLY 52 HA2 GLY 52 -14.218 -2.356 19.993 416 2HA GLY 52 HA1 GLY 52 -13.271 -0.955 19.516 417 H ARG 53 HN ARG 53 -13.505 -2.608 16.734 418 HA ARG 53 HA ARG 53 -16.178 -1.620 16.054 419 1HB ARG 53 HB2 ARG 53 -13.641 -0.978 14.555 420 2HB ARG 53 HB1 ARG 53 -15.257 -0.693 13.921 421 1HG ARG 53 HG2 ARG 53 -14.996 0.463 16.538 422 2HG ARG 53 HG1 ARG 53 -13.702 1.028 15.480 423 1HD ARG 53 HD2 ARG 53 -15.768 2.435 15.445 424 2HD ARG 53 HD1 ARG 53 -15.267 1.825 13.868 425 HE ARG 53 HE ARG 53 -17.197 0.590 13.762 426 1HH1 ARG 53 HH11 ARG 53 -16.767 1.757 17.023 427 2HH1 ARG 53 HH12 ARG 53 -18.346 1.269 17.538 428 1HH2 ARG 53 HH21 ARG 53 -19.274 -0.050 14.438 429 2HH2 ARG 53 HH22 ARG 53 -19.769 0.243 16.072 430 H MET 54 HN MET 54 -15.783 -4.233 16.495 431 HA MET 54 HA MET 54 -16.698 -5.519 14.249 432 1HB MET 54 HB2 MET 54 -13.885 -5.013 14.045 433 2HB MET 54 HB1 MET 54 -14.142 -6.748 14.167 434 1HG MET 54 HG2 MET 54 -15.916 -5.325 12.299 435 2HG MET 54 HG1 MET 54 -14.209 -5.366 11.861 436 1HE MET 54 HE1 MET 54 -15.023 -6.909 9.532 437 2HE MET 54 HE2 MET 54 -14.154 -8.409 9.860 438 3HE MET 54 HE3 MET 54 -13.454 -6.862 10.334 439 H LEU 55 HN LEU 55 -16.727 -5.537 17.222 440 HA LEU 55 HA LEU 55 -16.760 -8.425 17.499 441 1HB LEU 55 HB2 LEU 55 -14.705 -6.800 18.693 442 2HB LEU 55 HB1 LEU 55 -15.682 -7.548 19.945 443 HG LEU 55 HG LEU 55 -15.091 -9.522 17.973 444 1HD1 LEU 55 HD11 LEU 55 -12.539 -9.476 18.600 445 2HD1 LEU 55 HD12 LEU 55 -12.827 -7.741 18.725 446 3HD1 LEU 55 HD13 LEU 55 -13.149 -8.580 17.209 447 1HD2 LEU 55 HD21 LEU 55 -13.948 -9.277 20.744 448 2HD2 LEU 55 HD22 LEU 55 -14.279 -10.747 19.827 449 3HD2 LEU 55 HD23 LEU 55 -15.613 -9.764 20.431 450 HA PRO 56 HA PRO 56 -19.271 -6.461 21.160 451 1HB PRO 56 HB2 PRO 56 -19.114 -3.584 20.471 452 2HB PRO 56 HB1 PRO 56 -19.026 -4.364 22.052 453 1HG PRO 56 HG2 PRO 56 -16.856 -3.307 20.893 454 2HG PRO 56 HG1 PRO 56 -16.763 -4.784 21.869 455 1HD PRO 56 HD2 PRO 56 -16.728 -4.467 18.898 456 2HD PRO 56 HD1 PRO 56 -15.829 -5.597 19.929 457 H ILE 57 HN ILE 57 -19.018 -5.428 17.901 458 HA ILE 57 HA ILE 57 -21.751 -4.637 17.610 459 HB ILE 57 HB ILE 57 -21.091 -3.606 15.764 460 1HG1 ILE 57 HG12 ILE 57 -21.219 -6.021 14.660 461 2HG1 ILE 57 HG11 ILE 57 -20.573 -4.646 13.785 462 1HG2 ILE 57 HG21 ILE 57 -19.063 -3.359 17.145 463 2HG2 ILE 57 HG22 ILE 57 -18.761 -3.219 15.412 464 3HG2 ILE 57 HG23 ILE 57 -18.340 -4.706 16.265 465 1HD1 ILE 57 HD11 ILE 57 -18.594 -6.169 15.331 466 2HD1 ILE 57 HD12 ILE 57 -18.511 -5.502 13.700 467 3HD1 ILE 57 HD13 ILE 57 -19.343 -7.025 13.984 468 H GLN 58 HN GLN 58 -19.792 -7.351 16.375 469 HA GLN 58 HA GLN 58 -22.215 -8.692 15.504 470 1HB GLN 58 HB2 GLN 58 -20.883 -10.138 14.262 471 2HB GLN 58 HB1 GLN 58 -19.999 -8.626 14.188 472 1HG GLN 58 HG2 GLN 58 -18.504 -9.410 15.954 473 2HG GLN 58 HG1 GLN 58 -19.400 -10.927 16.030 474 1HE2 GLN 58 HE21 GLN 58 -19.778 -11.566 13.445 475 2HE2 GLN 58 HE22 GLN 58 -18.265 -11.814 12.648 476 H GLU 59 HN GLU 59 -20.159 -8.679 18.226 477 HA GLU 59 HA GLU 59 -20.415 -11.346 19.083 478 1HB GLU 59 HB2 GLU 59 -18.825 -9.585 19.991 479 2HB GLU 59 HB1 GLU 59 -20.192 -8.922 20.875 480 1HG GLU 59 HG2 GLU 59 -20.313 -11.538 21.588 481 2HG GLU 59 HG1 GLU 59 -18.574 -11.309 21.390 482 H ASN 60 HN ASN 60 -22.529 -8.651 19.025 483 HA ASN 60 HA ASN 60 -24.360 -9.673 20.977 484 1HB ASN 60 HB2 ASN 60 -24.005 -7.227 19.465 485 2HB ASN 60 HB1 ASN 60 -25.686 -7.754 19.429 486 1HD2 ASN 60 HD21 ASN 60 -23.005 -6.938 21.542 487 2HD2 ASN 60 HD22 ASN 60 -23.970 -6.504 22.907 488 H GLN 61 HN GLN 61 -23.639 -10.400 17.794 489 HA GLN 61 HA GLN 61 -24.584 -11.734 16.230 490 1HB GLN 61 HB2 GLN 61 -25.197 -13.030 18.376 491 2HB GLN 61 HB1 GLN 61 -26.809 -12.366 18.157 492 1HG GLN 61 HG2 GLN 61 -27.121 -14.278 17.018 493 2HG GLN 61 HG1 GLN 61 -26.412 -13.345 15.701 494 1HE2 GLN 61 HE21 GLN 61 -24.662 -14.123 14.740 495 2HE2 GLN 61 HE22 GLN 61 -23.689 -15.426 15.325 496 H ALA 62 HN ALA 62 -25.552 -8.890 16.881 497 HA ALA 62 HA ALA 62 -27.631 -8.857 14.864 498 1HB ALA 62 HB1 ALA 62 -28.399 -8.917 17.527 499 2HB ALA 62 HB2 ALA 62 -29.392 -8.423 16.156 500 3HB ALA 62 HB3 ALA 62 -28.502 -7.215 17.081 501 HA PRO 63 HA PRO 63 -25.831 -4.989 13.855 502 1HB PRO 63 HB2 PRO 63 -27.914 -3.422 13.109 503 2HB PRO 63 HB1 PRO 63 -27.335 -4.781 12.140 504 1HG PRO 63 HG2 PRO 63 -29.661 -4.653 14.016 505 2HG PRO 63 HG1 PRO 63 -29.554 -5.409 12.416 506 1HD PRO 63 HD2 PRO 63 -29.371 -6.821 14.730 507 2HD PRO 63 HD1 PRO 63 -28.536 -7.301 13.240 508 H ALA 64 HN ALA 64 -28.635 -3.178 14.807 509 HA ALA 64 HA ALA 64 -27.058 -1.717 16.732 510 1HB ALA 64 HB1 ALA 64 -29.432 -0.528 16.915 511 2HB ALA 64 HB2 ALA 64 -29.645 -1.316 15.351 512 3HB ALA 64 HB3 ALA 64 -28.302 -0.199 15.601 513 HA PRO 65 HA PRO 65 -30.802 -3.975 19.259 514 1HB PRO 65 HB2 PRO 65 -29.493 -6.576 18.607 515 2HB PRO 65 HB1 PRO 65 -31.195 -6.221 18.926 516 1HG PRO 65 HG2 PRO 65 -30.281 -6.616 16.430 517 2HG PRO 65 HG1 PRO 65 -31.577 -5.461 16.781 518 1HD PRO 65 HD2 PRO 65 -28.761 -4.999 16.059 519 2HD PRO 65 HD1 PRO 65 -30.173 -3.961 15.798 520 H ASN 66 HN ASN 66 -30.429 -4.619 21.397 521 HA ASN 66 HA ASN 66 -27.937 -5.582 22.345 522 1HB ASN 66 HB2 ASN 66 -28.377 -2.644 22.280 523 2HB ASN 66 HB1 ASN 66 -27.689 -3.311 23.758 524 1HD2 ASN 66 HD21 ASN 66 -26.015 -5.186 23.035 525 2HD2 ASN 66 HD22 ASN 66 -24.788 -4.594 21.972 526 H ILE 67 HN ILE 67 -30.449 -3.317 23.481 527 HA ILE 67 HA ILE 67 -31.974 -3.453 25.163 528 HB ILE 67 HB ILE 67 -31.367 -6.408 25.272 529 1HG1 ILE 67 HG12 ILE 67 -33.447 -4.967 23.613 530 2HG1 ILE 67 HG11 ILE 67 -31.961 -5.664 22.979 531 1HG2 ILE 67 HG21 ILE 67 -33.953 -5.039 25.942 532 2HG2 ILE 67 HG22 ILE 67 -32.677 -5.262 27.139 533 3HG2 ILE 67 HG23 ILE 67 -33.420 -6.666 26.371 534 1HD1 ILE 67 HD11 ILE 67 -34.469 -6.963 23.792 535 2HD1 ILE 67 HD12 ILE 67 -32.984 -7.810 24.225 536 3HD1 ILE 67 HD13 ILE 67 -33.309 -7.405 22.540 537 H THR 68 HN THR 68 -29.692 -6.013 26.144 538 HA THR 68 HA THR 68 -28.510 -4.360 28.174 539 HB THR 68 HB THR 68 -30.650 -4.979 29.241 540 HG1 THR 68 HG1 THR 68 -28.944 -4.726 30.633 541 1HG2 THR 68 HG21 THR 68 -29.909 -7.653 28.343 542 2HG2 THR 68 HG22 THR 68 -31.486 -6.988 28.775 543 3HG2 THR 68 HG23 THR 68 -30.399 -7.569 30.036 544 H GLY 69 HN GLY 69 -27.604 -6.455 29.859 545 1HA GLY 69 HA2 GLY 69 -25.284 -7.275 28.656 546 2HA GLY 69 HA1 GLY 69 -26.037 -8.135 29.990 547 H ALA 70 HN ALA 70 -24.584 -8.916 27.401 548 HA ALA 70 HA ALA 70 -26.627 -10.531 26.092 549 1HB ALA 70 HB1 ALA 70 -24.077 -9.417 25.334 550 2HB ALA 70 HB2 ALA 70 -25.375 -10.044 24.320 551 3HB ALA 70 HB3 ALA 70 -24.151 -11.140 24.961 Start of MODEL 3 1 1H MET 1 1H MET 1 38.387 8.805 -17.277 2 2H MET 1 2H MET 1 37.413 9.711 -16.192 3 3H MET 1 3H MET 1 37.753 10.323 -17.759 4 HA MET 1 HA MET 1 35.512 9.366 -17.419 5 1HB MET 1 HB2 MET 1 37.101 9.565 -19.574 6 2HB MET 1 HB1 MET 1 36.895 7.818 -19.546 7 1HG MET 1 HG2 MET 1 34.641 7.937 -19.975 8 2HG MET 1 HG1 MET 1 34.500 9.579 -19.346 9 1HE MET 1 HE1 MET 1 35.546 11.553 -20.339 10 2HE MET 1 HE2 MET 1 35.638 11.861 -22.074 11 3HE MET 1 HE3 MET 1 37.006 11.128 -21.234 12 H ALA 2 HN ALA 2 37.985 6.861 -18.015 13 HA ALA 2 HA ALA 2 36.461 5.058 -16.258 14 1HB ALA 2 HB1 ALA 2 37.790 4.124 -18.789 15 2HB ALA 2 HB2 ALA 2 36.096 4.608 -18.721 16 3HB ALA 2 HB3 ALA 2 36.663 3.245 -17.757 17 H ASP 3 HN ASP 3 37.669 4.358 -14.639 18 HA ASP 3 HA ASP 3 40.228 3.233 -14.929 19 1HB ASP 3 HB2 ASP 3 40.127 6.129 -14.384 20 2HB ASP 3 HB1 ASP 3 41.162 5.211 -13.295 21 H LYS 4 HN LYS 4 38.814 5.328 -12.414 22 HA LYS 4 HA LYS 4 39.432 3.634 -10.275 23 1HB LYS 4 HB2 LYS 4 37.863 6.058 -10.699 24 2HB LYS 4 HB1 LYS 4 37.184 5.029 -9.447 25 1HG LYS 4 HG2 LYS 4 39.594 4.963 -8.520 26 2HG LYS 4 HG1 LYS 4 39.843 6.386 -9.535 27 1HD LYS 4 HD2 LYS 4 38.602 7.708 -8.199 28 2HD LYS 4 HD1 LYS 4 37.403 6.448 -7.900 29 1HE LYS 4 HE2 LYS 4 40.082 6.788 -6.565 30 2HE LYS 4 HE1 LYS 4 38.489 6.960 -5.828 31 1HZ LYS 4 HZ1 LYS 4 38.335 4.474 -6.750 32 2HZ LYS 4 HZ2 LYS 4 38.894 4.852 -5.199 33 3HZ LYS 4 HZ3 LYS 4 39.999 4.556 -6.445 34 H THR 5 HN THR 5 37.194 3.198 -8.789 35 HA THR 5 HA THR 5 35.980 0.973 -10.222 36 HB THR 5 HB THR 5 36.904 0.545 -8.001 37 HG1 THR 5 HG1 THR 5 35.145 -0.714 -8.529 38 1HG2 THR 5 HG21 THR 5 34.797 1.879 -6.498 39 2HG2 THR 5 HG22 THR 5 35.935 2.989 -7.262 40 3HG2 THR 5 HG23 THR 5 36.523 1.740 -6.164 41 H ILE 6 HN ILE 6 34.736 2.499 -11.589 42 HA ILE 6 HA ILE 6 32.423 3.684 -10.226 43 HB ILE 6 HB ILE 6 33.300 4.013 -13.101 44 1HG1 ILE 6 HG12 ILE 6 33.835 6.377 -12.238 45 2HG1 ILE 6 HG11 ILE 6 33.772 5.669 -10.627 46 1HG2 ILE 6 HG21 ILE 6 31.595 6.082 -12.020 47 2HG2 ILE 6 HG22 ILE 6 30.820 4.500 -11.937 48 3HG2 ILE 6 HG23 ILE 6 31.406 5.115 -13.483 49 1HD1 ILE 6 HD11 ILE 6 35.978 5.825 -12.246 50 2HD1 ILE 6 HD12 ILE 6 35.448 4.155 -12.449 51 3HD1 ILE 6 HD13 ILE 6 35.794 4.782 -10.837 52 H PHE 7 HN PHE 7 33.058 1.839 -13.220 53 HA PHE 7 HA PHE 7 31.045 -0.089 -12.648 54 1HB PHE 7 HB2 PHE 7 29.631 1.869 -13.279 55 2HB PHE 7 HB1 PHE 7 30.405 1.870 -14.862 56 HD1 PHE 7 HD1 PHE 7 30.230 -0.296 -16.241 57 HD2 PHE 7 HD2 PHE 7 27.733 0.599 -12.913 58 HE1 PHE 7 HE1 PHE 7 28.570 -1.918 -17.056 59 HE2 PHE 7 HE2 PHE 7 26.068 -1.023 -13.722 60 HZ PHE 7 HZ PHE 7 26.486 -2.284 -15.795 61 H ASN 8 HN ASN 8 31.309 -1.892 -13.872 62 HA ASN 8 HA ASN 8 33.386 -1.765 -15.946 63 1HB ASN 8 HB2 ASN 8 32.988 -3.510 -13.758 64 2HB ASN 8 HB1 ASN 8 32.685 -4.458 -15.210 65 1HD2 ASN 8 HD21 ASN 8 34.431 -3.334 -16.984 66 2HD2 ASN 8 HD22 ASN 8 36.054 -3.615 -16.462 67 H ASP 9 HN ASP 9 32.992 -2.380 -18.005 68 HA ASP 9 HA ASP 9 30.422 -2.370 -19.047 69 1HB ASP 9 HB2 ASP 9 32.874 -3.677 -20.245 70 2HB ASP 9 HB1 ASP 9 31.419 -3.217 -21.123 71 H HIS 10 HN HIS 10 32.295 -5.012 -17.757 72 HA HIS 10 HA HIS 10 30.904 -7.176 -18.853 73 1HB HIS 10 HB2 HIS 10 33.067 -7.189 -17.480 74 2HB HIS 10 HB1 HIS 10 32.031 -7.154 -16.058 75 HD1 HIS 10 HD1 HIS 10 30.015 -9.195 -16.383 76 HD2 HIS 10 HD2 HIS 10 33.810 -9.724 -17.990 77 HE1 HIS 10 HE1 HIS 10 30.273 -11.676 -16.695 78 HE2 HIS 10 HE2 HIS 10 32.540 -11.965 -17.751 79 H LEU 11 HN LEU 11 30.026 -4.941 -16.355 80 HA LEU 11 HA LEU 11 27.995 -6.574 -15.169 81 1HB LEU 11 HB2 LEU 11 28.741 -3.675 -14.975 82 2HB LEU 11 HB1 LEU 11 27.275 -4.280 -14.227 83 HG LEU 11 HG LEU 11 29.280 -4.092 -12.714 84 1HD1 LEU 11 HD11 LEU 11 28.619 -5.896 -11.437 85 2HD1 LEU 11 HD12 LEU 11 28.386 -6.938 -12.842 86 3HD1 LEU 11 HD13 LEU 11 27.223 -5.660 -12.489 87 1HD2 LEU 11 HD21 LEU 11 30.951 -5.871 -12.834 88 2HD2 LEU 11 HD22 LEU 11 30.972 -4.872 -14.286 89 3HD2 LEU 11 HD23 LEU 11 30.215 -6.463 -14.324 90 H ASN 12 HN ASN 12 28.135 -5.141 -18.149 91 HA ASN 12 HA ASN 12 26.565 -4.852 -19.771 92 1HB ASN 12 HB2 ASN 12 25.397 -6.710 -18.183 93 2HB ASN 12 HB1 ASN 12 24.229 -5.399 -18.034 94 1HD2 ASN 12 HD21 ASN 12 26.236 -6.583 -20.710 95 2HD2 ASN 12 HD22 ASN 12 24.928 -6.817 -21.813 96 H THR 13 HN THR 13 23.812 -3.880 -19.269 97 HA THR 13 HA THR 13 24.055 -1.208 -19.562 98 HB THR 13 HB THR 13 21.748 -1.203 -18.195 99 HG1 THR 13 HG1 THR 13 20.819 -3.269 -18.341 100 1HG2 THR 13 HG21 THR 13 20.821 -2.465 -20.370 101 2HG2 THR 13 HG22 THR 13 22.424 -2.005 -20.940 102 3HG2 THR 13 HG23 THR 13 21.311 -0.771 -20.352 103 H ASN 14 HN ASN 14 23.957 0.643 -18.254 104 HA ASN 14 HA ASN 14 25.364 0.389 -15.770 105 1HB ASN 14 HB2 ASN 14 25.912 2.248 -17.198 106 2HB ASN 14 HB1 ASN 14 24.241 2.796 -17.213 107 1HD2 ASN 14 HD21 ASN 14 26.123 1.658 -14.461 108 2HD2 ASN 14 HD22 ASN 14 26.080 3.145 -13.585 109 HA PRO 15 HA PRO 15 21.035 2.270 -14.198 110 1HB PRO 15 HB2 PRO 15 19.400 0.560 -16.013 111 2HB PRO 15 HB1 PRO 15 19.064 2.177 -15.384 112 1HG PRO 15 HG2 PRO 15 19.855 1.833 -17.904 113 2HG PRO 15 HG1 PRO 15 20.428 3.212 -16.945 114 1HD PRO 15 HD2 PRO 15 21.856 0.713 -17.718 115 2HD PRO 15 HD1 PRO 15 22.485 2.359 -17.514 116 H LYS 16 HN LYS 16 21.803 -0.956 -15.300 117 HA LYS 16 HA LYS 16 20.186 -2.490 -13.636 118 1HB LYS 16 HB2 LYS 16 21.810 -3.194 -15.532 119 2HB LYS 16 HB1 LYS 16 23.014 -3.282 -14.253 120 1HG LYS 16 HG2 LYS 16 20.647 -4.660 -13.430 121 2HG LYS 16 HG1 LYS 16 21.151 -5.240 -15.018 122 1HD LYS 16 HD2 LYS 16 22.230 -6.577 -13.342 123 2HD LYS 16 HD1 LYS 16 23.447 -5.550 -14.103 124 1HE LYS 16 HE2 LYS 16 23.413 -4.035 -12.240 125 2HE LYS 16 HE1 LYS 16 22.057 -4.894 -11.511 126 1HZ LYS 16 HZ1 LYS 16 23.696 -5.891 -10.363 127 2HZ LYS 16 HZ2 LYS 16 24.882 -5.560 -11.522 128 3HZ LYS 16 HZ3 LYS 16 23.829 -6.865 -11.740 129 H THR 17 HN THR 17 23.178 -0.794 -12.917 130 HA THR 17 HA THR 17 23.338 -2.028 -10.289 131 HB THR 17 HB THR 17 25.090 0.075 -11.572 132 HG1 THR 17 HG1 THR 17 25.567 -2.693 -11.203 133 1HG2 THR 17 HG21 THR 17 25.287 0.158 -9.158 134 2HG2 THR 17 HG22 THR 17 26.743 -0.527 -9.885 135 3HG2 THR 17 HG23 THR 17 25.563 -1.583 -9.109 136 H ASN 18 HN ASN 18 23.147 1.279 -11.595 137 HA ASN 18 HA ASN 18 22.760 2.595 -9.189 138 1HB ASN 18 HB2 ASN 18 22.103 3.218 -12.031 139 2HB ASN 18 HB1 ASN 18 21.430 4.249 -10.772 140 1HD2 ASN 18 HD21 ASN 18 24.409 2.995 -12.138 141 2HD2 ASN 18 HD22 ASN 18 25.424 4.278 -11.580 142 H LEU 19 HN LEU 19 20.440 0.939 -11.228 143 HA LEU 19 HA LEU 19 18.139 1.888 -9.840 144 1HB LEU 19 HB2 LEU 19 18.144 1.122 -12.203 145 2HB LEU 19 HB1 LEU 19 18.456 -0.504 -11.627 146 HG LEU 19 HG LEU 19 16.108 0.670 -10.368 147 1HD1 LEU 19 HD11 LEU 19 15.591 1.836 -12.299 148 2HD1 LEU 19 HD12 LEU 19 14.758 0.301 -12.540 149 3HD1 LEU 19 HD13 LEU 19 16.293 0.607 -13.352 150 1HD2 LEU 19 HD21 LEU 19 15.253 -1.451 -10.612 151 2HD2 LEU 19 HD22 LEU 19 16.986 -1.779 -10.593 152 3HD2 LEU 19 HD23 LEU 19 16.112 -1.740 -12.125 153 H ARG 20 HN ARG 20 19.810 -1.215 -10.030 154 HA ARG 20 HA ARG 20 18.315 -2.578 -8.161 155 1HB ARG 20 HB2 ARG 20 20.308 -3.348 -9.698 156 2HB ARG 20 HB1 ARG 20 21.264 -3.035 -8.258 157 1HG ARG 20 HG2 ARG 20 20.520 -5.403 -8.557 158 2HG ARG 20 HG1 ARG 20 20.081 -4.671 -7.014 159 1HD ARG 20 HD2 ARG 20 18.141 -4.503 -9.266 160 2HD ARG 20 HD1 ARG 20 18.337 -6.053 -8.444 161 HE ARG 20 HE ARG 20 16.920 -3.817 -7.469 162 1HH1 ARG 20 HH11 ARG 20 19.111 -6.312 -6.390 163 2HH1 ARG 20 HH12 ARG 20 18.549 -6.272 -4.754 164 1HH2 ARG 20 HH21 ARG 20 16.184 -3.761 -5.317 165 2HH2 ARG 20 HH22 ARG 20 16.890 -4.821 -4.144 166 H LEU 21 HN LEU 21 20.346 0.054 -7.778 167 HA LEU 21 HA LEU 21 21.172 -0.354 -5.086 168 1HB LEU 21 HB2 LEU 21 21.529 1.571 -7.213 169 2HB LEU 21 HB1 LEU 21 21.241 2.380 -5.679 170 HG LEU 21 HG LEU 21 23.613 2.062 -6.042 171 1HD1 LEU 21 HD11 LEU 21 22.104 1.377 -3.808 172 2HD1 LEU 21 HD12 LEU 21 23.843 1.719 -3.842 173 3HD1 LEU 21 HD13 LEU 21 23.272 0.055 -3.973 174 1HD2 LEU 21 HD21 LEU 21 23.976 -0.683 -5.751 175 2HD2 LEU 21 HD22 LEU 21 24.206 0.260 -7.225 176 3HD2 LEU 21 HD23 LEU 21 22.656 -0.531 -6.918 177 H TRP 22 HN TRP 22 19.015 2.100 -6.529 178 HA TRP 22 HA TRP 22 18.029 2.863 -4.017 179 1HB TRP 22 HB2 TRP 22 17.915 4.138 -6.272 180 2HB TRP 22 HB1 TRP 22 16.452 3.204 -6.567 181 HD1 TRP 22 HD1 TRP 22 17.825 5.578 -3.813 182 HE1 TRP 22 HE1 TRP 22 15.845 6.945 -2.897 183 HE3 TRP 22 HE3 TRP 22 14.047 3.455 -6.525 184 HZ2 TRP 22 HZ2 TRP 22 13.052 7.103 -3.275 185 HZ3 TRP 22 HZ3 TRP 22 11.751 4.272 -6.188 186 HH2 TRP 22 HH2 TRP 22 11.265 6.058 -4.596 187 H VAL 23 HN VAL 23 16.822 0.660 -6.492 188 HA VAL 23 HA VAL 23 14.357 -0.012 -5.389 189 HB VAL 23 HB VAL 23 16.181 -1.922 -6.847 190 1HG1 VAL 23 HG11 VAL 23 13.807 -2.453 -5.685 191 2HG1 VAL 23 HG12 VAL 23 14.401 -3.275 -7.129 192 3HG1 VAL 23 HG13 VAL 23 13.269 -1.932 -7.282 193 1HG2 VAL 23 HG21 VAL 23 15.959 -0.756 -8.728 194 2HG2 VAL 23 HG22 VAL 23 15.281 0.558 -7.765 195 3HG2 VAL 23 HG23 VAL 23 14.213 -0.631 -8.510 196 H ALA 24 HN ALA 24 17.588 -1.160 -4.659 197 HA ALA 24 HA ALA 24 16.698 -3.249 -2.891 198 1HB ALA 24 HB1 ALA 24 19.382 -2.104 -3.599 199 2HB ALA 24 HB2 ALA 24 18.734 -3.709 -3.943 200 3HB ALA 24 HB3 ALA 24 19.193 -3.278 -2.296 201 H PHE 25 HN PHE 25 17.548 0.095 -2.625 202 HA PHE 25 HA PHE 25 18.217 0.232 0.082 203 1HB PHE 25 HB2 PHE 25 18.617 2.326 -0.592 204 2HB PHE 25 HB1 PHE 25 17.696 2.056 -2.062 205 HD1 PHE 25 HD1 PHE 25 16.152 3.669 -2.488 206 HD2 PHE 25 HD2 PHE 25 16.880 2.580 1.560 207 HE1 PHE 25 HE1 PHE 25 14.479 5.314 -1.746 208 HE2 PHE 25 HE2 PHE 25 15.207 4.220 2.307 209 HZ PHE 25 HZ PHE 25 14.003 5.589 0.653 210 H GLN 26 HN GLN 26 15.093 0.228 -1.516 211 HA GLN 26 HA GLN 26 13.697 0.603 1.020 212 1HB GLN 26 HB2 GLN 26 11.642 0.464 -0.450 213 2HB GLN 26 HB1 GLN 26 12.727 1.809 -0.780 214 1HG GLN 26 HG2 GLN 26 13.555 -0.372 -2.375 215 2HG GLN 26 HG1 GLN 26 11.807 -0.214 -2.543 216 1HE2 GLN 26 HE21 GLN 26 14.216 2.282 -1.957 217 2HE2 GLN 26 HE22 GLN 26 13.922 3.172 -3.408 218 H MET 27 HN MET 27 14.101 -1.836 -1.479 219 HA MET 27 HA MET 27 12.337 -3.766 -0.371 220 1HB MET 27 HB2 MET 27 12.755 -4.713 -2.365 221 2HB MET 27 HB1 MET 27 13.933 -3.454 -2.673 222 1HG MET 27 HG2 MET 27 15.720 -4.765 -1.976 223 2HG MET 27 HG1 MET 27 14.667 -5.941 -1.186 224 1HE MET 27 HE1 MET 27 13.827 -7.750 -1.916 225 2HE MET 27 HE2 MET 27 15.189 -8.483 -2.763 226 3HE MET 27 HE3 MET 27 13.617 -8.369 -3.554 227 H MET 28 HN MET 28 15.756 -3.180 -0.122 228 HA MET 28 HA MET 28 16.102 -5.509 1.557 229 1HB MET 28 HB2 MET 28 18.144 -5.543 0.659 230 2HB MET 28 HB1 MET 28 17.601 -4.226 -0.381 231 1HG MET 28 HG2 MET 28 18.517 -2.599 1.160 232 2HG MET 28 HG1 MET 28 18.974 -3.876 2.287 233 1HE MET 28 HE1 MET 28 22.521 -3.163 1.365 234 2HE MET 28 HE2 MET 28 21.203 -3.032 2.530 235 3HE MET 28 HE3 MET 28 21.403 -1.801 1.282 236 H LYS 29 HN LYS 29 16.404 -1.989 1.822 237 HA LYS 29 HA LYS 29 16.995 -2.296 4.681 238 1HB LYS 29 HB2 LYS 29 16.816 0.371 3.337 239 2HB LYS 29 HB1 LYS 29 17.820 -0.130 4.688 240 1HG LYS 29 HG2 LYS 29 19.084 -1.578 3.039 241 2HG LYS 29 HG1 LYS 29 18.221 -0.707 1.770 242 1HD LYS 29 HD2 LYS 29 19.910 0.602 3.900 243 2HD LYS 29 HD1 LYS 29 20.472 0.224 2.270 244 1HE LYS 29 HE2 LYS 29 18.675 1.652 1.358 245 2HE LYS 29 HE1 LYS 29 18.203 2.073 3.004 246 1HZ LYS 29 HZ1 LYS 29 19.593 3.785 2.647 247 2HZ LYS 29 HZ2 LYS 29 20.465 2.991 1.435 248 3HZ LYS 29 HZ3 LYS 29 20.795 2.669 3.062 249 H GLY 30 HN GLY 30 14.520 -1.245 2.490 250 1HA GLY 30 HA2 GLY 30 12.902 -0.085 4.605 251 2HA GLY 30 HA1 GLY 30 12.489 -0.187 2.899 252 H ALA 31 HN ALA 31 13.506 -3.179 3.527 253 HA ALA 31 HA ALA 31 10.806 -4.188 3.789 254 1HB ALA 31 HB1 ALA 31 13.463 -5.406 3.116 255 2HB ALA 31 HB2 ALA 31 11.988 -5.311 2.142 256 3HB ALA 31 HB3 ALA 31 12.069 -6.422 3.511 257 H GLY 32 HN GLY 32 13.903 -4.938 5.413 258 1HA GLY 32 HA2 GLY 32 12.593 -6.283 7.572 259 2HA GLY 32 HA1 GLY 32 14.301 -5.884 7.479 260 H TRP 33 HN TRP 33 13.427 -2.983 6.988 261 HA TRP 33 HA TRP 33 13.521 -2.229 9.759 262 1HB TRP 33 HB2 TRP 33 14.757 -0.975 8.029 263 2HB TRP 33 HB1 TRP 33 13.230 -0.499 7.292 264 HD1 TRP 33 HD1 TRP 33 11.802 1.387 8.526 265 HE1 TRP 33 HE1 TRP 33 12.424 3.123 10.323 266 HE3 TRP 33 HE3 TRP 33 16.227 -0.629 10.108 267 HZ2 TRP 33 HZ2 TRP 33 14.513 3.577 12.168 268 HZ3 TRP 33 HZ3 TRP 33 17.475 0.517 11.893 269 HH2 TRP 33 HH2 TRP 33 16.634 2.576 12.900 270 H ALA 34 HN ALA 34 11.322 -1.049 7.207 271 HA ALA 34 HA ALA 34 9.357 -0.124 8.951 272 1HB ALA 34 HB1 ALA 34 8.897 0.736 6.926 273 2HB ALA 34 HB2 ALA 34 7.894 -0.706 6.747 274 3HB ALA 34 HB3 ALA 34 9.524 -0.673 6.070 275 H GLY 35 HN GLY 35 9.219 -3.121 7.000 276 1HA GLY 35 HA2 GLY 35 6.983 -4.332 7.672 277 2HA GLY 35 HA1 GLY 35 8.492 -5.228 7.754 278 H GLY 36 HN GLY 36 9.694 -4.205 9.975 279 1HA GLY 36 HA2 GLY 36 8.097 -5.401 12.064 280 2HA GLY 36 HA1 GLY 36 9.753 -4.837 12.204 281 H VAL 37 HN VAL 37 9.331 -2.145 11.352 282 HA VAL 37 HA VAL 37 8.393 -1.043 13.811 283 HB VAL 37 HB VAL 37 9.136 0.444 11.293 284 1HG1 VAL 37 HG11 VAL 37 9.300 1.371 14.150 285 2HG1 VAL 37 HG12 VAL 37 7.897 1.660 13.122 286 3HG1 VAL 37 HG13 VAL 37 9.467 2.334 12.682 287 1HG2 VAL 37 HG21 VAL 37 11.371 0.423 11.910 288 2HG2 VAL 37 HG22 VAL 37 10.856 -1.220 12.290 289 3HG2 VAL 37 HG23 VAL 37 11.012 -0.024 13.577 290 H PHE 38 HN PHE 38 7.403 -0.655 10.433 291 HA PHE 38 HA PHE 38 5.118 0.822 11.021 292 1HB PHE 38 HB2 PHE 38 5.089 1.127 8.813 293 2HB PHE 38 HB1 PHE 38 6.491 0.072 8.722 294 HD1 PHE 38 HD1 PHE 38 2.847 0.273 8.323 295 HD2 PHE 38 HD2 PHE 38 6.311 -2.154 7.866 296 HE1 PHE 38 HE1 PHE 38 1.554 -1.308 6.950 297 HE2 PHE 38 HE2 PHE 38 5.027 -3.738 6.491 298 HZ PHE 38 HZ PHE 38 2.643 -3.316 6.032 299 H PHE 39 HN PHE 39 5.353 -2.617 10.034 300 HA PHE 39 HA PHE 39 2.611 -3.142 10.344 301 1HB PHE 39 HB2 PHE 39 4.585 -4.553 9.277 302 2HB PHE 39 HB1 PHE 39 4.609 -5.300 10.872 303 HD1 PHE 39 HD1 PHE 39 2.691 -6.575 11.680 304 HD2 PHE 39 HD2 PHE 39 2.771 -4.930 7.756 305 HE1 PHE 39 HE1 PHE 39 0.823 -8.039 11.033 306 HE2 PHE 39 HE2 PHE 39 0.902 -6.389 7.102 307 HZ PHE 39 HZ PHE 39 -0.075 -7.946 8.741 308 H GLY 40 HN GLY 40 5.313 -3.430 12.622 309 1HA GLY 40 HA2 GLY 40 3.989 -4.688 14.724 310 2HA GLY 40 HA1 GLY 40 5.308 -3.540 14.923 311 H THR 41 HN THR 41 3.853 -1.371 13.628 312 HA THR 41 HA THR 41 2.354 -0.501 15.947 313 HB THR 41 HB THR 41 2.714 1.012 13.379 314 HG1 THR 41 HG1 THR 41 4.619 1.853 14.326 315 1HG2 THR 41 HG21 THR 41 2.359 2.947 14.585 316 2HG2 THR 41 HG22 THR 41 2.711 2.168 16.128 317 3HG2 THR 41 HG23 THR 41 1.198 1.821 15.289 318 H LEU 42 HN LEU 42 1.737 -1.021 12.473 319 HA LEU 42 HA LEU 42 -0.956 -0.290 12.503 320 1HB LEU 42 HB2 LEU 42 0.215 -2.438 10.756 321 2HB LEU 42 HB1 LEU 42 -1.203 -1.456 10.436 322 HG LEU 42 HG LEU 42 1.657 -0.836 10.029 323 1HD1 LEU 42 HD11 LEU 42 -0.008 -1.259 8.228 324 2HD1 LEU 42 HD12 LEU 42 0.821 0.292 8.099 325 3HD1 LEU 42 HD13 LEU 42 -0.832 0.225 8.710 326 1HD2 LEU 42 HD21 LEU 42 1.443 0.862 11.586 327 2HD2 LEU 42 HD22 LEU 42 -0.266 1.116 11.231 328 3HD2 LEU 42 HD23 LEU 42 0.963 1.665 10.091 329 H LEU 43 HN LEU 43 0.605 -3.295 13.349 330 HA LEU 43 HA LEU 43 -1.815 -4.775 13.570 331 1HB LEU 43 HB2 LEU 43 -0.328 -6.436 13.551 332 2HB LEU 43 HB1 LEU 43 0.988 -5.302 13.741 333 HG LEU 43 HG LEU 43 1.079 -7.050 15.440 334 1HD1 LEU 43 HD11 LEU 43 1.899 -5.633 16.918 335 2HD1 LEU 43 HD12 LEU 43 0.319 -4.906 17.210 336 3HD1 LEU 43 HD13 LEU 43 1.305 -4.355 15.859 337 1HD2 LEU 43 HD21 LEU 43 -0.781 -7.884 16.307 338 2HD2 LEU 43 HD22 LEU 43 -1.738 -6.597 15.574 339 3HD2 LEU 43 HD23 LEU 43 -1.027 -6.367 17.172 340 H LEU 44 HN LEU 44 0.146 -2.740 15.646 341 HA LEU 44 HA LEU 44 -1.209 -3.478 18.047 342 1HB LEU 44 HB2 LEU 44 1.046 -1.966 17.371 343 2HB LEU 44 HB1 LEU 44 -0.048 -0.831 18.134 344 HG LEU 44 HG LEU 44 0.072 -1.877 20.191 345 1HD1 LEU 44 HD11 LEU 44 0.870 -4.376 18.715 346 2HD1 LEU 44 HD12 LEU 44 -0.581 -4.092 19.679 347 3HD1 LEU 44 HD13 LEU 44 0.992 -4.213 20.468 348 1HD2 LEU 44 HD21 LEU 44 2.286 -0.974 19.356 349 2HD2 LEU 44 HD22 LEU 44 2.756 -2.652 19.090 350 3HD2 LEU 44 HD23 LEU 44 2.355 -2.095 20.716 351 H ILE 45 HN ILE 45 -1.537 -0.776 15.792 352 HA ILE 45 HA ILE 45 -3.766 0.313 17.295 353 HB ILE 45 HB ILE 45 -2.214 1.210 14.893 354 1HG1 ILE 45 HG12 ILE 45 -2.951 2.889 17.258 355 2HG1 ILE 45 HG11 ILE 45 -1.712 1.650 17.441 356 1HG2 ILE 45 HG21 ILE 45 -4.986 1.956 15.629 357 2HG2 ILE 45 HG22 ILE 45 -4.209 1.875 14.041 358 3HG2 ILE 45 HG23 ILE 45 -3.898 3.247 15.109 359 1HD1 ILE 45 HD11 ILE 45 -1.684 4.084 15.699 360 2HD1 ILE 45 HD12 ILE 45 -0.597 2.724 15.413 361 3HD1 ILE 45 HD13 ILE 45 -0.535 3.596 16.946 362 H GLY 46 HN GLY 46 -3.201 -1.182 14.137 363 1HA GLY 46 HA2 GLY 46 -5.851 -0.924 13.193 364 2HA GLY 46 HA1 GLY 46 -4.632 -2.025 12.563 365 H PHE 47 HN PHE 47 -4.204 -3.270 15.178 366 HA PHE 47 HA PHE 47 -6.382 -5.134 14.983 367 1HB PHE 47 HB2 PHE 47 -3.831 -5.625 15.348 368 2HB PHE 47 HB1 PHE 47 -4.225 -5.364 17.045 369 HD1 PHE 47 HD1 PHE 47 -3.127 -7.888 16.305 370 HD2 PHE 47 HD2 PHE 47 -7.178 -6.600 16.093 371 HE1 PHE 47 HE1 PHE 47 -3.876 -10.225 16.469 372 HE2 PHE 47 HE2 PHE 47 -7.933 -8.934 16.257 373 HZ PHE 47 HZ PHE 47 -6.280 -10.750 16.446 374 H PHE 48 HN PHE 48 -5.228 -2.657 17.146 375 HA PHE 48 HA PHE 48 -7.013 -3.299 19.305 376 1HB PHE 48 HB2 PHE 48 -4.732 -1.891 19.181 377 2HB PHE 48 HB1 PHE 48 -5.875 -0.563 19.038 378 HD1 PHE 48 HD1 PHE 48 -3.996 -2.446 21.264 379 HD2 PHE 48 HD2 PHE 48 -7.867 -0.727 20.827 380 HE1 PHE 48 HE1 PHE 48 -4.276 -2.461 23.709 381 HE2 PHE 48 HE2 PHE 48 -8.152 -0.738 23.272 382 HZ PHE 48 HZ PHE 48 -6.354 -1.605 24.715 383 H ARG 49 HN ARG 49 -7.058 -1.231 16.491 384 HA ARG 49 HA ARG 49 -9.339 0.273 17.324 385 1HB ARG 49 HB2 ARG 49 -9.273 1.299 15.159 386 2HB ARG 49 HB1 ARG 49 -7.622 1.139 15.739 387 1HG ARG 49 HG2 ARG 49 -7.248 0.353 13.676 388 2HG ARG 49 HG1 ARG 49 -7.861 -1.156 14.354 389 1HD ARG 49 HD2 ARG 49 -9.130 -0.963 12.441 390 2HD ARG 49 HD1 ARG 49 -10.180 -0.207 13.638 391 HE ARG 49 HE ARG 49 -9.882 1.816 12.591 392 1HH1 ARG 49 HH11 ARG 49 -7.564 -0.478 11.345 393 2HH1 ARG 49 HH12 ARG 49 -7.057 0.552 10.048 394 1HH2 ARG 49 HH21 ARG 49 -9.216 3.169 10.886 395 2HH2 ARG 49 HH22 ARG 49 -7.996 2.620 9.786 396 H VAL 50 HN VAL 50 -8.815 -2.675 15.540 397 HA VAL 50 HA VAL 50 -11.483 -2.782 14.476 398 HB VAL 50 HB VAL 50 -9.704 -3.877 13.276 399 1HG1 VAL 50 HG11 VAL 50 -9.424 -5.609 15.724 400 2HG1 VAL 50 HG12 VAL 50 -8.230 -4.486 15.077 401 3HG1 VAL 50 HG13 VAL 50 -8.654 -5.938 14.172 402 1HG2 VAL 50 HG21 VAL 50 -11.990 -4.781 13.112 403 2HG2 VAL 50 HG22 VAL 50 -11.607 -5.926 14.398 404 3HG2 VAL 50 HG23 VAL 50 -10.757 -6.015 12.856 405 H VAL 51 HN VAL 51 -9.836 -3.939 17.340 406 HA VAL 51 HA VAL 51 -11.773 -5.835 18.132 407 HB VAL 51 HB VAL 51 -9.947 -4.180 19.889 408 1HG1 VAL 51 HG11 VAL 51 -11.387 -6.765 20.479 409 2HG1 VAL 51 HG12 VAL 51 -11.802 -5.180 21.134 410 3HG1 VAL 51 HG13 VAL 51 -10.264 -5.932 21.556 411 1HG2 VAL 51 HG21 VAL 51 -9.222 -6.023 17.976 412 2HG2 VAL 51 HG22 VAL 51 -9.254 -6.976 19.459 413 3HG2 VAL 51 HG23 VAL 51 -8.246 -5.532 19.361 414 H GLY 52 HN GLY 52 -11.793 -2.428 18.024 415 1HA GLY 52 HA2 GLY 52 -14.082 -2.303 19.866 416 2HA GLY 52 HA1 GLY 52 -13.098 -0.931 19.378 417 H ARG 53 HN ARG 53 -13.348 -2.380 16.537 418 HA ARG 53 HA ARG 53 -15.933 -1.094 15.930 419 1HB ARG 53 HB2 ARG 53 -13.320 -0.717 14.797 420 2HB ARG 53 HB1 ARG 53 -14.409 -1.322 13.556 421 1HG ARG 53 HG2 ARG 53 -16.004 0.503 14.208 422 2HG ARG 53 HG1 ARG 53 -14.721 1.160 15.224 423 1HD ARG 53 HD2 ARG 53 -13.404 1.739 13.416 424 2HD ARG 53 HD1 ARG 53 -14.174 0.562 12.350 425 HE ARG 53 HE ARG 53 -15.960 2.630 13.206 426 1HH1 ARG 53 HH11 ARG 53 -13.490 1.807 10.882 427 2HH1 ARG 53 HH12 ARG 53 -14.053 2.936 9.696 428 1HH2 ARG 53 HH21 ARG 53 -16.703 4.115 11.647 429 2HH2 ARG 53 HH22 ARG 53 -15.877 4.246 10.131 430 H MET 54 HN MET 54 -15.503 -3.880 16.711 431 HA MET 54 HA MET 54 -17.192 -5.141 14.885 432 1HB MET 54 HB2 MET 54 -14.322 -5.350 14.272 433 2HB MET 54 HB1 MET 54 -15.177 -6.885 14.307 434 1HG MET 54 HG2 MET 54 -16.869 -5.326 12.839 435 2HG MET 54 HG1 MET 54 -15.287 -4.713 12.361 436 1HE MET 54 HE1 MET 54 -15.128 -5.687 9.733 437 2HE MET 54 HE2 MET 54 -14.031 -7.059 9.892 438 3HE MET 54 HE3 MET 54 -13.801 -5.626 10.894 439 H LEU 55 HN LEU 55 -16.755 -4.878 17.740 440 HA LEU 55 HA LEU 55 -17.029 -7.689 18.412 441 1HB LEU 55 HB2 LEU 55 -14.655 -6.206 19.041 442 2HB LEU 55 HB1 LEU 55 -15.490 -6.619 20.527 443 HG LEU 55 HG LEU 55 -15.096 -8.764 18.505 444 1HD1 LEU 55 HD11 LEU 55 -12.915 -8.065 20.445 445 2HD1 LEU 55 HD12 LEU 55 -12.921 -7.459 18.789 446 3HD1 LEU 55 HD13 LEU 55 -12.870 -9.196 19.092 447 1HD2 LEU 55 HD21 LEU 55 -14.657 -9.014 21.440 448 2HD2 LEU 55 HD22 LEU 55 -15.320 -10.179 20.292 449 3HD2 LEU 55 HD23 LEU 55 -16.304 -8.819 20.837 450 HA PRO 56 HA PRO 56 -18.760 -4.990 22.024 451 1HB PRO 56 HB2 PRO 56 -18.353 -2.225 21.106 452 2HB PRO 56 HB1 PRO 56 -18.011 -2.938 22.684 453 1HG PRO 56 HG2 PRO 56 -16.051 -2.215 20.985 454 2HG PRO 56 HG1 PRO 56 -15.895 -3.609 22.072 455 1HD PRO 56 HD2 PRO 56 -16.513 -3.541 19.144 456 2HD PRO 56 HD1 PRO 56 -15.488 -4.663 20.057 457 H ILE 57 HN ILE 57 -18.851 -4.263 18.670 458 HA ILE 57 HA ILE 57 -21.463 -3.084 18.687 459 HB ILE 57 HB ILE 57 -21.012 -2.390 16.624 460 1HG1 ILE 57 HG12 ILE 57 -21.670 -4.726 15.798 461 2HG1 ILE 57 HG11 ILE 57 -20.675 -3.749 14.729 462 1HG2 ILE 57 HG21 ILE 57 -18.745 -2.304 15.935 463 2HG2 ILE 57 HG22 ILE 57 -18.353 -3.764 16.846 464 3HG2 ILE 57 HG23 ILE 57 -18.770 -2.278 17.698 465 1HD1 ILE 57 HD11 ILE 57 -19.097 -5.292 14.684 466 2HD1 ILE 57 HD12 ILE 57 -20.193 -6.350 15.564 467 3HD1 ILE 57 HD13 ILE 57 -19.025 -5.365 16.444 468 H GLN 58 HN GLN 58 -20.055 -6.215 17.905 469 HA GLN 58 HA GLN 58 -22.675 -7.327 17.323 470 1HB GLN 58 HB2 GLN 58 -21.583 -9.253 16.532 471 2HB GLN 58 HB1 GLN 58 -20.543 -7.932 16.031 472 1HG GLN 58 HG2 GLN 58 -19.035 -8.372 17.869 473 2HG GLN 58 HG1 GLN 58 -20.113 -9.635 18.473 474 1HE2 GLN 58 HE21 GLN 58 -19.968 -11.639 17.657 475 2HE2 GLN 58 HE22 GLN 58 -18.884 -12.111 16.397 476 H GLU 59 HN GLU 59 -20.595 -6.909 19.967 477 HA GLU 59 HA GLU 59 -21.049 -9.197 21.494 478 1HB GLU 59 HB2 GLU 59 -19.855 -6.628 21.839 479 2HB GLU 59 HB1 GLU 59 -20.926 -6.916 23.205 480 1HG GLU 59 HG2 GLU 59 -19.773 -9.169 23.432 481 2HG GLU 59 HG1 GLU 59 -18.567 -8.538 22.311 482 H ASN 60 HN ASN 60 -23.033 -6.517 20.674 483 HA ASN 60 HA ASN 60 -24.881 -6.618 22.765 484 1HB ASN 60 HB2 ASN 60 -24.569 -5.203 20.327 485 2HB ASN 60 HB1 ASN 60 -26.183 -5.909 20.310 486 1HD2 ASN 60 HD21 ASN 60 -24.294 -3.369 21.384 487 2HD2 ASN 60 HD22 ASN 60 -25.401 -2.681 22.519 488 H GLN 61 HN GLN 61 -24.294 -8.662 20.078 489 HA GLN 61 HA GLN 61 -25.200 -10.603 19.356 490 1HB GLN 61 HB2 GLN 61 -26.136 -10.422 22.175 491 2HB GLN 61 HB1 GLN 61 -26.922 -11.609 21.143 492 1HG GLN 61 HG2 GLN 61 -24.283 -12.048 20.604 493 2HG GLN 61 HG1 GLN 61 -24.250 -11.609 22.311 494 1HE2 GLN 61 HE21 GLN 61 -24.317 -14.150 20.350 495 2HE2 GLN 61 HE22 GLN 61 -25.186 -15.286 21.319 496 H ALA 62 HN ALA 62 -26.527 -8.025 18.804 497 HA ALA 62 HA ALA 62 -29.237 -9.043 18.251 498 1HB ALA 62 HB1 ALA 62 -28.675 -6.917 19.858 499 2HB ALA 62 HB2 ALA 62 -30.197 -7.161 19.002 500 3HB ALA 62 HB3 ALA 62 -28.948 -6.130 18.305 501 HA PRO 63 HA PRO 63 -27.828 -8.379 14.056 502 1HB PRO 63 HB2 PRO 63 -30.034 -9.296 12.788 503 2HB PRO 63 HB1 PRO 63 -28.857 -10.371 13.550 504 1HG PRO 63 HG2 PRO 63 -31.508 -9.437 14.576 505 2HG PRO 63 HG1 PRO 63 -30.776 -11.049 14.664 506 1HD PRO 63 HD2 PRO 63 -30.778 -9.273 16.740 507 2HD PRO 63 HD1 PRO 63 -29.533 -10.516 16.513 508 H ALA 64 HN ALA 64 -31.233 -7.954 13.437 509 HA ALA 64 HA ALA 64 -30.903 -5.478 12.186 510 1HB ALA 64 HB1 ALA 64 -32.806 -6.501 11.463 511 2HB ALA 64 HB2 ALA 64 -33.510 -5.408 12.655 512 3HB ALA 64 HB3 ALA 64 -33.228 -7.099 13.067 513 HA PRO 65 HA PRO 65 -33.042 -3.986 16.593 514 1HB PRO 65 HB2 PRO 65 -30.724 -5.331 17.913 515 2HB PRO 65 HB1 PRO 65 -32.336 -4.992 18.549 516 1HG PRO 65 HG2 PRO 65 -31.552 -7.433 17.580 517 2HG PRO 65 HG1 PRO 65 -33.232 -6.871 17.623 518 1HD PRO 65 HD2 PRO 65 -31.547 -7.364 15.337 519 2HD PRO 65 HD1 PRO 65 -33.261 -6.921 15.365 520 H ASN 66 HN ASN 66 -29.510 -4.548 16.563 521 HA ASN 66 HA ASN 66 -28.891 -1.896 15.745 522 1HB ASN 66 HB2 ASN 66 -27.730 -1.309 17.960 523 2HB ASN 66 HB1 ASN 66 -29.482 -1.142 17.895 524 1HD2 ASN 66 HD21 ASN 66 -26.819 -3.008 19.131 525 2HD2 ASN 66 HD22 ASN 66 -27.718 -3.871 20.327 526 H ILE 67 HN ILE 67 -27.597 -3.105 14.309 527 HA ILE 67 HA ILE 67 -25.528 -4.838 15.298 528 HB ILE 67 HB ILE 67 -26.564 -5.226 13.102 529 1HG1 ILE 67 HG12 ILE 67 -24.373 -5.401 11.788 530 2HG1 ILE 67 HG11 ILE 67 -23.603 -4.657 13.186 531 1HG2 ILE 67 HG21 ILE 67 -25.184 -2.670 12.290 532 2HG2 ILE 67 HG22 ILE 67 -26.925 -2.913 12.441 533 3HG2 ILE 67 HG23 ILE 67 -26.018 -3.781 11.203 534 1HD1 ILE 67 HD11 ILE 67 -23.292 -6.946 13.478 535 2HD1 ILE 67 HD12 ILE 67 -24.942 -7.325 12.985 536 3HD1 ILE 67 HD13 ILE 67 -24.643 -6.549 14.540 537 H THR 68 HN THR 68 -25.806 -1.486 14.369 538 HA THR 68 HA THR 68 -22.961 -1.112 15.043 539 HB THR 68 HB THR 68 -23.333 -0.782 12.636 540 HG1 THR 68 HG1 THR 68 -21.816 0.552 13.743 541 1HG2 THR 68 HG21 THR 68 -25.740 0.024 12.938 542 2HG2 THR 68 HG22 THR 68 -24.748 0.808 11.708 543 3HG2 THR 68 HG23 THR 68 -25.026 1.605 13.256 544 H GLY 69 HN GLY 69 -26.170 0.404 14.936 545 1HA GLY 69 HA2 GLY 69 -27.183 1.837 16.425 546 2HA GLY 69 HA1 GLY 69 -25.867 1.511 17.543 547 H ALA 70 HN ALA 70 -25.052 3.388 18.188 548 HA ALA 70 HA ALA 70 -24.691 5.523 16.194 549 1HB ALA 70 HB1 ALA 70 -26.107 5.824 18.363 550 2HB ALA 70 HB2 ALA 70 -25.019 7.108 17.835 551 3HB ALA 70 HB3 ALA 70 -24.532 6.020 19.135 Start of MODEL 4 1 1H MET 1 1H MET 1 15.960 -3.455 -16.010 2 2H MET 1 2H MET 1 16.870 -2.240 -16.811 3 3H MET 1 3H MET 1 17.646 -3.320 -15.725 4 HA MET 1 HA MET 1 16.863 -5.136 -17.236 5 1HB MET 1 HB2 MET 1 16.679 -2.795 -19.137 6 2HB MET 1 HB1 MET 1 16.359 -4.485 -19.502 7 1HG MET 1 HG2 MET 1 14.631 -3.954 -17.430 8 2HG MET 1 HG1 MET 1 14.624 -2.456 -18.356 9 1HE MET 1 HE1 MET 1 13.786 -2.280 -20.911 10 2HE MET 1 HE2 MET 1 13.571 -3.715 -21.914 11 3HE MET 1 HE3 MET 1 15.159 -3.334 -21.246 12 H ALA 2 HN ALA 2 18.802 -2.234 -17.350 13 HA ALA 2 HA ALA 2 21.002 -3.761 -18.580 14 1HB ALA 2 HB1 ALA 2 19.996 -1.421 -19.453 15 2HB ALA 2 HB2 ALA 2 21.673 -1.915 -19.691 16 3HB ALA 2 HB3 ALA 2 21.252 -0.831 -18.365 17 H ASP 3 HN ASP 3 23.172 -3.325 -17.772 18 HA ASP 3 HA ASP 3 23.185 -3.221 -14.876 19 1HB ASP 3 HB2 ASP 3 24.695 -4.577 -16.791 20 2HB ASP 3 HB1 ASP 3 25.809 -3.390 -16.119 21 H LYS 4 HN LYS 4 25.673 -2.177 -14.326 22 HA LYS 4 HA LYS 4 25.141 0.660 -14.615 23 1HB LYS 4 HB2 LYS 4 27.403 -0.680 -13.125 24 2HB LYS 4 HB1 LYS 4 26.847 0.978 -12.942 25 1HG LYS 4 HG2 LYS 4 25.656 0.219 -11.223 26 2HG LYS 4 HG1 LYS 4 24.575 -0.473 -12.434 27 1HD LYS 4 HD2 LYS 4 25.106 -2.222 -10.922 28 2HD LYS 4 HD1 LYS 4 26.032 -2.531 -12.392 29 1HE LYS 4 HE2 LYS 4 27.980 -1.401 -11.306 30 2HE LYS 4 HE1 LYS 4 27.038 -1.327 -9.817 31 1HZ LYS 4 HZ1 LYS 4 28.671 -3.329 -10.413 32 2HZ LYS 4 HZ2 LYS 4 27.240 -3.940 -11.075 33 3HZ LYS 4 HZ3 LYS 4 27.301 -3.517 -9.438 34 H THR 5 HN THR 5 26.342 2.100 -15.753 35 HA THR 5 HA THR 5 27.770 2.896 -17.336 36 HB THR 5 HB THR 5 29.813 0.803 -16.872 37 HG1 THR 5 HG1 THR 5 29.570 0.876 -14.797 38 1HG2 THR 5 HG21 THR 5 30.676 2.620 -18.001 39 2HG2 THR 5 HG22 THR 5 31.139 2.941 -16.330 40 3HG2 THR 5 HG23 THR 5 29.760 3.783 -17.040 41 H ILE 6 HN ILE 6 25.853 0.854 -18.060 42 HA ILE 6 HA ILE 6 26.974 0.140 -20.626 43 HB ILE 6 HB ILE 6 27.649 -1.773 -19.229 44 1HG1 ILE 6 HG12 ILE 6 25.448 -2.856 -20.928 45 2HG1 ILE 6 HG11 ILE 6 26.687 -1.875 -21.703 46 1HG2 ILE 6 HG21 ILE 6 25.583 -1.483 -17.715 47 2HG2 ILE 6 HG22 ILE 6 26.175 -3.114 -18.036 48 3HG2 ILE 6 HG23 ILE 6 24.764 -2.503 -18.898 49 1HD1 ILE 6 HD11 ILE 6 28.159 -3.614 -20.184 50 2HD1 ILE 6 HD12 ILE 6 27.817 -3.777 -21.907 51 3HD1 ILE 6 HD13 ILE 6 26.805 -4.607 -20.725 52 H PHE 7 HN PHE 7 25.056 1.940 -20.298 53 HA PHE 7 HA PHE 7 22.476 0.604 -20.681 54 1HB PHE 7 HB2 PHE 7 22.439 3.525 -20.783 55 2HB PHE 7 HB1 PHE 7 21.504 2.423 -19.777 56 HD1 PHE 7 HD1 PHE 7 24.241 4.730 -19.909 57 HD2 PHE 7 HD2 PHE 7 22.562 1.523 -17.674 58 HE1 PHE 7 HE1 PHE 7 25.578 5.398 -17.956 59 HE2 PHE 7 HE2 PHE 7 23.895 2.185 -15.715 60 HZ PHE 7 HZ PHE 7 25.406 4.124 -15.854 61 H ASN 8 HN ASN 8 24.429 0.364 -22.720 62 HA ASN 8 HA ASN 8 23.339 2.079 -24.848 63 1HB ASN 8 HB2 ASN 8 25.850 0.423 -25.048 64 2HB ASN 8 HB1 ASN 8 25.354 1.775 -26.061 65 1HD2 ASN 8 HD21 ASN 8 25.112 3.879 -24.888 66 2HD2 ASN 8 HD22 ASN 8 26.302 4.254 -23.693 67 H ASP 9 HN ASP 9 21.969 -0.251 -23.824 68 HA ASP 9 HA ASP 9 22.285 -2.236 -25.943 69 1HB ASP 9 HB2 ASP 9 20.550 -2.245 -23.464 70 2HB ASP 9 HB1 ASP 9 20.667 -3.571 -24.618 71 H HIS 10 HN HIS 10 19.663 -0.323 -24.468 72 HA HIS 10 HA HIS 10 17.972 -0.814 -26.783 73 1HB HIS 10 HB2 HIS 10 17.572 0.075 -24.013 74 2HB HIS 10 HB1 HIS 10 16.582 0.937 -25.186 75 HD1 HIS 10 HD1 HIS 10 15.009 -0.616 -26.710 76 HD2 HIS 10 HD2 HIS 10 16.670 -2.419 -23.354 77 HE1 HIS 10 HE1 HIS 10 13.654 -2.700 -26.328 78 HE2 HIS 10 HE2 HIS 10 14.618 -3.724 -24.237 79 H LEU 11 HN LEU 11 18.996 2.089 -24.971 80 HA LEU 11 HA LEU 11 19.502 3.487 -27.465 81 1HB LEU 11 HB2 LEU 11 17.404 4.402 -25.499 82 2HB LEU 11 HB1 LEU 11 18.069 5.417 -26.764 83 HG LEU 11 HG LEU 11 16.624 2.825 -27.307 84 1HD1 LEU 11 HD11 LEU 11 15.131 4.420 -26.197 85 2HD1 LEU 11 HD12 LEU 11 14.688 4.172 -27.886 86 3HD1 LEU 11 HD13 LEU 11 15.544 5.638 -27.405 87 1HD2 LEU 11 HD21 LEU 11 17.711 3.198 -29.260 88 2HD2 LEU 11 HD22 LEU 11 17.904 4.922 -28.950 89 3HD2 LEU 11 HD23 LEU 11 16.359 4.297 -29.525 90 H ASN 12 HN ASN 12 20.007 5.944 -26.780 91 HA ASN 12 HA ASN 12 22.360 5.822 -25.239 92 1HB ASN 12 HB2 ASN 12 20.784 8.307 -25.937 93 2HB ASN 12 HB1 ASN 12 22.499 8.215 -25.545 94 1HD2 ASN 12 HD21 ASN 12 23.423 6.192 -27.007 95 2HD2 ASN 12 HD22 ASN 12 23.203 6.488 -28.694 96 H THR 13 HN THR 13 19.488 7.815 -24.529 97 HA THR 13 HA THR 13 20.120 8.295 -21.855 98 HB THR 13 HB THR 13 18.446 9.587 -23.117 99 HG1 THR 13 HG1 THR 13 17.888 10.022 -21.149 100 1HG2 THR 13 HG21 THR 13 17.387 7.319 -24.008 101 2HG2 THR 13 HG22 THR 13 16.470 8.821 -23.889 102 3HG2 THR 13 HG23 THR 13 16.324 7.595 -22.629 103 H ASN 14 HN ASN 14 18.704 7.561 -19.973 104 HA ASN 14 HA ASN 14 17.435 5.039 -20.044 105 1HB ASN 14 HB2 ASN 14 19.132 3.753 -18.739 106 2HB ASN 14 HB1 ASN 14 19.641 4.126 -20.384 107 1HD2 ASN 14 HD21 ASN 14 21.159 5.826 -20.702 108 2HD2 ASN 14 HD22 ASN 14 22.261 6.258 -19.444 109 HA PRO 15 HA PRO 15 16.749 7.953 -16.392 110 1HB PRO 15 HB2 PRO 15 13.977 7.118 -17.070 111 2HB PRO 15 HB1 PRO 15 14.598 8.717 -16.650 112 1HG PRO 15 HG2 PRO 15 13.957 8.124 -19.167 113 2HG PRO 15 HG1 PRO 15 15.374 9.127 -18.797 114 1HD PRO 15 HD2 PRO 15 15.242 6.252 -19.603 115 2HD PRO 15 HD1 PRO 15 16.426 7.497 -20.051 116 H LYS 16 HN LYS 16 15.724 4.752 -17.322 117 HA LYS 16 HA LYS 16 14.592 3.842 -14.937 118 1HB LYS 16 HB2 LYS 16 14.862 2.731 -17.315 119 2HB LYS 16 HB1 LYS 16 16.304 2.030 -16.587 120 1HG LYS 16 HG2 LYS 16 14.258 1.642 -14.721 121 2HG LYS 16 HG1 LYS 16 13.550 1.267 -16.293 122 1HD LYS 16 HD2 LYS 16 14.469 -0.761 -15.527 123 2HD LYS 16 HD1 LYS 16 15.622 -0.147 -16.714 124 1HE LYS 16 HE2 LYS 16 16.124 0.765 -13.980 125 2HE LYS 16 HE1 LYS 16 16.239 -0.983 -14.183 126 1HZ LYS 16 HZ1 LYS 16 17.964 1.111 -15.190 127 2HZ LYS 16 HZ2 LYS 16 17.605 -0.105 -16.310 128 3HZ LYS 16 HZ3 LYS 16 18.317 -0.504 -14.829 129 H THR 17 HN THR 17 17.909 4.384 -15.817 130 HA THR 17 HA THR 17 19.027 2.769 -13.756 131 HB THR 17 HB THR 17 20.342 5.021 -15.276 132 HG1 THR 17 HG1 THR 17 19.490 3.322 -16.620 133 1HG2 THR 17 HG21 THR 17 21.297 3.597 -13.120 134 2HG2 THR 17 HG22 THR 17 22.262 4.478 -14.308 135 3HG2 THR 17 HG23 THR 17 21.968 2.751 -14.518 136 H ASN 18 HN ASN 18 17.702 5.934 -13.888 137 HA ASN 18 HA ASN 18 19.059 6.697 -11.430 138 1HB ASN 18 HB2 ASN 18 17.126 8.358 -13.020 139 2HB ASN 18 HB1 ASN 18 18.269 8.909 -11.800 140 1HD2 ASN 18 HD21 ASN 18 17.747 9.115 -14.909 141 2HD2 ASN 18 HD22 ASN 18 19.355 9.083 -15.539 142 H LEU 19 HN LEU 19 15.787 6.195 -12.679 143 HA LEU 19 HA LEU 19 14.520 6.825 -10.204 144 1HB LEU 19 HB2 LEU 19 13.350 7.145 -12.298 145 2HB LEU 19 HB1 LEU 19 13.505 5.441 -12.683 146 HG LEU 19 HG LEU 19 12.193 5.374 -10.269 147 1HD1 LEU 19 HD11 LEU 19 10.349 6.959 -10.446 148 2HD1 LEU 19 HD12 LEU 19 11.112 7.698 -11.854 149 3HD1 LEU 19 HD13 LEU 19 11.894 7.792 -10.276 150 1HD2 LEU 19 HD21 LEU 19 10.641 5.552 -12.811 151 2HD2 LEU 19 HD22 LEU 19 10.466 4.428 -11.465 152 3HD2 LEU 19 HD23 LEU 19 11.812 4.252 -12.593 153 H ARG 20 HN ARG 20 15.673 3.890 -11.740 154 HA ARG 20 HA ARG 20 14.258 2.088 -10.138 155 1HB ARG 20 HB2 ARG 20 15.430 1.548 -12.288 156 2HB ARG 20 HB1 ARG 20 16.941 1.533 -11.384 157 1HG ARG 20 HG2 ARG 20 15.926 -0.711 -11.757 158 2HG ARG 20 HG1 ARG 20 16.214 -0.313 -10.061 159 1HD ARG 20 HD2 ARG 20 13.561 0.355 -11.219 160 2HD ARG 20 HD1 ARG 20 13.912 -1.342 -10.899 161 HE ARG 20 HE ARG 20 13.464 0.745 -8.949 162 1HH1 ARG 20 HH11 ARG 20 14.812 -2.427 -9.530 163 2HH1 ARG 20 HH12 ARG 20 14.714 -2.907 -7.869 164 1HH2 ARG 20 HH21 ARG 20 13.336 0.110 -6.768 165 2HH2 ARG 20 HH22 ARG 20 13.873 -1.470 -6.303 166 H LEU 21 HN LEU 21 17.331 3.732 -9.527 167 HA LEU 21 HA LEU 21 17.802 2.028 -7.214 168 1HB LEU 21 HB2 LEU 21 19.452 4.360 -7.076 169 2HB LEU 21 HB1 LEU 21 19.920 2.692 -7.319 170 HG LEU 21 HG LEU 21 20.855 3.932 -9.102 171 1HD1 LEU 21 HD11 LEU 21 18.722 3.074 -10.813 172 2HD1 LEU 21 HD12 LEU 21 18.994 1.884 -9.541 173 3HD1 LEU 21 HD13 LEU 21 20.328 2.382 -10.584 174 1HD2 LEU 21 HD21 LEU 21 18.618 5.589 -8.717 175 2HD2 LEU 21 HD22 LEU 21 18.543 5.015 -10.382 176 3HD2 LEU 21 HD23 LEU 21 19.986 5.842 -9.805 177 H TRP 22 HN TRP 22 16.450 5.130 -7.963 178 HA TRP 22 HA TRP 22 16.361 6.124 -5.309 179 1HB TRP 22 HB2 TRP 22 16.048 7.465 -7.459 180 2HB TRP 22 HB1 TRP 22 14.416 6.810 -7.518 181 HD1 TRP 22 HD1 TRP 22 16.618 9.089 -5.321 182 HE1 TRP 22 HE1 TRP 22 15.071 10.648 -3.979 183 HE3 TRP 22 HE3 TRP 22 12.103 7.107 -6.670 184 HZ2 TRP 22 HZ2 TRP 22 12.303 10.992 -3.549 185 HZ3 TRP 22 HZ3 TRP 22 10.053 8.109 -5.748 186 HH2 TRP 22 HH2 TRP 22 10.153 10.010 -4.219 187 H VAL 23 HN VAL 23 14.122 4.339 -7.377 188 HA VAL 23 HA VAL 23 11.980 4.170 -5.549 189 HB VAL 23 HB VAL 23 12.680 2.230 -7.758 190 1HG1 VAL 23 HG11 VAL 23 10.775 1.966 -5.790 191 2HG1 VAL 23 HG12 VAL 23 10.762 1.157 -7.358 192 3HG1 VAL 23 HG13 VAL 23 9.866 2.659 -7.133 193 1HG2 VAL 23 HG21 VAL 23 10.542 4.144 -8.270 194 2HG2 VAL 23 HG22 VAL 23 11.910 3.673 -9.281 195 3HG2 VAL 23 HG23 VAL 23 12.116 4.908 -8.040 196 H ALA 24 HN ALA 24 14.868 2.273 -6.072 197 HA ALA 24 HA ALA 24 14.106 0.138 -4.295 198 1HB ALA 24 HB1 ALA 24 16.839 -0.037 -4.627 199 2HB ALA 24 HB2 ALA 24 16.295 0.722 -6.124 200 3HB ALA 24 HB3 ALA 24 15.621 -0.831 -5.624 201 H PHE 25 HN PHE 25 15.753 3.159 -4.085 202 HA PHE 25 HA PHE 25 17.267 2.824 -1.766 203 1HB PHE 25 HB2 PHE 25 17.858 4.873 -2.458 204 2HB PHE 25 HB1 PHE 25 16.415 5.008 -3.452 205 HD1 PHE 25 HD1 PHE 25 17.431 5.241 0.133 206 HD2 PHE 25 HD2 PHE 25 14.956 6.719 -3.000 207 HE1 PHE 25 HE1 PHE 25 16.565 6.981 1.643 208 HE2 PHE 25 HE2 PHE 25 14.086 8.463 -1.495 209 HZ PHE 25 HZ PHE 25 14.893 8.594 0.829 210 H GLN 26 HN GLN 26 13.898 3.809 -2.187 211 HA GLN 26 HA GLN 26 13.485 3.920 0.698 212 1HB GLN 26 HB2 GLN 26 11.295 4.768 0.196 213 2HB GLN 26 HB1 GLN 26 12.445 5.599 -0.842 214 1HG GLN 26 HG2 GLN 26 11.704 3.437 -2.355 215 2HG GLN 26 HG1 GLN 26 10.209 3.873 -1.528 216 1HE2 GLN 26 HE21 GLN 26 12.902 5.824 -2.754 217 2HE2 GLN 26 HE22 GLN 26 11.940 6.819 -3.789 218 H MET 27 HN MET 27 12.911 1.870 -2.013 219 HA MET 27 HA MET 27 10.944 0.139 -0.908 220 1HB MET 27 HB2 MET 27 11.007 -0.307 -3.131 221 2HB MET 27 HB1 MET 27 12.622 0.359 -3.272 222 1HG MET 27 HG2 MET 27 13.631 -1.623 -3.169 223 2HG MET 27 HG1 MET 27 12.448 -2.308 -2.051 224 1HE MET 27 HE1 MET 27 10.928 -4.773 -3.927 225 2HE MET 27 HE2 MET 27 9.794 -3.526 -3.409 226 3HE MET 27 HE3 MET 27 11.207 -3.900 -2.420 227 H MET 28 HN MET 28 14.408 0.293 -0.790 228 HA MET 28 HA MET 28 14.580 -2.322 0.449 229 1HB MET 28 HB2 MET 28 16.120 -1.273 -1.363 230 2HB MET 28 HB1 MET 28 16.895 -0.472 0.000 231 1HG MET 28 HG2 MET 28 17.829 -2.382 0.782 232 2HG MET 28 HG1 MET 28 16.488 -3.390 0.241 233 1HE MET 28 HE1 MET 28 19.956 -1.648 -1.908 234 2HE MET 28 HE2 MET 28 18.577 -0.770 -1.245 235 3HE MET 28 HE3 MET 28 18.572 -1.273 -2.936 236 H LYS 29 HN LYS 29 14.897 1.056 1.298 237 HA LYS 29 HA LYS 29 15.744 0.362 4.014 238 1HB LYS 29 HB2 LYS 29 16.996 2.181 3.238 239 2HB LYS 29 HB1 LYS 29 15.615 2.917 2.441 240 1HG LYS 29 HG2 LYS 29 15.484 2.687 5.387 241 2HG LYS 29 HG1 LYS 29 16.643 3.838 4.719 242 1HD LYS 29 HD2 LYS 29 13.753 3.760 3.879 243 2HD LYS 29 HD1 LYS 29 14.328 4.739 5.230 244 1HE LYS 29 HE2 LYS 29 15.897 5.052 2.780 245 2HE LYS 29 HE1 LYS 29 14.213 5.548 2.616 246 1HZ LYS 29 HZ1 LYS 29 16.351 6.730 4.193 247 2HZ LYS 29 HZ2 LYS 29 14.825 6.698 4.924 248 3HZ LYS 29 HZ3 LYS 29 15.031 7.466 3.431 249 H GLY 30 HN GLY 30 12.972 1.142 2.208 250 1HA GLY 30 HA2 GLY 30 11.441 1.881 4.595 251 2HA GLY 30 HA1 GLY 30 10.947 2.139 2.929 252 H ALA 31 HN ALA 31 12.089 -0.816 2.674 253 HA ALA 31 HA ALA 31 9.464 -2.017 3.113 254 1HB ALA 31 HB1 ALA 31 10.257 -3.807 1.653 255 2HB ALA 31 HB2 ALA 31 11.857 -3.055 1.592 256 3HB ALA 31 HB3 ALA 31 10.457 -2.221 0.893 257 H GLY 32 HN GLY 32 12.885 -2.632 3.866 258 1HA GLY 32 HA2 GLY 32 12.291 -4.948 5.452 259 2HA GLY 32 HA1 GLY 32 13.848 -4.144 5.323 260 H TRP 33 HN TRP 33 13.306 -1.625 6.237 261 HA TRP 33 HA TRP 33 13.347 -1.993 9.026 262 1HB TRP 33 HB2 TRP 33 14.299 -0.058 7.577 263 2HB TRP 33 HB1 TRP 33 12.697 0.650 7.754 264 HD1 TRP 33 HD1 TRP 33 13.550 -1.149 10.860 265 HE1 TRP 33 HE1 TRP 33 14.348 0.496 12.671 266 HE3 TRP 33 HE3 TRP 33 14.252 2.993 7.945 267 HZ2 TRP 33 HZ2 TRP 33 15.166 3.192 12.844 268 HZ3 TRP 33 HZ3 TRP 33 15.043 5.065 9.012 269 HH2 TRP 33 HH2 TRP 33 15.490 5.161 11.411 270 H ALA 34 HN ALA 34 10.861 -0.397 7.013 271 HA ALA 34 HA ALA 34 9.004 0.088 9.007 272 1HB ALA 34 HB1 ALA 34 8.702 -0.438 6.073 273 2HB ALA 34 HB2 ALA 34 8.551 1.085 6.950 274 3HB ALA 34 HB3 ALA 34 7.297 -0.147 7.096 275 H GLY 35 HN GLY 35 8.874 -2.688 6.744 276 1HA GLY 35 HA2 GLY 35 6.888 -4.205 7.468 277 2HA GLY 35 HA1 GLY 35 8.485 -4.933 7.399 278 H GLY 36 HN GLY 36 9.755 -4.129 9.585 279 1HA GLY 36 HA2 GLY 36 8.375 -5.549 11.676 280 2HA GLY 36 HA1 GLY 36 10.001 -4.895 11.751 281 H VAL 37 HN VAL 37 9.481 -2.180 11.256 282 HA VAL 37 HA VAL 37 8.555 -1.385 13.832 283 HB VAL 37 HB VAL 37 9.221 0.400 11.497 284 1HG1 VAL 37 HG11 VAL 37 9.969 1.753 13.697 285 2HG1 VAL 37 HG12 VAL 37 8.619 0.828 14.355 286 3HG1 VAL 37 HG13 VAL 37 8.369 1.889 12.967 287 1HG2 VAL 37 HG21 VAL 37 11.259 -0.541 11.657 288 2HG2 VAL 37 HG22 VAL 37 10.938 -1.212 13.256 289 3HG2 VAL 37 HG23 VAL 37 11.414 0.478 13.087 290 H PHE 38 HN PHE 38 7.508 -0.643 10.541 291 HA PHE 38 HA PHE 38 5.235 0.764 11.220 292 1HB PHE 38 HB2 PHE 38 6.400 -0.335 8.814 293 2HB PHE 38 HB1 PHE 38 4.644 -0.446 8.777 294 HD1 PHE 38 HD1 PHE 38 3.274 1.523 8.675 295 HD2 PHE 38 HD2 PHE 38 7.512 1.824 8.904 296 HE1 PHE 38 HE1 PHE 38 3.134 3.895 8.036 297 HE2 PHE 38 HE2 PHE 38 7.382 4.196 8.266 298 HZ PHE 38 HZ PHE 38 5.190 5.235 7.831 299 H PHE 39 HN PHE 39 5.378 -2.637 10.087 300 HA PHE 39 HA PHE 39 2.690 -3.218 10.423 301 1HB PHE 39 HB2 PHE 39 4.576 -4.645 9.384 302 2HB PHE 39 HB1 PHE 39 4.826 -5.253 11.019 303 HD1 PHE 39 HD1 PHE 39 3.246 -5.903 8.015 304 HD2 PHE 39 HD2 PHE 39 2.520 -5.966 12.208 305 HE1 PHE 39 HE1 PHE 39 1.444 -7.542 7.674 306 HE2 PHE 39 HE2 PHE 39 0.717 -7.607 11.875 307 HZ PHE 39 HZ PHE 39 0.178 -8.398 9.605 308 H GLY 40 HN GLY 40 5.308 -3.467 12.820 309 1HA GLY 40 HA2 GLY 40 3.873 -4.661 14.886 310 2HA GLY 40 HA1 GLY 40 5.205 -3.534 15.119 311 H THR 41 HN THR 41 3.832 -1.373 13.720 312 HA THR 41 HA THR 41 2.253 -0.425 15.956 313 HB THR 41 HB THR 41 2.870 1.005 13.381 314 HG1 THR 41 HG1 THR 41 4.826 0.450 14.281 315 1HG2 THR 41 HG21 THR 41 2.492 2.239 16.078 316 2HG2 THR 41 HG22 THR 41 1.137 1.938 14.989 317 3HG2 THR 41 HG23 THR 41 2.449 3.005 14.491 318 H LEU 42 HN LEU 42 1.788 -1.046 12.474 319 HA LEU 42 HA LEU 42 -0.888 -0.221 12.373 320 1HB LEU 42 HB2 LEU 42 0.223 -2.439 10.685 321 2HB LEU 42 HB1 LEU 42 -1.065 -1.315 10.291 322 HG LEU 42 HG LEU 42 1.896 -0.797 10.353 323 1HD1 LEU 42 HD11 LEU 42 1.366 -1.498 8.237 324 2HD1 LEU 42 HD12 LEU 42 1.129 0.243 8.082 325 3HD1 LEU 42 HD13 LEU 42 -0.262 -0.820 8.301 326 1HD2 LEU 42 HD21 LEU 42 1.013 1.080 11.503 327 2HD2 LEU 42 HD22 LEU 42 -0.351 1.203 10.393 328 3HD2 LEU 42 HD23 LEU 42 1.276 1.587 9.835 329 H LEU 43 HN LEU 43 0.571 -3.258 13.289 330 HA LEU 43 HA LEU 43 -1.884 -4.674 13.471 331 1HB LEU 43 HB2 LEU 43 -0.437 -6.373 13.480 332 2HB LEU 43 HB1 LEU 43 0.903 -5.269 13.680 333 HG LEU 43 HG LEU 43 0.933 -7.017 15.379 334 1HD1 LEU 43 HD11 LEU 43 0.229 -4.872 17.166 335 2HD1 LEU 43 HD12 LEU 43 1.189 -4.304 15.804 336 3HD1 LEU 43 HD13 LEU 43 1.801 -5.599 16.834 337 1HD2 LEU 43 HD21 LEU 43 -1.813 -6.758 15.381 338 2HD2 LEU 43 HD22 LEU 43 -1.329 -6.071 16.931 339 3HD2 LEU 43 HD23 LEU 43 -0.853 -7.716 16.509 340 H LEU 44 HN LEU 44 0.075 -2.641 15.548 341 HA LEU 44 HA LEU 44 -1.282 -3.347 17.957 342 1HB LEU 44 HB2 LEU 44 0.945 -1.787 17.242 343 2HB LEU 44 HB1 LEU 44 -0.166 -0.700 18.057 344 HG LEU 44 HG LEU 44 -0.180 -2.074 20.024 345 1HD1 LEU 44 HD11 LEU 44 -0.115 -4.269 19.018 346 2HD1 LEU 44 HD12 LEU 44 1.213 -4.113 20.168 347 3HD1 LEU 44 HD13 LEU 44 1.528 -3.988 18.437 348 1HD2 LEU 44 HD21 LEU 44 1.918 -1.556 20.807 349 2HD2 LEU 44 HD22 LEU 44 1.827 -0.522 19.382 350 3HD2 LEU 44 HD23 LEU 44 2.716 -2.043 19.311 351 H ILE 45 HN ILE 45 -1.600 -0.656 15.685 352 HA ILE 45 HA ILE 45 -3.829 0.464 17.147 353 HB ILE 45 HB ILE 45 -2.318 1.255 14.683 354 1HG1 ILE 45 HG12 ILE 45 -3.054 3.082 16.925 355 2HG1 ILE 45 HG11 ILE 45 -1.839 1.842 17.226 356 1HG2 ILE 45 HG21 ILE 45 -4.031 3.278 14.807 357 2HG2 ILE 45 HG22 ILE 45 -5.093 2.000 15.402 358 3HG2 ILE 45 HG23 ILE 45 -4.330 1.848 13.815 359 1HD1 ILE 45 HD11 ILE 45 -1.705 4.269 15.556 360 2HD1 ILE 45 HD12 ILE 45 -0.866 2.839 14.953 361 3HD1 ILE 45 HD13 ILE 45 -0.465 3.493 16.541 362 H GLY 46 HN GLY 46 -3.287 -1.211 14.082 363 1HA GLY 46 HA2 GLY 46 -5.958 -1.008 13.161 364 2HA GLY 46 HA1 GLY 46 -4.737 -2.128 12.562 365 H PHE 47 HN PHE 47 -4.239 -3.243 15.213 366 HA PHE 47 HA PHE 47 -6.345 -5.182 15.157 367 1HB PHE 47 HB2 PHE 47 -3.897 -5.724 15.516 368 2HB PHE 47 HB1 PHE 47 -4.068 -5.033 17.129 369 HD1 PHE 47 HD1 PHE 47 -5.404 -7.682 14.903 370 HD2 PHE 47 HD2 PHE 47 -4.873 -6.319 18.900 371 HE1 PHE 47 HE1 PHE 47 -6.217 -9.847 15.745 372 HE2 PHE 47 HE2 PHE 47 -5.683 -8.482 19.749 373 HZ PHE 47 HZ PHE 47 -6.357 -10.248 18.171 374 H PHE 48 HN PHE 48 -5.373 -2.495 17.155 375 HA PHE 48 HA PHE 48 -7.111 -3.109 19.343 376 1HB PHE 48 HB2 PHE 48 -5.125 -1.077 18.672 377 2HB PHE 48 HB1 PHE 48 -6.538 -0.380 19.449 378 HD1 PHE 48 HD1 PHE 48 -3.900 -2.944 19.845 379 HD2 PHE 48 HD2 PHE 48 -6.879 -0.583 21.759 380 HE1 PHE 48 HE1 PHE 48 -3.039 -3.643 22.042 381 HE2 PHE 48 HE2 PHE 48 -6.023 -1.278 23.959 382 HZ PHE 48 HZ PHE 48 -4.100 -2.810 24.101 383 H ARG 49 HN ARG 49 -7.106 -0.685 16.759 384 HA ARG 49 HA ARG 49 -9.555 0.456 17.375 385 1HB ARG 49 HB2 ARG 49 -9.425 1.592 15.333 386 2HB ARG 49 HB1 ARG 49 -7.750 1.299 15.769 387 1HG ARG 49 HG2 ARG 49 -7.734 0.736 13.553 388 2HG ARG 49 HG1 ARG 49 -8.043 -0.837 14.291 389 1HD ARG 49 HD2 ARG 49 -9.780 -0.950 12.887 390 2HD ARG 49 HD1 ARG 49 -10.570 0.170 13.993 391 HE ARG 49 HE ARG 49 -9.374 0.809 11.409 392 1HH1 ARG 49 HH11 ARG 49 -11.032 1.919 14.280 393 2HH1 ARG 49 HH12 ARG 49 -11.500 3.426 13.571 394 1HH2 ARG 49 HH21 ARG 49 -9.997 2.789 10.484 395 2HH2 ARG 49 HH22 ARG 49 -10.916 3.921 11.421 396 H VAL 50 HN VAL 50 -8.772 -2.450 15.651 397 HA VAL 50 HA VAL 50 -11.389 -2.793 14.506 398 HB VAL 50 HB VAL 50 -8.839 -4.211 14.458 399 1HG1 VAL 50 HG11 VAL 50 -10.034 -6.034 15.383 400 2HG1 VAL 50 HG12 VAL 50 -9.877 -6.339 13.652 401 3HG1 VAL 50 HG13 VAL 50 -11.406 -5.755 14.309 402 1HG2 VAL 50 HG21 VAL 50 -10.754 -4.478 12.252 403 2HG2 VAL 50 HG22 VAL 50 -9.057 -3.994 12.230 404 3HG2 VAL 50 HG23 VAL 50 -10.301 -2.825 12.669 405 H VAL 51 HN VAL 51 -9.678 -3.905 17.382 406 HA VAL 51 HA VAL 51 -11.450 -5.961 18.075 407 HB VAL 51 HB VAL 51 -9.158 -5.194 19.154 408 1HG1 VAL 51 HG11 VAL 51 -9.222 -3.852 20.995 409 2HG1 VAL 51 HG12 VAL 51 -10.901 -4.249 21.362 410 3HG1 VAL 51 HG13 VAL 51 -10.528 -3.119 20.060 411 1HG2 VAL 51 HG21 VAL 51 -10.932 -6.328 21.201 412 2HG2 VAL 51 HG22 VAL 51 -9.444 -6.969 20.505 413 3HG2 VAL 51 HG23 VAL 51 -10.970 -7.142 19.636 414 H GLY 52 HN GLY 52 -11.792 -2.560 18.145 415 1HA GLY 52 HA2 GLY 52 -14.186 -2.778 19.834 416 2HA GLY 52 HA1 GLY 52 -13.294 -1.296 19.530 417 H ARG 53 HN ARG 53 -13.251 -2.579 16.580 418 HA ARG 53 HA ARG 53 -15.935 -1.558 15.887 419 1HB ARG 53 HB2 ARG 53 -13.330 -1.077 14.425 420 2HB ARG 53 HB1 ARG 53 -14.915 -0.645 13.797 421 1HG ARG 53 HG2 ARG 53 -15.179 0.720 15.951 422 2HG ARG 53 HG1 ARG 53 -13.434 0.526 16.121 423 1HD ARG 53 HD2 ARG 53 -13.051 2.122 14.621 424 2HD ARG 53 HD1 ARG 53 -14.092 1.327 13.440 425 HE ARG 53 HE ARG 53 -15.636 2.935 13.868 426 1HH1 ARG 53 HH11 ARG 53 -13.645 2.588 16.714 427 2HH1 ARG 53 HH12 ARG 53 -14.457 3.843 17.586 428 1HH2 ARG 53 HH21 ARG 53 -16.702 4.588 15.014 429 2HH2 ARG 53 HH22 ARG 53 -16.192 4.979 16.623 430 H MET 54 HN MET 54 -15.416 -4.255 16.335 431 HA MET 54 HA MET 54 -16.513 -5.510 14.146 432 1HB MET 54 HB2 MET 54 -13.636 -5.077 13.866 433 2HB MET 54 HB1 MET 54 -14.091 -6.768 13.704 434 1HG MET 54 HG2 MET 54 -15.963 -5.418 12.173 435 2HG MET 54 HG1 MET 54 -14.450 -4.569 11.862 436 1HE MET 54 HE1 MET 54 -16.459 -7.962 10.959 437 2HE MET 54 HE2 MET 54 -15.781 -7.681 9.356 438 3HE MET 54 HE3 MET 54 -16.558 -6.360 10.230 439 H LEU 55 HN LEU 55 -16.397 -5.604 17.074 440 HA LEU 55 HA LEU 55 -16.268 -8.488 17.311 441 1HB LEU 55 HB2 LEU 55 -14.231 -6.778 18.422 442 2HB LEU 55 HB1 LEU 55 -15.090 -7.615 19.703 443 HG LEU 55 HG LEU 55 -14.617 -9.601 17.832 444 1HD1 LEU 55 HD11 LEU 55 -12.159 -7.871 18.098 445 2HD1 LEU 55 HD12 LEU 55 -13.087 -8.133 16.622 446 3HD1 LEU 55 HD13 LEU 55 -12.222 -9.475 17.369 447 1HD2 LEU 55 HD21 LEU 55 -14.483 -9.676 20.329 448 2HD2 LEU 55 HD22 LEU 55 -12.882 -8.944 20.208 449 3HD2 LEU 55 HD23 LEU 55 -13.182 -10.531 19.499 450 HA PRO 56 HA PRO 56 -18.621 -6.685 21.164 451 1HB PRO 56 HB2 PRO 56 -18.690 -3.811 20.452 452 2HB PRO 56 HB1 PRO 56 -18.457 -4.570 22.029 453 1HG PRO 56 HG2 PRO 56 -16.434 -3.390 20.712 454 2HG PRO 56 HG1 PRO 56 -16.189 -4.826 21.721 455 1HD PRO 56 HD2 PRO 56 -16.298 -4.585 18.752 456 2HD PRO 56 HD1 PRO 56 -15.324 -5.663 19.768 457 H ILE 57 HN ILE 57 -18.651 -5.656 17.890 458 HA ILE 57 HA ILE 57 -21.440 -5.038 17.784 459 HB ILE 57 HB ILE 57 -20.981 -3.994 15.886 460 1HG1 ILE 57 HG12 ILE 57 -20.987 -6.436 14.812 461 2HG1 ILE 57 HG11 ILE 57 -20.545 -5.014 13.889 462 1HG2 ILE 57 HG21 ILE 57 -18.708 -3.455 15.375 463 2HG2 ILE 57 HG22 ILE 57 -18.135 -4.893 16.219 464 3HG2 ILE 57 HG23 ILE 57 -18.891 -3.584 17.124 465 1HD1 ILE 57 HD11 ILE 57 -18.375 -6.472 15.293 466 2HD1 ILE 57 HD12 ILE 57 -18.357 -5.597 13.762 467 3HD1 ILE 57 HD13 ILE 57 -19.082 -7.198 13.850 468 H GLN 58 HN GLN 58 -19.433 -7.623 16.340 469 HA GLN 58 HA GLN 58 -21.848 -9.114 15.746 470 1HB GLN 58 HB2 GLN 58 -20.631 -10.366 14.252 471 2HB GLN 58 HB1 GLN 58 -19.748 -8.851 14.213 472 1HG GLN 58 HG2 GLN 58 -18.094 -9.770 15.755 473 2HG GLN 58 HG1 GLN 58 -18.988 -11.292 15.800 474 1HE2 GLN 58 HE21 GLN 58 -18.804 -12.714 14.129 475 2HE2 GLN 58 HE22 GLN 58 -17.699 -12.512 12.817 476 H GLU 59 HN GLU 59 -19.479 -9.002 18.199 477 HA GLU 59 HA GLU 59 -19.394 -11.682 19.008 478 1HB GLU 59 HB2 GLU 59 -17.878 -9.866 19.831 479 2HB GLU 59 HB1 GLU 59 -19.214 -9.240 20.787 480 1HG GLU 59 HG2 GLU 59 -17.556 -10.654 22.019 481 2HG GLU 59 HG1 GLU 59 -19.241 -11.151 22.174 482 H ASN 60 HN ASN 60 -21.820 -9.274 19.215 483 HA ASN 60 HA ASN 60 -23.272 -10.238 21.406 484 1HB ASN 60 HB2 ASN 60 -23.621 -8.272 19.324 485 2HB ASN 60 HB1 ASN 60 -25.120 -9.167 19.569 486 1HD2 ASN 60 HD21 ASN 60 -22.597 -7.393 21.288 487 2HD2 ASN 60 HD22 ASN 60 -23.622 -6.801 22.545 488 H GLN 61 HN GLN 61 -22.971 -11.262 18.117 489 HA GLN 61 HA GLN 61 -23.808 -12.994 16.922 490 1HB GLN 61 HB2 GLN 61 -23.444 -13.932 19.639 491 2HB GLN 61 HB1 GLN 61 -24.750 -14.802 18.845 492 1HG GLN 61 HG2 GLN 61 -21.927 -14.521 17.843 493 2HG GLN 61 HG1 GLN 61 -22.648 -15.960 18.559 494 1HE2 GLN 61 HE21 GLN 61 -25.040 -16.145 17.367 495 2HE2 GLN 61 HE22 GLN 61 -24.865 -16.358 15.661 496 H ALA 62 HN ALA 62 -25.633 -10.845 17.595 497 HA ALA 62 HA ALA 62 -28.116 -12.238 17.024 498 1HB ALA 62 HB1 ALA 62 -27.530 -11.304 19.643 499 2HB ALA 62 HB2 ALA 62 -29.007 -12.060 19.046 500 3HB ALA 62 HB3 ALA 62 -28.822 -10.308 18.973 501 HA PRO 63 HA PRO 63 -28.228 -8.498 14.581 502 1HB PRO 63 HB2 PRO 63 -30.193 -9.257 12.882 503 2HB PRO 63 HB1 PRO 63 -28.530 -9.836 12.753 504 1HG PRO 63 HG2 PRO 63 -30.944 -11.233 13.744 505 2HG PRO 63 HG1 PRO 63 -29.490 -11.895 12.985 506 1HD PRO 63 HD2 PRO 63 -30.100 -11.875 15.738 507 2HD PRO 63 HD1 PRO 63 -28.545 -12.296 15.000 508 H ALA 64 HN ALA 64 -31.575 -9.605 14.453 509 HA ALA 64 HA ALA 64 -32.594 -7.048 15.118 510 1HB ALA 64 HB1 ALA 64 -33.613 -9.209 13.859 511 2HB ALA 64 HB2 ALA 64 -34.584 -7.870 14.472 512 3HB ALA 64 HB3 ALA 64 -34.406 -9.341 15.428 513 HA PRO 65 HA PRO 65 -33.434 -9.489 19.371 514 1HB PRO 65 HB2 PRO 65 -30.631 -10.390 19.690 515 2HB PRO 65 HB1 PRO 65 -32.133 -11.228 20.087 516 1HG PRO 65 HG2 PRO 65 -30.624 -11.915 17.965 517 2HG PRO 65 HG1 PRO 65 -32.393 -12.050 17.953 518 1HD PRO 65 HD2 PRO 65 -30.621 -10.054 16.674 519 2HD PRO 65 HD1 PRO 65 -32.170 -10.706 16.112 520 H ASN 66 HN ASN 66 -31.205 -9.369 21.298 521 HA ASN 66 HA ASN 66 -30.008 -7.908 22.556 522 1HB ASN 66 HB2 ASN 66 -29.895 -6.636 19.909 523 2HB ASN 66 HB1 ASN 66 -29.752 -5.507 21.251 524 1HD2 ASN 66 HD21 ASN 66 -28.239 -7.949 19.415 525 2HD2 ASN 66 HD22 ASN 66 -26.728 -7.962 20.251 526 H ILE 67 HN ILE 67 -32.208 -5.798 20.698 527 HA ILE 67 HA ILE 67 -33.895 -5.449 23.006 528 HB ILE 67 HB ILE 67 -33.650 -2.953 23.011 529 1HG1 ILE 67 HG12 ILE 67 -31.127 -2.434 22.199 530 2HG1 ILE 67 HG11 ILE 67 -31.569 -3.670 21.025 531 1HG2 ILE 67 HG21 ILE 67 -31.036 -4.199 23.759 532 2HG2 ILE 67 HG22 ILE 67 -32.521 -4.656 24.595 533 3HG2 ILE 67 HG23 ILE 67 -31.978 -2.978 24.615 534 1HD1 ILE 67 HD11 ILE 67 -33.148 -2.353 20.033 535 2HD1 ILE 67 HD12 ILE 67 -31.989 -1.130 20.553 536 3HD1 ILE 67 HD13 ILE 67 -33.451 -1.419 21.498 537 H THR 68 HN THR 68 -35.474 -3.466 22.445 538 HA THR 68 HA THR 68 -36.760 -4.251 19.991 539 HB THR 68 HB THR 68 -38.600 -2.923 20.705 540 HG1 THR 68 HG1 THR 68 -38.396 -1.411 22.382 541 1HG2 THR 68 HG21 THR 68 -38.749 -3.424 23.220 542 2HG2 THR 68 HG22 THR 68 -37.224 -4.277 22.984 543 3HG2 THR 68 HG23 THR 68 -38.661 -4.773 22.090 544 H GLY 69 HN GLY 69 -36.924 -3.123 18.118 545 1HA GLY 69 HA2 GLY 69 -36.836 -0.625 17.364 546 2HA GLY 69 HA1 GLY 69 -35.158 -0.795 17.859 547 H ALA 70 HN ALA 70 -36.630 -0.385 15.205 548 HA ALA 70 HA ALA 70 -35.723 -2.721 13.713 549 1HB ALA 70 HB1 ALA 70 -36.935 -1.861 11.866 550 2HB ALA 70 HB2 ALA 70 -37.056 -0.263 12.602 551 3HB ALA 70 HB3 ALA 70 -37.949 -1.618 13.290 Start of MODEL 5 1 1H MET 1 1H MET 1 38.245 6.307 -8.100 2 2H MET 1 2H MET 1 38.067 7.774 -8.971 3 3H MET 1 3H MET 1 39.029 6.505 -9.611 4 HA MET 1 HA MET 1 37.107 6.361 -10.794 5 1HB MET 1 HB2 MET 1 36.916 4.517 -8.403 6 2HB MET 1 HB1 MET 1 36.033 4.289 -9.907 7 1HG MET 1 HG2 MET 1 37.915 3.695 -11.083 8 2HG MET 1 HG1 MET 1 39.001 4.537 -9.980 9 1HE MET 1 HE1 MET 1 40.382 2.078 -7.840 10 2HE MET 1 HE2 MET 1 40.427 3.594 -8.738 11 3HE MET 1 HE3 MET 1 40.764 2.072 -9.562 12 H ALA 2 HN ALA 2 35.932 6.027 -7.442 13 HA ALA 2 HA ALA 2 33.908 8.074 -7.975 14 1HB ALA 2 HB1 ALA 2 33.358 5.221 -7.255 15 2HB ALA 2 HB2 ALA 2 32.608 6.221 -8.499 16 3HB ALA 2 HB3 ALA 2 32.236 6.502 -6.798 17 H ASP 3 HN ASP 3 33.272 9.231 -6.191 18 HA ASP 3 HA ASP 3 34.570 8.512 -3.644 19 1HB ASP 3 HB2 ASP 3 34.327 11.158 -3.339 20 2HB ASP 3 HB1 ASP 3 35.741 10.423 -4.086 21 H LYS 4 HN LYS 4 32.189 11.006 -4.522 22 HA LYS 4 HA LYS 4 30.544 10.177 -2.270 23 1HB LYS 4 HB2 LYS 4 30.661 12.583 -4.043 24 2HB LYS 4 HB1 LYS 4 29.168 12.235 -3.182 25 1HG LYS 4 HG2 LYS 4 31.474 12.061 -1.442 26 2HG LYS 4 HG1 LYS 4 31.347 13.641 -2.220 27 1HD LYS 4 HD2 LYS 4 28.794 13.326 -1.508 28 2HD LYS 4 HD1 LYS 4 29.547 12.329 -0.261 29 1HE LYS 4 HE2 LYS 4 30.050 15.240 -0.848 30 2HE LYS 4 HE1 LYS 4 29.338 14.544 0.606 31 1HZ LYS 4 HZ1 LYS 4 31.438 13.526 1.139 32 2HZ LYS 4 HZ2 LYS 4 31.667 15.187 0.912 33 3HZ LYS 4 HZ3 LYS 4 32.133 14.098 -0.294 34 H THR 5 HN THR 5 28.033 10.611 -2.877 35 HA THR 5 HA THR 5 27.423 8.506 -4.776 36 HB THR 5 HB THR 5 26.302 8.550 -2.585 37 HG1 THR 5 HG1 THR 5 24.287 8.114 -3.378 38 1HG2 THR 5 HG21 THR 5 25.687 10.515 -1.752 39 2HG2 THR 5 HG22 THR 5 24.280 10.382 -2.808 40 3HG2 THR 5 HG23 THR 5 25.696 11.290 -3.336 41 H ILE 6 HN ILE 6 28.428 10.355 -6.309 42 HA ILE 6 HA ILE 6 26.113 11.724 -7.516 43 HB ILE 6 HB ILE 6 27.705 13.412 -8.399 44 1HG1 ILE 6 HG12 ILE 6 29.707 12.448 -6.382 45 2HG1 ILE 6 HG11 ILE 6 29.688 11.756 -8.001 46 1HG2 ILE 6 HG21 ILE 6 26.367 13.668 -6.272 47 2HG2 ILE 6 HG22 ILE 6 27.783 14.708 -6.425 48 3HG2 ILE 6 HG23 ILE 6 27.847 13.275 -5.399 49 1HD1 ILE 6 HD11 ILE 6 30.722 13.519 -8.856 50 2HD1 ILE 6 HD12 ILE 6 31.024 14.028 -7.195 51 3HD1 ILE 6 HD13 ILE 6 29.620 14.645 -8.065 52 H PHE 7 HN PHE 7 27.858 9.096 -7.933 53 HA PHE 7 HA PHE 7 28.456 7.779 -9.683 54 1HB PHE 7 HB2 PHE 7 26.058 8.961 -10.359 55 2HB PHE 7 HB1 PHE 7 27.063 9.304 -11.762 56 HD1 PHE 7 HD1 PHE 7 27.270 7.716 -13.423 57 HD2 PHE 7 HD2 PHE 7 26.067 6.500 -9.527 58 HE1 PHE 7 HE1 PHE 7 26.876 5.437 -14.261 59 HE2 PHE 7 HE2 PHE 7 25.672 4.217 -10.356 60 HZ PHE 7 HZ PHE 7 26.076 3.685 -12.726 61 H ASN 8 HN ASN 8 30.491 9.272 -9.138 62 HA ASN 8 HA ASN 8 32.422 10.170 -9.937 63 1HB ASN 8 HB2 ASN 8 31.414 9.461 -12.696 64 2HB ASN 8 HB1 ASN 8 33.085 9.640 -12.176 65 1HD2 ASN 8 HD21 ASN 8 32.742 7.432 -13.410 66 2HD2 ASN 8 HD22 ASN 8 32.576 6.068 -12.363 67 H ASP 9 HN ASP 9 33.001 11.601 -12.267 68 HA ASP 9 HA ASP 9 32.258 14.170 -11.645 69 1HB ASP 9 HB2 ASP 9 32.864 13.169 -14.435 70 2HB ASP 9 HB1 ASP 9 33.046 14.820 -13.846 71 H HIS 10 HN HIS 10 30.810 12.134 -14.192 72 HA HIS 10 HA HIS 10 28.809 13.953 -14.941 73 1HB HIS 10 HB2 HIS 10 29.245 11.024 -15.287 74 2HB HIS 10 HB1 HIS 10 27.635 11.659 -15.611 75 HD1 HIS 10 HD1 HIS 10 27.918 11.109 -18.136 76 HD2 HIS 10 HD2 HIS 10 30.659 13.861 -16.657 77 HE1 HIS 10 HE1 HIS 10 28.986 12.149 -20.161 78 HE2 HIS 10 HE2 HIS 10 30.587 13.864 -19.243 79 H LEU 11 HN LEU 11 27.169 14.699 -13.787 80 HA LEU 11 HA LEU 11 25.912 12.917 -11.807 81 1HB LEU 11 HB2 LEU 11 25.606 14.747 -10.305 82 2HB LEU 11 HB1 LEU 11 27.296 14.704 -10.765 83 HG LEU 11 HG LEU 11 25.435 16.511 -12.251 84 1HD1 LEU 11 HD11 LEU 11 26.806 17.407 -9.743 85 2HD1 LEU 11 HD12 LEU 11 25.163 16.765 -9.713 86 3HD1 LEU 11 HD13 LEU 11 25.529 18.207 -10.659 87 1HD2 LEU 11 HD21 LEU 11 28.070 15.947 -12.523 88 2HD2 LEU 11 HD22 LEU 11 28.136 17.343 -11.447 89 3HD2 LEU 11 HD23 LEU 11 27.322 17.470 -13.008 90 H ASN 12 HN ASN 12 23.824 14.626 -11.078 91 HA ASN 12 HA ASN 12 21.773 15.397 -11.708 92 1HB ASN 12 HB2 ASN 12 23.356 16.454 -13.634 93 2HB ASN 12 HB1 ASN 12 22.325 15.418 -14.617 94 1HD2 ASN 12 HD21 ASN 12 19.924 15.588 -13.916 95 2HD2 ASN 12 HD22 ASN 12 19.330 17.202 -13.747 96 H THR 13 HN THR 13 22.884 13.388 -14.444 97 HA THR 13 HA THR 13 20.376 11.919 -14.368 98 HB THR 13 HB THR 13 21.090 12.488 -16.559 99 HG1 THR 13 HG1 THR 13 21.873 9.791 -16.203 100 1HG2 THR 13 HG21 THR 13 23.338 12.993 -16.509 101 2HG2 THR 13 HG22 THR 13 23.303 11.478 -17.411 102 3HG2 THR 13 HG23 THR 13 23.766 11.480 -15.710 103 H ASN 14 HN ASN 14 20.601 10.803 -12.400 104 HA ASN 14 HA ASN 14 22.392 8.482 -12.578 105 1HB ASN 14 HB2 ASN 14 21.862 9.943 -9.988 106 2HB ASN 14 HB1 ASN 14 23.019 8.647 -10.276 107 1HD2 ASN 14 HD21 ASN 14 22.679 11.894 -9.906 108 2HD2 ASN 14 HD22 ASN 14 24.137 12.425 -10.666 109 HA PRO 15 HA PRO 15 17.842 7.437 -11.876 110 1HB PRO 15 HB2 PRO 15 18.685 5.288 -13.748 111 2HB PRO 15 HB1 PRO 15 17.210 6.259 -13.740 112 1HG PRO 15 HG2 PRO 15 19.129 6.717 -15.529 113 2HG PRO 15 HG1 PRO 15 18.230 8.057 -14.793 114 1HD PRO 15 HD2 PRO 15 20.990 7.074 -14.201 115 2HD PRO 15 HD1 PRO 15 20.373 8.737 -14.258 116 H LYS 16 HN LYS 16 20.874 5.695 -11.783 117 HA LYS 16 HA LYS 16 19.839 3.403 -10.423 118 1HB LYS 16 HB2 LYS 16 22.458 4.347 -11.350 119 2HB LYS 16 HB1 LYS 16 22.528 3.421 -9.859 120 1HG LYS 16 HG2 LYS 16 21.444 2.538 -12.520 121 2HG LYS 16 HG1 LYS 16 22.847 1.906 -11.654 122 1HD LYS 16 HD2 LYS 16 20.637 1.695 -9.909 123 2HD LYS 16 HD1 LYS 16 20.103 1.102 -11.482 124 1HE LYS 16 HE2 LYS 16 21.073 -0.652 -10.004 125 2HE LYS 16 HE1 LYS 16 21.884 -0.490 -11.561 126 1HZ LYS 16 HZ1 LYS 16 22.970 1.099 -9.382 127 2HZ LYS 16 HZ2 LYS 16 23.771 0.244 -10.603 128 3HZ LYS 16 HZ3 LYS 16 23.178 -0.576 -9.247 129 H THR 17 HN THR 17 21.241 6.463 -9.445 130 HA THR 17 HA THR 17 21.295 5.640 -6.657 131 HB THR 17 HB THR 17 22.020 8.293 -7.908 132 HG1 THR 17 HG1 THR 17 23.514 6.771 -8.500 133 1HG2 THR 17 HG21 THR 17 23.230 7.707 -5.356 134 2HG2 THR 17 HG22 THR 17 21.470 7.785 -5.235 135 3HG2 THR 17 HG23 THR 17 22.375 9.151 -5.897 136 H ASN 18 HN ASN 18 19.203 7.325 -8.828 137 HA ASN 18 HA ASN 18 17.818 8.688 -6.678 138 1HB ASN 18 HB2 ASN 18 17.784 8.767 -9.621 139 2HB ASN 18 HB1 ASN 18 16.216 9.022 -8.860 140 1HD2 ASN 18 HD21 ASN 18 19.312 10.326 -9.516 141 2HD2 ASN 18 HD22 ASN 18 19.064 11.871 -8.783 142 H LEU 19 HN LEU 19 16.630 6.527 -9.259 143 HA LEU 19 HA LEU 19 14.328 5.823 -7.736 144 1HB LEU 19 HB2 LEU 19 13.842 5.838 -9.961 145 2HB LEU 19 HB1 LEU 19 15.415 5.224 -10.423 146 HG LEU 19 HG LEU 19 13.573 3.371 -8.997 147 1HD1 LEU 19 HD11 LEU 19 13.299 3.900 -11.946 148 2HD1 LEU 19 HD12 LEU 19 12.213 4.581 -10.735 149 3HD1 LEU 19 HD13 LEU 19 12.323 2.833 -10.937 150 1HD2 LEU 19 HD21 LEU 19 15.182 1.961 -9.591 151 2HD2 LEU 19 HD22 LEU 19 16.012 3.239 -10.482 152 3HD2 LEU 19 HD23 LEU 19 14.790 2.253 -11.286 153 H ARG 20 HN ARG 20 17.132 3.981 -8.925 154 HA ARG 20 HA ARG 20 16.359 1.612 -7.708 155 1HB ARG 20 HB2 ARG 20 17.868 1.266 -9.405 156 2HB ARG 20 HB1 ARG 20 18.910 2.579 -8.890 157 1HG ARG 20 HG2 ARG 20 20.011 0.463 -8.545 158 2HG ARG 20 HG1 ARG 20 19.672 1.220 -6.992 159 1HD ARG 20 HD2 ARG 20 18.872 -1.353 -7.978 160 2HD ARG 20 HD1 ARG 20 18.708 -0.679 -6.359 161 HE ARG 20 HE ARG 20 16.502 -0.192 -6.807 162 1HH1 ARG 20 HH11 ARG 20 18.123 -1.084 -9.772 163 2HH1 ARG 20 HH12 ARG 20 16.657 -1.191 -10.686 164 1HH2 ARG 20 HH21 ARG 20 14.576 -0.338 -8.010 165 2HH2 ARG 20 HH22 ARG 20 14.643 -0.765 -9.687 166 H LEU 21 HN LEU 21 18.203 4.286 -6.408 167 HA LEU 21 HA LEU 21 19.055 2.762 -4.115 168 1HB LEU 21 HB2 LEU 21 20.553 4.390 -3.974 169 2HB LEU 21 HB1 LEU 21 19.778 5.216 -5.303 170 HG LEU 21 HG LEU 21 20.110 6.714 -3.430 171 1HD1 LEU 21 HD11 LEU 21 17.655 6.259 -4.730 172 2HD1 LEU 21 HD12 LEU 21 18.270 7.758 -4.032 173 3HD1 LEU 21 HD13 LEU 21 17.288 6.666 -3.052 174 1HD2 LEU 21 HD21 LEU 21 18.175 5.710 -1.579 175 2HD2 LEU 21 HD22 LEU 21 19.877 6.093 -1.322 176 3HD2 LEU 21 HD23 LEU 21 19.409 4.483 -1.874 177 H TRP 22 HN TRP 22 16.335 4.687 -5.025 178 HA TRP 22 HA TRP 22 15.352 4.991 -2.320 179 1HB TRP 22 HB2 TRP 22 14.928 6.573 -4.340 180 2HB TRP 22 HB1 TRP 22 13.707 5.395 -4.807 181 HD1 TRP 22 HD1 TRP 22 14.579 7.454 -1.624 182 HE1 TRP 22 HE1 TRP 22 12.368 8.194 -0.536 183 HE3 TRP 22 HE3 TRP 22 11.299 5.189 -4.829 184 HZ2 TRP 22 HZ2 TRP 22 9.600 7.865 -0.979 185 HZ3 TRP 22 HZ3 TRP 22 8.887 5.452 -4.424 186 HH2 TRP 22 HH2 TRP 22 8.055 6.762 -2.539 187 H VAL 23 HN VAL 23 14.810 2.967 -5.137 188 HA VAL 23 HA VAL 23 12.543 1.576 -4.216 189 HB VAL 23 HB VAL 23 14.693 0.644 -6.124 190 1HG1 VAL 23 HG11 VAL 23 12.202 -0.607 -5.154 191 2HG1 VAL 23 HG12 VAL 23 13.678 -1.346 -5.775 192 3HG1 VAL 23 HG13 VAL 23 12.485 -0.684 -6.892 193 1HG2 VAL 23 HG21 VAL 23 12.094 1.369 -7.224 194 2HG2 VAL 23 HG22 VAL 23 13.713 1.838 -7.740 195 3HG2 VAL 23 HG23 VAL 23 12.912 2.721 -6.439 196 H ALA 24 HN ALA 24 15.991 1.074 -3.778 197 HA ALA 24 HA ALA 24 15.672 -1.450 -2.431 198 1HB ALA 24 HB1 ALA 24 18.025 0.377 -2.859 199 2HB ALA 24 HB2 ALA 24 17.688 -1.171 -3.639 200 3HB ALA 24 HB3 ALA 24 18.129 -1.120 -1.932 201 H PHE 25 HN PHE 25 15.805 1.890 -1.546 202 HA PHE 25 HA PHE 25 16.557 1.633 1.148 203 1HB PHE 25 HB2 PHE 25 16.653 3.837 0.774 204 2HB PHE 25 HB1 PHE 25 15.590 3.714 -0.618 205 HD1 PHE 25 HD1 PHE 25 15.585 3.953 3.084 206 HD2 PHE 25 HD2 PHE 25 13.429 4.559 -0.533 207 HE1 PHE 25 HE1 PHE 25 13.823 5.131 4.337 208 HE2 PHE 25 HE2 PHE 25 11.663 5.737 0.711 209 HZ PHE 25 HZ PHE 25 11.860 6.024 3.150 210 H GLN 26 HN GLN 26 13.428 1.359 -0.440 211 HA GLN 26 HA GLN 26 12.090 1.058 2.135 212 1HB GLN 26 HB2 GLN 26 10.028 0.793 0.707 213 2HB GLN 26 HB1 GLN 26 10.847 2.343 0.560 214 1HG GLN 26 HG2 GLN 26 12.018 0.755 -1.387 215 2HG GLN 26 HG1 GLN 26 10.306 0.336 -1.443 216 1HE2 GLN 26 HE21 GLN 26 11.805 3.422 -0.622 217 2HE2 GLN 26 HE22 GLN 26 11.096 4.319 -1.917 218 H MET 27 HN MET 27 12.883 -0.828 -0.722 219 HA MET 27 HA MET 27 11.550 -3.217 0.070 220 1HB MET 27 HB2 MET 27 12.072 -3.782 -2.042 221 2HB MET 27 HB1 MET 27 12.909 -2.251 -2.186 222 1HG MET 27 HG2 MET 27 14.985 -3.247 -1.545 223 2HG MET 27 HG1 MET 27 14.188 -4.791 -1.232 224 1HE MET 27 HE1 MET 27 13.961 -6.513 -4.514 225 2HE MET 27 HE2 MET 27 12.747 -6.039 -3.327 226 3HE MET 27 HE3 MET 27 14.318 -6.632 -2.791 227 H MET 28 HN MET 28 14.851 -2.084 0.259 228 HA MET 28 HA MET 28 15.664 -4.515 1.603 229 1HB MET 28 HB2 MET 28 16.868 -3.175 -0.278 230 2HB MET 28 HB1 MET 28 17.449 -2.178 1.053 231 1HG MET 28 HG2 MET 28 18.025 -4.637 2.010 232 2HG MET 28 HG1 MET 28 18.198 -4.912 0.277 233 1HE MET 28 HE1 MET 28 20.477 -1.935 2.866 234 2HE MET 28 HE2 MET 28 18.771 -2.374 2.962 235 3HE MET 28 HE3 MET 28 19.309 -1.179 1.781 236 H LYS 29 HN LYS 29 15.428 -1.049 2.306 237 HA LYS 29 HA LYS 29 16.248 -1.583 5.071 238 1HB LYS 29 HB2 LYS 29 17.296 0.328 3.971 239 2HB LYS 29 HB1 LYS 29 15.720 1.026 3.641 240 1HG LYS 29 HG2 LYS 29 15.772 0.591 6.397 241 2HG LYS 29 HG1 LYS 29 17.359 1.245 5.986 242 1HD LYS 29 HD2 LYS 29 15.883 3.074 6.494 243 2HD LYS 29 HD1 LYS 29 16.216 3.083 4.760 244 1HE LYS 29 HE2 LYS 29 14.074 2.641 4.217 245 2HE LYS 29 HE1 LYS 29 13.862 1.519 5.560 246 1HZ LYS 29 HZ1 LYS 29 14.089 4.365 6.188 247 2HZ LYS 29 HZ2 LYS 29 13.175 3.162 6.946 248 3HZ LYS 29 HZ3 LYS 29 12.644 3.832 5.488 249 H GLY 30 HN GLY 30 13.502 -0.645 3.146 250 1HA GLY 30 HA2 GLY 30 11.846 -0.075 5.454 251 2HA GLY 30 HA1 GLY 30 11.348 -0.049 3.768 252 H ALA 31 HN ALA 31 12.900 -2.880 4.011 253 HA ALA 31 HA ALA 31 10.415 -4.352 4.268 254 1HB ALA 31 HB1 ALA 31 13.174 -5.026 3.300 255 2HB ALA 31 HB2 ALA 31 11.637 -5.049 2.421 256 3HB ALA 31 HB3 ALA 31 11.983 -6.292 3.628 257 H GLY 32 HN GLY 32 13.706 -4.733 5.615 258 1HA GLY 32 HA2 GLY 32 12.839 -6.549 7.634 259 2HA GLY 32 HA1 GLY 32 14.416 -5.782 7.537 260 H TRP 33 HN TRP 33 13.407 -3.073 7.579 261 HA TRP 33 HA TRP 33 13.078 -2.829 10.439 262 1HB TRP 33 HB2 TRP 33 14.361 -1.305 8.579 263 2HB TRP 33 HB1 TRP 33 12.872 -0.392 8.787 264 HD1 TRP 33 HD1 TRP 33 13.550 1.586 10.285 265 HE1 TRP 33 HE1 TRP 33 14.721 1.840 12.562 266 HE3 TRP 33 HE3 TRP 33 14.938 -3.278 11.030 267 HZ2 TRP 33 HZ2 TRP 33 16.057 0.195 14.428 268 HZ3 TRP 33 HZ3 TRP 33 16.160 -3.854 13.086 269 HH2 TRP 33 HH2 TRP 33 16.708 -2.152 14.750 270 H ALA 34 HN ALA 34 11.346 -1.182 7.785 271 HA ALA 34 HA ALA 34 9.142 -0.366 9.187 272 1HB ALA 34 HB1 ALA 34 9.888 -0.361 6.536 273 2HB ALA 34 HB2 ALA 34 8.407 0.331 7.202 274 3HB ALA 34 HB3 ALA 34 8.397 -1.303 6.537 275 H GLY 35 HN GLY 35 9.877 -3.589 8.075 276 1HA GLY 35 HA2 GLY 35 7.379 -4.783 8.093 277 2HA GLY 35 HA1 GLY 35 8.868 -5.599 8.549 278 H GLY 36 HN GLY 36 9.641 -4.643 10.847 279 1HA GLY 36 HA2 GLY 36 7.538 -5.469 12.659 280 2HA GLY 36 HA1 GLY 36 9.216 -5.154 13.075 281 H VAL 37 HN VAL 37 9.184 -2.490 11.811 282 HA VAL 37 HA VAL 37 8.241 -1.025 14.073 283 HB VAL 37 HB VAL 37 9.268 0.067 11.452 284 1HG1 VAL 37 HG11 VAL 37 9.140 1.290 14.206 285 2HG1 VAL 37 HG12 VAL 37 8.102 1.701 12.841 286 3HG1 VAL 37 HG13 VAL 37 9.830 2.045 12.770 287 1HG2 VAL 37 HG21 VAL 37 10.682 -1.588 13.073 288 2HG2 VAL 37 HG22 VAL 37 11.072 -0.014 13.770 289 3HG2 VAL 37 HG23 VAL 37 11.397 -0.329 12.066 290 H PHE 38 HN PHE 38 7.469 -0.968 10.609 291 HA PHE 38 HA PHE 38 5.244 0.730 10.966 292 1HB PHE 38 HB2 PHE 38 6.729 -0.202 8.790 293 2HB PHE 38 HB1 PHE 38 5.091 -0.782 8.512 294 HD1 PHE 38 HD1 PHE 38 7.272 1.832 7.907 295 HD2 PHE 38 HD2 PHE 38 3.238 1.093 9.043 296 HE1 PHE 38 HE1 PHE 38 6.636 4.061 7.085 297 HE2 PHE 38 HE2 PHE 38 2.595 3.322 8.221 298 HZ PHE 38 HZ PHE 38 4.294 4.809 7.241 299 H PHE 39 HN PHE 39 5.381 -2.719 10.008 300 HA PHE 39 HA PHE 39 2.598 -3.109 10.208 301 1HB PHE 39 HB2 PHE 39 4.710 -4.614 9.313 302 2HB PHE 39 HB1 PHE 39 4.252 -5.474 10.781 303 HD1 PHE 39 HD1 PHE 39 1.316 -5.025 10.755 304 HD2 PHE 39 HD2 PHE 39 4.008 -6.043 7.621 305 HE1 PHE 39 HE1 PHE 39 -0.522 -6.116 9.535 306 HE2 PHE 39 HE2 PHE 39 2.175 -7.135 6.395 307 HZ PHE 39 HZ PHE 39 -0.094 -7.172 7.352 308 H GLY 40 HN GLY 40 5.214 -3.447 12.556 309 1HA GLY 40 HA2 GLY 40 3.775 -4.723 14.602 310 2HA GLY 40 HA1 GLY 40 5.153 -3.657 14.849 311 H THR 41 HN THR 41 3.851 -1.403 13.533 312 HA THR 41 HA THR 41 2.380 -0.425 15.819 313 HB THR 41 HB THR 41 2.952 0.926 13.188 314 HG1 THR 41 HG1 THR 41 4.697 1.880 14.351 315 1HG2 THR 41 HG21 THR 41 1.205 1.850 14.913 316 2HG2 THR 41 HG22 THR 41 2.335 2.921 14.083 317 3HG2 THR 41 HG23 THR 41 2.660 2.407 15.739 318 H LEU 42 HN LEU 42 1.756 -1.015 12.370 319 HA LEU 42 HA LEU 42 -0.906 -0.171 12.359 320 1HB LEU 42 HB2 LEU 42 0.255 -2.349 10.638 321 2HB LEU 42 HB1 LEU 42 -1.168 -1.379 10.301 322 HG LEU 42 HG LEU 42 1.424 0.041 10.657 323 1HD1 LEU 42 HD11 LEU 42 2.416 -0.692 8.788 324 2HD1 LEU 42 HD12 LEU 42 0.893 -0.802 7.906 325 3HD1 LEU 42 HD13 LEU 42 1.386 -2.110 8.980 326 1HD2 LEU 42 HD21 LEU 42 -0.811 0.449 8.682 327 2HD2 LEU 42 HD22 LEU 42 0.466 1.584 9.120 328 3HD2 LEU 42 HD23 LEU 42 -0.786 1.170 10.291 329 H LEU 43 HN LEU 43 0.516 -3.281 13.159 330 HA LEU 43 HA LEU 43 -1.991 -4.600 13.408 331 1HB LEU 43 HB2 LEU 43 -0.664 -6.388 13.419 332 2HB LEU 43 HB1 LEU 43 0.743 -5.346 13.465 333 HG LEU 43 HG LEU 43 -0.716 -6.269 15.939 334 1HD1 LEU 43 HD11 LEU 43 1.765 -7.420 14.670 335 2HD1 LEU 43 HD12 LEU 43 0.182 -8.195 14.727 336 3HD1 LEU 43 HD13 LEU 43 1.072 -7.896 16.220 337 1HD2 LEU 43 HD21 LEU 43 0.690 -4.969 17.066 338 2HD2 LEU 43 HD22 LEU 43 1.151 -4.256 15.520 339 3HD2 LEU 43 HD23 LEU 43 2.082 -5.600 16.183 340 H LEU 44 HN LEU 44 0.057 -2.621 15.425 341 HA LEU 44 HA LEU 44 -1.203 -3.349 17.884 342 1HB LEU 44 HB2 LEU 44 1.086 -2.096 17.337 343 2HB LEU 44 HB1 LEU 44 0.074 -0.683 17.564 344 HG LEU 44 HG LEU 44 -0.292 -1.147 19.824 345 1HD1 LEU 44 HD11 LEU 44 -1.000 -3.375 19.850 346 2HD1 LEU 44 HD12 LEU 44 0.482 -3.375 20.812 347 3HD1 LEU 44 HD13 LEU 44 0.509 -3.956 19.146 348 1HD2 LEU 44 HD21 LEU 44 2.436 -2.315 19.698 349 2HD2 LEU 44 HD22 LEU 44 1.811 -1.004 20.697 350 3HD2 LEU 44 HD23 LEU 44 2.181 -0.718 18.997 351 H ILE 45 HN ILE 45 -1.584 -0.663 15.617 352 HA ILE 45 HA ILE 45 -3.781 0.453 17.143 353 HB ILE 45 HB ILE 45 -2.262 1.293 14.708 354 1HG1 ILE 45 HG12 ILE 45 -3.016 3.061 16.991 355 2HG1 ILE 45 HG11 ILE 45 -1.800 1.816 17.258 356 1HG2 ILE 45 HG21 ILE 45 -4.265 1.909 13.828 357 2HG2 ILE 45 HG22 ILE 45 -3.949 3.324 14.836 358 3HG2 ILE 45 HG23 ILE 45 -5.039 2.058 15.409 359 1HD1 ILE 45 HD11 ILE 45 -0.541 2.752 15.316 360 2HD1 ILE 45 HD12 ILE 45 -0.676 3.830 16.707 361 3HD1 ILE 45 HD13 ILE 45 -1.698 4.085 15.293 362 H GLY 46 HN GLY 46 -3.326 -0.925 13.897 363 1HA GLY 46 HA2 GLY 46 -6.000 -0.750 13.083 364 2HA GLY 46 HA1 GLY 46 -4.796 -1.840 12.407 365 H PHE 47 HN PHE 47 -4.344 -2.965 15.166 366 HA PHE 47 HA PHE 47 -6.491 -4.884 14.975 367 1HB PHE 47 HB2 PHE 47 -4.013 -5.493 15.240 368 2HB PHE 47 HB1 PHE 47 -4.209 -5.013 16.927 369 HD1 PHE 47 HD1 PHE 47 -4.193 -6.907 18.232 370 HD2 PHE 47 HD2 PHE 47 -6.422 -6.917 14.607 371 HE1 PHE 47 HE1 PHE 47 -5.054 -9.147 18.773 372 HE2 PHE 47 HE2 PHE 47 -7.288 -9.158 15.142 373 HZ PHE 47 HZ PHE 47 -6.605 -10.275 17.227 374 H PHE 48 HN PHE 48 -5.309 -2.389 17.098 375 HA PHE 48 HA PHE 48 -6.988 -3.034 19.316 376 1HB PHE 48 HB2 PHE 48 -5.071 -0.917 18.597 377 2HB PHE 48 HB1 PHE 48 -6.403 -0.367 19.603 378 HD1 PHE 48 HD1 PHE 48 -3.283 -0.769 20.103 379 HD2 PHE 48 HD2 PHE 48 -6.811 -2.872 21.224 380 HE1 PHE 48 HE1 PHE 48 -2.134 -1.630 22.100 381 HE2 PHE 48 HE2 PHE 48 -5.666 -3.737 23.221 382 HZ PHE 48 HZ PHE 48 -3.324 -3.115 23.661 383 H ARG 49 HN ARG 49 -7.234 -1.037 16.463 384 HA ARG 49 HA ARG 49 -9.609 0.295 17.338 385 1HB ARG 49 HB2 ARG 49 -9.567 1.453 15.281 386 2HB ARG 49 HB1 ARG 49 -7.887 1.256 15.755 387 1HG ARG 49 HG2 ARG 49 -7.561 0.518 13.681 388 2HG ARG 49 HG1 ARG 49 -8.336 -0.974 14.221 389 1HD ARG 49 HD2 ARG 49 -9.409 -0.267 12.201 390 2HD ARG 49 HD1 ARG 49 -10.525 -0.006 13.539 391 HE ARG 49 HE ARG 49 -10.281 2.295 13.282 392 1HH1 ARG 49 HH11 ARG 49 -8.198 0.577 11.063 393 2HH1 ARG 49 HH12 ARG 49 -7.896 1.968 10.082 394 1HH2 ARG 49 HH21 ARG 49 -9.879 4.120 11.988 395 2HH2 ARG 49 HH22 ARG 49 -8.847 3.978 10.606 396 H VAL 50 HN VAL 50 -8.873 -2.498 15.340 397 HA VAL 50 HA VAL 50 -11.585 -2.761 14.401 398 HB VAL 50 HB VAL 50 -10.840 -4.904 13.439 399 1HG1 VAL 50 HG11 VAL 50 -9.509 -2.327 12.906 400 2HG1 VAL 50 HG12 VAL 50 -10.459 -3.357 11.838 401 3HG1 VAL 50 HG13 VAL 50 -8.772 -3.749 12.168 402 1HG2 VAL 50 HG21 VAL 50 -8.134 -4.993 13.624 403 2HG2 VAL 50 HG22 VAL 50 -9.234 -5.950 14.615 404 3HG2 VAL 50 HG23 VAL 50 -8.568 -4.442 15.242 405 H VAL 51 HN VAL 51 -9.651 -4.036 17.025 406 HA VAL 51 HA VAL 51 -11.517 -6.116 17.676 407 HB VAL 51 HB VAL 51 -9.271 -4.908 19.306 408 1HG1 VAL 51 HG11 VAL 51 -11.052 -5.894 20.726 409 2HG1 VAL 51 HG12 VAL 51 -9.514 -6.749 20.841 410 3HG1 VAL 51 HG13 VAL 51 -10.830 -7.425 19.880 411 1HG2 VAL 51 HG21 VAL 51 -9.059 -6.451 17.097 412 2HG2 VAL 51 HG22 VAL 51 -9.135 -7.688 18.352 413 3HG2 VAL 51 HG23 VAL 51 -7.886 -6.445 18.414 414 H GLY 52 HN GLY 52 -11.098 -2.764 18.465 415 1HA GLY 52 HA2 GLY 52 -13.202 -2.915 20.502 416 2HA GLY 52 HA1 GLY 52 -12.180 -1.521 20.175 417 H ARG 53 HN ARG 53 -13.344 -3.024 17.360 418 HA ARG 53 HA ARG 53 -15.493 -1.031 17.141 419 1HB ARG 53 HB2 ARG 53 -13.541 -0.446 15.768 420 2HB ARG 53 HB1 ARG 53 -13.662 -1.994 14.943 421 1HG ARG 53 HG2 ARG 53 -14.633 -0.414 13.503 422 2HG ARG 53 HG1 ARG 53 -15.984 -1.282 14.233 423 1HD ARG 53 HD2 ARG 53 -15.918 0.642 15.985 424 2HD ARG 53 HD1 ARG 53 -15.026 1.505 14.734 425 HE ARG 53 HE ARG 53 -16.964 1.700 13.520 426 1HH1 ARG 53 HH11 ARG 53 -17.453 -0.599 16.101 427 2HH1 ARG 53 HH12 ARG 53 -19.166 -0.691 15.862 428 1HH2 ARG 53 HH21 ARG 53 -19.215 1.579 13.204 429 2HH2 ARG 53 HH22 ARG 53 -20.166 0.543 14.216 430 H MET 54 HN MET 54 -14.686 -4.350 16.941 431 HA MET 54 HA MET 54 -17.400 -4.935 16.070 432 1HB MET 54 HB2 MET 54 -14.940 -5.652 14.541 433 2HB MET 54 HB1 MET 54 -16.288 -6.779 14.548 434 1HG MET 54 HG2 MET 54 -17.296 -4.173 14.025 435 2HG MET 54 HG1 MET 54 -15.925 -4.472 12.959 436 1HE MET 54 HE1 MET 54 -17.496 -5.586 10.164 437 2HE MET 54 HE2 MET 54 -16.406 -6.846 10.745 438 3HE MET 54 HE3 MET 54 -16.032 -5.148 11.046 439 H LEU 55 HN LEU 55 -16.436 -5.257 18.628 440 HA LEU 55 HA LEU 55 -16.823 -8.090 18.951 441 1HB LEU 55 HB2 LEU 55 -14.558 -8.407 18.865 442 2HB LEU 55 HB1 LEU 55 -14.190 -6.817 19.487 443 HG LEU 55 HG LEU 55 -15.313 -7.954 21.685 444 1HD1 LEU 55 HD11 LEU 55 -15.646 -10.119 20.824 445 2HD1 LEU 55 HD12 LEU 55 -14.199 -10.223 21.827 446 3HD1 LEU 55 HD13 LEU 55 -14.051 -10.150 20.071 447 1HD2 LEU 55 HD21 LEU 55 -12.696 -8.662 21.986 448 2HD2 LEU 55 HD22 LEU 55 -13.346 -7.044 22.246 449 3HD2 LEU 55 HD23 LEU 55 -12.603 -7.459 20.702 450 HA PRO 56 HA PRO 56 -17.021 -5.947 23.352 451 1HB PRO 56 HB2 PRO 56 -16.818 -3.113 22.538 452 2HB PRO 56 HB1 PRO 56 -16.125 -3.932 23.940 453 1HG PRO 56 HG2 PRO 56 -14.663 -3.148 21.790 454 2HG PRO 56 HG1 PRO 56 -14.229 -4.521 22.820 455 1HD PRO 56 HD2 PRO 56 -15.307 -4.493 20.075 456 2HD PRO 56 HD1 PRO 56 -14.368 -5.734 20.919 457 H ILE 57 HN ILE 57 -18.195 -4.847 20.301 458 HA ILE 57 HA ILE 57 -20.487 -3.499 21.210 459 HB ILE 57 HB ILE 57 -21.002 -3.081 19.058 460 1HG1 ILE 57 HG12 ILE 57 -21.446 -5.710 18.690 461 2HG1 ILE 57 HG11 ILE 57 -21.393 -4.565 17.368 462 1HG2 ILE 57 HG21 ILE 57 -18.577 -2.725 19.367 463 2HG2 ILE 57 HG22 ILE 57 -19.082 -2.934 17.689 464 3HG2 ILE 57 HG23 ILE 57 -18.307 -4.262 18.550 465 1HD1 ILE 57 HD11 ILE 57 -20.124 -6.525 16.797 466 2HD1 ILE 57 HD12 ILE 57 -19.142 -6.358 18.254 467 3HD1 ILE 57 HD13 ILE 57 -19.039 -5.150 16.976 468 H GLN 58 HN GLN 58 -20.159 -6.737 19.797 469 HA GLN 58 HA GLN 58 -22.763 -7.401 20.870 470 1HB GLN 58 HB2 GLN 58 -21.808 -9.702 19.632 471 2HB GLN 58 HB1 GLN 58 -22.962 -8.552 18.983 472 1HG GLN 58 HG2 GLN 58 -21.355 -7.447 17.753 473 2HG GLN 58 HG1 GLN 58 -20.023 -8.165 18.661 474 1HE2 GLN 58 HE21 GLN 58 -21.749 -8.287 15.837 475 2HE2 GLN 58 HE22 GLN 58 -21.312 -9.873 15.312 476 H GLU 59 HN GLU 59 -19.408 -8.273 21.192 477 HA GLU 59 HA GLU 59 -19.635 -10.513 22.835 478 1HB GLU 59 HB2 GLU 59 -17.570 -9.351 21.667 479 2HB GLU 59 HB1 GLU 59 -17.426 -8.526 23.215 480 1HG GLU 59 HG2 GLU 59 -17.770 -11.401 23.496 481 2HG GLU 59 HG1 GLU 59 -16.338 -10.964 22.564 482 H ASN 60 HN ASN 60 -19.960 -7.130 23.369 483 HA ASN 60 HA ASN 60 -20.380 -7.603 26.219 484 1HB ASN 60 HB2 ASN 60 -18.691 -5.775 25.003 485 2HB ASN 60 HB1 ASN 60 -20.095 -4.807 25.444 486 1HD2 ASN 60 HD21 ASN 60 -17.172 -5.544 26.464 487 2HD2 ASN 60 HD22 ASN 60 -17.396 -5.531 28.177 488 H GLN 61 HN GLN 61 -21.815 -6.758 23.266 489 HA GLN 61 HA GLN 61 -23.862 -6.049 22.617 490 1HB GLN 61 HB2 GLN 61 -25.330 -6.609 25.063 491 2HB GLN 61 HB1 GLN 61 -25.471 -7.353 23.478 492 1HG GLN 61 HG2 GLN 61 -23.257 -8.574 24.264 493 2HG GLN 61 HG1 GLN 61 -23.924 -8.212 25.854 494 1HE2 GLN 61 HE21 GLN 61 -25.199 -9.298 22.722 495 2HE2 GLN 61 HE22 GLN 61 -26.108 -10.621 23.358 496 H ALA 62 HN ALA 62 -22.110 -4.226 24.261 497 HA ALA 62 HA ALA 62 -24.090 -2.141 24.632 498 1HB ALA 62 HB1 ALA 62 -24.264 -2.484 26.835 499 2HB ALA 62 HB2 ALA 62 -22.645 -1.790 26.939 500 3HB ALA 62 HB3 ALA 62 -22.853 -3.540 26.873 501 HA PRO 63 HA PRO 63 -20.962 0.649 23.315 502 1HB PRO 63 HB2 PRO 63 -20.909 2.603 25.254 503 2HB PRO 63 HB1 PRO 63 -22.098 2.506 23.956 504 1HG PRO 63 HG2 PRO 63 -22.324 1.602 26.797 505 2HG PRO 63 HG1 PRO 63 -23.523 2.421 25.779 506 1HD PRO 63 HD2 PRO 63 -23.648 -0.215 26.249 507 2HD PRO 63 HD1 PRO 63 -24.103 0.468 24.674 508 H ALA 64 HN ALA 64 -19.143 2.221 24.699 509 HA ALA 64 HA ALA 64 -17.097 0.363 25.254 510 1HB ALA 64 HB1 ALA 64 -17.146 2.960 24.536 511 2HB ALA 64 HB2 ALA 64 -15.717 2.125 25.144 512 3HB ALA 64 HB3 ALA 64 -16.699 3.100 26.236 513 HA PRO 65 HA PRO 65 -18.143 2.022 29.903 514 1HB PRO 65 HB2 PRO 65 -20.855 0.799 29.614 515 2HB PRO 65 HB1 PRO 65 -20.335 2.156 30.623 516 1HG PRO 65 HG2 PRO 65 -21.665 2.570 28.343 517 2HG PRO 65 HG1 PRO 65 -20.352 3.651 28.849 518 1HD PRO 65 HD2 PRO 65 -20.410 1.582 26.745 519 2HD PRO 65 HD1 PRO 65 -19.486 3.091 26.805 520 H ASN 66 HN ASN 66 -16.633 0.440 30.360 521 HA ASN 66 HA ASN 66 -17.570 -1.938 31.549 522 1HB ASN 66 HB2 ASN 66 -16.731 -2.096 28.721 523 2HB ASN 66 HB1 ASN 66 -16.021 -3.308 29.786 524 1HD2 ASN 66 HD21 ASN 66 -18.634 -2.542 27.884 525 2HD2 ASN 66 HD22 ASN 66 -19.755 -3.714 28.476 526 H ILE 67 HN ILE 67 -15.616 -3.460 32.024 527 HA ILE 67 HA ILE 67 -13.606 -1.824 33.253 528 HB ILE 67 HB ILE 67 -14.471 -3.838 34.367 529 1HG1 ILE 67 HG12 ILE 67 -11.534 -4.167 33.729 530 2HG1 ILE 67 HG11 ILE 67 -12.160 -2.930 34.814 531 1HG2 ILE 67 HG21 ILE 67 -13.065 -5.337 32.162 532 2HG2 ILE 67 HG22 ILE 67 -14.806 -5.250 32.423 533 3HG2 ILE 67 HG23 ILE 67 -13.779 -6.064 33.602 534 1HD1 ILE 67 HD11 ILE 67 -11.278 -5.289 35.660 535 2HD1 ILE 67 HD12 ILE 67 -12.966 -5.715 35.371 536 3HD1 ILE 67 HD13 ILE 67 -12.564 -4.401 36.477 537 H THR 68 HN THR 68 -11.510 -1.532 32.682 538 HA THR 68 HA THR 68 -10.627 -2.779 30.161 539 HB THR 68 HB THR 68 -9.067 -0.570 30.329 540 HG1 THR 68 HG1 THR 68 -10.457 1.144 30.956 541 1HG2 THR 68 HG21 THR 68 -10.047 0.001 28.425 542 2HG2 THR 68 HG22 THR 68 -11.629 0.158 29.189 543 3HG2 THR 68 HG23 THR 68 -11.064 -1.423 28.647 544 H GLY 69 HN GLY 69 -8.167 -2.767 29.951 545 1HA GLY 69 HA2 GLY 69 -6.645 -2.849 32.390 546 2HA GLY 69 HA1 GLY 69 -6.994 -4.448 31.751 547 H ALA 70 HN ALA 70 -5.551 -1.323 30.911 548 HA ALA 70 HA ALA 70 -3.623 -2.774 29.228 549 1HB ALA 70 HB1 ALA 70 -5.160 -1.747 27.700 550 2HB ALA 70 HB2 ALA 70 -3.644 -0.848 27.653 551 3HB ALA 70 HB3 ALA 70 -5.027 -0.199 28.534 Start of MODEL 6 1 1H MET 1 1H MET 1 23.066 15.516 -28.116 2 2H MET 1 2H MET 1 22.931 15.977 -26.468 3 3H MET 1 3H MET 1 23.900 16.899 -27.542 4 HA MET 1 HA MET 1 22.009 18.128 -27.323 5 1HB MET 1 HB2 MET 1 22.240 16.447 -29.762 6 2HB MET 1 HB1 MET 1 20.767 17.392 -29.593 7 1HG MET 1 HG2 MET 1 21.807 19.330 -29.998 8 2HG MET 1 HG1 MET 1 23.228 18.881 -29.058 9 1HE MET 1 HE1 MET 1 24.460 20.369 -31.088 10 2HE MET 1 HE2 MET 1 25.485 19.255 -31.994 11 3HE MET 1 HE3 MET 1 25.360 19.110 -30.241 12 H ALA 2 HN ALA 2 21.215 14.712 -27.766 13 HA ALA 2 HA ALA 2 18.734 15.166 -26.261 14 1HB ALA 2 HB1 ALA 2 18.038 15.041 -28.554 15 2HB ALA 2 HB2 ALA 2 17.574 13.545 -27.744 16 3HB ALA 2 HB3 ALA 2 18.981 13.573 -28.806 17 H ASP 3 HN ASP 3 18.006 13.394 -25.028 18 HA ASP 3 HA ASP 3 18.136 11.449 -23.843 19 1HB ASP 3 HB2 ASP 3 20.503 10.607 -25.512 20 2HB ASP 3 HB1 ASP 3 19.367 9.585 -24.639 21 H LYS 4 HN LYS 4 21.487 12.298 -24.737 22 HA LYS 4 HA LYS 4 22.370 11.904 -22.019 23 1HB LYS 4 HB2 LYS 4 24.582 12.477 -22.864 24 2HB LYS 4 HB1 LYS 4 23.814 11.302 -23.922 25 1HG LYS 4 HG2 LYS 4 23.083 13.394 -25.278 26 2HG LYS 4 HG1 LYS 4 24.394 14.189 -24.404 27 1HD LYS 4 HD2 LYS 4 25.503 11.795 -25.270 28 2HD LYS 4 HD1 LYS 4 24.504 12.325 -26.625 29 1HE LYS 4 HE2 LYS 4 25.643 14.636 -26.171 30 2HE LYS 4 HE1 LYS 4 26.866 13.652 -25.370 31 1HZ LYS 4 HZ1 LYS 4 26.949 14.217 -27.944 32 2HZ LYS 4 HZ2 LYS 4 26.033 12.798 -28.026 33 3HZ LYS 4 HZ3 LYS 4 27.565 12.773 -27.312 34 H THR 5 HN THR 5 22.993 13.455 -20.564 35 HA THR 5 HA THR 5 23.152 15.483 -19.546 36 HB THR 5 HB THR 5 23.876 17.318 -20.731 37 HG1 THR 5 HG1 THR 5 22.066 16.509 -22.734 38 1HG2 THR 5 HG21 THR 5 24.889 14.975 -21.662 39 2HG2 THR 5 HG22 THR 5 25.494 16.580 -22.070 40 3HG2 THR 5 HG23 THR 5 24.363 15.764 -23.150 41 H ILE 6 HN ILE 6 20.502 14.242 -20.758 42 HA ILE 6 HA ILE 6 18.787 16.145 -19.472 43 HB ILE 6 HB ILE 6 19.020 17.216 -21.673 44 1HG1 ILE 6 HG12 ILE 6 16.258 16.139 -21.801 45 2HG1 ILE 6 HG11 ILE 6 16.745 16.861 -20.271 46 1HG2 ILE 6 HG21 ILE 6 17.566 14.960 -22.967 47 2HG2 ILE 6 HG22 ILE 6 19.317 14.863 -22.777 48 3HG2 ILE 6 HG23 ILE 6 18.599 16.194 -23.685 49 1HD1 ILE 6 HD11 ILE 6 17.593 18.673 -22.190 50 2HD1 ILE 6 HD12 ILE 6 16.182 18.815 -21.142 51 3HD1 ILE 6 HD13 ILE 6 16.015 18.122 -22.756 52 H PHE 7 HN PHE 7 16.744 15.305 -19.000 53 HA PHE 7 HA PHE 7 16.560 12.536 -18.707 54 1HB PHE 7 HB2 PHE 7 14.388 14.639 -18.667 55 2HB PHE 7 HB1 PHE 7 14.147 12.964 -18.176 56 HD1 PHE 7 HD1 PHE 7 15.606 12.077 -16.273 57 HD2 PHE 7 HD2 PHE 7 15.158 16.217 -17.148 58 HE1 PHE 7 HE1 PHE 7 16.360 12.634 -13.999 59 HE2 PHE 7 HE2 PHE 7 15.914 16.783 -14.876 60 HZ PHE 7 HZ PHE 7 16.515 14.991 -13.298 61 H ASN 8 HN ASN 8 14.096 14.288 -20.563 62 HA ASN 8 HA ASN 8 14.521 13.243 -23.075 63 1HB ASN 8 HB2 ASN 8 13.525 11.241 -21.241 64 2HB ASN 8 HB1 ASN 8 12.369 11.514 -22.541 65 1HD2 ASN 8 HD21 ASN 8 13.927 12.040 -24.668 66 2HD2 ASN 8 HD22 ASN 8 14.924 10.681 -25.046 67 H ASP 9 HN ASP 9 12.847 13.722 -24.546 68 HA ASP 9 HA ASP 9 11.217 15.906 -23.808 69 1HB ASP 9 HB2 ASP 9 11.651 14.286 -26.254 70 2HB ASP 9 HB1 ASP 9 10.125 15.160 -26.157 71 H HIS 10 HN HIS 10 8.807 15.938 -24.325 72 HA HIS 10 HA HIS 10 7.498 14.116 -22.588 73 1HB HIS 10 HB2 HIS 10 5.396 15.224 -23.536 74 2HB HIS 10 HB1 HIS 10 6.547 16.271 -22.713 75 HD1 HIS 10 HD1 HIS 10 6.598 15.090 -26.327 76 HD2 HIS 10 HD2 HIS 10 6.342 18.590 -24.103 77 HE1 HIS 10 HE1 HIS 10 6.666 16.961 -28.007 78 HE2 HIS 10 HE2 HIS 10 6.393 19.062 -26.645 79 H LEU 11 HN LEU 11 8.328 12.164 -23.747 80 HA LEU 11 HA LEU 11 6.497 11.404 -25.928 81 1HB LEU 11 HB2 LEU 11 9.379 10.740 -25.440 82 2HB LEU 11 HB1 LEU 11 8.372 9.656 -26.381 83 HG LEU 11 HG LEU 11 8.462 12.543 -27.137 84 1HD1 LEU 11 HD11 LEU 11 10.533 12.511 -28.021 85 2HD1 LEU 11 HD12 LEU 11 10.447 10.799 -28.435 86 3HD1 LEU 11 HD13 LEU 11 10.822 11.289 -26.783 87 1HD2 LEU 11 HD21 LEU 11 8.384 10.072 -28.850 88 2HD2 LEU 11 HD22 LEU 11 7.959 11.724 -29.297 89 3HD2 LEU 11 HD23 LEU 11 6.935 10.821 -28.179 90 H ASN 12 HN ASN 12 5.105 10.914 -23.986 91 HA ASN 12 HA ASN 12 4.048 9.382 -22.682 92 1HB ASN 12 HB2 ASN 12 4.321 7.973 -24.732 93 2HB ASN 12 HB1 ASN 12 5.817 7.345 -24.049 94 1HD2 ASN 12 HD21 ASN 12 3.441 5.891 -24.768 95 2HD2 ASN 12 HD22 ASN 12 2.870 5.125 -23.330 96 H THR 13 HN THR 13 4.496 9.584 -20.596 97 HA THR 13 HA THR 13 5.407 9.178 -18.554 98 HB THR 13 HB THR 13 6.025 6.902 -19.947 99 HG1 THR 13 HG1 THR 13 6.842 7.424 -17.288 100 1HG2 THR 13 HG21 THR 13 8.593 7.489 -18.555 101 2HG2 THR 13 HG22 THR 13 8.388 7.965 -20.240 102 3HG2 THR 13 HG23 THR 13 8.222 6.272 -19.778 103 H ASN 14 HN ASN 14 7.719 9.196 -17.438 104 HA ASN 14 HA ASN 14 9.926 10.397 -18.541 105 1HB ASN 14 HB2 ASN 14 8.713 12.334 -19.186 106 2HB ASN 14 HB1 ASN 14 7.875 12.421 -17.644 107 1HD2 ASN 14 HD21 ASN 14 11.308 11.810 -18.035 108 2HD2 ASN 14 HD22 ASN 14 11.843 13.293 -17.328 109 HA PRO 15 HA PRO 15 9.786 11.146 -13.689 110 1HB PRO 15 HB2 PRO 15 7.441 9.467 -13.019 111 2HB PRO 15 HB1 PRO 15 7.932 11.028 -12.358 112 1HG PRO 15 HG2 PRO 15 5.848 10.837 -14.011 113 2HG PRO 15 HG1 PRO 15 6.958 12.218 -14.093 114 1HD PRO 15 HD2 PRO 15 6.803 9.801 -15.855 115 2HD PRO 15 HD1 PRO 15 7.074 11.499 -16.295 116 H LYS 16 HN LYS 16 9.286 8.358 -15.581 117 HA LYS 16 HA LYS 16 9.727 6.214 -13.927 118 1HB LYS 16 HB2 LYS 16 9.360 6.248 -16.453 119 2HB LYS 16 HB1 LYS 16 11.089 6.530 -16.600 120 1HG LYS 16 HG2 LYS 16 10.415 4.162 -16.889 121 2HG LYS 16 HG1 LYS 16 11.589 4.422 -15.598 122 1HD LYS 16 HD2 LYS 16 9.828 2.848 -14.931 123 2HD LYS 16 HD1 LYS 16 9.816 4.305 -13.938 124 1HE LYS 16 HE2 LYS 16 7.718 4.751 -14.518 125 2HE LYS 16 HE1 LYS 16 8.127 4.663 -16.232 126 1HZ LYS 16 HZ1 LYS 16 7.572 2.440 -16.336 127 2HZ LYS 16 HZ2 LYS 16 6.401 3.035 -15.269 128 3HZ LYS 16 HZ3 LYS 16 7.741 2.193 -14.670 129 H THR 17 HN THR 17 11.970 8.702 -14.863 130 HA THR 17 HA THR 17 14.222 7.185 -13.834 131 HB THR 17 HB THR 17 14.188 9.986 -14.948 132 HG1 THR 17 HG1 THR 17 15.022 8.925 -16.823 133 1HG2 THR 17 HG21 THR 17 16.630 8.587 -15.317 134 2HG2 THR 17 HG22 THR 17 16.195 8.544 -13.605 135 3HG2 THR 17 HG23 THR 17 16.331 10.092 -14.448 136 H ASN 18 HN ASN 18 12.035 9.635 -12.759 137 HA ASN 18 HA ASN 18 13.809 10.357 -10.542 138 1HB ASN 18 HB2 ASN 18 11.552 11.655 -11.918 139 2HB ASN 18 HB1 ASN 18 11.669 11.940 -10.185 140 1HD2 ASN 18 HD21 ASN 18 13.342 12.242 -13.247 141 2HD2 ASN 18 HD22 ASN 18 14.431 13.489 -12.746 142 H LEU 19 HN LEU 19 10.343 9.585 -10.939 143 HA LEU 19 HA LEU 19 10.010 9.124 -8.152 144 1HB LEU 19 HB2 LEU 19 7.853 9.334 -8.642 145 2HB LEU 19 HB1 LEU 19 8.334 9.630 -10.299 146 HG LEU 19 HG LEU 19 7.799 6.840 -9.304 147 1HD1 LEU 19 HD11 LEU 19 5.540 7.370 -10.587 148 2HD1 LEU 19 HD12 LEU 19 5.872 8.989 -9.973 149 3HD1 LEU 19 HD13 LEU 19 5.722 7.635 -8.853 150 1HD2 LEU 19 HD21 LEU 19 7.032 6.991 -11.906 151 2HD2 LEU 19 HD22 LEU 19 8.626 6.474 -11.361 152 3HD2 LEU 19 HD23 LEU 19 8.368 8.142 -11.872 153 H ARG 20 HN ARG 20 10.686 7.103 -10.914 154 HA ARG 20 HA ARG 20 9.963 4.668 -9.755 155 1HB ARG 20 HB2 ARG 20 10.772 5.396 -12.216 156 2HB ARG 20 HB1 ARG 20 12.222 4.586 -11.639 157 1HG ARG 20 HG2 ARG 20 9.472 3.466 -12.035 158 2HG ARG 20 HG1 ARG 20 10.999 2.923 -12.728 159 1HD ARG 20 HD2 ARG 20 10.696 1.328 -11.121 160 2HD ARG 20 HD1 ARG 20 11.618 2.517 -10.206 161 HE ARG 20 HE ARG 20 9.803 2.778 -8.843 162 1HH1 ARG 20 HH11 ARG 20 8.714 1.479 -11.899 163 2HH1 ARG 20 HH12 ARG 20 7.074 1.288 -11.375 164 1HH2 ARG 20 HH21 ARG 20 7.645 2.524 -8.159 165 2HH2 ARG 20 HH22 ARG 20 6.467 1.885 -9.255 166 H LEU 21 HN LEU 21 13.074 6.448 -9.605 167 HA LEU 21 HA LEU 21 14.262 4.189 -8.213 168 1HB LEU 21 HB2 LEU 21 15.843 6.463 -7.655 169 2HB LEU 21 HB1 LEU 21 16.204 5.119 -8.714 170 HG LEU 21 HG LEU 21 16.537 7.150 -9.908 171 1HD1 LEU 21 HD11 LEU 21 14.127 6.710 -11.338 172 2HD1 LEU 21 HD12 LEU 21 14.692 5.159 -10.721 173 3HD1 LEU 21 HD13 LEU 21 15.754 6.154 -11.718 174 1HD2 LEU 21 HD21 LEU 21 13.901 8.212 -10.063 175 2HD2 LEU 21 HD22 LEU 21 15.376 8.981 -9.484 176 3HD2 LEU 21 HD23 LEU 21 14.361 8.064 -8.367 177 H TRP 22 HN TRP 22 12.426 6.960 -7.375 178 HA TRP 22 HA TRP 22 13.214 6.996 -4.608 179 1HB TRP 22 HB2 TRP 22 12.072 8.877 -6.111 180 2HB TRP 22 HB1 TRP 22 10.597 8.128 -5.509 181 HD1 TRP 22 HD1 TRP 22 13.831 9.737 -4.097 182 HE1 TRP 22 HE1 TRP 22 13.247 10.845 -1.849 183 HE3 TRP 22 HE3 TRP 22 8.941 8.290 -3.718 184 HZ2 TRP 22 HZ2 TRP 22 11.014 11.076 -0.141 185 HZ3 TRP 22 HZ3 TRP 22 7.652 8.996 -1.744 186 HH2 TRP 22 HH2 TRP 22 8.670 10.359 0.007 187 H VAL 23 HN VAL 23 10.292 6.054 -6.394 188 HA VAL 23 HA VAL 23 8.922 4.820 -4.298 189 HB VAL 23 HB VAL 23 8.804 4.043 -7.213 190 1HG1 VAL 23 HG11 VAL 23 7.126 3.437 -4.826 191 2HG1 VAL 23 HG12 VAL 23 7.606 2.391 -6.162 192 3HG1 VAL 23 HG13 VAL 23 6.345 3.602 -6.398 193 1HG2 VAL 23 HG21 VAL 23 8.371 6.538 -6.333 194 2HG2 VAL 23 HG22 VAL 23 6.777 5.844 -6.033 195 3HG2 VAL 23 HG23 VAL 23 7.461 5.815 -7.658 196 H ALA 24 HN ALA 24 11.530 3.735 -6.306 197 HA ALA 24 HA ALA 24 11.300 0.960 -5.633 198 1HB ALA 24 HB1 ALA 24 13.276 2.623 -7.131 199 2HB ALA 24 HB2 ALA 24 12.302 1.261 -7.689 200 3HB ALA 24 HB3 ALA 24 13.695 0.979 -6.645 201 H PHE 25 HN PHE 25 12.872 3.744 -4.307 202 HA PHE 25 HA PHE 25 14.837 2.392 -2.769 203 1HB PHE 25 HB2 PHE 25 15.571 4.489 -2.598 204 2HB PHE 25 HB1 PHE 25 14.097 5.054 -3.365 205 HD1 PHE 25 HD1 PHE 25 12.891 6.650 -2.271 206 HD2 PHE 25 HD2 PHE 25 15.251 3.952 0.023 207 HE1 PHE 25 HE1 PHE 25 12.269 7.852 -0.217 208 HE2 PHE 25 HE2 PHE 25 14.632 5.148 2.078 209 HZ PHE 25 HZ PHE 25 13.138 7.101 1.961 210 H GLN 26 HN GLN 26 11.502 3.224 -2.197 211 HA GLN 26 HA GLN 26 11.697 2.561 0.635 212 1HB GLN 26 HB2 GLN 26 9.233 3.108 0.622 213 2HB GLN 26 HB1 GLN 26 10.313 4.432 0.201 214 1HG GLN 26 HG2 GLN 26 9.674 3.096 -2.188 215 2HG GLN 26 HG1 GLN 26 8.168 3.314 -1.296 216 1HE2 GLN 26 HE21 GLN 26 11.044 5.351 -1.330 217 2HE2 GLN 26 HE22 GLN 26 10.265 6.759 -1.962 218 H MET 27 HN MET 27 10.279 1.265 -2.317 219 HA MET 27 HA MET 27 8.756 -0.788 -1.084 220 1HB MET 27 HB2 MET 27 9.036 -1.937 -3.367 221 2HB MET 27 HB1 MET 27 8.177 -0.403 -3.322 222 1HG MET 27 HG2 MET 27 9.535 0.280 -4.928 223 2HG MET 27 HG1 MET 27 10.837 0.275 -3.743 224 1HE MET 27 HE1 MET 27 9.909 -1.588 -7.310 225 2HE MET 27 HE2 MET 27 8.710 -1.700 -6.022 226 3HE MET 27 HE3 MET 27 9.636 -3.125 -6.491 227 H MET 28 HN MET 28 12.044 -0.623 -2.206 228 HA MET 28 HA MET 28 12.471 -3.419 -1.568 229 1HB MET 28 HB2 MET 28 13.307 -2.436 -3.660 230 2HB MET 28 HB1 MET 28 14.339 -1.355 -2.732 231 1HG MET 28 HG2 MET 28 15.472 -3.360 -1.779 232 2HG MET 28 HG1 MET 28 14.523 -4.356 -2.881 233 1HE MET 28 HE1 MET 28 17.173 -1.616 -2.462 234 2HE MET 28 HE2 MET 28 16.198 -0.768 -3.663 235 3HE MET 28 HE3 MET 28 17.805 -1.360 -4.089 236 H LYS 29 HN LYS 29 13.568 -0.239 -0.502 237 HA LYS 29 HA LYS 29 15.111 -1.499 1.652 238 1HB LYS 29 HB2 LYS 29 14.906 1.468 1.249 239 2HB LYS 29 HB1 LYS 29 16.214 0.538 1.963 240 1HG LYS 29 HG2 LYS 29 16.630 -0.420 -0.332 241 2HG LYS 29 HG1 LYS 29 15.512 0.799 -0.945 242 1HD LYS 29 HD2 LYS 29 17.475 1.970 0.826 243 2HD LYS 29 HD1 LYS 29 18.247 1.099 -0.499 244 1HE LYS 29 HE2 LYS 29 15.966 2.784 -1.270 245 2HE LYS 29 HE1 LYS 29 17.362 3.660 -0.648 246 1HZ LYS 29 HZ1 LYS 29 18.708 2.884 -2.349 247 2HZ LYS 29 HZ2 LYS 29 17.243 3.175 -3.143 248 3HZ LYS 29 HZ3 LYS 29 17.682 1.594 -2.731 249 H GLY 30 HN GLY 30 12.468 0.769 1.139 250 1HA GLY 30 HA2 GLY 30 11.897 1.165 3.898 251 2HA GLY 30 HA1 GLY 30 10.850 1.568 2.544 252 H ALA 31 HN ALA 31 11.333 -1.444 1.791 253 HA ALA 31 HA ALA 31 8.877 -2.351 2.960 254 1HB ALA 31 HB1 ALA 31 9.106 -3.078 0.789 255 2HB ALA 31 HB2 ALA 31 9.598 -4.510 1.698 256 3HB ALA 31 HB3 ALA 31 10.823 -3.458 0.979 257 H GLY 32 HN GLY 32 12.295 -3.311 3.228 258 1HA GLY 32 HA2 GLY 32 11.789 -5.419 5.080 259 2HA GLY 32 HA1 GLY 32 13.354 -4.699 4.736 260 H TRP 33 HN TRP 33 12.574 -2.014 5.442 261 HA TRP 33 HA TRP 33 13.102 -2.137 8.234 262 1HB TRP 33 HB2 TRP 33 13.982 -0.328 6.836 263 2HB TRP 33 HB1 TRP 33 12.345 0.221 6.493 264 HD1 TRP 33 HD1 TRP 33 11.970 2.403 7.771 265 HE1 TRP 33 HE1 TRP 33 12.458 3.257 10.148 266 HE3 TRP 33 HE3 TRP 33 14.494 -1.654 9.593 267 HZ2 TRP 33 HZ2 TRP 33 13.742 2.336 12.488 268 HZ3 TRP 33 HZ3 TRP 33 15.318 -1.586 11.910 269 HH2 TRP 33 HH2 TRP 33 14.950 0.369 13.326 270 H ALA 34 HN ALA 34 10.444 -0.359 6.653 271 HA ALA 34 HA ALA 34 8.828 -0.001 8.825 272 1HB ALA 34 HB1 ALA 34 8.369 -0.143 5.923 273 2HB ALA 34 HB2 ALA 34 7.880 1.081 7.093 274 3HB ALA 34 HB3 ALA 34 6.941 -0.405 6.924 275 H GLY 35 HN GLY 35 8.457 -2.730 6.532 276 1HA GLY 35 HA2 GLY 35 6.518 -4.242 7.408 277 2HA GLY 35 HA1 GLY 35 8.095 -4.980 7.178 278 H GLY 36 HN GLY 36 9.556 -4.111 9.267 279 1HA GLY 36 HA2 GLY 36 8.426 -5.613 11.447 280 2HA GLY 36 HA1 GLY 36 10.015 -4.864 11.403 281 H VAL 37 HN VAL 37 9.411 -2.196 11.037 282 HA VAL 37 HA VAL 37 8.539 -1.473 13.656 283 HB VAL 37 HB VAL 37 9.119 0.360 11.331 284 1HG1 VAL 37 HG11 VAL 37 9.857 1.738 13.501 285 2HG1 VAL 37 HG12 VAL 37 8.582 0.749 14.214 286 3HG1 VAL 37 HG13 VAL 37 8.222 1.795 12.839 287 1HG2 VAL 37 HG21 VAL 37 11.176 0.003 13.393 288 2HG2 VAL 37 HG22 VAL 37 11.333 0.138 11.641 289 3HG2 VAL 37 HG23 VAL 37 10.905 -1.408 12.371 290 H PHE 38 HN PHE 38 7.399 -0.687 10.408 291 HA PHE 38 HA PHE 38 5.131 0.688 11.103 292 1HB PHE 38 HB2 PHE 38 6.322 0.057 8.764 293 2HB PHE 38 HB1 PHE 38 4.908 -0.987 8.685 294 HD1 PHE 38 HD1 PHE 38 5.789 2.546 9.502 295 HD2 PHE 38 HD2 PHE 38 3.000 -0.140 7.734 296 HE1 PHE 38 HE1 PHE 38 4.431 4.455 8.751 297 HE2 PHE 38 HE2 PHE 38 1.636 1.764 6.980 298 HZ PHE 38 HZ PHE 38 2.353 4.067 7.489 299 H PHE 39 HN PHE 39 5.268 -2.758 10.120 300 HA PHE 39 HA PHE 39 2.596 -3.347 10.573 301 1HB PHE 39 HB2 PHE 39 4.363 -4.816 9.488 302 2HB PHE 39 HB1 PHE 39 4.857 -5.274 11.112 303 HD1 PHE 39 HD1 PHE 39 4.334 -7.541 9.861 304 HD2 PHE 39 HD2 PHE 39 1.392 -4.760 11.182 305 HE1 PHE 39 HE1 PHE 39 2.648 -9.332 9.875 306 HE2 PHE 39 HE2 PHE 39 -0.295 -6.547 11.198 307 HZ PHE 39 HZ PHE 39 0.331 -8.836 10.544 308 H GLY 40 HN GLY 40 5.304 -3.445 12.878 309 1HA GLY 40 HA2 GLY 40 3.969 -4.565 15.052 310 2HA GLY 40 HA1 GLY 40 5.288 -3.407 15.182 311 H THR 41 HN THR 41 3.830 -1.341 13.730 312 HA THR 41 HA THR 41 2.328 -0.296 15.970 313 HB THR 41 HB THR 41 2.758 0.979 13.285 314 HG1 THR 41 HG1 THR 41 4.431 0.983 15.569 315 1HG2 THR 41 HG21 THR 41 1.110 1.965 14.959 316 2HG2 THR 41 HG22 THR 41 2.341 3.032 14.285 317 3HG2 THR 41 HG23 THR 41 2.533 2.380 15.913 318 H LEU 42 HN LEU 42 1.726 -1.028 12.535 319 HA LEU 42 HA LEU 42 -0.964 -0.308 12.511 320 1HB LEU 42 HB2 LEU 42 0.232 -2.534 10.885 321 2HB LEU 42 HB1 LEU 42 -1.200 -1.592 10.509 322 HG LEU 42 HG LEU 42 1.554 -0.378 10.674 323 1HD1 LEU 42 HD11 LEU 42 1.042 -0.381 8.052 324 2HD1 LEU 42 HD12 LEU 42 0.237 -1.885 8.501 325 3HD1 LEU 42 HD13 LEU 42 1.950 -1.662 8.856 326 1HD2 LEU 42 HD21 LEU 42 0.136 1.165 8.999 327 2HD2 LEU 42 HD22 LEU 42 0.209 1.436 10.740 328 3HD2 LEU 42 HD23 LEU 42 -1.164 0.580 10.038 329 H LEU 43 HN LEU 43 0.580 -3.296 13.482 330 HA LEU 43 HA LEU 43 -1.863 -4.724 13.782 331 1HB LEU 43 HB2 LEU 43 -0.462 -6.444 13.918 332 2HB LEU 43 HB1 LEU 43 0.893 -5.336 13.889 333 HG LEU 43 HG LEU 43 -0.511 -6.146 16.434 334 1HD1 LEU 43 HD11 LEU 43 1.726 -7.488 16.660 335 2HD1 LEU 43 HD12 LEU 43 1.674 -7.467 14.897 336 3HD1 LEU 43 HD13 LEU 43 0.345 -8.183 15.809 337 1HD2 LEU 43 HD21 LEU 43 2.263 -5.391 16.612 338 2HD2 LEU 43 HD22 LEU 43 0.857 -4.718 17.439 339 3HD2 LEU 43 HD23 LEU 43 1.308 -4.124 15.842 340 H LEU 44 HN LEU 44 0.114 -2.609 15.771 341 HA LEU 44 HA LEU 44 -1.217 -3.266 18.215 342 1HB LEU 44 HB2 LEU 44 1.062 -1.940 17.627 343 2HB LEU 44 HB1 LEU 44 -0.007 -0.583 17.904 344 HG LEU 44 HG LEU 44 0.211 -0.778 20.110 345 1HD1 LEU 44 HD11 LEU 44 -0.301 -3.742 19.919 346 2HD1 LEU 44 HD12 LEU 44 -1.546 -2.503 20.086 347 3HD1 LEU 44 HD13 LEU 44 -0.367 -2.748 21.375 348 1HD2 LEU 44 HD21 LEU 44 2.433 -1.190 20.062 349 2HD2 LEU 44 HD22 LEU 44 2.257 -2.653 19.093 350 3HD2 LEU 44 HD23 LEU 44 1.920 -2.696 20.824 351 H ILE 45 HN ILE 45 -1.540 -0.642 15.867 352 HA ILE 45 HA ILE 45 -3.795 0.504 17.269 353 HB ILE 45 HB ILE 45 -2.204 1.273 14.851 354 1HG1 ILE 45 HG12 ILE 45 -2.953 3.048 17.144 355 2HG1 ILE 45 HG11 ILE 45 -1.702 1.827 17.362 356 1HG2 ILE 45 HG21 ILE 45 -3.865 3.341 14.954 357 2HG2 ILE 45 HG22 ILE 45 -4.978 2.083 15.497 358 3HG2 ILE 45 HG23 ILE 45 -4.168 1.933 13.933 359 1HD1 ILE 45 HD11 ILE 45 -1.690 4.276 15.681 360 2HD1 ILE 45 HD12 ILE 45 -0.722 2.890 15.181 361 3HD1 ILE 45 HD13 ILE 45 -0.448 3.635 16.757 362 H GLY 46 HN GLY 46 -3.227 -0.979 14.082 363 1HA GLY 46 HA2 GLY 46 -5.862 -0.779 13.153 364 2HA GLY 46 HA1 GLY 46 -4.652 -1.908 12.560 365 H PHE 47 HN PHE 47 -4.274 -3.053 15.246 366 HA PHE 47 HA PHE 47 -6.451 -4.911 15.067 367 1HB PHE 47 HB2 PHE 47 -3.932 -5.448 15.461 368 2HB PHE 47 HB1 PHE 47 -4.301 -5.083 17.145 369 HD1 PHE 47 HD1 PHE 47 -3.271 -7.642 16.701 370 HD2 PHE 47 HD2 PHE 47 -7.283 -6.335 16.135 371 HE1 PHE 47 HE1 PHE 47 -4.064 -9.949 17.009 372 HE2 PHE 47 HE2 PHE 47 -8.081 -8.639 16.444 373 HZ PHE 47 HZ PHE 47 -6.472 -10.451 16.882 374 H PHE 48 HN PHE 48 -5.322 -2.388 17.200 375 HA PHE 48 HA PHE 48 -7.075 -2.997 19.373 376 1HB PHE 48 HB2 PHE 48 -4.880 -1.468 19.173 377 2HB PHE 48 HB1 PHE 48 -6.093 -0.215 18.953 378 HD1 PHE 48 HD1 PHE 48 -8.167 -0.669 20.750 379 HD2 PHE 48 HD2 PHE 48 -4.040 -1.562 21.283 380 HE1 PHE 48 HE1 PHE 48 -8.462 -0.547 23.190 381 HE2 PHE 48 HE2 PHE 48 -4.327 -1.443 23.725 382 HZ PHE 48 HZ PHE 48 -6.540 -0.935 24.680 383 H ARG 49 HN ARG 49 -7.197 -0.955 16.528 384 HA ARG 49 HA ARG 49 -9.600 0.365 17.296 385 1HB ARG 49 HB2 ARG 49 -9.470 1.521 15.269 386 2HB ARG 49 HB1 ARG 49 -7.793 1.216 15.688 387 1HG ARG 49 HG2 ARG 49 -7.695 0.593 13.524 388 2HG ARG 49 HG1 ARG 49 -8.238 -0.948 14.192 389 1HD ARG 49 HD2 ARG 49 -9.544 -0.340 12.227 390 2HD ARG 49 HD1 ARG 49 -10.554 -0.361 13.668 391 HE ARG 49 HE ARG 49 -9.718 1.992 12.149 392 1HH1 ARG 49 HH11 ARG 49 -11.487 0.670 14.857 393 2HH1 ARG 49 HH12 ARG 49 -12.424 2.104 15.101 394 1HH2 ARG 49 HH21 ARG 49 -10.947 3.874 12.475 395 2HH2 ARG 49 HH22 ARG 49 -12.117 3.922 13.751 396 H VAL 50 HN VAL 50 -8.821 -2.488 15.429 397 HA VAL 50 HA VAL 50 -11.492 -2.783 14.400 398 HB VAL 50 HB VAL 50 -9.619 -3.586 13.097 399 1HG1 VAL 50 HG11 VAL 50 -9.224 -5.856 15.005 400 2HG1 VAL 50 HG12 VAL 50 -8.349 -4.341 15.217 401 3HG1 VAL 50 HG13 VAL 50 -8.151 -5.271 13.733 402 1HG2 VAL 50 HG21 VAL 50 -11.920 -4.649 13.013 403 2HG2 VAL 50 HG22 VAL 50 -11.223 -5.979 13.940 404 3HG2 VAL 50 HG23 VAL 50 -10.590 -5.592 12.340 405 H VAL 51 HN VAL 51 -9.686 -3.961 17.159 406 HA VAL 51 HA VAL 51 -11.493 -6.067 17.781 407 HB VAL 51 HB VAL 51 -9.533 -4.568 19.530 408 1HG1 VAL 51 HG11 VAL 51 -11.508 -6.690 20.193 409 2HG1 VAL 51 HG12 VAL 51 -10.914 -5.350 21.174 410 3HG1 VAL 51 HG13 VAL 51 -9.910 -6.781 20.935 411 1HG2 VAL 51 HG21 VAL 51 -9.050 -6.373 17.546 412 2HG2 VAL 51 HG22 VAL 51 -9.140 -7.416 18.965 413 3HG2 VAL 51 HG23 VAL 51 -7.988 -6.080 18.924 414 H GLY 52 HN GLY 52 -11.839 -2.743 17.809 415 1HA GLY 52 HA2 GLY 52 -13.983 -2.887 19.827 416 2HA GLY 52 HA1 GLY 52 -13.089 -1.425 19.439 417 H ARG 53 HN ARG 53 -13.341 -2.509 16.472 418 HA ARG 53 HA ARG 53 -15.962 -1.226 16.065 419 1HB ARG 53 HB2 ARG 53 -13.933 -0.187 15.022 420 2HB ARG 53 HB1 ARG 53 -13.763 -1.632 14.035 421 1HG ARG 53 HG2 ARG 53 -15.685 -1.175 12.810 422 2HG ARG 53 HG1 ARG 53 -16.312 -0.062 14.029 423 1HD ARG 53 HD2 ARG 53 -13.970 1.142 13.370 424 2HD ARG 53 HD1 ARG 53 -14.415 0.404 11.831 425 HE ARG 53 HE ARG 53 -16.139 1.903 11.645 426 1HH1 ARG 53 HH11 ARG 53 -14.929 1.959 14.920 427 2HH1 ARG 53 HH12 ARG 53 -15.868 3.342 15.375 428 1HH2 ARG 53 HH21 ARG 53 -17.374 3.722 12.243 429 2HH2 ARG 53 HH22 ARG 53 -17.256 4.343 13.856 430 H MET 54 HN MET 54 -14.842 -4.243 16.337 431 HA MET 54 HA MET 54 -17.012 -5.404 14.871 432 1HB MET 54 HB2 MET 54 -14.175 -5.765 13.917 433 2HB MET 54 HB1 MET 54 -15.427 -6.952 13.579 434 1HG MET 54 HG2 MET 54 -15.346 -4.082 12.683 435 2HG MET 54 HG1 MET 54 -15.178 -5.521 11.685 436 1HE MET 54 HE1 MET 54 -18.539 -5.933 10.331 437 2HE MET 54 HE2 MET 54 -16.878 -6.520 10.439 438 3HE MET 54 HE3 MET 54 -17.196 -4.860 9.936 439 H LEU 55 HN LEU 55 -16.522 -5.465 17.550 440 HA LEU 55 HA LEU 55 -16.175 -8.302 17.977 441 1HB LEU 55 HB2 LEU 55 -14.031 -6.527 18.522 442 2HB LEU 55 HB1 LEU 55 -14.690 -7.036 20.067 443 HG LEU 55 HG LEU 55 -14.500 -9.374 18.527 444 1HD1 LEU 55 HD11 LEU 55 -12.966 -7.941 17.086 445 2HD1 LEU 55 HD12 LEU 55 -12.308 -9.463 17.688 446 3HD1 LEU 55 HD13 LEU 55 -11.859 -7.943 18.459 447 1HD2 LEU 55 HD21 LEU 55 -14.096 -8.787 21.038 448 2HD2 LEU 55 HD22 LEU 55 -12.418 -8.606 20.523 449 3HD2 LEU 55 HD23 LEU 55 -13.249 -10.145 20.299 450 HA PRO 56 HA PRO 56 -18.024 -6.247 21.972 451 1HB PRO 56 HB2 PRO 56 -18.364 -3.450 21.057 452 2HB PRO 56 HB1 PRO 56 -17.829 -4.059 22.627 453 1HG PRO 56 HG2 PRO 56 -16.113 -2.917 20.920 454 2HG PRO 56 HG1 PRO 56 -15.633 -4.288 21.939 455 1HD PRO 56 HD2 PRO 56 -16.344 -4.240 19.034 456 2HD PRO 56 HD1 PRO 56 -15.087 -5.165 19.873 457 H ILE 57 HN ILE 57 -18.645 -5.522 18.675 458 HA ILE 57 HA ILE 57 -21.442 -5.034 18.996 459 HB ILE 57 HB ILE 57 -21.420 -4.228 16.925 460 1HG1 ILE 57 HG12 ILE 57 -21.329 -6.745 16.118 461 2HG1 ILE 57 HG11 ILE 57 -21.076 -5.428 14.988 462 1HG2 ILE 57 HG21 ILE 57 -19.311 -3.532 16.043 463 2HG2 ILE 57 HG22 ILE 57 -18.471 -4.802 16.936 464 3HG2 ILE 57 HG23 ILE 57 -19.242 -3.475 17.804 465 1HD1 ILE 57 HD11 ILE 57 -19.482 -7.521 15.067 466 2HD1 ILE 57 HD12 ILE 57 -18.685 -6.569 16.320 467 3HD1 ILE 57 HD13 ILE 57 -18.881 -5.908 14.696 468 H GLN 58 HN GLN 58 -19.494 -7.671 17.626 469 HA GLN 58 HA GLN 58 -21.858 -9.340 17.487 470 1HB GLN 58 HB2 GLN 58 -20.743 -10.675 16.007 471 2HB GLN 58 HB1 GLN 58 -19.860 -9.180 15.757 472 1HG GLN 58 HG2 GLN 58 -18.096 -9.958 17.249 473 2HG GLN 58 HG1 GLN 58 -18.990 -11.456 17.526 474 1HE2 GLN 58 HE21 GLN 58 -18.284 -9.574 14.603 475 2HE2 GLN 58 HE22 GLN 58 -17.541 -10.872 13.739 476 H GLU 59 HN GLU 59 -19.368 -8.692 19.678 477 HA GLU 59 HA GLU 59 -18.946 -11.203 20.852 478 1HB GLU 59 HB2 GLU 59 -17.529 -9.230 21.289 479 2HB GLU 59 HB1 GLU 59 -18.860 -8.470 22.151 480 1HG GLU 59 HG2 GLU 59 -18.414 -11.054 23.258 481 2HG GLU 59 HG1 GLU 59 -16.870 -10.209 23.148 482 H ASN 60 HN ASN 60 -21.604 -9.057 20.885 483 HA ASN 60 HA ASN 60 -22.812 -9.600 23.310 484 1HB ASN 60 HB2 ASN 60 -23.483 -8.238 20.967 485 2HB ASN 60 HB1 ASN 60 -24.745 -9.454 21.144 486 1HD2 ASN 60 HD21 ASN 60 -22.908 -7.549 23.504 487 2HD2 ASN 60 HD22 ASN 60 -24.289 -6.852 24.273 488 H GLN 61 HN GLN 61 -22.410 -11.579 20.517 489 HA GLN 61 HA GLN 61 -22.992 -13.704 19.992 490 1HB GLN 61 HB2 GLN 61 -23.449 -14.093 22.949 491 2HB GLN 61 HB1 GLN 61 -22.999 -15.310 21.763 492 1HG GLN 61 HG2 GLN 61 -21.015 -13.331 21.642 493 2HG GLN 61 HG1 GLN 61 -21.328 -13.619 23.353 494 1HE2 GLN 61 HE21 GLN 61 -19.624 -14.631 20.689 495 2HE2 GLN 61 HE22 GLN 61 -19.146 -16.195 21.248 496 H ALA 62 HN ALA 62 -25.116 -11.615 20.270 497 HA ALA 62 HA ALA 62 -27.467 -12.909 21.241 498 1HB ALA 62 HB1 ALA 62 -27.785 -10.749 19.264 499 2HB ALA 62 HB2 ALA 62 -26.845 -10.338 20.699 500 3HB ALA 62 HB3 ALA 62 -28.495 -10.936 20.868 501 HA PRO 63 HA PRO 63 -28.251 -15.379 17.639 502 1HB PRO 63 HB2 PRO 63 -30.790 -16.135 18.165 503 2HB PRO 63 HB1 PRO 63 -29.408 -16.767 19.067 504 1HG PRO 63 HG2 PRO 63 -31.325 -14.593 19.823 505 2HG PRO 63 HG1 PRO 63 -30.677 -15.911 20.818 506 1HD PRO 63 HD2 PRO 63 -29.704 -13.364 20.889 507 2HD PRO 63 HD1 PRO 63 -28.713 -14.795 21.234 508 H ALA 64 HN ALA 64 -31.588 -14.493 17.899 509 HA ALA 64 HA ALA 64 -31.718 -13.514 15.273 510 1HB ALA 64 HB1 ALA 64 -33.828 -12.622 17.122 511 2HB ALA 64 HB2 ALA 64 -33.551 -14.363 17.063 512 3HB ALA 64 HB3 ALA 64 -33.948 -13.481 15.587 513 HA PRO 65 HA PRO 65 -32.142 -9.166 17.930 514 1HB PRO 65 HB2 PRO 65 -29.525 -9.847 19.177 515 2HB PRO 65 HB1 PRO 65 -30.859 -8.888 19.818 516 1HG PRO 65 HG2 PRO 65 -30.344 -11.519 20.476 517 2HG PRO 65 HG1 PRO 65 -31.908 -10.711 20.669 518 1HD PRO 65 HD2 PRO 65 -31.204 -12.843 18.890 519 2HD PRO 65 HD1 PRO 65 -32.783 -12.070 19.095 520 H ASN 66 HN ASN 66 -29.284 -10.887 16.738 521 HA ASN 66 HA ASN 66 -28.462 -8.436 15.332 522 1HB ASN 66 HB2 ASN 66 -26.727 -10.834 15.940 523 2HB ASN 66 HB1 ASN 66 -26.207 -9.258 15.347 524 1HD2 ASN 66 HD21 ASN 66 -25.174 -10.514 17.628 525 2HD2 ASN 66 HD22 ASN 66 -25.584 -9.557 19.006 526 H ILE 67 HN ILE 67 -28.711 -8.406 13.208 527 HA ILE 67 HA ILE 67 -29.785 -10.547 11.752 528 HB ILE 67 HB ILE 67 -29.266 -9.207 9.731 529 1HG1 ILE 67 HG12 ILE 67 -28.076 -7.190 11.641 530 2HG1 ILE 67 HG11 ILE 67 -27.100 -8.295 10.676 531 1HG2 ILE 67 HG21 ILE 67 -31.291 -8.503 10.417 532 2HG2 ILE 67 HG22 ILE 67 -30.421 -7.023 10.822 533 3HG2 ILE 67 HG23 ILE 67 -30.750 -8.223 12.072 534 1HD1 ILE 67 HD11 ILE 67 -28.749 -5.973 9.807 535 2HD1 ILE 67 HD12 ILE 67 -28.425 -7.291 8.681 536 3HD1 ILE 67 HD13 ILE 67 -27.088 -6.392 9.395 537 H THR 68 HN THR 68 -28.903 -11.970 10.268 538 HA THR 68 HA THR 68 -26.114 -12.611 10.700 539 HB THR 68 HB THR 68 -28.418 -14.003 9.452 540 HG1 THR 68 HG1 THR 68 -27.819 -14.132 11.738 541 1HG2 THR 68 HG21 THR 68 -26.997 -14.795 7.870 542 2HG2 THR 68 HG22 THR 68 -26.636 -15.923 9.177 543 3HG2 THR 68 HG23 THR 68 -25.570 -14.550 8.877 544 H GLY 69 HN GLY 69 -24.507 -12.066 9.368 545 1HA GLY 69 HA2 GLY 69 -24.751 -11.996 6.543 546 2HA GLY 69 HA1 GLY 69 -24.814 -10.365 7.191 547 H ALA 70 HN ALA 70 -23.017 -10.689 9.338 548 HA ALA 70 HA ALA 70 -20.515 -10.688 7.845 549 1HB ALA 70 HB1 ALA 70 -20.763 -10.014 10.753 550 2HB ALA 70 HB2 ALA 70 -21.275 -8.873 9.511 551 3HB ALA 70 HB3 ALA 70 -19.601 -9.420 9.566 Start of MODEL 7 1 1H MET 1 1H MET 1 7.383 -4.988 -19.579 2 2H MET 1 2H MET 1 6.255 -3.801 -20.092 3 3H MET 1 3H MET 1 6.448 -5.249 -20.992 4 HA MET 1 HA MET 1 5.782 -6.419 -18.879 5 1HB MET 1 HB2 MET 1 5.435 -3.565 -18.246 6 2HB MET 1 HB1 MET 1 4.045 -4.566 -17.848 7 1HG MET 1 HG2 MET 1 5.550 -4.327 -15.954 8 2HG MET 1 HG1 MET 1 5.441 -6.005 -16.484 9 1HE MET 1 HE1 MET 1 8.739 -3.301 -15.819 10 2HE MET 1 HE2 MET 1 8.633 -4.734 -14.795 11 3HE MET 1 HE3 MET 1 7.222 -3.696 -15.009 12 H ALA 2 HN ALA 2 3.368 -6.814 -18.582 13 HA ALA 2 HA ALA 2 1.933 -6.187 -21.081 14 1HB ALA 2 HB1 ALA 2 1.763 -8.789 -19.567 15 2HB ALA 2 HB2 ALA 2 2.754 -8.531 -21.003 16 3HB ALA 2 HB3 ALA 2 0.999 -8.400 -21.109 17 H ASP 3 HN ASP 3 0.167 -5.033 -20.720 18 HA ASP 3 HA ASP 3 -1.870 -5.733 -18.948 19 1HB ASP 3 HB2 ASP 3 -1.496 -3.487 -17.525 20 2HB ASP 3 HB1 ASP 3 -0.889 -5.055 -17.005 21 H LYS 4 HN LYS 4 -0.626 -2.446 -19.469 22 HA LYS 4 HA LYS 4 -3.124 -1.751 -20.793 23 1HB LYS 4 HB2 LYS 4 -1.924 -0.355 -18.977 24 2HB LYS 4 HB1 LYS 4 -0.845 0.141 -20.273 25 1HG LYS 4 HG2 LYS 4 -2.345 1.546 -21.139 26 2HG LYS 4 HG1 LYS 4 -3.669 0.396 -20.955 27 1HD LYS 4 HD2 LYS 4 -2.741 1.409 -18.399 28 2HD LYS 4 HD1 LYS 4 -3.265 2.706 -19.475 29 1HE LYS 4 HE2 LYS 4 -5.129 1.937 -18.135 30 2HE LYS 4 HE1 LYS 4 -5.394 1.526 -19.829 31 1HZ LYS 4 HZ1 LYS 4 -4.902 -0.715 -19.423 32 2HZ LYS 4 HZ2 LYS 4 -5.901 -0.257 -18.137 33 3HZ LYS 4 HZ3 LYS 4 -4.232 -0.398 -17.901 34 H THR 5 HN THR 5 -2.910 -0.190 -22.706 35 HA THR 5 HA THR 5 -1.467 -1.555 -24.770 36 HB THR 5 HB THR 5 -2.401 0.345 -26.202 37 HG1 THR 5 HG1 THR 5 -3.741 1.761 -25.283 38 1HG2 THR 5 HG21 THR 5 -4.100 -1.566 -24.672 39 2HG2 THR 5 HG22 THR 5 -3.679 -1.552 -26.386 40 3HG2 THR 5 HG23 THR 5 -4.844 -0.389 -25.754 41 H ILE 6 HN ILE 6 0.592 -1.041 -23.428 42 HA ILE 6 HA ILE 6 2.633 -0.038 -23.362 43 HB ILE 6 HB ILE 6 1.802 1.473 -25.834 44 1HG1 ILE 6 HG12 ILE 6 3.262 -0.700 -26.695 45 2HG1 ILE 6 HG11 ILE 6 2.261 -1.395 -25.424 46 1HG2 ILE 6 HG21 ILE 6 4.374 0.875 -24.469 47 2HG2 ILE 6 HG22 ILE 6 3.831 2.353 -25.264 48 3HG2 ILE 6 HG23 ILE 6 4.361 0.976 -26.230 49 1HD1 ILE 6 HD11 ILE 6 0.295 -0.929 -26.544 50 2HD1 ILE 6 HD12 ILE 6 1.393 -1.385 -27.846 51 3HD1 ILE 6 HD13 ILE 6 1.041 0.316 -27.545 52 H PHE 7 HN PHE 7 3.741 1.993 -22.932 53 HA PHE 7 HA PHE 7 1.866 4.062 -21.994 54 1HB PHE 7 HB2 PHE 7 4.415 4.416 -20.777 55 2HB PHE 7 HB1 PHE 7 2.898 3.955 -20.014 56 HD1 PHE 7 HD1 PHE 7 2.429 1.658 -19.464 57 HD2 PHE 7 HD2 PHE 7 6.062 2.744 -21.394 58 HE1 PHE 7 HE1 PHE 7 3.370 -0.550 -18.926 59 HE2 PHE 7 HE2 PHE 7 7.010 0.538 -20.859 60 HZ PHE 7 HZ PHE 7 5.662 -1.114 -19.623 61 H ASN 8 HN ASN 8 3.643 6.104 -21.504 62 HA ASN 8 HA ASN 8 4.664 7.878 -22.493 63 1HB ASN 8 HB2 ASN 8 5.812 5.552 -23.954 64 2HB ASN 8 HB1 ASN 8 6.069 7.152 -24.645 65 1HD2 ASN 8 HD21 ASN 8 6.694 5.058 -21.940 66 2HD2 ASN 8 HD22 ASN 8 7.972 5.997 -21.251 67 H ASP 9 HN ASP 9 2.908 9.028 -23.172 68 HA ASP 9 HA ASP 9 2.280 8.820 -26.028 69 1HB ASP 9 HB2 ASP 9 -0.097 9.017 -25.629 70 2HB ASP 9 HB1 ASP 9 0.513 7.648 -24.706 71 H HIS 10 HN HIS 10 0.289 10.855 -25.999 72 HA HIS 10 HA HIS 10 1.693 13.141 -26.444 73 1HB HIS 10 HB2 HIS 10 -0.856 12.568 -26.731 74 2HB HIS 10 HB1 HIS 10 -1.010 13.389 -25.182 75 HD1 HIS 10 HD1 HIS 10 0.273 15.893 -25.250 76 HD2 HIS 10 HD2 HIS 10 -1.130 14.265 -28.806 77 HE1 HIS 10 HE1 HIS 10 0.064 17.831 -26.841 78 HE2 HIS 10 HE2 HIS 10 -0.876 16.834 -28.955 79 H LEU 11 HN LEU 11 0.419 12.036 -23.344 80 HA LEU 11 HA LEU 11 2.109 14.037 -22.023 81 1HB LEU 11 HB2 LEU 11 0.155 14.013 -20.246 82 2HB LEU 11 HB1 LEU 11 0.149 15.119 -21.606 83 HG LEU 11 HG LEU 11 -1.198 12.504 -22.002 84 1HD1 LEU 11 HD11 LEU 11 -2.350 12.734 -20.082 85 2HD1 LEU 11 HD12 LEU 11 -3.254 13.934 -21.005 86 3HD1 LEU 11 HD13 LEU 11 -1.958 14.447 -19.926 87 1HD2 LEU 11 HD21 LEU 11 -2.323 15.177 -22.672 88 2HD2 LEU 11 HD22 LEU 11 -2.435 13.651 -23.549 89 3HD2 LEU 11 HD23 LEU 11 -0.939 14.583 -23.589 90 H ASN 12 HN ASN 12 2.601 13.501 -19.764 91 HA ASN 12 HA ASN 12 3.179 10.686 -19.516 92 1HB ASN 12 HB2 ASN 12 4.715 12.649 -18.858 93 2HB ASN 12 HB1 ASN 12 3.724 12.764 -17.407 94 1HD2 ASN 12 HD21 ASN 12 3.633 10.929 -16.002 95 2HD2 ASN 12 HD22 ASN 12 4.958 9.822 -15.939 96 H THR 13 HN THR 13 0.645 10.491 -19.514 97 HA THR 13 HA THR 13 -0.380 10.685 -16.773 98 HB THR 13 HB THR 13 -1.794 11.684 -18.486 99 HG1 THR 13 HG1 THR 13 -2.944 9.241 -17.632 100 1HG2 THR 13 HG21 THR 13 -1.119 9.362 -20.005 101 2HG2 THR 13 HG22 THR 13 -1.964 10.826 -20.511 102 3HG2 THR 13 HG23 THR 13 -2.870 9.474 -19.830 103 H ASN 14 HN ASN 14 0.955 8.877 -16.089 104 HA ASN 14 HA ASN 14 -0.323 6.311 -16.738 105 1HB ASN 14 HB2 ASN 14 2.101 6.836 -17.719 106 2HB ASN 14 HB1 ASN 14 2.590 6.309 -16.112 107 1HD2 ASN 14 HD21 ASN 14 3.621 4.696 -17.662 108 2HD2 ASN 14 HD22 ASN 14 2.720 3.254 -17.962 109 HA PRO 15 HA PRO 15 -0.260 7.316 -12.129 110 1HB PRO 15 HB2 PRO 15 -2.908 6.002 -12.435 111 2HB PRO 15 HB1 PRO 15 -2.470 7.455 -11.531 112 1HG PRO 15 HG2 PRO 15 -3.807 7.630 -13.830 113 2HG PRO 15 HG1 PRO 15 -2.555 8.812 -13.407 114 1HD PRO 15 HD2 PRO 15 -2.428 6.515 -15.315 115 2HD PRO 15 HD1 PRO 15 -1.713 8.135 -15.448 116 H LYS 16 HN LYS 16 -0.969 4.523 -14.103 117 HA LYS 16 HA LYS 16 -0.904 2.587 -12.017 118 1HB LYS 16 HB2 LYS 16 -1.196 2.622 -14.901 119 2HB LYS 16 HB1 LYS 16 -0.147 1.309 -14.387 120 1HG LYS 16 HG2 LYS 16 -2.636 1.628 -12.847 121 2HG LYS 16 HG1 LYS 16 -2.825 1.129 -14.531 122 1HD LYS 16 HD2 LYS 16 -1.882 -0.898 -14.174 123 2HD LYS 16 HD1 LYS 16 -0.730 -0.270 -12.992 124 1HE LYS 16 HE2 LYS 16 -2.024 -1.392 -11.527 125 2HE LYS 16 HE1 LYS 16 -3.036 0.049 -11.633 126 1HZ LYS 16 HZ1 LYS 16 -4.581 -1.015 -12.908 127 2HZ LYS 16 HZ2 LYS 16 -4.037 -2.324 -11.982 128 3HZ LYS 16 HZ3 LYS 16 -3.472 -2.116 -13.562 129 H THR 17 HN THR 17 1.533 4.177 -13.934 130 HA THR 17 HA THR 17 3.578 2.288 -13.100 131 HB THR 17 HB THR 17 3.241 4.007 -15.318 132 HG1 THR 17 HG1 THR 17 5.129 2.921 -16.005 133 1HG2 THR 17 HG21 THR 17 5.481 5.054 -15.449 134 2HG2 THR 17 HG22 THR 17 5.688 4.735 -13.726 135 3HG2 THR 17 HG23 THR 17 4.405 5.813 -14.276 136 H ASN 18 HN ASN 18 3.030 5.798 -12.853 137 HA ASN 18 HA ASN 18 5.064 6.578 -11.250 138 1HB ASN 18 HB2 ASN 18 2.269 7.465 -11.575 139 2HB ASN 18 HB1 ASN 18 3.096 8.029 -10.128 140 1HD2 ASN 18 HD21 ASN 18 2.727 8.378 -13.491 141 2HD2 ASN 18 HD22 ASN 18 3.912 9.613 -13.730 142 H LEU 19 HN LEU 19 2.067 5.047 -10.175 143 HA LEU 19 HA LEU 19 2.781 5.114 -7.405 144 1HB LEU 19 HB2 LEU 19 0.430 4.921 -8.510 145 2HB LEU 19 HB1 LEU 19 0.789 3.207 -8.585 146 HG LEU 19 HG LEU 19 1.334 3.678 -5.981 147 1HD1 LEU 19 HD11 LEU 19 -0.101 5.236 -5.006 148 2HD1 LEU 19 HD12 LEU 19 -1.067 5.403 -6.471 149 3HD1 LEU 19 HD13 LEU 19 0.559 6.083 -6.405 150 1HD2 LEU 19 HD21 LEU 19 -1.136 2.847 -7.429 151 2HD2 LEU 19 HD22 LEU 19 -1.184 3.023 -5.675 152 3HD2 LEU 19 HD23 LEU 19 -0.048 1.895 -6.418 153 H ARG 20 HN ARG 20 3.194 2.919 -10.074 154 HA ARG 20 HA ARG 20 3.791 0.601 -8.652 155 1HB ARG 20 HB2 ARG 20 3.431 1.085 -11.238 156 2HB ARG 20 HB1 ARG 20 5.189 1.066 -11.228 157 1HG ARG 20 HG2 ARG 20 4.028 -1.119 -11.754 158 2HG ARG 20 HG1 ARG 20 5.270 -1.166 -10.503 159 1HD ARG 20 HD2 ARG 20 2.473 -0.668 -9.642 160 2HD ARG 20 HD1 ARG 20 2.877 -2.296 -10.190 161 HE ARG 20 HE ARG 20 3.658 -1.075 -7.722 162 1HH1 ARG 20 HH11 ARG 20 4.650 -3.382 -10.153 163 2HH1 ARG 20 HH12 ARG 20 5.659 -4.278 -9.068 164 1HH2 ARG 20 HH21 ARG 20 4.988 -2.253 -6.300 165 2HH2 ARG 20 HH22 ARG 20 5.850 -3.638 -6.880 166 H LEU 21 HN LEU 21 5.980 3.262 -9.645 167 HA LEU 21 HA LEU 21 8.235 1.725 -8.649 168 1HB LEU 21 HB2 LEU 21 8.971 4.478 -8.778 169 2HB LEU 21 HB1 LEU 21 9.536 3.140 -9.753 170 HG LEU 21 HG LEU 21 8.789 4.858 -11.206 171 1HD1 LEU 21 HD11 LEU 21 7.392 2.312 -11.084 172 2HD1 LEU 21 HD12 LEU 21 8.139 3.140 -12.449 173 3HD1 LEU 21 HD13 LEU 21 6.499 3.555 -11.960 174 1HD2 LEU 21 HD21 LEU 21 6.890 5.335 -9.165 175 2HD2 LEU 21 HD22 LEU 21 6.014 5.021 -10.665 176 3HD2 LEU 21 HD23 LEU 21 7.226 6.296 -10.608 177 H TRP 22 HN TRP 22 6.024 4.129 -7.458 178 HA TRP 22 HA TRP 22 7.519 4.730 -5.113 179 1HB TRP 22 HB2 TRP 22 5.596 6.116 -6.128 180 2HB TRP 22 HB1 TRP 22 4.523 4.977 -5.316 181 HD1 TRP 22 HD1 TRP 22 7.505 7.262 -4.313 182 HE1 TRP 22 HE1 TRP 22 7.013 8.231 -1.985 183 HE3 TRP 22 HE3 TRP 22 3.065 4.903 -3.373 184 HZ2 TRP 22 HZ2 TRP 22 5.020 8.022 -0.008 185 HZ3 TRP 22 HZ3 TRP 22 1.935 5.342 -1.230 186 HH2 TRP 22 HH2 TRP 22 2.898 6.867 0.415 187 H VAL 23 HN VAL 23 4.956 2.474 -5.971 188 HA VAL 23 HA VAL 23 4.579 1.378 -3.381 189 HB VAL 23 HB VAL 23 3.976 0.220 -6.105 190 1HG1 VAL 23 HG11 VAL 23 3.242 -0.787 -3.360 191 2HG1 VAL 23 HG12 VAL 23 4.182 -1.623 -4.596 192 3HG1 VAL 23 HG13 VAL 23 2.461 -1.325 -4.846 193 1HG2 VAL 23 HG21 VAL 23 1.818 1.023 -4.269 194 2HG2 VAL 23 HG22 VAL 23 1.963 1.232 -6.015 195 3HG2 VAL 23 HG23 VAL 23 2.795 2.339 -4.922 196 H ALA 24 HN ALA 24 6.776 0.759 -6.008 197 HA ALA 24 HA ALA 24 7.792 -1.714 -4.939 198 1HB ALA 24 HB1 ALA 24 8.149 -1.796 -7.167 199 2HB ALA 24 HB2 ALA 24 9.651 -0.971 -6.748 200 3HB ALA 24 HB3 ALA 24 8.264 -0.041 -7.322 201 H PHE 25 HN PHE 25 8.493 1.653 -4.682 202 HA PHE 25 HA PHE 25 11.158 1.446 -3.729 203 1HB PHE 25 HB2 PHE 25 11.054 3.631 -4.186 204 2HB PHE 25 HB1 PHE 25 9.311 3.532 -4.384 205 HD1 PHE 25 HD1 PHE 25 8.001 4.856 -3.052 206 HD2 PHE 25 HD2 PHE 25 11.862 3.728 -1.665 207 HE1 PHE 25 HE1 PHE 25 7.698 6.281 -1.069 208 HE2 PHE 25 HE2 PHE 25 11.567 5.150 0.321 209 HZ PHE 25 HZ PHE 25 9.484 6.430 0.620 210 H GLN 26 HN GLN 26 8.014 1.345 -2.230 211 HA GLN 26 HA GLN 26 9.143 1.369 0.467 212 1HB GLN 26 HB2 GLN 26 6.270 0.792 0.140 213 2HB GLN 26 HB1 GLN 26 7.077 1.936 1.210 214 1HG GLN 26 HG2 GLN 26 7.531 3.175 -1.068 215 2HG GLN 26 HG1 GLN 26 6.088 2.286 -1.551 216 1HE2 GLN 26 HE21 GLN 26 7.376 4.729 0.563 217 2HE2 GLN 26 HE22 GLN 26 5.860 5.417 1.026 218 H MET 27 HN MET 27 7.838 -0.751 -1.914 219 HA MET 27 HA MET 27 7.261 -3.024 -0.367 220 1HB MET 27 HB2 MET 27 6.593 -3.630 -2.440 221 2HB MET 27 HB1 MET 27 7.460 -2.264 -3.118 222 1HG MET 27 HG2 MET 27 9.276 -3.486 -3.697 223 2HG MET 27 HG1 MET 27 8.981 -4.730 -2.478 224 1HE MET 27 HE1 MET 27 6.442 -6.237 -2.782 225 2HE MET 27 HE2 MET 27 8.082 -6.871 -2.901 226 3HE MET 27 HE3 MET 27 6.878 -7.312 -4.111 227 H MET 28 HN MET 28 10.171 -1.710 -1.693 228 HA MET 28 HA MET 28 11.727 -4.024 -0.896 229 1HB MET 28 HB2 MET 28 11.795 -2.511 -3.091 230 2HB MET 28 HB1 MET 28 12.990 -1.642 -2.129 231 1HG MET 28 HG2 MET 28 14.306 -3.660 -1.873 232 2HG MET 28 HG1 MET 28 13.085 -4.589 -2.743 233 1HE MET 28 HE1 MET 28 16.145 -1.647 -4.066 234 2HE MET 28 HE2 MET 28 14.960 -1.425 -2.780 235 3HE MET 28 HE3 MET 28 14.600 -0.872 -4.415 236 H LYS 29 HN LYS 29 11.470 -0.586 -0.122 237 HA LYS 29 HA LYS 29 13.570 -0.856 1.901 238 1HB LYS 29 HB2 LYS 29 12.019 1.581 1.001 239 2HB LYS 29 HB1 LYS 29 13.376 1.587 2.121 240 1HG LYS 29 HG2 LYS 29 14.652 0.459 0.149 241 2HG LYS 29 HG1 LYS 29 13.354 1.152 -0.829 242 1HD LYS 29 HD2 LYS 29 15.206 2.657 1.019 243 2HD LYS 29 HD1 LYS 29 15.251 2.668 -0.745 244 1HE LYS 29 HE2 LYS 29 13.714 4.274 -0.829 245 2HE LYS 29 HE1 LYS 29 12.615 3.341 0.185 246 1HZ LYS 29 HZ1 LYS 29 13.452 4.304 2.111 247 2HZ LYS 29 HZ2 LYS 29 13.388 5.602 1.028 248 3HZ LYS 29 HZ3 LYS 29 14.867 4.850 1.359 249 H GLY 30 HN GLY 30 10.170 -0.149 1.566 250 1HA GLY 30 HA2 GLY 30 9.732 0.268 4.371 251 2HA GLY 30 HA1 GLY 30 8.509 0.164 3.113 252 H ALA 31 HN ALA 31 10.031 -2.484 2.397 253 HA ALA 31 HA ALA 31 8.197 -4.163 3.815 254 1HB ALA 31 HB1 ALA 31 10.284 -4.614 1.713 255 2HB ALA 31 HB2 ALA 31 8.530 -4.842 1.629 256 3HB ALA 31 HB3 ALA 31 9.524 -5.980 2.543 257 H GLY 32 HN GLY 32 11.769 -4.080 3.637 258 1HA GLY 32 HA2 GLY 32 12.053 -5.939 5.797 259 2HA GLY 32 HA1 GLY 32 13.341 -5.011 5.049 260 H TRP 33 HN TRP 33 12.534 -2.437 5.510 261 HA TRP 33 HA TRP 33 13.221 -2.134 8.274 262 1HB TRP 33 HB2 TRP 33 13.935 -0.639 6.311 263 2HB TRP 33 HB1 TRP 33 12.340 0.090 6.442 264 HD1 TRP 33 HD1 TRP 33 12.068 0.334 9.565 265 HE1 TRP 33 HE1 TRP 33 13.557 1.982 10.867 266 HE3 TRP 33 HE3 TRP 33 15.866 0.846 6.182 267 HZ2 TRP 33 HZ2 TRP 33 16.016 3.321 10.507 268 HZ3 TRP 33 HZ3 TRP 33 17.750 2.329 6.737 269 HH2 TRP 33 HH2 TRP 33 17.821 3.541 8.856 270 H ALA 34 HN ALA 34 10.524 -0.611 6.483 271 HA ALA 34 HA ALA 34 9.029 0.027 8.744 272 1HB ALA 34 HB1 ALA 34 8.752 0.439 6.036 273 2HB ALA 34 HB2 ALA 34 7.613 0.943 7.282 274 3HB ALA 34 HB3 ALA 34 7.369 -0.581 6.432 275 H GLY 35 HN GLY 35 8.579 -2.754 6.533 276 1HA GLY 35 HA2 GLY 35 6.507 -4.107 7.440 277 2HA GLY 35 HA1 GLY 35 8.035 -4.943 7.206 278 H GLY 36 HN GLY 36 9.542 -3.997 9.284 279 1HA GLY 36 HA2 GLY 36 8.409 -5.456 11.494 280 2HA GLY 36 HA1 GLY 36 10.001 -4.719 11.432 281 H VAL 37 HN VAL 37 9.386 -2.058 10.986 282 HA VAL 37 HA VAL 37 8.554 -1.256 13.596 283 HB VAL 37 HB VAL 37 9.139 0.464 11.183 284 1HG1 VAL 37 HG11 VAL 37 8.478 1.036 14.002 285 2HG1 VAL 37 HG12 VAL 37 8.221 2.010 12.554 286 3HG1 VAL 37 HG13 VAL 37 9.811 1.964 13.314 287 1HG2 VAL 37 HG21 VAL 37 11.058 -0.041 13.424 288 2HG2 VAL 37 HG22 VAL 37 11.377 0.530 11.787 289 3HG2 VAL 37 HG23 VAL 37 10.955 -1.159 12.064 290 H PHE 38 HN PHE 38 7.363 -0.572 10.344 291 HA PHE 38 HA PHE 38 5.086 0.795 11.087 292 1HB PHE 38 HB2 PHE 38 6.226 -0.229 8.660 293 2HB PHE 38 HB1 PHE 38 4.485 -0.493 8.662 294 HD1 PHE 38 HD1 PHE 38 3.085 1.206 7.984 295 HD2 PHE 38 HD2 PHE 38 7.010 2.162 9.318 296 HE1 PHE 38 HE1 PHE 38 2.727 3.553 7.341 297 HE2 PHE 38 HE2 PHE 38 6.660 4.511 8.677 298 HZ PHE 38 HZ PHE 38 4.516 5.209 7.688 299 H PHE 39 HN PHE 39 5.260 -2.620 9.990 300 HA PHE 39 HA PHE 39 2.576 -3.205 10.437 301 1HB PHE 39 HB2 PHE 39 4.473 -4.598 9.299 302 2HB PHE 39 HB1 PHE 39 4.679 -5.289 10.906 303 HD1 PHE 39 HD1 PHE 39 2.303 -5.952 12.024 304 HD2 PHE 39 HD2 PHE 39 3.152 -5.776 7.856 305 HE1 PHE 39 HE1 PHE 39 0.456 -7.517 11.584 306 HE2 PHE 39 HE2 PHE 39 1.306 -7.340 7.411 307 HZ PHE 39 HZ PHE 39 -0.045 -8.212 9.274 308 H GLY 40 HN GLY 40 5.320 -3.416 12.676 309 1HA GLY 40 HA2 GLY 40 4.038 -4.690 14.802 310 2HA GLY 40 HA1 GLY 40 5.352 -3.534 14.977 311 H THR 41 HN THR 41 3.917 -1.349 13.754 312 HA THR 41 HA THR 41 2.424 -0.505 16.078 313 HB THR 41 HB THR 41 2.827 1.001 13.507 314 HG1 THR 41 HG1 THR 41 4.686 1.854 14.472 315 1HG2 THR 41 HG21 THR 41 2.745 2.272 16.185 316 2HG2 THR 41 HG22 THR 41 1.232 1.768 15.429 317 3HG2 THR 41 HG23 THR 41 2.288 2.918 14.607 318 H LEU 42 HN LEU 42 1.795 -1.067 12.626 319 HA LEU 42 HA LEU 42 -0.895 -0.303 12.650 320 1HB LEU 42 HB2 LEU 42 0.309 -2.436 10.903 321 2HB LEU 42 HB1 LEU 42 -1.136 -1.493 10.580 322 HG LEU 42 HG LEU 42 1.424 -0.018 10.937 323 1HD1 LEU 42 HD11 LEU 42 1.586 -0.358 8.329 324 2HD1 LEU 42 HD12 LEU 42 0.822 -1.900 8.716 325 3HD1 LEU 42 HD13 LEU 42 2.367 -1.473 9.451 326 1HD2 LEU 42 HD21 LEU 42 -0.391 1.387 10.583 327 2HD2 LEU 42 HD22 LEU 42 -1.129 0.301 9.406 328 3HD2 LEU 42 HD23 LEU 42 0.309 1.227 8.973 329 H LEU 43 HN LEU 43 0.638 -3.333 13.482 330 HA LEU 43 HA LEU 43 -1.795 -4.772 13.701 331 1HB LEU 43 HB2 LEU 43 -0.376 -6.482 13.708 332 2HB LEU 43 HB1 LEU 43 0.976 -5.372 13.797 333 HG LEU 43 HG LEU 43 -0.490 -6.389 16.230 334 1HD1 LEU 43 HD11 LEU 43 0.429 -8.364 15.631 335 2HD1 LEU 43 HD12 LEU 43 1.877 -7.642 16.333 336 3HD1 LEU 43 HD13 LEU 43 1.635 -7.612 14.587 337 1HD2 LEU 43 HD21 LEU 43 2.265 -5.609 16.553 338 2HD2 LEU 43 HD22 LEU 43 0.824 -5.025 17.389 339 3HD2 LEU 43 HD23 LEU 43 1.309 -4.299 15.857 340 H LEU 44 HN LEU 44 0.164 -2.711 15.745 341 HA LEU 44 HA LEU 44 -1.126 -3.467 18.187 342 1HB LEU 44 HB2 LEU 44 1.139 -2.144 17.656 343 2HB LEU 44 HB1 LEU 44 0.079 -0.769 17.898 344 HG LEU 44 HG LEU 44 -0.356 -1.365 20.149 345 1HD1 LEU 44 HD11 LEU 44 0.737 -3.493 21.079 346 2HD1 LEU 44 HD12 LEU 44 0.828 -4.013 19.395 347 3HD1 LEU 44 HD13 LEU 44 -0.739 -3.664 20.127 348 1HD2 LEU 44 HD21 LEU 44 1.872 -0.360 19.645 349 2HD2 LEU 44 HD22 LEU 44 2.556 -1.986 19.698 350 3HD2 LEU 44 HD23 LEU 44 1.816 -1.292 21.142 351 H ILE 45 HN ILE 45 -1.443 -0.683 16.016 352 HA ILE 45 HA ILE 45 -3.718 0.366 17.434 353 HB ILE 45 HB ILE 45 -2.191 1.187 14.991 354 1HG1 ILE 45 HG12 ILE 45 -2.951 2.981 17.252 355 2HG1 ILE 45 HG11 ILE 45 -1.729 1.746 17.536 356 1HG2 ILE 45 HG21 ILE 45 -4.205 1.777 14.113 357 2HG2 ILE 45 HG22 ILE 45 -3.891 3.208 15.096 358 3HG2 ILE 45 HG23 ILE 45 -4.972 1.946 15.693 359 1HD1 ILE 45 HD11 ILE 45 -1.603 4.211 15.932 360 2HD1 ILE 45 HD12 ILE 45 -0.778 2.800 15.268 361 3HD1 ILE 45 HD13 ILE 45 -0.353 3.397 16.872 362 H GLY 46 HN GLY 46 -3.168 -1.120 14.252 363 1HA GLY 46 HA2 GLY 46 -5.829 -1.006 13.362 364 2HA GLY 46 HA1 GLY 46 -4.597 -2.114 12.767 365 H PHE 47 HN PHE 47 -4.196 -3.058 15.591 366 HA PHE 47 HA PHE 47 -6.156 -5.141 15.461 367 1HB PHE 47 HB2 PHE 47 -3.939 -5.827 16.016 368 2HB PHE 47 HB1 PHE 47 -3.816 -4.603 17.276 369 HD1 PHE 47 HD1 PHE 47 -4.515 -5.032 19.475 370 HD2 PHE 47 HD2 PHE 47 -5.476 -7.785 16.375 371 HE1 PHE 47 HE1 PHE 47 -5.261 -6.662 21.160 372 HE2 PHE 47 HE2 PHE 47 -6.225 -9.419 18.057 373 HZ PHE 47 HZ PHE 47 -6.117 -8.857 20.452 374 H PHE 48 HN PHE 48 -5.466 -2.323 17.398 375 HA PHE 48 HA PHE 48 -7.424 -2.920 19.422 376 1HB PHE 48 HB2 PHE 48 -5.248 -1.145 19.137 377 2HB PHE 48 HB1 PHE 48 -6.678 -0.139 19.331 378 HD1 PHE 48 HD1 PHE 48 -8.350 -1.322 21.212 379 HD2 PHE 48 HD2 PHE 48 -4.098 -1.448 21.087 380 HE1 PHE 48 HE1 PHE 48 -8.293 -1.705 23.642 381 HE2 PHE 48 HE2 PHE 48 -4.033 -1.832 23.516 382 HZ PHE 48 HZ PHE 48 -6.134 -1.961 24.797 383 H ARG 49 HN ARG 49 -7.272 -1.051 16.462 384 HA ARG 49 HA ARG 49 -9.704 0.363 16.924 385 1HB ARG 49 HB2 ARG 49 -9.406 1.322 14.805 386 2HB ARG 49 HB1 ARG 49 -7.773 1.058 15.396 387 1HG ARG 49 HG2 ARG 49 -7.410 0.141 13.398 388 2HG ARG 49 HG1 ARG 49 -8.256 -1.264 14.051 389 1HD ARG 49 HD2 ARG 49 -9.447 -0.936 12.122 390 2HD ARG 49 HD1 ARG 49 -10.380 0.060 13.236 391 HE ARG 49 HE ARG 49 -9.642 1.949 12.141 392 1HH1 ARG 49 HH11 ARG 49 -7.877 -0.840 10.995 393 2HH1 ARG 49 HH12 ARG 49 -7.183 -0.001 9.650 394 1HH2 ARG 49 HH21 ARG 49 -8.727 3.050 10.372 395 2HH2 ARG 49 HH22 ARG 49 -7.664 2.206 9.297 396 H VAL 50 HN VAL 50 -8.859 -2.654 15.386 397 HA VAL 50 HA VAL 50 -11.468 -3.015 14.199 398 HB VAL 50 HB VAL 50 -10.667 -5.247 13.553 399 1HG1 VAL 50 HG11 VAL 50 -8.350 -4.126 12.533 400 2HG1 VAL 50 HG12 VAL 50 -9.403 -2.744 12.826 401 3HG1 VAL 50 HG13 VAL 50 -9.954 -4.068 11.803 402 1HG2 VAL 50 HG21 VAL 50 -8.705 -4.724 15.621 403 2HG2 VAL 50 HG22 VAL 50 -7.951 -5.233 14.111 404 3HG2 VAL 50 HG23 VAL 50 -9.174 -6.249 14.871 405 H VAL 51 HN VAL 51 -9.911 -3.898 17.193 406 HA VAL 51 HA VAL 51 -11.887 -5.907 17.735 407 HB VAL 51 HB VAL 51 -9.837 -4.672 19.590 408 1HG1 VAL 51 HG11 VAL 51 -11.996 -6.621 20.013 409 2HG1 VAL 51 HG12 VAL 51 -11.129 -5.617 21.175 410 3HG1 VAL 51 HG13 VAL 51 -10.415 -7.128 20.610 411 1HG2 VAL 51 HG21 VAL 51 -9.587 -7.454 18.638 412 2HG2 VAL 51 HG22 VAL 51 -8.349 -6.225 18.899 413 3HG2 VAL 51 HG23 VAL 51 -9.327 -6.195 17.430 414 H GLY 52 HN GLY 52 -11.973 -2.616 17.729 415 1HA GLY 52 HA2 GLY 52 -14.264 -2.609 19.579 416 2HA GLY 52 HA1 GLY 52 -13.057 -1.332 19.659 417 H ARG 53 HN ARG 53 -13.723 -2.602 16.547 418 HA ARG 53 HA ARG 53 -15.805 -0.723 15.901 419 1HB ARG 53 HB2 ARG 53 -13.593 0.551 15.826 420 2HB ARG 53 HB1 ARG 53 -13.203 -0.444 14.430 421 1HG ARG 53 HG2 ARG 53 -15.533 0.408 13.573 422 2HG ARG 53 HG1 ARG 53 -15.215 1.723 14.708 423 1HD ARG 53 HD2 ARG 53 -13.004 2.045 13.606 424 2HD ARG 53 HD1 ARG 53 -13.478 0.844 12.406 425 HE ARG 53 HE ARG 53 -14.313 3.577 12.535 426 1HH1 ARG 53 HH11 ARG 53 -15.260 0.383 11.493 427 2HH1 ARG 53 HH12 ARG 53 -16.341 0.965 10.274 428 1HH2 ARG 53 HH21 ARG 53 -15.736 4.344 10.928 429 2HH2 ARG 53 HH22 ARG 53 -16.612 3.212 9.952 430 H MET 54 HN MET 54 -13.342 -2.869 14.654 431 HA MET 54 HA MET 54 -15.208 -3.833 12.594 432 1HB MET 54 HB2 MET 54 -12.202 -4.107 12.750 433 2HB MET 54 HB1 MET 54 -13.220 -4.632 11.413 434 1HG MET 54 HG2 MET 54 -13.860 -2.309 10.985 435 2HG MET 54 HG1 MET 54 -12.832 -1.786 12.318 436 1HE MET 54 HE1 MET 54 -10.967 -4.047 8.765 437 2HE MET 54 HE2 MET 54 -12.707 -4.007 9.051 438 3HE MET 54 HE3 MET 54 -11.641 -4.807 10.207 439 H LEU 55 HN LEU 55 -15.959 -4.998 14.818 440 HA LEU 55 HA LEU 55 -15.145 -7.731 14.456 441 1HB LEU 55 HB2 LEU 55 -13.828 -6.306 16.457 442 2HB LEU 55 HB1 LEU 55 -15.059 -7.219 17.308 443 HG LEU 55 HG LEU 55 -13.380 -8.653 15.310 444 1HD1 LEU 55 HD11 LEU 55 -12.455 -7.814 18.050 445 2HD1 LEU 55 HD12 LEU 55 -11.683 -7.470 16.501 446 3HD1 LEU 55 HD13 LEU 55 -11.724 -9.122 17.118 447 1HD2 LEU 55 HD21 LEU 55 -14.075 -10.506 16.399 448 2HD2 LEU 55 HD22 LEU 55 -15.388 -9.442 16.905 449 3HD2 LEU 55 HD23 LEU 55 -14.022 -9.731 17.983 450 HA PRO 56 HA PRO 56 -18.990 -7.522 17.384 451 1HB PRO 56 HB2 PRO 56 -19.579 -4.634 17.480 452 2HB PRO 56 HB1 PRO 56 -19.556 -5.814 18.793 453 1HG PRO 56 HG2 PRO 56 -17.653 -3.935 18.557 454 2HG PRO 56 HG1 PRO 56 -17.290 -5.563 19.159 455 1HD PRO 56 HD2 PRO 56 -16.809 -4.392 16.446 456 2HD PRO 56 HD1 PRO 56 -15.770 -5.456 17.415 457 H ILE 57 HN ILE 57 -18.258 -5.520 14.700 458 HA ILE 57 HA ILE 57 -20.958 -5.354 13.728 459 HB ILE 57 HB ILE 57 -20.255 -3.696 12.410 460 1HG1 ILE 57 HG12 ILE 57 -19.227 -5.440 10.838 461 2HG1 ILE 57 HG11 ILE 57 -18.580 -3.811 10.751 462 1HG2 ILE 57 HG21 ILE 57 -18.334 -2.525 13.118 463 2HG2 ILE 57 HG22 ILE 57 -17.569 -4.005 13.696 464 3HG2 ILE 57 HG23 ILE 57 -18.983 -3.363 14.528 465 1HD1 ILE 57 HD11 ILE 57 -16.545 -4.464 11.357 466 2HD1 ILE 57 HD12 ILE 57 -17.106 -6.085 10.960 467 3HD1 ILE 57 HD13 ILE 57 -17.152 -5.522 12.630 468 H GLN 58 HN GLN 58 -18.040 -7.166 13.051 469 HA GLN 58 HA GLN 58 -19.331 -8.598 10.885 470 1HB GLN 58 HB2 GLN 58 -17.249 -9.404 10.276 471 2HB GLN 58 HB1 GLN 58 -16.826 -7.851 10.977 472 1HG GLN 58 HG2 GLN 58 -16.276 -8.985 13.092 473 2HG GLN 58 HG1 GLN 58 -16.630 -10.534 12.322 474 1HE2 GLN 58 HE21 GLN 58 -15.466 -10.535 9.998 475 2HE2 GLN 58 HE22 GLN 58 -13.768 -10.235 10.101 476 H GLU 59 HN GLU 59 -18.893 -8.842 14.233 477 HA GLU 59 HA GLU 59 -18.786 -11.618 14.619 478 1HB GLU 59 HB2 GLU 59 -19.091 -9.251 16.215 479 2HB GLU 59 HB1 GLU 59 -20.294 -10.433 16.715 480 1HG GLU 59 HG2 GLU 59 -17.316 -10.847 16.586 481 2HG GLU 59 HG1 GLU 59 -18.297 -10.669 18.041 482 H ASN 60 HN ASN 60 -21.271 -9.452 13.674 483 HA ASN 60 HA ASN 60 -23.510 -11.004 14.394 484 1HB ASN 60 HB2 ASN 60 -23.704 -8.620 13.896 485 2HB ASN 60 HB1 ASN 60 -23.185 -8.907 12.238 486 1HD2 ASN 60 HD21 ASN 60 -24.703 -9.176 10.778 487 2HD2 ASN 60 HD22 ASN 60 -26.356 -9.570 11.087 488 H GLN 61 HN GLN 61 -21.289 -11.026 11.731 489 HA GLN 61 HA GLN 61 -20.930 -12.478 10.033 490 1HB GLN 61 HB2 GLN 61 -22.234 -14.022 12.049 491 2HB GLN 61 HB1 GLN 61 -22.847 -14.534 10.482 492 1HG GLN 61 HG2 GLN 61 -20.366 -14.641 9.797 493 2HG GLN 61 HG1 GLN 61 -20.049 -14.621 11.531 494 1HE2 GLN 61 HE21 GLN 61 -19.368 -16.646 11.876 495 2HE2 GLN 61 HE22 GLN 61 -20.289 -18.069 11.540 496 H ALA 62 HN ALA 62 -23.391 -10.549 10.182 497 HA ALA 62 HA ALA 62 -24.368 -11.263 7.549 498 1HB ALA 62 HB1 ALA 62 -26.783 -10.768 8.571 499 2HB ALA 62 HB2 ALA 62 -26.029 -11.507 9.985 500 3HB ALA 62 HB3 ALA 62 -26.106 -12.394 8.463 501 HA PRO 63 HA PRO 63 -24.587 -6.923 6.933 502 1HB PRO 63 HB2 PRO 63 -26.896 -6.640 5.485 503 2HB PRO 63 HB1 PRO 63 -25.365 -7.197 4.817 504 1HG PRO 63 HG2 PRO 63 -27.746 -8.786 5.667 505 2HG PRO 63 HG1 PRO 63 -26.672 -9.021 4.279 506 1HD PRO 63 HD2 PRO 63 -26.493 -10.508 6.530 507 2HD PRO 63 HD1 PRO 63 -25.083 -10.114 5.529 508 H ALA 64 HN ALA 64 -26.724 -5.197 6.770 509 HA ALA 64 HA ALA 64 -27.348 -4.793 9.512 510 1HB ALA 64 HB1 ALA 64 -28.374 -3.391 7.054 511 2HB ALA 64 HB2 ALA 64 -26.987 -2.923 8.039 512 3HB ALA 64 HB3 ALA 64 -28.615 -2.844 8.714 513 HA PRO 65 HA PRO 65 -31.795 -6.192 7.843 514 1HB PRO 65 HB2 PRO 65 -30.933 -8.777 6.722 515 2HB PRO 65 HB1 PRO 65 -32.077 -7.597 6.079 516 1HG PRO 65 HG2 PRO 65 -29.629 -7.965 5.006 517 2HG PRO 65 HG1 PRO 65 -30.431 -6.385 5.020 518 1HD PRO 65 HD2 PRO 65 -28.242 -7.427 6.734 519 2HD PRO 65 HD1 PRO 65 -28.492 -5.794 6.083 520 H ASN 66 HN ASN 66 -29.356 -7.397 9.728 521 HA ASN 66 HA ASN 66 -30.530 -9.777 10.733 522 1HB ASN 66 HB2 ASN 66 -28.068 -8.673 10.938 523 2HB ASN 66 HB1 ASN 66 -28.734 -8.225 12.505 524 1HD2 ASN 66 HD21 ASN 66 -28.019 -10.916 10.374 525 2HD2 ASN 66 HD22 ASN 66 -27.924 -12.116 11.613 526 H ILE 67 HN ILE 67 -32.713 -8.597 10.823 527 HA ILE 67 HA ILE 67 -33.139 -6.851 13.050 528 HB ILE 67 HB ILE 67 -35.543 -7.099 12.527 529 1HG1 ILE 67 HG12 ILE 67 -35.618 -8.366 10.078 530 2HG1 ILE 67 HG11 ILE 67 -34.513 -9.381 11.001 531 1HG2 ILE 67 HG21 ILE 67 -33.717 -5.676 11.207 532 2HG2 ILE 67 HG22 ILE 67 -35.429 -5.659 10.780 533 3HG2 ILE 67 HG23 ILE 67 -34.304 -6.672 9.875 534 1HD1 ILE 67 HD11 ILE 67 -36.367 -10.392 11.707 535 2HD1 ILE 67 HD12 ILE 67 -37.399 -9.042 11.237 536 3HD1 ILE 67 HD13 ILE 67 -36.540 -9.001 12.777 537 H THR 68 HN THR 68 -34.762 -7.360 14.761 538 HA THR 68 HA THR 68 -34.353 -10.107 15.732 539 HB THR 68 HB THR 68 -33.418 -8.365 17.178 540 HG1 THR 68 HG1 THR 68 -33.990 -9.744 18.636 541 1HG2 THR 68 HG21 THR 68 -34.637 -6.425 16.906 542 2HG2 THR 68 HG22 THR 68 -35.157 -6.996 18.492 543 3HG2 THR 68 HG23 THR 68 -36.185 -7.251 17.082 544 H GLY 69 HN GLY 69 -36.750 -7.664 15.025 545 1HA GLY 69 HA2 GLY 69 -38.963 -8.904 16.280 546 2HA GLY 69 HA1 GLY 69 -39.046 -7.729 14.977 547 H ALA 70 HN ALA 70 -40.943 -9.490 14.820 548 HA ALA 70 HA ALA 70 -40.173 -11.872 13.387 549 1HB ALA 70 HB1 ALA 70 -42.997 -11.026 13.344 550 2HB ALA 70 HB2 ALA 70 -42.296 -11.299 14.939 551 3HB ALA 70 HB3 ALA 70 -42.283 -12.590 13.737 Start of MODEL 8 1 1H MET 1 1H MET 1 30.245 23.198 0.651 2 2H MET 1 2H MET 1 31.652 23.591 1.550 3 3H MET 1 3H MET 1 30.419 22.633 2.260 4 HA MET 1 HA MET 1 31.870 21.813 -0.153 5 1HB MET 1 HB2 MET 1 33.481 22.251 1.649 6 2HB MET 1 HB1 MET 1 32.535 21.255 2.747 7 1HG MET 1 HG2 MET 1 34.100 19.738 2.145 8 2HG MET 1 HG1 MET 1 32.928 19.444 0.862 9 1HE MET 1 HE1 MET 1 34.292 18.965 -1.638 10 2HE MET 1 HE2 MET 1 34.759 18.177 -0.132 11 3HE MET 1 HE3 MET 1 35.994 18.852 -1.193 12 H ALA 2 HN ALA 2 30.669 20.503 2.939 13 HA ALA 2 HA ALA 2 29.350 18.357 1.425 14 1HB ALA 2 HB1 ALA 2 29.547 18.154 4.363 15 2HB ALA 2 HB2 ALA 2 31.067 18.102 3.472 16 3HB ALA 2 HB3 ALA 2 29.796 16.930 3.120 17 H ASP 3 HN ASP 3 27.281 17.542 2.370 18 HA ASP 3 HA ASP 3 25.679 19.096 4.073 19 1HB ASP 3 HB2 ASP 3 25.957 20.360 1.662 20 2HB ASP 3 HB1 ASP 3 24.489 19.424 1.402 21 H LYS 4 HN LYS 4 23.149 18.629 3.023 22 HA LYS 4 HA LYS 4 22.923 15.796 3.465 23 1HB LYS 4 HB2 LYS 4 20.988 18.053 3.100 24 2HB LYS 4 HB1 LYS 4 20.420 16.395 2.960 25 1HG LYS 4 HG2 LYS 4 21.999 17.244 5.349 26 2HG LYS 4 HG1 LYS 4 20.275 17.607 5.238 27 1HD LYS 4 HD2 LYS 4 20.434 14.943 4.504 28 2HD LYS 4 HD1 LYS 4 21.620 15.091 5.802 29 1HE LYS 4 HE2 LYS 4 19.616 14.559 6.891 30 2HE LYS 4 HE1 LYS 4 19.790 16.299 7.106 31 1HZ LYS 4 HZ1 LYS 4 18.241 16.663 5.310 32 2HZ LYS 4 HZ2 LYS 4 17.531 15.659 6.472 33 3HZ LYS 4 HZ3 LYS 4 18.114 14.998 5.027 34 H THR 5 HN THR 5 22.708 14.235 1.997 35 HA THR 5 HA THR 5 22.879 13.225 -0.050 36 HB THR 5 HB THR 5 20.497 13.332 0.138 37 HG1 THR 5 HG1 THR 5 21.469 12.878 -1.985 38 1HG2 THR 5 HG21 THR 5 20.689 16.131 -0.940 39 2HG2 THR 5 HG22 THR 5 20.087 15.628 0.640 40 3HG2 THR 5 HG23 THR 5 19.191 15.205 -0.820 41 H ILE 6 HN ILE 6 24.942 14.519 -0.334 42 HA ILE 6 HA ILE 6 24.833 16.674 -2.261 43 HB ILE 6 HB ILE 6 27.383 15.305 -1.504 44 1HG1 ILE 6 HG12 ILE 6 27.159 17.308 0.367 45 2HG1 ILE 6 HG11 ILE 6 25.527 16.650 0.334 46 1HG2 ILE 6 HG21 ILE 6 28.379 17.215 -2.183 47 2HG2 ILE 6 HG22 ILE 6 27.090 18.241 -1.554 48 3HG2 ILE 6 HG23 ILE 6 26.882 17.407 -3.095 49 1HD1 ILE 6 HD11 ILE 6 27.652 15.685 1.787 50 2HD1 ILE 6 HD12 ILE 6 27.549 14.575 0.420 51 3HD1 ILE 6 HD13 ILE 6 26.144 14.835 1.454 52 H PHE 7 HN PHE 7 25.362 16.577 -4.401 53 HA PHE 7 HA PHE 7 25.356 13.944 -5.597 54 1HB PHE 7 HB2 PHE 7 23.973 15.755 -6.543 55 2HB PHE 7 HB1 PHE 7 25.428 16.669 -6.915 56 HD1 PHE 7 HD1 PHE 7 24.925 13.025 -7.320 57 HD2 PHE 7 HD2 PHE 7 25.300 16.796 -9.253 58 HE1 PHE 7 HE1 PHE 7 25.059 11.888 -9.497 59 HE2 PHE 7 HE2 PHE 7 25.434 15.668 -11.437 60 HZ PHE 7 HZ PHE 7 25.312 13.209 -11.560 61 H ASN 8 HN ASN 8 27.154 16.208 -7.444 62 HA ASN 8 HA ASN 8 29.280 16.095 -8.259 63 1HB ASN 8 HB2 ASN 8 29.433 16.308 -5.335 64 2HB ASN 8 HB1 ASN 8 30.903 15.686 -6.077 65 1HD2 ASN 8 HD21 ASN 8 32.008 17.569 -5.480 66 2HD2 ASN 8 HD22 ASN 8 31.791 19.054 -6.337 67 H ASP 9 HN ASP 9 31.538 14.748 -7.681 68 HA ASP 9 HA ASP 9 32.615 12.757 -7.881 69 1HB ASP 9 HB2 ASP 9 30.759 12.305 -5.907 70 2HB ASP 9 HB1 ASP 9 30.394 11.023 -7.057 71 H HIS 10 HN HIS 10 29.264 11.708 -8.498 72 HA HIS 10 HA HIS 10 29.921 10.142 -10.727 73 1HB HIS 10 HB2 HIS 10 27.644 10.594 -9.219 74 2HB HIS 10 HB1 HIS 10 27.205 11.222 -10.804 75 HD1 HIS 10 HD1 HIS 10 29.191 8.891 -12.107 76 HD2 HIS 10 HD2 HIS 10 25.816 8.456 -9.723 77 HE1 HIS 10 HE1 HIS 10 28.329 6.575 -12.578 78 HE2 HIS 10 HE2 HIS 10 26.244 6.363 -11.179 79 H LEU 11 HN LEU 11 28.450 10.671 -12.849 80 HA LEU 11 HA LEU 11 29.769 12.970 -14.009 81 1HB LEU 11 HB2 LEU 11 27.779 11.456 -15.591 82 2HB LEU 11 HB1 LEU 11 29.374 12.025 -16.043 83 HG LEU 11 HG LEU 11 30.066 10.092 -14.295 84 1HD1 LEU 11 HD11 LEU 11 28.627 8.330 -14.178 85 2HD1 LEU 11 HD12 LEU 11 27.834 8.729 -15.701 86 3HD1 LEU 11 HD13 LEU 11 27.460 9.649 -14.244 87 1HD2 LEU 11 HD21 LEU 11 30.527 10.542 -16.852 88 2HD2 LEU 11 HD22 LEU 11 29.388 9.209 -17.054 89 3HD2 LEU 11 HD23 LEU 11 30.867 8.974 -16.121 90 H ASN 12 HN ASN 12 27.996 13.824 -15.916 91 HA ASN 12 HA ASN 12 26.374 15.625 -14.431 92 1HB ASN 12 HB2 ASN 12 26.981 15.137 -17.291 93 2HB ASN 12 HB1 ASN 12 25.451 15.938 -16.948 94 1HD2 ASN 12 HD21 ASN 12 28.726 16.353 -17.409 95 2HD2 ASN 12 HD22 ASN 12 28.874 17.970 -16.822 96 H THR 13 HN THR 13 24.992 14.269 -13.216 97 HA THR 13 HA THR 13 22.603 13.482 -14.680 98 HB THR 13 HB THR 13 22.513 11.263 -13.829 99 HG1 THR 13 HG1 THR 13 23.505 10.685 -12.080 100 1HG2 THR 13 HG21 THR 13 24.383 10.166 -14.751 101 2HG2 THR 13 HG22 THR 13 25.413 11.579 -14.525 102 3HG2 THR 13 HG23 THR 13 24.122 11.613 -15.725 103 H ASN 14 HN ASN 14 21.667 12.021 -12.213 104 HA ASN 14 HA ASN 14 21.722 13.713 -9.987 105 1HB ASN 14 HB2 ASN 14 20.269 14.896 -11.985 106 2HB ASN 14 HB1 ASN 14 19.015 14.048 -11.085 107 1HD2 ASN 14 HD21 ASN 14 22.000 15.667 -10.065 108 2HD2 ASN 14 HD22 ASN 14 21.234 16.754 -8.962 109 HA PRO 15 HA PRO 15 17.854 10.586 -9.785 110 1HB PRO 15 HB2 PRO 15 18.887 8.884 -12.014 111 2HB PRO 15 HB1 PRO 15 17.222 9.168 -11.496 112 1HG PRO 15 HG2 PRO 15 18.166 10.388 -13.651 113 2HG PRO 15 HG1 PRO 15 17.128 11.263 -12.509 114 1HD PRO 15 HD2 PRO 15 20.078 11.434 -12.906 115 2HD PRO 15 HD1 PRO 15 18.921 12.712 -12.483 116 H LYS 16 HN LYS 16 21.209 9.908 -10.524 117 HA LYS 16 HA LYS 16 21.348 7.388 -9.228 118 1HB LYS 16 HB2 LYS 16 23.169 9.202 -10.550 119 2HB LYS 16 HB1 LYS 16 23.895 8.567 -9.079 120 1HG LYS 16 HG2 LYS 16 22.718 6.913 -11.304 121 2HG LYS 16 HG1 LYS 16 24.436 7.208 -11.035 122 1HD LYS 16 HD2 LYS 16 24.487 5.436 -9.695 123 2HD LYS 16 HD1 LYS 16 23.404 6.283 -8.587 124 1HE LYS 16 HE2 LYS 16 22.410 4.175 -9.105 125 2HE LYS 16 HE1 LYS 16 21.484 5.423 -9.938 126 1HZ LYS 16 HZ1 LYS 16 23.668 4.256 -11.452 127 2HZ LYS 16 HZ2 LYS 16 22.102 4.659 -11.945 128 3HZ LYS 16 HZ3 LYS 16 22.379 3.212 -11.116 129 H THR 17 HN THR 17 22.358 10.640 -8.160 130 HA THR 17 HA THR 17 22.684 9.637 -5.450 131 HB THR 17 HB THR 17 23.196 12.368 -6.633 132 HG1 THR 17 HG1 THR 17 24.765 11.013 -7.315 133 1HG2 THR 17 HG21 THR 17 22.923 11.633 -3.904 134 2HG2 THR 17 HG22 THR 17 23.377 13.191 -4.596 135 3HG2 THR 17 HG23 THR 17 24.620 11.993 -4.233 136 H ASN 18 HN ASN 18 20.354 11.341 -7.329 137 HA ASN 18 HA ASN 18 19.041 12.450 -4.994 138 1HB ASN 18 HB2 ASN 18 19.245 13.492 -7.392 139 2HB ASN 18 HB1 ASN 18 17.834 12.494 -7.733 140 1HD2 ASN 18 HD21 ASN 18 16.410 14.151 -7.984 141 2HD2 ASN 18 HD22 ASN 18 15.914 15.189 -6.694 142 H LEU 19 HN LEU 19 17.952 10.352 -7.676 143 HA LEU 19 HA LEU 19 15.664 9.489 -6.228 144 1HB LEU 19 HB2 LEU 19 15.903 9.715 -8.737 145 2HB LEU 19 HB1 LEU 19 16.851 8.240 -8.675 146 HG LEU 19 HG LEU 19 14.577 7.506 -7.329 147 1HD1 LEU 19 HD11 LEU 19 13.758 9.312 -9.600 148 2HD1 LEU 19 HD12 LEU 19 13.461 9.594 -7.885 149 3HD1 LEU 19 HD13 LEU 19 12.691 8.234 -8.700 150 1HD2 LEU 19 HD21 LEU 19 14.066 6.800 -9.952 151 2HD2 LEU 19 HD22 LEU 19 15.040 5.892 -8.795 152 3HD2 LEU 19 HD23 LEU 19 15.815 7.017 -9.910 153 H ARG 20 HN ARG 20 18.583 7.840 -7.373 154 HA ARG 20 HA ARG 20 18.046 5.381 -6.286 155 1HB ARG 20 HB2 ARG 20 20.227 6.560 -7.552 156 2HB ARG 20 HB1 ARG 20 20.860 6.011 -6.006 157 1HG ARG 20 HG2 ARG 20 19.576 4.386 -8.178 158 2HG ARG 20 HG1 ARG 20 21.208 4.246 -7.520 159 1HD ARG 20 HD2 ARG 20 20.283 2.538 -6.365 160 2HD ARG 20 HD1 ARG 20 19.785 3.836 -5.283 161 HE ARG 20 HE ARG 20 17.614 3.417 -5.859 162 1HH1 ARG 20 HH11 ARG 20 19.700 2.048 -8.304 163 2HH1 ARG 20 HH12 ARG 20 18.407 1.267 -9.150 164 1HH2 ARG 20 HH21 ARG 20 15.912 2.388 -6.975 165 2HH2 ARG 20 HH22 ARG 20 16.257 1.461 -8.397 166 H LEU 21 HN LEU 21 18.687 8.309 -4.734 167 HA LEU 21 HA LEU 21 19.726 7.279 -2.290 168 1HB LEU 21 HB2 LEU 21 19.114 9.842 -3.493 169 2HB LEU 21 HB1 LEU 21 18.610 9.785 -1.809 170 HG LEU 21 HG LEU 21 20.900 10.618 -2.049 171 1HD1 LEU 21 HD11 LEU 21 19.870 8.673 -0.337 172 2HD1 LEU 21 HD12 LEU 21 21.316 9.664 -0.066 173 3HD1 LEU 21 HD13 LEU 21 21.470 8.065 -0.795 174 1HD2 LEU 21 HD21 LEU 21 21.045 8.781 -4.068 175 2HD2 LEU 21 HD22 LEU 21 21.946 7.966 -2.778 176 3HD2 LEU 21 HD23 LEU 21 22.446 9.568 -3.323 177 H TRP 22 HN TRP 22 16.667 8.967 -3.010 178 HA TRP 22 HA TRP 22 15.532 8.281 -0.560 179 1HB TRP 22 HB2 TRP 22 14.758 10.058 -2.262 180 2HB TRP 22 HB1 TRP 22 13.905 8.744 -3.063 181 HD1 TRP 22 HD1 TRP 22 14.091 10.030 0.611 182 HE1 TRP 22 HE1 TRP 22 11.693 10.058 1.548 183 HE3 TRP 22 HE3 TRP 22 11.600 8.272 -3.491 184 HZ2 TRP 22 HZ2 TRP 22 9.088 9.419 0.661 185 HZ3 TRP 22 HZ3 TRP 22 9.157 8.009 -3.365 186 HH2 TRP 22 HH2 TRP 22 7.929 8.571 -1.331 187 H VAL 23 HN VAL 23 15.329 6.757 -3.745 188 HA VAL 23 HA VAL 23 13.501 4.747 -3.259 189 HB VAL 23 HB VAL 23 16.024 4.397 -4.879 190 1HG1 VAL 23 HG11 VAL 23 13.504 2.886 -4.576 191 2HG1 VAL 23 HG12 VAL 23 15.126 2.323 -4.983 192 3HG1 VAL 23 HG13 VAL 23 14.115 3.072 -6.220 193 1HG2 VAL 23 HG21 VAL 23 14.077 6.360 -5.230 194 2HG2 VAL 23 HG22 VAL 23 13.669 5.103 -6.397 195 3HG2 VAL 23 HG23 VAL 23 15.276 5.831 -6.411 196 H ALA 24 HN ALA 24 16.828 5.023 -2.252 197 HA ALA 24 HA ALA 24 17.042 2.305 -1.334 198 1HB ALA 24 HB1 ALA 24 19.106 3.539 -0.129 199 2HB ALA 24 HB2 ALA 24 18.791 4.681 -1.437 200 3HB ALA 24 HB3 ALA 24 19.143 2.992 -1.804 201 H PHE 25 HN PHE 25 16.032 5.350 -0.037 202 HA PHE 25 HA PHE 25 16.358 4.841 2.706 203 1HB PHE 25 HB2 PHE 25 15.806 7.011 2.645 204 2HB PHE 25 HB1 PHE 25 15.160 6.844 1.022 205 HD1 PHE 25 HD1 PHE 25 12.947 7.324 0.674 206 HD2 PHE 25 HD2 PHE 25 14.196 6.097 4.554 207 HE1 PHE 25 HE1 PHE 25 10.670 7.705 1.528 208 HE2 PHE 25 HE2 PHE 25 11.924 6.477 5.412 209 HZ PHE 25 HZ PHE 25 10.155 7.281 3.898 210 H GLN 26 HN GLN 26 13.889 3.862 0.439 211 HA GLN 26 HA GLN 26 12.148 2.996 2.605 212 1HB GLN 26 HB2 GLN 26 10.670 2.232 0.684 213 2HB GLN 26 HB1 GLN 26 10.962 3.963 0.807 214 1HG GLN 26 HG2 GLN 26 12.985 2.784 -0.810 215 2HG GLN 26 HG1 GLN 26 11.401 2.276 -1.397 216 1HE2 GLN 26 HE21 GLN 26 12.322 5.291 0.175 217 2HE2 GLN 26 HE22 GLN 26 11.910 6.323 -1.149 218 H MET 27 HN MET 27 14.204 1.574 0.113 219 HA MET 27 HA MET 27 13.362 -1.111 0.852 220 1HB MET 27 HB2 MET 27 15.628 -1.460 -0.684 221 2HB MET 27 HB1 MET 27 13.972 -1.482 -1.267 222 1HG MET 27 HG2 MET 27 14.104 0.716 -2.043 223 2HG MET 27 HG1 MET 27 15.568 1.044 -1.115 224 1HE MET 27 HE1 MET 27 18.302 -0.890 -2.955 225 2HE MET 27 HE2 MET 27 17.577 -0.666 -1.363 226 3HE MET 27 HE3 MET 27 18.092 0.736 -2.303 227 H MET 28 HN MET 28 16.123 0.972 1.396 228 HA MET 28 HA MET 28 17.456 -1.156 2.865 229 1HB MET 28 HB2 MET 28 18.680 0.399 1.296 230 2HB MET 28 HB1 MET 28 18.397 1.687 2.459 231 1HG MET 28 HG2 MET 28 19.497 -0.170 4.068 232 2HG MET 28 HG1 MET 28 20.292 -0.560 2.544 233 1HE MET 28 HE1 MET 28 20.005 3.500 4.424 234 2HE MET 28 HE2 MET 28 20.729 2.382 5.580 235 3HE MET 28 HE3 MET 28 19.155 2.022 4.873 236 H LYS 29 HN LYS 29 16.056 2.046 3.445 237 HA LYS 29 HA LYS 29 16.456 1.691 6.323 238 1HB LYS 29 HB2 LYS 29 15.277 4.045 4.842 239 2HB LYS 29 HB1 LYS 29 15.718 4.001 6.541 240 1HG LYS 29 HG2 LYS 29 18.087 3.476 5.714 241 2HG LYS 29 HG1 LYS 29 17.507 4.029 4.142 242 1HD LYS 29 HD2 LYS 29 17.428 5.626 6.700 243 2HD LYS 29 HD1 LYS 29 18.606 5.829 5.401 244 1HE LYS 29 HE2 LYS 29 17.215 7.194 4.337 245 2HE LYS 29 HE1 LYS 29 16.004 5.917 4.264 246 1HZ LYS 29 HZ1 LYS 29 15.106 7.844 5.360 247 2HZ LYS 29 HZ2 LYS 29 16.373 7.860 6.480 248 3HZ LYS 29 HZ3 LYS 29 15.256 6.590 6.486 249 H GLY 30 HN GLY 30 13.944 1.705 3.903 250 1HA GLY 30 HA2 GLY 30 11.832 1.612 5.898 251 2HA GLY 30 HA1 GLY 30 11.624 1.592 4.154 252 H ALA 31 HN ALA 31 13.975 -0.623 4.802 253 HA ALA 31 HA ALA 31 12.096 -2.813 4.500 254 1HB ALA 31 HB1 ALA 31 14.349 -4.111 4.352 255 2HB ALA 31 HB2 ALA 31 15.049 -2.499 4.165 256 3HB ALA 31 HB3 ALA 31 13.832 -3.079 3.018 257 H GLY 32 HN GLY 32 14.937 -2.206 6.589 258 1HA GLY 32 HA2 GLY 32 14.178 -4.291 8.406 259 2HA GLY 32 HA1 GLY 32 15.491 -3.145 8.625 260 H TRP 33 HN TRP 33 13.865 -0.778 8.406 261 HA TRP 33 HA TRP 33 13.001 -0.621 11.122 262 1HB TRP 33 HB2 TRP 33 14.023 1.312 10.108 263 2HB TRP 33 HB1 TRP 33 12.814 1.340 8.831 264 HD1 TRP 33 HD1 TRP 33 12.874 1.702 12.703 265 HE1 TRP 33 HE1 TRP 33 11.112 3.465 13.350 266 HE3 TRP 33 HE3 TRP 33 10.981 2.698 8.061 267 HZ2 TRP 33 HZ2 TRP 33 9.175 5.066 12.061 268 HZ3 TRP 33 HZ3 TRP 33 9.176 4.357 7.853 269 HH2 TRP 33 HH2 TRP 33 8.292 5.516 9.812 270 H ALA 34 HN ALA 34 11.147 0.206 8.177 271 HA ALA 34 HA ALA 34 8.653 0.329 9.247 272 1HB ALA 34 HB1 ALA 34 9.284 -0.916 6.575 273 2HB ALA 34 HB2 ALA 34 9.183 0.815 6.891 274 3HB ALA 34 HB3 ALA 34 7.752 -0.200 7.065 275 H GLY 35 HN GLY 35 9.578 -2.639 7.484 276 1HA GLY 35 HA2 GLY 35 7.807 -4.442 7.977 277 2HA GLY 35 HA1 GLY 35 9.460 -4.837 8.416 278 H GLY 36 HN GLY 36 10.025 -3.772 10.690 279 1HA GLY 36 HA2 GLY 36 8.241 -5.061 12.552 280 2HA GLY 36 HA1 GLY 36 9.775 -4.294 12.929 281 H VAL 37 HN VAL 37 9.199 -1.693 11.913 282 HA VAL 37 HA VAL 37 7.732 -0.665 14.130 283 HB VAL 37 HB VAL 37 8.825 0.802 11.729 284 1HG1 VAL 37 HG11 VAL 37 7.260 2.238 12.714 285 2HG1 VAL 37 HG12 VAL 37 8.802 2.728 13.416 286 3HG1 VAL 37 HG13 VAL 37 7.686 1.728 14.348 287 1HG2 VAL 37 HG21 VAL 37 10.089 -0.311 14.116 288 2HG2 VAL 37 HG22 VAL 37 10.434 1.401 13.867 289 3HG2 VAL 37 HG23 VAL 37 10.809 0.233 12.602 290 H PHE 38 HN PHE 38 7.294 -0.448 10.625 291 HA PHE 38 HA PHE 38 4.836 0.808 10.703 292 1HB PHE 38 HB2 PHE 38 6.567 -0.159 8.717 293 2HB PHE 38 HB1 PHE 38 5.003 -0.902 8.399 294 HD1 PHE 38 HD1 PHE 38 6.811 1.476 7.094 295 HD2 PHE 38 HD2 PHE 38 3.146 1.201 9.239 296 HE1 PHE 38 HE1 PHE 38 6.042 3.559 6.036 297 HE2 PHE 38 HE2 PHE 38 2.369 3.283 8.183 298 HZ PHE 38 HZ PHE 38 3.817 4.464 6.580 299 H PHE 39 HN PHE 39 5.433 -2.686 10.080 300 HA PHE 39 HA PHE 39 2.657 -3.296 10.253 301 1HB PHE 39 HB2 PHE 39 3.460 -5.083 9.172 302 2HB PHE 39 HB1 PHE 39 5.105 -4.724 9.670 303 HD1 PHE 39 HD1 PHE 39 2.348 -6.937 9.998 304 HD2 PHE 39 HD2 PHE 39 5.812 -5.504 12.013 305 HE1 PHE 39 HE1 PHE 39 2.322 -8.925 11.449 306 HE2 PHE 39 HE2 PHE 39 5.791 -7.489 13.467 307 HZ PHE 39 HZ PHE 39 4.046 -9.204 13.185 308 H GLY 40 HN GLY 40 5.345 -3.513 12.558 309 1HA GLY 40 HA2 GLY 40 3.983 -4.834 14.622 310 2HA GLY 40 HA1 GLY 40 5.316 -3.707 14.854 311 H THR 41 HN THR 41 3.905 -1.513 13.560 312 HA THR 41 HA THR 41 2.392 -0.620 15.859 313 HB THR 41 HB THR 41 3.067 0.768 13.271 314 HG1 THR 41 HG1 THR 41 4.868 0.241 14.637 315 1HG2 THR 41 HG21 THR 41 1.244 1.953 14.157 316 2HG2 THR 41 HG22 THR 41 2.684 2.850 14.643 317 3HG2 THR 41 HG23 THR 41 1.854 1.814 15.806 318 H LEU 42 HN LEU 42 1.810 -1.154 12.381 319 HA LEU 42 HA LEU 42 -0.873 -0.365 12.394 320 1HB LEU 42 HB2 LEU 42 0.358 -2.460 10.616 321 2HB LEU 42 HB1 LEU 42 -1.127 -1.576 10.316 322 HG LEU 42 HG LEU 42 1.294 0.081 10.679 323 1HD1 LEU 42 HD11 LEU 42 2.497 -0.630 8.937 324 2HD1 LEU 42 HD12 LEU 42 1.065 -0.888 7.941 325 3HD1 LEU 42 HD13 LEU 42 1.582 -2.131 9.078 326 1HD2 LEU 42 HD21 LEU 42 0.261 1.356 8.885 327 2HD2 LEU 42 HD22 LEU 42 -0.906 1.029 10.168 328 3HD2 LEU 42 HD23 LEU 42 -0.954 0.096 8.672 329 H LEU 43 HN LEU 43 0.618 -3.472 13.096 330 HA LEU 43 HA LEU 43 -1.862 -4.843 13.334 331 1HB LEU 43 HB2 LEU 43 -0.517 -6.617 13.311 332 2HB LEU 43 HB1 LEU 43 0.871 -5.550 13.319 333 HG LEU 43 HG LEU 43 -0.487 -6.517 15.834 334 1HD1 LEU 43 HD11 LEU 43 0.616 -8.272 14.247 335 2HD1 LEU 43 HD12 LEU 43 0.960 -8.300 15.977 336 3HD1 LEU 43 HD13 LEU 43 2.122 -7.587 14.858 337 1HD2 LEU 43 HD21 LEU 43 1.333 -4.470 15.370 338 2HD2 LEU 43 HD22 LEU 43 2.308 -5.808 15.985 339 3HD2 LEU 43 HD23 LEU 43 0.939 -5.208 16.924 340 H LEU 44 HN LEU 44 0.173 -2.887 15.400 341 HA LEU 44 HA LEU 44 -1.082 -3.715 17.834 342 1HB LEU 44 HB2 LEU 44 1.189 -2.396 17.320 343 2HB LEU 44 HB1 LEU 44 0.149 -1.022 17.632 344 HG LEU 44 HG LEU 44 -0.101 -1.536 19.866 345 1HD1 LEU 44 HD11 LEU 44 -0.980 -3.723 19.778 346 2HD1 LEU 44 HD12 LEU 44 0.469 -3.830 20.781 347 3HD1 LEU 44 HD13 LEU 44 0.514 -4.378 19.103 348 1HD2 LEU 44 HD21 LEU 44 2.014 -1.469 20.639 349 2HD2 LEU 44 HD22 LEU 44 2.415 -1.373 18.924 350 3HD2 LEU 44 HD23 LEU 44 2.494 -2.922 19.762 351 H ILE 45 HN ILE 45 -1.436 -0.894 15.726 352 HA ILE 45 HA ILE 45 -3.655 0.141 17.248 353 HB ILE 45 HB ILE 45 -2.166 1.043 14.816 354 1HG1 ILE 45 HG12 ILE 45 -2.950 2.754 17.139 355 2HG1 ILE 45 HG11 ILE 45 -1.689 1.546 17.366 356 1HG2 ILE 45 HG21 ILE 45 -3.888 3.018 14.913 357 2HG2 ILE 45 HG22 ILE 45 -4.947 1.778 15.597 358 3HG2 ILE 45 HG23 ILE 45 -4.246 1.553 13.990 359 1HD1 ILE 45 HD11 ILE 45 -1.692 3.896 15.504 360 2HD1 ILE 45 HD12 ILE 45 -0.536 2.570 15.365 361 3HD1 ILE 45 HD13 ILE 45 -0.586 3.547 16.834 362 H GLY 46 HN GLY 46 -3.202 -1.181 13.980 363 1HA GLY 46 HA2 GLY 46 -5.858 -0.920 13.152 364 2HA GLY 46 HA1 GLY 46 -4.683 -2.040 12.474 365 H PHE 47 HN PHE 47 -4.183 -3.392 14.967 366 HA PHE 47 HA PHE 47 -6.387 -5.193 14.803 367 1HB PHE 47 HB2 PHE 47 -3.855 -5.723 15.121 368 2HB PHE 47 HB1 PHE 47 -4.201 -5.466 16.830 369 HD1 PHE 47 HD1 PHE 47 -3.152 -7.985 16.167 370 HD2 PHE 47 HD2 PHE 47 -7.191 -6.678 15.832 371 HE1 PHE 47 HE1 PHE 47 -3.919 -10.316 16.341 372 HE2 PHE 47 HE2 PHE 47 -7.961 -9.007 16.006 373 HZ PHE 47 HZ PHE 47 -6.325 -10.828 16.260 374 H PHE 48 HN PHE 48 -5.241 -2.770 17.035 375 HA PHE 48 HA PHE 48 -6.988 -3.523 19.173 376 1HB PHE 48 HB2 PHE 48 -4.991 -1.410 18.653 377 2HB PHE 48 HB1 PHE 48 -6.317 -0.925 19.702 378 HD1 PHE 48 HD1 PHE 48 -6.814 -3.524 21.104 379 HD2 PHE 48 HD2 PHE 48 -3.199 -1.489 20.154 380 HE1 PHE 48 HE1 PHE 48 -5.709 -4.601 23.020 381 HE2 PHE 48 HE2 PHE 48 -2.088 -2.565 22.066 382 HZ PHE 48 HZ PHE 48 -3.343 -4.122 23.501 383 H ARG 49 HN ARG 49 -7.019 -1.125 16.617 384 HA ARG 49 HA ARG 49 -9.326 0.211 17.498 385 1HB ARG 49 HB2 ARG 49 -9.285 1.394 15.438 386 2HB ARG 49 HB1 ARG 49 -7.620 1.164 15.949 387 1HG ARG 49 HG2 ARG 49 -7.166 0.296 13.975 388 2HG ARG 49 HG1 ARG 49 -8.267 -1.037 14.329 389 1HD ARG 49 HD2 ARG 49 -10.104 0.653 13.594 390 2HD ARG 49 HD1 ARG 49 -8.764 1.481 12.800 391 HE ARG 49 HE ARG 49 -8.874 -1.316 12.213 392 1HH1 ARG 49 HH11 ARG 49 -10.116 1.819 11.325 393 2HH1 ARG 49 HH12 ARG 49 -10.498 1.348 9.703 394 1HH2 ARG 49 HH21 ARG 49 -9.381 -1.941 10.076 395 2HH2 ARG 49 HH22 ARG 49 -10.080 -0.784 8.994 396 H VAL 50 HN VAL 50 -8.846 -2.665 15.589 397 HA VAL 50 HA VAL 50 -11.451 -2.752 14.442 398 HB VAL 50 HB VAL 50 -9.532 -5.007 15.034 399 1HG1 VAL 50 HG11 VAL 50 -10.934 -6.003 13.041 400 2HG1 VAL 50 HG12 VAL 50 -12.171 -4.916 13.671 401 3HG1 VAL 50 HG13 VAL 50 -11.478 -6.158 14.711 402 1HG2 VAL 50 HG21 VAL 50 -8.457 -4.573 13.114 403 2HG2 VAL 50 HG22 VAL 50 -9.151 -2.961 13.290 404 3HG2 VAL 50 HG23 VAL 50 -9.942 -4.155 12.261 405 H VAL 51 HN VAL 51 -9.931 -4.205 17.301 406 HA VAL 51 HA VAL 51 -12.131 -5.645 18.184 407 HB VAL 51 HB VAL 51 -10.122 -4.298 19.985 408 1HG1 VAL 51 HG11 VAL 51 -11.435 -5.199 21.557 409 2HG1 VAL 51 HG12 VAL 51 -10.762 -6.748 21.048 410 3HG1 VAL 51 HG13 VAL 51 -12.302 -6.196 20.387 411 1HG2 VAL 51 HG21 VAL 51 -9.689 -7.111 19.319 412 2HG2 VAL 51 HG22 VAL 51 -8.541 -5.776 19.399 413 3HG2 VAL 51 HG23 VAL 51 -9.508 -6.021 17.944 414 H GLY 52 HN GLY 52 -11.401 -2.263 18.376 415 1HA GLY 52 HA2 GLY 52 -13.605 -1.745 20.198 416 2HA GLY 52 HA1 GLY 52 -12.508 -0.547 19.521 417 H ARG 53 HN ARG 53 -13.477 -2.543 17.059 418 HA ARG 53 HA ARG 53 -15.624 -0.687 16.295 419 1HB ARG 53 HB2 ARG 53 -13.536 -2.102 14.644 420 2HB ARG 53 HB1 ARG 53 -14.978 -1.400 13.922 421 1HG ARG 53 HG2 ARG 53 -13.715 0.509 15.654 422 2HG ARG 53 HG1 ARG 53 -12.549 -0.132 14.495 423 1HD ARG 53 HD2 ARG 53 -13.382 1.299 13.010 424 2HD ARG 53 HD1 ARG 53 -14.850 0.324 12.999 425 HE ARG 53 HE ARG 53 -14.752 2.276 15.113 426 1HH1 ARG 53 HH11 ARG 53 -15.641 1.688 11.788 427 2HH1 ARG 53 HH12 ARG 53 -16.799 2.974 11.740 428 1HH2 ARG 53 HH21 ARG 53 -16.274 3.969 15.050 429 2HH2 ARG 53 HH22 ARG 53 -17.159 4.269 13.591 430 H MET 54 HN MET 54 -15.311 -3.687 17.493 431 HA MET 54 HA MET 54 -17.832 -4.522 16.375 432 1HB MET 54 HB2 MET 54 -16.600 -6.901 16.022 433 2HB MET 54 HB1 MET 54 -16.890 -5.746 14.732 434 1HG MET 54 HG2 MET 54 -14.689 -6.286 14.411 435 2HG MET 54 HG1 MET 54 -14.559 -4.822 15.381 436 1HE MET 54 HE1 MET 54 -14.385 -8.439 14.996 437 2HE MET 54 HE2 MET 54 -13.656 -9.116 16.452 438 3HE MET 54 HE3 MET 54 -12.652 -8.271 15.272 439 H LEU 55 HN LEU 55 -16.779 -3.831 19.011 440 HA LEU 55 HA LEU 55 -17.799 -6.169 20.386 441 1HB LEU 55 HB2 LEU 55 -14.985 -5.403 20.469 442 2HB LEU 55 HB1 LEU 55 -15.711 -5.544 22.058 443 HG LEU 55 HG LEU 55 -16.276 -7.754 20.184 444 1HD1 LEU 55 HD11 LEU 55 -14.120 -8.826 20.563 445 2HD1 LEU 55 HD12 LEU 55 -13.541 -7.386 21.401 446 3HD1 LEU 55 HD13 LEU 55 -13.926 -7.311 19.682 447 1HD2 LEU 55 HD21 LEU 55 -15.670 -9.009 22.338 448 2HD2 LEU 55 HD22 LEU 55 -17.141 -8.035 22.332 449 3HD2 LEU 55 HD23 LEU 55 -15.678 -7.422 23.105 450 HA PRO 56 HA PRO 56 -17.815 -2.429 23.462 451 1HB PRO 56 HB2 PRO 56 -16.903 -0.222 21.723 452 2HB PRO 56 HB1 PRO 56 -16.489 -0.564 23.405 453 1HG PRO 56 HG2 PRO 56 -14.743 -0.937 21.395 454 2HG PRO 56 HG1 PRO 56 -14.764 -1.973 22.833 455 1HD PRO 56 HD2 PRO 56 -15.774 -2.524 20.080 456 2HD PRO 56 HD1 PRO 56 -15.025 -3.624 21.253 457 H ILE 57 HN ILE 57 -18.413 -2.499 20.101 458 HA ILE 57 HA ILE 57 -20.619 -0.659 20.156 459 HB ILE 57 HB ILE 57 -20.177 -0.401 18.001 460 1HG1 ILE 57 HG12 ILE 57 -21.716 -2.596 17.822 461 2HG1 ILE 57 HG11 ILE 57 -20.996 -1.826 16.420 462 1HG2 ILE 57 HG21 ILE 57 -18.234 -1.383 16.975 463 2HG2 ILE 57 HG22 ILE 57 -18.205 -2.667 18.186 464 3HG2 ILE 57 HG23 ILE 57 -17.892 -0.998 18.662 465 1HD1 ILE 57 HD11 ILE 57 -19.403 -3.937 17.755 466 2HD1 ILE 57 HD12 ILE 57 -19.560 -3.530 16.047 467 3HD1 ILE 57 HD13 ILE 57 -20.837 -4.432 16.856 468 H GLN 58 HN GLN 58 -20.226 -4.116 19.387 469 HA GLN 58 HA GLN 58 -23.096 -4.503 19.646 470 1HB GLN 58 HB2 GLN 58 -22.729 -5.969 18.014 471 2HB GLN 58 HB1 GLN 58 -20.997 -5.731 18.160 472 1HG GLN 58 HG2 GLN 58 -20.747 -7.542 19.605 473 2HG GLN 58 HG1 GLN 58 -22.475 -7.606 19.962 474 1HE2 GLN 58 HE21 GLN 58 -20.934 -7.296 16.809 475 2HE2 GLN 58 HE22 GLN 58 -21.512 -8.795 16.176 476 H GLU 59 HN GLU 59 -20.152 -5.362 21.359 477 HA GLU 59 HA GLU 59 -21.272 -7.300 23.068 478 1HB GLU 59 HB2 GLU 59 -18.793 -6.802 22.626 479 2HB GLU 59 HB1 GLU 59 -18.967 -5.495 23.789 480 1HG GLU 59 HG2 GLU 59 -18.038 -7.559 24.763 481 2HG GLU 59 HG1 GLU 59 -19.538 -7.041 25.531 482 H ASN 60 HN ASN 60 -21.154 -3.827 23.095 483 HA ASN 60 HA ASN 60 -22.159 -3.675 25.791 484 1HB ASN 60 HB2 ASN 60 -21.396 -1.637 23.727 485 2HB ASN 60 HB1 ASN 60 -22.318 -1.160 25.148 486 1HD2 ASN 60 HD21 ASN 60 -19.459 -0.772 24.108 487 2HD2 ASN 60 HD22 ASN 60 -18.484 -1.099 25.495 488 H GLN 61 HN GLN 61 -23.353 -3.741 22.566 489 HA GLN 61 HA GLN 61 -25.421 -3.555 21.640 490 1HB GLN 61 HB2 GLN 61 -25.640 -5.088 24.067 491 2HB GLN 61 HB1 GLN 61 -27.129 -4.193 23.799 492 1HG GLN 61 HG2 GLN 61 -27.608 -5.303 21.847 493 2HG GLN 61 HG1 GLN 61 -25.922 -5.721 21.543 494 1HE2 GLN 61 HE21 GLN 61 -28.075 -6.196 24.322 495 2HE2 GLN 61 HE22 GLN 61 -27.857 -7.907 24.417 496 H ALA 62 HN ALA 62 -24.315 -1.195 23.084 497 HA ALA 62 HA ALA 62 -26.782 0.346 23.162 498 1HB ALA 62 HB1 ALA 62 -26.055 -0.528 25.516 499 2HB ALA 62 HB2 ALA 62 -26.608 1.135 25.315 500 3HB ALA 62 HB3 ALA 62 -24.882 0.784 25.418 501 HA PRO 63 HA PRO 63 -24.137 3.497 21.563 502 1HB PRO 63 HB2 PRO 63 -25.367 5.767 22.354 503 2HB PRO 63 HB1 PRO 63 -26.085 4.646 21.196 504 1HG PRO 63 HG2 PRO 63 -26.802 5.152 24.008 505 2HG PRO 63 HG1 PRO 63 -27.787 4.488 22.699 506 1HD PRO 63 HD2 PRO 63 -26.444 3.066 24.790 507 2HD PRO 63 HD1 PRO 63 -27.403 2.398 23.456 508 H ALA 64 HN ALA 64 -24.934 5.559 24.284 509 HA ALA 64 HA ALA 64 -22.292 6.368 24.703 510 1HB ALA 64 HB1 ALA 64 -23.245 7.911 25.992 511 2HB ALA 64 HB2 ALA 64 -23.954 6.697 27.057 512 3HB ALA 64 HB3 ALA 64 -24.791 7.172 25.578 513 HA PRO 65 HA PRO 65 -22.615 3.660 28.925 514 1HB PRO 65 HB2 PRO 65 -23.974 1.329 27.924 515 2HB PRO 65 HB1 PRO 65 -24.434 2.372 29.269 516 1HG PRO 65 HG2 PRO 65 -25.372 2.388 26.470 517 2HG PRO 65 HG1 PRO 65 -26.177 2.986 27.931 518 1HD PRO 65 HD2 PRO 65 -25.184 4.663 26.089 519 2HD PRO 65 HD1 PRO 65 -25.104 5.044 27.823 520 H ASN 66 HN ASN 66 -20.426 3.546 28.340 521 HA ASN 66 HA ASN 66 -19.652 0.988 27.144 522 1HB ASN 66 HB2 ASN 66 -18.348 3.611 26.391 523 2HB ASN 66 HB1 ASN 66 -17.935 2.017 25.771 524 1HD2 ASN 66 HD21 ASN 66 -20.366 0.937 25.253 525 2HD2 ASN 66 HD22 ASN 66 -21.164 1.840 24.016 526 H ILE 67 HN ILE 67 -16.947 1.196 27.255 527 HA ILE 67 HA ILE 67 -16.352 1.922 30.046 528 HB ILE 67 HB ILE 67 -16.667 -0.509 29.898 529 1HG1 ILE 67 HG12 ILE 67 -14.137 0.791 30.671 530 2HG1 ILE 67 HG11 ILE 67 -15.203 -0.248 31.607 531 1HG2 ILE 67 HG21 ILE 67 -14.251 -0.694 28.138 532 2HG2 ILE 67 HG22 ILE 67 -15.868 -0.532 27.450 533 3HG2 ILE 67 HG23 ILE 67 -15.482 -1.912 28.477 534 1HD1 ILE 67 HD11 ILE 67 -13.084 -1.314 31.413 535 2HD1 ILE 67 HD12 ILE 67 -13.076 -1.101 29.663 536 3HD1 ILE 67 HD13 ILE 67 -14.233 -2.202 30.411 537 H THR 68 HN THR 68 -15.739 3.748 28.265 538 HA THR 68 HA THR 68 -12.828 3.512 27.987 539 HB THR 68 HB THR 68 -13.827 3.077 25.778 540 HG1 THR 68 HG1 THR 68 -11.929 4.058 25.526 541 1HG2 THR 68 HG21 THR 68 -14.788 5.898 25.653 542 2HG2 THR 68 HG22 THR 68 -15.845 4.621 26.251 543 3HG2 THR 68 HG23 THR 68 -15.186 4.527 24.617 544 H GLY 69 HN GLY 69 -11.680 5.394 28.328 545 1HA GLY 69 HA2 GLY 69 -13.011 7.941 28.557 546 2HA GLY 69 HA1 GLY 69 -12.543 7.255 30.107 547 H ALA 70 HN ALA 70 -10.255 6.762 30.431 548 HA ALA 70 HA ALA 70 -8.437 8.233 28.664 549 1HB ALA 70 HB1 ALA 70 -8.918 9.844 30.347 550 2HB ALA 70 HB2 ALA 70 -7.313 9.198 30.688 551 3HB ALA 70 HB3 ALA 70 -8.700 8.657 31.634 Start of MODEL 9 1 1H MET 1 1H MET 1 1.203 -10.256 -10.061 2 2H MET 1 2H MET 1 2.518 -10.579 -11.116 3 3H MET 1 3H MET 1 0.984 -10.154 -11.758 4 HA MET 1 HA MET 1 1.144 -7.990 -11.058 5 1HB MET 1 HB2 MET 1 2.941 -7.246 -9.537 6 2HB MET 1 HB1 MET 1 1.920 -8.473 -8.801 7 1HG MET 1 HG2 MET 1 4.345 -9.421 -10.194 8 2HG MET 1 HG1 MET 1 4.582 -8.527 -8.693 9 1HE MET 1 HE1 MET 1 5.798 -10.855 -8.866 10 2HE MET 1 HE2 MET 1 5.022 -12.415 -8.594 11 3HE MET 1 HE3 MET 1 5.459 -11.396 -7.222 12 H ALA 2 HN ALA 2 2.226 -9.663 -13.219 13 HA ALA 2 HA ALA 2 4.307 -7.807 -14.152 14 1HB ALA 2 HB1 ALA 2 5.719 -9.555 -13.834 15 2HB ALA 2 HB2 ALA 2 5.103 -10.017 -15.420 16 3HB ALA 2 HB3 ALA 2 4.437 -10.759 -13.965 17 H ASP 3 HN ASP 3 4.466 -7.639 -16.482 18 HA ASP 3 HA ASP 3 2.172 -8.671 -17.980 19 1HB ASP 3 HB2 ASP 3 1.788 -6.425 -18.982 20 2HB ASP 3 HB1 ASP 3 1.432 -6.483 -17.258 21 H LYS 4 HN LYS 4 2.456 -7.820 -20.389 22 HA LYS 4 HA LYS 4 4.756 -9.062 -21.397 23 1HB LYS 4 HB2 LYS 4 4.079 -7.908 -23.569 24 2HB LYS 4 HB1 LYS 4 2.884 -8.965 -22.830 25 1HG LYS 4 HG2 LYS 4 2.613 -6.249 -21.885 26 2HG LYS 4 HG1 LYS 4 2.520 -6.339 -23.645 27 1HD LYS 4 HD2 LYS 4 0.894 -8.008 -21.727 28 2HD LYS 4 HD1 LYS 4 0.313 -6.568 -22.564 29 1HE LYS 4 HE2 LYS 4 1.516 -8.638 -24.278 30 2HE LYS 4 HE1 LYS 4 0.008 -9.094 -23.484 31 1HZ LYS 4 HZ1 LYS 4 -1.175 -7.636 -24.702 32 2HZ LYS 4 HZ2 LYS 4 0.105 -7.798 -25.795 33 3HZ LYS 4 HZ3 LYS 4 0.054 -6.474 -24.745 34 H THR 5 HN THR 5 5.979 -7.629 -23.254 35 HA THR 5 HA THR 5 7.558 -6.056 -23.697 36 HB THR 5 HB THR 5 6.389 -4.424 -21.440 37 HG1 THR 5 HG1 THR 5 4.669 -4.405 -22.633 38 1HG2 THR 5 HG21 THR 5 8.572 -3.892 -23.004 39 2HG2 THR 5 HG22 THR 5 7.596 -2.701 -22.147 40 3HG2 THR 5 HG23 THR 5 7.268 -3.054 -23.843 41 H ILE 6 HN ILE 6 7.192 -5.620 -20.175 42 HA ILE 6 HA ILE 6 8.796 -5.565 -18.535 43 HB ILE 6 HB ILE 6 9.983 -7.749 -18.265 44 1HG1 ILE 6 HG12 ILE 6 8.462 -8.525 -20.762 45 2HG1 ILE 6 HG11 ILE 6 10.196 -8.226 -20.707 46 1HG2 ILE 6 HG21 ILE 6 8.084 -8.006 -17.113 47 2HG2 ILE 6 HG22 ILE 6 7.560 -9.001 -18.470 48 3HG2 ILE 6 HG23 ILE 6 7.101 -7.299 -18.395 49 1HD1 ILE 6 HD11 ILE 6 10.445 -10.381 -20.279 50 2HD1 ILE 6 HD12 ILE 6 8.714 -10.596 -20.027 51 3HD1 ILE 6 HD13 ILE 6 9.741 -10.077 -18.692 52 H PHE 7 HN PHE 7 9.785 -3.881 -20.228 53 HA PHE 7 HA PHE 7 12.111 -4.430 -21.633 54 1HB PHE 7 HB2 PHE 7 10.645 -2.192 -21.186 55 2HB PHE 7 HB1 PHE 7 12.066 -1.840 -20.208 56 HD1 PHE 7 HD1 PHE 7 10.689 -1.941 -23.507 57 HD2 PHE 7 HD2 PHE 7 14.338 -1.933 -21.318 58 HE1 PHE 7 HE1 PHE 7 11.896 -1.235 -25.530 59 HE2 PHE 7 HE2 PHE 7 15.552 -1.225 -23.338 60 HZ PHE 7 HZ PHE 7 14.331 -0.875 -25.448 61 H ASN 8 HN ASN 8 14.339 -3.962 -21.132 62 HA ASN 8 HA ASN 8 15.226 -3.637 -18.445 63 1HB ASN 8 HB2 ASN 8 16.278 -5.840 -18.162 64 2HB ASN 8 HB1 ASN 8 14.528 -5.983 -18.291 65 1HD2 ASN 8 HD21 ASN 8 13.732 -6.374 -20.563 66 2HD2 ASN 8 HD22 ASN 8 14.625 -7.507 -21.512 67 H ASP 9 HN ASP 9 17.721 -4.323 -18.398 68 HA ASP 9 HA ASP 9 19.812 -3.837 -19.153 69 1HB ASP 9 HB2 ASP 9 18.730 -4.259 -21.941 70 2HB ASP 9 HB1 ASP 9 20.386 -4.473 -21.385 71 H HIS 10 HN HIS 10 20.672 -2.533 -21.509 72 HA HIS 10 HA HIS 10 20.502 0.131 -20.830 73 1HB HIS 10 HB2 HIS 10 21.338 -1.372 -23.231 74 2HB HIS 10 HB1 HIS 10 20.932 0.318 -23.507 75 HD1 HIS 10 HD1 HIS 10 23.317 -1.838 -21.534 76 HD2 HIS 10 HD2 HIS 10 22.823 2.129 -22.666 77 HE1 HIS 10 HE1 HIS 10 25.453 -0.682 -20.882 78 HE2 HIS 10 HE2 HIS 10 25.170 1.694 -21.667 79 H LEU 11 HN LEU 11 18.467 0.900 -20.413 80 HA LEU 11 HA LEU 11 16.673 1.121 -22.742 81 1HB LEU 11 HB2 LEU 11 14.770 1.015 -21.277 82 2HB LEU 11 HB1 LEU 11 15.782 -0.392 -21.003 83 HG LEU 11 HG LEU 11 16.754 1.260 -19.097 84 1HD1 LEU 11 HD11 LEU 11 14.692 2.761 -19.953 85 2HD1 LEU 11 HD12 LEU 11 15.297 2.778 -18.295 86 3HD1 LEU 11 HD13 LEU 11 13.886 1.804 -18.711 87 1HD2 LEU 11 HD21 LEU 11 15.019 0.076 -17.589 88 2HD2 LEU 11 HD22 LEU 11 16.181 -0.902 -18.484 89 3HD2 LEU 11 HD23 LEU 11 14.527 -0.740 -19.073 90 H ASN 12 HN ASN 12 15.167 3.012 -22.585 91 HA ASN 12 HA ASN 12 16.667 5.339 -21.620 92 1HB ASN 12 HB2 ASN 12 15.428 4.825 -24.054 93 2HB ASN 12 HB1 ASN 12 14.319 5.927 -23.243 94 1HD2 ASN 12 HD21 ASN 12 17.854 5.635 -23.299 95 2HD2 ASN 12 HD22 ASN 12 18.151 7.259 -23.804 96 H THR 13 HN THR 13 13.248 4.347 -21.910 97 HA THR 13 HA THR 13 12.618 4.754 -19.212 98 HB THR 13 HB THR 13 12.939 7.081 -19.459 99 HG1 THR 13 HG1 THR 13 11.095 7.268 -18.495 100 1HG2 THR 13 HG21 THR 13 11.164 7.908 -21.480 101 2HG2 THR 13 HG22 THR 13 12.208 6.666 -22.174 102 3HG2 THR 13 HG23 THR 13 12.918 8.092 -21.418 103 H ASN 14 HN ASN 14 11.302 3.014 -19.306 104 HA ASN 14 HA ASN 14 9.109 3.057 -21.264 105 1HB ASN 14 HB2 ASN 14 8.899 0.594 -20.647 106 2HB ASN 14 HB1 ASN 14 10.342 1.058 -21.544 107 1HD2 ASN 14 HD21 ASN 14 9.589 -1.101 -19.516 108 2HD2 ASN 14 HD22 ASN 14 10.904 -1.079 -18.398 109 HA PRO 15 HA PRO 15 6.071 3.928 -18.190 110 1HB PRO 15 HB2 PRO 15 4.474 1.774 -19.483 111 2HB PRO 15 HB1 PRO 15 4.035 3.451 -19.145 112 1HG PRO 15 HG2 PRO 15 4.629 2.677 -21.622 113 2HG PRO 15 HG1 PRO 15 5.153 4.258 -21.012 114 1HD PRO 15 HD2 PRO 15 6.732 1.754 -21.401 115 2HD PRO 15 HD1 PRO 15 7.216 3.444 -21.646 116 H LYS 16 HN LYS 16 6.798 0.538 -18.888 117 HA LYS 16 HA LYS 16 5.640 -0.548 -16.547 118 1HB LYS 16 HB2 LYS 16 6.657 -1.620 -18.801 119 2HB LYS 16 HB1 LYS 16 8.006 -1.901 -17.709 120 1HG LYS 16 HG2 LYS 16 5.194 -2.711 -17.035 121 2HG LYS 16 HG1 LYS 16 6.301 -3.758 -17.926 122 1HD LYS 16 HD2 LYS 16 7.458 -4.289 -16.080 123 2HD LYS 16 HD1 LYS 16 7.478 -2.620 -15.507 124 1HE LYS 16 HE2 LYS 16 6.098 -3.358 -13.905 125 2HE LYS 16 HE1 LYS 16 4.858 -3.304 -15.158 126 1HZ LYS 16 HZ1 LYS 16 5.236 -5.620 -15.625 127 2HZ LYS 16 HZ2 LYS 16 4.919 -5.433 -13.973 128 3HZ LYS 16 HZ3 LYS 16 6.504 -5.689 -14.506 129 H THR 17 HN THR 17 9.102 0.027 -17.285 130 HA THR 17 HA THR 17 9.926 -0.503 -14.629 131 HB THR 17 HB THR 17 11.341 0.984 -16.848 132 HG1 THR 17 HG1 THR 17 12.421 -1.035 -17.065 133 1HG2 THR 17 HG21 THR 17 13.001 -0.390 -14.906 134 2HG2 THR 17 HG22 THR 17 12.106 0.962 -14.213 135 3HG2 THR 17 HG23 THR 17 13.162 1.223 -15.600 136 H ASN 18 HN ASN 18 8.869 2.358 -16.303 137 HA ASN 18 HA ASN 18 9.880 4.362 -14.733 138 1HB ASN 18 HB2 ASN 18 7.570 4.043 -16.492 139 2HB ASN 18 HB1 ASN 18 7.312 5.240 -15.227 140 1HD2 ASN 18 HD21 ASN 18 8.764 7.014 -15.083 141 2HD2 ASN 18 HD22 ASN 18 9.637 7.548 -16.475 142 H LEU 19 HN LEU 19 6.604 3.046 -14.315 143 HA LEU 19 HA LEU 19 6.403 4.066 -11.649 144 1HB LEU 19 HB2 LEU 19 4.401 4.022 -12.869 145 2HB LEU 19 HB1 LEU 19 4.661 2.374 -13.406 146 HG LEU 19 HG LEU 19 4.388 2.688 -10.490 147 1HD1 LEU 19 HD11 LEU 19 2.355 3.718 -12.359 148 2HD1 LEU 19 HD12 LEU 19 2.650 4.114 -10.666 149 3HD1 LEU 19 HD13 LEU 19 1.768 2.645 -11.087 150 1HD2 LEU 19 HD21 LEU 19 2.900 0.892 -12.388 151 2HD2 LEU 19 HD22 LEU 19 3.215 0.650 -10.670 152 3HD2 LEU 19 HD23 LEU 19 4.537 0.541 -11.831 153 H ARG 20 HN ARG 20 6.818 0.893 -13.129 154 HA ARG 20 HA ARG 20 6.563 -0.729 -10.939 155 1HB ARG 20 HB2 ARG 20 6.835 -1.570 -13.217 156 2HB ARG 20 HB1 ARG 20 8.526 -1.081 -13.198 157 1HG ARG 20 HG2 ARG 20 8.486 -3.394 -12.771 158 2HG ARG 20 HG1 ARG 20 8.825 -2.604 -11.226 159 1HD ARG 20 HD2 ARG 20 5.988 -3.122 -11.928 160 2HD ARG 20 HD1 ARG 20 6.983 -4.506 -11.477 161 HE ARG 20 HE ARG 20 6.937 -2.183 -9.685 162 1HH1 ARG 20 HH11 ARG 20 5.965 -5.485 -10.321 163 2HH1 ARG 20 HH12 ARG 20 5.564 -5.809 -8.670 164 1HH2 ARG 20 HH21 ARG 20 6.409 -2.622 -7.522 165 2HH2 ARG 20 HH22 ARG 20 5.817 -4.188 -7.082 166 H LEU 21 HN LEU 21 9.279 1.322 -11.751 167 HA LEU 21 HA LEU 21 11.036 0.040 -9.861 168 1HB LEU 21 HB2 LEU 21 12.603 1.785 -10.387 169 2HB LEU 21 HB1 LEU 21 11.875 1.201 -11.874 170 HG LEU 21 HG LEU 21 10.231 3.199 -11.494 171 1HD1 LEU 21 HD11 LEU 21 11.917 3.543 -9.323 172 2HD1 LEU 21 HD12 LEU 21 10.744 4.703 -9.952 173 3HD1 LEU 21 HD13 LEU 21 12.425 4.773 -10.485 174 1HD2 LEU 21 HD21 LEU 21 11.308 4.224 -13.189 175 2HD2 LEU 21 HD22 LEU 21 12.226 2.717 -13.199 176 3HD2 LEU 21 HD23 LEU 21 12.878 4.143 -12.387 177 H TRP 22 HN TRP 22 9.029 2.970 -9.942 178 HA TRP 22 HA TRP 22 9.809 3.952 -7.404 179 1HB TRP 22 HB2 TRP 22 8.487 5.259 -9.107 180 2HB TRP 22 HB1 TRP 22 7.091 4.263 -8.708 181 HD1 TRP 22 HD1 TRP 22 9.578 6.528 -6.756 182 HE1 TRP 22 HE1 TRP 22 8.245 7.794 -4.957 183 HE3 TRP 22 HE3 TRP 22 4.955 4.515 -7.601 184 HZ2 TRP 22 HZ2 TRP 22 5.590 7.922 -4.016 185 HZ3 TRP 22 HZ3 TRP 22 3.072 5.262 -6.204 186 HH2 TRP 22 HH2 TRP 22 3.387 6.931 -4.448 187 H VAL 23 HN VAL 23 7.248 1.808 -8.523 188 HA VAL 23 HA VAL 23 6.057 1.249 -6.043 189 HB VAL 23 HB VAL 23 6.273 -0.721 -8.310 190 1HG1 VAL 23 HG11 VAL 23 5.182 -1.046 -5.869 191 2HG1 VAL 23 HG12 VAL 23 4.589 -1.855 -7.321 192 3HG1 VAL 23 HG13 VAL 23 3.798 -0.388 -6.743 193 1HG2 VAL 23 HG21 VAL 23 5.213 1.889 -8.462 194 2HG2 VAL 23 HG22 VAL 23 3.841 0.784 -8.396 195 3HG2 VAL 23 HG23 VAL 23 5.072 0.589 -9.644 196 H ALA 24 HN ALA 24 8.909 0.113 -7.637 197 HA ALA 24 HA ALA 24 9.400 -2.129 -5.905 198 1HB ALA 24 HB1 ALA 24 11.636 -2.101 -7.077 199 2HB ALA 24 HB2 ALA 24 11.045 -0.715 -7.999 200 3HB ALA 24 HB3 ALA 24 10.230 -2.277 -8.126 201 H PHE 25 HN PHE 25 10.177 1.241 -5.977 202 HA PHE 25 HA PHE 25 12.439 1.304 -4.332 203 1HB PHE 25 HB2 PHE 25 12.291 3.457 -4.913 204 2HB PHE 25 HB1 PHE 25 10.666 3.198 -5.528 205 HD1 PHE 25 HD1 PHE 25 8.907 4.353 -4.574 206 HD2 PHE 25 HD2 PHE 25 12.483 3.804 -2.333 207 HE1 PHE 25 HE1 PHE 25 8.004 5.793 -2.794 208 HE2 PHE 25 HE2 PHE 25 11.589 5.245 -0.550 209 HZ PHE 25 HZ PHE 25 9.348 6.238 -0.777 210 H GLN 26 HN GLN 26 8.998 1.497 -3.524 211 HA GLN 26 HA GLN 26 9.597 1.462 -0.668 212 1HB GLN 26 HB2 GLN 26 7.098 1.608 -0.445 213 2HB GLN 26 HB1 GLN 26 7.843 2.952 -1.302 214 1HG GLN 26 HG2 GLN 26 7.158 0.911 -3.166 215 2HG GLN 26 HG1 GLN 26 5.757 1.277 -2.160 216 1HE2 GLN 26 HE21 GLN 26 6.379 4.018 -1.691 217 2HE2 GLN 26 HE22 GLN 26 6.150 4.869 -3.177 218 H MET 27 HN MET 27 8.505 -0.610 -3.210 219 HA MET 27 HA MET 27 7.342 -2.709 -1.749 220 1HB MET 27 HB2 MET 27 6.998 -3.162 -3.946 221 2HB MET 27 HB1 MET 27 8.381 -2.194 -4.418 222 1HG MET 27 HG2 MET 27 9.577 -3.959 -4.876 223 2HG MET 27 HG1 MET 27 9.282 -4.660 -3.287 224 1HE MET 27 HE1 MET 27 6.119 -6.124 -3.307 225 2HE MET 27 HE2 MET 27 7.726 -6.006 -2.588 226 3HE MET 27 HE3 MET 27 7.299 -7.408 -3.570 227 H MET 28 HN MET 28 10.608 -1.796 -2.387 228 HA MET 28 HA MET 28 11.677 -4.251 -1.271 229 1HB MET 28 HB2 MET 28 12.449 -2.925 -3.383 230 2HB MET 28 HB1 MET 28 13.330 -1.946 -2.214 231 1HG MET 28 HG2 MET 28 13.849 -4.649 -1.585 232 2HG MET 28 HG1 MET 28 14.032 -4.473 -3.328 233 1HE MET 28 HE1 MET 28 14.916 -1.145 -3.077 234 2HE MET 28 HE2 MET 28 15.338 -2.317 -4.325 235 3HE MET 28 HE3 MET 28 16.610 -1.461 -3.451 236 H LYS 29 HN LYS 29 11.552 -0.811 -0.551 237 HA LYS 29 HA LYS 29 13.090 -1.202 1.904 238 1HB LYS 29 HB2 LYS 29 13.789 0.760 0.869 239 2HB LYS 29 HB1 LYS 29 12.174 1.169 0.317 240 1HG LYS 29 HG2 LYS 29 11.696 1.512 2.863 241 2HG LYS 29 HG1 LYS 29 13.451 1.642 2.974 242 1HD LYS 29 HD2 LYS 29 13.169 3.797 2.454 243 2HD LYS 29 HD1 LYS 29 12.840 3.238 0.814 244 1HE LYS 29 HE2 LYS 29 10.895 3.989 2.973 245 2HE LYS 29 HE1 LYS 29 11.035 4.639 1.341 246 1HZ LYS 29 HZ1 LYS 29 9.511 2.425 2.269 247 2HZ LYS 29 HZ2 LYS 29 10.539 1.954 1.014 248 3HZ LYS 29 HZ3 LYS 29 9.445 3.221 0.777 249 H GLY 30 HN GLY 30 9.971 0.053 0.866 250 1HA GLY 30 HA2 GLY 30 8.849 0.392 3.420 251 2HA GLY 30 HA1 GLY 30 7.966 0.229 1.908 252 H ALA 31 HN ALA 31 9.395 -2.429 1.523 253 HA ALA 31 HA ALA 31 7.335 -4.022 2.737 254 1HB ALA 31 HB1 ALA 31 8.477 -5.891 1.525 255 2HB ALA 31 HB2 ALA 31 9.658 -4.710 0.943 256 3HB ALA 31 HB3 ALA 31 7.951 -4.548 0.505 257 H GLY 32 HN GLY 32 10.910 -4.175 2.855 258 1HA GLY 32 HA2 GLY 32 10.913 -6.072 4.983 259 2HA GLY 32 HA1 GLY 32 12.303 -5.176 4.392 260 H TRP 33 HN TRP 33 12.251 -2.780 5.031 261 HA TRP 33 HA TRP 33 12.581 -2.509 7.733 262 1HB TRP 33 HB2 TRP 33 13.377 -0.891 6.042 263 2HB TRP 33 HB1 TRP 33 11.725 -0.321 5.827 264 HD1 TRP 33 HD1 TRP 33 11.530 1.969 6.945 265 HE1 TRP 33 HE1 TRP 33 12.294 3.011 9.171 266 HE3 TRP 33 HE3 TRP 33 14.162 -1.987 8.829 267 HZ2 TRP 33 HZ2 TRP 33 13.811 2.254 11.428 268 HZ3 TRP 33 HZ3 TRP 33 15.241 -1.746 11.028 269 HH2 TRP 33 HH2 TRP 33 15.068 0.331 12.298 270 H ALA 34 HN ALA 34 9.774 -1.115 5.997 271 HA ALA 34 HA ALA 34 8.307 -0.379 8.216 272 1HB ALA 34 HB1 ALA 34 6.643 -1.439 6.055 273 2HB ALA 34 HB2 ALA 34 7.887 -0.311 5.515 274 3HB ALA 34 HB3 ALA 34 6.720 0.185 6.739 275 H GLY 35 HN GLY 35 7.749 -3.377 6.340 276 1HA GLY 35 HA2 GLY 35 5.908 -4.744 7.574 277 2HA GLY 35 HA1 GLY 35 7.454 -5.525 7.289 278 H GLY 36 HN GLY 36 9.116 -4.501 9.115 279 1HA GLY 36 HA2 GLY 36 8.137 -5.676 11.552 280 2HA GLY 36 HA1 GLY 36 9.747 -5.037 11.273 281 H VAL 37 HN VAL 37 9.135 -2.386 10.592 282 HA VAL 37 HA VAL 37 8.671 -1.309 13.186 283 HB VAL 37 HB VAL 37 8.890 0.208 10.591 284 1HG1 VAL 37 HG11 VAL 37 8.178 1.150 13.025 285 2HG1 VAL 37 HG12 VAL 37 9.020 2.100 11.802 286 3HG1 VAL 37 HG13 VAL 37 9.930 1.330 13.101 287 1HG2 VAL 37 HG21 VAL 37 10.836 -1.151 10.712 288 2HG2 VAL 37 HG22 VAL 37 11.037 -0.823 12.433 289 3HG2 VAL 37 HG23 VAL 37 11.306 0.459 11.254 290 H PHE 38 HN PHE 38 7.029 -0.909 10.072 291 HA PHE 38 HA PHE 38 4.909 0.565 11.076 292 1HB PHE 38 HB2 PHE 38 5.615 0.256 8.649 293 2HB PHE 38 HB1 PHE 38 4.687 -1.237 8.689 294 HD1 PHE 38 HD1 PHE 38 3.883 0.469 6.675 295 HD2 PHE 38 HD2 PHE 38 2.900 0.749 10.808 296 HE1 PHE 38 HE1 PHE 38 1.851 1.729 6.104 297 HE2 PHE 38 HE2 PHE 38 0.866 2.010 10.242 298 HZ PHE 38 HZ PHE 38 0.339 2.501 7.886 299 H PHE 39 HN PHE 39 4.854 -2.913 10.139 300 HA PHE 39 HA PHE 39 2.317 -3.481 11.002 301 1HB PHE 39 HB2 PHE 39 4.109 -4.972 9.857 302 2HB PHE 39 HB1 PHE 39 4.508 -5.451 11.504 303 HD1 PHE 39 HD1 PHE 39 1.688 -5.234 9.103 304 HD2 PHE 39 HD2 PHE 39 3.278 -7.114 12.573 305 HE1 PHE 39 HE1 PHE 39 -0.156 -6.862 9.058 306 HE2 PHE 39 HE2 PHE 39 1.437 -8.747 12.536 307 HZ PHE 39 HZ PHE 39 -0.282 -8.622 10.776 308 H GLY 40 HN GLY 40 5.269 -3.291 12.979 309 1HA GLY 40 HA2 GLY 40 4.283 -4.335 15.361 310 2HA GLY 40 HA1 GLY 40 5.466 -3.033 15.269 311 H THR 41 HN THR 41 3.990 -1.058 14.079 312 HA THR 41 HA THR 41 2.349 -0.160 16.286 313 HB THR 41 HB THR 41 3.007 1.134 13.639 314 HG1 THR 41 HG1 THR 41 4.167 1.614 16.182 315 1HG2 THR 41 HG21 THR 41 2.266 3.182 14.467 316 2HG2 THR 41 HG22 THR 41 2.191 2.590 16.126 317 3HG2 THR 41 HG23 THR 41 1.005 2.043 14.942 318 H LEU 42 HN LEU 42 1.908 -0.591 12.809 319 HA LEU 42 HA LEU 42 -0.743 -0.010 12.502 320 1HB LEU 42 HB2 LEU 42 0.175 -0.379 10.484 321 2HB LEU 42 HB1 LEU 42 1.307 -1.558 11.122 322 HG LEU 42 HG LEU 42 -0.195 -3.340 10.820 323 1HD1 LEU 42 HD11 LEU 42 -2.499 -2.411 9.620 324 2HD1 LEU 42 HD12 LEU 42 -2.224 -1.244 10.913 325 3HD1 LEU 42 HD13 LEU 42 -2.355 -2.961 11.290 326 1HD2 LEU 42 HD21 LEU 42 0.010 -1.424 8.549 327 2HD2 LEU 42 HD22 LEU 42 -0.947 -2.893 8.353 328 3HD2 LEU 42 HD23 LEU 42 0.764 -3.004 8.769 329 H LEU 43 HN LEU 43 0.678 -3.112 13.379 330 HA LEU 43 HA LEU 43 -1.809 -4.439 13.540 331 1HB LEU 43 HB2 LEU 43 -0.494 -6.220 13.535 332 2HB LEU 43 HB1 LEU 43 0.879 -5.134 13.481 333 HG LEU 43 HG LEU 43 -0.357 -6.145 16.047 334 1HD1 LEU 43 HD11 LEU 43 2.146 -7.141 14.699 335 2HD1 LEU 43 HD12 LEU 43 0.588 -7.967 14.630 336 3HD1 LEU 43 HD13 LEU 43 1.405 -7.752 16.179 337 1HD2 LEU 43 HD21 LEU 43 2.412 -5.370 16.145 338 2HD2 LEU 43 HD22 LEU 43 1.046 -4.779 17.092 339 3HD2 LEU 43 HD23 LEU 43 1.416 -4.052 15.530 340 H LEU 44 HN LEU 44 0.189 -2.573 15.764 341 HA LEU 44 HA LEU 44 -1.219 -3.473 18.099 342 1HB LEU 44 HB2 LEU 44 1.101 -2.153 17.738 343 2HB LEU 44 HB1 LEU 44 0.053 -0.803 18.127 344 HG LEU 44 HG LEU 44 -0.339 -1.559 20.291 345 1HD1 LEU 44 HD11 LEU 44 -1.050 -3.761 20.047 346 2HD1 LEU 44 HD12 LEU 44 0.445 -3.916 20.973 347 3HD1 LEU 44 HD13 LEU 44 0.439 -4.254 19.242 348 1HD2 LEU 44 HD21 LEU 44 1.819 -0.791 20.436 349 2HD2 LEU 44 HD22 LEU 44 2.457 -2.065 19.396 350 3HD2 LEU 44 HD23 LEU 44 2.004 -2.430 21.061 351 H ILE 45 HN ILE 45 -1.390 -0.590 16.092 352 HA ILE 45 HA ILE 45 -3.610 0.554 17.496 353 HB ILE 45 HB ILE 45 -1.956 1.272 15.116 354 1HG1 ILE 45 HG12 ILE 45 -2.810 2.906 17.507 355 2HG1 ILE 45 HG11 ILE 45 -1.357 1.908 17.464 356 1HG2 ILE 45 HG21 ILE 45 -4.753 2.121 15.562 357 2HG2 ILE 45 HG22 ILE 45 -3.834 1.944 14.061 358 3HG2 ILE 45 HG23 ILE 45 -3.594 3.365 15.082 359 1HD1 ILE 45 HD11 ILE 45 -0.522 3.243 15.585 360 2HD1 ILE 45 HD12 ILE 45 -0.805 4.213 17.032 361 3HD1 ILE 45 HD13 ILE 45 -1.956 4.266 15.695 362 H GLY 46 HN GLY 46 -3.098 -0.940 14.332 363 1HA GLY 46 HA2 GLY 46 -5.735 -0.655 13.404 364 2HA GLY 46 HA1 GLY 46 -4.530 -1.765 12.764 365 H PHE 47 HN PHE 47 -4.016 -3.288 15.021 366 HA PHE 47 HA PHE 47 -6.190 -5.065 14.891 367 1HB PHE 47 HB2 PHE 47 -3.754 -5.656 15.339 368 2HB PHE 47 HB1 PHE 47 -4.041 -5.128 16.997 369 HD1 PHE 47 HD1 PHE 47 -4.264 -7.827 14.694 370 HD2 PHE 47 HD2 PHE 47 -5.918 -6.280 18.296 371 HE1 PHE 47 HE1 PHE 47 -5.124 -10.063 15.253 372 HE2 PHE 47 HE2 PHE 47 -6.781 -8.513 18.862 373 HZ PHE 47 HZ PHE 47 -6.384 -10.409 17.340 374 H PHE 48 HN PHE 48 -5.234 -2.557 17.089 375 HA PHE 48 HA PHE 48 -7.081 -3.226 19.166 376 1HB PHE 48 HB2 PHE 48 -5.273 -0.909 18.554 377 2HB PHE 48 HB1 PHE 48 -6.517 -0.730 19.788 378 HD1 PHE 48 HD1 PHE 48 -4.968 -3.990 19.296 379 HD2 PHE 48 HD2 PHE 48 -4.805 -0.341 21.480 380 HE1 PHE 48 HE1 PHE 48 -3.488 -5.051 20.951 381 HE2 PHE 48 HE2 PHE 48 -3.325 -1.395 23.138 382 HZ PHE 48 HZ PHE 48 -2.665 -3.754 22.874 383 H ARG 49 HN ARG 49 -7.135 -1.259 16.290 384 HA ARG 49 HA ARG 49 -9.498 0.165 17.011 385 1HB ARG 49 HB2 ARG 49 -9.290 1.304 15.011 386 2HB ARG 49 HB1 ARG 49 -7.628 0.859 15.360 387 1HG ARG 49 HG2 ARG 49 -7.515 -0.005 13.328 388 2HG ARG 49 HG1 ARG 49 -8.642 -1.254 13.849 389 1HD ARG 49 HD2 ARG 49 -9.504 -0.229 11.859 390 2HD ARG 49 HD1 ARG 49 -10.513 0.255 13.223 391 HE ARG 49 HE ARG 49 -9.788 2.427 12.969 392 1HH1 ARG 49 HH11 ARG 49 -7.869 0.317 10.957 393 2HH1 ARG 49 HH12 ARG 49 -7.131 1.617 10.084 394 1HH2 ARG 49 HH21 ARG 49 -8.817 4.135 11.825 395 2HH2 ARG 49 HH22 ARG 49 -7.670 3.784 10.574 396 H VAL 50 HN VAL 50 -8.830 -2.835 15.386 397 HA VAL 50 HA VAL 50 -11.472 -3.104 14.254 398 HB VAL 50 HB VAL 50 -9.632 -5.426 14.661 399 1HG1 VAL 50 HG11 VAL 50 -10.620 -6.246 12.646 400 2HG1 VAL 50 HG12 VAL 50 -11.416 -4.701 12.352 401 3HG1 VAL 50 HG13 VAL 50 -11.911 -5.700 13.717 402 1HG2 VAL 50 HG21 VAL 50 -7.975 -4.474 13.527 403 2HG2 VAL 50 HG22 VAL 50 -8.940 -3.031 13.226 404 3HG2 VAL 50 HG23 VAL 50 -9.045 -4.403 12.126 405 H VAL 51 HN VAL 51 -9.868 -4.082 17.221 406 HA VAL 51 HA VAL 51 -11.850 -6.021 17.879 407 HB VAL 51 HB VAL 51 -10.023 -4.596 19.811 408 1HG1 VAL 51 HG11 VAL 51 -10.532 -7.317 20.455 409 2HG1 VAL 51 HG12 VAL 51 -12.076 -6.530 20.129 410 3HG1 VAL 51 HG13 VAL 51 -10.991 -5.870 21.352 411 1HG2 VAL 51 HG21 VAL 51 -8.283 -5.694 18.960 412 2HG2 VAL 51 HG22 VAL 51 -9.314 -6.217 17.627 413 3HG2 VAL 51 HG23 VAL 51 -9.149 -7.228 19.064 414 H GLY 52 HN GLY 52 -11.878 -2.669 17.819 415 1HA GLY 52 HA2 GLY 52 -14.173 -2.609 19.675 416 2HA GLY 52 HA1 GLY 52 -13.063 -1.260 19.472 417 H ARG 53 HN ARG 53 -13.514 -2.685 16.480 418 HA ARG 53 HA ARG 53 -16.014 -1.421 15.823 419 1HB ARG 53 HB2 ARG 53 -14.293 0.447 15.881 420 2HB ARG 53 HB1 ARG 53 -13.554 -0.320 14.482 421 1HG ARG 53 HG2 ARG 53 -15.685 -0.078 13.266 422 2HG ARG 53 HG1 ARG 53 -16.350 0.779 14.656 423 1HD ARG 53 HD2 ARG 53 -14.838 2.577 14.388 424 2HD ARG 53 HD1 ARG 53 -13.846 1.668 13.248 425 HE ARG 53 HE ARG 53 -16.133 3.230 12.637 426 1HH1 ARG 53 HH11 ARG 53 -14.468 0.303 11.725 427 2HH1 ARG 53 HH12 ARG 53 -15.079 0.311 10.104 428 1HH2 ARG 53 HH21 ARG 53 -16.940 3.243 10.507 429 2HH2 ARG 53 HH22 ARG 53 -16.485 1.979 9.414 430 H MET 54 HN MET 54 -15.166 -4.064 15.606 431 HA MET 54 HA MET 54 -16.005 -4.840 13.119 432 1HB MET 54 HB2 MET 54 -13.208 -3.961 13.087 433 2HB MET 54 HB1 MET 54 -13.436 -5.585 12.456 434 1HG MET 54 HG2 MET 54 -15.453 -4.176 11.242 435 2HG MET 54 HG1 MET 54 -14.129 -3.014 11.290 436 1HE MET 54 HE1 MET 54 -11.236 -4.807 9.861 437 2HE MET 54 HE2 MET 54 -11.915 -3.446 10.753 438 3HE MET 54 HE3 MET 54 -11.947 -3.449 8.990 439 H LEU 55 HN LEU 55 -16.362 -5.849 15.604 440 HA LEU 55 HA LEU 55 -15.442 -8.555 15.257 441 1HB LEU 55 HB2 LEU 55 -13.628 -8.236 16.556 442 2HB LEU 55 HB1 LEU 55 -14.267 -6.778 17.281 443 HG LEU 55 HG LEU 55 -15.727 -8.270 18.717 444 1HD1 LEU 55 HD11 LEU 55 -15.013 -10.236 17.008 445 2HD1 LEU 55 HD12 LEU 55 -15.596 -10.513 18.650 446 3HD1 LEU 55 HD13 LEU 55 -13.863 -10.506 18.318 447 1HD2 LEU 55 HD21 LEU 55 -14.073 -7.468 20.022 448 2HD2 LEU 55 HD22 LEU 55 -12.810 -7.898 18.866 449 3HD2 LEU 55 HD23 LEU 55 -13.480 -9.127 19.939 450 HA PRO 56 HA PRO 56 -18.802 -8.378 18.751 451 1HB PRO 56 HB2 PRO 56 -19.535 -5.518 18.788 452 2HB PRO 56 HB1 PRO 56 -19.258 -6.621 20.140 453 1HG PRO 56 HG2 PRO 56 -17.518 -4.671 19.525 454 2HG PRO 56 HG1 PRO 56 -16.984 -6.239 20.156 455 1HD PRO 56 HD2 PRO 56 -16.941 -5.207 17.350 456 2HD PRO 56 HD1 PRO 56 -15.739 -6.185 18.213 457 H ILE 57 HN ILE 57 -18.620 -6.485 15.894 458 HA ILE 57 HA ILE 57 -21.434 -6.451 15.342 459 HB ILE 57 HB ILE 57 -20.986 -5.037 13.639 460 1HG1 ILE 57 HG12 ILE 57 -19.880 -6.889 12.282 461 2HG1 ILE 57 HG11 ILE 57 -19.312 -5.259 11.960 462 1HG2 ILE 57 HG21 ILE 57 -18.237 -4.945 14.825 463 2HG2 ILE 57 HG22 ILE 57 -19.667 -4.300 15.629 464 3HG2 ILE 57 HG23 ILE 57 -19.144 -3.626 14.084 465 1HD1 ILE 57 HD11 ILE 57 -17.647 -6.277 13.979 466 2HD1 ILE 57 HD12 ILE 57 -17.251 -5.967 12.287 467 3HD1 ILE 57 HD13 ILE 57 -17.831 -7.554 12.778 468 H GLN 58 HN GLN 58 -18.624 -8.291 14.365 469 HA GLN 58 HA GLN 58 -20.221 -9.935 12.605 470 1HB GLN 58 HB2 GLN 58 -18.203 -10.921 11.838 471 2HB GLN 58 HB1 GLN 58 -17.873 -9.205 11.999 472 1HG GLN 58 HG2 GLN 58 -16.709 -9.580 14.078 473 2HG GLN 58 HG1 GLN 58 -17.136 -11.293 14.037 474 1HE2 GLN 58 HE21 GLN 58 -16.608 -12.066 11.547 475 2HE2 GLN 58 HE22 GLN 58 -14.940 -11.847 11.160 476 H GLU 59 HN GLU 59 -19.342 -9.806 15.833 477 HA GLU 59 HA GLU 59 -18.945 -12.466 16.559 478 1HB GLU 59 HB2 GLU 59 -18.759 -10.326 17.985 479 2HB GLU 59 HB1 GLU 59 -20.497 -10.470 18.208 480 1HG GLU 59 HG2 GLU 59 -19.226 -12.982 18.759 481 2HG GLU 59 HG1 GLU 59 -18.466 -11.695 19.695 482 H ASN 60 HN ASN 60 -21.699 -10.691 15.546 483 HA ASN 60 HA ASN 60 -23.764 -12.272 16.540 484 1HB ASN 60 HB2 ASN 60 -24.116 -10.056 15.552 485 2HB ASN 60 HB1 ASN 60 -23.617 -10.668 13.978 486 1HD2 ASN 60 HD21 ASN 60 -26.046 -10.975 16.505 487 2HD2 ASN 60 HD22 ASN 60 -27.317 -11.525 15.473 488 H GLN 61 HN GLN 61 -21.431 -12.826 14.095 489 HA GLN 61 HA GLN 61 -20.933 -14.660 12.854 490 1HB GLN 61 HB2 GLN 61 -22.025 -15.851 14.885 491 2HB GLN 61 HB1 GLN 61 -23.418 -16.044 13.830 492 1HG GLN 61 HG2 GLN 61 -22.156 -18.036 13.693 493 2HG GLN 61 HG1 GLN 61 -21.905 -17.164 12.183 494 1HE2 GLN 61 HE21 GLN 61 -20.464 -16.971 15.421 495 2HE2 GLN 61 HE22 GLN 61 -18.828 -17.124 14.890 496 H ALA 62 HN ALA 62 -22.620 -12.483 11.944 497 HA ALA 62 HA ALA 62 -23.649 -13.754 9.553 498 1HB ALA 62 HB1 ALA 62 -25.390 -12.933 11.681 499 2HB ALA 62 HB2 ALA 62 -25.783 -13.744 10.165 500 3HB ALA 62 HB3 ALA 62 -25.712 -11.983 10.231 501 HA PRO 63 HA PRO 63 -21.770 -10.078 7.902 502 1HB PRO 63 HB2 PRO 63 -22.970 -10.155 5.423 503 2HB PRO 63 HB1 PRO 63 -21.531 -11.075 5.870 504 1HG PRO 63 HG2 PRO 63 -24.382 -11.955 5.743 505 2HG PRO 63 HG1 PRO 63 -22.913 -12.833 5.280 506 1HD PRO 63 HD2 PRO 63 -24.212 -13.326 7.590 507 2HD PRO 63 HD1 PRO 63 -22.448 -13.452 7.455 508 H ALA 64 HN ALA 64 -24.921 -10.171 6.284 509 HA ALA 64 HA ALA 64 -25.848 -7.914 7.876 510 1HB ALA 64 HB1 ALA 64 -24.658 -6.820 6.088 511 2HB ALA 64 HB2 ALA 64 -26.391 -6.587 5.866 512 3HB ALA 64 HB3 ALA 64 -25.526 -7.769 4.882 513 HA PRO 65 HA PRO 65 -29.242 -10.720 6.223 514 1HB PRO 65 HB2 PRO 65 -29.199 -12.604 8.338 515 2HB PRO 65 HB1 PRO 65 -28.661 -12.862 6.679 516 1HG PRO 65 HG2 PRO 65 -27.024 -12.857 8.933 517 2HG PRO 65 HG1 PRO 65 -26.472 -12.692 7.259 518 1HD PRO 65 HD2 PRO 65 -26.943 -10.580 9.320 519 2HD PRO 65 HD1 PRO 65 -25.675 -10.696 8.086 520 H ASN 66 HN ASN 66 -28.440 -9.383 9.298 521 HA ASN 66 HA ASN 66 -31.241 -9.409 10.166 522 1HB ASN 66 HB2 ASN 66 -28.919 -8.414 11.806 523 2HB ASN 66 HB1 ASN 66 -30.484 -8.994 12.362 524 1HD2 ASN 66 HD21 ASN 66 -27.782 -9.817 13.117 525 2HD2 ASN 66 HD22 ASN 66 -27.699 -11.515 12.810 526 H ILE 67 HN ILE 67 -32.441 -7.607 10.078 527 HA ILE 67 HA ILE 67 -31.097 -5.130 9.258 528 HB ILE 67 HB ILE 67 -34.058 -5.674 9.145 529 1HG1 ILE 67 HG12 ILE 67 -32.121 -5.963 6.846 530 2HG1 ILE 67 HG11 ILE 67 -32.640 -7.330 7.826 531 1HG2 ILE 67 HG21 ILE 67 -33.781 -3.397 8.920 532 2HG2 ILE 67 HG22 ILE 67 -33.731 -3.932 7.239 533 3HG2 ILE 67 HG23 ILE 67 -32.232 -3.560 8.091 534 1HD1 ILE 67 HD11 ILE 67 -33.841 -6.629 5.562 535 2HD1 ILE 67 HD12 ILE 67 -34.767 -5.630 6.684 536 3HD1 ILE 67 HD13 ILE 67 -34.701 -7.379 6.907 537 H THR 68 HN THR 68 -31.461 -3.184 10.294 538 HA THR 68 HA THR 68 -32.709 -3.398 12.952 539 HB THR 68 HB THR 68 -30.574 -2.868 13.552 540 HG1 THR 68 HG1 THR 68 -31.238 -1.058 14.380 541 1HG2 THR 68 HG21 THR 68 -30.287 -1.709 10.830 542 2HG2 THR 68 HG22 THR 68 -29.285 -2.892 11.669 543 3HG2 THR 68 HG23 THR 68 -29.193 -1.187 12.111 544 H GLY 69 HN GLY 69 -31.725 -0.466 11.226 545 1HA GLY 69 HA2 GLY 69 -32.909 1.428 10.701 546 2HA GLY 69 HA1 GLY 69 -34.150 0.316 10.146 547 H ALA 70 HN ALA 70 -33.180 2.521 12.598 548 HA ALA 70 HA ALA 70 -35.472 1.835 14.286 549 1HB ALA 70 HB1 ALA 70 -34.362 2.735 16.030 550 2HB ALA 70 HB2 ALA 70 -33.718 4.067 15.073 551 3HB ALA 70 HB3 ALA 70 -32.956 2.479 14.998 Start of MODEL 10 1 1H MET 1 1H MET 1 6.722 -14.091 -27.820 2 2H MET 1 2H MET 1 5.846 -15.493 -27.363 3 3H MET 1 3H MET 1 7.303 -15.087 -26.554 4 HA MET 1 HA MET 1 4.702 -13.731 -26.455 5 1HB MET 1 HB2 MET 1 6.450 -15.321 -24.631 6 2HB MET 1 HB1 MET 1 5.467 -14.043 -23.928 7 1HG MET 1 HG2 MET 1 4.201 -16.037 -25.744 8 2HG MET 1 HG1 MET 1 4.562 -16.478 -24.075 9 1HE MET 1 HE1 MET 1 0.727 -14.981 -25.271 10 2HE MET 1 HE2 MET 1 1.458 -16.570 -25.046 11 3HE MET 1 HE3 MET 1 2.032 -15.510 -26.332 12 H ALA 2 HN ALA 2 7.767 -13.490 -24.667 13 HA ALA 2 HA ALA 2 8.400 -10.880 -25.585 14 1HB ALA 2 HB1 ALA 2 7.664 -10.664 -22.739 15 2HB ALA 2 HB2 ALA 2 6.321 -10.773 -23.877 16 3HB ALA 2 HB3 ALA 2 7.518 -9.489 -24.046 17 H ASP 3 HN ASP 3 10.048 -9.829 -23.982 18 HA ASP 3 HA ASP 3 11.856 -11.980 -23.117 19 1HB ASP 3 HB2 ASP 3 13.657 -10.287 -23.347 20 2HB ASP 3 HB1 ASP 3 12.795 -10.569 -24.856 21 H LYS 4 HN LYS 4 13.523 -10.902 -21.410 22 HA LYS 4 HA LYS 4 12.064 -10.679 -19.016 23 1HB LYS 4 HB2 LYS 4 14.907 -10.502 -19.811 24 2HB LYS 4 HB1 LYS 4 14.484 -9.700 -18.304 25 1HG LYS 4 HG2 LYS 4 13.543 -12.486 -18.747 26 2HG LYS 4 HG1 LYS 4 15.240 -12.212 -18.348 27 1HD LYS 4 HD2 LYS 4 14.386 -12.420 -16.241 28 2HD LYS 4 HD1 LYS 4 14.174 -10.682 -16.469 29 1HE LYS 4 HE2 LYS 4 12.173 -11.836 -15.538 30 2HE LYS 4 HE1 LYS 4 11.868 -10.973 -17.044 31 1HZ LYS 4 HZ1 LYS 4 11.642 -12.915 -18.218 32 2HZ LYS 4 HZ2 LYS 4 10.986 -13.374 -16.728 33 3HZ LYS 4 HZ3 LYS 4 12.565 -13.827 -17.132 34 H THR 5 HN THR 5 12.566 -8.793 -17.437 35 HA THR 5 HA THR 5 12.322 -6.608 -16.850 36 HB THR 5 HB THR 5 12.734 -5.551 -19.590 37 HG1 THR 5 HG1 THR 5 14.497 -6.599 -19.930 38 1HG2 THR 5 HG21 THR 5 13.677 -4.888 -16.841 39 2HG2 THR 5 HG22 THR 5 12.850 -3.873 -18.022 40 3HG2 THR 5 HG23 THR 5 14.548 -4.288 -18.251 41 H ILE 6 HN ILE 6 11.160 -6.717 -20.225 42 HA ILE 6 HA ILE 6 8.856 -5.154 -19.643 43 HB ILE 6 HB ILE 6 9.883 -5.207 -21.881 44 1HG1 ILE 6 HG12 ILE 6 7.128 -6.308 -22.268 45 2HG1 ILE 6 HG11 ILE 6 7.327 -4.828 -21.335 46 1HG2 ILE 6 HG21 ILE 6 8.608 -7.756 -22.617 47 2HG2 ILE 6 HG22 ILE 6 10.035 -7.882 -21.589 48 3HG2 ILE 6 HG23 ILE 6 10.139 -7.055 -23.144 49 1HD1 ILE 6 HD11 ILE 6 7.886 -3.602 -23.148 50 2HD1 ILE 6 HD12 ILE 6 6.934 -4.843 -23.963 51 3HD1 ILE 6 HD13 ILE 6 8.695 -4.949 -23.949 52 H PHE 7 HN PHE 7 6.652 -5.794 -19.734 53 HA PHE 7 HA PHE 7 5.966 -7.988 -18.187 54 1HB PHE 7 HB2 PHE 7 3.643 -7.621 -19.013 55 2HB PHE 7 HB1 PHE 7 4.434 -6.143 -18.474 56 HD1 PHE 7 HD1 PHE 7 5.184 -4.473 -20.106 57 HD2 PHE 7 HD2 PHE 7 3.004 -7.929 -21.287 58 HE1 PHE 7 HE1 PHE 7 4.684 -3.412 -22.268 59 HE2 PHE 7 HE2 PHE 7 2.502 -6.878 -23.453 60 HZ PHE 7 HZ PHE 7 3.342 -4.614 -23.946 61 H ASN 8 HN ASN 8 5.034 -10.007 -18.647 62 HA ASN 8 HA ASN 8 6.169 -11.353 -20.880 63 1HB ASN 8 HB2 ASN 8 4.237 -12.174 -18.721 64 2HB ASN 8 HB1 ASN 8 4.670 -13.267 -20.033 65 1HD2 ASN 8 HD21 ASN 8 5.164 -13.567 -17.209 66 2HD2 ASN 8 HD22 ASN 8 6.876 -13.689 -17.016 67 H ASP 9 HN ASP 9 2.839 -10.438 -20.035 68 HA ASP 9 HA ASP 9 1.001 -10.073 -21.328 69 1HB ASP 9 HB2 ASP 9 2.992 -9.118 -22.870 70 2HB ASP 9 HB1 ASP 9 2.428 -10.423 -23.906 71 H HIS 10 HN HIS 10 0.518 -12.271 -20.469 72 HA HIS 10 HA HIS 10 0.916 -14.597 -22.006 73 1HB HIS 10 HB2 HIS 10 -0.384 -13.896 -19.556 74 2HB HIS 10 HB1 HIS 10 -1.488 -14.879 -20.513 75 HD1 HIS 10 HD1 HIS 10 -0.528 -17.272 -21.258 76 HD2 HIS 10 HD2 HIS 10 1.608 -15.283 -18.301 77 HE1 HIS 10 HE1 HIS 10 0.932 -19.021 -20.192 78 HE2 HIS 10 HE2 HIS 10 2.264 -17.780 -18.451 79 H LEU 11 HN LEU 11 -1.876 -12.414 -21.746 80 HA LEU 11 HA LEU 11 -2.770 -13.381 -24.376 81 1HB LEU 11 HB2 LEU 11 -4.837 -12.571 -22.399 82 2HB LEU 11 HB1 LEU 11 -4.939 -13.723 -23.716 83 HG LEU 11 HG LEU 11 -3.275 -15.096 -22.160 84 1HD1 LEU 11 HD11 LEU 11 -4.716 -13.226 -20.305 85 2HD1 LEU 11 HD12 LEU 11 -2.991 -13.585 -20.384 86 3HD1 LEU 11 HD13 LEU 11 -4.119 -14.801 -19.783 87 1HD2 LEU 11 HD21 LEU 11 -5.138 -16.372 -21.421 88 2HD2 LEU 11 HD22 LEU 11 -5.557 -15.719 -23.007 89 3HD2 LEU 11 HD23 LEU 11 -6.220 -14.984 -21.547 90 H ASN 12 HN ASN 12 -3.568 -10.905 -21.936 91 HA ASN 12 HA ASN 12 -2.770 -8.713 -23.493 92 1HB ASN 12 HB2 ASN 12 -5.007 -7.789 -24.080 93 2HB ASN 12 HB1 ASN 12 -4.612 -9.260 -24.964 94 1HD2 ASN 12 HD21 ASN 12 -5.633 -11.214 -24.359 95 2HD2 ASN 12 HD22 ASN 12 -7.146 -11.201 -23.523 96 H THR 13 HN THR 13 -2.577 -9.587 -20.812 97 HA THR 13 HA THR 13 -4.203 -7.613 -19.362 98 HB THR 13 HB THR 13 -3.095 -9.032 -17.374 99 HG1 THR 13 HG1 THR 13 -1.979 -10.521 -18.482 100 1HG2 THR 13 HG21 THR 13 -5.130 -9.910 -17.000 101 2HG2 THR 13 HG22 THR 13 -5.303 -10.498 -18.654 102 3HG2 THR 13 HG23 THR 13 -5.598 -8.798 -18.286 103 H ASN 14 HN ASN 14 -3.042 -5.759 -19.614 104 HA ASN 14 HA ASN 14 -0.193 -5.682 -19.230 105 1HB ASN 14 HB2 ASN 14 -1.903 -4.123 -20.633 106 2HB ASN 14 HB1 ASN 14 -1.705 -3.144 -19.183 107 1HD2 ASN 14 HD21 ASN 14 -0.255 -1.632 -19.499 108 2HD2 ASN 14 HD22 ASN 14 1.238 -1.807 -20.349 109 HA PRO 15 HA PRO 15 -2.023 -3.316 -15.198 110 1HB PRO 15 HB2 PRO 15 -3.738 -5.690 -14.584 111 2HB PRO 15 HB1 PRO 15 -3.982 -3.988 -14.168 112 1HG PRO 15 HG2 PRO 15 -5.345 -5.084 -16.164 113 2HG PRO 15 HG1 PRO 15 -4.712 -3.433 -16.303 114 1HD PRO 15 HD2 PRO 15 -3.732 -5.953 -17.553 115 2HD PRO 15 HD1 PRO 15 -3.713 -4.295 -18.188 116 H LYS 16 HN LYS 16 -1.257 -6.661 -15.869 117 HA LYS 16 HA LYS 16 -0.434 -7.602 -13.407 118 1HB LYS 16 HB2 LYS 16 -0.151 -8.390 -16.104 119 2HB LYS 16 HB1 LYS 16 1.469 -8.399 -15.420 120 1HG LYS 16 HG2 LYS 16 -0.936 -9.897 -14.407 121 2HG LYS 16 HG1 LYS 16 0.502 -10.575 -15.173 122 1HD LYS 16 HD2 LYS 16 1.581 -10.646 -13.225 123 2HD LYS 16 HD1 LYS 16 1.232 -8.946 -12.910 124 1HE LYS 16 HE2 LYS 16 -0.680 -11.220 -12.394 125 2HE LYS 16 HE1 LYS 16 0.349 -10.476 -11.171 126 1HZ LYS 16 HZ1 LYS 16 -1.937 -9.600 -11.189 127 2HZ LYS 16 HZ2 LYS 16 -1.692 -9.018 -12.758 128 3HZ LYS 16 HZ3 LYS 16 -0.779 -8.398 -11.476 129 H THR 17 HN THR 17 1.076 -5.216 -15.444 130 HA THR 17 HA THR 17 3.548 -5.284 -13.915 131 HB THR 17 HB THR 17 2.701 -3.482 -16.192 132 HG1 THR 17 HG1 THR 17 2.972 -5.389 -17.127 133 1HG2 THR 17 HG21 THR 17 4.527 -2.587 -14.714 134 2HG2 THR 17 HG22 THR 17 4.944 -2.801 -16.414 135 3HG2 THR 17 HG23 THR 17 5.496 -3.972 -15.216 136 H ASN 18 HN ASN 18 1.067 -2.859 -14.740 137 HA ASN 18 HA ASN 18 1.871 -0.783 -13.167 138 1HB ASN 18 HB2 ASN 18 -0.772 -1.725 -14.134 139 2HB ASN 18 HB1 ASN 18 -0.782 -0.516 -12.854 140 1HD2 ASN 18 HD21 ASN 18 -1.799 -0.027 -15.381 141 2HD2 ASN 18 HD22 ASN 18 -0.814 1.156 -16.164 142 H LEU 19 HN LEU 19 0.222 -3.700 -12.157 143 HA LEU 19 HA LEU 19 -0.253 -2.826 -9.481 144 1HB LEU 19 HB2 LEU 19 -1.442 -4.676 -10.862 145 2HB LEU 19 HB1 LEU 19 -0.101 -5.680 -10.345 146 HG LEU 19 HG LEU 19 -0.893 -4.642 -7.961 147 1HD1 LEU 19 HD11 LEU 19 -3.374 -4.881 -7.917 148 2HD1 LEU 19 HD12 LEU 19 -3.351 -4.905 -9.681 149 3HD1 LEU 19 HD13 LEU 19 -2.794 -3.476 -8.812 150 1HD2 LEU 19 HD21 LEU 19 -0.542 -7.067 -8.861 151 2HD2 LEU 19 HD22 LEU 19 -2.300 -7.061 -9.005 152 3HD2 LEU 19 HD23 LEU 19 -1.543 -6.790 -7.436 153 H ARG 20 HN ARG 20 1.942 -5.125 -11.014 154 HA ARG 20 HA ARG 20 3.426 -5.831 -8.808 155 1HB ARG 20 HB2 ARG 20 3.547 -6.438 -11.459 156 2HB ARG 20 HB1 ARG 20 4.999 -5.463 -11.272 157 1HG ARG 20 HG2 ARG 20 5.329 -7.922 -10.996 158 2HG ARG 20 HG1 ARG 20 5.884 -6.941 -9.639 159 1HD ARG 20 HD2 ARG 20 3.095 -7.917 -9.509 160 2HD ARG 20 HD1 ARG 20 4.359 -9.137 -9.356 161 HE ARG 20 HE ARG 20 3.620 -7.186 -7.404 162 1HH1 ARG 20 HH11 ARG 20 6.332 -9.002 -8.651 163 2HH1 ARG 20 HH12 ARG 20 7.212 -8.951 -7.160 164 1HH2 ARG 20 HH21 ARG 20 4.778 -7.118 -5.446 165 2HH2 ARG 20 HH22 ARG 20 6.329 -7.882 -5.341 166 H LEU 21 HN LEU 21 3.161 -2.856 -10.350 167 HA LEU 21 HA LEU 21 5.708 -1.769 -9.687 168 1HB LEU 21 HB2 LEU 21 3.315 -0.988 -11.098 169 2HB LEU 21 HB1 LEU 21 3.868 0.311 -10.051 170 HG LEU 21 HG LEU 21 4.843 0.549 -12.246 171 1HD1 LEU 21 HD11 LEU 21 7.238 -0.387 -10.901 172 2HD1 LEU 21 HD12 LEU 21 6.164 0.492 -9.800 173 3HD1 LEU 21 HD13 LEU 21 6.739 1.259 -11.292 174 1HD2 LEU 21 HD21 LEU 21 5.514 -1.207 -13.458 175 2HD2 LEU 21 HD22 LEU 21 4.834 -2.232 -12.187 176 3HD2 LEU 21 HD23 LEU 21 6.547 -1.794 -12.152 177 H TRP 22 HN TRP 22 2.424 -0.913 -8.571 178 HA TRP 22 HA TRP 22 3.464 0.553 -6.400 179 1HB TRP 22 HB2 TRP 22 1.155 0.821 -7.442 180 2HB TRP 22 HB1 TRP 22 0.674 -0.612 -6.541 181 HD1 TRP 22 HD1 TRP 22 2.283 2.831 -5.694 182 HE1 TRP 22 HE1 TRP 22 1.260 3.647 -3.476 183 HE3 TRP 22 HE3 TRP 22 -0.743 -1.161 -4.676 184 HZ2 TRP 22 HZ2 TRP 22 -0.587 2.720 -1.551 185 HZ3 TRP 22 HZ3 TRP 22 -2.104 -1.118 -2.628 186 HH2 TRP 22 HH2 TRP 22 -2.026 0.782 -1.097 187 H VAL 23 HN VAL 23 2.428 -2.748 -6.841 188 HA VAL 23 HA VAL 23 2.349 -3.541 -4.133 189 HB VAL 23 HB VAL 23 2.985 -5.276 -6.518 190 1HG1 VAL 23 HG11 VAL 23 1.743 -6.013 -3.873 191 2HG1 VAL 23 HG12 VAL 23 3.447 -6.238 -4.268 192 3HG1 VAL 23 HG13 VAL 23 2.208 -7.107 -5.175 193 1HG2 VAL 23 HG21 VAL 23 0.253 -5.139 -5.375 194 2HG2 VAL 23 HG22 VAL 23 0.775 -5.439 -7.033 195 3HG2 VAL 23 HG23 VAL 23 0.778 -3.796 -6.390 196 H ALA 24 HN ALA 24 4.917 -3.294 -6.498 197 HA ALA 24 HA ALA 24 6.877 -4.656 -4.888 198 1HB ALA 24 HB1 ALA 24 7.206 -4.832 -7.209 199 2HB ALA 24 HB2 ALA 24 8.454 -3.719 -6.651 200 3HB ALA 24 HB3 ALA 24 7.011 -3.095 -7.452 201 H PHE 25 HN PHE 25 5.768 -1.417 -5.323 202 HA PHE 25 HA PHE 25 7.990 0.016 -4.382 203 1HB PHE 25 HB2 PHE 25 6.645 1.648 -5.112 204 2HB PHE 25 HB1 PHE 25 5.254 0.574 -5.097 205 HD1 PHE 25 HD1 PHE 25 7.350 2.585 -2.762 206 HD2 PHE 25 HD2 PHE 25 3.485 1.086 -3.721 207 HE1 PHE 25 HE1 PHE 25 6.394 3.869 -0.892 208 HE2 PHE 25 HE2 PHE 25 2.521 2.370 -1.853 209 HZ PHE 25 HZ PHE 25 3.978 3.762 -0.437 210 H GLN 26 HN GLN 26 5.224 -1.378 -2.692 211 HA GLN 26 HA GLN 26 6.262 -0.533 -0.096 212 1HB GLN 26 HB2 GLN 26 4.197 -1.415 0.813 213 2HB GLN 26 HB1 GLN 26 3.830 -0.400 -0.576 214 1HG GLN 26 HG2 GLN 26 3.960 -2.673 -1.864 215 2HG GLN 26 HG1 GLN 26 3.632 -3.345 -0.268 216 1HE2 GLN 26 HE21 GLN 26 2.473 -0.404 -1.874 217 2HE2 GLN 26 HE22 GLN 26 0.792 -0.786 -1.745 218 H MET 27 HN MET 27 5.998 -3.315 -2.126 219 HA MET 27 HA MET 27 6.443 -5.389 -0.293 220 1HB MET 27 HB2 MET 27 6.008 -6.379 -2.284 221 2HB MET 27 HB1 MET 27 6.478 -4.935 -3.155 222 1HG MET 27 HG2 MET 27 8.027 -6.254 -4.019 223 2HG MET 27 HG1 MET 27 8.905 -5.883 -2.541 224 1HE MET 27 HE1 MET 27 7.413 -9.016 -0.425 225 2HE MET 27 HE2 MET 27 7.005 -7.306 -0.553 226 3HE MET 27 HE3 MET 27 8.673 -7.794 -0.251 227 H MET 28 HN MET 28 8.555 -3.147 -1.876 228 HA MET 28 HA MET 28 10.933 -4.472 -0.877 229 1HB MET 28 HB2 MET 28 10.341 -3.224 -3.206 230 2HB MET 28 HB1 MET 28 11.163 -1.925 -2.343 231 1HG MET 28 HG2 MET 28 12.865 -3.974 -1.883 232 2HG MET 28 HG1 MET 28 12.231 -4.423 -3.465 233 1HE MET 28 HE1 MET 28 13.024 -1.139 -5.510 234 2HE MET 28 HE2 MET 28 11.671 -1.135 -4.379 235 3HE MET 28 HE3 MET 28 11.979 -2.553 -5.382 236 H LYS 29 HN LYS 29 9.253 -1.391 -0.512 237 HA LYS 29 HA LYS 29 11.210 -0.499 1.468 238 1HB LYS 29 HB2 LYS 29 10.588 1.180 -0.108 239 2HB LYS 29 HB1 LYS 29 8.877 0.841 0.101 240 1HG LYS 29 HG2 LYS 29 9.769 1.562 2.638 241 2HG LYS 29 HG1 LYS 29 10.588 2.666 1.534 242 1HD LYS 29 HD2 LYS 29 8.442 3.580 2.266 243 2HD LYS 29 HD1 LYS 29 8.441 3.266 0.531 244 1HE LYS 29 HE2 LYS 29 6.814 1.727 0.692 245 2HE LYS 29 HE1 LYS 29 7.516 1.008 2.142 246 1HZ LYS 29 HZ1 LYS 29 5.332 1.997 2.551 247 2HZ LYS 29 HZ2 LYS 29 5.921 3.513 2.087 248 3HZ LYS 29 HZ3 LYS 29 6.538 2.752 3.466 249 H GLY 30 HN GLY 30 7.839 -1.346 1.167 250 1HA GLY 30 HA2 GLY 30 7.233 -0.845 3.931 251 2HA GLY 30 HA1 GLY 30 6.174 -1.563 2.727 252 H ALA 31 HN ALA 31 8.784 -3.375 2.327 253 HA ALA 31 HA ALA 31 7.706 -5.505 3.933 254 1HB ALA 31 HB1 ALA 31 9.839 -5.308 1.840 255 2HB ALA 31 HB2 ALA 31 8.330 -6.235 1.832 256 3HB ALA 31 HB3 ALA 31 9.683 -6.761 2.838 257 H GLY 32 HN GLY 32 11.004 -4.157 3.613 258 1HA GLY 32 HA2 GLY 32 11.821 -5.420 6.070 259 2HA GLY 32 HA1 GLY 32 12.795 -4.355 5.070 260 H TRP 33 HN TRP 33 10.874 -2.179 5.102 261 HA TRP 33 HA TRP 33 11.590 -1.111 7.707 262 1HB TRP 33 HB2 TRP 33 11.607 -0.005 5.214 263 2HB TRP 33 HB1 TRP 33 10.087 0.614 5.851 264 HD1 TRP 33 HD1 TRP 33 13.607 0.235 7.470 265 HE1 TRP 33 HE1 TRP 33 14.214 2.487 8.556 266 HE3 TRP 33 HE3 TRP 33 9.443 2.905 6.180 267 HZ2 TRP 33 HZ2 TRP 33 13.076 5.058 8.830 268 HZ3 TRP 33 HZ3 TRP 33 9.280 5.253 6.892 269 HH2 TRP 33 HH2 TRP 33 11.060 6.307 8.191 270 H ALA 34 HN ALA 34 8.600 -0.888 5.740 271 HA ALA 34 HA ALA 34 7.002 -0.230 7.978 272 1HB ALA 34 HB1 ALA 34 6.449 0.256 5.572 273 2HB ALA 34 HB2 ALA 34 5.123 -0.406 6.529 274 3HB ALA 34 HB3 ALA 34 6.004 -1.440 5.408 275 H GLY 35 HN GLY 35 7.849 -3.285 6.465 276 1HA GLY 35 HA2 GLY 35 5.938 -4.965 7.539 277 2HA GLY 35 HA1 GLY 35 7.613 -5.430 7.270 278 H GLY 36 HN GLY 36 9.114 -4.284 8.997 279 1HA GLY 36 HA2 GLY 36 8.270 -5.365 11.529 280 2HA GLY 36 HA1 GLY 36 9.829 -4.646 11.159 281 H VAL 37 HN VAL 37 8.911 -2.116 10.254 282 HA VAL 37 HA VAL 37 8.570 -0.840 12.772 283 HB VAL 37 HB VAL 37 8.452 0.401 10.028 284 1HG1 VAL 37 HG11 VAL 37 9.196 2.438 11.268 285 2HG1 VAL 37 HG12 VAL 37 8.909 1.563 12.771 286 3HG1 VAL 37 HG13 VAL 37 7.569 1.894 11.673 287 1HG2 VAL 37 HG21 VAL 37 10.696 0.391 9.891 288 2HG2 VAL 37 HG22 VAL 37 10.579 -0.966 11.012 289 3HG2 VAL 37 HG23 VAL 37 10.908 0.656 11.620 290 H PHE 38 HN PHE 38 6.614 -0.891 9.805 291 HA PHE 38 HA PHE 38 4.483 0.470 10.997 292 1HB PHE 38 HB2 PHE 38 5.086 -0.211 8.442 293 2HB PHE 38 HB1 PHE 38 3.759 -1.314 8.784 294 HD1 PHE 38 HD1 PHE 38 1.928 0.154 10.388 295 HD2 PHE 38 HD2 PHE 38 4.336 1.535 7.164 296 HE1 PHE 38 HE1 PHE 38 0.315 1.964 9.963 297 HE2 PHE 38 HE2 PHE 38 2.728 3.347 6.732 298 HZ PHE 38 HZ PHE 38 0.714 3.562 8.133 299 H PHE 39 HN PHE 39 4.654 -3.017 10.112 300 HA PHE 39 HA PHE 39 2.300 -3.847 11.185 301 1HB PHE 39 HB2 PHE 39 4.106 -5.214 10.029 302 2HB PHE 39 HB1 PHE 39 4.828 -5.401 11.624 303 HD1 PHE 39 HD1 PHE 39 1.577 -5.857 9.861 304 HD2 PHE 39 HD2 PHE 39 4.207 -7.197 12.927 305 HE1 PHE 39 HE1 PHE 39 0.078 -7.754 10.313 306 HE2 PHE 39 HE2 PHE 39 2.712 -9.097 13.383 307 HZ PHE 39 HZ PHE 39 0.644 -9.378 12.074 308 H GLY 40 HN GLY 40 5.334 -3.337 13.016 309 1HA GLY 40 HA2 GLY 40 4.520 -4.259 15.492 310 2HA GLY 40 HA1 GLY 40 5.595 -2.883 15.268 311 H THR 41 HN THR 41 4.005 -1.031 14.120 312 HA THR 41 HA THR 41 2.353 -0.201 16.344 313 HB THR 41 HB THR 41 2.772 1.116 13.668 314 HG1 THR 41 HG1 THR 41 4.249 1.321 16.077 315 1HG2 THR 41 HG21 THR 41 2.198 3.177 14.737 316 2HG2 THR 41 HG22 THR 41 2.042 2.374 16.299 317 3HG2 THR 41 HG23 THR 41 0.898 2.017 15.005 318 H LEU 42 HN LEU 42 1.828 -0.698 12.881 319 HA LEU 42 HA LEU 42 -0.857 -0.254 12.673 320 1HB LEU 42 HB2 LEU 42 0.090 -0.547 10.643 321 2HB LEU 42 HB1 LEU 42 1.190 -1.785 11.229 322 HG LEU 42 HG LEU 42 -0.370 -3.503 10.891 323 1HD1 LEU 42 HD11 LEU 42 -2.508 -3.106 11.426 324 2HD1 LEU 42 HD12 LEU 42 -2.684 -2.432 9.805 325 3HD1 LEU 42 HD13 LEU 42 -2.331 -1.370 11.169 326 1HD2 LEU 42 HD21 LEU 42 -0.217 -1.504 8.683 327 2HD2 LEU 42 HD22 LEU 42 -1.182 -2.966 8.474 328 3HD2 LEU 42 HD23 LEU 42 0.543 -3.089 8.824 329 H LEU 43 HN LEU 43 0.749 -3.259 13.548 330 HA LEU 43 HA LEU 43 -1.657 -4.727 13.757 331 1HB LEU 43 HB2 LEU 43 -0.240 -6.429 13.763 332 2HB LEU 43 HB1 LEU 43 1.074 -5.271 13.701 333 HG LEU 43 HG LEU 43 -0.120 -6.298 16.281 334 1HD1 LEU 43 HD11 LEU 43 2.352 -7.253 14.841 335 2HD1 LEU 43 HD12 LEU 43 0.843 -8.151 15.007 336 3HD1 LEU 43 HD13 LEU 43 1.807 -7.775 16.435 337 1HD2 LEU 43 HD21 LEU 43 1.555 -4.144 15.732 338 2HD2 LEU 43 HD22 LEU 43 2.624 -5.411 16.334 339 3HD2 LEU 43 HD23 LEU 43 1.250 -4.881 17.305 340 H LEU 44 HN LEU 44 0.278 -2.742 15.929 341 HA LEU 44 HA LEU 44 -1.077 -3.646 18.295 342 1HB LEU 44 HB2 LEU 44 1.194 -2.250 17.868 343 2HB LEU 44 HB1 LEU 44 0.105 -0.933 18.247 344 HG LEU 44 HG LEU 44 -0.174 -1.606 20.440 345 1HD1 LEU 44 HD11 LEU 44 0.565 -3.941 21.191 346 2HD1 LEU 44 HD12 LEU 44 0.549 -4.351 19.475 347 3HD1 LEU 44 HD13 LEU 44 -0.932 -3.809 20.263 348 1HD2 LEU 44 HD21 LEU 44 2.561 -2.044 19.419 349 2HD2 LEU 44 HD22 LEU 44 2.231 -2.607 21.057 350 3HD2 LEU 44 HD23 LEU 44 1.969 -0.913 20.637 351 H ILE 45 HN ILE 45 -1.309 -0.770 16.289 352 HA ILE 45 HA ILE 45 -3.593 0.297 17.640 353 HB ILE 45 HB ILE 45 -1.930 1.091 15.280 354 1HG1 ILE 45 HG12 ILE 45 -2.709 2.660 17.735 355 2HG1 ILE 45 HG11 ILE 45 -1.305 1.599 17.675 356 1HG2 ILE 45 HG21 ILE 45 -4.708 1.917 15.828 357 2HG2 ILE 45 HG22 ILE 45 -3.809 1.846 14.304 358 3HG2 ILE 45 HG23 ILE 45 -3.561 3.197 15.415 359 1HD1 ILE 45 HD11 ILE 45 -1.146 3.280 15.427 360 2HD1 ILE 45 HD12 ILE 45 -0.121 3.273 16.861 361 3HD1 ILE 45 HD13 ILE 45 -1.555 4.298 16.808 362 H GLY 46 HN GLY 46 -2.995 -0.963 14.362 363 1HA GLY 46 HA2 GLY 46 -5.614 -0.743 13.421 364 2HA GLY 46 HA1 GLY 46 -4.388 -1.827 12.777 365 H PHE 47 HN PHE 47 -4.045 -3.141 15.399 366 HA PHE 47 HA PHE 47 -6.154 -5.029 15.032 367 1HB PHE 47 HB2 PHE 47 -3.733 -5.603 15.564 368 2HB PHE 47 HB1 PHE 47 -4.090 -5.110 17.218 369 HD1 PHE 47 HD1 PHE 47 -4.815 -7.571 14.593 370 HD2 PHE 47 HD2 PHE 47 -5.399 -6.492 18.668 371 HE1 PHE 47 HE1 PHE 47 -5.689 -9.822 15.058 372 HE2 PHE 47 HE2 PHE 47 -6.274 -8.744 19.141 373 HZ PHE 47 HZ PHE 47 -6.420 -10.412 17.335 374 H PHE 48 HN PHE 48 -5.296 -2.525 17.284 375 HA PHE 48 HA PHE 48 -7.252 -3.219 19.267 376 1HB PHE 48 HB2 PHE 48 -5.051 -1.442 19.058 377 2HB PHE 48 HB1 PHE 48 -6.467 -0.463 19.409 378 HD1 PHE 48 HD1 PHE 48 -4.057 -2.799 20.712 379 HD2 PHE 48 HD2 PHE 48 -7.828 -0.967 21.440 380 HE1 PHE 48 HE1 PHE 48 -3.898 -3.423 23.086 381 HE2 PHE 48 HE2 PHE 48 -7.676 -1.588 23.816 382 HZ PHE 48 HZ PHE 48 -5.709 -2.818 24.642 383 H ARG 49 HN ARG 49 -7.098 -1.145 16.459 384 HA ARG 49 HA ARG 49 -9.484 0.292 17.076 385 1HB ARG 49 HB2 ARG 49 -9.114 1.507 15.144 386 2HB ARG 49 HB1 ARG 49 -7.485 1.017 15.587 387 1HG ARG 49 HG2 ARG 49 -7.320 0.372 13.457 388 2HG ARG 49 HG1 ARG 49 -8.253 -1.035 13.968 389 1HD ARG 49 HD2 ARG 49 -9.170 0.036 11.941 390 2HD ARG 49 HD1 ARG 49 -10.311 0.028 13.287 391 HE ARG 49 HE ARG 49 -9.024 2.440 13.463 392 1HH1 ARG 49 HH11 ARG 49 -10.891 0.801 11.014 393 2HH1 ARG 49 HH12 ARG 49 -11.497 2.268 10.319 394 1HH2 ARG 49 HH21 ARG 49 -9.820 4.366 12.555 395 2HH2 ARG 49 HH22 ARG 49 -10.889 4.293 11.193 396 H VAL 50 HN VAL 50 -8.735 -2.617 15.320 397 HA VAL 50 HA VAL 50 -11.318 -2.765 14.040 398 HB VAL 50 HB VAL 50 -10.615 -4.974 13.252 399 1HG1 VAL 50 HG11 VAL 50 -8.363 -4.146 12.182 400 2HG1 VAL 50 HG12 VAL 50 -8.838 -2.612 12.911 401 3HG1 VAL 50 HG13 VAL 50 -9.902 -3.402 11.749 402 1HG2 VAL 50 HG21 VAL 50 -9.060 -6.205 14.257 403 2HG2 VAL 50 HG22 VAL 50 -8.974 -4.967 15.511 404 3HG2 VAL 50 HG23 VAL 50 -7.873 -4.909 14.136 405 H VAL 51 HN VAL 51 -9.877 -3.939 16.992 406 HA VAL 51 HA VAL 51 -11.870 -5.930 17.432 407 HB VAL 51 HB VAL 51 -9.980 -4.652 19.412 408 1HG1 VAL 51 HG11 VAL 51 -12.134 -6.603 19.686 409 2HG1 VAL 51 HG12 VAL 51 -11.276 -5.683 20.922 410 3HG1 VAL 51 HG13 VAL 51 -10.586 -7.184 20.305 411 1HG2 VAL 51 HG21 VAL 51 -9.341 -6.189 17.252 412 2HG2 VAL 51 HG22 VAL 51 -9.533 -7.407 18.515 413 3HG2 VAL 51 HG23 VAL 51 -8.387 -6.084 18.734 414 H GLY 52 HN GLY 52 -11.924 -2.570 17.659 415 1HA GLY 52 HA2 GLY 52 -14.399 -2.725 19.252 416 2HA GLY 52 HA1 GLY 52 -13.194 -1.492 19.601 417 H ARG 53 HN ARG 53 -13.633 -2.410 16.314 418 HA ARG 53 HA ARG 53 -15.689 -0.621 15.607 419 1HB ARG 53 HB2 ARG 53 -13.772 0.918 16.338 420 2HB ARG 53 HB1 ARG 53 -12.961 0.397 14.867 421 1HG ARG 53 HG2 ARG 53 -14.377 1.549 13.509 422 2HG ARG 53 HG1 ARG 53 -15.734 1.429 14.635 423 1HD ARG 53 HD2 ARG 53 -15.259 3.422 15.494 424 2HD ARG 53 HD1 ARG 53 -13.604 2.923 15.835 425 HE ARG 53 HE ARG 53 -12.905 4.012 13.937 426 1HH1 ARG 53 HH11 ARG 53 -16.390 3.794 13.926 427 2HH1 ARG 53 HH12 ARG 53 -16.575 4.864 12.578 428 1HH2 ARG 53 HH21 ARG 53 -13.150 5.420 12.164 429 2HH2 ARG 53 HH22 ARG 53 -14.738 5.788 11.578 430 H MET 54 HN MET 54 -14.627 -3.303 15.006 431 HA MET 54 HA MET 54 -15.239 -3.430 12.276 432 1HB MET 54 HB2 MET 54 -12.675 -2.462 12.635 433 2HB MET 54 HB1 MET 54 -12.415 -4.180 12.363 434 1HG MET 54 HG2 MET 54 -12.541 -3.765 10.196 435 2HG MET 54 HG1 MET 54 -14.259 -3.443 10.425 436 1HE MET 54 HE1 MET 54 -10.721 -1.226 10.852 437 2HE MET 54 HE2 MET 54 -10.995 -0.654 9.206 438 3HE MET 54 HE3 MET 54 -10.932 -2.386 9.539 439 H LEU 55 HN LEU 55 -15.907 -4.851 14.610 440 HA LEU 55 HA LEU 55 -15.241 -7.523 13.709 441 1HB LEU 55 HB2 LEU 55 -14.077 -6.383 16.088 442 2HB LEU 55 HB1 LEU 55 -15.095 -7.752 16.501 443 HG LEU 55 HG LEU 55 -13.204 -8.109 14.245 444 1HD1 LEU 55 HD11 LEU 55 -11.438 -8.768 15.938 445 2HD1 LEU 55 HD12 LEU 55 -12.369 -7.851 17.123 446 3HD1 LEU 55 HD13 LEU 55 -11.696 -7.039 15.709 447 1HD2 LEU 55 HD21 LEU 55 -12.973 -10.319 15.610 448 2HD2 LEU 55 HD22 LEU 55 -14.427 -10.017 14.656 449 3HD2 LEU 55 HD23 LEU 55 -14.448 -9.758 16.401 450 HA PRO 56 HA PRO 56 -19.049 -7.740 16.712 451 1HB PRO 56 HB2 PRO 56 -19.492 -4.872 17.281 452 2HB PRO 56 HB1 PRO 56 -19.595 -6.257 18.371 453 1HG PRO 56 HG2 PRO 56 -17.571 -4.489 18.499 454 2HG PRO 56 HG1 PRO 56 -17.344 -6.211 18.856 455 1HD PRO 56 HD2 PRO 56 -16.593 -4.658 16.424 456 2HD PRO 56 HD1 PRO 56 -15.755 -6.010 17.208 457 H ILE 57 HN ILE 57 -18.196 -5.337 14.433 458 HA ILE 57 HA ILE 57 -20.885 -5.012 13.408 459 HB ILE 57 HB ILE 57 -20.218 -2.978 12.807 460 1HG1 ILE 57 HG12 ILE 57 -19.393 -4.064 10.673 461 2HG1 ILE 57 HG11 ILE 57 -18.629 -2.536 11.086 462 1HG2 ILE 57 HG21 ILE 57 -18.764 -3.287 14.805 463 2HG2 ILE 57 HG22 ILE 57 -18.194 -2.067 13.664 464 3HG2 ILE 57 HG23 ILE 57 -17.435 -3.660 13.709 465 1HD1 ILE 57 HD11 ILE 57 -17.412 -5.024 10.555 466 2HD1 ILE 57 HD12 ILE 57 -17.088 -4.619 12.241 467 3HD1 ILE 57 HD13 ILE 57 -16.647 -3.490 10.959 468 H GLN 58 HN GLN 58 -17.807 -6.433 12.540 469 HA GLN 58 HA GLN 58 -18.800 -7.278 9.940 470 1HB GLN 58 HB2 GLN 58 -16.641 -7.416 9.314 471 2HB GLN 58 HB1 GLN 58 -16.309 -6.530 10.791 472 1HG GLN 58 HG2 GLN 58 -15.735 -8.523 11.953 473 2HG GLN 58 HG1 GLN 58 -16.306 -9.532 10.620 474 1HE2 GLN 58 HE21 GLN 58 -14.328 -6.605 10.558 475 2HE2 GLN 58 HE22 GLN 58 -12.949 -7.338 9.820 476 H GLU 59 HN GLU 59 -18.628 -8.445 13.115 477 HA GLU 59 HA GLU 59 -18.410 -11.226 12.619 478 1HB GLU 59 HB2 GLU 59 -18.562 -9.544 14.864 479 2HB GLU 59 HB1 GLU 59 -19.978 -10.578 14.969 480 1HG GLU 59 HG2 GLU 59 -17.784 -12.222 14.281 481 2HG GLU 59 HG1 GLU 59 -17.274 -11.180 15.608 482 H ASN 60 HN ASN 60 -20.852 -8.908 12.193 483 HA ASN 60 HA ASN 60 -22.984 -10.887 12.161 484 1HB ASN 60 HB2 ASN 60 -22.806 -8.003 12.563 485 2HB ASN 60 HB1 ASN 60 -24.085 -8.448 11.434 486 1HD2 ASN 60 HD21 ASN 60 -22.764 -9.375 14.591 487 2HD2 ASN 60 HD22 ASN 60 -24.293 -9.701 15.327 488 H GLN 61 HN GLN 61 -20.764 -10.674 10.157 489 HA GLN 61 HA GLN 61 -20.517 -11.068 7.938 490 1HB GLN 61 HB2 GLN 61 -23.235 -11.727 8.441 491 2HB GLN 61 HB1 GLN 61 -23.194 -10.818 6.937 492 1HG GLN 61 HG2 GLN 61 -22.034 -12.428 5.830 493 2HG GLN 61 HG1 GLN 61 -21.210 -12.992 7.283 494 1HE2 GLN 61 HE21 GLN 61 -22.632 -14.488 5.201 495 2HE2 GLN 61 HE22 GLN 61 -23.854 -15.392 6.022 496 H ALA 62 HN ALA 62 -20.162 -9.833 6.118 497 HA ALA 62 HA ALA 62 -20.126 -7.076 6.370 498 1HB ALA 62 HB1 ALA 62 -20.246 -7.705 3.598 499 2HB ALA 62 HB2 ALA 62 -19.352 -8.982 4.422 500 3HB ALA 62 HB3 ALA 62 -18.838 -7.301 4.580 501 HA PRO 63 HA PRO 63 -24.153 -5.610 5.339 502 1HB PRO 63 HB2 PRO 63 -23.608 -3.326 3.982 503 2HB PRO 63 HB1 PRO 63 -23.356 -3.483 5.725 504 1HG PRO 63 HG2 PRO 63 -21.368 -3.698 3.497 505 2HG PRO 63 HG1 PRO 63 -21.218 -2.859 5.052 506 1HD PRO 63 HD2 PRO 63 -20.129 -5.297 4.604 507 2HD PRO 63 HD1 PRO 63 -20.734 -4.800 6.197 508 H ALA 64 HN ALA 64 -24.177 -7.596 3.817 509 HA ALA 64 HA ALA 64 -25.361 -6.837 1.386 510 1HB ALA 64 HB1 ALA 64 -23.056 -8.333 0.481 511 2HB ALA 64 HB2 ALA 64 -22.592 -6.801 1.219 512 3HB ALA 64 HB3 ALA 64 -23.731 -6.822 -0.127 513 HA PRO 65 HA PRO 65 -24.544 -11.742 1.343 514 1HB PRO 65 HB2 PRO 65 -23.822 -12.387 4.014 515 2HB PRO 65 HB1 PRO 65 -22.832 -12.564 2.564 516 1HG PRO 65 HG2 PRO 65 -22.856 -10.389 4.585 517 2HG PRO 65 HG1 PRO 65 -21.514 -11.002 3.603 518 1HD PRO 65 HD2 PRO 65 -22.663 -8.653 3.059 519 2HD PRO 65 HD1 PRO 65 -22.127 -9.731 1.754 520 H ASN 66 HN ASN 66 -25.340 -10.347 4.539 521 HA ASN 66 HA ASN 66 -27.896 -11.800 4.430 522 1HB ASN 66 HB2 ASN 66 -27.925 -11.336 6.937 523 2HB ASN 66 HB1 ASN 66 -26.719 -12.484 6.366 524 1HD2 ASN 66 HD21 ASN 66 -26.126 -11.628 8.694 525 2HD2 ASN 66 HD22 ASN 66 -24.929 -10.382 8.693 526 H ILE 67 HN ILE 67 -26.419 -8.660 4.772 527 HA ILE 67 HA ILE 67 -28.959 -7.368 5.353 528 HB ILE 67 HB ILE 67 -26.322 -6.019 4.787 529 1HG1 ILE 67 HG12 ILE 67 -25.976 -7.577 6.617 530 2HG1 ILE 67 HG11 ILE 67 -26.033 -5.937 7.252 531 1HG2 ILE 67 HG21 ILE 67 -27.576 -4.418 6.513 532 2HG2 ILE 67 HG22 ILE 67 -28.983 -5.161 5.753 533 3HG2 ILE 67 HG23 ILE 67 -27.801 -4.301 4.768 534 1HD1 ILE 67 HD11 ILE 67 -28.376 -7.817 7.271 535 2HD1 ILE 67 HD12 ILE 67 -28.235 -6.263 8.092 536 3HD1 ILE 67 HD13 ILE 67 -27.247 -7.629 8.611 537 H THR 68 HN THR 68 -29.613 -8.422 3.154 538 HA THR 68 HA THR 68 -29.299 -6.339 1.103 539 HB THR 68 HB THR 68 -29.678 -8.561 -0.422 540 HG1 THR 68 HG1 THR 68 -29.410 -10.061 1.152 541 1HG2 THR 68 HG21 THR 68 -27.995 -7.025 -1.017 542 2HG2 THR 68 HG22 THR 68 -27.189 -8.575 -0.772 543 3HG2 THR 68 HG23 THR 68 -27.093 -7.325 0.468 544 H GLY 69 HN GLY 69 -31.213 -9.144 2.159 545 1HA GLY 69 HA2 GLY 69 -33.527 -9.215 2.460 546 2HA GLY 69 HA1 GLY 69 -33.651 -7.640 1.693 547 H ALA 70 HN ALA 70 -31.880 -10.234 0.190 548 HA ALA 70 HA ALA 70 -34.044 -11.214 -1.393 549 1HB ALA 70 HB1 ALA 70 -33.386 -10.323 -3.539 550 2HB ALA 70 HB2 ALA 70 -32.053 -9.437 -2.797 551 3HB ALA 70 HB3 ALA 70 -33.719 -8.994 -2.427
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