NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
25330 | 2k7r | 15926 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 HA MET 1 HA MET 1 5.710 -11.820 -5.770 2 HB2 MET 1 1HB MET 1 7.109 -13.892 -6.017 3 HB3 MET 1 2HB MET 1 6.644 -14.343 -4.383 4 HG2 MET 1 1HG MET 1 4.300 -14.420 -5.072 5 HG3 MET 1 2HG MET 1 4.771 -13.974 -6.713 6 HE1 MET 1 2HE MET 1 3.780 -17.695 -7.225 7 HE2 MET 1 3HE MET 1 3.579 -16.035 -7.786 8 HE3 MET 1 1HE MET 1 2.987 -16.505 -6.193 9 H GLU 2 H GLU 2 6.755 -11.865 -2.532 10 HA GLU 2 HA GLU 2 3.986 -11.965 -1.565 11 HB2 GLU 2 1HB GLU 2 4.891 -12.840 0.578 12 HB3 GLU 2 2HB GLU 2 5.152 -13.926 -0.775 13 HG2 GLU 2 1HG GLU 2 7.242 -12.065 0.337 14 HG3 GLU 2 2HG GLU 2 7.065 -13.754 0.801 15 HA PRO 3 HA PRO 3 5.436 -7.673 -0.841 16 HB2 PRO 3 1HB PRO 3 2.523 -7.256 -0.595 17 HB3 PRO 3 2HB PRO 3 3.697 -6.414 -1.611 18 HG2 PRO 3 1HG PRO 3 1.929 -8.130 -2.659 19 HG3 PRO 3 2HG PRO 3 3.579 -7.991 -3.295 20 HD2 PRO 3 1HD PRO 3 2.408 -10.080 -1.504 21 HD3 PRO 3 2HD PRO 3 3.548 -10.261 -2.853 22 H ILE 4 H ILE 4 6.230 -7.528 1.159 23 HA ILE 4 HA ILE 4 4.847 -8.493 3.469 24 HB ILE 4 HB ILE 4 7.311 -6.745 3.311 25 HG12 ILE 4 1HG1 ILE 4 7.052 -9.754 3.540 26 HG13 ILE 4 2HG1 ILE 4 7.574 -8.877 2.106 27 HG21 ILE 4 1HG2 ILE 4 7.780 -7.559 5.565 28 HG22 ILE 4 2HG2 ILE 4 6.260 -8.453 5.563 29 HG23 ILE 4 3HG2 ILE 4 6.246 -6.689 5.508 30 HD11 ILE 4 3HD1 ILE 4 9.464 -9.830 3.276 31 HD12 ILE 4 1HD1 ILE 4 9.009 -8.970 4.747 32 HD13 ILE 4 2HD1 ILE 4 9.532 -8.067 3.325 33 H GLY 5 H GLY 5 5.412 -5.362 1.984 34 HA2 GLY 5 1HA GLY 5 3.761 -4.076 4.053 35 HA3 GLY 5 2HA GLY 5 4.784 -3.239 2.893 36 H ARG 6 H ARG 6 2.111 -5.586 2.768 37 HA ARG 6 HA ARG 6 1.068 -4.743 0.316 38 HB2 ARG 6 1HB ARG 6 -0.132 -6.183 2.663 39 HB3 ARG 6 2HB ARG 6 -1.113 -5.761 1.267 40 HG2 ARG 6 1HG ARG 6 0.229 -7.103 -0.172 41 HG3 ARG 6 2HG ARG 6 1.415 -7.378 1.105 42 HD2 ARG 6 1HD ARG 6 -0.160 -8.660 2.375 43 HD3 ARG 6 2HD ARG 6 -1.462 -8.252 1.259 44 HE ARG 6 HE ARG 6 -0.470 -9.679 -0.372 45 HH11 ARG 6 1HH1 ARG 6 1.113 -9.802 2.743 46 HH12 ARG 6 2HH1 ARG 6 1.791 -11.380 2.487 47 HH21 ARG 6 1HH2 ARG 6 0.415 -11.769 -0.708 48 HH22 ARG 6 2HH2 ARG 6 1.376 -12.505 0.541 49 H SER 7 H SER 7 0.007 -3.000 -0.286 50 HA SER 7 HA SER 7 -0.746 -1.042 1.721 51 HB2 SER 7 1HB SER 7 -0.994 -0.860 -1.289 52 HB3 SER 7 2HB SER 7 -1.043 0.475 -0.134 53 HG SER 7 HG SER 7 1.193 -0.832 0.325 54 H LEU 8 H LEU 8 -2.198 -3.620 0.194 55 HA LEU 8 HA LEU 8 -4.871 -2.566 0.067 56 HB2 LEU 8 1HB LEU 8 -3.716 -4.691 -1.107 57 HB3 LEU 8 2HB LEU 8 -4.409 -5.495 0.286 58 HG LEU 8 HG LEU 8 -5.949 -3.891 -1.760 59 HD11 LEU 8 1HD1 LEU 8 -5.827 -6.862 -1.280 60 HD12 LEU 8 2HD1 LEU 8 -5.094 -6.002 -2.634 61 HD13 LEU 8 3HD1 LEU 8 -6.848 -6.039 -2.459 62 HD21 LEU 8 3HD2 LEU 8 -6.970 -3.778 0.467 63 HD22 LEU 8 1HD2 LEU 8 -6.954 -5.540 0.561 64 HD23 LEU 8 2HD2 LEU 8 -7.947 -4.730 -0.651 65 H GLN 9 H GLN 9 -4.495 -1.660 2.289 66 HA GLN 9 HA GLN 9 -5.724 -3.487 4.211 67 HB2 GLN 9 1HB GLN 9 -4.287 -2.494 6.021 68 HB3 GLN 9 2HB GLN 9 -3.437 -3.533 4.891 69 HG2 GLN 9 1HG GLN 9 -2.557 -1.583 3.731 70 HG3 GLN 9 2HG GLN 9 -3.435 -0.522 4.833 71 HE21 GLN 9 2HE2 GLN 9 -0.735 -2.673 4.459 72 HE22 GLN 9 1HE2 GLN 9 0.058 -2.265 5.949 73 H GLY 10 H GLY 10 -7.615 -2.633 4.635 74 HA2 GLY 10 1HA GLY 10 -8.189 0.103 4.038 75 HA3 GLY 10 2HA GLY 10 -9.308 -1.078 4.700 76 H VAL 11 H VAL 11 -8.178 1.807 5.328 77 HA VAL 11 HA VAL 11 -7.388 1.672 8.040 78 HB VAL 11 HB VAL 11 -8.009 4.058 8.165 79 HG11 VAL 11 1HG1 VAL 11 -6.452 4.878 6.453 80 HG12 VAL 11 2HG1 VAL 11 -6.504 3.302 5.664 81 HG13 VAL 11 3HG1 VAL 11 -5.828 3.454 7.286 82 HG21 VAL 11 3HG2 VAL 11 -9.028 3.673 5.348 83 HG22 VAL 11 1HG2 VAL 11 -8.856 5.219 6.178 84 HG23 VAL 11 2HG2 VAL 11 -10.011 4.025 6.770 85 H THR 12 H THR 12 -8.601 1.789 9.913 86 HA THR 12 HA THR 12 -11.092 0.463 9.787 87 HB THR 12 HB THR 12 -11.116 1.015 12.303 88 HG1 THR 12 HG1 THR 12 -9.375 2.020 13.115 89 HG21 THR 12 3HG2 THR 12 -10.390 -1.142 11.372 90 HG22 THR 12 1HG2 THR 12 -9.416 -0.677 12.766 91 HG23 THR 12 2HG2 THR 12 -8.769 -0.488 11.136 92 H GLY 13 H GLY 13 -10.274 3.769 9.661 93 HA2 GLY 13 1HA GLY 13 -12.834 4.728 10.590 94 HA3 GLY 13 2HA GLY 13 -11.556 5.690 9.860 95 H ARG 14 H ARG 14 -14.373 3.730 9.266 96 HA ARG 14 HA ARG 14 -14.617 5.020 6.675 97 HB2 ARG 14 1HB ARG 14 -15.257 2.936 5.534 98 HB3 ARG 14 2HB ARG 14 -13.593 2.902 6.089 99 HG2 ARG 14 1HG ARG 14 -15.521 1.763 7.977 100 HG3 ARG 14 2HG ARG 14 -15.400 0.910 6.439 101 HD2 ARG 14 1HD ARG 14 -13.040 1.636 8.160 102 HD3 ARG 14 2HD ARG 14 -13.858 0.074 8.213 103 HE ARG 14 HE ARG 14 -12.531 1.128 5.796 104 HH11 ARG 14 1HH1 ARG 14 -13.276 -1.473 8.008 105 HH12 ARG 14 2HH1 ARG 14 -12.467 -2.682 7.056 106 HH21 ARG 14 1HH2 ARG 14 -11.433 -0.462 4.548 107 HH22 ARG 14 2HH2 ARG 14 -11.405 -2.110 5.117 108 HA PRO 15 HA PRO 15 -18.715 5.036 8.774 109 HB2 PRO 15 1HB PRO 15 -19.170 7.670 8.364 110 HB3 PRO 15 2HB PRO 15 -18.271 7.079 9.768 111 HG2 PRO 15 1HG PRO 15 -17.231 8.209 7.193 112 HG3 PRO 15 2HG PRO 15 -16.705 8.552 8.852 113 HD2 PRO 15 1HD PRO 15 -15.373 6.838 7.222 114 HD3 PRO 15 2HD PRO 15 -15.442 6.627 8.981 115 H ASP 16 H ASP 16 -20.768 5.988 7.680 116 HA ASP 16 HA ASP 16 -20.984 5.044 5.042 117 HB2 ASP 16 1HB ASP 16 -22.890 5.297 6.601 118 HB3 ASP 16 2HB ASP 16 -22.761 7.044 6.455 119 H PHE 17 H PHE 17 -20.000 8.075 6.343 120 HA PHE 17 HA PHE 17 -20.249 9.823 4.234 121 HB2 PHE 17 1HB PHE 17 -19.398 10.532 6.392 122 HB3 PHE 17 2HB PHE 17 -17.962 9.535 6.189 123 HD1 PHE 17 HD2 PHE 17 -19.744 12.485 4.837 124 HD2 PHE 17 HD1 PHE 17 -16.064 10.361 5.101 125 HE1 PHE 17 HE2 PHE 17 -18.577 14.382 3.793 126 HE2 PHE 17 HE1 PHE 17 -14.892 12.256 4.059 127 HZ PHE 17 HZ PHE 17 -16.150 14.270 3.399 128 H GLN 18 H GLN 18 -17.764 7.302 4.689 129 HA GLN 18 HA GLN 18 -16.223 8.164 2.443 130 HB2 GLN 18 1HB GLN 18 -14.876 6.235 2.744 131 HB3 GLN 18 2HB GLN 18 -15.329 6.767 4.354 132 HG2 GLN 18 1HG GLN 18 -15.844 4.635 4.711 133 HG3 GLN 18 2HG GLN 18 -17.301 4.972 3.783 134 HE21 GLN 18 2HE2 GLN 18 -15.757 5.243 1.270 135 HE22 GLN 18 1HE2 GLN 18 -15.376 3.625 0.797 136 H LYS 19 H LYS 19 -18.927 6.053 2.911 137 HA LYS 19 HA LYS 19 -18.867 4.700 0.432 138 HB2 LYS 19 1HB LYS 19 -21.184 5.410 2.250 139 HB3 LYS 19 2HB LYS 19 -21.289 4.301 0.884 140 HG2 LYS 19 1HG LYS 19 -19.839 2.744 1.929 141 HG3 LYS 19 2HG LYS 19 -19.403 3.901 3.188 142 HD2 LYS 19 1HD LYS 19 -20.998 2.240 4.011 143 HD3 LYS 19 2HD LYS 19 -21.688 3.864 4.031 144 HE2 LYS 19 1HE LYS 19 -22.708 3.306 1.779 145 HE3 LYS 19 2HE LYS 19 -22.239 1.634 2.090 146 HZ1 LYS 19 3HZ LYS 19 -23.540 1.728 4.150 147 HZ2 LYS 19 1HZ LYS 19 -24.499 1.992 2.775 148 HZ3 LYS 19 2HZ LYS 19 -24.041 3.300 3.754 149 H ARG 20 H ARG 20 -20.329 7.715 1.504 150 HA ARG 20 HA ARG 20 -21.508 8.472 -0.970 151 HB2 ARG 20 1HB ARG 20 -20.335 10.490 0.918 152 HB3 ARG 20 2HB ARG 20 -21.808 10.595 -0.031 153 HG2 ARG 20 1HG ARG 20 -22.941 9.103 1.461 154 HG3 ARG 20 2HG ARG 20 -21.438 8.799 2.338 155 HD2 ARG 20 1HD ARG 20 -22.904 10.388 3.515 156 HD3 ARG 20 2HD ARG 20 -21.348 11.088 3.078 157 HE ARG 20 HE ARG 20 -23.757 11.567 1.440 158 HH11 ARG 20 1HH1 ARG 20 -21.007 12.724 3.268 159 HH12 ARG 20 2HH1 ARG 20 -21.260 14.391 2.866 160 HH21 ARG 20 1HH2 ARG 20 -24.136 13.775 0.932 161 HH22 ARG 20 2HH2 ARG 20 -23.063 14.996 1.556 162 H LEU 21 H LEU 21 -18.472 9.144 0.622 163 HA LEU 21 HA LEU 21 -17.293 10.869 -1.194 164 HB2 LEU 21 1HB LEU 21 -16.295 10.559 0.921 165 HB3 LEU 21 2HB LEU 21 -16.129 8.832 0.680 166 HG LEU 21 HG LEU 21 -14.447 9.305 -1.105 167 HD11 LEU 21 1HD1 LEU 21 -13.427 11.537 -1.163 168 HD12 LEU 21 2HD1 LEU 21 -14.659 12.124 -0.046 169 HD13 LEU 21 3HD1 LEU 21 -15.119 11.579 -1.659 170 HD21 LEU 21 3HD2 LEU 21 -13.825 10.379 1.645 171 HD22 LEU 21 1HD2 LEU 21 -12.638 9.849 0.453 172 HD23 LEU 21 2HD2 LEU 21 -13.767 8.688 1.151 173 H GLU 22 H GLU 22 -16.942 7.302 -1.132 174 HA GLU 22 HA GLU 22 -15.332 7.284 -3.483 175 HB2 GLU 22 1HB GLU 22 -15.542 4.864 -3.442 176 HB3 GLU 22 2HB GLU 22 -15.210 5.469 -1.828 177 HG2 GLU 22 1HG GLU 22 -17.434 5.084 -1.123 178 HG3 GLU 22 2HG GLU 22 -17.982 4.803 -2.776 179 H GLN 23 H GLN 23 -18.755 7.165 -2.895 180 HA GLN 23 HA GLN 23 -19.495 6.153 -5.444 181 HB2 GLN 23 1HB GLN 23 -20.881 6.344 -3.233 182 HB3 GLN 23 2HB GLN 23 -21.271 7.949 -3.830 183 HG2 GLN 23 1HG GLN 23 -23.001 6.407 -4.445 184 HG3 GLN 23 2HG GLN 23 -22.151 6.953 -5.889 185 HE21 GLN 23 2HE2 GLN 23 -20.870 4.605 -3.639 186 HE22 GLN 23 1HE2 GLN 23 -20.941 3.249 -4.707 187 H MET 24 H MET 24 -19.439 9.425 -4.048 188 HA MET 24 HA MET 24 -20.154 10.726 -6.461 189 HB2 MET 24 1HB MET 24 -19.464 12.791 -5.351 190 HB3 MET 24 2HB MET 24 -20.465 11.807 -4.296 191 HG2 MET 24 1HG MET 24 -18.341 10.992 -3.232 192 HG3 MET 24 2HG MET 24 -17.492 12.227 -4.160 193 HE1 MET 24 3HE MET 24 -17.984 14.848 -3.901 194 HE2 MET 24 1HE MET 24 -19.136 15.517 -2.746 195 HE3 MET 24 2HE MET 24 -19.712 14.581 -4.125 196 H LYS 25 H LYS 25 -17.067 9.897 -5.002 197 HA LYS 25 HA LYS 25 -15.305 11.205 -6.693 198 HB2 LYS 25 1HB LYS 25 -14.648 9.890 -4.695 199 HB3 LYS 25 2HB LYS 25 -15.019 8.409 -5.559 200 HG2 LYS 25 1HG LYS 25 -12.663 8.697 -5.581 201 HG3 LYS 25 2HG LYS 25 -13.252 9.022 -7.212 202 HD2 LYS 25 1HD LYS 25 -13.057 11.387 -6.878 203 HD3 LYS 25 2HD LYS 25 -12.696 11.162 -5.165 204 HE2 LYS 25 1HE LYS 25 -10.973 10.103 -7.401 205 HE3 LYS 25 2HE LYS 25 -10.702 11.652 -6.604 206 HZ1 LYS 25 3HZ LYS 25 -10.249 10.572 -4.560 207 HZ2 LYS 25 1HZ LYS 25 -9.352 9.746 -5.740 208 HZ3 LYS 25 2HZ LYS 25 -10.787 9.068 -5.133 209 H GLU 26 H GLU 26 -16.734 7.971 -7.092 210 HA GLU 26 HA GLU 26 -15.677 7.546 -9.682 211 HB2 GLU 26 1HB GLU 26 -16.310 5.630 -8.437 212 HB3 GLU 26 2HB GLU 26 -17.927 6.260 -8.146 213 HG2 GLU 26 1HG GLU 26 -18.559 5.912 -10.402 214 HG3 GLU 26 2HG GLU 26 -16.899 5.566 -10.881 215 H LYS 27 H LYS 27 -18.859 8.621 -8.542 216 HA LYS 27 HA LYS 27 -20.195 8.815 -10.949 217 HB2 LYS 27 1HB LYS 27 -20.470 9.960 -8.281 218 HB3 LYS 27 2HB LYS 27 -21.107 11.007 -9.541 219 HG2 LYS 27 1HG LYS 27 -21.853 8.112 -9.264 220 HG3 LYS 27 2HG LYS 27 -22.753 9.431 -8.514 221 HD2 LYS 27 1HD LYS 27 -22.209 9.209 -11.475 222 HD3 LYS 27 2HD LYS 27 -23.699 8.673 -10.692 223 HE2 LYS 27 1HE LYS 27 -24.094 10.956 -9.891 224 HE3 LYS 27 2HE LYS 27 -22.611 11.491 -10.677 225 HZ1 LYS 27 3HZ LYS 27 -24.846 10.238 -12.163 226 HZ2 LYS 27 1HZ LYS 27 -23.534 11.109 -12.796 227 HZ3 LYS 27 2HZ LYS 27 -24.740 11.914 -11.915 228 H VAL 28 H VAL 28 -18.116 11.280 -9.432 229 HA VAL 28 HA VAL 28 -18.474 13.226 -11.441 230 HB VAL 28 HB VAL 28 -16.121 12.801 -9.584 231 HG11 VAL 28 1HG1 VAL 28 -15.542 15.127 -10.072 232 HG12 VAL 28 2HG1 VAL 28 -16.829 15.192 -11.277 233 HG13 VAL 28 3HG1 VAL 28 -15.452 14.116 -11.515 234 HG21 VAL 28 3HG2 VAL 28 -18.186 13.221 -8.399 235 HG22 VAL 28 1HG2 VAL 28 -18.521 14.620 -9.418 236 HG23 VAL 28 2HG2 VAL 28 -17.150 14.646 -8.309 237 H MET 29 H MET 29 -16.120 10.615 -11.042 238 HA MET 29 HA MET 29 -14.782 11.262 -13.524 239 HB2 MET 29 1HB MET 29 -14.497 8.956 -11.595 240 HB3 MET 29 2HB MET 29 -13.537 9.118 -13.059 241 HG2 MET 29 1HG MET 29 -12.637 11.233 -12.242 242 HG3 MET 29 2HG MET 29 -13.608 11.083 -10.780 243 HE1 MET 29 3HE MET 29 -10.352 11.489 -10.986 244 HE2 MET 29 1HE MET 29 -9.879 10.482 -9.618 245 HE3 MET 29 2HE MET 29 -11.287 11.538 -9.491 246 H LYS 30 H LYS 30 -17.714 10.375 -13.307 247 HA LYS 30 HA LYS 30 -17.573 8.223 -15.313 248 HB2 LYS 30 1HB LYS 30 -19.036 8.373 -12.871 249 HB3 LYS 30 2HB LYS 30 -20.189 8.414 -14.195 250 HG2 LYS 30 1HG LYS 30 -19.876 6.147 -13.506 251 HG3 LYS 30 2HG LYS 30 -19.157 6.359 -15.104 252 HD2 LYS 30 1HD LYS 30 -16.945 6.540 -14.096 253 HD3 LYS 30 2HD LYS 30 -17.653 6.376 -12.487 254 HE2 LYS 30 1HE LYS 30 -18.501 4.152 -13.125 255 HE3 LYS 30 2HE LYS 30 -17.697 4.315 -14.688 256 HZ1 LYS 30 3HZ LYS 30 -15.608 4.706 -13.245 257 HZ2 LYS 30 1HZ LYS 30 -16.182 3.121 -13.446 258 HZ3 LYS 30 2HZ LYS 30 -16.510 3.959 -12.014 259 H ASP 31 H ASP 31 -18.357 11.466 -14.796 260 HA ASP 31 HA ASP 31 -20.548 11.536 -16.687 261 HB2 ASP 31 1HB ASP 31 -20.419 13.048 -14.655 262 HB3 ASP 31 2HB ASP 31 -19.131 13.911 -15.491 263 H GLN 32 H GLN 32 -20.509 12.590 -18.666 264 HA GLN 32 HA GLN 32 -18.073 12.079 -20.085 265 HB2 GLN 32 1HB GLN 32 -20.599 13.347 -21.143 266 HB3 GLN 32 2HB GLN 32 -19.336 12.556 -22.077 267 HG2 GLN 32 1HG GLN 32 -21.219 11.246 -20.129 268 HG3 GLN 32 2HG GLN 32 -21.263 11.118 -21.885 269 HE21 GLN 32 2HE2 GLN 32 -21.006 9.045 -19.834 270 HE22 GLN 32 1HE2 GLN 32 -19.545 8.196 -20.190 271 H ASP 33 H ASP 33 -19.795 14.968 -19.015 272 HA ASP 33 HA ASP 33 -18.305 16.818 -20.613 273 HB2 ASP 33 1HB ASP 33 -20.554 17.260 -19.430 274 HB3 ASP 33 2HB ASP 33 -19.607 17.458 -17.968 275 H VAL 34 H VAL 34 -18.086 15.542 -17.371 276 HA VAL 34 HA VAL 34 -15.955 17.029 -16.384 277 HB VAL 34 HB VAL 34 -16.743 14.169 -15.800 278 HG11 VAL 34 1HG1 VAL 34 -15.496 14.389 -13.720 279 HG12 VAL 34 2HG1 VAL 34 -14.965 16.004 -14.195 280 HG13 VAL 34 3HG1 VAL 34 -14.424 14.595 -15.107 281 HG21 VAL 34 3HG2 VAL 34 -18.499 15.792 -15.341 282 HG22 VAL 34 1HG2 VAL 34 -17.374 16.757 -14.382 283 HG23 VAL 34 2HG2 VAL 34 -17.844 15.148 -13.836 284 H GLN 35 H GLN 35 -15.939 13.986 -18.241 285 HA GLN 35 HA GLN 35 -13.191 13.495 -18.246 286 HB2 GLN 35 1HB GLN 35 -15.042 13.049 -20.596 287 HB3 GLN 35 2HB GLN 35 -13.532 12.213 -20.274 288 HG2 GLN 35 1HG GLN 35 -16.029 12.036 -18.611 289 HG3 GLN 35 2HG GLN 35 -15.477 10.843 -19.780 290 HE21 GLN 35 2HE2 GLN 35 -15.983 10.604 -16.929 291 HE22 GLN 35 1HE2 GLN 35 -14.516 10.021 -16.228 292 H ALA 36 H ALA 36 -15.144 15.351 -20.532 293 HA ALA 36 HA ALA 36 -13.089 16.144 -22.253 294 HB1 ALA 36 1HB ALA 36 -15.484 16.330 -22.780 295 HB2 ALA 36 2HB ALA 36 -14.617 17.841 -23.060 296 HB3 ALA 36 3HB ALA 36 -15.619 17.652 -21.621 297 H PHE 37 H PHE 37 -14.480 17.860 -19.451 298 HA PHE 37 HA PHE 37 -12.812 20.125 -19.672 299 HB2 PHE 37 1HB PHE 37 -14.819 20.251 -18.341 300 HB3 PHE 37 2HB PHE 37 -14.232 18.984 -17.265 301 HD1 PHE 37 HD1 PHE 37 -13.375 22.388 -18.490 302 HD2 PHE 37 HD2 PHE 37 -13.081 19.544 -15.338 303 HE1 PHE 37 HE1 PHE 37 -12.329 24.090 -17.059 304 HE2 PHE 37 HE2 PHE 37 -12.041 21.243 -13.898 305 HZ PHE 37 HZ PHE 37 -11.660 23.520 -14.759 306 H LEU 38 H LEU 38 -12.468 17.107 -17.871 307 HA LEU 38 HA LEU 38 -10.275 17.767 -16.308 308 HB2 LEU 38 1HB LEU 38 -11.611 15.336 -17.145 309 HB3 LEU 38 2HB LEU 38 -9.879 15.100 -17.001 310 HG LEU 38 HG LEU 38 -10.968 14.509 -14.922 311 HD11 LEU 38 1HD1 LEU 38 -9.511 17.134 -14.643 312 HD12 LEU 38 2HD1 LEU 38 -8.741 15.559 -14.846 313 HD13 LEU 38 3HD1 LEU 38 -9.694 15.895 -13.400 314 HD21 LEU 38 3HD2 LEU 38 -11.983 17.346 -14.877 315 HD22 LEU 38 1HD2 LEU 38 -12.186 16.145 -13.600 316 HD23 LEU 38 2HD2 LEU 38 -12.960 15.907 -15.169 317 H LYS 39 H LYS 39 -10.301 16.283 -19.545 318 HA LYS 39 HA LYS 39 -7.438 16.276 -19.662 319 HB2 LYS 39 1HB LYS 39 -7.727 15.546 -21.994 320 HB3 LYS 39 2HB LYS 39 -8.659 14.578 -20.865 321 HG2 LYS 39 1HG LYS 39 -10.678 15.839 -21.483 322 HG3 LYS 39 2HG LYS 39 -9.722 16.751 -22.656 323 HD2 LYS 39 1HD LYS 39 -10.912 14.932 -23.752 324 HD3 LYS 39 2HD LYS 39 -9.169 14.658 -23.814 325 HE2 LYS 39 1HE LYS 39 -9.469 13.235 -21.736 326 HE3 LYS 39 2HE LYS 39 -11.202 13.329 -22.038 327 HZ1 LYS 39 3HZ LYS 39 -10.820 12.340 -24.221 328 HZ2 LYS 39 1HZ LYS 39 -10.276 11.325 -22.975 329 HZ3 LYS 39 2HZ LYS 39 -9.160 12.219 -23.886 330 H GLU 40 H GLU 40 -9.926 18.510 -20.517 331 HA GLU 40 HA GLU 40 -8.521 20.111 -22.346 332 HB2 GLU 40 1HB GLU 40 -10.993 20.174 -21.703 333 HB3 GLU 40 2HB GLU 40 -10.492 21.138 -20.327 334 HG2 GLU 40 1HG GLU 40 -11.217 22.615 -22.017 335 HG3 GLU 40 2HG GLU 40 -9.467 22.755 -21.909 336 H ASN 41 H ASN 41 -8.808 20.224 -18.842 337 HA ASN 41 HA ASN 41 -6.637 22.218 -18.781 338 HB2 ASN 41 1HB ASN 41 -9.025 21.819 -16.992 339 HB3 ASN 41 2HB ASN 41 -7.609 22.716 -16.442 340 HD21 ASN 41 2HD2 ASN 41 -10.342 22.690 -18.577 341 HD22 ASN 41 1HD2 ASN 41 -10.241 24.349 -19.062 342 H GLU 42 H GLU 42 -6.372 19.240 -18.820 343 HA GLU 42 HA GLU 42 -5.843 18.355 -16.167 344 HB2 GLU 42 1HB GLU 42 -4.786 16.397 -17.178 345 HB3 GLU 42 2HB GLU 42 -6.329 16.754 -17.935 346 HG2 GLU 42 1HG GLU 42 -5.232 17.703 -19.846 347 HG3 GLU 42 2HG GLU 42 -3.656 17.524 -19.074 348 H GLU 43 H GLU 43 -4.008 20.232 -18.358 349 HA GLU 43 HA GLU 43 -1.444 19.708 -17.217 350 HB2 GLU 43 1HB GLU 43 -1.737 20.608 -19.481 351 HB3 GLU 43 2HB GLU 43 -2.469 22.059 -18.825 352 HG2 GLU 43 1HG GLU 43 0.277 21.351 -17.948 353 HG3 GLU 43 2HG GLU 43 0.051 21.977 -19.579 354 H VAL 44 H VAL 44 -4.158 21.640 -16.376 355 HA VAL 44 HA VAL 44 -2.601 23.277 -14.511 356 HB VAL 44 HB VAL 44 -5.524 23.535 -15.216 357 HG11 VAL 44 1HG1 VAL 44 -3.590 25.440 -13.906 358 HG12 VAL 44 2HG1 VAL 44 -4.943 24.612 -13.135 359 HG13 VAL 44 3HG1 VAL 44 -5.247 25.831 -14.373 360 HG21 VAL 44 3HG2 VAL 44 -3.180 24.997 -16.421 361 HG22 VAL 44 1HG2 VAL 44 -4.883 25.333 -16.742 362 HG23 VAL 44 2HG2 VAL 44 -4.177 23.791 -17.232 363 H ILE 45 H ILE 45 -5.309 21.023 -14.650 364 HA ILE 45 HA ILE 45 -5.900 21.256 -11.840 365 HB ILE 45 HB ILE 45 -6.943 19.286 -13.880 366 HG12 ILE 45 1HG1 ILE 45 -8.200 21.843 -12.867 367 HG13 ILE 45 2HG1 ILE 45 -7.387 21.678 -14.422 368 HG21 ILE 45 1HG2 ILE 45 -8.014 20.039 -11.164 369 HG22 ILE 45 2HG2 ILE 45 -7.247 18.509 -11.588 370 HG23 ILE 45 3HG2 ILE 45 -8.792 18.952 -12.315 371 HD11 ILE 45 3HD1 ILE 45 -9.868 20.224 -13.536 372 HD12 ILE 45 1HD1 ILE 45 -9.032 19.975 -15.070 373 HD13 ILE 45 2HD1 ILE 45 -9.769 21.535 -14.712 374 H ASP 46 H ASP 46 -5.508 19.787 -10.250 375 HA ASP 46 HA ASP 46 -3.736 17.526 -10.910 376 HB2 ASP 46 1HB ASP 46 -2.744 19.284 -9.411 377 HB3 ASP 46 2HB ASP 46 -4.005 18.919 -8.238 378 H GLN 47 H GLN 47 -3.987 15.651 -9.476 379 HA GLN 47 HA GLN 47 -6.555 14.603 -9.398 380 HB2 GLN 47 1HB GLN 47 -4.088 13.916 -7.808 381 HB3 GLN 47 2HB GLN 47 -5.540 12.918 -7.832 382 HG2 GLN 47 1HG GLN 47 -5.284 12.532 -10.195 383 HG3 GLN 47 2HG GLN 47 -3.908 13.634 -10.255 384 HE21 GLN 47 2HE2 GLN 47 -1.932 12.983 -9.457 385 HE22 GLN 47 1HE2 GLN 47 -1.585 11.321 -9.088 386 H LYS 48 H LYS 48 -4.673 16.188 -6.855 387 HA LYS 48 HA LYS 48 -6.590 15.737 -4.803 388 HB2 LYS 48 1HB LYS 48 -4.268 17.638 -5.040 389 HB3 LYS 48 2HB LYS 48 -5.275 17.534 -3.604 390 HG2 LYS 48 1HG LYS 48 -4.713 15.151 -3.405 391 HG3 LYS 48 2HG LYS 48 -3.654 15.300 -4.805 392 HD2 LYS 48 1HD LYS 48 -2.281 16.918 -3.600 393 HD3 LYS 48 2HD LYS 48 -3.361 16.799 -2.208 394 HE2 LYS 48 1HE LYS 48 -1.778 14.515 -3.378 395 HE3 LYS 48 2HE LYS 48 -1.323 15.436 -1.946 396 HZ1 LYS 48 3HZ LYS 48 -3.857 13.895 -2.199 397 HZ2 LYS 48 1HZ LYS 48 -3.261 14.661 -0.807 398 HZ3 LYS 48 2HZ LYS 48 -2.457 13.309 -1.444 399 H MET 49 H MET 49 -5.988 18.402 -7.015 400 HA MET 49 HA MET 49 -7.802 20.265 -6.061 401 HB2 MET 49 1HB MET 49 -6.203 20.626 -7.943 402 HB3 MET 49 2HB MET 49 -7.234 19.638 -8.963 403 HG2 MET 49 1HG MET 49 -9.050 21.222 -8.683 404 HG3 MET 49 2HG MET 49 -8.030 22.192 -7.625 405 HE1 MET 49 3HE MET 49 -6.018 23.651 -8.407 406 HE2 MET 49 1HE MET 49 -5.331 23.603 -10.031 407 HE3 MET 49 2HE MET 49 -5.214 22.190 -8.982 408 H ILE 50 H ILE 50 -8.319 17.427 -8.085 409 HA ILE 50 HA ILE 50 -11.031 17.824 -8.683 410 HB ILE 50 HB ILE 50 -9.466 15.257 -8.388 411 HG12 ILE 50 1HG1 ILE 50 -8.649 16.765 -10.139 412 HG13 ILE 50 2HG1 ILE 50 -9.380 15.326 -10.839 413 HG21 ILE 50 1HG2 ILE 50 -11.266 14.206 -9.700 414 HG22 ILE 50 2HG2 ILE 50 -12.199 15.697 -9.579 415 HG23 ILE 50 3HG2 ILE 50 -11.823 14.772 -8.125 416 HD11 ILE 50 3HD1 ILE 50 -9.991 17.321 -12.081 417 HD12 ILE 50 1HD1 ILE 50 -10.683 18.029 -10.622 418 HD13 ILE 50 2HD1 ILE 50 -11.411 16.588 -11.330 419 H GLU 51 H GLU 51 -9.482 16.071 -6.004 420 HA GLU 51 HA GLU 51 -11.956 15.285 -4.829 421 HB2 GLU 51 1HB GLU 51 -9.189 15.399 -3.620 422 HB3 GLU 51 2HB GLU 51 -10.584 14.610 -2.892 423 HG2 GLU 51 1HG GLU 51 -10.731 13.160 -4.908 424 HG3 GLU 51 2HG GLU 51 -9.215 13.866 -5.463 425 H LYS 52 H LYS 52 -9.874 18.081 -4.441 426 HA LYS 52 HA LYS 52 -11.191 19.091 -2.128 427 HB2 LYS 52 1HB LYS 52 -9.425 20.365 -4.205 428 HB3 LYS 52 2HB LYS 52 -10.175 21.314 -2.930 429 HG2 LYS 52 1HG LYS 52 -8.302 18.994 -2.529 430 HG3 LYS 52 2HG LYS 52 -7.893 20.704 -2.358 431 HD2 LYS 52 1HD LYS 52 -9.577 20.896 -0.562 432 HD3 LYS 52 2HD LYS 52 -9.903 19.168 -0.707 433 HE2 LYS 52 1HE LYS 52 -8.415 19.539 1.142 434 HE3 LYS 52 2HE LYS 52 -7.541 18.714 -0.146 435 HZ1 LYS 52 3HZ LYS 52 -7.438 21.646 0.329 436 HZ2 LYS 52 1HZ LYS 52 -6.492 20.763 -0.766 437 HZ3 LYS 52 2HZ LYS 52 -6.283 20.547 0.904 438 H SER 53 H SER 53 -11.598 19.632 -5.601 439 HA SER 53 HA SER 53 -13.877 21.390 -5.106 440 HB2 SER 53 1HB SER 53 -12.691 20.539 -7.757 441 HB3 SER 53 2HB SER 53 -13.771 21.900 -7.457 442 HG SER 53 HG SER 53 -11.074 21.588 -6.653 443 H LEU 54 H LEU 54 -13.738 18.387 -4.668 444 HA LEU 54 HA LEU 54 -15.183 16.889 -6.465 445 HB2 LEU 54 1HB LEU 54 -14.310 16.641 -3.811 446 HB3 LEU 54 2HB LEU 54 -16.039 16.338 -3.767 447 HG LEU 54 HG LEU 54 -14.024 14.872 -5.473 448 HD11 LEU 54 1HD1 LEU 54 -15.577 13.960 -3.056 449 HD12 LEU 54 2HD1 LEU 54 -13.852 14.326 -3.098 450 HD13 LEU 54 3HD1 LEU 54 -14.488 12.969 -4.027 451 HD21 LEU 54 3HD2 LEU 54 -15.883 13.369 -6.023 452 HD22 LEU 54 1HD2 LEU 54 -16.175 15.013 -6.594 453 HD23 LEU 54 2HD2 LEU 54 -16.987 14.426 -5.143 454 H ASN 55 H ASN 55 -16.428 18.737 -3.738 455 HA ASN 55 HA ASN 55 -19.134 18.269 -3.991 456 HB2 ASN 55 1HB ASN 55 -17.871 20.892 -3.192 457 HB3 ASN 55 2HB ASN 55 -19.476 20.328 -2.750 458 HD21 ASN 55 2HD2 ASN 55 -17.180 21.148 -1.132 459 HD22 ASN 55 1HD2 ASN 55 -16.846 19.820 -0.072 460 H LYS 56 H LYS 56 -17.173 20.783 -5.534 461 HA LYS 56 HA LYS 56 -19.265 22.073 -6.895 462 HB2 LYS 56 1HB LYS 56 -16.300 21.915 -7.422 463 HB3 LYS 56 2HB LYS 56 -17.386 22.913 -8.380 464 HG2 LYS 56 1HG LYS 56 -17.120 23.153 -5.394 465 HG3 LYS 56 2HG LYS 56 -16.170 24.102 -6.543 466 HD2 LYS 56 1HD LYS 56 -18.130 25.125 -7.429 467 HD3 LYS 56 2HD LYS 56 -19.179 24.019 -6.539 468 HE2 LYS 56 1HE LYS 56 -17.291 25.929 -5.188 469 HE3 LYS 56 2HE LYS 56 -18.954 26.353 -5.593 470 HZ1 LYS 56 3HZ LYS 56 -18.884 25.598 -3.348 471 HZ2 LYS 56 1HZ LYS 56 -18.060 24.178 -3.775 472 HZ3 LYS 56 2HZ LYS 56 -19.667 24.404 -4.265 473 H LEU 57 H LEU 57 -16.918 19.651 -8.054 474 HA LEU 57 HA LEU 57 -17.986 19.510 -10.655 475 HB2 LEU 57 1HB LEU 57 -16.134 17.824 -9.053 476 HB3 LEU 57 2HB LEU 57 -16.813 17.139 -10.516 477 HG LEU 57 HG LEU 57 -15.883 19.024 -11.815 478 HD11 LEU 57 1HD1 LEU 57 -14.221 20.497 -10.777 479 HD12 LEU 57 2HD1 LEU 57 -14.618 19.815 -9.199 480 HD13 LEU 57 3HD1 LEU 57 -15.831 20.727 -10.097 481 HD21 LEU 57 3HD2 LEU 57 -13.859 17.543 -10.143 482 HD22 LEU 57 1HD2 LEU 57 -13.549 18.330 -11.690 483 HD23 LEU 57 2HD2 LEU 57 -14.633 16.941 -11.610 484 H TYR 58 H TYR 58 -18.802 17.770 -7.707 485 HA TYR 58 HA TYR 58 -20.470 15.869 -9.039 486 HB2 TYR 58 1HB TYR 58 -19.446 15.545 -6.753 487 HB3 TYR 58 2HB TYR 58 -20.644 16.682 -6.137 488 HD1 TYR 58 HD1 TYR 58 -20.402 13.536 -8.118 489 HD2 TYR 58 HD2 TYR 58 -22.691 15.856 -5.382 490 HE1 TYR 58 HE1 TYR 58 -22.013 11.697 -7.922 491 HE2 TYR 58 HE2 TYR 58 -24.310 14.018 -5.176 492 HH TYR 58 HH TYR 58 -25.057 12.071 -6.460 493 H GLU 59 H GLU 59 -21.032 18.938 -7.372 494 HA GLU 59 HA GLU 59 -23.849 18.957 -7.650 495 HB2 GLU 59 1HB GLU 59 -22.591 20.399 -6.087 496 HB3 GLU 59 2HB GLU 59 -21.904 21.270 -7.449 497 HG2 GLU 59 1HG GLU 59 -24.040 22.151 -8.047 498 HG3 GLU 59 2HG GLU 59 -24.845 21.137 -6.848 499 H TYR 60 H TYR 60 -21.206 19.902 -9.688 500 HA TYR 60 HA TYR 60 -22.488 21.335 -11.701 501 HB2 TYR 60 1HB TYR 60 -20.073 21.171 -11.439 502 HB3 TYR 60 2HB TYR 60 -20.124 19.456 -11.809 503 HD1 TYR 60 HD2 TYR 60 -20.808 22.802 -13.267 504 HD2 TYR 60 HD1 TYR 60 -19.823 18.727 -14.005 505 HE1 TYR 60 HE2 TYR 60 -20.327 23.347 -15.611 506 HE2 TYR 60 HE1 TYR 60 -19.341 19.261 -16.365 507 HH TYR 60 HH TYR 60 -19.134 20.869 -17.880 508 H ILE 61 H ILE 61 -21.817 17.852 -11.520 509 HA ILE 61 HA ILE 61 -23.114 17.303 -14.010 510 HB ILE 61 HB ILE 61 -22.715 14.952 -13.523 511 HG12 ILE 61 1HG1 ILE 61 -21.696 15.919 -10.839 512 HG13 ILE 61 2HG1 ILE 61 -23.168 14.986 -11.100 513 HG21 ILE 61 1HG2 ILE 61 -20.929 16.306 -14.467 514 HG22 ILE 61 2HG2 ILE 61 -20.273 15.054 -13.412 515 HG23 ILE 61 3HG2 ILE 61 -20.372 16.721 -12.846 516 HD11 ILE 61 3HD1 ILE 61 -21.382 13.570 -10.295 517 HD12 ILE 61 1HD1 ILE 61 -20.355 14.065 -11.641 518 HD13 ILE 61 2HD1 ILE 61 -21.817 13.127 -11.946 519 H GLU 62 H GLU 62 -24.141 17.412 -10.700 520 HA GLU 62 HA GLU 62 -26.350 15.644 -10.979 521 HB2 GLU 62 1HB GLU 62 -25.990 15.666 -8.779 522 HB3 GLU 62 2HB GLU 62 -24.934 17.059 -8.926 523 HG2 GLU 62 1HG GLU 62 -26.492 17.832 -7.474 524 HG3 GLU 62 2HG GLU 62 -27.153 18.384 -9.010 525 H GLN 63 H GLN 63 -25.849 19.108 -11.332 526 HA GLN 63 HA GLN 63 -28.676 19.717 -11.331 527 HB2 GLN 63 1HB GLN 63 -26.290 21.428 -12.056 528 HB3 GLN 63 2HB GLN 63 -27.943 22.009 -11.897 529 HG2 GLN 63 1HG GLN 63 -27.937 21.372 -9.538 530 HG3 GLN 63 2HG GLN 63 -26.277 20.798 -9.703 531 HE21 GLN 63 2HE2 GLN 63 -24.621 22.296 -10.022 532 HE22 GLN 63 1HE2 GLN 63 -24.823 23.964 -9.611 533 H SER 64 H SER 64 -29.319 21.292 -13.269 534 HA SER 64 HA SER 64 -29.529 19.645 -15.559 535 HB2 SER 64 1HB SER 64 -31.282 21.252 -14.995 536 HB3 SER 64 2HB SER 64 -30.157 22.593 -15.204 537 HG SER 64 HG SER 64 -30.241 22.369 -17.336 538 H LYS 65 H LYS 65 -27.998 19.260 -16.979 539 HA LYS 65 HA LYS 65 -25.717 20.949 -17.311 540 HB2 LYS 65 1HB LYS 65 -26.384 18.290 -17.918 541 HB3 LYS 65 2HB LYS 65 -26.087 19.061 -19.472 542 HG2 LYS 65 1HG LYS 65 -24.192 19.103 -17.133 543 HG3 LYS 65 2HG LYS 65 -24.076 18.019 -18.522 544 HD2 LYS 65 1HD LYS 65 -23.535 19.745 -19.979 545 HD3 LYS 65 2HD LYS 65 -24.190 20.986 -18.910 546 HE2 LYS 65 1HE LYS 65 -22.365 20.680 -17.365 547 HE3 LYS 65 2HE LYS 65 -21.747 19.330 -18.317 548 HZ1 LYS 65 3HZ LYS 65 -21.041 20.722 -19.999 549 HZ2 LYS 65 1HZ LYS 65 -20.675 21.611 -18.603 550 HZ3 LYS 65 2HZ LYS 65 -22.045 22.006 -19.517 551 H ASN 66 H ASN 66 -28.792 20.598 -18.819 552 HA ASN 66 HA ASN 66 -28.038 22.400 -21.012 553 HB2 ASN 66 1HB ASN 66 -29.573 20.092 -20.987 554 HB3 ASN 66 2HB ASN 66 -30.773 21.377 -20.996 555 HD21 ASN 66 2HD2 ASN 66 -30.044 19.418 -23.044 556 HD22 ASN 66 1HD2 ASN 66 -29.633 20.343 -24.452 557 H CYS 67 H CYS 67 -30.672 23.416 -21.460 558 HA CYS 67 HA CYS 67 -31.593 24.584 -18.989 559 HB2 CYS 67 1HB CYS 67 -31.020 26.787 -19.280 560 HB3 CYS 67 2HB CYS 67 -29.603 26.017 -19.969 561 H SER 68 H SER 68 -33.547 25.920 -19.358 562 HA SER 68 HA SER 68 -35.170 24.427 -21.236 563 HB2 SER 68 1HB SER 68 -35.915 24.948 -18.893 564 HB3 SER 68 2HB SER 68 -36.057 26.639 -19.373 565 HG SER 68 HG SER 68 -37.326 24.989 -21.118 566 H TYR 69 H TYR 69 -33.476 27.351 -21.286 567 HA TYR 69 HA TYR 69 -35.028 28.790 -23.165 568 HB2 TYR 69 1HB TYR 69 -32.919 29.439 -21.732 569 HB3 TYR 69 2HB TYR 69 -32.046 28.924 -23.165 570 HD1 TYR 69 HD2 TYR 69 -34.346 31.408 -21.788 571 HD2 TYR 69 HD1 TYR 69 -32.149 30.200 -25.217 572 HE1 TYR 69 HE2 TYR 69 -34.748 33.604 -22.809 573 HE2 TYR 69 HE1 TYR 69 -32.541 32.392 -26.252 574 HH TYR 69 HH TYR 69 -34.321 34.233 -26.037 575 H CYS 70 H CYS 70 -33.331 25.896 -23.439 576 HA CYS 70 HA CYS 70 -33.483 26.105 -26.370 577 HB2 CYS 70 1HB CYS 70 -31.553 24.529 -26.519 578 HB3 CYS 70 2HB CYS 70 -31.144 26.111 -25.872 579 H SER 71 H SER 71 -33.627 23.984 -23.557 580 HA SER 71 HA SER 71 -34.901 21.905 -25.171 581 HB2 SER 71 1HB SER 71 -34.086 21.799 -22.260 582 HB3 SER 71 2HB SER 71 -34.483 20.437 -23.308 583 HG SER 71 HG SER 71 -32.317 20.477 -23.338 584 H GLU 72 H GLU 72 -36.922 20.997 -24.501 585 HA GLU 72 HA GLU 72 -38.669 22.955 -23.259 586 HB2 GLU 72 1HB GLU 72 -40.411 21.094 -23.876 587 HB3 GLU 72 2HB GLU 72 -39.758 22.162 -25.105 588 HG2 GLU 72 1HG GLU 72 -39.806 19.941 -25.968 589 HG3 GLU 72 2HG GLU 72 -38.127 20.403 -25.705 590 H ASP 73 H ASP 73 -36.642 21.095 -21.931 591 HA ASP 73 HA ASP 73 -38.073 19.468 -20.114 592 HB2 ASP 73 1HB ASP 73 -35.311 20.683 -19.944 593 HB3 ASP 73 2HB ASP 73 -35.964 19.593 -18.730 594 H GLU 74 H GLU 74 -39.781 20.761 -19.389 595 HA GLU 74 HA GLU 74 -39.260 23.180 -17.919 596 HB2 GLU 74 1HB GLU 74 -41.338 22.795 -19.238 597 HB3 GLU 74 2HB GLU 74 -41.791 21.534 -18.101 598 HG2 GLU 74 1HG GLU 74 -41.825 23.212 -16.301 599 HG3 GLU 74 2HG GLU 74 -41.458 24.461 -17.492 600 H ASN 75 H ASN 75 -39.007 19.918 -17.256 601 HA ASN 75 HA ASN 75 -39.985 19.978 -14.539 602 HB2 ASN 75 1HB ASN 75 -39.842 17.972 -16.267 603 HB3 ASN 75 2HB ASN 75 -38.247 17.769 -15.551 604 HD21 ASN 75 2HD2 ASN 75 -41.647 17.530 -15.088 605 HD22 ASN 75 1HD2 ASN 75 -41.599 16.730 -13.552 606 H CYS 76 H CYS 76 -37.133 20.853 -16.102 607 HA CYS 76 HA CYS 76 -35.391 20.306 -13.847 608 HB2 CYS 76 1HB CYS 76 -34.834 21.747 -16.452 609 HB3 CYS 76 2HB CYS 76 -33.627 21.279 -15.256 610 HG CYS 76 HG CYS 76 -34.326 18.485 -15.575 611 H ASN 77 H ASN 77 -35.418 21.636 -12.156 612 HA ASN 77 HA ASN 77 -36.360 24.342 -12.358 613 HB2 ASN 77 1HB ASN 77 -36.775 23.035 -10.322 614 HB3 ASN 77 2HB ASN 77 -35.042 22.898 -10.048 615 HD21 ASN 77 2HD2 ASN 77 -35.087 23.917 -8.081 616 HD22 ASN 77 1HD2 ASN 77 -35.411 25.610 -7.897 617 H ASN 78 H ASN 78 -35.113 25.785 -13.349 618 HA ASN 78 HA ASN 78 -32.256 25.907 -12.623 619 HB2 ASN 78 1HB ASN 78 -33.569 26.716 -15.233 620 HB3 ASN 78 2HB ASN 78 -31.876 26.976 -14.841 621 HD21 ASN 78 2HD2 ASN 78 -33.144 25.465 -16.994 622 HD22 ASN 78 1HD2 ASN 78 -32.511 23.854 -16.868 623 H LEU 79 H LEU 79 -31.531 27.811 -11.826 624 HA LEU 79 HA LEU 79 -33.447 30.024 -11.767 625 HB2 LEU 79 1HB LEU 79 -32.073 30.952 -9.923 626 HB3 LEU 79 2HB LEU 79 -32.851 29.429 -9.556 627 HG LEU 79 HG LEU 79 -30.007 29.398 -10.474 628 HD11 LEU 79 1HD1 LEU 79 -29.279 29.709 -8.161 629 HD12 LEU 79 2HD1 LEU 79 -30.944 30.042 -7.682 630 HD13 LEU 79 3HD1 LEU 79 -30.102 31.145 -8.769 631 HD21 LEU 79 3HD2 LEU 79 -29.917 27.481 -8.960 632 HD22 LEU 79 1HD2 LEU 79 -31.214 27.290 -10.140 633 HD23 LEU 79 2HD2 LEU 79 -31.592 27.770 -8.487 634 H LEU 80 H LEU 80 -30.119 29.169 -12.535 635 HA LEU 80 HA LEU 80 -29.690 31.735 -13.825 636 HB2 LEU 80 1HB LEU 80 -28.012 29.246 -13.602 637 HB3 LEU 80 2HB LEU 80 -27.554 30.586 -14.630 638 HG LEU 80 HG LEU 80 -26.311 30.850 -12.661 639 HD11 LEU 80 1HD1 LEU 80 -28.714 32.650 -12.425 640 HD12 LEU 80 2HD1 LEU 80 -27.296 32.923 -13.437 641 HD13 LEU 80 3HD1 LEU 80 -27.138 32.927 -11.681 642 HD21 LEU 80 3HD2 LEU 80 -27.260 30.817 -10.412 643 HD22 LEU 80 1HD2 LEU 80 -27.521 29.286 -11.248 644 HD23 LEU 80 2HD2 LEU 80 -28.846 30.438 -11.084 645 H GLU 81 H GLU 81 -31.904 30.719 -14.883 646 HA GLU 81 HA GLU 81 -31.538 28.930 -17.050 647 HB2 GLU 81 1HB GLU 81 -33.710 29.264 -15.939 648 HB3 GLU 81 2HB GLU 81 -33.764 30.916 -16.535 649 HG2 GLU 81 1HG GLU 81 -35.168 29.326 -17.809 650 HG3 GLU 81 2HG GLU 81 -33.974 30.173 -18.789 651 H GLY 82 H GLY 82 -31.584 29.355 -19.270 652 HA2 GLY 82 1HA GLY 82 -31.184 30.679 -21.170 653 HA3 GLY 82 2HA GLY 82 -30.871 32.056 -20.122 654 H TYR 83 H TYR 83 -29.208 29.831 -18.602 655 HA TYR 83 HA TYR 83 -26.794 30.084 -20.282 656 HB2 TYR 83 1HB TYR 83 -26.888 30.143 -17.257 657 HB3 TYR 83 2HB TYR 83 -25.465 30.351 -18.266 658 HD1 TYR 83 HD1 TYR 83 -25.056 32.466 -19.412 659 HD2 TYR 83 HD2 TYR 83 -28.471 31.939 -16.930 660 HE1 TYR 83 HE1 TYR 83 -25.375 34.903 -19.341 661 HE2 TYR 83 HE2 TYR 83 -28.803 34.374 -16.856 662 HH TYR 83 HH TYR 83 -27.531 36.412 -17.153 663 H HIS 84 H HIS 84 -25.085 28.457 -19.585 664 HA HIS 84 HA HIS 84 -26.219 25.998 -18.408 665 HB2 HIS 84 1HB HIS 84 -24.307 26.174 -20.749 666 HB3 HIS 84 2HB HIS 84 -24.627 24.696 -19.860 667 HD1 HIS 84 HD1 HIS 84 -25.531 23.522 -21.977 668 HD2 HIS 84 HD2 HIS 84 -27.658 26.912 -20.875 669 HE1 HIS 84 HE1 HIS 84 -27.563 23.621 -23.484 670 HA PRO 85 HA PRO 85 -22.644 26.381 -15.798 671 HB2 PRO 85 1HB PRO 85 -22.545 23.899 -14.763 672 HB3 PRO 85 2HB PRO 85 -23.817 25.045 -14.330 673 HG2 PRO 85 1HG PRO 85 -23.898 22.754 -16.248 674 HG3 PRO 85 2HG PRO 85 -25.123 23.283 -15.081 675 HD2 PRO 85 1HD PRO 85 -25.209 23.868 -17.758 676 HD3 PRO 85 2HD PRO 85 -25.967 24.866 -16.502 677 H LYS 86 H LYS 86 -20.523 26.321 -16.197 678 HA LYS 86 HA LYS 86 -19.377 23.907 -17.413 679 HB2 LYS 86 1HB LYS 86 -17.896 25.206 -18.836 680 HB3 LYS 86 2HB LYS 86 -19.560 25.636 -19.195 681 HG2 LYS 86 1HG LYS 86 -19.338 27.678 -17.910 682 HG3 LYS 86 2HG LYS 86 -17.696 27.236 -17.452 683 HD2 LYS 86 1HD LYS 86 -18.625 27.695 -20.286 684 HD3 LYS 86 2HD LYS 86 -17.800 28.898 -19.298 685 HE2 LYS 86 1HE LYS 86 -15.952 28.085 -20.302 686 HE3 LYS 86 2HE LYS 86 -16.084 26.816 -19.087 687 HZ1 LYS 86 3HZ LYS 86 -17.272 25.445 -20.686 688 HZ2 LYS 86 1HZ LYS 86 -15.767 25.911 -21.315 689 HZ3 LYS 86 2HZ LYS 86 -17.184 26.676 -21.847 690 H LEU 87 H LEU 87 -17.306 23.409 -16.705 691 HA LEU 87 HA LEU 87 -16.661 24.474 -14.109 692 HB2 LEU 87 1HB LEU 87 -15.316 22.370 -15.805 693 HB3 LEU 87 2HB LEU 87 -14.846 22.775 -14.164 694 HG LEU 87 HG LEU 87 -17.552 21.687 -14.946 695 HD11 LEU 87 1HD1 LEU 87 -15.181 20.304 -13.701 696 HD12 LEU 87 2HD1 LEU 87 -15.820 20.029 -15.322 697 HD13 LEU 87 3HD1 LEU 87 -16.789 19.606 -13.910 698 HD21 LEU 87 3HD2 LEU 87 -17.853 21.380 -12.554 699 HD22 LEU 87 1HD2 LEU 87 -17.562 23.078 -12.935 700 HD23 LEU 87 2HD2 LEU 87 -16.268 22.093 -12.248 701 H VAL 88 H VAL 88 -14.899 25.659 -13.534 702 HA VAL 88 HA VAL 88 -12.908 26.320 -15.581 703 HB VAL 88 HB VAL 88 -12.898 28.708 -14.857 704 HG11 VAL 88 1HG1 VAL 88 -14.024 28.079 -16.925 705 HG12 VAL 88 2HG1 VAL 88 -14.882 29.397 -16.124 706 HG13 VAL 88 3HG1 VAL 88 -15.508 27.750 -16.032 707 HG21 VAL 88 3HG2 VAL 88 -14.839 29.613 -13.677 708 HG22 VAL 88 1HG2 VAL 88 -13.979 28.432 -12.687 709 HG23 VAL 88 2HG2 VAL 88 -15.485 27.983 -13.489 710 H VAL 89 H VAL 89 -10.848 26.604 -14.770 711 HA VAL 89 HA VAL 89 -10.542 25.866 -11.961 712 HB VAL 89 HB VAL 89 -9.228 24.543 -13.496 713 HG11 VAL 89 1HG1 VAL 89 -7.439 25.483 -14.864 714 HG12 VAL 89 2HG1 VAL 89 -7.913 27.110 -14.373 715 HG13 VAL 89 3HG1 VAL 89 -9.014 26.123 -15.334 716 HG21 VAL 89 3HG2 VAL 89 -7.501 26.432 -11.902 717 HG22 VAL 89 1HG2 VAL 89 -6.983 24.874 -12.545 718 HG23 VAL 89 2HG2 VAL 89 -8.250 24.943 -11.321 719 H ASN 90 H ASN 90 -10.380 27.388 -10.515 720 HA ASN 90 HA ASN 90 -9.121 29.947 -11.265 721 HB2 ASN 90 1HB ASN 90 -11.357 29.376 -9.313 722 HB3 ASN 90 2HB ASN 90 -10.502 30.913 -9.378 723 HD21 ASN 90 2HD2 ASN 90 -13.321 30.145 -9.883 724 HD22 ASN 90 1HD2 ASN 90 -13.681 30.768 -11.461 725 H GLY 91 H GLY 91 -7.061 29.576 -10.608 726 HA2 GLY 91 1HA GLY 91 -5.314 29.424 -9.126 727 HA3 GLY 91 2HA GLY 91 -6.484 29.603 -7.823 728 H ARG 92 H ARG 92 -6.784 27.903 -6.538 729 HA ARG 92 HA ARG 92 -5.752 25.308 -7.469 730 HB2 ARG 92 1HB ARG 92 -6.009 26.470 -4.701 731 HB3 ARG 92 2HB ARG 92 -5.724 24.759 -4.974 732 HG2 ARG 92 1HG ARG 92 -3.634 25.821 -4.513 733 HG3 ARG 92 2HG ARG 92 -3.656 25.343 -6.210 734 HD2 ARG 92 1HD ARG 92 -4.282 27.648 -6.819 735 HD3 ARG 92 2HD ARG 92 -4.171 28.103 -5.123 736 HE ARG 92 HE ARG 92 -1.762 26.909 -6.100 737 HH11 ARG 92 1HH1 ARG 92 -3.579 29.901 -5.909 738 HH12 ARG 92 2HH1 ARG 92 -2.186 30.910 -6.140 739 HH21 ARG 92 1HH2 ARG 92 0.073 28.232 -6.379 740 HH22 ARG 92 2HH2 ARG 92 -0.109 29.967 -6.427 741 H SER 93 H SER 93 -8.580 26.848 -7.250 742 HA SER 93 HA SER 93 -10.050 24.416 -6.476 743 HB2 SER 93 1HB SER 93 -11.906 26.052 -5.829 744 HB3 SER 93 2HB SER 93 -10.492 26.002 -4.773 745 HG SER 93 HG SER 93 -10.804 27.861 -6.892 746 H ILE 94 H ILE 94 -11.865 23.865 -7.683 747 HA ILE 94 HA ILE 94 -12.000 25.149 -10.323 748 HB ILE 94 HB ILE 94 -13.077 22.445 -9.492 749 HG12 ILE 94 1HG1 ILE 94 -10.602 23.053 -11.117 750 HG13 ILE 94 2HG1 ILE 94 -10.566 22.687 -9.396 751 HG21 ILE 94 1HG2 ILE 94 -14.246 23.425 -11.400 752 HG22 ILE 94 2HG2 ILE 94 -13.269 22.045 -11.902 753 HG23 ILE 94 3HG2 ILE 94 -12.706 23.687 -12.219 754 HD11 ILE 94 3HD1 ILE 94 -11.562 20.489 -9.883 755 HD12 ILE 94 1HD1 ILE 94 -10.002 20.731 -10.670 756 HD13 ILE 94 2HD1 ILE 94 -11.495 20.867 -11.604 757 H ASP 95 H ASP 95 -13.748 26.302 -10.852 758 HA ASP 95 HA ASP 95 -16.017 26.274 -8.985 759 HB2 ASP 95 1HB ASP 95 -14.822 28.507 -10.617 760 HB3 ASP 95 2HB ASP 95 -16.442 28.613 -9.940 761 H ILE 96 H ILE 96 -17.987 27.368 -10.154 762 HA ILE 96 HA ILE 96 -18.357 26.011 -12.738 763 HB ILE 96 HB ILE 96 -20.408 26.203 -10.522 764 HG12 ILE 96 1HG1 ILE 96 -19.054 23.711 -11.546 765 HG13 ILE 96 2HG1 ILE 96 -18.423 24.629 -10.181 766 HG21 ILE 96 1HG2 ILE 96 -21.719 24.676 -11.947 767 HG22 ILE 96 2HG2 ILE 96 -20.486 24.807 -13.200 768 HG23 ILE 96 3HG2 ILE 96 -21.422 26.227 -12.731 769 HD11 ILE 96 3HD1 ILE 96 -21.127 23.332 -10.355 770 HD12 ILE 96 1HD1 ILE 96 -20.528 24.284 -8.996 771 HD13 ILE 96 2HD1 ILE 96 -19.739 22.767 -9.423 772 H GLU 97 H GLU 97 -18.462 27.633 -14.149 773 HA GLU 97 HA GLU 97 -19.992 30.041 -13.434 774 HB2 GLU 97 1HB GLU 97 -17.832 29.575 -15.495 775 HB3 GLU 97 2HB GLU 97 -18.789 31.049 -15.416 776 HG2 GLU 97 1HG GLU 97 -17.164 30.032 -13.103 777 HG3 GLU 97 2HG GLU 97 -16.520 31.123 -14.329 778 H TYR 98 H TYR 98 -21.476 30.890 -14.898 779 HA TYR 98 HA TYR 98 -22.638 28.868 -16.670 780 HB2 TYR 98 1HB TYR 98 -23.711 31.194 -15.156 781 HB3 TYR 98 2HB TYR 98 -24.525 30.741 -16.651 782 HD1 TYR 98 HD2 TYR 98 -23.658 29.628 -13.242 783 HD2 TYR 98 HD1 TYR 98 -25.838 28.746 -16.796 784 HE1 TYR 98 HE2 TYR 98 -24.913 27.890 -12.035 785 HE2 TYR 98 HE1 TYR 98 -27.099 27.010 -15.594 786 HH TYR 98 HH TYR 98 -26.798 25.568 -13.581 787 H TYR 99 H TYR 99 -22.448 29.038 -18.787 788 HA TYR 99 HA TYR 99 -21.822 31.674 -19.925 789 HB2 TYR 99 1HB TYR 99 -21.035 30.509 -21.924 790 HB3 TYR 99 2HB TYR 99 -20.201 29.893 -20.506 791 HD1 TYR 99 HD2 TYR 99 -20.600 27.612 -19.723 792 HD2 TYR 99 HD1 TYR 99 -22.575 29.121 -23.177 793 HE1 TYR 99 HE2 TYR 99 -21.241 25.325 -20.351 794 HE2 TYR 99 HE1 TYR 99 -23.218 26.836 -23.814 795 HH TYR 99 HH TYR 99 -22.900 24.182 -21.678 796 H GLU 100 H GLU 100 -23.119 32.497 -21.601 797 HA GLU 100 HA GLU 100 -25.852 31.882 -21.311 798 HB2 GLU 100 1HB GLU 100 -26.216 33.414 -23.229 799 HB3 GLU 100 2HB GLU 100 -25.218 34.103 -21.958 800 HG2 GLU 100 1HG GLU 100 -23.266 33.916 -23.239 801 HG3 GLU 100 2HG GLU 100 -24.027 32.816 -24.387 802 H CYS 101 H CYS 101 -27.246 30.699 -22.446 803 HA CYS 101 HA CYS 101 -26.445 28.486 -23.933 804 HB2 CYS 101 1HB CYS 101 -28.655 28.810 -22.810 805 HB3 CYS 101 2HB CYS 101 -29.105 29.927 -24.092 806 HA PRO 102 HA PRO 102 -25.260 30.480 -27.765 807 HB2 PRO 102 1HB PRO 102 -25.075 28.171 -29.244 808 HB3 PRO 102 2HB PRO 102 -23.807 28.762 -28.165 809 HG2 PRO 102 1HG PRO 102 -25.895 26.677 -27.675 810 HG3 PRO 102 2HG PRO 102 -24.177 26.669 -27.233 811 HD2 PRO 102 1HD PRO 102 -26.095 27.224 -25.437 812 HD3 PRO 102 2HD PRO 102 -24.518 28.041 -25.395 813 H VAL 103 H VAL 103 -28.019 28.500 -27.249 814 HA VAL 103 HA VAL 103 -29.192 28.687 -29.824 815 HB VAL 103 HB VAL 103 -30.522 28.204 -27.147 816 HG11 VAL 103 1HG1 VAL 103 -31.511 27.595 -29.937 817 HG12 VAL 103 2HG1 VAL 103 -32.132 28.857 -28.873 818 HG13 VAL 103 3HG1 VAL 103 -32.322 27.161 -28.430 819 HG21 VAL 103 3HG2 VAL 103 -28.783 26.584 -27.584 820 HG22 VAL 103 1HG2 VAL 103 -29.432 26.278 -29.195 821 HG23 VAL 103 2HG2 VAL 103 -30.367 25.830 -27.767 822 H LYS 104 H LYS 104 -28.829 30.941 -27.261 823 HA LYS 104 HA LYS 104 -31.046 32.621 -27.858 824 HB2 LYS 104 1HB LYS 104 -29.698 32.794 -25.760 825 HB3 LYS 104 2HB LYS 104 -28.352 33.407 -26.711 826 HG2 LYS 104 1HG LYS 104 -29.703 35.329 -27.385 827 HG3 LYS 104 2HG LYS 104 -31.044 34.721 -26.416 828 HD2 LYS 104 1HD LYS 104 -29.860 36.462 -25.214 829 HD3 LYS 104 2HD LYS 104 -29.645 34.912 -24.398 830 HE2 LYS 104 1HE LYS 104 -27.427 34.690 -25.230 831 HE3 LYS 104 2HE LYS 104 -27.643 36.035 -26.350 832 HZ1 LYS 104 3HZ LYS 104 -27.775 36.365 -23.405 833 HZ2 LYS 104 1HZ LYS 104 -27.645 37.575 -24.583 834 HZ3 LYS 104 2HZ LYS 104 -26.333 36.536 -24.284 835 H ARG 105 H ARG 105 -28.023 31.968 -29.328 836 HA ARG 105 HA ARG 105 -28.202 34.269 -31.113 837 HB2 ARG 105 1HB ARG 105 -26.100 32.154 -30.684 838 HB3 ARG 105 2HB ARG 105 -26.046 33.265 -32.043 839 HG2 ARG 105 1HG ARG 105 -25.990 34.016 -29.131 840 HG3 ARG 105 2HG ARG 105 -24.621 34.029 -30.244 841 HD2 ARG 105 1HD ARG 105 -27.054 35.792 -30.257 842 HD3 ARG 105 2HD ARG 105 -25.365 36.267 -30.083 843 HE ARG 105 HE ARG 105 -25.747 34.974 -32.570 844 HH11 ARG 105 1HH1 ARG 105 -26.342 38.008 -30.913 845 HH12 ARG 105 2HH1 ARG 105 -26.485 38.926 -32.388 846 HH21 ARG 105 1HH2 ARG 105 -25.967 36.167 -34.494 847 HH22 ARG 105 2HH2 ARG 105 -26.312 37.870 -34.420 848 H LYS 106 H LYS 106 -29.116 34.121 -33.023 849 HA LYS 106 HA LYS 106 -29.252 31.479 -34.328 850 HB2 LYS 106 1HB LYS 106 -31.385 33.623 -34.380 851 HB3 LYS 106 2HB LYS 106 -31.406 32.161 -35.352 852 HG2 LYS 106 1HG LYS 106 -32.703 31.407 -33.685 853 HG3 LYS 106 2HG LYS 106 -31.153 31.078 -32.910 854 HD2 LYS 106 1HD LYS 106 -32.584 32.205 -31.337 855 HD3 LYS 106 2HD LYS 106 -31.288 33.304 -31.814 856 HE2 LYS 106 1HE LYS 106 -32.745 34.490 -33.297 857 HE3 LYS 106 2HE LYS 106 -34.024 33.299 -33.072 858 HZ1 LYS 106 3HZ LYS 106 -33.009 35.249 -31.077 859 HZ2 LYS 106 1HZ LYS 106 -34.048 33.965 -30.682 860 HZ3 LYS 106 2HZ LYS 106 -34.559 35.173 -31.757 Start of MODEL 2 1 HA MET 1 HA MET 1 -2.967 -2.597 -2.360 2 HB2 MET 1 1HB MET 1 -2.005 -3.303 -0.179 3 HB3 MET 1 2HB MET 1 -2.279 -4.981 -0.627 4 HG2 MET 1 1HG MET 1 0.030 -4.380 -0.981 5 HG3 MET 1 2HG MET 1 -0.755 -4.723 -2.520 6 HE1 MET 1 2HE MET 1 1.245 -3.546 -3.837 7 HE2 MET 1 3HE MET 1 2.040 -3.244 -2.292 8 HE3 MET 1 1HE MET 1 1.841 -1.931 -3.451 9 H GLU 2 H GLU 2 -4.299 -5.850 -1.825 10 HA GLU 2 HA GLU 2 -3.932 -6.351 -4.709 11 HB2 GLU 2 1HB GLU 2 -3.606 -8.370 -2.480 12 HB3 GLU 2 2HB GLU 2 -3.519 -8.724 -4.199 13 HG2 GLU 2 1HG GLU 2 -1.593 -7.099 -4.301 14 HG3 GLU 2 2HG GLU 2 -1.606 -7.119 -2.538 15 HA PRO 3 HA PRO 3 -8.239 -7.410 -4.774 16 HB2 PRO 3 1HB PRO 3 -8.237 -9.375 -6.670 17 HB3 PRO 3 2HB PRO 3 -8.119 -7.654 -7.049 18 HG2 PRO 3 1HG PRO 3 -5.950 -9.707 -6.868 19 HG3 PRO 3 2HG PRO 3 -6.172 -8.413 -8.061 20 HD2 PRO 3 1HD PRO 3 -4.423 -8.207 -6.020 21 HD3 PRO 3 2HD PRO 3 -5.300 -6.801 -6.657 22 H ILE 4 H ILE 4 -9.484 -8.696 -3.565 23 HA ILE 4 HA ILE 4 -8.293 -11.063 -2.348 24 HB ILE 4 HB ILE 4 -10.960 -9.719 -1.803 25 HG12 ILE 4 1HG1 ILE 4 -9.727 -9.259 0.445 26 HG13 ILE 4 2HG1 ILE 4 -8.262 -9.557 -0.481 27 HG21 ILE 4 1HG2 ILE 4 -11.071 -12.085 -1.282 28 HG22 ILE 4 2HG2 ILE 4 -11.049 -11.133 0.203 29 HG23 ILE 4 3HG2 ILE 4 -9.590 -11.968 -0.331 30 HD11 ILE 4 3HD1 ILE 4 -10.322 -7.436 -1.045 31 HD12 ILE 4 1HD1 ILE 4 -8.872 -7.740 -2.003 32 HD13 ILE 4 2HD1 ILE 4 -8.726 -7.188 -0.335 33 H GLY 5 H GLY 5 -8.944 -13.140 -2.747 34 HA2 GLY 5 1HA GLY 5 -10.168 -13.661 -5.254 35 HA3 GLY 5 2HA GLY 5 -9.712 -14.863 -4.060 36 H ARG 6 H ARG 6 -11.544 -13.096 -2.211 37 HA ARG 6 HA ARG 6 -14.106 -14.135 -3.198 38 HB2 ARG 6 1HB ARG 6 -14.721 -14.720 -0.878 39 HB3 ARG 6 2HB ARG 6 -13.342 -15.641 -1.456 40 HG2 ARG 6 1HG ARG 6 -11.929 -13.836 -0.264 41 HG3 ARG 6 2HG ARG 6 -13.430 -13.454 0.582 42 HD2 ARG 6 1HD ARG 6 -12.266 -14.999 1.943 43 HD3 ARG 6 2HD ARG 6 -13.578 -15.897 1.180 44 HE ARG 6 HE ARG 6 -11.044 -15.987 -0.219 45 HH11 ARG 6 1HH1 ARG 6 -13.113 -17.531 2.161 46 HH12 ARG 6 2HH1 ARG 6 -12.340 -19.077 1.996 47 HH21 ARG 6 1HH2 ARG 6 -10.020 -18.011 -0.401 48 HH22 ARG 6 2HH2 ARG 6 -10.576 -19.352 0.557 49 H SER 7 H SER 7 -15.097 -12.316 -3.813 50 HA SER 7 HA SER 7 -14.681 -9.803 -2.531 51 HB2 SER 7 1HB SER 7 -16.675 -9.189 -4.101 52 HB3 SER 7 2HB SER 7 -15.117 -9.624 -4.811 53 HG SER 7 HG SER 7 -16.874 -10.730 -5.804 54 H LEU 8 H LEU 8 -16.799 -12.411 -1.974 55 HA LEU 8 HA LEU 8 -18.944 -10.945 -0.781 56 HB2 LEU 8 1HB LEU 8 -18.192 -13.863 -0.536 57 HB3 LEU 8 2HB LEU 8 -19.676 -13.159 0.072 58 HG LEU 8 HG LEU 8 -20.152 -12.492 -2.363 59 HD11 LEU 8 1HD1 LEU 8 -18.047 -14.597 -2.849 60 HD12 LEU 8 2HD1 LEU 8 -17.916 -12.887 -3.257 61 HD13 LEU 8 3HD1 LEU 8 -19.115 -13.897 -4.066 62 HD21 LEU 8 3HD2 LEU 8 -21.136 -14.658 -2.840 63 HD22 LEU 8 1HD2 LEU 8 -21.341 -14.250 -1.137 64 HD23 LEU 8 2HD2 LEU 8 -20.108 -15.414 -1.623 65 H GLN 9 H GLN 9 -15.840 -11.856 0.202 66 HA GLN 9 HA GLN 9 -16.375 -11.062 2.963 67 HB2 GLN 9 1HB GLN 9 -15.116 -13.665 2.097 68 HB3 GLN 9 2HB GLN 9 -14.824 -12.976 3.686 69 HG2 GLN 9 1HG GLN 9 -17.556 -13.643 2.617 70 HG3 GLN 9 2HG GLN 9 -16.589 -14.727 3.613 71 HE21 GLN 9 2HE2 GLN 9 -18.445 -11.792 3.534 72 HE22 GLN 9 1HE2 GLN 9 -18.569 -11.589 5.251 73 H GLY 10 H GLY 10 -13.708 -11.787 3.831 74 HA2 GLY 10 1HA GLY 10 -11.439 -11.372 3.386 75 HA3 GLY 10 2HA GLY 10 -11.898 -10.511 1.926 76 H VAL 11 H VAL 11 -13.277 -8.469 2.451 77 HA VAL 11 HA VAL 11 -11.797 -7.024 4.538 78 HB VAL 11 HB VAL 11 -12.482 -4.951 3.221 79 HG11 VAL 11 1HG1 VAL 11 -10.609 -6.950 1.957 80 HG12 VAL 11 2HG1 VAL 11 -10.213 -5.800 3.235 81 HG13 VAL 11 3HG1 VAL 11 -10.637 -5.216 1.627 82 HG21 VAL 11 3HG2 VAL 11 -13.031 -7.024 1.096 83 HG22 VAL 11 1HG2 VAL 11 -12.937 -5.281 0.835 84 HG23 VAL 11 2HG2 VAL 11 -14.219 -5.955 1.842 85 H THR 12 H THR 12 -13.099 -7.329 6.281 86 HA THR 12 HA THR 12 -15.909 -6.549 6.057 87 HB THR 12 HB THR 12 -15.955 -7.397 8.491 88 HG1 THR 12 HG1 THR 12 -13.386 -7.577 8.138 89 HG21 THR 12 3HG2 THR 12 -16.238 -9.709 7.754 90 HG22 THR 12 1HG2 THR 12 -15.399 -9.341 6.247 91 HG23 THR 12 2HG2 THR 12 -16.956 -8.590 6.595 92 H GLY 13 H GLY 13 -15.589 -4.329 5.876 93 HA2 GLY 13 1HA GLY 13 -15.976 -2.672 7.905 94 HA3 GLY 13 2HA GLY 13 -14.242 -2.929 8.051 95 H ARG 14 H ARG 14 -16.628 -1.073 6.638 96 HA ARG 14 HA ARG 14 -14.711 0.397 5.096 97 HB2 ARG 14 1HB ARG 14 -16.215 0.366 3.024 98 HB3 ARG 14 2HB ARG 14 -15.191 -1.029 3.309 99 HG2 ARG 14 1HG ARG 14 -17.991 -1.087 4.312 100 HG3 ARG 14 2HG ARG 14 -17.692 -1.301 2.585 101 HD2 ARG 14 1HD ARG 14 -16.169 -3.145 3.072 102 HD3 ARG 14 2HD ARG 14 -16.438 -2.923 4.799 103 HE ARG 14 HE ARG 14 -18.798 -3.541 4.352 104 HH11 ARG 14 1HH1 ARG 14 -16.309 -4.470 2.070 105 HH12 ARG 14 2HH1 ARG 14 -17.155 -5.874 1.500 106 HH21 ARG 14 1HH2 ARG 14 -19.919 -5.418 3.627 107 HH22 ARG 14 2HH2 ARG 14 -19.202 -6.420 2.396 108 HA PRO 15 HA PRO 15 -17.607 3.109 7.405 109 HB2 PRO 15 1HB PRO 15 -15.827 5.228 6.818 110 HB3 PRO 15 2HB PRO 15 -15.971 4.352 8.343 111 HG2 PRO 15 1HG PRO 15 -14.025 3.998 6.132 112 HG3 PRO 15 2HG PRO 15 -13.822 3.723 7.871 113 HD2 PRO 15 1HD PRO 15 -14.065 1.687 6.140 114 HD3 PRO 15 2HD PRO 15 -14.762 1.609 7.772 115 H ASP 16 H ASP 16 -19.022 4.677 6.650 116 HA ASP 16 HA ASP 16 -19.474 4.425 3.826 117 HB2 ASP 16 1HB ASP 16 -21.042 5.480 6.121 118 HB3 ASP 16 2HB ASP 16 -21.469 6.032 4.502 119 H PHE 17 H PHE 17 -17.640 6.562 5.567 120 HA PHE 17 HA PHE 17 -18.087 8.956 4.131 121 HB2 PHE 17 1HB PHE 17 -16.753 8.999 6.153 122 HB3 PHE 17 2HB PHE 17 -15.585 7.883 5.454 123 HD1 PHE 17 HD2 PHE 17 -16.983 11.294 5.146 124 HD2 PHE 17 HD1 PHE 17 -13.779 8.666 4.180 125 HE1 PHE 17 HE2 PHE 17 -15.680 13.199 4.296 126 HE2 PHE 17 HE1 PHE 17 -12.469 10.566 3.328 127 HZ PHE 17 HZ PHE 17 -13.420 12.836 3.386 128 H GLN 18 H GLN 18 -15.634 6.388 3.690 129 HA GLN 18 HA GLN 18 -14.754 7.346 1.179 130 HB2 GLN 18 1HB GLN 18 -13.559 5.311 0.950 131 HB3 GLN 18 2HB GLN 18 -13.459 5.791 2.635 132 HG2 GLN 18 1HG GLN 18 -15.126 4.160 3.245 133 HG3 GLN 18 2HG GLN 18 -15.372 3.729 1.553 134 HE21 GLN 18 2HE2 GLN 18 -12.501 3.918 0.953 135 HE22 GLN 18 1HE2 GLN 18 -11.771 2.523 1.652 136 H LYS 19 H LYS 19 -17.318 5.190 2.156 137 HA LYS 19 HA LYS 19 -18.035 4.095 -0.311 138 HB2 LYS 19 1HB LYS 19 -19.726 4.928 2.048 139 HB3 LYS 19 2HB LYS 19 -20.363 4.032 0.674 140 HG2 LYS 19 1HG LYS 19 -17.993 2.966 2.103 141 HG3 LYS 19 2HG LYS 19 -19.577 2.821 2.857 142 HD2 LYS 19 1HD LYS 19 -18.922 1.881 0.071 143 HD3 LYS 19 2HD LYS 19 -18.922 0.843 1.499 144 HE2 LYS 19 1HE LYS 19 -21.280 2.361 0.379 145 HE3 LYS 19 2HE LYS 19 -21.025 0.617 0.303 146 HZ1 LYS 19 3HZ LYS 19 -21.567 2.266 2.716 147 HZ2 LYS 19 1HZ LYS 19 -21.025 0.658 2.798 148 HZ3 LYS 19 2HZ LYS 19 -22.512 1.013 2.075 149 H ARG 20 H ARG 20 -19.089 7.097 1.249 150 HA ARG 20 HA ARG 20 -20.633 8.050 -0.914 151 HB2 ARG 20 1HB ARG 20 -21.046 8.979 1.227 152 HB3 ARG 20 2HB ARG 20 -19.351 9.368 1.470 153 HG2 ARG 20 1HG ARG 20 -20.678 11.358 1.044 154 HG3 ARG 20 2HG ARG 20 -19.478 11.090 -0.221 155 HD2 ARG 20 1HD ARG 20 -21.642 11.780 -1.145 156 HD3 ARG 20 2HD ARG 20 -21.179 10.166 -1.679 157 HE ARG 20 HE ARG 20 -22.731 9.400 0.200 158 HH11 ARG 20 1HH1 ARG 20 -23.182 12.401 -1.527 159 HH12 ARG 20 2HH1 ARG 20 -24.915 12.360 -1.416 160 HH21 ARG 20 1HH2 ARG 20 -24.987 9.335 0.378 161 HH22 ARG 20 2HH2 ARG 20 -25.950 10.619 -0.302 162 H LEU 21 H LEU 21 -17.310 8.680 0.125 163 HA LEU 21 HA LEU 21 -16.526 10.519 -1.780 164 HB2 LEU 21 1HB LEU 21 -15.062 10.044 0.007 165 HB3 LEU 21 2HB LEU 21 -15.049 8.329 -0.347 166 HG LEU 21 HG LEU 21 -13.760 8.791 -2.410 167 HD11 LEU 21 1HD1 LEU 21 -13.645 11.611 -1.341 168 HD12 LEU 21 2HD1 LEU 21 -14.494 11.093 -2.796 169 HD13 LEU 21 3HD1 LEU 21 -12.736 10.988 -2.717 170 HD21 LEU 21 3HD2 LEU 21 -12.622 8.150 -0.363 171 HD22 LEU 21 1HD2 LEU 21 -12.547 9.838 0.143 172 HD23 LEU 21 2HD2 LEU 21 -11.649 9.303 -1.278 173 H GLU 22 H GLU 22 -16.308 6.971 -2.013 174 HA GLU 22 HA GLU 22 -15.377 6.913 -4.680 175 HB2 GLU 22 1HB GLU 22 -16.760 4.883 -2.941 176 HB3 GLU 22 2HB GLU 22 -16.283 4.522 -4.594 177 HG2 GLU 22 1HG GLU 22 -14.386 5.440 -2.449 178 HG3 GLU 22 2HG GLU 22 -14.679 3.753 -2.868 179 H GLN 23 H GLN 23 -18.589 6.793 -3.254 180 HA GLN 23 HA GLN 23 -20.094 6.142 -5.516 181 HB2 GLN 23 1HB GLN 23 -20.770 6.318 -3.036 182 HB3 GLN 23 2HB GLN 23 -21.018 8.023 -3.358 183 HG2 GLN 23 1HG GLN 23 -22.676 7.454 -5.066 184 HG3 GLN 23 2HG GLN 23 -22.439 5.742 -4.710 185 HE21 GLN 23 2HE2 GLN 23 -23.076 4.936 -2.670 186 HE22 GLN 23 1HE2 GLN 23 -24.251 5.775 -1.711 187 H MET 24 H MET 24 -19.317 9.336 -4.159 188 HA MET 24 HA MET 24 -20.578 10.727 -6.311 189 HB2 MET 24 1HB MET 24 -19.637 12.748 -5.301 190 HB3 MET 24 2HB MET 24 -20.445 11.744 -4.111 191 HG2 MET 24 1HG MET 24 -18.130 10.846 -3.549 192 HG3 MET 24 2HG MET 24 -17.508 12.194 -4.496 193 HE1 MET 24 3HE MET 24 -19.060 15.243 -2.493 194 HE2 MET 24 1HE MET 24 -19.807 14.376 -3.834 195 HE3 MET 24 2HE MET 24 -18.092 14.784 -3.894 196 H LYS 25 H LYS 25 -17.255 9.830 -5.556 197 HA LYS 25 HA LYS 25 -15.949 11.257 -7.583 198 HB2 LYS 25 1HB LYS 25 -14.880 9.968 -5.683 199 HB3 LYS 25 2HB LYS 25 -15.182 8.501 -6.601 200 HG2 LYS 25 1HG LYS 25 -12.943 9.078 -7.016 201 HG3 LYS 25 2HG LYS 25 -13.829 9.546 -8.468 202 HD2 LYS 25 1HD LYS 25 -12.359 11.340 -7.980 203 HD3 LYS 25 2HD LYS 25 -13.971 11.870 -7.487 204 HE2 LYS 25 1HE LYS 25 -12.369 12.500 -5.798 205 HE3 LYS 25 2HE LYS 25 -13.425 11.244 -5.160 206 HZ1 LYS 25 3HZ LYS 25 -10.999 10.984 -4.654 207 HZ2 LYS 25 1HZ LYS 25 -10.745 10.680 -6.304 208 HZ3 LYS 25 2HZ LYS 25 -11.724 9.635 -5.388 209 H GLU 26 H GLU 26 -17.520 8.105 -7.585 210 HA GLU 26 HA GLU 26 -16.819 7.280 -10.176 211 HB2 GLU 26 1HB GLU 26 -17.838 5.864 -8.340 212 HB3 GLU 26 2HB GLU 26 -19.386 6.610 -8.718 213 HG2 GLU 26 1HG GLU 26 -19.273 4.486 -9.796 214 HG3 GLU 26 2HG GLU 26 -19.174 5.742 -11.030 215 H LYS 27 H LYS 27 -19.730 8.907 -8.964 216 HA LYS 27 HA LYS 27 -21.093 9.162 -11.385 217 HB2 LYS 27 1HB LYS 27 -21.137 10.825 -8.874 218 HB3 LYS 27 2HB LYS 27 -22.199 11.158 -10.233 219 HG2 LYS 27 1HG LYS 27 -23.194 8.949 -10.022 220 HG3 LYS 27 2HG LYS 27 -22.087 8.561 -8.704 221 HD2 LYS 27 1HD LYS 27 -24.179 9.178 -7.735 222 HD3 LYS 27 2HD LYS 27 -23.042 10.493 -7.439 223 HE2 LYS 27 1HE LYS 27 -25.094 11.492 -8.093 224 HE3 LYS 27 2HE LYS 27 -23.997 11.635 -9.464 225 HZ1 LYS 27 3HZ LYS 27 -25.088 9.819 -10.549 226 HZ2 LYS 27 1HZ LYS 27 -26.272 10.939 -10.074 227 HZ3 LYS 27 2HZ LYS 27 -26.053 9.512 -9.187 228 H VAL 28 H VAL 28 -18.832 11.397 -9.818 229 HA VAL 28 HA VAL 28 -19.088 13.478 -11.692 230 HB VAL 28 HB VAL 28 -16.804 12.802 -9.835 231 HG11 VAL 28 1HG1 VAL 28 -17.284 15.338 -11.391 232 HG12 VAL 28 2HG1 VAL 28 -15.977 14.186 -11.664 233 HG13 VAL 28 3HG1 VAL 28 -16.044 15.103 -10.157 234 HG21 VAL 28 3HG2 VAL 28 -19.003 14.852 -9.618 235 HG22 VAL 28 1HG2 VAL 28 -17.737 14.548 -8.426 236 HG23 VAL 28 2HG2 VAL 28 -18.958 13.312 -8.759 237 H MET 29 H MET 29 -16.873 10.718 -11.540 238 HA MET 29 HA MET 29 -15.451 11.597 -13.909 239 HB2 MET 29 1HB MET 29 -15.231 9.122 -12.202 240 HB3 MET 29 2HB MET 29 -14.259 9.385 -13.642 241 HG2 MET 29 1HG MET 29 -14.300 11.170 -11.217 242 HG3 MET 29 2HG MET 29 -13.072 9.961 -11.574 243 HE1 MET 29 3HE MET 29 -11.135 13.305 -12.190 244 HE2 MET 29 1HE MET 29 -11.107 11.736 -11.383 245 HE3 MET 29 2HE MET 29 -12.311 12.941 -10.928 246 H LYS 30 H LYS 30 -18.401 10.657 -13.780 247 HA LYS 30 HA LYS 30 -18.216 8.733 -15.992 248 HB2 LYS 30 1HB LYS 30 -19.990 8.984 -13.739 249 HB3 LYS 30 2HB LYS 30 -20.910 9.051 -15.235 250 HG2 LYS 30 1HG LYS 30 -20.701 6.774 -14.320 251 HG3 LYS 30 2HG LYS 30 -20.024 6.934 -15.941 252 HD2 LYS 30 1HD LYS 30 -17.781 7.066 -15.016 253 HD3 LYS 30 2HD LYS 30 -18.432 7.001 -13.377 254 HE2 LYS 30 1HE LYS 30 -19.261 4.777 -13.739 255 HE3 LYS 30 2HE LYS 30 -18.790 4.833 -15.438 256 HZ1 LYS 30 3HZ LYS 30 -16.945 4.911 -13.109 257 HZ2 LYS 30 1HZ LYS 30 -16.471 5.004 -14.736 258 HZ3 LYS 30 2HZ LYS 30 -17.188 3.586 -14.143 259 H ASP 31 H ASP 31 -18.970 11.979 -15.229 260 HA ASP 31 HA ASP 31 -20.859 12.393 -17.351 261 HB2 ASP 31 1HB ASP 31 -20.924 13.762 -15.303 262 HB3 ASP 31 2HB ASP 31 -19.346 14.430 -15.707 263 H GLN 32 H GLN 32 -20.525 13.032 -19.353 264 HA GLN 32 HA GLN 32 -18.033 12.704 -20.578 265 HB2 GLN 32 1HB GLN 32 -20.473 14.182 -21.588 266 HB3 GLN 32 2HB GLN 32 -19.121 13.662 -22.584 267 HG2 GLN 32 1HG GLN 32 -19.634 11.366 -22.215 268 HG3 GLN 32 2HG GLN 32 -20.840 11.775 -20.995 269 HE21 GLN 32 2HE2 GLN 32 -22.831 12.588 -21.638 270 HE22 GLN 32 1HE2 GLN 32 -23.388 12.469 -23.274 271 H ASP 33 H ASP 33 -19.760 15.681 -19.685 272 HA ASP 33 HA ASP 33 -17.889 17.440 -20.890 273 HB2 ASP 33 1HB ASP 33 -19.886 17.969 -18.681 274 HB3 ASP 33 2HB ASP 33 -18.988 19.208 -19.549 275 H VAL 34 H VAL 34 -18.303 16.198 -17.602 276 HA VAL 34 HA VAL 34 -16.259 17.571 -16.333 277 HB VAL 34 HB VAL 34 -17.277 14.763 -15.929 278 HG11 VAL 34 1HG1 VAL 34 -14.966 14.811 -15.160 279 HG12 VAL 34 2HG1 VAL 34 -16.079 14.733 -13.792 280 HG13 VAL 34 3HG1 VAL 34 -15.298 16.259 -14.209 281 HG21 VAL 34 3HG2 VAL 34 -18.313 15.746 -13.940 282 HG22 VAL 34 1HG2 VAL 34 -18.820 16.576 -15.413 283 HG23 VAL 34 2HG2 VAL 34 -17.619 17.313 -14.355 284 H GLN 35 H GLN 35 -16.048 14.514 -18.159 285 HA GLN 35 HA GLN 35 -13.273 14.143 -17.779 286 HB2 GLN 35 1HB GLN 35 -14.820 13.169 -20.173 287 HB3 GLN 35 2HB GLN 35 -13.414 12.432 -19.417 288 HG2 GLN 35 1HG GLN 35 -14.852 12.145 -17.369 289 HG3 GLN 35 2HG GLN 35 -16.219 12.560 -18.387 290 HE21 GLN 35 2HE2 GLN 35 -15.672 10.106 -16.981 291 HE22 GLN 35 1HE2 GLN 35 -15.627 8.861 -18.172 292 H ALA 36 H ALA 36 -15.149 15.692 -20.307 293 HA ALA 36 HA ALA 36 -13.068 16.352 -22.070 294 HB1 ALA 36 1HB ALA 36 -14.562 18.093 -22.921 295 HB2 ALA 36 2HB ALA 36 -15.603 17.895 -21.511 296 HB3 ALA 36 3HB ALA 36 -15.428 16.577 -22.670 297 H PHE 37 H PHE 37 -14.324 17.987 -19.226 298 HA PHE 37 HA PHE 37 -12.662 20.277 -19.395 299 HB2 PHE 37 1HB PHE 37 -14.680 20.339 -18.082 300 HB3 PHE 37 2HB PHE 37 -14.127 18.999 -17.085 301 HD1 PHE 37 HD1 PHE 37 -12.999 22.395 -18.111 302 HD2 PHE 37 HD2 PHE 37 -13.290 19.488 -15.025 303 HE1 PHE 37 HE1 PHE 37 -12.054 24.003 -16.516 304 HE2 PHE 37 HE2 PHE 37 -12.348 21.092 -13.416 305 HZ PHE 37 HZ PHE 37 -11.732 23.356 -14.161 306 H LEU 38 H LEU 38 -12.425 17.211 -17.651 307 HA LEU 38 HA LEU 38 -10.146 17.691 -16.157 308 HB2 LEU 38 1HB LEU 38 -11.600 15.341 -17.082 309 HB3 LEU 38 2HB LEU 38 -9.884 15.042 -16.886 310 HG LEU 38 HG LEU 38 -10.960 14.427 -14.852 311 HD11 LEU 38 1HD1 LEU 38 -8.817 15.584 -14.635 312 HD12 LEU 38 2HD1 LEU 38 -9.866 15.882 -13.249 313 HD13 LEU 38 3HD1 LEU 38 -9.668 17.122 -14.489 314 HD21 LEU 38 3HD2 LEU 38 -12.304 16.016 -13.543 315 HD22 LEU 38 1HD2 LEU 38 -13.040 15.638 -15.101 316 HD23 LEU 38 2HD2 LEU 38 -12.203 17.174 -14.869 317 H LYS 39 H LYS 39 -10.364 16.410 -19.467 318 HA LYS 39 HA LYS 39 -7.509 16.194 -19.703 319 HB2 LYS 39 1HB LYS 39 -7.923 15.611 -22.036 320 HB3 LYS 39 2HB LYS 39 -8.996 14.710 -20.972 321 HG2 LYS 39 1HG LYS 39 -10.863 15.861 -21.656 322 HG3 LYS 39 2HG LYS 39 -9.935 17.262 -22.192 323 HD2 LYS 39 1HD LYS 39 -9.005 15.852 -24.024 324 HD3 LYS 39 2HD LYS 39 -10.110 14.568 -23.528 325 HE2 LYS 39 1HE LYS 39 -12.011 15.866 -24.080 326 HE3 LYS 39 2HE LYS 39 -11.048 17.334 -24.242 327 HZ1 LYS 39 3HZ LYS 39 -10.871 14.958 -26.017 328 HZ2 LYS 39 1HZ LYS 39 -9.973 16.390 -26.174 329 HZ3 LYS 39 2HZ LYS 39 -11.656 16.415 -26.393 330 H GLU 40 H GLU 40 -9.875 18.647 -20.366 331 HA GLU 40 HA GLU 40 -8.398 20.187 -22.205 332 HB2 GLU 40 1HB GLU 40 -10.903 20.325 -21.416 333 HB3 GLU 40 2HB GLU 40 -10.255 21.444 -20.232 334 HG2 GLU 40 1HG GLU 40 -11.095 22.644 -22.133 335 HG3 GLU 40 2HG GLU 40 -9.348 22.825 -22.027 336 H ASN 41 H ASN 41 -8.613 20.171 -18.703 337 HA ASN 41 HA ASN 41 -6.421 22.141 -18.587 338 HB2 ASN 41 1HB ASN 41 -8.750 21.666 -16.728 339 HB3 ASN 41 2HB ASN 41 -7.336 22.608 -16.251 340 HD21 ASN 41 2HD2 ASN 41 -10.182 22.487 -18.214 341 HD22 ASN 41 1HD2 ASN 41 -10.164 24.145 -18.696 342 H GLU 42 H GLU 42 -6.184 19.204 -18.814 343 HA GLU 42 HA GLU 42 -5.727 18.060 -16.257 344 HB2 GLU 42 1HB GLU 42 -4.711 16.190 -17.440 345 HB3 GLU 42 2HB GLU 42 -6.200 16.684 -18.227 346 HG2 GLU 42 1HG GLU 42 -4.944 17.829 -19.952 347 HG3 GLU 42 2HG GLU 42 -3.430 17.429 -19.144 348 H GLU 43 H GLU 43 -3.877 20.178 -18.126 349 HA GLU 43 HA GLU 43 -1.292 19.388 -17.162 350 HB2 GLU 43 1HB GLU 43 -1.625 20.518 -19.330 351 HB3 GLU 43 2HB GLU 43 -2.217 21.944 -18.493 352 HG2 GLU 43 1HG GLU 43 -0.012 22.180 -17.414 353 HG3 GLU 43 2HG GLU 43 0.564 20.807 -18.360 354 H VAL 44 H VAL 44 -3.910 21.200 -15.960 355 HA VAL 44 HA VAL 44 -2.180 22.534 -13.977 356 HB VAL 44 HB VAL 44 -4.964 23.359 -14.825 357 HG11 VAL 44 1HG1 VAL 44 -4.493 25.410 -13.596 358 HG12 VAL 44 2HG1 VAL 44 -2.910 24.783 -13.135 359 HG13 VAL 44 3HG1 VAL 44 -4.376 24.003 -12.538 360 HG21 VAL 44 3HG2 VAL 44 -3.851 25.238 -15.964 361 HG22 VAL 44 1HG2 VAL 44 -3.424 23.676 -16.666 362 HG23 VAL 44 2HG2 VAL 44 -2.287 24.509 -15.604 363 H ILE 45 H ILE 45 -5.182 20.761 -14.475 364 HA ILE 45 HA ILE 45 -5.996 20.812 -11.745 365 HB ILE 45 HB ILE 45 -6.898 18.970 -13.967 366 HG12 ILE 45 1HG1 ILE 45 -8.045 21.568 -12.953 367 HG13 ILE 45 2HG1 ILE 45 -7.182 21.361 -14.468 368 HG21 ILE 45 1HG2 ILE 45 -8.234 19.657 -11.345 369 HG22 ILE 45 2HG2 ILE 45 -7.464 18.120 -11.734 370 HG23 ILE 45 3HG2 ILE 45 -8.904 18.631 -12.614 371 HD11 ILE 45 3HD1 ILE 45 -9.595 21.484 -14.760 372 HD12 ILE 45 1HD1 ILE 45 -9.781 20.035 -13.767 373 HD13 ILE 45 2HD1 ILE 45 -8.932 19.938 -15.313 374 H ASP 46 H ASP 46 -5.836 19.300 -10.190 375 HA ASP 46 HA ASP 46 -4.016 17.027 -10.672 376 HB2 ASP 46 1HB ASP 46 -3.303 18.918 -9.041 377 HB3 ASP 46 2HB ASP 46 -4.554 18.281 -7.981 378 H GLN 47 H GLN 47 -4.495 15.138 -9.298 379 HA GLN 47 HA GLN 47 -7.184 14.337 -9.225 380 HB2 GLN 47 1HB GLN 47 -4.847 13.355 -7.579 381 HB3 GLN 47 2HB GLN 47 -6.370 12.496 -7.789 382 HG2 GLN 47 1HG GLN 47 -5.921 12.310 -10.189 383 HG3 GLN 47 2HG GLN 47 -4.387 13.151 -9.959 384 HE21 GLN 47 2HE2 GLN 47 -4.846 10.505 -11.018 385 HE22 GLN 47 1HE2 GLN 47 -3.983 9.407 -9.984 386 H LYS 48 H LYS 48 -5.044 15.747 -6.812 387 HA LYS 48 HA LYS 48 -6.835 15.695 -4.629 388 HB2 LYS 48 1HB LYS 48 -4.499 17.488 -5.276 389 HB3 LYS 48 2HB LYS 48 -5.371 17.552 -3.753 390 HG2 LYS 48 1HG LYS 48 -3.905 15.158 -4.838 391 HG3 LYS 48 2HG LYS 48 -3.316 16.244 -3.579 392 HD2 LYS 48 1HD LYS 48 -5.251 15.625 -2.175 393 HD3 LYS 48 2HD LYS 48 -5.776 14.496 -3.427 394 HE2 LYS 48 1HE LYS 48 -4.577 13.318 -1.676 395 HE3 LYS 48 2HE LYS 48 -3.668 13.261 -3.184 396 HZ1 LYS 48 3HZ LYS 48 -3.141 15.096 -0.904 397 HZ2 LYS 48 1HZ LYS 48 -2.273 15.069 -2.361 398 HZ3 LYS 48 2HZ LYS 48 -2.221 13.735 -1.318 399 H MET 49 H MET 49 -6.253 18.032 -7.188 400 HA MET 49 HA MET 49 -7.830 20.144 -6.299 401 HB2 MET 49 1HB MET 49 -6.286 20.288 -8.208 402 HB3 MET 49 2HB MET 49 -7.320 19.208 -9.131 403 HG2 MET 49 1HG MET 49 -7.875 21.301 -9.922 404 HG3 MET 49 2HG MET 49 -9.139 20.936 -8.752 405 HE1 MET 49 3HE MET 49 -5.622 23.811 -7.958 406 HE2 MET 49 1HE MET 49 -5.910 23.010 -9.503 407 HE3 MET 49 2HE MET 49 -5.419 22.065 -8.096 408 H ILE 50 H ILE 50 -8.640 17.270 -8.182 409 HA ILE 50 HA ILE 50 -11.337 17.850 -8.706 410 HB ILE 50 HB ILE 50 -9.961 15.176 -8.391 411 HG12 ILE 50 1HG1 ILE 50 -9.059 16.576 -10.191 412 HG13 ILE 50 2HG1 ILE 50 -9.922 15.192 -10.848 413 HG21 ILE 50 1HG2 ILE 50 -12.357 14.922 -8.073 414 HG22 ILE 50 2HG2 ILE 50 -11.866 14.239 -9.623 415 HG23 ILE 50 3HG2 ILE 50 -12.666 15.809 -9.565 416 HD11 ILE 50 3HD1 ILE 50 -10.399 17.213 -12.111 417 HD12 ILE 50 1HD1 ILE 50 -10.987 18.001 -10.647 418 HD13 ILE 50 2HD1 ILE 50 -11.854 16.615 -11.311 419 H GLU 51 H GLU 51 -9.809 16.082 -6.038 420 HA GLU 51 HA GLU 51 -12.253 15.443 -4.754 421 HB2 GLU 51 1HB GLU 51 -9.487 15.538 -3.548 422 HB3 GLU 51 2HB GLU 51 -10.885 14.698 -2.890 423 HG2 GLU 51 1HG GLU 51 -10.923 13.346 -5.014 424 HG3 GLU 51 2HG GLU 51 -9.352 14.052 -5.389 425 H LYS 52 H LYS 52 -9.994 18.102 -4.487 426 HA LYS 52 HA LYS 52 -11.054 19.311 -2.176 427 HB2 LYS 52 1HB LYS 52 -8.874 19.896 -3.222 428 HB3 LYS 52 2HB LYS 52 -9.741 20.636 -4.559 429 HG2 LYS 52 1HG LYS 52 -8.988 22.338 -3.039 430 HG3 LYS 52 2HG LYS 52 -10.750 22.236 -2.984 431 HD2 LYS 52 1HD LYS 52 -10.628 20.926 -0.937 432 HD3 LYS 52 2HD LYS 52 -8.867 20.955 -1.007 433 HE2 LYS 52 1HE LYS 52 -8.933 23.415 -0.827 434 HE3 LYS 52 2HE LYS 52 -10.688 23.331 -0.660 435 HZ1 LYS 52 3HZ LYS 52 -8.722 22.071 1.176 436 HZ2 LYS 52 1HZ LYS 52 -10.409 22.029 1.342 437 HZ3 LYS 52 2HZ LYS 52 -9.582 23.502 1.489 438 H SER 53 H SER 53 -11.861 19.570 -5.597 439 HA SER 53 HA SER 53 -14.086 21.369 -4.915 440 HB2 SER 53 1HB SER 53 -12.839 20.845 -7.627 441 HB3 SER 53 2HB SER 53 -14.033 22.083 -7.236 442 HG SER 53 HG SER 53 -11.347 21.909 -6.353 443 H LEU 54 H LEU 54 -14.050 18.420 -4.622 444 HA LEU 54 HA LEU 54 -15.416 17.050 -6.611 445 HB2 LEU 54 1HB LEU 54 -14.529 16.451 -4.105 446 HB3 LEU 54 2HB LEU 54 -16.262 16.481 -3.839 447 HG LEU 54 HG LEU 54 -15.792 14.236 -4.277 448 HD11 LEU 54 1HD1 LEU 54 -16.748 13.717 -6.468 449 HD12 LEU 54 2HD1 LEU 54 -16.584 15.413 -6.926 450 HD13 LEU 54 3HD1 LEU 54 -17.670 14.956 -5.612 451 HD21 LEU 54 3HD2 LEU 54 -13.551 14.295 -4.975 452 HD22 LEU 54 1HD2 LEU 54 -13.945 15.214 -6.428 453 HD23 LEU 54 2HD2 LEU 54 -14.449 13.530 -6.284 454 H ASN 55 H ASN 55 -16.660 18.969 -3.929 455 HA ASN 55 HA ASN 55 -19.390 18.422 -4.335 456 HB2 ASN 55 1HB ASN 55 -18.201 20.887 -3.055 457 HB3 ASN 55 2HB ASN 55 -19.834 20.274 -2.831 458 HD21 ASN 55 2HD2 ASN 55 -16.575 20.094 -1.885 459 HD22 ASN 55 1HD2 ASN 55 -16.740 18.864 -0.676 460 H LYS 56 H LYS 56 -17.227 20.759 -5.757 461 HA LYS 56 HA LYS 56 -19.199 22.420 -6.947 462 HB2 LYS 56 1HB LYS 56 -16.329 21.868 -7.718 463 HB3 LYS 56 2HB LYS 56 -17.330 23.091 -8.481 464 HG2 LYS 56 1HG LYS 56 -16.765 23.077 -5.533 465 HG3 LYS 56 2HG LYS 56 -15.714 23.875 -6.705 466 HD2 LYS 56 1HD LYS 56 -17.851 25.066 -7.499 467 HD3 LYS 56 2HD LYS 56 -18.551 24.523 -5.971 468 HE2 LYS 56 1HE LYS 56 -16.808 25.657 -4.734 469 HE3 LYS 56 2HE LYS 56 -16.010 26.123 -6.232 470 HZ1 LYS 56 3HZ LYS 56 -18.222 27.290 -6.748 471 HZ2 LYS 56 1HZ LYS 56 -17.175 28.007 -5.620 472 HZ3 LYS 56 2HZ LYS 56 -18.526 27.145 -5.084 473 H LEU 57 H LEU 57 -17.193 19.793 -8.241 474 HA LEU 57 HA LEU 57 -18.426 19.748 -10.781 475 HB2 LEU 57 1HB LEU 57 -16.638 17.889 -9.272 476 HB3 LEU 57 2HB LEU 57 -17.392 17.334 -10.755 477 HG LEU 57 HG LEU 57 -16.344 19.249 -11.956 478 HD11 LEU 57 1HD1 LEU 57 -16.053 20.768 -10.081 479 HD12 LEU 57 2HD1 LEU 57 -14.516 20.459 -10.888 480 HD13 LEU 57 3HD1 LEU 57 -14.884 19.667 -9.355 481 HD21 LEU 57 3HD2 LEU 57 -15.327 17.032 -11.962 482 HD22 LEU 57 1HD2 LEU 57 -14.427 17.439 -10.500 483 HD23 LEU 57 2HD2 LEU 57 -14.107 18.306 -12.003 484 H TYR 58 H TYR 58 -19.032 17.999 -7.794 485 HA TYR 58 HA TYR 58 -20.974 16.215 -8.812 486 HB2 TYR 58 1HB TYR 58 -19.742 16.174 -6.544 487 HB3 TYR 58 2HB TYR 58 -20.977 17.302 -5.999 488 HD1 TYR 58 HD1 TYR 58 -20.717 14.030 -7.764 489 HD2 TYR 58 HD2 TYR 58 -22.832 16.405 -4.942 490 HE1 TYR 58 HE1 TYR 58 -22.168 12.119 -7.261 491 HE2 TYR 58 HE2 TYR 58 -24.301 14.498 -4.431 492 HH TYR 58 HH TYR 58 -25.059 12.431 -5.448 493 H GLU 59 H GLU 59 -21.197 19.431 -7.341 494 HA GLU 59 HA GLU 59 -23.971 19.769 -7.418 495 HB2 GLU 59 1HB GLU 59 -22.331 21.321 -6.338 496 HB3 GLU 59 2HB GLU 59 -21.861 21.876 -7.937 497 HG2 GLU 59 1HG GLU 59 -23.363 23.465 -6.993 498 HG3 GLU 59 2HG GLU 59 -24.196 22.629 -8.303 499 H TYR 60 H TYR 60 -21.488 20.478 -9.822 500 HA TYR 60 HA TYR 60 -23.051 21.662 -11.780 501 HB2 TYR 60 1HB TYR 60 -20.703 21.827 -11.984 502 HB3 TYR 60 2HB TYR 60 -20.487 20.082 -11.890 503 HD1 TYR 60 HD2 TYR 60 -21.798 22.790 -14.056 504 HD2 TYR 60 HD1 TYR 60 -20.426 18.775 -13.832 505 HE1 TYR 60 HE2 TYR 60 -21.837 22.653 -16.508 506 HE2 TYR 60 HE1 TYR 60 -20.461 18.618 -16.283 507 HH TYR 60 HH TYR 60 -20.938 21.366 -18.310 508 H ILE 61 H ILE 61 -22.228 18.203 -11.430 509 HA ILE 61 HA ILE 61 -23.596 17.538 -13.853 510 HB ILE 61 HB ILE 61 -23.181 15.187 -13.256 511 HG12 ILE 61 1HG1 ILE 61 -21.908 16.348 -10.769 512 HG13 ILE 61 2HG1 ILE 61 -23.374 15.372 -10.811 513 HG21 ILE 61 1HG2 ILE 61 -20.736 15.311 -13.398 514 HG22 ILE 61 2HG2 ILE 61 -20.803 17.019 -12.964 515 HG23 ILE 61 3HG2 ILE 61 -21.515 16.465 -14.479 516 HD11 ILE 61 3HD1 ILE 61 -21.454 14.062 -10.116 517 HD12 ILE 61 1HD1 ILE 61 -20.622 14.463 -11.619 518 HD13 ILE 61 2HD1 ILE 61 -22.087 13.482 -11.657 519 H GLU 62 H GLU 62 -24.508 17.607 -10.480 520 HA GLU 62 HA GLU 62 -26.897 16.045 -10.891 521 HB2 GLU 62 1HB GLU 62 -26.020 17.763 -8.569 522 HB3 GLU 62 2HB GLU 62 -27.450 16.739 -8.574 523 HG2 GLU 62 1HG GLU 62 -24.676 15.704 -9.034 524 HG3 GLU 62 2HG GLU 62 -25.426 15.798 -7.442 525 H GLN 63 H GLN 63 -26.035 19.429 -10.902 526 HA GLN 63 HA GLN 63 -28.754 20.376 -10.779 527 HB2 GLN 63 1HB GLN 63 -27.863 22.578 -11.094 528 HB3 GLN 63 2HB GLN 63 -26.786 21.724 -10.000 529 HG2 GLN 63 1HG GLN 63 -25.160 21.421 -11.698 530 HG3 GLN 63 2HG GLN 63 -26.274 21.972 -12.948 531 HE21 GLN 63 2HE2 GLN 63 -24.245 22.937 -10.292 532 HE22 GLN 63 1HE2 GLN 63 -24.220 24.628 -10.662 533 H SER 64 H SER 64 -29.044 22.246 -12.672 534 HA SER 64 HA SER 64 -29.617 20.715 -15.006 535 HB2 SER 64 1HB SER 64 -30.398 22.943 -15.909 536 HB3 SER 64 2HB SER 64 -31.168 22.451 -14.400 537 HG SER 64 HG SER 64 -28.898 24.149 -14.515 538 H LYS 65 H LYS 65 -27.665 19.994 -15.828 539 HA LYS 65 HA LYS 65 -25.480 21.619 -16.562 540 HB2 LYS 65 1HB LYS 65 -25.185 19.240 -16.525 541 HB3 LYS 65 2HB LYS 65 -26.524 18.992 -17.634 542 HG2 LYS 65 1HG LYS 65 -25.140 20.267 -19.344 543 HG3 LYS 65 2HG LYS 65 -23.784 20.057 -18.233 544 HD2 LYS 65 1HD LYS 65 -25.464 17.779 -19.275 545 HD3 LYS 65 2HD LYS 65 -23.968 18.318 -20.038 546 HE2 LYS 65 1HE LYS 65 -24.097 17.523 -17.142 547 HE3 LYS 65 2HE LYS 65 -23.809 16.348 -18.428 548 HZ1 LYS 65 3HZ LYS 65 -22.129 18.731 -17.841 549 HZ2 LYS 65 1HZ LYS 65 -21.881 17.639 -19.115 550 HZ3 LYS 65 2HZ LYS 65 -21.727 17.111 -17.513 551 H ASN 66 H ASN 66 -28.521 20.871 -18.035 552 HA ASN 66 HA ASN 66 -27.873 22.281 -20.498 553 HB2 ASN 66 1HB ASN 66 -29.321 20.074 -20.121 554 HB3 ASN 66 2HB ASN 66 -30.598 21.257 -19.875 555 HD21 ASN 66 2HD2 ASN 66 -30.352 19.302 -21.959 556 HD22 ASN 66 1HD2 ASN 66 -30.301 20.171 -23.458 557 H CYS 67 H CYS 67 -30.489 23.342 -20.981 558 HA CYS 67 HA CYS 67 -31.194 24.941 -18.687 559 HB2 CYS 67 1HB CYS 67 -30.614 27.033 -19.400 560 HB3 CYS 67 2HB CYS 67 -29.281 26.116 -20.067 561 H SER 68 H SER 68 -33.153 26.014 -18.916 562 HA SER 68 HA SER 68 -34.972 24.459 -20.509 563 HB2 SER 68 1HB SER 68 -35.451 25.215 -18.155 564 HB3 SER 68 2HB SER 68 -35.630 26.855 -18.777 565 HG SER 68 HG SER 68 -37.109 25.207 -20.270 566 H TYR 69 H TYR 69 -33.119 27.019 -21.270 567 HA TYR 69 HA TYR 69 -34.938 28.479 -22.947 568 HB2 TYR 69 1HB TYR 69 -32.673 29.181 -21.780 569 HB3 TYR 69 2HB TYR 69 -31.971 28.572 -23.268 570 HD1 TYR 69 HD2 TYR 69 -34.398 31.010 -21.927 571 HD2 TYR 69 HD1 TYR 69 -31.965 29.876 -25.221 572 HE1 TYR 69 HE2 TYR 69 -34.857 33.164 -22.999 573 HE2 TYR 69 HE1 TYR 69 -32.415 32.036 -26.302 574 HH TYR 69 HH TYR 69 -34.099 33.810 -26.246 575 H CYS 70 H CYS 70 -33.247 25.558 -23.148 576 HA CYS 70 HA CYS 70 -33.670 25.517 -26.057 577 HB2 CYS 70 1HB CYS 70 -31.679 24.058 -26.309 578 HB3 CYS 70 2HB CYS 70 -31.278 25.672 -25.736 579 H SER 71 H SER 71 -33.388 23.585 -23.083 580 HA SER 71 HA SER 71 -35.024 21.511 -24.333 581 HB2 SER 71 1HB SER 71 -34.556 20.244 -22.217 582 HB3 SER 71 2HB SER 71 -33.105 20.662 -23.124 583 HG SER 71 HG SER 71 -33.677 21.225 -20.609 584 H GLU 72 H GLU 72 -37.026 20.860 -23.375 585 HA GLU 72 HA GLU 72 -38.306 23.114 -21.986 586 HB2 GLU 72 1HB GLU 72 -39.212 22.291 -24.202 587 HB3 GLU 72 2HB GLU 72 -39.670 20.807 -23.376 588 HG2 GLU 72 1HG GLU 72 -40.933 22.358 -21.753 589 HG3 GLU 72 2HG GLU 72 -40.760 23.569 -23.022 590 H ASP 73 H ASP 73 -36.920 20.242 -21.230 591 HA ASP 73 HA ASP 73 -38.843 18.904 -19.710 592 HB2 ASP 73 1HB ASP 73 -37.102 17.613 -18.784 593 HB3 ASP 73 2HB ASP 73 -36.550 18.029 -20.400 594 H GLU 74 H GLU 74 -39.649 19.159 -17.775 595 HA GLU 74 HA GLU 74 -38.888 21.531 -16.256 596 HB2 GLU 74 1HB GLU 74 -40.985 20.996 -14.957 597 HB3 GLU 74 2HB GLU 74 -41.224 21.381 -16.655 598 HG2 GLU 74 1HG GLU 74 -41.454 19.025 -17.187 599 HG3 GLU 74 2HG GLU 74 -41.147 18.602 -15.502 600 H ASN 75 H ASN 75 -37.773 18.579 -16.409 601 HA ASN 75 HA ASN 75 -37.965 17.580 -13.760 602 HB2 ASN 75 1HB ASN 75 -35.970 16.950 -15.944 603 HB3 ASN 75 2HB ASN 75 -36.106 16.066 -14.427 604 HD21 ASN 75 2HD2 ASN 75 -37.446 16.609 -17.548 605 HD22 ASN 75 1HD2 ASN 75 -38.659 15.377 -17.481 606 H CYS 76 H CYS 76 -35.554 19.521 -15.462 607 HA CYS 76 HA CYS 76 -34.272 19.995 -12.858 608 HB2 CYS 76 1HB CYS 76 -32.305 20.777 -14.176 609 HB3 CYS 76 2HB CYS 76 -32.692 19.083 -14.430 610 HG CYS 76 HG CYS 76 -34.161 19.829 -16.884 611 H ASN 77 H ASN 77 -34.918 21.810 -11.932 612 HA ASN 77 HA ASN 77 -36.110 23.929 -13.435 613 HB2 ASN 77 1HB ASN 77 -36.239 25.121 -11.260 614 HB3 ASN 77 2HB ASN 77 -36.943 23.513 -11.203 615 HD21 ASN 77 2HD2 ASN 77 -35.904 25.262 -9.095 616 HD22 ASN 77 1HD2 ASN 77 -34.708 24.329 -8.261 617 H ASN 78 H ASN 78 -34.937 25.158 -14.674 618 HA ASN 78 HA ASN 78 -32.141 25.634 -14.075 619 HB2 ASN 78 1HB ASN 78 -32.870 24.998 -16.333 620 HB3 ASN 78 2HB ASN 78 -33.795 26.483 -16.444 621 HD21 ASN 78 2HD2 ASN 78 -30.618 26.205 -14.978 622 HD22 ASN 78 1HD2 ASN 78 -29.795 27.158 -16.163 623 H LEU 79 H LEU 79 -31.829 27.097 -12.626 624 HA LEU 79 HA LEU 79 -33.468 29.340 -12.101 625 HB2 LEU 79 1HB LEU 79 -30.663 28.633 -11.266 626 HB3 LEU 79 2HB LEU 79 -31.396 30.156 -10.809 627 HG LEU 79 HG LEU 79 -33.252 28.801 -9.737 628 HD11 LEU 79 1HD1 LEU 79 -32.738 26.503 -9.119 629 HD12 LEU 79 2HD1 LEU 79 -31.259 26.569 -10.079 630 HD13 LEU 79 3HD1 LEU 79 -32.830 26.684 -10.871 631 HD21 LEU 79 3HD2 LEU 79 -31.541 29.915 -8.435 632 HD22 LEU 79 1HD2 LEU 79 -30.449 28.548 -8.662 633 HD23 LEU 79 2HD2 LEU 79 -31.927 28.350 -7.721 634 H LEU 80 H LEU 80 -30.095 29.367 -13.229 635 HA LEU 80 HA LEU 80 -30.487 31.904 -14.532 636 HB2 LEU 80 1HB LEU 80 -28.123 30.022 -14.523 637 HB3 LEU 80 2HB LEU 80 -28.140 31.566 -15.346 638 HG LEU 80 HG LEU 80 -28.651 32.584 -13.037 639 HD11 LEU 80 1HD1 LEU 80 -27.795 31.312 -11.133 640 HD12 LEU 80 2HD1 LEU 80 -27.564 29.907 -12.172 641 HD13 LEU 80 3HD1 LEU 80 -29.190 30.519 -11.868 642 HD21 LEU 80 3HD2 LEU 80 -26.547 32.890 -14.208 643 HD22 LEU 80 1HD2 LEU 80 -25.965 31.338 -13.600 644 HD23 LEU 80 2HD2 LEU 80 -26.272 32.665 -12.482 645 H GLU 81 H GLU 81 -32.225 31.233 -15.880 646 HA GLU 81 HA GLU 81 -31.879 29.149 -17.805 647 HB2 GLU 81 1HB GLU 81 -34.089 29.849 -16.853 648 HB3 GLU 81 2HB GLU 81 -33.965 31.339 -17.779 649 HG2 GLU 81 1HG GLU 81 -33.805 29.938 -19.844 650 HG3 GLU 81 2HG GLU 81 -34.171 28.536 -18.841 651 H GLY 82 H GLY 82 -31.217 29.250 -19.822 652 HA2 GLY 82 1HA GLY 82 -30.812 30.378 -21.899 653 HA3 GLY 82 2HA GLY 82 -30.650 31.883 -21.000 654 H TYR 83 H TYR 83 -29.108 29.887 -19.069 655 HA TYR 83 HA TYR 83 -26.544 30.054 -20.525 656 HB2 TYR 83 1HB TYR 83 -27.040 30.374 -17.548 657 HB3 TYR 83 2HB TYR 83 -25.460 30.377 -18.320 658 HD1 TYR 83 HD1 TYR 83 -28.546 32.277 -17.771 659 HD2 TYR 83 HD2 TYR 83 -24.688 32.293 -19.556 660 HE1 TYR 83 HE1 TYR 83 -28.708 34.713 -18.081 661 HE2 TYR 83 HE2 TYR 83 -24.836 34.725 -19.874 662 HH TYR 83 HH TYR 83 -26.556 36.449 -20.082 663 H HIS 84 H HIS 84 -24.962 28.422 -19.878 664 HA HIS 84 HA HIS 84 -26.077 26.110 -18.420 665 HB2 HIS 84 1HB HIS 84 -24.179 26.044 -20.780 666 HB3 HIS 84 2HB HIS 84 -24.462 24.671 -19.725 667 HD1 HIS 84 HD1 HIS 84 -25.480 23.172 -21.559 668 HD2 HIS 84 HD2 HIS 84 -27.451 26.794 -21.044 669 HE1 HIS 84 HE1 HIS 84 -27.530 23.111 -23.064 670 HA PRO 85 HA PRO 85 -22.635 26.818 -15.768 671 HB2 PRO 85 1HB PRO 85 -22.375 24.364 -14.649 672 HB3 PRO 85 2HB PRO 85 -23.669 25.488 -14.229 673 HG2 PRO 85 1HG PRO 85 -23.735 23.101 -16.013 674 HG3 PRO 85 2HG PRO 85 -24.969 23.701 -14.893 675 HD2 PRO 85 1HD PRO 85 -25.035 24.086 -17.609 676 HD3 PRO 85 2HD PRO 85 -25.830 25.156 -16.438 677 H LYS 86 H LYS 86 -20.494 26.840 -15.964 678 HA LYS 86 HA LYS 86 -19.196 24.714 -17.535 679 HB2 LYS 86 1HB LYS 86 -17.645 26.477 -18.435 680 HB3 LYS 86 2HB LYS 86 -19.301 26.609 -19.008 681 HG2 LYS 86 1HG LYS 86 -19.739 28.418 -17.491 682 HG3 LYS 86 2HG LYS 86 -18.150 28.228 -16.752 683 HD2 LYS 86 1HD LYS 86 -18.608 28.952 -19.642 684 HD3 LYS 86 2HD LYS 86 -18.302 30.123 -18.359 685 HE2 LYS 86 1HE LYS 86 -16.165 28.884 -17.887 686 HE3 LYS 86 2HE LYS 86 -16.463 27.961 -19.360 687 HZ1 LYS 86 3HZ LYS 86 -16.417 30.008 -20.628 688 HZ2 LYS 86 1HZ LYS 86 -14.982 29.842 -19.740 689 HZ3 LYS 86 2HZ LYS 86 -16.184 30.914 -19.214 690 H LEU 87 H LEU 87 -17.453 23.850 -16.629 691 HA LEU 87 HA LEU 87 -16.667 24.686 -13.997 692 HB2 LEU 87 1HB LEU 87 -15.488 22.556 -15.786 693 HB3 LEU 87 2HB LEU 87 -15.168 22.756 -14.075 694 HG LEU 87 HG LEU 87 -17.856 22.052 -15.254 695 HD11 LEU 87 1HD1 LEU 87 -17.466 19.825 -14.366 696 HD12 LEU 87 2HD1 LEU 87 -15.868 20.312 -13.801 697 HD13 LEU 87 3HD1 LEU 87 -16.211 20.253 -15.529 698 HD21 LEU 87 3HD2 LEU 87 -18.056 23.265 -13.165 699 HD22 LEU 87 1HD2 LEU 87 -16.893 22.180 -12.400 700 HD23 LEU 87 2HD2 LEU 87 -18.462 21.566 -12.922 701 H VAL 88 H VAL 88 -14.916 25.844 -13.437 702 HA VAL 88 HA VAL 88 -12.826 26.308 -15.459 703 HB VAL 88 HB VAL 88 -12.562 28.635 -14.642 704 HG11 VAL 88 1HG1 VAL 88 -15.301 28.013 -15.723 705 HG12 VAL 88 2HG1 VAL 88 -13.830 28.232 -16.673 706 HG13 VAL 88 3HG1 VAL 88 -14.508 29.587 -15.769 707 HG21 VAL 88 3HG2 VAL 88 -14.375 29.684 -13.355 708 HG22 VAL 88 1HG2 VAL 88 -13.556 28.418 -12.440 709 HG23 VAL 88 2HG2 VAL 88 -15.134 28.104 -13.162 710 H VAL 89 H VAL 89 -10.743 26.221 -14.669 711 HA VAL 89 HA VAL 89 -10.485 25.505 -11.867 712 HB VAL 89 HB VAL 89 -8.430 25.512 -14.077 713 HG11 VAL 89 1HG1 VAL 89 -7.362 26.039 -11.932 714 HG12 VAL 89 2HG1 VAL 89 -6.927 24.422 -12.488 715 HG13 VAL 89 3HG1 VAL 89 -8.128 24.624 -11.212 716 HG21 VAL 89 3HG2 VAL 89 -9.950 23.375 -12.648 717 HG22 VAL 89 1HG2 VAL 89 -8.518 23.057 -13.629 718 HG23 VAL 89 2HG2 VAL 89 -9.953 23.760 -14.371 719 H ASN 90 H ASN 90 -10.161 26.946 -10.396 720 HA ASN 90 HA ASN 90 -9.120 29.586 -11.195 721 HB2 ASN 90 1HB ASN 90 -11.646 28.940 -10.236 722 HB3 ASN 90 2HB ASN 90 -10.806 29.524 -8.807 723 HD21 ASN 90 2HD2 ASN 90 -13.004 30.628 -10.473 724 HD22 ASN 90 1HD2 ASN 90 -12.496 32.227 -10.882 725 H GLY 91 H GLY 91 -7.010 29.290 -10.552 726 HA2 GLY 91 1HA GLY 91 -5.244 29.283 -9.082 727 HA3 GLY 91 2HA GLY 91 -6.407 29.614 -7.807 728 H ARG 92 H ARG 92 -6.614 28.107 -6.296 729 HA ARG 92 HA ARG 92 -5.642 25.411 -6.901 730 HB2 ARG 92 1HB ARG 92 -5.675 27.064 -4.420 731 HB3 ARG 92 2HB ARG 92 -5.742 25.314 -4.264 732 HG2 ARG 92 1HG ARG 92 -3.464 26.076 -4.104 733 HG3 ARG 92 2HG ARG 92 -3.683 25.123 -5.569 734 HD2 ARG 92 1HD ARG 92 -4.150 27.526 -6.594 735 HD3 ARG 92 2HD ARG 92 -3.138 28.017 -5.240 736 HE ARG 92 HE ARG 92 -2.139 25.882 -6.959 737 HH11 ARG 92 1HH1 ARG 92 -1.972 29.239 -5.961 738 HH12 ARG 92 2HH1 ARG 92 -0.499 29.550 -6.827 739 HH21 ARG 92 1HH2 ARG 92 -0.221 26.301 -8.127 740 HH22 ARG 92 2HH2 ARG 92 0.490 27.889 -8.080 741 H SER 93 H SER 93 -8.405 26.689 -7.291 742 HA SER 93 HA SER 93 -9.855 24.384 -6.218 743 HB2 SER 93 1HB SER 93 -10.952 27.207 -6.151 744 HB3 SER 93 2HB SER 93 -11.702 25.756 -5.495 745 HG SER 93 HG SER 93 -9.303 26.985 -4.599 746 H ILE 94 H ILE 94 -11.983 24.109 -7.361 747 HA ILE 94 HA ILE 94 -11.884 25.209 -10.099 748 HB ILE 94 HB ILE 94 -13.163 22.635 -9.140 749 HG12 ILE 94 1HG1 ILE 94 -10.752 23.028 -10.923 750 HG13 ILE 94 2HG1 ILE 94 -10.652 22.682 -9.203 751 HG21 ILE 94 1HG2 ILE 94 -14.395 23.642 -10.994 752 HG22 ILE 94 2HG2 ILE 94 -13.564 22.172 -11.506 753 HG23 ILE 94 3HG2 ILE 94 -12.904 23.751 -11.932 754 HD11 ILE 94 3HD1 ILE 94 -10.299 20.675 -10.481 755 HD12 ILE 94 1HD1 ILE 94 -11.841 20.899 -11.314 756 HD13 ILE 94 2HD1 ILE 94 -11.814 20.560 -9.581 757 H ASP 95 H ASP 95 -13.610 26.370 -10.794 758 HA ASP 95 HA ASP 95 -15.846 26.694 -8.899 759 HB2 ASP 95 1HB ASP 95 -14.104 28.656 -9.493 760 HB3 ASP 95 2HB ASP 95 -15.213 28.859 -10.842 761 H ILE 96 H ILE 96 -17.723 27.883 -10.190 762 HA ILE 96 HA ILE 96 -18.144 26.479 -12.741 763 HB ILE 96 HB ILE 96 -20.216 26.677 -10.551 764 HG12 ILE 96 1HG1 ILE 96 -18.815 24.179 -11.508 765 HG13 ILE 96 2HG1 ILE 96 -18.287 25.088 -10.095 766 HG21 ILE 96 1HG2 ILE 96 -21.516 25.166 -11.979 767 HG22 ILE 96 2HG2 ILE 96 -20.244 25.237 -13.200 768 HG23 ILE 96 3HG2 ILE 96 -21.155 26.690 -12.791 769 HD11 ILE 96 3HD1 ILE 96 -20.428 24.698 -9.029 770 HD12 ILE 96 1HD1 ILE 96 -19.660 23.178 -9.485 771 HD13 ILE 96 2HD1 ILE 96 -20.989 23.820 -10.452 772 H GLU 97 H GLU 97 -18.292 28.113 -14.140 773 HA GLU 97 HA GLU 97 -19.800 30.526 -13.403 774 HB2 GLU 97 1HB GLU 97 -18.072 29.994 -15.827 775 HB3 GLU 97 2HB GLU 97 -18.845 31.521 -15.432 776 HG2 GLU 97 1HG GLU 97 -17.483 31.541 -13.322 777 HG3 GLU 97 2HG GLU 97 -16.594 30.166 -13.980 778 H TYR 98 H TYR 98 -20.783 31.426 -15.676 779 HA TYR 98 HA TYR 98 -22.356 29.251 -16.854 780 HB2 TYR 98 1HB TYR 98 -23.341 31.718 -15.489 781 HB3 TYR 98 2HB TYR 98 -24.260 31.069 -16.845 782 HD1 TYR 98 HD2 TYR 98 -23.131 30.476 -13.412 783 HD2 TYR 98 HD1 TYR 98 -25.473 28.987 -16.648 784 HE1 TYR 98 HE2 TYR 98 -24.206 28.883 -11.882 785 HE2 TYR 98 HE1 TYR 98 -26.560 27.385 -15.114 786 HH TYR 98 HH TYR 98 -26.045 26.260 -12.931 787 H TYR 99 H TYR 99 -22.238 29.268 -18.963 788 HA TYR 99 HA TYR 99 -21.677 31.808 -20.341 789 HB2 TYR 99 1HB TYR 99 -20.905 30.472 -22.246 790 HB3 TYR 99 2HB TYR 99 -20.005 30.059 -20.795 791 HD1 TYR 99 HD2 TYR 99 -20.337 27.896 -19.707 792 HD2 TYR 99 HD1 TYR 99 -22.342 28.864 -23.328 793 HE1 TYR 99 HE2 TYR 99 -20.845 25.519 -20.047 794 HE2 TYR 99 HE1 TYR 99 -22.861 26.484 -23.688 795 HH TYR 99 HH TYR 99 -22.490 24.134 -21.252 796 H GLU 100 H GLU 100 -22.899 32.249 -22.285 797 HA GLU 100 HA GLU 100 -25.651 31.640 -21.798 798 HB2 GLU 100 1HB GLU 100 -26.138 33.105 -23.700 799 HB3 GLU 100 2HB GLU 100 -25.051 33.866 -22.550 800 HG2 GLU 100 1HG GLU 100 -24.034 32.481 -24.996 801 HG3 GLU 100 2HG GLU 100 -24.569 34.159 -25.030 802 H CYS 101 H CYS 101 -26.843 30.164 -22.627 803 HA CYS 101 HA CYS 101 -26.145 28.004 -24.139 804 HB2 CYS 101 1HB CYS 101 -28.324 28.372 -22.980 805 HB3 CYS 101 2HB CYS 101 -28.795 29.463 -24.273 806 HA PRO 102 HA PRO 102 -25.046 29.792 -28.101 807 HB2 PRO 102 1HB PRO 102 -25.009 27.360 -29.429 808 HB3 PRO 102 2HB PRO 102 -23.653 28.061 -28.544 809 HG2 PRO 102 1HG PRO 102 -25.596 25.969 -27.690 810 HG3 PRO 102 2HG PRO 102 -23.862 26.100 -27.350 811 HD2 PRO 102 1HD PRO 102 -25.735 26.719 -25.519 812 HD3 PRO 102 2HD PRO 102 -24.191 27.590 -25.617 813 H VAL 103 H VAL 103 -27.894 28.120 -27.318 814 HA VAL 103 HA VAL 103 -29.133 28.231 -29.904 815 HB VAL 103 HB VAL 103 -30.344 27.821 -27.162 816 HG11 VAL 103 1HG1 VAL 103 -32.281 26.912 -28.327 817 HG12 VAL 103 2HG1 VAL 103 -31.543 27.305 -29.880 818 HG13 VAL 103 3HG1 VAL 103 -32.010 28.596 -28.773 819 HG21 VAL 103 3HG2 VAL 103 -29.521 25.844 -29.285 820 HG22 VAL 103 1HG2 VAL 103 -30.383 25.444 -27.798 821 HG23 VAL 103 2HG2 VAL 103 -28.744 26.093 -27.721 822 H LYS 104 H LYS 104 -28.744 30.382 -27.208 823 HA LYS 104 HA LYS 104 -30.951 32.097 -27.701 824 HB2 LYS 104 1HB LYS 104 -29.580 32.005 -25.591 825 HB3 LYS 104 2HB LYS 104 -28.304 32.849 -26.455 826 HG2 LYS 104 1HG LYS 104 -29.709 34.779 -26.750 827 HG3 LYS 104 2HG LYS 104 -31.088 33.928 -26.049 828 HD2 LYS 104 1HD LYS 104 -29.918 33.765 -23.919 829 HD3 LYS 104 2HD LYS 104 -28.511 34.569 -24.616 830 HE2 LYS 104 1HE LYS 104 -29.782 36.159 -23.339 831 HE3 LYS 104 2HE LYS 104 -29.905 36.559 -25.047 832 HZ1 LYS 104 3HZ LYS 104 -31.967 35.137 -23.440 833 HZ2 LYS 104 1HZ LYS 104 -32.089 35.513 -25.094 834 HZ3 LYS 104 2HZ LYS 104 -32.034 36.754 -23.942 835 H ARG 105 H ARG 105 -27.584 32.096 -28.737 836 HA ARG 105 HA ARG 105 -28.392 33.622 -31.094 837 HB2 ARG 105 1HB ARG 105 -26.188 34.282 -29.200 838 HB3 ARG 105 2HB ARG 105 -25.914 34.554 -30.918 839 HG2 ARG 105 1HG ARG 105 -28.229 35.663 -29.355 840 HG3 ARG 105 2HG ARG 105 -26.747 36.547 -29.735 841 HD2 ARG 105 1HD ARG 105 -27.197 36.272 -32.120 842 HD3 ARG 105 2HD ARG 105 -28.667 35.374 -31.744 843 HE ARG 105 HE ARG 105 -28.567 38.012 -30.581 844 HH11 ARG 105 1HH1 ARG 105 -29.388 36.193 -33.459 845 HH12 ARG 105 2HH1 ARG 105 -30.580 37.333 -34.001 846 HH21 ARG 105 1HH2 ARG 105 -30.136 39.513 -31.273 847 HH22 ARG 105 2HH2 ARG 105 -31.018 39.222 -32.751 848 H LYS 106 H LYS 106 -28.480 31.714 -32.207 849 HA LYS 106 HA LYS 106 -26.180 29.977 -32.345 850 HB2 LYS 106 1HB LYS 106 -28.819 29.524 -32.573 851 HB3 LYS 106 2HB LYS 106 -28.413 29.715 -34.274 852 HG2 LYS 106 1HG LYS 106 -26.746 27.962 -34.088 853 HG3 LYS 106 2HG LYS 106 -27.123 27.784 -32.373 854 HD2 LYS 106 1HD LYS 106 -28.291 26.061 -33.536 855 HD3 LYS 106 2HD LYS 106 -29.482 27.265 -33.038 856 HE2 LYS 106 1HE LYS 106 -29.946 26.586 -35.303 857 HE3 LYS 106 2HE LYS 106 -29.371 28.253 -35.305 858 HZ1 LYS 106 3HZ LYS 106 -28.345 26.990 -37.073 859 HZ2 LYS 106 1HZ LYS 106 -27.753 25.848 -35.967 860 HZ3 LYS 106 2HZ LYS 106 -27.171 27.440 -35.939 Start of MODEL 3 1 HA MET 1 HA MET 1 -7.910 -5.265 -16.197 2 HB2 MET 1 1HB MET 1 -6.295 -3.307 -17.843 3 HB3 MET 1 2HB MET 1 -5.617 -4.278 -16.545 4 HG2 MET 1 1HG MET 1 -6.283 -6.312 -17.755 5 HG3 MET 1 2HG MET 1 -6.872 -5.305 -19.077 6 HE1 MET 1 2HE MET 1 -3.740 -6.415 -16.998 7 HE2 MET 1 3HE MET 1 -3.661 -4.658 -16.861 8 HE3 MET 1 1HE MET 1 -2.443 -5.528 -17.794 9 H GLU 2 H GLU 2 -8.137 -4.710 -14.174 10 HA GLU 2 HA GLU 2 -8.490 -1.869 -13.544 11 HB2 GLU 2 1HB GLU 2 -9.366 -4.331 -12.027 12 HB3 GLU 2 2HB GLU 2 -9.626 -2.679 -11.490 13 HG2 GLU 2 1HG GLU 2 -11.661 -3.339 -12.426 14 HG3 GLU 2 2HG GLU 2 -10.905 -2.328 -13.653 15 HA PRO 3 HA PRO 3 -4.776 -1.901 -11.130 16 HB2 PRO 3 1HB PRO 3 -5.264 0.182 -9.480 17 HB3 PRO 3 2HB PRO 3 -4.911 0.398 -11.199 18 HG2 PRO 3 1HG PRO 3 -7.543 0.439 -9.781 19 HG3 PRO 3 2HG PRO 3 -6.954 1.487 -11.084 20 HD2 PRO 3 1HD PRO 3 -8.648 -0.625 -11.477 21 HD3 PRO 3 2HD PRO 3 -7.530 -0.018 -12.715 22 H ILE 4 H ILE 4 -3.988 -2.303 -8.989 23 HA ILE 4 HA ILE 4 -5.670 -4.085 -7.520 24 HB ILE 4 HB ILE 4 -3.317 -4.594 -7.731 25 HG12 ILE 4 1HG1 ILE 4 -2.740 -4.954 -5.328 26 HG13 ILE 4 2HG1 ILE 4 -4.105 -3.933 -4.887 27 HG21 ILE 4 1HG2 ILE 4 -1.588 -3.267 -6.611 28 HG22 ILE 4 2HG2 ILE 4 -2.801 -2.058 -6.188 29 HG23 ILE 4 3HG2 ILE 4 -2.407 -2.359 -7.883 30 HD11 ILE 4 3HD1 ILE 4 -4.671 -6.285 -4.694 31 HD12 ILE 4 1HD1 ILE 4 -4.256 -6.538 -6.389 32 HD13 ILE 4 2HD1 ILE 4 -5.628 -5.516 -5.963 33 H GLY 5 H GLY 5 -6.887 -3.691 -5.797 34 HA2 GLY 5 1HA GLY 5 -7.042 -0.967 -4.804 35 HA3 GLY 5 2HA GLY 5 -8.165 -2.272 -4.454 36 H ARG 6 H ARG 6 -8.223 -2.435 -2.307 37 HA ARG 6 HA ARG 6 -5.647 -2.697 -0.900 38 HB2 ARG 6 1HB ARG 6 -8.023 -1.033 -0.203 39 HB3 ARG 6 2HB ARG 6 -7.142 -1.799 1.111 40 HG2 ARG 6 1HG ARG 6 -6.252 0.368 0.879 41 HG3 ARG 6 2HG ARG 6 -5.058 -0.735 0.199 42 HD2 ARG 6 1HD ARG 6 -6.075 -0.234 -2.061 43 HD3 ARG 6 2HD ARG 6 -6.971 1.063 -1.269 44 HE ARG 6 HE ARG 6 -4.026 0.940 -1.202 45 HH11 ARG 6 1HH1 ARG 6 -6.997 2.677 -1.903 46 HH12 ARG 6 2HH1 ARG 6 -6.189 4.195 -2.168 47 HH21 ARG 6 1HH2 ARG 6 -2.972 2.921 -1.573 48 HH22 ARG 6 2HH2 ARG 6 -3.894 4.332 -2.021 49 H SER 7 H SER 7 -5.801 -3.902 1.148 50 HA SER 7 HA SER 7 -7.219 -6.360 0.707 51 HB2 SER 7 1HB SER 7 -5.649 -5.564 3.164 52 HB3 SER 7 2HB SER 7 -5.969 -7.194 2.564 53 HG SER 7 HG SER 7 -4.008 -6.851 1.764 54 H LEU 8 H LEU 8 -7.959 -3.457 2.232 55 HA LEU 8 HA LEU 8 -9.665 -4.538 4.290 56 HB2 LEU 8 1HB LEU 8 -10.297 -2.108 4.590 57 HB3 LEU 8 2HB LEU 8 -8.624 -2.528 4.888 58 HG LEU 8 HG LEU 8 -8.180 -1.718 2.491 59 HD11 LEU 8 1HD1 LEU 8 -10.855 -0.407 2.957 60 HD12 LEU 8 2HD1 LEU 8 -10.504 -1.644 1.751 61 HD13 LEU 8 3HD1 LEU 8 -9.744 -0.058 1.632 62 HD21 LEU 8 3HD2 LEU 8 -9.014 0.215 4.645 63 HD22 LEU 8 1HD2 LEU 8 -8.010 0.608 3.247 64 HD23 LEU 8 2HD2 LEU 8 -7.429 -0.535 4.458 65 H GLN 9 H GLN 9 -10.032 -4.728 1.195 66 HA GLN 9 HA GLN 9 -12.344 -3.429 0.403 67 HB2 GLN 9 1HB GLN 9 -12.583 -5.346 -1.228 68 HB3 GLN 9 2HB GLN 9 -11.036 -4.512 -1.245 69 HG2 GLN 9 1HG GLN 9 -10.019 -6.289 0.037 70 HG3 GLN 9 2HG GLN 9 -11.572 -7.108 0.181 71 HE21 GLN 9 2HE2 GLN 9 -8.964 -6.260 -1.950 72 HE22 GLN 9 1HE2 GLN 9 -9.351 -7.399 -3.200 73 H GLY 10 H GLY 10 -12.048 -6.563 2.069 74 HA2 GLY 10 1HA GLY 10 -14.997 -6.641 2.186 75 HA3 GLY 10 2HA GLY 10 -13.978 -8.070 2.129 76 H VAL 11 H VAL 11 -13.403 -5.222 4.134 77 HA VAL 11 HA VAL 11 -14.231 -6.786 6.481 78 HB VAL 11 HB VAL 11 -12.343 -5.974 7.786 79 HG11 VAL 11 1HG1 VAL 11 -12.082 -8.111 6.685 80 HG12 VAL 11 2HG1 VAL 11 -10.537 -7.260 6.716 81 HG13 VAL 11 3HG1 VAL 11 -11.485 -7.316 5.229 82 HG21 VAL 11 3HG2 VAL 11 -10.466 -4.804 6.740 83 HG22 VAL 11 1HG2 VAL 11 -11.953 -3.862 6.630 84 HG23 VAL 11 2HG2 VAL 11 -11.355 -4.735 5.218 85 H THR 12 H THR 12 -14.561 -5.404 8.418 86 HA THR 12 HA THR 12 -16.088 -3.072 7.702 87 HB THR 12 HB THR 12 -16.854 -4.658 9.435 88 HG1 THR 12 HG1 THR 12 -17.902 -2.955 10.084 89 HG21 THR 12 3HG2 THR 12 -15.836 -4.624 11.674 90 HG22 THR 12 1HG2 THR 12 -14.542 -3.591 11.063 91 HG23 THR 12 2HG2 THR 12 -14.722 -5.237 10.452 92 H GLY 13 H GLY 13 -13.406 -2.738 7.033 93 HA2 GLY 13 1HA GLY 13 -12.441 -0.768 9.010 94 HA3 GLY 13 2HA GLY 13 -11.399 -1.658 7.910 95 H ARG 14 H ARG 14 -14.429 -0.392 6.817 96 HA ARG 14 HA ARG 14 -13.265 2.021 5.786 97 HB2 ARG 14 1HB ARG 14 -14.300 1.305 3.440 98 HB3 ARG 14 2HB ARG 14 -12.628 1.017 3.869 99 HG2 ARG 14 1HG ARG 14 -13.415 -0.955 2.849 100 HG3 ARG 14 2HG ARG 14 -13.309 -1.297 4.576 101 HD2 ARG 14 1HD ARG 14 -15.636 -1.226 4.841 102 HD3 ARG 14 2HD ARG 14 -15.873 -0.403 3.298 103 HE ARG 14 HE ARG 14 -14.749 -2.795 2.624 104 HH11 ARG 14 1HH1 ARG 14 -17.568 -1.857 4.480 105 HH12 ARG 14 2HH1 ARG 14 -18.491 -3.256 4.020 106 HH21 ARG 14 1HH2 ARG 14 -15.967 -4.622 1.998 107 HH22 ARG 14 2HH2 ARG 14 -17.584 -4.828 2.622 108 HA PRO 15 HA PRO 15 -17.500 2.565 7.421 109 HB2 PRO 15 1HB PRO 15 -17.081 5.292 7.706 110 HB3 PRO 15 2HB PRO 15 -16.763 4.075 8.944 111 HG2 PRO 15 1HG PRO 15 -14.870 5.350 7.009 112 HG3 PRO 15 2HG PRO 15 -14.633 4.975 8.729 113 HD2 PRO 15 1HD PRO 15 -13.574 3.412 6.850 114 HD3 PRO 15 2HD PRO 15 -14.294 2.707 8.310 115 H ASP 16 H ASP 16 -19.250 4.071 6.845 116 HA ASP 16 HA ASP 16 -19.803 4.048 4.104 117 HB2 ASP 16 1HB ASP 16 -21.054 5.571 6.386 118 HB3 ASP 16 2HB ASP 16 -21.662 5.694 4.740 119 H PHE 17 H PHE 17 -18.162 6.412 6.025 120 HA PHE 17 HA PHE 17 -18.391 8.719 4.536 121 HB2 PHE 17 1HB PHE 17 -17.171 8.553 6.677 122 HB3 PHE 17 2HB PHE 17 -15.886 7.664 5.868 123 HD1 PHE 17 HD2 PHE 17 -17.527 10.941 6.189 124 HD2 PHE 17 HD1 PHE 17 -14.241 8.780 4.559 125 HE1 PHE 17 HE2 PHE 17 -16.398 13.060 5.657 126 HE2 PHE 17 HE1 PHE 17 -13.108 10.896 4.030 127 HZ PHE 17 HZ PHE 17 -14.186 13.041 4.579 128 H GLN 18 H GLN 18 -16.149 6.006 3.987 129 HA GLN 18 HA GLN 18 -14.896 7.280 1.761 130 HB2 GLN 18 1HB GLN 18 -13.585 5.363 1.563 131 HB3 GLN 18 2HB GLN 18 -13.933 5.445 3.274 132 HG2 GLN 18 1HG GLN 18 -14.307 3.238 2.946 133 HG3 GLN 18 2HG GLN 18 -15.927 3.838 2.597 134 HE21 GLN 18 2HE2 GLN 18 -13.156 4.143 0.422 135 HE22 GLN 18 1HE2 GLN 18 -13.788 3.106 -0.799 136 H LYS 19 H LYS 19 -17.641 5.223 2.208 137 HA LYS 19 HA LYS 19 -17.928 4.420 -0.503 138 HB2 LYS 19 1HB LYS 19 -19.730 4.357 1.894 139 HB3 LYS 19 2HB LYS 19 -20.343 3.947 0.301 140 HG2 LYS 19 1HG LYS 19 -17.965 2.618 1.560 141 HG3 LYS 19 2HG LYS 19 -19.615 2.013 1.697 142 HD2 LYS 19 1HD LYS 19 -19.708 2.011 -0.816 143 HD3 LYS 19 2HD LYS 19 -17.979 2.359 -0.807 144 HE2 LYS 19 1HE LYS 19 -19.325 -0.043 0.402 145 HE3 LYS 19 2HE LYS 19 -18.395 -0.021 -1.095 146 HZ1 LYS 19 3HZ LYS 19 -16.922 -0.815 0.506 147 HZ2 LYS 19 1HZ LYS 19 -17.437 0.298 1.682 148 HZ3 LYS 19 2HZ LYS 19 -16.507 0.825 0.367 149 H ARG 20 H ARG 20 -19.368 7.036 1.438 150 HA ARG 20 HA ARG 20 -21.004 7.957 -0.720 151 HB2 ARG 20 1HB ARG 20 -21.471 9.891 0.660 152 HB3 ARG 20 2HB ARG 20 -21.578 8.423 1.620 153 HG2 ARG 20 1HG ARG 20 -19.335 8.876 2.517 154 HG3 ARG 20 2HG ARG 20 -19.289 10.378 1.590 155 HD2 ARG 20 1HD ARG 20 -19.933 10.838 3.874 156 HD3 ARG 20 2HD ARG 20 -21.286 11.153 2.786 157 HE ARG 20 HE ARG 20 -22.072 8.849 3.481 158 HH11 ARG 20 1HH1 ARG 20 -20.207 10.942 5.603 159 HH12 ARG 20 2HH1 ARG 20 -20.827 10.207 7.055 160 HH21 ARG 20 1HH2 ARG 20 -22.875 7.907 5.396 161 HH22 ARG 20 2HH2 ARG 20 -22.326 8.496 6.938 162 H LEU 21 H LEU 21 -17.771 8.661 0.405 163 HA LEU 21 HA LEU 21 -17.302 10.969 -1.153 164 HB2 LEU 21 1HB LEU 21 -15.809 10.485 0.623 165 HB3 LEU 21 2HB LEU 21 -15.518 8.858 0.040 166 HG LEU 21 HG LEU 21 -14.331 9.825 -1.917 167 HD11 LEU 21 1HD1 LEU 21 -15.389 12.021 -1.940 168 HD12 LEU 21 2HD1 LEU 21 -13.634 12.166 -1.831 169 HD13 LEU 21 3HD1 LEU 21 -14.630 12.413 -0.397 170 HD21 LEU 21 3HD2 LEU 21 -13.271 10.608 0.794 171 HD22 LEU 21 1HD2 LEU 21 -12.311 10.426 -0.673 172 HD23 LEU 21 2HD2 LEU 21 -13.114 9.024 0.037 173 H GLU 22 H GLU 22 -16.541 7.548 -1.730 174 HA GLU 22 HA GLU 22 -15.669 7.999 -4.384 175 HB2 GLU 22 1HB GLU 22 -16.387 5.473 -2.919 176 HB3 GLU 22 2HB GLU 22 -15.746 5.500 -4.559 177 HG2 GLU 22 1HG GLU 22 -14.373 6.600 -2.115 178 HG3 GLU 22 2HG GLU 22 -13.997 5.078 -2.913 179 H GLN 23 H GLN 23 -18.803 7.365 -2.998 180 HA GLN 23 HA GLN 23 -20.163 6.581 -5.330 181 HB2 GLN 23 1HB GLN 23 -20.883 7.650 -2.701 182 HB3 GLN 23 2HB GLN 23 -22.012 8.088 -3.973 183 HG2 GLN 23 1HG GLN 23 -22.361 5.766 -4.520 184 HG3 GLN 23 2HG GLN 23 -21.121 5.278 -3.366 185 HE21 GLN 23 2HE2 GLN 23 -21.558 5.379 -1.176 186 HE22 GLN 23 1HE2 GLN 23 -23.174 5.498 -0.556 187 H MET 24 H MET 24 -19.973 9.853 -3.910 188 HA MET 24 HA MET 24 -21.021 11.149 -6.166 189 HB2 MET 24 1HB MET 24 -20.054 13.211 -5.267 190 HB3 MET 24 2HB MET 24 -20.879 12.290 -4.023 191 HG2 MET 24 1HG MET 24 -18.687 11.452 -3.261 192 HG3 MET 24 2HG MET 24 -17.909 12.488 -4.456 193 HE1 MET 24 3HE MET 24 -19.089 16.053 -3.177 194 HE2 MET 24 1HE MET 24 -19.895 15.010 -4.348 195 HE3 MET 24 2HE MET 24 -18.144 15.208 -4.405 196 H LYS 25 H LYS 25 -17.762 10.224 -5.318 197 HA LYS 25 HA LYS 25 -16.302 11.335 -7.410 198 HB2 LYS 25 1HB LYS 25 -15.317 10.196 -5.483 199 HB3 LYS 25 2HB LYS 25 -15.998 8.671 -6.021 200 HG2 LYS 25 1HG LYS 25 -13.785 8.530 -6.645 201 HG3 LYS 25 2HG LYS 25 -14.598 9.016 -8.133 202 HD2 LYS 25 1HD LYS 25 -13.360 10.856 -8.256 203 HD3 LYS 25 2HD LYS 25 -13.841 11.336 -6.626 204 HE2 LYS 25 1HE LYS 25 -11.671 9.338 -7.235 205 HE3 LYS 25 2HE LYS 25 -11.379 11.050 -6.936 206 HZ1 LYS 25 3HZ LYS 25 -12.203 10.838 -4.734 207 HZ2 LYS 25 1HZ LYS 25 -11.077 9.607 -4.968 208 HZ3 LYS 25 2HZ LYS 25 -12.729 9.241 -4.990 209 H GLU 26 H GLU 26 -18.033 8.263 -7.235 210 HA GLU 26 HA GLU 26 -17.359 7.094 -9.636 211 HB2 GLU 26 1HB GLU 26 -18.660 6.038 -7.804 212 HB3 GLU 26 2HB GLU 26 -20.048 7.020 -8.246 213 HG2 GLU 26 1HG GLU 26 -20.342 4.828 -9.126 214 HG3 GLU 26 2HG GLU 26 -20.049 5.937 -10.466 215 H LYS 27 H LYS 27 -20.113 9.220 -8.970 216 HA LYS 27 HA LYS 27 -21.131 9.368 -11.570 217 HB2 LYS 27 1HB LYS 27 -21.219 11.298 -9.261 218 HB3 LYS 27 2HB LYS 27 -22.009 11.648 -10.790 219 HG2 LYS 27 1HG LYS 27 -22.563 9.191 -9.152 220 HG3 LYS 27 2HG LYS 27 -23.489 10.687 -9.028 221 HD2 LYS 27 1HD LYS 27 -23.139 9.042 -11.532 222 HD3 LYS 27 2HD LYS 27 -24.570 9.041 -10.501 223 HE2 LYS 27 1HE LYS 27 -23.477 11.462 -11.925 224 HE3 LYS 27 2HE LYS 27 -24.798 10.462 -12.523 225 HZ1 LYS 27 3HZ LYS 27 -26.138 11.073 -10.671 226 HZ2 LYS 27 1HZ LYS 27 -25.512 12.501 -11.333 227 HZ3 LYS 27 2HZ LYS 27 -24.852 11.866 -9.910 228 H VAL 28 H VAL 28 -18.771 11.435 -9.931 229 HA VAL 28 HA VAL 28 -18.517 13.312 -12.016 230 HB VAL 28 HB VAL 28 -16.517 12.640 -9.842 231 HG11 VAL 28 1HG1 VAL 28 -15.490 13.894 -11.640 232 HG12 VAL 28 2HG1 VAL 28 -15.667 14.902 -10.203 233 HG13 VAL 28 3HG1 VAL 28 -16.777 15.097 -11.562 234 HG21 VAL 28 3HG2 VAL 28 -18.700 13.271 -8.942 235 HG22 VAL 28 1HG2 VAL 28 -18.670 14.753 -9.897 236 HG23 VAL 28 2HG2 VAL 28 -17.483 14.506 -8.612 237 H MET 29 H MET 29 -16.744 10.346 -11.279 238 HA MET 29 HA MET 29 -14.590 10.929 -13.062 239 HB2 MET 29 1HB MET 29 -13.710 8.790 -12.502 240 HB3 MET 29 2HB MET 29 -14.405 9.464 -11.038 241 HG2 MET 29 1HG MET 29 -16.249 8.018 -11.109 242 HG3 MET 29 2HG MET 29 -15.926 7.559 -12.781 243 HE1 MET 29 3HE MET 29 -13.408 6.188 -9.161 244 HE2 MET 29 1HE MET 29 -14.852 7.194 -9.045 245 HE3 MET 29 2HE MET 29 -13.376 7.846 -9.756 246 H LYS 30 H LYS 30 -17.720 9.987 -13.796 247 HA LYS 30 HA LYS 30 -16.727 8.713 -16.255 248 HB2 LYS 30 1HB LYS 30 -18.751 7.742 -14.357 249 HB3 LYS 30 2HB LYS 30 -19.136 7.556 -16.068 250 HG2 LYS 30 1HG LYS 30 -17.752 5.840 -16.245 251 HG3 LYS 30 2HG LYS 30 -16.415 6.797 -15.600 252 HD2 LYS 30 1HD LYS 30 -16.658 4.977 -14.137 253 HD3 LYS 30 2HD LYS 30 -17.397 6.361 -13.318 254 HE2 LYS 30 1HE LYS 30 -19.561 5.590 -13.720 255 HE3 LYS 30 2HE LYS 30 -19.033 4.490 -14.996 256 HZ1 LYS 30 3HZ LYS 30 -18.073 3.048 -13.418 257 HZ2 LYS 30 1HZ LYS 30 -19.618 3.421 -12.830 258 HZ3 LYS 30 2HZ LYS 30 -18.253 4.169 -12.155 259 H ASP 31 H ASP 31 -18.408 11.316 -15.088 260 HA ASP 31 HA ASP 31 -20.328 11.483 -17.201 261 HB2 ASP 31 1HB ASP 31 -19.681 12.975 -14.803 262 HB3 ASP 31 2HB ASP 31 -19.998 14.036 -16.164 263 H GLN 32 H GLN 32 -20.107 12.345 -19.150 264 HA GLN 32 HA GLN 32 -17.475 12.455 -20.167 265 HB2 GLN 32 1HB GLN 32 -18.549 12.930 -22.332 266 HB3 GLN 32 2HB GLN 32 -19.240 11.544 -21.506 267 HG2 GLN 32 1HG GLN 32 -21.097 12.992 -20.742 268 HG3 GLN 32 2HG GLN 32 -20.422 14.301 -21.714 269 HE21 GLN 32 2HE2 GLN 32 -19.544 12.402 -23.803 270 HE22 GLN 32 1HE2 GLN 32 -20.982 11.978 -24.674 271 H ASP 33 H ASP 33 -19.771 14.984 -19.375 272 HA ASP 33 HA ASP 33 -18.362 17.091 -20.655 273 HB2 ASP 33 1HB ASP 33 -19.619 18.501 -18.839 274 HB3 ASP 33 2HB ASP 33 -20.520 17.734 -20.140 275 H VAL 34 H VAL 34 -18.315 15.803 -17.373 276 HA VAL 34 HA VAL 34 -16.302 17.402 -16.298 277 HB VAL 34 HB VAL 34 -16.820 14.467 -15.786 278 HG11 VAL 34 1HG1 VAL 34 -15.714 14.837 -13.624 279 HG12 VAL 34 2HG1 VAL 34 -15.315 16.484 -14.122 280 HG13 VAL 34 3HG1 VAL 34 -14.618 15.111 -14.980 281 HG21 VAL 34 3HG2 VAL 34 -18.129 15.257 -13.867 282 HG22 VAL 34 1HG2 VAL 34 -18.784 15.854 -15.392 283 HG23 VAL 34 2HG2 VAL 34 -17.836 16.925 -14.360 284 H GLN 35 H GLN 35 -16.058 14.400 -18.179 285 HA GLN 35 HA GLN 35 -13.298 14.036 -18.169 286 HB2 GLN 35 1HB GLN 35 -15.199 13.524 -20.464 287 HB3 GLN 35 2HB GLN 35 -13.597 12.826 -20.282 288 HG2 GLN 35 1HG GLN 35 -15.873 12.392 -18.374 289 HG3 GLN 35 2HG GLN 35 -15.435 11.305 -19.689 290 HE21 GLN 35 2HE2 GLN 35 -15.483 10.942 -16.768 291 HE22 GLN 35 1HE2 GLN 35 -13.904 10.382 -16.350 292 H ALA 36 H ALA 36 -15.286 15.816 -20.484 293 HA ALA 36 HA ALA 36 -13.304 16.715 -22.205 294 HB1 ALA 36 1HB ALA 36 -14.864 18.474 -22.855 295 HB2 ALA 36 2HB ALA 36 -15.827 18.163 -21.410 296 HB3 ALA 36 3HB ALA 36 -15.694 16.929 -22.664 297 H PHE 37 H PHE 37 -14.471 18.197 -19.201 298 HA PHE 37 HA PHE 37 -12.808 20.491 -19.394 299 HB2 PHE 37 1HB PHE 37 -14.772 20.521 -17.962 300 HB3 PHE 37 2HB PHE 37 -14.118 19.209 -16.988 301 HD1 PHE 37 HD2 PHE 37 -13.193 22.626 -18.142 302 HD2 PHE 37 HD1 PHE 37 -13.044 19.729 -15.031 303 HE1 PHE 37 HE2 PHE 37 -12.086 24.262 -16.684 304 HE2 PHE 37 HE1 PHE 37 -11.941 21.362 -13.559 305 HZ PHE 37 HZ PHE 37 -11.455 23.634 -14.386 306 H LEU 38 H LEU 38 -12.473 17.371 -17.762 307 HA LEU 38 HA LEU 38 -10.091 17.925 -16.402 308 HB2 LEU 38 1HB LEU 38 -11.646 15.542 -17.083 309 HB3 LEU 38 2HB LEU 38 -9.927 15.239 -16.927 310 HG LEU 38 HG LEU 38 -11.058 14.819 -14.821 311 HD11 LEU 38 1HD1 LEU 38 -9.709 16.240 -13.373 312 HD12 LEU 38 2HD1 LEU 38 -9.394 17.329 -14.723 313 HD13 LEU 38 3HD1 LEU 38 -8.774 15.678 -14.759 314 HD21 LEU 38 3HD2 LEU 38 -12.954 16.347 -15.131 315 HD22 LEU 38 1HD2 LEU 38 -11.874 17.721 -14.901 316 HD23 LEU 38 2HD2 LEU 38 -12.158 16.592 -13.575 317 H LYS 39 H LYS 39 -10.622 16.526 -19.622 318 HA LYS 39 HA LYS 39 -7.836 16.131 -20.121 319 HB2 LYS 39 1HB LYS 39 -8.460 15.717 -22.437 320 HB3 LYS 39 2HB LYS 39 -9.556 14.873 -21.354 321 HG2 LYS 39 1HG LYS 39 -11.342 16.172 -21.916 322 HG3 LYS 39 2HG LYS 39 -10.341 17.572 -22.304 323 HD2 LYS 39 1HD LYS 39 -10.483 15.061 -23.968 324 HD3 LYS 39 2HD LYS 39 -11.413 16.525 -24.288 325 HE2 LYS 39 1HE LYS 39 -8.400 16.354 -24.197 326 HE3 LYS 39 2HE LYS 39 -9.373 16.382 -25.666 327 HZ1 LYS 39 3HZ LYS 39 -8.372 18.565 -24.910 328 HZ2 LYS 39 1HZ LYS 39 -9.507 18.552 -23.657 329 HZ3 LYS 39 2HZ LYS 39 -10.031 18.585 -25.265 330 H GLU 40 H GLU 40 -9.986 18.823 -20.416 331 HA GLU 40 HA GLU 40 -8.420 20.309 -22.275 332 HB2 GLU 40 1HB GLU 40 -10.944 20.530 -21.543 333 HB3 GLU 40 2HB GLU 40 -10.277 21.608 -20.329 334 HG2 GLU 40 1HG GLU 40 -11.060 22.779 -22.345 335 HG3 GLU 40 2HG GLU 40 -9.349 23.035 -22.008 336 H ASN 41 H ASN 41 -8.753 20.272 -18.762 337 HA ASN 41 HA ASN 41 -6.500 22.168 -18.586 338 HB2 ASN 41 1HB ASN 41 -8.874 21.712 -16.791 339 HB3 ASN 41 2HB ASN 41 -7.431 22.545 -16.216 340 HD21 ASN 41 2HD2 ASN 41 -10.194 22.697 -18.308 341 HD22 ASN 41 1HD2 ASN 41 -10.062 24.376 -18.698 342 H GLU 42 H GLU 42 -6.285 19.261 -18.883 343 HA GLU 42 HA GLU 42 -5.810 18.009 -16.400 344 HB2 GLU 42 1HB GLU 42 -4.661 16.266 -17.688 345 HB3 GLU 42 2HB GLU 42 -6.190 16.715 -18.428 346 HG2 GLU 42 1HG GLU 42 -5.003 18.075 -20.066 347 HG3 GLU 42 2HG GLU 42 -3.467 17.642 -19.316 348 H GLU 43 H GLU 43 -3.915 20.167 -18.265 349 HA GLU 43 HA GLU 43 -1.376 19.470 -17.161 350 HB2 GLU 43 1HB GLU 43 -1.733 20.639 -19.355 351 HB3 GLU 43 2HB GLU 43 -2.213 22.069 -18.456 352 HG2 GLU 43 1HG GLU 43 0.084 22.239 -19.194 353 HG3 GLU 43 2HG GLU 43 -0.005 22.179 -17.434 354 H VAL 44 H VAL 44 -4.048 21.397 -16.150 355 HA VAL 44 HA VAL 44 -2.386 22.893 -14.243 356 HB VAL 44 HB VAL 44 -5.293 23.361 -14.932 357 HG11 VAL 44 1HG1 VAL 44 -3.262 25.074 -13.503 358 HG12 VAL 44 2HG1 VAL 44 -4.646 24.257 -12.774 359 HG13 VAL 44 3HG1 VAL 44 -4.901 25.570 -13.923 360 HG21 VAL 44 3HG2 VAL 44 -4.493 25.230 -16.321 361 HG22 VAL 44 1HG2 VAL 44 -3.937 23.668 -16.926 362 HG23 VAL 44 2HG2 VAL 44 -2.831 24.715 -16.038 363 H ILE 45 H ILE 45 -5.225 20.810 -14.455 364 HA ILE 45 HA ILE 45 -5.799 20.946 -11.645 365 HB ILE 45 HB ILE 45 -6.864 19.034 -13.722 366 HG12 ILE 45 1HG1 ILE 45 -8.071 21.608 -12.697 367 HG13 ILE 45 2HG1 ILE 45 -7.250 21.438 -14.246 368 HG21 ILE 45 1HG2 ILE 45 -8.705 18.674 -12.190 369 HG22 ILE 45 2HG2 ILE 45 -7.994 19.804 -11.038 370 HG23 ILE 45 3HG2 ILE 45 -7.176 18.284 -11.399 371 HD11 ILE 45 3HD1 ILE 45 -9.652 21.356 -14.526 372 HD12 ILE 45 1HD1 ILE 45 -9.755 20.003 -13.398 373 HD13 ILE 45 2HD1 ILE 45 -8.928 19.803 -14.943 374 H ASP 46 H ASP 46 -5.429 19.460 -10.082 375 HA ASP 46 HA ASP 46 -3.763 17.126 -10.771 376 HB2 ASP 46 1HB ASP 46 -2.501 18.757 -9.430 377 HB3 ASP 46 2HB ASP 46 -3.768 18.745 -8.213 378 H GLN 47 H GLN 47 -4.011 15.322 -9.190 379 HA GLN 47 HA GLN 47 -6.620 14.411 -8.969 380 HB2 GLN 47 1HB GLN 47 -4.049 13.667 -7.626 381 HB3 GLN 47 2HB GLN 47 -5.548 12.828 -7.230 382 HG2 GLN 47 1HG GLN 47 -5.809 12.138 -9.529 383 HG3 GLN 47 2HG GLN 47 -4.382 13.063 -9.995 384 HE21 GLN 47 2HE2 GLN 47 -2.358 12.275 -9.531 385 HE22 GLN 47 1HE2 GLN 47 -2.084 10.643 -9.006 386 H LYS 48 H LYS 48 -4.588 15.984 -6.500 387 HA LYS 48 HA LYS 48 -6.491 15.769 -4.407 388 HB2 LYS 48 1HB LYS 48 -4.159 17.629 -4.827 389 HB3 LYS 48 2HB LYS 48 -5.159 17.672 -3.384 390 HG2 LYS 48 1HG LYS 48 -4.575 15.287 -2.982 391 HG3 LYS 48 2HG LYS 48 -3.457 15.383 -4.346 392 HD2 LYS 48 1HD LYS 48 -2.257 15.712 -2.264 393 HD3 LYS 48 2HD LYS 48 -2.260 17.208 -3.199 394 HE2 LYS 48 1HE LYS 48 -4.145 18.024 -1.835 395 HE3 LYS 48 2HE LYS 48 -4.067 16.547 -0.875 396 HZ1 LYS 48 3HZ LYS 48 -1.908 18.572 -1.125 397 HZ2 LYS 48 1HZ LYS 48 -1.818 17.143 -0.214 398 HZ3 LYS 48 2HZ LYS 48 -2.917 18.358 0.221 399 H MET 49 H MET 49 -5.860 18.187 -6.849 400 HA MET 49 HA MET 49 -7.578 20.210 -5.986 401 HB2 MET 49 1HB MET 49 -5.858 20.250 -7.874 402 HB3 MET 49 2HB MET 49 -7.077 19.472 -8.865 403 HG2 MET 49 1HG MET 49 -8.554 21.364 -8.584 404 HG3 MET 49 2HG MET 49 -7.384 22.129 -7.508 405 HE1 MET 49 3HE MET 49 -7.141 24.382 -10.696 406 HE2 MET 49 1HE MET 49 -7.375 24.354 -8.949 407 HE3 MET 49 2HE MET 49 -8.589 23.645 -10.014 408 H ILE 50 H ILE 50 -8.141 17.281 -7.846 409 HA ILE 50 HA ILE 50 -10.826 17.755 -8.548 410 HB ILE 50 HB ILE 50 -9.341 15.159 -8.130 411 HG12 ILE 50 1HG1 ILE 50 -8.496 16.610 -9.943 412 HG13 ILE 50 2HG1 ILE 50 -9.185 15.110 -10.556 413 HG21 ILE 50 1HG2 ILE 50 -12.058 15.617 -9.359 414 HG22 ILE 50 2HG2 ILE 50 -11.704 14.730 -7.875 415 HG23 ILE 50 3HG2 ILE 50 -11.154 14.102 -9.428 416 HD11 ILE 50 3HD1 ILE 50 -11.238 16.296 -11.135 417 HD12 ILE 50 1HD1 ILE 50 -9.829 16.988 -11.938 418 HD13 ILE 50 2HD1 ILE 50 -10.533 17.798 -10.538 419 H GLU 51 H GLU 51 -9.478 15.790 -5.885 420 HA GLU 51 HA GLU 51 -11.863 15.193 -4.590 421 HB2 GLU 51 1HB GLU 51 -9.136 15.648 -3.362 422 HB3 GLU 51 2HB GLU 51 -10.474 14.825 -2.574 423 HG2 GLU 51 1HG GLU 51 -8.994 13.910 -5.035 424 HG3 GLU 51 2HG GLU 51 -8.863 13.236 -3.414 425 H LYS 52 H LYS 52 -9.730 17.986 -4.232 426 HA LYS 52 HA LYS 52 -11.044 19.152 -2.022 427 HB2 LYS 52 1HB LYS 52 -8.754 19.738 -2.708 428 HB3 LYS 52 2HB LYS 52 -9.380 20.466 -4.179 429 HG2 LYS 52 1HG LYS 52 -8.830 22.160 -2.541 430 HG3 LYS 52 2HG LYS 52 -10.565 22.137 -2.861 431 HD2 LYS 52 1HD LYS 52 -10.921 20.842 -0.810 432 HD3 LYS 52 2HD LYS 52 -9.184 20.870 -0.492 433 HE2 LYS 52 1HE LYS 52 -10.955 23.303 -0.705 434 HE3 LYS 52 2HE LYS 52 -10.428 22.561 0.805 435 HZ1 LYS 52 3HZ LYS 52 -8.538 23.579 -1.243 436 HZ2 LYS 52 1HZ LYS 52 -8.187 23.112 0.347 437 HZ3 LYS 52 2HZ LYS 52 -9.090 24.516 0.052 438 H SER 53 H SER 53 -11.680 19.218 -5.443 439 HA SER 53 HA SER 53 -13.824 21.197 -5.009 440 HB2 SER 53 1HB SER 53 -12.504 20.526 -7.647 441 HB3 SER 53 2HB SER 53 -13.563 21.891 -7.287 442 HG SER 53 HG SER 53 -10.919 21.438 -6.364 443 H LEU 54 H LEU 54 -13.727 18.179 -4.728 444 HA LEU 54 HA LEU 54 -15.055 16.904 -6.822 445 HB2 LEU 54 1HB LEU 54 -14.036 16.139 -4.412 446 HB3 LEU 54 2HB LEU 54 -15.757 16.029 -4.092 447 HG LEU 54 HG LEU 54 -14.966 13.873 -4.758 448 HD11 LEU 54 1HD1 LEU 54 -16.452 15.139 -7.037 449 HD12 LEU 54 2HD1 LEU 54 -17.167 14.454 -5.576 450 HD13 LEU 54 3HD1 LEU 54 -16.324 13.410 -6.722 451 HD21 LEU 54 3HD2 LEU 54 -13.916 13.473 -6.934 452 HD22 LEU 54 1HD2 LEU 54 -12.939 14.521 -5.905 453 HD23 LEU 54 2HD2 LEU 54 -13.883 15.213 -7.224 454 H ASN 55 H ASN 55 -16.300 18.502 -3.935 455 HA ASN 55 HA ASN 55 -19.025 18.048 -4.379 456 HB2 ASN 55 1HB ASN 55 -19.449 19.847 -2.816 457 HB3 ASN 55 2HB ASN 55 -18.085 18.897 -2.242 458 HD21 ASN 55 2HD2 ASN 55 -19.175 21.965 -3.346 459 HD22 ASN 55 1HD2 ASN 55 -17.683 22.817 -3.102 460 H LYS 56 H LYS 56 -16.845 20.476 -5.688 461 HA LYS 56 HA LYS 56 -18.912 22.093 -6.823 462 HB2 LYS 56 1HB LYS 56 -15.947 21.947 -7.375 463 HB3 LYS 56 2HB LYS 56 -17.023 23.100 -8.152 464 HG2 LYS 56 1HG LYS 56 -16.523 22.884 -5.191 465 HG3 LYS 56 2HG LYS 56 -15.833 24.095 -6.271 466 HD2 LYS 56 1HD LYS 56 -18.788 23.707 -5.799 467 HD3 LYS 56 2HD LYS 56 -17.796 24.913 -4.978 468 HE2 LYS 56 1HE LYS 56 -17.269 25.953 -7.120 469 HE3 LYS 56 2HE LYS 56 -18.216 24.727 -7.961 470 HZ1 LYS 56 3HZ LYS 56 -19.325 26.608 -5.950 471 HZ2 LYS 56 1HZ LYS 56 -20.205 25.518 -6.910 472 HZ3 LYS 56 2HZ LYS 56 -19.416 26.841 -7.627 473 H LEU 57 H LEU 57 -16.765 19.566 -8.085 474 HA LEU 57 HA LEU 57 -17.733 19.666 -10.741 475 HB2 LEU 57 1HB LEU 57 -16.511 17.363 -9.220 476 HB3 LEU 57 2HB LEU 57 -16.771 17.392 -10.952 477 HG LEU 57 HG LEU 57 -14.893 19.165 -9.393 478 HD11 LEU 57 1HD1 LEU 57 -14.121 16.864 -9.720 479 HD12 LEU 57 2HD1 LEU 57 -13.161 18.014 -10.651 480 HD13 LEU 57 3HD1 LEU 57 -14.383 17.029 -11.456 481 HD21 LEU 57 3HD2 LEU 57 -15.951 20.377 -11.249 482 HD22 LEU 57 1HD2 LEU 57 -15.436 19.106 -12.357 483 HD23 LEU 57 2HD2 LEU 57 -14.233 20.096 -11.530 484 H TYR 58 H TYR 58 -18.722 17.871 -7.885 485 HA TYR 58 HA TYR 58 -20.722 16.324 -9.187 486 HB2 TYR 58 1HB TYR 58 -19.614 15.907 -6.901 487 HB3 TYR 58 2HB TYR 58 -20.766 17.083 -6.274 488 HD1 TYR 58 HD1 TYR 58 -20.594 13.925 -8.223 489 HD2 TYR 58 HD2 TYR 58 -22.888 16.376 -5.612 490 HE1 TYR 58 HE1 TYR 58 -22.274 12.147 -8.049 491 HE2 TYR 58 HE2 TYR 58 -24.580 14.603 -5.427 492 HH TYR 58 HH TYR 58 -25.357 12.674 -6.690 493 H GLU 59 H GLU 59 -20.711 19.378 -7.442 494 HA GLU 59 HA GLU 59 -23.420 19.995 -7.466 495 HB2 GLU 59 1HB GLU 59 -21.659 21.261 -6.277 496 HB3 GLU 59 2HB GLU 59 -21.056 21.854 -7.814 497 HG2 GLU 59 1HG GLU 59 -23.167 23.033 -8.181 498 HG3 GLU 59 2HG GLU 59 -23.757 22.440 -6.626 499 H TYR 60 H TYR 60 -20.945 20.424 -9.928 500 HA TYR 60 HA TYR 60 -22.432 21.830 -11.828 501 HB2 TYR 60 1HB TYR 60 -20.074 21.645 -12.110 502 HB3 TYR 60 2HB TYR 60 -20.141 19.887 -12.090 503 HD1 TYR 60 HD1 TYR 60 -21.246 22.835 -14.080 504 HD2 TYR 60 HD2 TYR 60 -20.243 18.702 -14.089 505 HE1 TYR 60 HE1 TYR 60 -21.373 22.816 -16.533 506 HE2 TYR 60 HE2 TYR 60 -20.367 18.668 -16.542 507 HH TYR 60 HH TYR 60 -21.380 19.909 -18.348 508 H ILE 61 H ILE 61 -21.955 18.310 -11.503 509 HA ILE 61 HA ILE 61 -23.594 17.770 -13.772 510 HB ILE 61 HB ILE 61 -23.371 15.386 -13.162 511 HG12 ILE 61 1HG1 ILE 61 -21.682 16.431 -10.877 512 HG13 ILE 61 2HG1 ILE 61 -23.264 15.676 -10.703 513 HG21 ILE 61 1HG2 ILE 61 -21.745 16.466 -14.602 514 HG22 ILE 61 2HG2 ILE 61 -20.952 15.271 -13.576 515 HG23 ILE 61 3HG2 ILE 61 -20.817 16.987 -13.196 516 HD11 ILE 61 3HD1 ILE 61 -20.789 14.352 -11.794 517 HD12 ILE 61 1HD1 ILE 61 -22.371 13.596 -11.601 518 HD13 ILE 61 2HD1 ILE 61 -21.469 14.126 -10.182 519 H GLU 62 H GLU 62 -24.241 17.952 -10.319 520 HA GLU 62 HA GLU 62 -26.779 16.626 -10.538 521 HB2 GLU 62 1HB GLU 62 -27.197 17.324 -8.266 522 HB3 GLU 62 2HB GLU 62 -25.554 16.714 -8.395 523 HG2 GLU 62 1HG GLU 62 -24.633 18.868 -8.251 524 HG3 GLU 62 2HG GLU 62 -26.194 19.639 -8.538 525 H GLN 63 H GLN 63 -25.636 19.829 -11.099 526 HA GLN 63 HA GLN 63 -28.197 21.102 -11.014 527 HB2 GLN 63 1HB GLN 63 -25.545 21.893 -12.209 528 HB3 GLN 63 2HB GLN 63 -26.980 22.889 -12.388 529 HG2 GLN 63 1HG GLN 63 -27.152 23.100 -9.970 530 HG3 GLN 63 2HG GLN 63 -25.731 22.075 -9.776 531 HE21 GLN 63 2HE2 GLN 63 -23.719 22.874 -10.297 532 HE22 GLN 63 1HE2 GLN 63 -23.415 24.566 -10.499 533 H SER 64 H SER 64 -28.336 22.449 -13.449 534 HA SER 64 HA SER 64 -29.538 20.356 -15.029 535 HB2 SER 64 1HB SER 64 -30.674 22.539 -14.582 536 HB3 SER 64 2HB SER 64 -29.450 23.328 -15.575 537 HG SER 64 HG SER 64 -30.518 22.745 -17.264 538 H LYS 65 H LYS 65 -28.705 19.448 -16.761 539 HA LYS 65 HA LYS 65 -26.177 20.216 -17.853 540 HB2 LYS 65 1HB LYS 65 -26.837 17.887 -17.915 541 HB3 LYS 65 2HB LYS 65 -28.304 18.282 -18.801 542 HG2 LYS 65 1HG LYS 65 -26.889 19.061 -20.685 543 HG3 LYS 65 2HG LYS 65 -25.475 18.481 -19.803 544 HD2 LYS 65 1HD LYS 65 -26.199 16.233 -19.935 545 HD3 LYS 65 2HD LYS 65 -27.816 16.711 -20.465 546 HE2 LYS 65 1HE LYS 65 -25.258 17.089 -22.022 547 HE3 LYS 65 2HE LYS 65 -26.474 15.848 -22.325 548 HZ1 LYS 65 3HZ LYS 65 -26.724 17.731 -23.829 549 HZ2 LYS 65 1HZ LYS 65 -26.925 18.781 -22.513 550 HZ3 LYS 65 2HZ LYS 65 -28.080 17.581 -22.822 551 H ASN 66 H ASN 66 -29.476 21.000 -18.453 552 HA ASN 66 HA ASN 66 -28.714 22.505 -20.873 553 HB2 ASN 66 1HB ASN 66 -31.371 21.152 -20.313 554 HB3 ASN 66 2HB ASN 66 -31.009 22.134 -21.725 555 HD21 ASN 66 2HD2 ASN 66 -31.889 19.406 -21.634 556 HD22 ASN 66 1HD2 ASN 66 -30.666 18.460 -22.407 557 H CYS 67 H CYS 67 -31.241 23.797 -21.115 558 HA CYS 67 HA CYS 67 -31.829 25.032 -18.583 559 HB2 CYS 67 1HB CYS 67 -31.222 27.241 -19.054 560 HB3 CYS 67 2HB CYS 67 -29.838 26.323 -19.620 561 H SER 68 H SER 68 -33.665 26.559 -18.825 562 HA SER 68 HA SER 68 -35.733 25.221 -20.167 563 HB2 SER 68 1HB SER 68 -36.147 26.544 -18.159 564 HB3 SER 68 2HB SER 68 -35.708 28.022 -19.013 565 HG SER 68 HG SER 68 -37.945 26.341 -19.472 566 H TYR 69 H TYR 69 -33.709 27.867 -21.174 567 HA TYR 69 HA TYR 69 -35.359 28.789 -23.295 568 HB2 TYR 69 1HB TYR 69 -33.213 29.777 -22.032 569 HB3 TYR 69 2HB TYR 69 -32.433 29.161 -23.480 570 HD1 TYR 69 HD2 TYR 69 -34.991 31.510 -22.235 571 HD2 TYR 69 HD1 TYR 69 -32.712 30.231 -25.593 572 HE1 TYR 69 HE2 TYR 69 -35.716 33.504 -23.476 573 HE2 TYR 69 HE1 TYR 69 -33.430 32.228 -26.843 574 HH TYR 69 HH TYR 69 -35.037 34.867 -25.339 575 H CYS 70 H CYS 70 -33.767 25.933 -22.966 576 HA CYS 70 HA CYS 70 -33.873 25.534 -25.866 577 HB2 CYS 70 1HB CYS 70 -31.857 24.130 -25.822 578 HB3 CYS 70 2HB CYS 70 -31.506 25.787 -25.348 579 H SER 71 H SER 71 -35.265 24.781 -23.125 580 HA SER 71 HA SER 71 -35.895 22.068 -23.932 581 HB2 SER 71 1HB SER 71 -34.066 21.682 -22.387 582 HB3 SER 71 2HB SER 71 -34.803 22.737 -21.187 583 HG SER 71 HG SER 71 -36.025 21.145 -20.566 584 H GLU 72 H GLU 72 -37.992 21.985 -24.023 585 HA GLU 72 HA GLU 72 -39.689 23.815 -22.562 586 HB2 GLU 72 1HB GLU 72 -40.559 21.426 -24.190 587 HB3 GLU 72 2HB GLU 72 -41.494 22.864 -23.802 588 HG2 GLU 72 1HG GLU 72 -39.045 22.832 -25.518 589 HG3 GLU 72 2HG GLU 72 -40.696 22.774 -26.129 590 H ASP 73 H ASP 73 -38.160 21.007 -21.804 591 HA ASP 73 HA ASP 73 -40.337 19.663 -20.521 592 HB2 ASP 73 1HB ASP 73 -38.358 18.498 -21.575 593 HB3 ASP 73 2HB ASP 73 -37.390 19.072 -20.221 594 H GLU 74 H GLU 74 -40.865 19.715 -18.404 595 HA GLU 74 HA GLU 74 -40.119 21.953 -16.875 596 HB2 GLU 74 1HB GLU 74 -41.583 19.435 -16.093 597 HB3 GLU 74 2HB GLU 74 -41.403 20.831 -15.041 598 HG2 GLU 74 1HG GLU 74 -42.733 20.849 -17.729 599 HG3 GLU 74 2HG GLU 74 -43.566 20.767 -16.179 600 H ASN 75 H ASN 75 -38.775 18.738 -17.015 601 HA ASN 75 HA ASN 75 -37.528 19.010 -14.419 602 HB2 ASN 75 1HB ASN 75 -38.250 16.781 -15.299 603 HB3 ASN 75 2HB ASN 75 -36.974 16.899 -16.509 604 HD21 ASN 75 2HD2 ASN 75 -37.664 16.619 -13.095 605 HD22 ASN 75 1HD2 ASN 75 -36.097 16.051 -12.624 606 H CYS 76 H CYS 76 -36.721 21.124 -15.301 607 HA CYS 76 HA CYS 76 -33.973 20.687 -16.265 608 HB2 CYS 76 1HB CYS 76 -34.024 23.120 -16.864 609 HB3 CYS 76 2HB CYS 76 -35.157 22.132 -17.778 610 HG CYS 76 HG CYS 76 -36.251 23.751 -15.000 611 H ASN 77 H ASN 77 -32.489 20.807 -14.730 612 HA ASN 77 HA ASN 77 -33.235 21.628 -12.070 613 HB2 ASN 77 1HB ASN 77 -30.533 20.726 -13.092 614 HB3 ASN 77 2HB ASN 77 -31.025 20.832 -11.407 615 HD21 ASN 77 2HD2 ASN 77 -30.033 18.569 -12.909 616 HD22 ASN 77 1HD2 ASN 77 -31.251 17.338 -12.800 617 H ASN 78 H ASN 78 -32.924 23.703 -14.264 618 HA ASN 78 HA ASN 78 -30.704 25.242 -13.119 619 HB2 ASN 78 1HB ASN 78 -30.700 26.587 -15.139 620 HB3 ASN 78 2HB ASN 78 -30.604 24.887 -15.568 621 HD21 ASN 78 2HD2 ASN 78 -32.552 27.761 -15.633 622 HD22 ASN 78 1HD2 ASN 78 -33.769 27.165 -16.703 623 H LEU 79 H LEU 79 -31.121 26.871 -11.819 624 HA LEU 79 HA LEU 79 -33.747 28.113 -11.840 625 HB2 LEU 79 1HB LEU 79 -32.946 29.456 -9.953 626 HB3 LEU 79 2HB LEU 79 -32.797 27.739 -9.653 627 HG LEU 79 HG LEU 79 -30.386 29.120 -10.702 628 HD11 LEU 79 1HD1 LEU 79 -29.795 29.944 -8.487 629 HD12 LEU 79 2HD1 LEU 79 -31.360 29.428 -7.863 630 HD13 LEU 79 3HD1 LEU 79 -31.273 30.718 -9.062 631 HD21 LEU 79 3HD2 LEU 79 -30.846 27.090 -8.514 632 HD22 LEU 79 1HD2 LEU 79 -29.285 27.586 -9.166 633 HD23 LEU 79 2HD2 LEU 79 -30.428 26.710 -10.182 634 H LEU 80 H LEU 80 -30.492 28.625 -12.892 635 HA LEU 80 HA LEU 80 -31.009 31.314 -13.839 636 HB2 LEU 80 1HB LEU 80 -28.670 29.467 -14.361 637 HB3 LEU 80 2HB LEU 80 -28.776 31.131 -14.895 638 HG LEU 80 HG LEU 80 -29.018 31.668 -12.354 639 HD11 LEU 80 1HD1 LEU 80 -29.252 29.351 -11.614 640 HD12 LEU 80 2HD1 LEU 80 -27.830 30.117 -10.905 641 HD13 LEU 80 3HD1 LEU 80 -27.648 28.986 -12.248 642 HD21 LEU 80 3HD2 LEU 80 -26.401 30.773 -13.549 643 HD22 LEU 80 1HD2 LEU 80 -26.595 31.861 -12.175 644 HD23 LEU 80 2HD2 LEU 80 -27.157 32.350 -13.774 645 H GLU 81 H GLU 81 -32.322 31.534 -15.543 646 HA GLU 81 HA GLU 81 -32.532 29.377 -17.490 647 HB2 GLU 81 1HB GLU 81 -34.550 30.545 -16.598 648 HB3 GLU 81 2HB GLU 81 -33.998 32.024 -17.372 649 HG2 GLU 81 1HG GLU 81 -34.116 30.866 -19.556 650 HG3 GLU 81 2HG GLU 81 -34.800 29.465 -18.731 651 H GLY 82 H GLY 82 -31.931 29.501 -19.585 652 HA2 GLY 82 1HA GLY 82 -31.225 30.484 -21.579 653 HA3 GLY 82 2HA GLY 82 -30.990 31.998 -20.719 654 H TYR 83 H TYR 83 -29.492 29.948 -18.753 655 HA TYR 83 HA TYR 83 -26.955 30.088 -20.239 656 HB2 TYR 83 1HB TYR 83 -27.467 30.831 -17.352 657 HB3 TYR 83 2HB TYR 83 -25.857 30.631 -18.041 658 HD1 TYR 83 HD1 TYR 83 -28.891 32.718 -18.049 659 HD2 TYR 83 HD2 TYR 83 -24.922 32.281 -19.505 660 HE1 TYR 83 HE1 TYR 83 -28.933 35.048 -18.843 661 HE2 TYR 83 HE2 TYR 83 -24.946 34.605 -20.296 662 HH TYR 83 HH TYR 83 -26.773 36.264 -21.039 663 H HIS 84 H HIS 84 -25.284 28.625 -19.477 664 HA HIS 84 HA HIS 84 -26.316 26.252 -18.060 665 HB2 HIS 84 1HB HIS 84 -24.506 26.294 -20.483 666 HB3 HIS 84 2HB HIS 84 -24.762 24.876 -19.482 667 HD1 HIS 84 HD1 HIS 84 -25.855 23.440 -21.263 668 HD2 HIS 84 HD2 HIS 84 -27.751 27.097 -20.689 669 HE1 HIS 84 HE1 HIS 84 -27.903 23.440 -22.768 670 HA PRO 85 HA PRO 85 -22.653 26.778 -15.640 671 HB2 PRO 85 1HB PRO 85 -22.519 24.365 -14.462 672 HB3 PRO 85 2HB PRO 85 -23.785 25.532 -14.065 673 HG2 PRO 85 1HG PRO 85 -23.914 23.111 -15.803 674 HG3 PRO 85 2HG PRO 85 -25.125 23.750 -14.681 675 HD2 PRO 85 1HD PRO 85 -25.165 24.112 -17.421 676 HD3 PRO 85 2HD PRO 85 -26.001 25.152 -16.254 677 H LYS 86 H LYS 86 -20.472 26.270 -15.597 678 HA LYS 86 HA LYS 86 -19.463 23.960 -17.025 679 HB2 LYS 86 1HB LYS 86 -17.954 25.220 -18.462 680 HB3 LYS 86 2HB LYS 86 -19.613 25.683 -18.803 681 HG2 LYS 86 1HG LYS 86 -19.347 27.738 -17.584 682 HG3 LYS 86 2HG LYS 86 -17.737 27.256 -17.047 683 HD2 LYS 86 1HD LYS 86 -17.003 27.215 -19.409 684 HD3 LYS 86 2HD LYS 86 -18.597 27.799 -19.889 685 HE2 LYS 86 1HE LYS 86 -16.748 29.250 -18.002 686 HE3 LYS 86 2HE LYS 86 -16.850 29.572 -19.731 687 HZ1 LYS 86 3HZ LYS 86 -18.193 31.051 -18.194 688 HZ2 LYS 86 1HZ LYS 86 -19.222 29.726 -17.977 689 HZ3 LYS 86 2HZ LYS 86 -19.010 30.389 -19.519 690 H LEU 87 H LEU 87 -17.260 23.494 -16.441 691 HA LEU 87 HA LEU 87 -16.607 24.525 -13.822 692 HB2 LEU 87 1HB LEU 87 -15.185 22.474 -15.525 693 HB3 LEU 87 2HB LEU 87 -14.721 22.908 -13.895 694 HG LEU 87 HG LEU 87 -15.866 20.947 -13.551 695 HD11 LEU 87 1HD1 LEU 87 -18.018 23.045 -13.354 696 HD12 LEU 87 2HD1 LEU 87 -16.805 22.669 -12.128 697 HD13 LEU 87 3HD1 LEU 87 -18.030 21.472 -12.553 698 HD21 LEU 87 3HD2 LEU 87 -16.585 20.581 -15.830 699 HD22 LEU 87 1HD2 LEU 87 -17.861 21.786 -15.650 700 HD23 LEU 87 2HD2 LEU 87 -17.921 20.287 -14.718 701 H VAL 88 H VAL 88 -14.872 25.744 -13.273 702 HA VAL 88 HA VAL 88 -13.041 26.583 -15.414 703 HB VAL 88 HB VAL 88 -12.998 28.872 -14.540 704 HG11 VAL 88 1HG1 VAL 88 -14.553 28.354 -16.348 705 HG12 VAL 88 2HG1 VAL 88 -15.183 29.621 -15.294 706 HG13 VAL 88 3HG1 VAL 88 -15.804 27.976 -15.161 707 HG21 VAL 88 3HG2 VAL 88 -15.228 27.993 -12.712 708 HG22 VAL 88 1HG2 VAL 88 -14.635 29.643 -12.902 709 HG23 VAL 88 2HG2 VAL 88 -13.584 28.401 -12.217 710 H VAL 89 H VAL 89 -10.940 27.219 -14.646 711 HA VAL 89 HA VAL 89 -10.324 26.053 -12.034 712 HB VAL 89 HB VAL 89 -8.968 25.122 -13.786 713 HG11 VAL 89 1HG1 VAL 89 -9.164 26.909 -15.434 714 HG12 VAL 89 2HG1 VAL 89 -7.477 26.464 -15.176 715 HG13 VAL 89 3HG1 VAL 89 -8.121 27.939 -14.453 716 HG21 VAL 89 3HG2 VAL 89 -7.879 25.479 -11.646 717 HG22 VAL 89 1HG2 VAL 89 -7.357 27.085 -12.160 718 HG23 VAL 89 2HG2 VAL 89 -6.724 25.650 -12.970 719 H ASN 90 H ASN 90 -10.261 27.400 -10.386 720 HA ASN 90 HA ASN 90 -9.183 30.105 -10.842 721 HB2 ASN 90 1HB ASN 90 -11.505 29.213 -9.161 722 HB3 ASN 90 2HB ASN 90 -10.589 30.644 -8.699 723 HD21 ASN 90 2HD2 ASN 90 -13.363 30.386 -9.579 724 HD22 ASN 90 1HD2 ASN 90 -13.520 31.415 -10.957 725 H GLY 91 H GLY 91 -7.113 29.745 -10.269 726 HA2 GLY 91 1HA GLY 91 -5.310 29.430 -8.879 727 HA3 GLY 91 2HA GLY 91 -6.424 29.580 -7.527 728 H ARG 92 H ARG 92 -6.286 27.894 -6.222 729 HA ARG 92 HA ARG 92 -5.543 25.287 -7.325 730 HB2 ARG 92 1HB ARG 92 -5.692 26.285 -4.477 731 HB3 ARG 92 2HB ARG 92 -5.241 24.646 -4.929 732 HG2 ARG 92 1HG ARG 92 -3.768 27.142 -5.752 733 HG3 ARG 92 2HG ARG 92 -3.299 26.064 -4.435 734 HD2 ARG 92 1HD ARG 92 -3.015 24.232 -6.010 735 HD3 ARG 92 2HD ARG 92 -3.555 25.263 -7.335 736 HE ARG 92 HE ARG 92 -1.394 26.541 -6.132 737 HH11 ARG 92 1HH1 ARG 92 -1.980 23.535 -7.854 738 HH12 ARG 92 2HH1 ARG 92 -0.384 23.478 -8.541 739 HH21 ARG 92 1HH2 ARG 92 0.690 26.461 -7.064 740 HH22 ARG 92 2HH2 ARG 92 1.124 25.128 -8.091 741 H SER 93 H SER 93 -8.297 26.718 -7.280 742 HA SER 93 HA SER 93 -9.793 24.405 -6.235 743 HB2 SER 93 1HB SER 93 -10.766 27.272 -6.236 744 HB3 SER 93 2HB SER 93 -11.567 25.879 -5.512 745 HG SER 93 HG SER 93 -10.271 25.984 -3.835 746 H ILE 94 H ILE 94 -11.463 23.642 -7.496 747 HA ILE 94 HA ILE 94 -11.695 24.790 -10.183 748 HB ILE 94 HB ILE 94 -12.812 22.185 -9.118 749 HG12 ILE 94 1HG1 ILE 94 -10.384 22.628 -10.866 750 HG13 ILE 94 2HG1 ILE 94 -10.304 22.341 -9.133 751 HG21 ILE 94 1HG2 ILE 94 -12.546 23.218 -11.940 752 HG22 ILE 94 2HG2 ILE 94 -14.049 23.056 -11.033 753 HG23 ILE 94 3HG2 ILE 94 -13.131 21.619 -11.482 754 HD11 ILE 94 3HD1 ILE 94 -11.386 20.154 -9.491 755 HD12 ILE 94 1HD1 ILE 94 -9.828 20.312 -10.305 756 HD13 ILE 94 2HD1 ILE 94 -11.327 20.446 -11.231 757 H ASP 95 H ASP 95 -13.582 25.731 -10.876 758 HA ASP 95 HA ASP 95 -15.678 26.058 -8.836 759 HB2 ASP 95 1HB ASP 95 -14.008 27.994 -9.020 760 HB3 ASP 95 2HB ASP 95 -14.682 28.287 -10.609 761 H ILE 96 H ILE 96 -17.554 27.379 -9.960 762 HA ILE 96 HA ILE 96 -18.031 26.198 -12.611 763 HB ILE 96 HB ILE 96 -20.055 26.545 -10.394 764 HG12 ILE 96 1HG1 ILE 96 -19.004 24.003 -11.646 765 HG13 ILE 96 2HG1 ILE 96 -18.396 24.669 -10.135 766 HG21 ILE 96 1HG2 ILE 96 -21.610 25.397 -11.908 767 HG22 ILE 96 2HG2 ILE 96 -20.378 25.405 -13.171 768 HG23 ILE 96 3HG2 ILE 96 -21.050 26.928 -12.586 769 HD11 ILE 96 3HD1 ILE 96 -20.591 24.426 -9.137 770 HD12 ILE 96 1HD1 ILE 96 -19.989 22.889 -9.755 771 HD13 ILE 96 2HD1 ILE 96 -21.214 23.782 -10.656 772 H GLU 97 H GLU 97 -18.578 27.551 -14.104 773 HA GLU 97 HA GLU 97 -19.577 30.234 -13.394 774 HB2 GLU 97 1HB GLU 97 -17.155 29.727 -14.517 775 HB3 GLU 97 2HB GLU 97 -18.148 29.841 -15.959 776 HG2 GLU 97 1HG GLU 97 -18.284 31.980 -13.894 777 HG3 GLU 97 2HG GLU 97 -16.942 31.937 -15.037 778 H TYR 98 H TYR 98 -20.696 31.190 -15.472 779 HA TYR 98 HA TYR 98 -22.297 29.041 -16.694 780 HB2 TYR 98 1HB TYR 98 -23.134 31.425 -15.179 781 HB3 TYR 98 2HB TYR 98 -24.047 31.111 -16.653 782 HD1 TYR 98 HD1 TYR 98 -22.955 29.562 -13.458 783 HD2 TYR 98 HD2 TYR 98 -25.727 29.463 -16.695 784 HE1 TYR 98 HE1 TYR 98 -24.284 27.880 -12.257 785 HE2 TYR 98 HE2 TYR 98 -27.063 27.780 -15.493 786 HH TYR 98 HH TYR 98 -26.407 26.915 -12.186 787 H TYR 99 H TYR 99 -22.586 29.128 -18.818 788 HA TYR 99 HA TYR 99 -21.819 31.618 -20.197 789 HB2 TYR 99 1HB TYR 99 -21.139 30.257 -22.135 790 HB3 TYR 99 2HB TYR 99 -20.202 29.850 -20.704 791 HD1 TYR 99 HD2 TYR 99 -20.506 27.697 -19.592 792 HD2 TYR 99 HD1 TYR 99 -22.651 28.662 -23.138 793 HE1 TYR 99 HE2 TYR 99 -21.067 25.330 -19.887 794 HE2 TYR 99 HE1 TYR 99 -23.223 26.290 -23.442 795 HH TYR 99 HH TYR 99 -22.299 24.069 -22.750 796 H GLU 100 H GLU 100 -23.056 32.147 -22.088 797 HA GLU 100 HA GLU 100 -25.820 31.692 -21.597 798 HB2 GLU 100 1HB GLU 100 -24.742 33.832 -22.470 799 HB3 GLU 100 2HB GLU 100 -24.666 33.035 -24.037 800 HG2 GLU 100 1HG GLU 100 -27.023 32.892 -24.178 801 HG3 GLU 100 2HG GLU 100 -27.221 33.365 -22.492 802 H CYS 101 H CYS 101 -27.246 30.465 -22.612 803 HA CYS 101 HA CYS 101 -26.638 28.082 -23.809 804 HB2 CYS 101 1HB CYS 101 -28.874 28.852 -22.929 805 HB3 CYS 101 2HB CYS 101 -29.108 29.697 -24.452 806 HA PRO 102 HA PRO 102 -24.960 29.260 -27.748 807 HB2 PRO 102 1HB PRO 102 -24.993 26.754 -28.863 808 HB3 PRO 102 2HB PRO 102 -23.757 27.322 -27.734 809 HG2 PRO 102 1HG PRO 102 -26.175 25.637 -27.209 810 HG3 PRO 102 2HG PRO 102 -24.526 25.463 -26.579 811 HD2 PRO 102 1HD PRO 102 -26.495 26.545 -25.105 812 HD3 PRO 102 2HD PRO 102 -24.821 27.125 -24.993 813 H VAL 103 H VAL 103 -28.098 27.992 -27.273 814 HA VAL 103 HA VAL 103 -28.930 27.716 -29.963 815 HB VAL 103 HB VAL 103 -30.147 26.824 -27.921 816 HG11 VAL 103 1HG1 VAL 103 -30.171 28.822 -26.558 817 HG12 VAL 103 2HG1 VAL 103 -31.821 28.292 -26.884 818 HG13 VAL 103 3HG1 VAL 103 -31.145 29.664 -27.764 819 HG21 VAL 103 3HG2 VAL 103 -31.765 28.379 -29.932 820 HG22 VAL 103 1HG2 VAL 103 -32.366 27.069 -28.916 821 HG23 VAL 103 2HG2 VAL 103 -31.135 26.744 -30.138 822 H LYS 104 H LYS 104 -28.261 30.418 -28.006 823 HA LYS 104 HA LYS 104 -30.005 32.259 -29.365 824 HB2 LYS 104 1HB LYS 104 -27.760 32.768 -27.405 825 HB3 LYS 104 2HB LYS 104 -28.929 33.965 -27.955 826 HG2 LYS 104 1HG LYS 104 -30.741 32.665 -26.974 827 HG3 LYS 104 2HG LYS 104 -29.585 31.448 -26.438 828 HD2 LYS 104 1HD LYS 104 -30.045 32.788 -24.551 829 HD3 LYS 104 2HD LYS 104 -28.456 33.287 -25.124 830 HE2 LYS 104 1HE LYS 104 -30.965 34.722 -25.941 831 HE3 LYS 104 2HE LYS 104 -30.112 35.116 -24.450 832 HZ1 LYS 104 3HZ LYS 104 -28.114 35.552 -25.789 833 HZ2 LYS 104 1HZ LYS 104 -29.406 36.574 -26.203 834 HZ3 LYS 104 2HZ LYS 104 -29.006 35.270 -27.204 835 H ARG 105 H ARG 105 -27.010 30.878 -30.058 836 HA ARG 105 HA ARG 105 -26.696 32.806 -32.243 837 HB2 ARG 105 1HB ARG 105 -24.977 33.279 -30.471 838 HB3 ARG 105 2HB ARG 105 -24.336 31.661 -30.738 839 HG2 ARG 105 1HG ARG 105 -24.016 32.301 -33.145 840 HG3 ARG 105 2HG ARG 105 -24.407 33.955 -32.679 841 HD2 ARG 105 1HD ARG 105 -22.112 32.282 -31.672 842 HD3 ARG 105 2HD ARG 105 -22.012 33.672 -32.748 843 HE ARG 105 HE ARG 105 -22.579 33.725 -29.872 844 HH11 ARG 105 1HH1 ARG 105 -21.952 35.440 -32.855 845 HH12 ARG 105 2HH1 ARG 105 -21.588 36.945 -32.071 846 HH21 ARG 105 1HH2 ARG 105 -22.092 35.692 -28.827 847 HH22 ARG 105 2HH2 ARG 105 -21.696 37.100 -29.768 848 H LYS 106 H LYS 106 -27.644 31.350 -33.651 849 HA LYS 106 HA LYS 106 -25.904 29.218 -34.561 850 HB2 LYS 106 1HB LYS 106 -27.745 27.544 -34.583 851 HB3 LYS 106 2HB LYS 106 -27.228 27.994 -32.965 852 HG2 LYS 106 1HG LYS 106 -29.163 29.413 -32.693 853 HG3 LYS 106 2HG LYS 106 -29.655 29.106 -34.360 854 HD2 LYS 106 1HD LYS 106 -29.402 26.989 -32.223 855 HD3 LYS 106 2HD LYS 106 -30.916 27.759 -32.696 856 HE2 LYS 106 1HE LYS 106 -30.594 26.922 -34.991 857 HE3 LYS 106 2HE LYS 106 -29.113 26.120 -34.476 858 HZ1 LYS 106 3HZ LYS 106 -30.360 24.692 -33.043 859 HZ2 LYS 106 1HZ LYS 106 -31.080 24.644 -34.577 860 HZ3 LYS 106 2HZ LYS 106 -31.796 25.546 -33.330 Start of MODEL 4 1 HA MET 1 HA MET 1 -32.019 -1.591 -10.644 2 HB2 MET 1 1HB MET 1 -31.054 1.222 -11.204 3 HB3 MET 1 2HB MET 1 -32.185 0.322 -12.198 4 HG2 MET 1 1HG MET 1 -33.473 1.807 -10.917 5 HG3 MET 1 2HG MET 1 -33.698 0.216 -10.194 6 HE1 MET 1 2HE MET 1 -34.698 1.355 -7.976 7 HE2 MET 1 3HE MET 1 -34.496 2.924 -8.753 8 HE3 MET 1 1HE MET 1 -33.887 2.664 -7.119 9 H GLU 2 H GLU 2 -28.780 -0.248 -10.606 10 HA GLU 2 HA GLU 2 -28.151 -1.839 -13.007 11 HB2 GLU 2 1HB GLU 2 -27.894 0.626 -13.290 12 HB3 GLU 2 2HB GLU 2 -26.710 0.621 -11.990 13 HG2 GLU 2 1HG GLU 2 -25.565 0.678 -14.082 14 HG3 GLU 2 2HG GLU 2 -25.298 -0.897 -13.335 15 HA PRO 3 HA PRO 3 -25.928 -3.824 -9.523 16 HB2 PRO 3 1HB PRO 3 -26.002 -6.333 -10.564 17 HB3 PRO 3 2HB PRO 3 -27.321 -5.640 -9.617 18 HG2 PRO 3 1HG PRO 3 -27.060 -5.939 -12.576 19 HG3 PRO 3 2HG PRO 3 -28.491 -6.137 -11.548 20 HD2 PRO 3 1HD PRO 3 -27.992 -3.906 -13.048 21 HD3 PRO 3 2HD PRO 3 -28.956 -3.896 -11.559 22 H ILE 4 H ILE 4 -23.975 -2.856 -9.979 23 HA ILE 4 HA ILE 4 -22.328 -4.113 -12.063 24 HB ILE 4 HB ILE 4 -21.930 -1.488 -10.613 25 HG12 ILE 4 1HG1 ILE 4 -23.729 -1.407 -12.275 26 HG13 ILE 4 2HG1 ILE 4 -22.342 -0.465 -12.810 27 HG21 ILE 4 1HG2 ILE 4 -19.780 -2.473 -11.086 28 HG22 ILE 4 2HG2 ILE 4 -20.059 -1.126 -12.189 29 HG23 ILE 4 3HG2 ILE 4 -20.252 -2.787 -12.756 30 HD11 ILE 4 3HD1 ILE 4 -23.291 -1.725 -14.645 31 HD12 ILE 4 1HD1 ILE 4 -23.074 -3.230 -13.748 32 HD13 ILE 4 2HD1 ILE 4 -21.667 -2.304 -14.271 33 H GLY 5 H GLY 5 -22.355 -3.115 -8.676 34 HA2 GLY 5 1HA GLY 5 -19.865 -4.539 -8.171 35 HA3 GLY 5 2HA GLY 5 -20.741 -3.534 -7.025 36 H ARG 6 H ARG 6 -19.647 -6.310 -6.889 37 HA ARG 6 HA ARG 6 -22.130 -7.785 -6.349 38 HB2 ARG 6 1HB ARG 6 -19.295 -8.690 -6.835 39 HB3 ARG 6 2HB ARG 6 -20.514 -9.763 -6.155 40 HG2 ARG 6 1HG ARG 6 -21.857 -9.607 -8.117 41 HG3 ARG 6 2HG ARG 6 -20.840 -8.323 -8.776 42 HD2 ARG 6 1HD ARG 6 -19.780 -11.068 -8.162 43 HD3 ARG 6 2HD ARG 6 -20.508 -10.664 -9.715 44 HE ARG 6 HE ARG 6 -18.412 -8.865 -8.906 45 HH11 ARG 6 1HH1 ARG 6 -19.086 -11.911 -10.492 46 HH12 ARG 6 2HH1 ARG 6 -17.682 -11.834 -11.520 47 HH21 ARG 6 1HH2 ARG 6 -16.543 -8.775 -10.230 48 HH22 ARG 6 2HH2 ARG 6 -16.249 -10.053 -11.373 49 H SER 7 H SER 7 -22.498 -8.732 -4.345 50 HA SER 7 HA SER 7 -21.439 -7.263 -2.140 51 HB2 SER 7 1HB SER 7 -23.259 -9.677 -2.131 52 HB3 SER 7 2HB SER 7 -22.995 -8.563 -0.789 53 HG SER 7 HG SER 7 -23.882 -7.594 -3.286 54 H LEU 8 H LEU 8 -19.196 -7.831 -2.361 55 HA LEU 8 HA LEU 8 -18.502 -10.529 -1.431 56 HB2 LEU 8 1HB LEU 8 -17.402 -9.568 -3.468 57 HB3 LEU 8 2HB LEU 8 -16.688 -8.337 -2.448 58 HG LEU 8 HG LEU 8 -15.492 -10.116 -1.192 59 HD11 LEU 8 1HD1 LEU 8 -17.018 -11.964 -1.632 60 HD12 LEU 8 2HD1 LEU 8 -15.379 -12.365 -2.145 61 HD13 LEU 8 3HD1 LEU 8 -16.594 -11.920 -3.343 62 HD21 LEU 8 3HD2 LEU 8 -15.018 -10.092 -4.170 63 HD22 LEU 8 1HD2 LEU 8 -13.853 -10.589 -2.942 64 HD23 LEU 8 2HD2 LEU 8 -14.399 -8.913 -3.014 65 H GLN 9 H GLN 9 -19.425 -7.842 -0.036 66 HA GLN 9 HA GLN 9 -17.301 -7.696 1.963 67 HB2 GLN 9 1HB GLN 9 -18.536 -5.632 2.730 68 HB3 GLN 9 2HB GLN 9 -17.809 -5.539 1.133 69 HG2 GLN 9 1HG GLN 9 -19.953 -5.866 0.089 70 HG3 GLN 9 2HG GLN 9 -20.715 -6.119 1.660 71 HE21 GLN 9 2HE2 GLN 9 -18.234 -3.735 1.133 72 HE22 GLN 9 1HE2 GLN 9 -19.251 -2.351 1.326 73 H GLY 10 H GLY 10 -17.529 -9.016 3.580 74 HA2 GLY 10 1HA GLY 10 -20.191 -9.236 4.854 75 HA3 GLY 10 2HA GLY 10 -19.119 -10.622 4.687 76 H VAL 11 H VAL 11 -18.372 -7.293 5.541 77 HA VAL 11 HA VAL 11 -16.948 -8.267 7.912 78 HB VAL 11 HB VAL 11 -16.759 -5.549 6.581 79 HG11 VAL 11 1HG1 VAL 11 -14.649 -5.345 7.805 80 HG12 VAL 11 2HG1 VAL 11 -14.951 -6.902 8.576 81 HG13 VAL 11 3HG1 VAL 11 -16.020 -5.538 8.898 82 HG21 VAL 11 3HG2 VAL 11 -14.996 -7.970 6.229 83 HG22 VAL 11 1HG2 VAL 11 -14.663 -6.362 5.590 84 HG23 VAL 11 2HG2 VAL 11 -16.063 -7.266 5.014 85 H THR 12 H THR 12 -17.264 -7.298 9.942 86 HA THR 12 HA THR 12 -19.927 -6.319 10.425 87 HB THR 12 HB THR 12 -18.834 -7.867 11.996 88 HG1 THR 12 HG1 THR 12 -20.217 -6.919 13.292 89 HG21 THR 12 3HG2 THR 12 -16.996 -5.548 12.594 90 HG22 THR 12 1HG2 THR 12 -16.542 -7.068 11.822 91 HG23 THR 12 2HG2 THR 12 -17.073 -7.057 13.503 92 H GLY 13 H GLY 13 -17.606 -4.734 9.043 93 HA2 GLY 13 1HA GLY 13 -18.092 -2.227 10.526 94 HA3 GLY 13 2HA GLY 13 -16.592 -2.564 9.668 95 H ARG 14 H ARG 14 -19.196 -0.700 9.443 96 HA ARG 14 HA ARG 14 -19.150 -0.708 6.518 97 HB2 ARG 14 1HB ARG 14 -21.734 -0.801 8.101 98 HB3 ARG 14 2HB ARG 14 -21.615 -0.513 6.375 99 HG2 ARG 14 1HG ARG 14 -22.127 -2.725 6.367 100 HG3 ARG 14 2HG ARG 14 -20.367 -2.831 6.409 101 HD2 ARG 14 1HD ARG 14 -21.220 -4.371 8.016 102 HD3 ARG 14 2HD ARG 14 -20.518 -3.015 8.899 103 HE ARG 14 HE ARG 14 -23.415 -3.071 8.385 104 HH11 ARG 14 1HH1 ARG 14 -20.733 -3.131 10.637 105 HH12 ARG 14 2HH1 ARG 14 -21.733 -2.981 12.043 106 HH21 ARG 14 1HH2 ARG 14 -24.741 -2.818 10.243 107 HH22 ARG 14 2HH2 ARG 14 -24.007 -2.757 11.820 108 HA PRO 15 HA PRO 15 -19.061 3.630 8.132 109 HB2 PRO 15 1HB PRO 15 -17.078 4.414 6.428 110 HB3 PRO 15 2HB PRO 15 -16.772 3.761 8.042 111 HG2 PRO 15 1HG PRO 15 -16.627 2.400 5.383 112 HG3 PRO 15 2HG PRO 15 -15.544 2.254 6.779 113 HD2 PRO 15 1HD PRO 15 -17.445 0.404 6.195 114 HD3 PRO 15 2HD PRO 15 -16.925 0.761 7.852 115 H ASP 16 H ASP 16 -20.790 4.596 7.285 116 HA ASP 16 HA ASP 16 -21.641 4.208 4.588 117 HB2 ASP 16 1HB ASP 16 -22.580 6.278 6.582 118 HB3 ASP 16 2HB ASP 16 -23.412 5.810 5.103 119 H PHE 17 H PHE 17 -19.838 6.648 6.278 120 HA PHE 17 HA PHE 17 -19.980 8.806 4.578 121 HB2 PHE 17 1HB PHE 17 -18.851 8.878 6.747 122 HB3 PHE 17 2HB PHE 17 -17.583 7.820 6.142 123 HD1 PHE 17 HD2 PHE 17 -19.080 11.181 5.798 124 HD2 PHE 17 HD1 PHE 17 -15.741 8.681 4.952 125 HE1 PHE 17 HE2 PHE 17 -17.794 13.147 5.076 126 HE2 PHE 17 HE1 PHE 17 -14.449 10.646 4.234 127 HZ PHE 17 HZ PHE 17 -15.476 12.884 4.290 128 H GLN 18 H GLN 18 -17.749 6.026 4.360 129 HA GLN 18 HA GLN 18 -16.328 7.117 2.164 130 HB2 GLN 18 1HB GLN 18 -15.148 5.099 2.028 131 HB3 GLN 18 2HB GLN 18 -15.468 5.334 3.737 132 HG2 GLN 18 1HG GLN 18 -17.117 3.660 3.771 133 HG3 GLN 18 2HG GLN 18 -17.227 3.615 2.014 134 HE21 GLN 18 2HE2 GLN 18 -14.356 3.611 1.590 135 HE22 GLN 18 1HE2 GLN 18 -13.793 2.055 2.062 136 H LYS 19 H LYS 19 -19.232 5.198 2.404 137 HA LYS 19 HA LYS 19 -19.075 4.202 -0.260 138 HB2 LYS 19 1HB LYS 19 -21.160 4.138 1.864 139 HB3 LYS 19 2HB LYS 19 -21.623 3.765 0.212 140 HG2 LYS 19 1HG LYS 19 -19.407 2.410 1.723 141 HG3 LYS 19 2HG LYS 19 -21.046 1.774 1.537 142 HD2 LYS 19 1HD LYS 19 -20.792 1.587 -0.823 143 HD3 LYS 19 2HD LYS 19 -19.279 2.495 -0.794 144 HE2 LYS 19 1HE LYS 19 -19.681 -0.149 0.568 145 HE3 LYS 19 2HE LYS 19 -19.023 0.025 -1.058 146 HZ1 LYS 19 3HZ LYS 19 -17.846 0.981 1.488 147 HZ2 LYS 19 1HZ LYS 19 -17.285 1.501 -0.029 148 HZ3 LYS 19 2HZ LYS 19 -17.197 -0.137 0.400 149 H ARG 20 H ARG 20 -20.746 6.966 1.218 150 HA ARG 20 HA ARG 20 -21.933 7.689 -1.294 151 HB2 ARG 20 1HB ARG 20 -22.752 9.644 -0.248 152 HB3 ARG 20 2HB ARG 20 -22.833 8.383 0.967 153 HG2 ARG 20 1HG ARG 20 -20.986 9.260 2.144 154 HG3 ARG 20 2HG ARG 20 -20.567 10.350 0.817 155 HD2 ARG 20 1HD ARG 20 -22.702 11.531 1.145 156 HD3 ARG 20 2HD ARG 20 -23.072 10.461 2.493 157 HE ARG 20 HE ARG 20 -21.199 11.449 3.688 158 HH11 ARG 20 1HH1 ARG 20 -22.362 13.139 0.856 159 HH12 ARG 20 2HH1 ARG 20 -21.768 14.691 1.366 160 HH21 ARG 20 1HH2 ARG 20 -20.407 13.480 4.368 161 HH22 ARG 20 2HH2 ARG 20 -20.660 14.887 3.377 162 H LEU 21 H LEU 21 -18.909 8.192 0.273 163 HA LEU 21 HA LEU 21 -17.962 10.320 -1.359 164 HB2 LEU 21 1HB LEU 21 -16.832 9.942 0.687 165 HB3 LEU 21 2HB LEU 21 -16.623 8.235 0.351 166 HG LEU 21 HG LEU 21 -15.026 8.799 -1.440 167 HD11 LEU 21 1HD1 LEU 21 -15.366 11.623 -0.432 168 HD12 LEU 21 2HD1 LEU 21 -15.836 11.015 -2.020 169 HD13 LEU 21 3HD1 LEU 21 -14.132 11.083 -1.571 170 HD21 LEU 21 3HD2 LEU 21 -14.377 9.947 1.273 171 HD22 LEU 21 1HD2 LEU 21 -13.197 9.497 0.041 172 HD23 LEU 21 2HD2 LEU 21 -14.215 8.261 0.782 173 H GLU 22 H GLU 22 -17.481 6.794 -1.461 174 HA GLU 22 HA GLU 22 -16.126 6.618 -3.890 175 HB2 GLU 22 1HB GLU 22 -18.096 4.682 -2.640 176 HB3 GLU 22 2HB GLU 22 -17.065 4.299 -4.010 177 HG2 GLU 22 1HG GLU 22 -15.098 4.501 -2.680 178 HG3 GLU 22 2HG GLU 22 -16.017 5.150 -1.324 179 H GLN 23 H GLN 23 -19.571 6.684 -3.159 180 HA GLN 23 HA GLN 23 -20.599 6.157 -5.690 181 HB2 GLN 23 1HB GLN 23 -21.738 6.438 -3.334 182 HB3 GLN 23 2HB GLN 23 -21.953 8.100 -3.861 183 HG2 GLN 23 1HG GLN 23 -23.936 6.900 -4.373 184 HG3 GLN 23 2HG GLN 23 -23.106 7.246 -5.890 185 HE21 GLN 23 2HE2 GLN 23 -23.958 4.783 -3.579 186 HE22 GLN 23 1HE2 GLN 23 -23.619 3.431 -4.598 187 H MET 24 H MET 24 -20.016 9.327 -4.145 188 HA MET 24 HA MET 24 -20.784 10.783 -6.451 189 HB2 MET 24 1HB MET 24 -19.891 12.753 -5.312 190 HB3 MET 24 2HB MET 24 -20.924 11.811 -4.251 191 HG2 MET 24 1HG MET 24 -18.925 10.850 -3.205 192 HG3 MET 24 2HG MET 24 -17.916 11.857 -4.239 193 HE1 MET 24 3HE MET 24 -18.810 15.462 -3.011 194 HE2 MET 24 1HE MET 24 -19.614 14.586 -4.314 195 HE3 MET 24 2HE MET 24 -17.862 14.490 -4.139 196 H LYS 25 H LYS 25 -17.627 9.787 -5.187 197 HA LYS 25 HA LYS 25 -16.046 11.242 -7.000 198 HB2 LYS 25 1HB LYS 25 -15.176 10.166 -4.947 199 HB3 LYS 25 2HB LYS 25 -15.431 8.591 -5.678 200 HG2 LYS 25 1HG LYS 25 -13.081 9.313 -5.748 201 HG3 LYS 25 2HG LYS 25 -13.758 9.038 -7.353 202 HD2 LYS 25 1HD LYS 25 -14.059 11.427 -7.664 203 HD3 LYS 25 2HD LYS 25 -13.484 11.733 -6.027 204 HE2 LYS 25 1HE LYS 25 -11.827 10.373 -8.138 205 HE3 LYS 25 2HE LYS 25 -11.805 12.114 -7.866 206 HZ1 LYS 25 3HZ LYS 25 -9.995 10.992 -6.718 207 HZ2 LYS 25 1HZ LYS 25 -11.099 10.057 -5.838 208 HZ3 LYS 25 2HZ LYS 25 -11.038 11.738 -5.616 209 H GLU 26 H GLU 26 -17.400 7.967 -7.191 210 HA GLU 26 HA GLU 26 -16.216 7.277 -9.657 211 HB2 GLU 26 1HB GLU 26 -17.283 5.686 -8.024 212 HB3 GLU 26 2HB GLU 26 -18.852 6.271 -8.562 213 HG2 GLU 26 1HG GLU 26 -18.350 4.208 -9.669 214 HG3 GLU 26 2HG GLU 26 -18.304 5.520 -10.847 215 H LYS 27 H LYS 27 -19.382 8.626 -8.842 216 HA LYS 27 HA LYS 27 -20.472 8.829 -11.384 217 HB2 LYS 27 1HB LYS 27 -20.842 10.430 -8.877 218 HB3 LYS 27 2HB LYS 27 -21.685 10.882 -10.352 219 HG2 LYS 27 1HG LYS 27 -22.679 8.625 -10.438 220 HG3 LYS 27 2HG LYS 27 -21.876 8.236 -8.916 221 HD2 LYS 27 1HD LYS 27 -24.187 8.855 -8.511 222 HD3 LYS 27 2HD LYS 27 -23.104 10.065 -7.821 223 HE2 LYS 27 1HE LYS 27 -23.476 11.513 -9.748 224 HE3 LYS 27 2HE LYS 27 -24.521 10.291 -10.475 225 HZ1 LYS 27 3HZ LYS 27 -26.094 10.564 -8.724 226 HZ2 LYS 27 1HZ LYS 27 -25.726 12.111 -9.324 227 HZ3 LYS 27 2HZ LYS 27 -25.053 11.584 -7.859 228 H VAL 28 H VAL 28 -18.406 11.169 -9.677 229 HA VAL 28 HA VAL 28 -18.534 13.187 -11.630 230 HB VAL 28 HB VAL 28 -16.291 12.605 -9.681 231 HG11 VAL 28 1HG1 VAL 28 -15.690 14.962 -9.975 232 HG12 VAL 28 2HG1 VAL 28 -16.942 15.123 -11.206 233 HG13 VAL 28 3HG1 VAL 28 -15.558 14.066 -11.488 234 HG21 VAL 28 3HG2 VAL 28 -17.330 14.262 -8.245 235 HG22 VAL 28 1HG2 VAL 28 -18.481 12.968 -8.605 236 HG23 VAL 28 2HG2 VAL 28 -18.610 14.521 -9.436 237 H MET 29 H MET 29 -16.448 10.363 -11.300 238 HA MET 29 HA MET 29 -14.744 11.175 -13.492 239 HB2 MET 29 1HB MET 29 -14.875 8.612 -11.899 240 HB3 MET 29 2HB MET 29 -13.683 8.945 -13.147 241 HG2 MET 29 1HG MET 29 -12.843 10.834 -11.852 242 HG3 MET 29 2HG MET 29 -14.054 10.523 -10.607 243 HE1 MET 29 3HE MET 29 -10.579 7.640 -11.596 244 HE2 MET 29 1HE MET 29 -10.859 9.166 -12.434 245 HE3 MET 29 2HE MET 29 -11.987 7.827 -12.643 246 H LYS 30 H LYS 30 -17.782 9.920 -13.368 247 HA LYS 30 HA LYS 30 -17.433 8.336 -15.816 248 HB2 LYS 30 1HB LYS 30 -19.332 8.245 -13.568 249 HB3 LYS 30 2HB LYS 30 -20.057 8.014 -15.151 250 HG2 LYS 30 1HG LYS 30 -19.404 5.912 -13.996 251 HG3 LYS 30 2HG LYS 30 -18.676 6.118 -15.589 252 HD2 LYS 30 1HD LYS 30 -16.602 6.865 -14.566 253 HD3 LYS 30 2HD LYS 30 -17.330 6.736 -12.964 254 HE2 LYS 30 1HE LYS 30 -17.535 4.364 -13.178 255 HE3 LYS 30 2HE LYS 30 -17.023 4.420 -14.868 256 HZ1 LYS 30 3HZ LYS 30 -15.365 5.121 -12.500 257 HZ2 LYS 30 1HZ LYS 30 -14.855 5.237 -14.116 258 HZ3 LYS 30 2HZ LYS 30 -15.213 3.721 -13.443 259 H ASP 31 H ASP 31 -18.224 11.433 -14.885 260 HA ASP 31 HA ASP 31 -20.314 11.920 -16.794 261 HB2 ASP 31 1HB ASP 31 -20.168 13.300 -14.780 262 HB3 ASP 31 2HB ASP 31 -18.572 13.864 -15.272 263 H GLN 32 H GLN 32 -20.161 12.787 -18.777 264 HA GLN 32 HA GLN 32 -17.799 12.231 -20.234 265 HB2 GLN 32 1HB GLN 32 -20.274 13.750 -21.080 266 HB3 GLN 32 2HB GLN 32 -19.042 13.115 -22.165 267 HG2 GLN 32 1HG GLN 32 -19.584 10.847 -21.489 268 HG3 GLN 32 2HG GLN 32 -20.776 11.456 -20.343 269 HE21 GLN 32 2HE2 GLN 32 -22.454 10.330 -21.327 270 HE22 GLN 32 1HE2 GLN 32 -23.110 10.800 -22.854 271 H ASP 33 H ASP 33 -19.319 15.247 -19.171 272 HA ASP 33 HA ASP 33 -17.534 16.936 -20.620 273 HB2 ASP 33 1HB ASP 33 -19.379 17.514 -18.295 274 HB3 ASP 33 2HB ASP 33 -18.461 18.746 -19.152 275 H VAL 34 H VAL 34 -17.739 15.834 -17.260 276 HA VAL 34 HA VAL 34 -15.676 17.322 -16.158 277 HB VAL 34 HB VAL 34 -16.624 14.541 -15.488 278 HG11 VAL 34 1HG1 VAL 34 -14.714 16.283 -13.933 279 HG12 VAL 34 2HG1 VAL 34 -14.333 14.737 -14.693 280 HG13 VAL 34 3HG1 VAL 34 -15.458 14.803 -13.333 281 HG21 VAL 34 3HG2 VAL 34 -18.248 16.332 -15.159 282 HG22 VAL 34 1HG2 VAL 34 -17.084 17.214 -14.172 283 HG23 VAL 34 2HG2 VAL 34 -17.722 15.667 -13.614 284 H GLN 35 H GLN 35 -15.405 14.031 -17.554 285 HA GLN 35 HA GLN 35 -12.611 13.878 -17.121 286 HB2 GLN 35 1HB GLN 35 -12.704 11.936 -18.691 287 HB3 GLN 35 2HB GLN 35 -13.799 11.850 -17.324 288 HG2 GLN 35 1HG GLN 35 -15.571 12.768 -18.911 289 HG3 GLN 35 2HG GLN 35 -14.439 12.377 -20.203 290 HE21 GLN 35 2HE2 GLN 35 -14.819 10.500 -17.261 291 HE22 GLN 35 1HE2 GLN 35 -15.475 9.098 -18.018 292 H ALA 36 H ALA 36 -14.508 14.980 -19.870 293 HA ALA 36 HA ALA 36 -12.324 15.305 -21.658 294 HB1 ALA 36 1HB ALA 36 -14.940 16.812 -21.553 295 HB2 ALA 36 2HB ALA 36 -14.648 15.307 -22.426 296 HB3 ALA 36 3HB ALA 36 -13.816 16.785 -22.911 297 H PHE 37 H PHE 37 -13.880 17.422 -19.326 298 HA PHE 37 HA PHE 37 -12.341 19.724 -19.739 299 HB2 PHE 37 1HB PHE 37 -14.386 19.770 -18.453 300 HB3 PHE 37 2HB PHE 37 -13.716 18.661 -17.266 301 HD1 PHE 37 HD1 PHE 37 -13.415 22.073 -18.650 302 HD2 PHE 37 HD2 PHE 37 -12.491 19.439 -15.444 303 HE1 PHE 37 HE1 PHE 37 -12.663 23.988 -17.303 304 HE2 PHE 37 HE2 PHE 37 -11.738 21.351 -14.085 305 HZ PHE 37 HZ PHE 37 -11.829 23.626 -15.014 306 H LEU 38 H LEU 38 -11.807 16.882 -17.726 307 HA LEU 38 HA LEU 38 -9.581 17.795 -16.303 308 HB2 LEU 38 1HB LEU 38 -10.870 15.228 -16.806 309 HB3 LEU 38 2HB LEU 38 -9.136 15.088 -16.599 310 HG LEU 38 HG LEU 38 -10.209 14.738 -14.480 311 HD11 LEU 38 1HD1 LEU 38 -8.085 15.894 -14.419 312 HD12 LEU 38 2HD1 LEU 38 -9.146 16.504 -13.148 313 HD13 LEU 38 3HD1 LEU 38 -8.901 17.446 -14.617 314 HD21 LEU 38 3HD2 LEU 38 -11.555 16.498 -13.414 315 HD22 LEU 38 1HD2 LEU 38 -12.307 15.871 -14.881 316 HD23 LEU 38 2HD2 LEU 38 -11.488 17.434 -14.909 317 H LYS 39 H LYS 39 -9.695 15.929 -19.342 318 HA LYS 39 HA LYS 39 -6.853 15.808 -19.554 319 HB2 LYS 39 1HB LYS 39 -7.249 14.999 -21.862 320 HB3 LYS 39 2HB LYS 39 -8.159 14.111 -20.651 321 HG2 LYS 39 1HG LYS 39 -10.187 15.140 -21.282 322 HG3 LYS 39 2HG LYS 39 -9.354 16.352 -22.255 323 HD2 LYS 39 1HD LYS 39 -10.395 14.613 -23.647 324 HD3 LYS 39 2HD LYS 39 -8.640 14.636 -23.824 325 HE2 LYS 39 1HE LYS 39 -8.485 12.763 -22.228 326 HE3 LYS 39 2HE LYS 39 -10.246 12.717 -22.138 327 HZ1 LYS 39 3HZ LYS 39 -9.284 11.074 -23.688 328 HZ2 LYS 39 1HZ LYS 39 -8.686 12.344 -24.639 329 HZ3 LYS 39 2HZ LYS 39 -10.359 12.145 -24.449 330 H GLU 40 H GLU 40 -9.221 18.137 -20.464 331 HA GLU 40 HA GLU 40 -7.558 19.560 -22.303 332 HB2 GLU 40 1HB GLU 40 -10.240 19.731 -21.292 333 HB3 GLU 40 2HB GLU 40 -9.474 21.308 -21.203 334 HG2 GLU 40 1HG GLU 40 -8.940 21.214 -23.565 335 HG3 GLU 40 2HG GLU 40 -9.620 19.591 -23.669 336 H ASN 41 H ASN 41 -8.186 19.717 -18.846 337 HA ASN 41 HA ASN 41 -6.384 22.042 -18.662 338 HB2 ASN 41 1HB ASN 41 -8.619 21.124 -16.856 339 HB3 ASN 41 2HB ASN 41 -7.471 22.378 -16.404 340 HD21 ASN 41 2HD2 ASN 41 -10.137 21.531 -18.460 341 HD22 ASN 41 1HD2 ASN 41 -10.512 23.145 -18.967 342 H GLU 42 H GLU 42 -5.624 19.171 -18.757 343 HA GLU 42 HA GLU 42 -4.963 18.199 -16.200 344 HB2 GLU 42 1HB GLU 42 -3.488 16.642 -17.361 345 HB3 GLU 42 2HB GLU 42 -5.029 16.774 -18.201 346 HG2 GLU 42 1HG GLU 42 -4.115 17.976 -19.960 347 HG3 GLU 42 2HG GLU 42 -2.698 18.446 -19.026 348 H GLU 43 H GLU 43 -3.515 20.598 -18.167 349 HA GLU 43 HA GLU 43 -0.883 20.436 -17.070 350 HB2 GLU 43 1HB GLU 43 -1.475 21.412 -19.311 351 HB3 GLU 43 2HB GLU 43 -2.178 22.780 -18.468 352 HG2 GLU 43 1HG GLU 43 0.033 23.326 -19.253 353 HG3 GLU 43 2HG GLU 43 0.004 23.299 -17.491 354 H VAL 44 H VAL 44 -3.845 21.757 -16.035 355 HA VAL 44 HA VAL 44 -2.494 23.554 -14.135 356 HB VAL 44 HB VAL 44 -5.413 23.562 -14.919 357 HG11 VAL 44 1HG1 VAL 44 -5.007 24.523 -12.737 358 HG12 VAL 44 2HG1 VAL 44 -5.403 25.800 -13.887 359 HG13 VAL 44 3HG1 VAL 44 -3.730 25.545 -13.395 360 HG21 VAL 44 3HG2 VAL 44 -3.174 25.326 -15.914 361 HG22 VAL 44 1HG2 VAL 44 -4.889 25.551 -16.259 362 HG23 VAL 44 2HG2 VAL 44 -4.050 24.118 -16.855 363 H ILE 45 H ILE 45 -5.039 21.128 -14.435 364 HA ILE 45 HA ILE 45 -5.614 21.181 -11.608 365 HB ILE 45 HB ILE 45 -6.643 19.292 -13.724 366 HG12 ILE 45 1HG1 ILE 45 -7.859 21.848 -12.666 367 HG13 ILE 45 2HG1 ILE 45 -7.045 21.695 -14.218 368 HG21 ILE 45 1HG2 ILE 45 -6.955 18.488 -11.432 369 HG22 ILE 45 2HG2 ILE 45 -8.492 18.925 -12.177 370 HG23 ILE 45 3HG2 ILE 45 -7.739 20.010 -11.008 371 HD11 ILE 45 3HD1 ILE 45 -8.732 20.094 -14.943 372 HD12 ILE 45 1HD1 ILE 45 -9.440 21.644 -14.478 373 HD13 ILE 45 2HD1 ILE 45 -9.549 20.258 -13.387 374 H ASP 46 H ASP 46 -5.197 19.626 -10.102 375 HA ASP 46 HA ASP 46 -3.615 17.289 -10.925 376 HB2 ASP 46 1HB ASP 46 -2.006 17.603 -9.292 377 HB3 ASP 46 2HB ASP 46 -2.348 19.276 -9.719 378 H GLN 47 H GLN 47 -3.481 15.854 -8.699 379 HA GLN 47 HA GLN 47 -6.100 14.849 -8.442 380 HB2 GLN 47 1HB GLN 47 -3.547 14.252 -6.970 381 HB3 GLN 47 2HB GLN 47 -5.054 13.417 -6.615 382 HG2 GLN 47 1HG GLN 47 -3.835 13.518 -9.353 383 HG3 GLN 47 2HG GLN 47 -3.495 12.244 -8.186 384 HE21 GLN 47 2HE2 GLN 47 -4.355 10.678 -9.539 385 HE22 GLN 47 1HE2 GLN 47 -6.064 10.514 -9.792 386 H LYS 48 H LYS 48 -4.095 16.767 -6.189 387 HA LYS 48 HA LYS 48 -5.898 16.768 -4.054 388 HB2 LYS 48 1HB LYS 48 -3.804 18.737 -4.940 389 HB3 LYS 48 2HB LYS 48 -4.803 19.033 -3.524 390 HG2 LYS 48 1HG LYS 48 -2.893 18.094 -2.651 391 HG3 LYS 48 2HG LYS 48 -4.008 16.737 -2.734 392 HD2 LYS 48 1HD LYS 48 -2.946 15.956 -4.764 393 HD3 LYS 48 2HD LYS 48 -1.872 17.359 -4.764 394 HE2 LYS 48 1HE LYS 48 -1.970 15.138 -2.724 395 HE3 LYS 48 2HE LYS 48 -0.675 15.473 -3.875 396 HZ1 LYS 48 3HZ LYS 48 -0.275 17.585 -2.744 397 HZ2 LYS 48 1HZ LYS 48 -0.115 16.282 -1.672 398 HZ3 LYS 48 2HZ LYS 48 -1.508 17.247 -1.634 399 H MET 49 H MET 49 -5.578 18.972 -6.808 400 HA MET 49 HA MET 49 -7.567 20.785 -6.138 401 HB2 MET 49 1HB MET 49 -5.920 20.874 -8.082 402 HB3 MET 49 2HB MET 49 -7.039 19.836 -8.951 403 HG2 MET 49 1HG MET 49 -8.771 21.505 -8.789 404 HG3 MET 49 2HG MET 49 -7.724 22.526 -7.806 405 HE1 MET 49 3HE MET 49 -5.431 23.590 -8.739 406 HE2 MET 49 1HE MET 49 -4.898 23.425 -10.412 407 HE3 MET 49 2HE MET 49 -4.913 22.018 -9.348 408 H ILE 50 H ILE 50 -7.811 17.647 -7.736 409 HA ILE 50 HA ILE 50 -10.530 17.705 -8.407 410 HB ILE 50 HB ILE 50 -8.829 15.331 -7.624 411 HG12 ILE 50 1HG1 ILE 50 -7.956 16.609 -9.547 412 HG13 ILE 50 2HG1 ILE 50 -8.517 15.011 -10.030 413 HG21 ILE 50 1HG2 ILE 50 -11.187 14.782 -7.458 414 HG22 ILE 50 2HG2 ILE 50 -10.471 13.978 -8.855 415 HG23 ILE 50 3HG2 ILE 50 -11.471 15.414 -9.080 416 HD11 ILE 50 3HD1 ILE 50 -10.587 15.995 -10.869 417 HD12 ILE 50 1HD1 ILE 50 -9.170 16.712 -11.638 418 HD13 ILE 50 2HD1 ILE 50 -10.025 17.592 -10.373 419 H GLU 51 H GLU 51 -8.957 16.323 -5.526 420 HA GLU 51 HA GLU 51 -11.314 15.523 -4.231 421 HB2 GLU 51 1HB GLU 51 -8.706 16.329 -2.929 422 HB3 GLU 51 2HB GLU 51 -9.948 15.292 -2.242 423 HG2 GLU 51 1HG GLU 51 -8.324 14.648 -4.691 424 HG3 GLU 51 2HG GLU 51 -7.994 14.052 -3.066 425 H LYS 52 H LYS 52 -9.512 18.554 -4.151 426 HA LYS 52 HA LYS 52 -10.964 19.703 -1.994 427 HB2 LYS 52 1HB LYS 52 -9.270 20.944 -4.157 428 HB3 LYS 52 2HB LYS 52 -9.975 21.862 -2.835 429 HG2 LYS 52 1HG LYS 52 -8.049 19.567 -2.517 430 HG3 LYS 52 2HG LYS 52 -7.619 21.277 -2.443 431 HD2 LYS 52 1HD LYS 52 -9.544 19.863 -0.591 432 HD3 LYS 52 2HD LYS 52 -7.878 20.297 -0.203 433 HE2 LYS 52 1HE LYS 52 -8.467 22.675 -0.611 434 HE3 LYS 52 2HE LYS 52 -10.143 22.181 -0.835 435 HZ1 LYS 52 3HZ LYS 52 -10.195 21.379 1.424 436 HZ2 LYS 52 1HZ LYS 52 -9.704 23.001 1.405 437 HZ3 LYS 52 2HZ LYS 52 -8.560 21.768 1.644 438 H SER 53 H SER 53 -11.602 19.425 -5.394 439 HA SER 53 HA SER 53 -13.856 21.296 -5.077 440 HB2 SER 53 1HB SER 53 -13.754 21.615 -7.534 441 HB3 SER 53 2HB SER 53 -12.265 22.106 -6.727 442 HG SER 53 HG SER 53 -11.298 20.201 -7.409 443 H LEU 54 H LEU 54 -13.481 18.247 -4.697 444 HA LEU 54 HA LEU 54 -14.961 16.789 -6.508 445 HB2 LEU 54 1HB LEU 54 -13.943 16.456 -3.889 446 HB3 LEU 54 2HB LEU 54 -15.627 15.980 -3.843 447 HG LEU 54 HG LEU 54 -13.559 14.871 -5.723 448 HD11 LEU 54 1HD1 LEU 54 -13.153 14.181 -3.424 449 HD12 LEU 54 2HD1 LEU 54 -13.755 12.826 -4.376 450 HD13 LEU 54 3HD1 LEU 54 -14.833 13.671 -3.267 451 HD21 LEU 54 3HD2 LEU 54 -15.269 13.218 -6.288 452 HD22 LEU 54 1HD2 LEU 54 -15.792 14.852 -6.691 453 HD23 LEU 54 2HD2 LEU 54 -16.420 14.055 -5.247 454 H ASN 55 H ASN 55 -16.021 18.682 -3.767 455 HA ASN 55 HA ASN 55 -18.763 18.153 -3.905 456 HB2 ASN 55 1HB ASN 55 -19.059 20.233 -2.617 457 HB3 ASN 55 2HB ASN 55 -17.764 19.241 -1.963 458 HD21 ASN 55 2HD2 ASN 55 -18.306 22.103 -1.697 459 HD22 ASN 55 1HD2 ASN 55 -16.870 22.907 -2.245 460 H LYS 56 H LYS 56 -16.815 20.652 -5.484 461 HA LYS 56 HA LYS 56 -18.985 22.004 -6.709 462 HB2 LYS 56 1HB LYS 56 -16.096 21.912 -7.603 463 HB3 LYS 56 2HB LYS 56 -17.288 23.119 -8.057 464 HG2 LYS 56 1HG LYS 56 -16.344 22.653 -5.240 465 HG3 LYS 56 2HG LYS 56 -15.675 23.870 -6.328 466 HD2 LYS 56 1HD LYS 56 -18.591 23.731 -5.590 467 HD3 LYS 56 2HD LYS 56 -17.413 24.698 -4.702 468 HE2 LYS 56 1HE LYS 56 -16.891 25.930 -6.760 469 HE3 LYS 56 2HE LYS 56 -18.090 24.973 -7.630 470 HZ1 LYS 56 3HZ LYS 56 -18.964 27.136 -6.956 471 HZ2 LYS 56 1HZ LYS 56 -18.662 26.766 -5.330 472 HZ3 LYS 56 2HZ LYS 56 -19.809 25.874 -6.201 473 H LEU 57 H LEU 57 -16.646 19.622 -7.933 474 HA LEU 57 HA LEU 57 -17.577 19.439 -10.551 475 HB2 LEU 57 1HB LEU 57 -16.373 17.258 -8.841 476 HB3 LEU 57 2HB LEU 57 -16.511 17.218 -10.588 477 HG LEU 57 HG LEU 57 -14.860 19.217 -9.036 478 HD11 LEU 57 1HD1 LEU 57 -12.934 17.976 -9.905 479 HD12 LEU 57 2HD1 LEU 57 -14.026 16.779 -10.599 480 HD13 LEU 57 3HD1 LEU 57 -13.935 16.977 -8.851 481 HD21 LEU 57 3HD2 LEU 57 -15.686 20.078 -11.177 482 HD22 LEU 57 1HD2 LEU 57 -15.023 18.665 -11.998 483 HD23 LEU 57 2HD2 LEU 57 -13.942 19.816 -11.212 484 H TYR 58 H TYR 58 -18.600 17.737 -7.633 485 HA TYR 58 HA TYR 58 -20.416 16.008 -8.936 486 HB2 TYR 58 1HB TYR 58 -19.485 15.682 -6.621 487 HB3 TYR 58 2HB TYR 58 -20.591 16.937 -6.068 488 HD1 TYR 58 HD2 TYR 58 -20.677 13.816 -8.091 489 HD2 TYR 58 HD1 TYR 58 -22.606 16.236 -5.182 490 HE1 TYR 58 HE2 TYR 58 -22.452 12.136 -7.895 491 HE2 TYR 58 HE1 TYR 58 -24.400 14.567 -4.970 492 HH TYR 58 HH TYR 58 -25.408 12.786 -6.330 493 H GLU 59 H GLU 59 -20.842 19.175 -7.369 494 HA GLU 59 HA GLU 59 -23.587 19.381 -7.594 495 HB2 GLU 59 1HB GLU 59 -21.353 21.393 -7.621 496 HB3 GLU 59 2HB GLU 59 -23.031 21.846 -7.629 497 HG2 GLU 59 1HG GLU 59 -21.714 20.204 -5.505 498 HG3 GLU 59 2HG GLU 59 -22.041 21.932 -5.396 499 H TYR 60 H TYR 60 -20.996 20.095 -9.863 500 HA TYR 60 HA TYR 60 -22.460 21.404 -11.844 501 HB2 TYR 60 1HB TYR 60 -20.081 21.454 -11.937 502 HB3 TYR 60 2HB TYR 60 -19.975 19.697 -11.976 503 HD1 TYR 60 HD1 TYR 60 -21.167 22.618 -13.953 504 HD2 TYR 60 HD2 TYR 60 -19.852 18.575 -14.021 505 HE1 TYR 60 HE1 TYR 60 -21.099 22.686 -16.407 506 HE2 TYR 60 HE2 TYR 60 -19.781 18.628 -16.475 507 HH TYR 60 HH TYR 60 -20.762 19.863 -18.315 508 H ILE 61 H ILE 61 -21.707 17.936 -11.531 509 HA ILE 61 HA ILE 61 -23.012 17.273 -13.977 510 HB ILE 61 HB ILE 61 -22.613 14.947 -13.411 511 HG12 ILE 61 1HG1 ILE 61 -21.669 15.954 -10.715 512 HG13 ILE 61 2HG1 ILE 61 -23.171 15.079 -10.994 513 HG21 ILE 61 1HG2 ILE 61 -20.765 16.233 -14.312 514 HG22 ILE 61 2HG2 ILE 61 -20.167 15.047 -13.153 515 HG23 ILE 61 3HG2 ILE 61 -20.297 16.743 -12.690 516 HD11 ILE 61 3HD1 ILE 61 -21.414 13.642 -10.097 517 HD12 ILE 61 1HD1 ILE 61 -20.403 14.007 -11.496 518 HD13 ILE 61 2HD1 ILE 61 -21.917 13.127 -11.707 519 H GLU 62 H GLU 62 -24.048 17.428 -10.644 520 HA GLU 62 HA GLU 62 -26.472 15.949 -11.037 521 HB2 GLU 62 1HB GLU 62 -25.679 17.875 -8.852 522 HB3 GLU 62 2HB GLU 62 -27.078 16.810 -8.807 523 HG2 GLU 62 1HG GLU 62 -24.295 15.767 -9.149 524 HG3 GLU 62 2HG GLU 62 -24.991 16.075 -7.559 525 H GLN 63 H GLN 63 -25.474 19.201 -11.534 526 HA GLN 63 HA GLN 63 -28.142 20.294 -11.578 527 HB2 GLN 63 1HB GLN 63 -25.457 21.422 -12.358 528 HB3 GLN 63 2HB GLN 63 -26.958 22.306 -12.589 529 HG2 GLN 63 1HG GLN 63 -27.388 22.250 -10.205 530 HG3 GLN 63 2HG GLN 63 -25.926 21.297 -9.946 531 HE21 GLN 63 2HE2 GLN 63 -23.934 22.274 -10.152 532 HE22 GLN 63 1HE2 GLN 63 -23.739 23.992 -10.138 533 H SER 64 H SER 64 -28.855 21.521 -13.561 534 HA SER 64 HA SER 64 -29.240 19.673 -15.648 535 HB2 SER 64 1HB SER 64 -29.804 22.647 -15.634 536 HB3 SER 64 2HB SER 64 -30.517 21.452 -16.718 537 HG SER 64 HG SER 64 -31.763 22.118 -14.772 538 H LYS 65 H LYS 65 -27.703 19.101 -17.012 539 HA LYS 65 HA LYS 65 -25.578 20.703 -17.940 540 HB2 LYS 65 1HB LYS 65 -25.498 18.282 -18.078 541 HB3 LYS 65 2HB LYS 65 -26.906 18.260 -19.128 542 HG2 LYS 65 1HG LYS 65 -25.638 19.343 -20.893 543 HG3 LYS 65 2HG LYS 65 -24.224 19.439 -19.836 544 HD2 LYS 65 1HD LYS 65 -24.022 17.060 -19.775 545 HD3 LYS 65 2HD LYS 65 -25.577 16.852 -20.583 546 HE2 LYS 65 1HE LYS 65 -23.754 16.465 -22.136 547 HE3 LYS 65 2HE LYS 65 -24.665 17.900 -22.596 548 HZ1 LYS 65 3HZ LYS 65 -22.938 19.271 -21.585 549 HZ2 LYS 65 1HZ LYS 65 -22.301 18.269 -22.794 550 HZ3 LYS 65 2HZ LYS 65 -22.059 17.878 -21.160 551 H ASN 66 H ASN 66 -28.887 20.401 -18.837 552 HA ASN 66 HA ASN 66 -28.546 22.080 -21.223 553 HB2 ASN 66 1HB ASN 66 -30.904 21.469 -21.709 554 HB3 ASN 66 2HB ASN 66 -29.873 20.048 -21.548 555 HD21 ASN 66 2HD2 ASN 66 -32.814 20.529 -21.159 556 HD22 ASN 66 1HD2 ASN 66 -33.148 19.884 -19.584 557 H CYS 67 H CYS 67 -31.061 23.209 -21.296 558 HA CYS 67 HA CYS 67 -31.799 24.369 -18.792 559 HB2 CYS 67 1HB CYS 67 -31.226 26.591 -19.090 560 HB3 CYS 67 2HB CYS 67 -29.813 25.792 -19.753 561 H SER 68 H SER 68 -33.741 25.770 -19.097 562 HA SER 68 HA SER 68 -35.543 24.253 -20.711 563 HB2 SER 68 1HB SER 68 -36.164 26.885 -19.368 564 HB3 SER 68 2HB SER 68 -37.277 25.566 -19.737 565 HG SER 68 HG SER 68 -35.440 25.835 -17.663 566 H TYR 69 H TYR 69 -33.833 27.236 -21.145 567 HA TYR 69 HA TYR 69 -35.396 28.337 -23.227 568 HB2 TYR 69 1HB TYR 69 -33.291 29.185 -21.763 569 HB3 TYR 69 2HB TYR 69 -32.486 28.827 -23.284 570 HD1 TYR 69 HD1 TYR 69 -34.951 30.967 -21.625 571 HD2 TYR 69 HD2 TYR 69 -32.944 30.116 -25.275 572 HE1 TYR 69 HE1 TYR 69 -35.715 33.118 -22.537 573 HE2 TYR 69 HE2 TYR 69 -33.703 32.264 -26.198 574 HH TYR 69 HH TYR 69 -35.313 33.940 -25.895 575 H CYS 70 H CYS 70 -33.601 25.531 -23.214 576 HA CYS 70 HA CYS 70 -33.678 25.469 -26.151 577 HB2 CYS 70 1HB CYS 70 -31.555 24.247 -26.247 578 HB3 CYS 70 2HB CYS 70 -31.337 25.843 -25.539 579 H SER 71 H SER 71 -34.859 24.207 -23.423 580 HA SER 71 HA SER 71 -35.145 21.541 -24.614 581 HB2 SER 71 1HB SER 71 -34.973 22.199 -21.663 582 HB3 SER 71 2HB SER 71 -35.227 20.594 -22.347 583 HG SER 71 HG SER 71 -33.177 20.568 -23.113 584 H GLU 72 H GLU 72 -37.163 20.580 -24.437 585 HA GLU 72 HA GLU 72 -39.315 22.479 -24.462 586 HB2 GLU 72 1HB GLU 72 -39.029 20.555 -26.044 587 HB3 GLU 72 2HB GLU 72 -39.434 19.475 -24.720 588 HG2 GLU 72 1HG GLU 72 -41.637 20.353 -24.579 589 HG3 GLU 72 2HG GLU 72 -41.246 21.652 -25.711 590 H ASP 73 H ASP 73 -37.879 20.557 -22.102 591 HA ASP 73 HA ASP 73 -40.220 20.109 -20.496 592 HB2 ASP 73 1HB ASP 73 -37.397 19.376 -20.380 593 HB3 ASP 73 2HB ASP 73 -38.071 19.775 -18.807 594 H GLU 74 H GLU 74 -41.035 22.229 -20.278 595 HA GLU 74 HA GLU 74 -39.658 24.336 -18.966 596 HB2 GLU 74 1HB GLU 74 -41.620 24.784 -20.307 597 HB3 GLU 74 2HB GLU 74 -42.600 23.718 -19.317 598 HG2 GLU 74 1HG GLU 74 -43.172 25.949 -18.770 599 HG3 GLU 74 2HG GLU 74 -42.266 25.283 -17.417 600 H ASN 75 H ASN 75 -40.747 21.374 -17.869 601 HA ASN 75 HA ASN 75 -41.626 22.103 -15.252 602 HB2 ASN 75 1HB ASN 75 -42.423 20.053 -16.290 603 HB3 ASN 75 2HB ASN 75 -40.780 19.434 -16.397 604 HD21 ASN 75 2HD2 ASN 75 -39.878 18.444 -14.667 605 HD22 ASN 75 1HD2 ASN 75 -40.703 18.192 -13.160 606 H CYS 76 H CYS 76 -38.559 21.779 -16.696 607 HA CYS 76 HA CYS 76 -37.096 20.872 -14.420 608 HB2 CYS 76 1HB CYS 76 -36.102 22.391 -16.841 609 HB3 CYS 76 2HB CYS 76 -35.111 21.487 -15.701 610 HG CYS 76 HG CYS 76 -36.918 20.407 -18.295 611 H ASN 77 H ASN 77 -36.755 21.994 -12.627 612 HA ASN 77 HA ASN 77 -37.068 24.881 -12.626 613 HB2 ASN 77 1HB ASN 77 -38.021 23.347 -10.835 614 HB3 ASN 77 2HB ASN 77 -36.370 23.119 -10.272 615 HD21 ASN 77 2HD2 ASN 77 -38.634 24.267 -8.885 616 HD22 ASN 77 1HD2 ASN 77 -38.175 25.882 -8.445 617 H ASN 78 H ASN 78 -35.337 25.849 -13.492 618 HA ASN 78 HA ASN 78 -32.662 24.984 -12.651 619 HB2 ASN 78 1HB ASN 78 -33.577 26.676 -14.986 620 HB3 ASN 78 2HB ASN 78 -31.884 26.437 -14.568 621 HD21 ASN 78 2HD2 ASN 78 -33.422 25.692 -16.961 622 HD22 ASN 78 1HD2 ASN 78 -33.203 23.978 -17.128 623 H LEU 79 H LEU 79 -31.471 26.188 -11.343 624 HA LEU 79 HA LEU 79 -32.518 28.474 -10.070 625 HB2 LEU 79 1HB LEU 79 -30.475 28.598 -8.837 626 HB3 LEU 79 2HB LEU 79 -30.963 26.924 -8.975 627 HG LEU 79 HG LEU 79 -28.847 28.164 -10.730 628 HD11 LEU 79 1HD1 LEU 79 -28.199 28.336 -8.384 629 HD12 LEU 79 2HD1 LEU 79 -27.216 27.142 -9.235 630 HD13 LEU 79 3HD1 LEU 79 -28.517 26.616 -8.167 631 HD21 LEU 79 3HD2 LEU 79 -29.677 26.161 -11.702 632 HD22 LEU 79 1HD2 LEU 79 -29.688 25.331 -10.144 633 HD23 LEU 79 2HD2 LEU 79 -28.157 25.745 -10.912 634 H LEU 80 H LEU 80 -30.529 28.090 -12.870 635 HA LEU 80 HA LEU 80 -30.751 30.963 -13.341 636 HB2 LEU 80 1HB LEU 80 -28.183 29.396 -13.398 637 HB3 LEU 80 2HB LEU 80 -28.399 30.776 -14.451 638 HG LEU 80 HG LEU 80 -29.000 31.996 -12.184 639 HD11 LEU 80 1HD1 LEU 80 -27.621 31.183 -10.337 640 HD12 LEU 80 2HD1 LEU 80 -27.218 29.745 -11.277 641 HD13 LEU 80 3HD1 LEU 80 -28.884 30.033 -10.774 642 HD21 LEU 80 3HD2 LEU 80 -26.184 31.332 -13.032 643 HD22 LEU 80 1HD2 LEU 80 -26.668 32.694 -12.021 644 HD23 LEU 80 2HD2 LEU 80 -27.197 32.612 -13.701 645 H GLU 81 H GLU 81 -32.091 30.913 -15.020 646 HA GLU 81 HA GLU 81 -31.849 28.784 -17.003 647 HB2 GLU 81 1HB GLU 81 -34.042 29.260 -15.960 648 HB3 GLU 81 2HB GLU 81 -33.989 30.884 -16.628 649 HG2 GLU 81 1HG GLU 81 -35.395 29.219 -17.872 650 HG3 GLU 81 2HG GLU 81 -34.203 30.099 -18.832 651 H GLY 82 H GLY 82 -31.839 29.229 -19.245 652 HA2 GLY 82 1HA GLY 82 -31.291 30.486 -21.131 653 HA3 GLY 82 2HA GLY 82 -31.024 31.887 -20.103 654 H TYR 83 H TYR 83 -29.446 29.670 -18.468 655 HA TYR 83 HA TYR 83 -26.948 29.964 -20.003 656 HB2 TYR 83 1HB TYR 83 -27.261 30.060 -16.994 657 HB3 TYR 83 2HB TYR 83 -25.753 30.221 -17.881 658 HD1 TYR 83 HD2 TYR 83 -28.900 31.882 -16.966 659 HD2 TYR 83 HD1 TYR 83 -25.144 32.308 -18.919 660 HE1 TYR 83 HE2 TYR 83 -29.191 34.321 -16.982 661 HE2 TYR 83 HE1 TYR 83 -25.424 34.751 -18.933 662 HH TYR 83 HH TYR 83 -27.780 36.327 -17.079 663 H HIS 84 H HIS 84 -25.295 28.338 -19.388 664 HA HIS 84 HA HIS 84 -26.393 25.917 -18.107 665 HB2 HIS 84 1HB HIS 84 -24.448 26.029 -20.425 666 HB3 HIS 84 2HB HIS 84 -24.785 24.579 -19.496 667 HD1 HIS 84 HD1 HIS 84 -25.638 23.351 -21.617 668 HD2 HIS 84 HD2 HIS 84 -27.812 26.741 -20.601 669 HE1 HIS 84 HE1 HIS 84 -27.636 23.422 -23.173 670 HA PRO 85 HA PRO 85 -22.848 26.429 -15.476 671 HB2 PRO 85 1HB PRO 85 -22.671 23.923 -14.467 672 HB3 PRO 85 2HB PRO 85 -23.923 25.065 -13.969 673 HG2 PRO 85 1HG PRO 85 -24.092 22.780 -15.887 674 HG3 PRO 85 2HG PRO 85 -25.273 23.324 -14.682 675 HD2 PRO 85 1HD PRO 85 -25.441 23.892 -17.358 676 HD3 PRO 85 2HD PRO 85 -26.148 24.913 -16.089 677 H LYS 86 H LYS 86 -20.664 26.141 -15.606 678 HA LYS 86 HA LYS 86 -19.625 23.959 -17.250 679 HB2 LYS 86 1HB LYS 86 -18.117 25.453 -18.469 680 HB3 LYS 86 2HB LYS 86 -19.793 25.881 -18.773 681 HG2 LYS 86 1HG LYS 86 -19.649 27.779 -17.334 682 HG3 LYS 86 2HG LYS 86 -18.060 27.283 -16.750 683 HD2 LYS 86 1HD LYS 86 -18.722 28.117 -19.576 684 HD3 LYS 86 2HD LYS 86 -17.886 29.102 -18.375 685 HE2 LYS 86 1HE LYS 86 -16.119 27.368 -18.254 686 HE3 LYS 86 2HE LYS 86 -16.932 26.497 -19.552 687 HZ1 LYS 86 3HZ LYS 86 -15.152 27.814 -20.440 688 HZ2 LYS 86 1HZ LYS 86 -15.766 29.220 -19.717 689 HZ3 LYS 86 2HZ LYS 86 -16.628 28.462 -20.965 690 H LEU 87 H LEU 87 -17.523 23.361 -16.754 691 HA LEU 87 HA LEU 87 -16.656 24.093 -14.100 692 HB2 LEU 87 1HB LEU 87 -15.467 22.186 -16.121 693 HB3 LEU 87 2HB LEU 87 -14.909 22.379 -14.469 694 HG LEU 87 HG LEU 87 -17.639 21.392 -15.279 695 HD11 LEU 87 1HD1 LEU 87 -15.283 19.894 -14.149 696 HD12 LEU 87 2HD1 LEU 87 -15.858 19.804 -15.816 697 HD13 LEU 87 3HD1 LEU 87 -16.879 19.226 -14.496 698 HD21 LEU 87 3HD2 LEU 87 -17.660 22.593 -13.158 699 HD22 LEU 87 1HD2 LEU 87 -16.330 21.593 -12.571 700 HD23 LEU 87 2HD2 LEU 87 -17.899 20.862 -12.908 701 H VAL 88 H VAL 88 -14.994 25.392 -13.595 702 HA VAL 88 HA VAL 88 -13.129 26.185 -15.729 703 HB VAL 88 HB VAL 88 -13.073 28.484 -14.910 704 HG11 VAL 88 1HG1 VAL 88 -15.237 29.253 -15.673 705 HG12 VAL 88 2HG1 VAL 88 -15.905 27.633 -15.476 706 HG13 VAL 88 3HG1 VAL 88 -14.662 27.935 -16.691 707 HG21 VAL 88 3HG2 VAL 88 -13.608 28.131 -12.583 708 HG22 VAL 88 1HG2 VAL 88 -15.240 27.612 -13.004 709 HG23 VAL 88 2HG2 VAL 88 -14.747 29.284 -13.275 710 H VAL 89 H VAL 89 -10.999 26.604 -14.992 711 HA VAL 89 HA VAL 89 -10.583 25.928 -12.164 712 HB VAL 89 HB VAL 89 -8.537 25.744 -14.395 713 HG11 VAL 89 1HG1 VAL 89 -7.128 24.658 -12.749 714 HG12 VAL 89 2HG1 VAL 89 -8.385 24.837 -11.523 715 HG13 VAL 89 3HG1 VAL 89 -7.584 26.265 -12.179 716 HG21 VAL 89 3HG2 VAL 89 -8.739 23.292 -13.919 717 HG22 VAL 89 1HG2 VAL 89 -10.111 24.038 -14.738 718 HG23 VAL 89 2HG2 VAL 89 -10.205 23.677 -13.014 719 H ASN 90 H ASN 90 -10.310 27.586 -10.940 720 HA ASN 90 HA ASN 90 -9.166 30.058 -12.055 721 HB2 ASN 90 1HB ASN 90 -11.237 29.522 -9.948 722 HB3 ASN 90 2HB ASN 90 -10.310 31.021 -9.890 723 HD21 ASN 90 2HD2 ASN 90 -13.151 30.623 -10.297 724 HD22 ASN 90 1HD2 ASN 90 -13.534 31.346 -11.819 725 H GLY 91 H GLY 91 -7.057 30.055 -11.599 726 HA2 GLY 91 1HA GLY 91 -5.131 30.132 -10.338 727 HA3 GLY 91 2HA GLY 91 -6.146 30.175 -8.901 728 H ARG 92 H ARG 92 -6.282 28.422 -7.664 729 HA ARG 92 HA ARG 92 -5.185 25.893 -8.728 730 HB2 ARG 92 1HB ARG 92 -5.129 26.983 -5.910 731 HB3 ARG 92 2HB ARG 92 -4.631 25.360 -6.348 732 HG2 ARG 92 1HG ARG 92 -3.366 27.844 -7.470 733 HG3 ARG 92 2HG ARG 92 -2.783 27.013 -6.027 734 HD2 ARG 92 1HD ARG 92 -1.458 26.025 -7.597 735 HD3 ARG 92 2HD ARG 92 -2.833 24.927 -7.641 736 HE ARG 92 HE ARG 92 -3.202 26.990 -9.530 737 HH11 ARG 92 1HH1 ARG 92 -1.336 24.080 -8.960 738 HH12 ARG 92 2HH1 ARG 92 -0.999 23.812 -10.650 739 HH21 ARG 92 1HH2 ARG 92 -2.736 26.660 -11.757 740 HH22 ARG 92 2HH2 ARG 92 -1.776 25.284 -12.234 741 H SER 93 H SER 93 -8.017 27.285 -8.186 742 HA SER 93 HA SER 93 -9.223 24.881 -6.981 743 HB2 SER 93 1HB SER 93 -11.010 26.458 -6.111 744 HB3 SER 93 2HB SER 93 -9.422 26.627 -5.361 745 HG SER 93 HG SER 93 -9.933 28.194 -7.609 746 H ILE 94 H ILE 94 -10.951 24.003 -7.977 747 HA ILE 94 HA ILE 94 -11.674 25.057 -10.591 748 HB ILE 94 HB ILE 94 -12.500 22.469 -9.248 749 HG12 ILE 94 1HG1 ILE 94 -10.392 22.962 -11.368 750 HG13 ILE 94 2HG1 ILE 94 -10.049 22.682 -9.664 751 HG21 ILE 94 1HG2 ILE 94 -12.782 23.416 -12.099 752 HG22 ILE 94 2HG2 ILE 94 -14.086 23.125 -10.947 753 HG23 ILE 94 3HG2 ILE 94 -13.118 21.775 -11.540 754 HD11 ILE 94 3HD1 ILE 94 -11.109 20.459 -9.870 755 HD12 ILE 94 1HD1 ILE 94 -9.685 20.664 -10.893 756 HD13 ILE 94 2HD1 ILE 94 -11.300 20.753 -11.598 757 H ASP 95 H ASP 95 -13.695 25.825 -11.110 758 HA ASP 95 HA ASP 95 -15.690 25.940 -8.965 759 HB2 ASP 95 1HB ASP 95 -14.169 28.094 -9.356 760 HB3 ASP 95 2HB ASP 95 -15.325 28.368 -10.650 761 H ILE 96 H ILE 96 -17.710 27.177 -10.003 762 HA ILE 96 HA ILE 96 -18.258 25.848 -12.577 763 HB ILE 96 HB ILE 96 -20.221 26.177 -10.301 764 HG12 ILE 96 1HG1 ILE 96 -18.964 23.618 -11.289 765 HG13 ILE 96 2HG1 ILE 96 -18.338 24.525 -9.917 766 HG21 ILE 96 1HG2 ILE 96 -21.636 24.684 -11.652 767 HG22 ILE 96 2HG2 ILE 96 -20.424 24.718 -12.934 768 HG23 ILE 96 3HG2 ILE 96 -21.277 26.195 -12.488 769 HD11 ILE 96 3HD1 ILE 96 -21.067 23.295 -10.143 770 HD12 ILE 96 1HD1 ILE 96 -20.487 24.258 -8.783 771 HD13 ILE 96 2HD1 ILE 96 -19.720 22.714 -9.161 772 H GLU 97 H GLU 97 -18.453 27.399 -14.021 773 HA GLU 97 HA GLU 97 -19.725 29.940 -13.272 774 HB2 GLU 97 1HB GLU 97 -17.970 29.187 -15.614 775 HB3 GLU 97 2HB GLU 97 -18.752 30.751 -15.439 776 HG2 GLU 97 1HG GLU 97 -16.927 29.672 -13.327 777 HG3 GLU 97 2HG GLU 97 -16.309 30.534 -14.734 778 H TYR 98 H TYR 98 -20.812 30.923 -15.375 779 HA TYR 98 HA TYR 98 -22.514 28.851 -16.573 780 HB2 TYR 98 1HB TYR 98 -23.291 31.338 -15.131 781 HB3 TYR 98 2HB TYR 98 -24.254 30.861 -16.526 782 HD1 TYR 98 HD1 TYR 98 -23.215 29.919 -13.127 783 HD2 TYR 98 HD2 TYR 98 -25.682 28.931 -16.455 784 HE1 TYR 98 HE1 TYR 98 -24.471 28.342 -11.720 785 HE2 TYR 98 HE2 TYR 98 -26.945 27.354 -15.048 786 HH TYR 98 HH TYR 98 -26.536 26.019 -12.953 787 H TYR 99 H TYR 99 -22.731 28.968 -18.710 788 HA TYR 99 HA TYR 99 -21.916 31.477 -20.005 789 HB2 TYR 99 1HB TYR 99 -21.305 30.162 -21.998 790 HB3 TYR 99 2HB TYR 99 -20.352 29.716 -20.591 791 HD1 TYR 99 HD2 TYR 99 -20.651 27.532 -19.536 792 HD2 TYR 99 HD1 TYR 99 -22.830 28.591 -23.031 793 HE1 TYR 99 HE2 TYR 99 -21.193 25.163 -19.906 794 HE2 TYR 99 HE1 TYR 99 -23.376 26.223 -23.425 795 HH TYR 99 HH TYR 99 -22.816 23.803 -21.039 796 H GLU 100 H GLU 100 -23.208 32.356 -21.511 797 HA GLU 100 HA GLU 100 -25.951 31.950 -21.399 798 HB2 GLU 100 1HB GLU 100 -24.178 33.316 -23.415 799 HB3 GLU 100 2HB GLU 100 -25.930 33.301 -23.579 800 HG2 GLU 100 1HG GLU 100 -24.891 34.148 -20.960 801 HG3 GLU 100 2HG GLU 100 -24.560 35.230 -22.313 802 H CYS 101 H CYS 101 -27.243 30.485 -22.248 803 HA CYS 101 HA CYS 101 -26.482 28.323 -23.807 804 HB2 CYS 101 1HB CYS 101 -28.651 28.560 -22.588 805 HB3 CYS 101 2HB CYS 101 -29.190 29.683 -23.829 806 HA PRO 102 HA PRO 102 -25.418 30.359 -27.621 807 HB2 PRO 102 1HB PRO 102 -25.247 28.060 -29.138 808 HB3 PRO 102 2HB PRO 102 -23.958 28.691 -28.110 809 HG2 PRO 102 1HG PRO 102 -25.915 26.508 -27.573 810 HG3 PRO 102 2HG PRO 102 -24.208 26.626 -27.119 811 HD2 PRO 102 1HD PRO 102 -26.207 27.060 -25.361 812 HD3 PRO 102 2HD PRO 102 -24.656 27.919 -25.271 813 H VAL 103 H VAL 103 -28.303 28.817 -26.998 814 HA VAL 103 HA VAL 103 -29.429 28.984 -29.638 815 HB VAL 103 HB VAL 103 -30.823 28.675 -26.964 816 HG11 VAL 103 1HG1 VAL 103 -31.831 28.197 -29.764 817 HG12 VAL 103 2HG1 VAL 103 -32.339 29.495 -28.682 818 HG13 VAL 103 3HG1 VAL 103 -32.701 27.814 -28.280 819 HG21 VAL 103 3HG2 VAL 103 -29.956 26.614 -28.988 820 HG22 VAL 103 1HG2 VAL 103 -30.953 26.288 -27.570 821 HG23 VAL 103 2HG2 VAL 103 -29.291 26.843 -27.371 822 H LYS 104 H LYS 104 -29.549 30.928 -26.657 823 HA LYS 104 HA LYS 104 -31.292 32.882 -27.884 824 HB2 LYS 104 1HB LYS 104 -31.074 34.096 -25.731 825 HB3 LYS 104 2HB LYS 104 -31.631 32.442 -25.544 826 HG2 LYS 104 1HG LYS 104 -29.301 31.796 -24.945 827 HG3 LYS 104 2HG LYS 104 -28.876 33.508 -24.975 828 HD2 LYS 104 1HD LYS 104 -31.012 32.283 -23.230 829 HD3 LYS 104 2HD LYS 104 -29.377 32.681 -22.698 830 HE2 LYS 104 1HE LYS 104 -31.378 34.660 -23.790 831 HE3 LYS 104 2HE LYS 104 -31.040 34.401 -22.079 832 HZ1 LYS 104 3HZ LYS 104 -28.672 34.973 -22.620 833 HZ2 LYS 104 1HZ LYS 104 -29.776 36.257 -22.742 834 HZ3 LYS 104 2HZ LYS 104 -29.217 35.493 -24.145 835 H ARG 105 H ARG 105 -27.908 32.389 -27.454 836 HA ARG 105 HA ARG 105 -27.467 34.807 -29.035 837 HB2 ARG 105 1HB ARG 105 -26.890 35.488 -26.770 838 HB3 ARG 105 2HB ARG 105 -25.846 34.086 -26.583 839 HG2 ARG 105 1HG ARG 105 -24.349 34.930 -28.289 840 HG3 ARG 105 2HG ARG 105 -25.420 36.299 -28.581 841 HD2 ARG 105 1HD ARG 105 -24.156 35.737 -25.910 842 HD3 ARG 105 2HD ARG 105 -23.401 36.754 -27.135 843 HE ARG 105 HE ARG 105 -25.298 38.263 -26.920 844 HH11 ARG 105 1HH1 ARG 105 -24.869 35.889 -24.414 845 HH12 ARG 105 2HH1 ARG 105 -25.757 36.779 -23.215 846 HH21 ARG 105 1HH2 ARG 105 -26.429 39.494 -25.339 847 HH22 ARG 105 2HH2 ARG 105 -26.617 38.843 -23.742 848 H LYS 106 H LYS 106 -26.960 33.817 -30.877 849 HA LYS 106 HA LYS 106 -24.944 31.692 -30.820 850 HB2 LYS 106 1HB LYS 106 -26.954 30.860 -31.749 851 HB3 LYS 106 2HB LYS 106 -27.217 32.319 -32.693 852 HG2 LYS 106 1HG LYS 106 -25.274 31.746 -34.067 853 HG3 LYS 106 2HG LYS 106 -25.088 30.252 -33.149 854 HD2 LYS 106 1HD LYS 106 -27.215 29.449 -33.896 855 HD3 LYS 106 2HD LYS 106 -27.599 31.006 -34.634 856 HE2 LYS 106 1HE LYS 106 -25.405 29.118 -35.483 857 HE3 LYS 106 2HE LYS 106 -26.937 29.376 -36.320 858 HZ1 LYS 106 3HZ LYS 106 -25.150 30.617 -37.356 859 HZ2 LYS 106 1HZ LYS 106 -24.823 31.426 -35.901 860 HZ3 LYS 106 2HZ LYS 106 -26.299 31.678 -36.698 Start of MODEL 5 1 HA MET 1 HA MET 1 -14.805 -11.258 14.435 2 HB2 MET 1 1HB MET 1 -14.637 -9.027 13.453 3 HB3 MET 1 2HB MET 1 -12.894 -9.206 13.303 4 HG2 MET 1 1HG MET 1 -14.001 -9.539 11.169 5 HG3 MET 1 2HG MET 1 -13.204 -11.013 11.708 6 HE1 MET 1 2HE MET 1 -14.550 -12.462 9.956 7 HE2 MET 1 3HE MET 1 -15.321 -10.989 9.373 8 HE3 MET 1 1HE MET 1 -16.303 -12.395 9.775 9 H GLU 2 H GLU 2 -14.139 -13.258 14.230 10 HA GLU 2 HA GLU 2 -11.283 -13.878 14.122 11 HB2 GLU 2 1HB GLU 2 -13.630 -15.785 14.270 12 HB3 GLU 2 2HB GLU 2 -11.939 -16.165 14.558 13 HG2 GLU 2 1HG GLU 2 -13.685 -14.403 16.263 14 HG3 GLU 2 2HG GLU 2 -13.162 -16.044 16.639 15 HA PRO 3 HA PRO 3 -11.424 -14.811 9.753 16 HB2 PRO 3 1HB PRO 3 -9.729 -17.170 10.205 17 HB3 PRO 3 2HB PRO 3 -9.368 -15.690 9.314 18 HG2 PRO 3 1HG PRO 3 -8.206 -16.253 11.679 19 HG3 PRO 3 2HG PRO 3 -8.589 -14.593 11.185 20 HD2 PRO 3 1HD PRO 3 -10.062 -16.394 13.072 21 HD3 PRO 3 2HD PRO 3 -9.720 -14.656 13.206 22 H ILE 4 H ILE 4 -13.597 -15.473 9.642 23 HA ILE 4 HA ILE 4 -14.012 -18.390 9.724 24 HB ILE 4 HB ILE 4 -16.020 -16.257 10.494 25 HG12 ILE 4 1HG1 ILE 4 -14.634 -18.343 12.197 26 HG13 ILE 4 2HG1 ILE 4 -14.269 -16.623 12.200 27 HG21 ILE 4 1HG2 ILE 4 -17.471 -18.128 11.115 28 HG22 ILE 4 2HG2 ILE 4 -16.270 -19.262 10.496 29 HG23 ILE 4 3HG2 ILE 4 -17.082 -18.149 9.395 30 HD11 ILE 4 3HD1 ILE 4 -16.479 -16.130 13.063 31 HD12 ILE 4 1HD1 ILE 4 -15.643 -17.280 14.107 32 HD13 ILE 4 2HD1 ILE 4 -16.902 -17.842 13.004 33 H GLY 5 H GLY 5 -14.322 -19.099 7.714 34 HA2 GLY 5 1HA GLY 5 -15.780 -19.340 5.853 35 HA3 GLY 5 2HA GLY 5 -16.231 -17.649 6.018 36 H ARG 6 H ARG 6 -15.042 -19.472 3.834 37 HA ARG 6 HA ARG 6 -12.855 -17.661 3.065 38 HB2 ARG 6 1HB ARG 6 -12.109 -19.944 3.134 39 HB3 ARG 6 2HB ARG 6 -13.489 -20.482 2.194 40 HG2 ARG 6 1HG ARG 6 -11.440 -20.435 0.870 41 HG3 ARG 6 2HG ARG 6 -12.653 -19.319 0.241 42 HD2 ARG 6 1HD ARG 6 -10.461 -18.287 0.211 43 HD3 ARG 6 2HD ARG 6 -11.508 -17.462 1.361 44 HE ARG 6 HE ARG 6 -10.214 -18.280 3.125 45 HH11 ARG 6 1HH1 ARG 6 -9.112 -19.532 0.049 46 HH12 ARG 6 2HH1 ARG 6 -7.556 -20.010 0.642 47 HH21 ARG 6 1HH2 ARG 6 -8.128 -18.865 3.913 48 HH22 ARG 6 2HH2 ARG 6 -6.984 -19.599 2.820 49 H SER 7 H SER 7 -13.648 -16.045 1.896 50 HA SER 7 HA SER 7 -15.227 -16.702 -0.471 51 HB2 SER 7 1HB SER 7 -16.799 -15.973 1.344 52 HB3 SER 7 2HB SER 7 -15.957 -14.423 1.390 53 HG SER 7 HG SER 7 -17.411 -15.553 -0.779 54 H LEU 8 H LEU 8 -14.766 -15.463 -2.236 55 HA LEU 8 HA LEU 8 -12.381 -13.876 -2.183 56 HB2 LEU 8 1HB LEU 8 -13.351 -15.334 -4.088 57 HB3 LEU 8 2HB LEU 8 -14.385 -13.966 -4.431 58 HG LEU 8 HG LEU 8 -12.296 -14.200 -5.851 59 HD11 LEU 8 1HD1 LEU 8 -12.636 -11.614 -4.342 60 HD12 LEU 8 2HD1 LEU 8 -13.574 -12.121 -5.745 61 HD13 LEU 8 3HD1 LEU 8 -11.845 -11.812 -5.906 62 HD21 LEU 8 3HD2 LEU 8 -10.739 -14.836 -4.109 63 HD22 LEU 8 1HD2 LEU 8 -10.982 -13.292 -3.291 64 HD23 LEU 8 2HD2 LEU 8 -10.210 -13.341 -4.877 65 H GLN 9 H GLN 9 -15.775 -13.296 -1.936 66 HA GLN 9 HA GLN 9 -15.603 -10.447 -2.410 67 HB2 GLN 9 1HB GLN 9 -17.871 -12.199 -1.437 68 HB3 GLN 9 2HB GLN 9 -18.015 -10.482 -1.782 69 HG2 GLN 9 1HG GLN 9 -17.193 -12.551 -3.803 70 HG3 GLN 9 2HG GLN 9 -18.840 -11.964 -3.590 71 HE21 GLN 9 2HE2 GLN 9 -17.990 -9.240 -3.027 72 HE22 GLN 9 1HE2 GLN 9 -17.510 -8.563 -4.542 73 H GLY 10 H GLY 10 -13.861 -11.204 -0.406 74 HA2 GLY 10 1HA GLY 10 -15.045 -10.918 2.199 75 HA3 GLY 10 2HA GLY 10 -13.330 -11.008 1.832 76 H VAL 11 H VAL 11 -16.078 -8.795 1.355 77 HA VAL 11 HA VAL 11 -14.296 -6.519 1.727 78 HB VAL 11 HB VAL 11 -17.279 -6.521 1.221 79 HG11 VAL 11 1HG1 VAL 11 -16.496 -4.464 2.242 80 HG12 VAL 11 2HG1 VAL 11 -16.928 -4.183 0.556 81 HG13 VAL 11 3HG1 VAL 11 -15.232 -4.317 1.020 82 HG21 VAL 11 3HG2 VAL 11 -16.741 -6.034 -1.107 83 HG22 VAL 11 1HG2 VAL 11 -16.052 -7.584 -0.622 84 HG23 VAL 11 2HG2 VAL 11 -15.019 -6.160 -0.748 85 H THR 12 H THR 12 -13.736 -6.580 3.864 86 HA THR 12 HA THR 12 -15.609 -7.040 5.962 87 HB THR 12 HB THR 12 -12.998 -5.649 6.429 88 HG1 THR 12 HG1 THR 12 -13.024 -8.456 6.143 89 HG21 THR 12 3HG2 THR 12 -12.948 -7.146 8.377 90 HG22 THR 12 1HG2 THR 12 -14.451 -7.892 7.846 91 HG23 THR 12 2HG2 THR 12 -14.435 -6.197 8.336 92 H GLY 13 H GLY 13 -17.255 -5.561 5.904 93 HA2 GLY 13 1HA GLY 13 -18.240 -3.655 6.786 94 HA3 GLY 13 2HA GLY 13 -16.639 -2.997 7.078 95 H ARG 14 H ARG 14 -19.231 -2.049 5.746 96 HA ARG 14 HA ARG 14 -17.841 -0.447 3.811 97 HB2 ARG 14 1HB ARG 14 -19.429 -0.873 1.944 98 HB3 ARG 14 2HB ARG 14 -18.400 -2.244 2.313 99 HG2 ARG 14 1HG ARG 14 -21.175 -2.046 3.426 100 HG3 ARG 14 2HG ARG 14 -20.879 -2.658 1.799 101 HD2 ARG 14 1HD ARG 14 -19.452 -4.403 2.689 102 HD3 ARG 14 2HD ARG 14 -19.645 -3.759 4.319 103 HE ARG 14 HE ARG 14 -22.197 -4.249 3.527 104 HH11 ARG 14 1HH1 ARG 14 -19.291 -6.217 3.546 105 HH12 ARG 14 2HH1 ARG 14 -20.142 -7.701 3.862 106 HH21 ARG 14 1HH2 ARG 14 -23.317 -6.191 3.971 107 HH22 ARG 14 2HH2 ARG 14 -22.424 -7.681 4.102 108 HA PRO 15 HA PRO 15 -21.110 1.758 6.214 109 HB2 PRO 15 1HB PRO 15 -19.572 3.966 6.647 110 HB3 PRO 15 2HB PRO 15 -19.572 2.557 7.716 111 HG2 PRO 15 1HG PRO 15 -17.634 3.304 5.559 112 HG3 PRO 15 2HG PRO 15 -17.313 2.643 7.174 113 HD2 PRO 15 1HD PRO 15 -17.270 1.114 4.943 114 HD3 PRO 15 2HD PRO 15 -17.789 0.483 6.520 115 H ASP 16 H ASP 16 -22.312 3.608 5.614 116 HA ASP 16 HA ASP 16 -22.631 4.091 2.907 117 HB2 ASP 16 1HB ASP 16 -24.395 4.640 4.429 118 HB3 ASP 16 2HB ASP 16 -23.380 5.788 5.291 119 H PHE 17 H PHE 17 -20.532 5.708 5.198 120 HA PHE 17 HA PHE 17 -19.857 7.999 3.809 121 HB2 PHE 17 1HB PHE 17 -19.074 7.539 6.085 122 HB3 PHE 17 2HB PHE 17 -18.043 6.246 5.481 123 HD1 PHE 17 HD2 PHE 17 -18.558 9.882 5.558 124 HD2 PHE 17 HD1 PHE 17 -15.936 6.710 4.469 125 HE1 PHE 17 HE2 PHE 17 -16.742 11.505 5.215 126 HE2 PHE 17 HE1 PHE 17 -14.114 8.327 4.127 127 HZ PHE 17 HZ PHE 17 -14.519 10.726 4.494 128 H GLN 18 H GLN 18 -18.188 4.831 3.622 129 HA GLN 18 HA GLN 18 -16.463 5.775 1.551 130 HB2 GLN 18 1HB GLN 18 -15.462 3.649 1.568 131 HB3 GLN 18 2HB GLN 18 -15.909 3.964 3.228 132 HG2 GLN 18 1HG GLN 18 -16.577 1.806 3.068 133 HG3 GLN 18 2HG GLN 18 -18.069 2.605 2.580 134 HE21 GLN 18 2HE2 GLN 18 -15.284 2.365 0.414 135 HE22 GLN 18 1HE2 GLN 18 -16.041 1.263 -0.680 136 H LYS 19 H LYS 19 -19.514 4.140 1.687 137 HA LYS 19 HA LYS 19 -19.554 3.197 -0.973 138 HB2 LYS 19 1HB LYS 19 -21.727 3.746 1.034 139 HB3 LYS 19 2HB LYS 19 -22.069 3.129 -0.579 140 HG2 LYS 19 1HG LYS 19 -20.280 1.799 1.437 141 HG3 LYS 19 2HG LYS 19 -21.950 1.357 1.119 142 HD2 LYS 19 1HD LYS 19 -19.608 1.177 -0.769 143 HD3 LYS 19 2HD LYS 19 -20.534 -0.154 -0.079 144 HE2 LYS 19 1HE LYS 19 -22.469 0.450 -1.369 145 HE3 LYS 19 2HE LYS 19 -21.683 1.925 -1.939 146 HZ1 LYS 19 3HZ LYS 19 -20.914 -0.877 -2.586 147 HZ2 LYS 19 1HZ LYS 19 -19.997 0.488 -3.021 148 HZ3 LYS 19 2HZ LYS 19 -21.556 0.275 -3.647 149 H ARG 20 H ARG 20 -20.895 6.144 0.509 150 HA ARG 20 HA ARG 20 -21.861 7.161 -1.965 151 HB2 ARG 20 1HB ARG 20 -22.291 9.213 -0.773 152 HB3 ARG 20 2HB ARG 20 -22.749 7.855 0.240 153 HG2 ARG 20 1HG ARG 20 -20.477 8.105 1.343 154 HG3 ARG 20 2HG ARG 20 -20.368 9.657 0.511 155 HD2 ARG 20 1HD ARG 20 -22.560 8.812 2.395 156 HD3 ARG 20 2HD ARG 20 -21.232 9.903 2.788 157 HE ARG 20 HE ARG 20 -22.177 11.426 1.071 158 HH11 ARG 20 1HH1 ARG 20 -24.207 8.983 2.565 159 HH12 ARG 20 2HH1 ARG 20 -25.690 9.860 2.287 160 HH21 ARG 20 1HH2 ARG 20 -24.125 12.580 0.706 161 HH22 ARG 20 2HH2 ARG 20 -25.642 11.885 1.197 162 H LEU 21 H LEU 21 -18.812 7.208 -0.334 163 HA LEU 21 HA LEU 21 -17.625 9.370 -1.727 164 HB2 LEU 21 1HB LEU 21 -16.610 8.695 0.298 165 HB3 LEU 21 2HB LEU 21 -16.520 7.019 -0.209 166 HG LEU 21 HG LEU 21 -14.842 7.690 -1.927 167 HD11 LEU 21 1HD1 LEU 21 -15.431 10.043 -2.136 168 HD12 LEU 21 2HD1 LEU 21 -13.737 9.863 -1.683 169 HD13 LEU 21 3HD1 LEU 21 -14.928 10.331 -0.470 170 HD21 LEU 21 3HD2 LEU 21 -13.001 7.968 -0.316 171 HD22 LEU 21 1HD2 LEU 21 -14.143 6.716 0.175 172 HD23 LEU 21 2HD2 LEU 21 -14.183 8.298 0.951 173 H GLU 22 H GLU 22 -17.420 5.830 -2.211 174 HA GLU 22 HA GLU 22 -16.022 6.067 -4.677 175 HB2 GLU 22 1HB GLU 22 -16.587 3.689 -5.016 176 HB3 GLU 22 2HB GLU 22 -15.889 3.992 -3.433 177 HG2 GLU 22 1HG GLU 22 -18.075 3.857 -2.409 178 HG3 GLU 22 2HG GLU 22 -18.830 3.661 -3.991 179 H GLN 23 H GLN 23 -19.381 6.082 -3.781 180 HA GLN 23 HA GLN 23 -20.506 5.540 -6.307 181 HB2 GLN 23 1HB GLN 23 -21.682 5.537 -4.068 182 HB3 GLN 23 2HB GLN 23 -21.715 7.287 -4.167 183 HG2 GLN 23 1HG GLN 23 -23.195 7.289 -5.957 184 HG3 GLN 23 2HG GLN 23 -22.849 5.611 -6.367 185 HE21 GLN 23 2HE2 GLN 23 -23.394 6.652 -3.086 186 HE22 GLN 23 1HE2 GLN 23 -24.920 5.864 -2.886 187 H MET 24 H MET 24 -19.994 8.666 -4.645 188 HA MET 24 HA MET 24 -20.729 10.246 -6.844 189 HB2 MET 24 1HB MET 24 -19.556 12.105 -5.750 190 HB3 MET 24 2HB MET 24 -20.595 11.228 -4.639 191 HG2 MET 24 1HG MET 24 -18.771 10.223 -3.571 192 HG3 MET 24 2HG MET 24 -17.669 10.701 -4.842 193 HE1 MET 24 3HE MET 24 -20.427 12.947 -3.526 194 HE2 MET 24 1HE MET 24 -19.684 13.803 -2.172 195 HE3 MET 24 2HE MET 24 -20.023 12.074 -2.051 196 H LYS 25 H LYS 25 -17.620 8.910 -5.876 197 HA LYS 25 HA LYS 25 -15.957 10.133 -7.733 198 HB2 LYS 25 1HB LYS 25 -15.243 8.637 -5.852 199 HB3 LYS 25 2HB LYS 25 -15.780 7.258 -6.802 200 HG2 LYS 25 1HG LYS 25 -13.412 7.456 -7.021 201 HG3 LYS 25 2HG LYS 25 -14.148 7.910 -8.559 202 HD2 LYS 25 1HD LYS 25 -12.412 9.484 -8.083 203 HD3 LYS 25 2HD LYS 25 -13.963 10.295 -7.860 204 HE2 LYS 25 1HE LYS 25 -12.360 10.847 -6.079 205 HE3 LYS 25 2HE LYS 25 -13.797 10.036 -5.461 206 HZ1 LYS 25 3HZ LYS 25 -11.607 9.263 -4.540 207 HZ2 LYS 25 1HZ LYS 25 -11.274 8.590 -6.061 208 HZ3 LYS 25 2HZ LYS 25 -12.607 8.041 -5.157 209 H GLU 26 H GLU 26 -17.772 7.091 -8.027 210 HA GLU 26 HA GLU 26 -17.061 6.454 -10.654 211 HB2 GLU 26 1HB GLU 26 -18.259 4.990 -8.979 212 HB3 GLU 26 2HB GLU 26 -19.725 5.886 -9.350 213 HG2 GLU 26 1HG GLU 26 -19.739 3.850 -10.590 214 HG3 GLU 26 2HG GLU 26 -19.490 5.184 -11.716 215 H LYS 27 H LYS 27 -19.897 8.177 -9.425 216 HA LYS 27 HA LYS 27 -21.218 8.779 -11.764 217 HB2 LYS 27 1HB LYS 27 -20.903 10.419 -9.251 218 HB3 LYS 27 2HB LYS 27 -22.055 10.795 -10.523 219 HG2 LYS 27 1HG LYS 27 -22.037 8.123 -9.164 220 HG3 LYS 27 2HG LYS 27 -22.887 9.506 -8.482 221 HD2 LYS 27 1HD LYS 27 -23.342 8.446 -11.268 222 HD3 LYS 27 2HD LYS 27 -24.320 7.998 -9.867 223 HE2 LYS 27 1HE LYS 27 -24.834 10.414 -9.539 224 HE3 LYS 27 2HE LYS 27 -23.985 10.754 -11.046 225 HZ1 LYS 27 3HZ LYS 27 -25.570 9.336 -12.211 226 HZ2 LYS 27 1HZ LYS 27 -26.361 10.604 -11.403 227 HZ3 LYS 27 2HZ LYS 27 -26.392 9.036 -10.759 228 H VAL 28 H VAL 28 -18.725 10.736 -10.152 229 HA VAL 28 HA VAL 28 -18.737 12.848 -12.010 230 HB VAL 28 HB VAL 28 -16.573 11.956 -10.088 231 HG11 VAL 28 1HG1 VAL 28 -15.612 14.177 -10.346 232 HG12 VAL 28 2HG1 VAL 28 -16.813 14.562 -11.579 233 HG13 VAL 28 3HG1 VAL 28 -15.609 13.309 -11.881 234 HG21 VAL 28 3HG2 VAL 28 -18.667 12.607 -9.014 235 HG22 VAL 28 1HG2 VAL 28 -18.649 14.138 -9.891 236 HG23 VAL 28 2HG2 VAL 28 -17.397 13.792 -8.696 237 H MET 29 H MET 29 -16.970 9.810 -11.936 238 HA MET 29 HA MET 29 -15.138 10.483 -14.033 239 HB2 MET 29 1HB MET 29 -15.972 7.803 -12.908 240 HB3 MET 29 2HB MET 29 -14.672 8.029 -14.068 241 HG2 MET 29 1HG MET 29 -14.752 9.242 -11.317 242 HG3 MET 29 2HG MET 29 -13.896 7.762 -11.746 243 HE1 MET 29 3HE MET 29 -11.615 8.707 -10.790 244 HE2 MET 29 1HE MET 29 -12.493 10.147 -10.281 245 HE3 MET 29 2HE MET 29 -10.983 10.307 -11.183 246 H LYS 30 H LYS 30 -18.420 9.856 -14.071 247 HA LYS 30 HA LYS 30 -18.344 8.531 -16.692 248 HB2 LYS 30 1HB LYS 30 -20.195 8.502 -14.417 249 HB3 LYS 30 2HB LYS 30 -20.992 8.628 -15.976 250 HG2 LYS 30 1HG LYS 30 -20.787 6.315 -15.199 251 HG3 LYS 30 2HG LYS 30 -19.941 6.590 -16.721 252 HD2 LYS 30 1HD LYS 30 -17.823 6.688 -15.579 253 HD3 LYS 30 2HD LYS 30 -18.626 6.569 -14.010 254 HE2 LYS 30 1HE LYS 30 -19.346 4.354 -14.453 255 HE3 LYS 30 2HE LYS 30 -18.855 4.460 -16.143 256 HZ1 LYS 30 3HZ LYS 30 -17.090 4.384 -13.757 257 HZ2 LYS 30 1HZ LYS 30 -16.540 4.723 -15.331 258 HZ3 LYS 30 2HZ LYS 30 -17.230 3.215 -14.983 259 H ASP 31 H ASP 31 -18.645 11.615 -15.440 260 HA ASP 31 HA ASP 31 -20.728 12.465 -17.264 261 HB2 ASP 31 1HB ASP 31 -20.578 13.460 -15.008 262 HB3 ASP 31 2HB ASP 31 -19.016 14.155 -15.441 263 H GLN 32 H GLN 32 -20.480 13.401 -19.154 264 HA GLN 32 HA GLN 32 -18.038 13.257 -20.542 265 HB2 GLN 32 1HB GLN 32 -20.492 14.869 -21.252 266 HB3 GLN 32 2HB GLN 32 -19.214 14.389 -22.357 267 HG2 GLN 32 1HG GLN 32 -19.819 12.064 -22.096 268 HG3 GLN 32 2HG GLN 32 -21.039 12.493 -20.898 269 HE21 GLN 32 2HE2 GLN 32 -22.728 11.632 -22.077 270 HE22 GLN 32 1HE2 GLN 32 -23.315 12.367 -23.534 271 H ASP 33 H ASP 33 -19.725 15.961 -19.007 272 HA ASP 33 HA ASP 33 -18.060 17.988 -20.112 273 HB2 ASP 33 1HB ASP 33 -19.817 18.062 -17.650 274 HB3 ASP 33 2HB ASP 33 -19.106 19.466 -18.436 275 H VAL 34 H VAL 34 -18.191 16.351 -16.978 276 HA VAL 34 HA VAL 34 -16.099 17.671 -15.705 277 HB VAL 34 HB VAL 34 -17.104 14.842 -15.420 278 HG11 VAL 34 1HG1 VAL 34 -14.760 14.887 -14.720 279 HG12 VAL 34 2HG1 VAL 34 -15.840 14.683 -13.341 280 HG13 VAL 34 3HG1 VAL 34 -15.101 16.254 -13.659 281 HG21 VAL 34 3HG2 VAL 34 -18.654 16.581 -14.749 282 HG22 VAL 34 1HG2 VAL 34 -17.418 17.323 -13.734 283 HG23 VAL 34 2HG2 VAL 34 -18.050 15.727 -13.328 284 H GLN 35 H GLN 35 -15.925 14.614 -17.547 285 HA GLN 35 HA GLN 35 -13.134 14.349 -17.212 286 HB2 GLN 35 1HB GLN 35 -13.277 12.589 -18.908 287 HB3 GLN 35 2HB GLN 35 -14.528 12.431 -17.689 288 HG2 GLN 35 1HG GLN 35 -16.042 13.645 -19.343 289 HG3 GLN 35 2HG GLN 35 -14.789 13.310 -20.535 290 HE21 GLN 35 2HE2 GLN 35 -15.754 11.194 -17.870 291 HE22 GLN 35 1HE2 GLN 35 -16.360 9.929 -18.871 292 H ALA 36 H ALA 36 -15.072 15.919 -19.668 293 HA ALA 36 HA ALA 36 -12.978 16.470 -21.490 294 HB1 ALA 36 1HB ALA 36 -15.514 18.018 -20.965 295 HB2 ALA 36 2HB ALA 36 -15.315 16.700 -22.122 296 HB3 ALA 36 3HB ALA 36 -14.461 18.226 -22.363 297 H PHE 37 H PHE 37 -14.273 18.256 -18.721 298 HA PHE 37 HA PHE 37 -12.566 20.493 -18.946 299 HB2 PHE 37 1HB PHE 37 -14.525 20.673 -17.582 300 HB3 PHE 37 2HB PHE 37 -14.033 19.307 -16.586 301 HD1 PHE 37 HD2 PHE 37 -12.884 22.709 -17.590 302 HD2 PHE 37 HD1 PHE 37 -12.983 19.702 -14.578 303 HE1 PHE 37 HE2 PHE 37 -11.805 24.260 -16.010 304 HE2 PHE 37 HE1 PHE 37 -11.913 21.250 -12.994 305 HZ PHE 37 HZ PHE 37 -11.323 23.531 -13.710 306 H LEU 38 H LEU 38 -12.246 17.394 -17.324 307 HA LEU 38 HA LEU 38 -9.960 17.908 -15.821 308 HB2 LEU 38 1HB LEU 38 -11.377 15.537 -16.754 309 HB3 LEU 38 2HB LEU 38 -9.648 15.280 -16.608 310 HG LEU 38 HG LEU 38 -10.676 14.618 -14.554 311 HD11 LEU 38 1HD1 LEU 38 -9.542 16.089 -12.968 312 HD12 LEU 38 2HD1 LEU 38 -9.345 17.305 -14.234 313 HD13 LEU 38 3HD1 LEU 38 -8.530 15.745 -14.371 314 HD21 LEU 38 3HD2 LEU 38 -12.762 15.859 -14.745 315 HD22 LEU 38 1HD2 LEU 38 -11.902 17.373 -14.466 316 HD23 LEU 38 2HD2 LEU 38 -11.995 16.163 -13.186 317 H LYS 39 H LYS 39 -10.236 16.774 -19.173 318 HA LYS 39 HA LYS 39 -7.367 16.726 -19.488 319 HB2 LYS 39 1HB LYS 39 -7.857 16.219 -21.866 320 HB3 LYS 39 2HB LYS 39 -8.664 15.124 -20.752 321 HG2 LYS 39 1HG LYS 39 -10.743 16.379 -21.033 322 HG3 LYS 39 2HG LYS 39 -9.929 17.464 -22.157 323 HD2 LYS 39 1HD LYS 39 -10.035 14.500 -22.622 324 HD3 LYS 39 2HD LYS 39 -11.344 15.563 -23.132 325 HE2 LYS 39 1HE LYS 39 -9.960 15.303 -25.019 326 HE3 LYS 39 2HE LYS 39 -9.597 16.902 -24.378 327 HZ1 LYS 39 3HZ LYS 39 -7.578 16.115 -23.457 328 HZ2 LYS 39 1HZ LYS 39 -7.633 15.560 -25.057 329 HZ3 LYS 39 2HZ LYS 39 -7.968 14.495 -23.778 330 H GLU 40 H GLU 40 -9.911 19.000 -19.924 331 HA GLU 40 HA GLU 40 -8.739 20.743 -21.786 332 HB2 GLU 40 1HB GLU 40 -11.130 20.758 -20.942 333 HB3 GLU 40 2HB GLU 40 -10.534 21.522 -19.483 334 HG2 GLU 40 1HG GLU 40 -9.710 23.411 -20.829 335 HG3 GLU 40 2HG GLU 40 -10.383 22.652 -22.270 336 H ASN 41 H ASN 41 -8.702 20.732 -18.256 337 HA ASN 41 HA ASN 41 -6.463 22.660 -18.348 338 HB2 ASN 41 1HB ASN 41 -8.695 22.321 -16.358 339 HB3 ASN 41 2HB ASN 41 -7.214 23.181 -15.945 340 HD21 ASN 41 2HD2 ASN 41 -10.113 23.212 -17.844 341 HD22 ASN 41 1HD2 ASN 41 -10.019 24.864 -18.330 342 H GLU 42 H GLU 42 -6.194 19.794 -18.548 343 HA GLU 42 HA GLU 42 -5.696 18.559 -16.073 344 HB2 GLU 42 1HB GLU 42 -4.502 16.840 -17.325 345 HB3 GLU 42 2HB GLU 42 -5.999 17.279 -18.133 346 HG2 GLU 42 1HG GLU 42 -4.752 18.643 -19.719 347 HG3 GLU 42 2HG GLU 42 -3.246 18.227 -18.896 348 H GLU 43 H GLU 43 -3.767 20.766 -17.879 349 HA GLU 43 HA GLU 43 -1.300 20.063 -16.547 350 HB2 GLU 43 1HB GLU 43 -1.408 20.885 -18.908 351 HB3 GLU 43 2HB GLU 43 -1.913 22.450 -18.293 352 HG2 GLU 43 1HG GLU 43 0.194 22.694 -17.114 353 HG3 GLU 43 2HG GLU 43 0.700 21.098 -17.669 354 H VAL 44 H VAL 44 -3.947 22.196 -16.065 355 HA VAL 44 HA VAL 44 -2.412 23.982 -14.319 356 HB VAL 44 HB VAL 44 -5.298 24.232 -15.180 357 HG11 VAL 44 1HG1 VAL 44 -5.038 26.576 -14.490 358 HG12 VAL 44 2HG1 VAL 44 -3.396 26.226 -13.949 359 HG13 VAL 44 3HG1 VAL 44 -4.768 25.466 -13.148 360 HG21 VAL 44 3HG2 VAL 44 -2.848 25.552 -16.342 361 HG22 VAL 44 1HG2 VAL 44 -4.516 25.845 -16.831 362 HG23 VAL 44 2HG2 VAL 44 -3.779 24.263 -17.107 363 H ILE 45 H ILE 45 -5.157 21.777 -14.273 364 HA ILE 45 HA ILE 45 -5.897 22.260 -11.560 365 HB ILE 45 HB ILE 45 -6.481 19.841 -13.272 366 HG12 ILE 45 1HG1 ILE 45 -8.192 22.288 -12.820 367 HG13 ILE 45 2HG1 ILE 45 -7.239 21.994 -14.272 368 HG21 ILE 45 1HG2 ILE 45 -6.858 19.400 -10.929 369 HG22 ILE 45 2HG2 ILE 45 -8.400 19.529 -11.771 370 HG23 ILE 45 3HG2 ILE 45 -7.823 20.868 -10.780 371 HD11 ILE 45 3HD1 ILE 45 -9.577 21.418 -14.600 372 HD12 ILE 45 1HD1 ILE 45 -9.486 20.263 -13.271 373 HD13 ILE 45 2HD1 ILE 45 -8.542 19.996 -14.737 374 H ASP 46 H ASP 46 -5.345 21.209 -9.735 375 HA ASP 46 HA ASP 46 -3.034 19.436 -9.842 376 HB2 ASP 46 1HB ASP 46 -4.489 20.584 -7.444 377 HB3 ASP 46 2HB ASP 46 -2.994 19.661 -7.393 378 H GLN 47 H GLN 47 -3.065 17.331 -8.972 379 HA GLN 47 HA GLN 47 -5.457 15.864 -9.092 380 HB2 GLN 47 1HB GLN 47 -2.882 15.253 -7.625 381 HB3 GLN 47 2HB GLN 47 -4.176 14.091 -7.896 382 HG2 GLN 47 1HG GLN 47 -3.869 14.256 -10.285 383 HG3 GLN 47 2HG GLN 47 -2.643 15.501 -10.067 384 HE21 GLN 47 2HE2 GLN 47 -2.517 12.867 -11.350 385 HE22 GLN 47 1HE2 GLN 47 -1.207 12.040 -10.584 386 H LYS 48 H LYS 48 -3.789 17.476 -6.477 387 HA LYS 48 HA LYS 48 -5.435 16.685 -4.347 388 HB2 LYS 48 1HB LYS 48 -3.996 19.323 -4.689 389 HB3 LYS 48 2HB LYS 48 -4.551 18.631 -3.178 390 HG2 LYS 48 1HG LYS 48 -2.324 17.659 -4.947 391 HG3 LYS 48 2HG LYS 48 -2.207 18.279 -3.300 392 HD2 LYS 48 1HD LYS 48 -3.607 15.733 -4.107 393 HD3 LYS 48 2HD LYS 48 -1.986 15.824 -3.421 394 HE2 LYS 48 1HE LYS 48 -2.860 16.717 -1.361 395 HE3 LYS 48 2HE LYS 48 -4.479 16.821 -2.052 396 HZ1 LYS 48 3HZ LYS 48 -4.639 14.476 -2.153 397 HZ2 LYS 48 1HZ LYS 48 -4.076 14.851 -0.597 398 HZ3 LYS 48 2HZ LYS 48 -2.999 14.268 -1.765 399 H MET 49 H MET 49 -5.588 19.413 -6.570 400 HA MET 49 HA MET 49 -7.761 20.792 -5.569 401 HB2 MET 49 1HB MET 49 -6.223 21.476 -7.449 402 HB3 MET 49 2HB MET 49 -7.141 20.411 -8.498 403 HG2 MET 49 1HG MET 49 -9.167 21.732 -7.972 404 HG3 MET 49 2HG MET 49 -8.148 22.832 -7.048 405 HE1 MET 49 3HE MET 49 -6.209 24.304 -8.122 406 HE2 MET 49 1HE MET 49 -5.817 24.314 -9.841 407 HE3 MET 49 2HE MET 49 -5.486 22.879 -8.868 408 H ILE 50 H ILE 50 -7.666 17.959 -7.663 409 HA ILE 50 HA ILE 50 -10.405 17.842 -8.301 410 HB ILE 50 HB ILE 50 -8.346 15.639 -8.138 411 HG12 ILE 50 1HG1 ILE 50 -7.879 17.340 -9.822 412 HG13 ILE 50 2HG1 ILE 50 -8.365 15.838 -10.601 413 HG21 ILE 50 1HG2 ILE 50 -10.566 14.679 -7.878 414 HG22 ILE 50 2HG2 ILE 50 -9.903 14.280 -9.464 415 HG23 ILE 50 3HG2 ILE 50 -11.124 15.543 -9.308 416 HD11 ILE 50 3HD1 ILE 50 -10.602 16.740 -10.950 417 HD12 ILE 50 1HD1 ILE 50 -9.368 17.767 -11.681 418 HD13 ILE 50 2HD1 ILE 50 -10.123 18.241 -10.158 419 H GLU 51 H GLU 51 -8.545 16.212 -5.736 420 HA GLU 51 HA GLU 51 -10.673 14.856 -4.531 421 HB2 GLU 51 1HB GLU 51 -8.212 16.011 -3.205 422 HB3 GLU 51 2HB GLU 51 -9.271 14.795 -2.504 423 HG2 GLU 51 1HG GLU 51 -8.673 13.255 -4.320 424 HG3 GLU 51 2HG GLU 51 -7.580 14.478 -4.973 425 H LYS 52 H LYS 52 -9.539 18.156 -4.152 426 HA LYS 52 HA LYS 52 -11.175 18.708 -1.868 427 HB2 LYS 52 1HB LYS 52 -8.956 19.797 -2.484 428 HB3 LYS 52 2HB LYS 52 -9.858 20.731 -3.669 429 HG2 LYS 52 1HG LYS 52 -9.587 22.053 -1.705 430 HG3 LYS 52 2HG LYS 52 -11.284 21.583 -1.829 431 HD2 LYS 52 1HD LYS 52 -10.935 19.813 -0.197 432 HD3 LYS 52 2HD LYS 52 -9.219 20.211 -0.106 433 HE2 LYS 52 1HE LYS 52 -11.517 21.994 0.698 434 HE3 LYS 52 2HE LYS 52 -10.430 21.140 1.791 435 HZ1 LYS 52 3HZ LYS 52 -9.610 23.306 1.698 436 HZ2 LYS 52 1HZ LYS 52 -9.829 23.432 0.022 437 HZ3 LYS 52 2HZ LYS 52 -8.592 22.453 0.642 438 H SER 53 H SER 53 -11.550 18.999 -5.328 439 HA SER 53 HA SER 53 -13.928 20.687 -4.947 440 HB2 SER 53 1HB SER 53 -12.444 20.154 -7.526 441 HB3 SER 53 2HB SER 53 -13.658 21.398 -7.224 442 HG SER 53 HG SER 53 -11.020 21.222 -6.225 443 H LEU 54 H LEU 54 -13.458 17.559 -4.960 444 HA LEU 54 HA LEU 54 -14.913 16.441 -7.043 445 HB2 LEU 54 1HB LEU 54 -13.571 15.160 -5.428 446 HB3 LEU 54 2HB LEU 54 -14.747 15.509 -4.177 447 HG LEU 54 HG LEU 54 -16.445 14.219 -5.404 448 HD11 LEU 54 1HD1 LEU 54 -14.203 13.536 -7.296 449 HD12 LEU 54 2HD1 LEU 54 -15.548 14.615 -7.664 450 HD13 LEU 54 3HD1 LEU 54 -15.850 12.906 -7.343 451 HD21 LEU 54 3HD2 LEU 54 -15.482 12.008 -5.031 452 HD22 LEU 54 1HD2 LEU 54 -15.067 13.110 -3.718 453 HD23 LEU 54 2HD2 LEU 54 -13.870 12.717 -4.953 454 H ASN 55 H ASN 55 -16.010 17.818 -3.993 455 HA ASN 55 HA ASN 55 -18.720 17.161 -4.174 456 HB2 ASN 55 1HB ASN 55 -19.091 19.115 -2.656 457 HB3 ASN 55 2HB ASN 55 -17.833 18.017 -2.103 458 HD21 ASN 55 2HD2 ASN 55 -15.711 18.700 -2.057 459 HD22 ASN 55 1HD2 ASN 55 -15.257 20.358 -2.262 460 H LYS 56 H LYS 56 -16.915 19.879 -5.544 461 HA LYS 56 HA LYS 56 -19.196 21.250 -6.539 462 HB2 LYS 56 1HB LYS 56 -16.259 21.413 -7.176 463 HB3 LYS 56 2HB LYS 56 -17.448 22.377 -8.041 464 HG2 LYS 56 1HG LYS 56 -17.010 22.415 -5.065 465 HG3 LYS 56 2HG LYS 56 -16.397 23.614 -6.206 466 HD2 LYS 56 1HD LYS 56 -18.706 24.152 -6.861 467 HD3 LYS 56 2HD LYS 56 -19.302 22.966 -5.697 468 HE2 LYS 56 1HE LYS 56 -18.258 24.241 -3.883 469 HE3 LYS 56 2HE LYS 56 -17.696 25.434 -5.054 470 HZ1 LYS 56 3HZ LYS 56 -19.713 26.154 -3.949 471 HZ2 LYS 56 1HZ LYS 56 -20.536 24.770 -4.478 472 HZ3 LYS 56 2HZ LYS 56 -20.003 25.922 -5.605 473 H LEU 57 H LEU 57 -16.905 18.973 -7.973 474 HA LEU 57 HA LEU 57 -17.960 19.030 -10.577 475 HB2 LEU 57 1HB LEU 57 -16.298 17.104 -9.020 476 HB3 LEU 57 2HB LEU 57 -17.005 16.555 -10.527 477 HG LEU 57 HG LEU 57 -15.841 18.332 -11.743 478 HD11 LEU 57 1HD1 LEU 57 -15.773 20.025 -9.989 479 HD12 LEU 57 2HD1 LEU 57 -14.164 19.716 -10.645 480 HD13 LEU 57 3HD1 LEU 57 -14.623 19.045 -9.079 481 HD21 LEU 57 3HD2 LEU 57 -14.730 16.202 -11.512 482 HD22 LEU 57 1HD2 LEU 57 -14.056 16.690 -9.959 483 HD23 LEU 57 2HD2 LEU 57 -13.544 17.505 -11.436 484 H TYR 58 H TYR 58 -18.774 17.067 -7.752 485 HA TYR 58 HA TYR 58 -20.696 15.437 -9.035 486 HB2 TYR 58 1HB TYR 58 -19.560 15.110 -6.747 487 HB3 TYR 58 2HB TYR 58 -20.799 16.195 -6.124 488 HD1 TYR 58 HD2 TYR 58 -20.654 13.248 -8.407 489 HD2 TYR 58 HD1 TYR 58 -22.594 15.135 -5.125 490 HE1 TYR 58 HE2 TYR 58 -22.187 11.343 -8.225 491 HE2 TYR 58 HE1 TYR 58 -24.138 13.229 -4.937 492 HH TYR 58 HH TYR 58 -24.999 11.420 -6.246 493 H GLU 59 H GLU 59 -21.014 18.451 -7.170 494 HA GLU 59 HA GLU 59 -23.791 18.757 -7.364 495 HB2 GLU 59 1HB GLU 59 -22.466 20.170 -5.901 496 HB3 GLU 59 2HB GLU 59 -21.575 20.821 -7.267 497 HG2 GLU 59 1HG GLU 59 -23.708 21.821 -8.087 498 HG3 GLU 59 2HG GLU 59 -24.467 21.296 -6.583 499 H TYR 60 H TYR 60 -21.196 19.786 -9.503 500 HA TYR 60 HA TYR 60 -22.686 21.247 -11.341 501 HB2 TYR 60 1HB TYR 60 -20.329 21.448 -11.343 502 HB3 TYR 60 2HB TYR 60 -20.097 19.717 -11.527 503 HD1 TYR 60 HD1 TYR 60 -21.195 22.784 -13.282 504 HD2 TYR 60 HD2 TYR 60 -19.932 18.735 -13.662 505 HE1 TYR 60 HE1 TYR 60 -20.936 23.098 -15.700 506 HE2 TYR 60 HE2 TYR 60 -19.672 19.044 -16.089 507 HH TYR 60 HH TYR 60 -20.461 20.498 -17.863 508 H ILE 61 H ILE 61 -22.024 17.764 -11.256 509 HA ILE 61 HA ILE 61 -23.111 17.353 -13.872 510 HB ILE 61 HB ILE 61 -22.877 14.974 -13.475 511 HG12 ILE 61 1HG1 ILE 61 -22.105 15.759 -10.655 512 HG13 ILE 61 2HG1 ILE 61 -23.540 14.854 -11.126 513 HG21 ILE 61 1HG2 ILE 61 -20.942 16.216 -14.194 514 HG22 ILE 61 2HG2 ILE 61 -20.450 14.926 -13.095 515 HG23 ILE 61 3HG2 ILE 61 -20.524 16.594 -12.523 516 HD11 ILE 61 3HD1 ILE 61 -22.150 13.020 -11.894 517 HD12 ILE 61 1HD1 ILE 61 -21.805 13.408 -10.209 518 HD13 ILE 61 2HD1 ILE 61 -20.699 13.933 -11.480 519 H GLU 62 H GLU 62 -24.398 17.295 -10.624 520 HA GLU 62 HA GLU 62 -26.823 15.960 -11.463 521 HB2 GLU 62 1HB GLU 62 -27.528 16.105 -9.188 522 HB3 GLU 62 2HB GLU 62 -25.820 15.694 -9.172 523 HG2 GLU 62 1HG GLU 62 -25.232 17.963 -8.626 524 HG3 GLU 62 2HG GLU 62 -26.918 18.461 -8.756 525 H GLN 63 H GLN 63 -25.668 19.191 -11.319 526 HA GLN 63 HA GLN 63 -28.397 20.260 -11.220 527 HB2 GLN 63 1HB GLN 63 -27.532 22.273 -10.394 528 HB3 GLN 63 2HB GLN 63 -26.571 21.041 -9.590 529 HG2 GLN 63 1HG GLN 63 -24.707 21.447 -10.980 530 HG3 GLN 63 2HG GLN 63 -25.658 22.440 -12.084 531 HE21 GLN 63 2HE2 GLN 63 -23.223 23.079 -10.636 532 HE22 GLN 63 1HE2 GLN 63 -23.581 24.474 -9.677 533 H SER 64 H SER 64 -29.243 21.454 -12.834 534 HA SER 64 HA SER 64 -29.446 22.805 -14.646 535 HB2 SER 64 1HB SER 64 -28.045 24.159 -13.134 536 HB3 SER 64 2HB SER 64 -26.606 23.500 -13.901 537 HG SER 64 HG SER 64 -27.582 24.386 -15.907 538 H LYS 65 H LYS 65 -28.540 20.104 -15.334 539 HA LYS 65 HA LYS 65 -26.440 20.193 -17.202 540 HB2 LYS 65 1HB LYS 65 -28.681 18.284 -16.700 541 HB3 LYS 65 2HB LYS 65 -27.738 18.120 -18.174 542 HG2 LYS 65 1HG LYS 65 -26.664 18.060 -15.362 543 HG3 LYS 65 2HG LYS 65 -26.866 16.677 -16.438 544 HD2 LYS 65 1HD LYS 65 -25.307 17.816 -18.045 545 HD3 LYS 65 2HD LYS 65 -24.993 19.016 -16.792 546 HE2 LYS 65 1HE LYS 65 -24.203 17.227 -15.305 547 HE3 LYS 65 2HE LYS 65 -24.489 16.051 -16.586 548 HZ1 LYS 65 3HZ LYS 65 -22.217 16.548 -16.680 549 HZ2 LYS 65 1HZ LYS 65 -22.476 18.218 -16.526 550 HZ3 LYS 65 2HZ LYS 65 -22.898 17.428 -17.959 551 H ASN 66 H ASN 66 -29.737 21.147 -17.446 552 HA ASN 66 HA ASN 66 -29.288 21.872 -20.260 553 HB2 ASN 66 1HB ASN 66 -31.620 21.342 -20.799 554 HB3 ASN 66 2HB ASN 66 -30.778 19.903 -20.228 555 HD21 ASN 66 2HD2 ASN 66 -33.652 20.608 -20.277 556 HD22 ASN 66 1HD2 ASN 66 -34.193 20.428 -18.640 557 H CYS 67 H CYS 67 -31.654 23.162 -20.723 558 HA CYS 67 HA CYS 67 -32.310 24.912 -18.562 559 HB2 CYS 67 1HB CYS 67 -31.446 26.934 -19.297 560 HB3 CYS 67 2HB CYS 67 -30.123 25.837 -19.655 561 H SER 68 H SER 68 -33.952 26.531 -19.298 562 HA SER 68 HA SER 68 -36.053 25.026 -20.420 563 HB2 SER 68 1HB SER 68 -37.228 27.330 -20.322 564 HB3 SER 68 2HB SER 68 -36.660 26.613 -18.811 565 HG SER 68 HG SER 68 -36.003 28.767 -18.921 566 H TYR 69 H TYR 69 -33.862 27.305 -21.819 567 HA TYR 69 HA TYR 69 -35.318 27.972 -24.121 568 HB2 TYR 69 1HB TYR 69 -33.272 29.082 -23.069 569 HB3 TYR 69 2HB TYR 69 -32.322 27.872 -23.909 570 HD1 TYR 69 HD2 TYR 69 -35.276 28.887 -25.647 571 HD2 TYR 69 HD1 TYR 69 -31.210 29.876 -24.954 572 HE1 TYR 69 HE2 TYR 69 -35.277 30.259 -27.681 573 HE2 TYR 69 HE1 TYR 69 -31.189 31.253 -26.979 574 HH TYR 69 HH TYR 69 -32.536 31.267 -29.206 575 H CYS 70 H CYS 70 -33.724 25.100 -23.240 576 HA CYS 70 HA CYS 70 -33.781 24.233 -26.053 577 HB2 CYS 70 1HB CYS 70 -31.840 22.766 -25.588 578 HB3 CYS 70 2HB CYS 70 -31.466 24.477 -25.414 579 H SER 71 H SER 71 -35.343 23.858 -23.266 580 HA SER 71 HA SER 71 -36.067 21.095 -23.915 581 HB2 SER 71 1HB SER 71 -35.780 22.117 -21.084 582 HB3 SER 71 2HB SER 71 -36.071 20.459 -21.603 583 HG SER 71 HG SER 71 -33.922 20.836 -22.771 584 H GLU 72 H GLU 72 -38.262 20.568 -23.439 585 HA GLU 72 HA GLU 72 -40.038 22.837 -23.240 586 HB2 GLU 72 1HB GLU 72 -40.563 20.910 -24.711 587 HB3 GLU 72 2HB GLU 72 -40.690 19.881 -23.292 588 HG2 GLU 72 1HG GLU 72 -42.594 21.117 -22.499 589 HG3 GLU 72 2HG GLU 72 -42.419 22.287 -23.806 590 H ASP 73 H ASP 73 -38.594 20.533 -21.165 591 HA ASP 73 HA ASP 73 -40.279 20.642 -18.927 592 HB2 ASP 73 1HB ASP 73 -37.267 20.371 -19.094 593 HB3 ASP 73 2HB ASP 73 -38.202 20.130 -17.624 594 H GLU 74 H GLU 74 -41.020 22.568 -18.211 595 HA GLU 74 HA GLU 74 -39.361 24.920 -18.186 596 HB2 GLU 74 1HB GLU 74 -41.338 25.984 -17.110 597 HB3 GLU 74 2HB GLU 74 -41.712 25.191 -18.633 598 HG2 GLU 74 1HG GLU 74 -42.663 23.308 -17.473 599 HG3 GLU 74 2HG GLU 74 -42.189 23.990 -15.918 600 H ASN 75 H ASN 75 -39.842 22.310 -16.133 601 HA ASN 75 HA ASN 75 -39.178 23.722 -13.690 602 HB2 ASN 75 1HB ASN 75 -39.153 21.323 -12.758 603 HB3 ASN 75 2HB ASN 75 -40.696 21.982 -13.290 604 HD21 ASN 75 2HD2 ASN 75 -38.166 19.702 -13.981 605 HD22 ASN 75 1HD2 ASN 75 -39.041 18.783 -15.159 606 H CYS 76 H CYS 76 -37.173 24.537 -14.574 607 HA CYS 76 HA CYS 76 -35.073 22.633 -15.154 608 HB2 CYS 76 1HB CYS 76 -34.895 25.645 -14.981 609 HB3 CYS 76 2HB CYS 76 -33.737 24.557 -15.739 610 HG CYS 76 HG CYS 76 -36.263 26.081 -17.090 611 H ASN 77 H ASN 77 -33.398 22.103 -13.878 612 HA ASN 77 HA ASN 77 -33.228 23.223 -11.178 613 HB2 ASN 77 1HB ASN 77 -31.744 20.958 -12.548 614 HB3 ASN 77 2HB ASN 77 -31.434 21.473 -10.894 615 HD21 ASN 77 2HD2 ASN 77 -32.351 18.905 -11.928 616 HD22 ASN 77 1HD2 ASN 77 -33.849 18.577 -11.131 617 H ASN 78 H ASN 78 -32.751 24.999 -13.212 618 HA ASN 78 HA ASN 78 -29.824 25.276 -13.379 619 HB2 ASN 78 1HB ASN 78 -30.932 24.759 -15.538 620 HB3 ASN 78 2HB ASN 78 -31.945 26.181 -15.350 621 HD21 ASN 78 2HD2 ASN 78 -29.876 25.284 -17.343 622 HD22 ASN 78 1HD2 ASN 78 -28.818 26.651 -17.500 623 H LEU 79 H LEU 79 -28.933 27.217 -12.848 624 HA LEU 79 HA LEU 79 -30.573 29.035 -11.324 625 HB2 LEU 79 1HB LEU 79 -27.623 28.950 -11.945 626 HB3 LEU 79 2HB LEU 79 -28.360 30.255 -11.035 627 HG LEU 79 HG LEU 79 -29.127 28.545 -9.364 628 HD11 LEU 79 1HD1 LEU 79 -29.020 26.543 -10.715 629 HD12 LEU 79 2HD1 LEU 79 -27.946 26.393 -9.324 630 HD13 LEU 79 3HD1 LEU 79 -27.280 26.742 -10.919 631 HD21 LEU 79 3HD2 LEU 79 -27.191 29.963 -8.981 632 HD22 LEU 79 1HD2 LEU 79 -26.159 28.796 -9.809 633 HD23 LEU 79 2HD2 LEU 79 -26.949 28.357 -8.292 634 H LEU 80 H LEU 80 -28.165 29.634 -13.872 635 HA LEU 80 HA LEU 80 -29.526 32.086 -14.606 636 HB2 LEU 80 1HB LEU 80 -26.968 30.809 -15.563 637 HB3 LEU 80 2HB LEU 80 -27.638 32.245 -16.307 638 HG LEU 80 HG LEU 80 -27.493 33.350 -14.026 639 HD11 LEU 80 1HD1 LEU 80 -27.281 31.358 -12.649 640 HD12 LEU 80 2HD1 LEU 80 -25.873 32.403 -12.451 641 HD13 LEU 80 3HD1 LEU 80 -25.761 30.949 -13.446 642 HD21 LEU 80 3HD2 LEU 80 -25.944 33.818 -15.846 643 HD22 LEU 80 1HD2 LEU 80 -24.937 32.458 -15.351 644 HD23 LEU 80 2HD2 LEU 80 -25.127 33.850 -14.285 645 H GLU 81 H GLU 81 -31.352 31.716 -15.725 646 HA GLU 81 HA GLU 81 -31.737 29.567 -17.509 647 HB2 GLU 81 1HB GLU 81 -33.611 30.724 -16.441 648 HB3 GLU 81 2HB GLU 81 -33.221 32.198 -17.319 649 HG2 GLU 81 1HG GLU 81 -33.743 31.145 -19.417 650 HG3 GLU 81 2HG GLU 81 -34.016 29.601 -18.611 651 H GLY 82 H GLY 82 -31.601 29.409 -19.687 652 HA2 GLY 82 1HA GLY 82 -31.108 30.058 -21.882 653 HA3 GLY 82 2HA GLY 82 -30.676 31.656 -21.286 654 H TYR 83 H TYR 83 -29.138 29.829 -19.187 655 HA TYR 83 HA TYR 83 -26.732 29.515 -20.860 656 HB2 TYR 83 1HB TYR 83 -27.022 30.575 -18.045 657 HB3 TYR 83 2HB TYR 83 -25.479 30.035 -18.692 658 HD1 TYR 83 HD1 TYR 83 -28.280 32.344 -19.644 659 HD2 TYR 83 HD2 TYR 83 -24.086 31.643 -19.559 660 HE1 TYR 83 HE1 TYR 83 -27.891 34.578 -20.588 661 HE2 TYR 83 HE2 TYR 83 -23.686 33.874 -20.508 662 HH TYR 83 HH TYR 83 -24.782 35.576 -21.747 663 H HIS 84 H HIS 84 -25.116 28.002 -19.851 664 HA HIS 84 HA HIS 84 -26.316 25.934 -18.135 665 HB2 HIS 84 1HB HIS 84 -24.595 25.460 -20.571 666 HB3 HIS 84 2HB HIS 84 -24.891 24.243 -19.344 667 HD1 HIS 84 HD1 HIS 84 -26.081 22.620 -20.892 668 HD2 HIS 84 HD2 HIS 84 -27.856 26.382 -20.778 669 HE1 HIS 84 HE1 HIS 84 -28.147 22.506 -22.356 670 HA PRO 85 HA PRO 85 -22.606 26.563 -15.839 671 HB2 PRO 85 1HB PRO 85 -22.449 24.289 -14.433 672 HB3 PRO 85 2HB PRO 85 -23.754 25.454 -14.167 673 HG2 PRO 85 1HG PRO 85 -23.783 22.891 -15.705 674 HG3 PRO 85 2HG PRO 85 -25.012 23.561 -14.616 675 HD2 PRO 85 1HD PRO 85 -25.112 23.732 -17.363 676 HD3 PRO 85 2HD PRO 85 -25.927 24.858 -16.263 677 H LYS 86 H LYS 86 -20.436 26.122 -15.821 678 HA LYS 86 HA LYS 86 -19.418 23.714 -17.086 679 HB2 LYS 86 1HB LYS 86 -19.553 25.257 -18.952 680 HB3 LYS 86 2HB LYS 86 -18.735 26.505 -18.024 681 HG2 LYS 86 1HG LYS 86 -16.698 25.208 -18.009 682 HG3 LYS 86 2HG LYS 86 -17.511 23.887 -18.851 683 HD2 LYS 86 1HD LYS 86 -17.735 25.149 -20.831 684 HD3 LYS 86 2HD LYS 86 -17.360 26.660 -20.001 685 HE2 LYS 86 1HE LYS 86 -15.461 26.013 -21.305 686 HE3 LYS 86 2HE LYS 86 -15.076 25.812 -19.599 687 HZ1 LYS 86 3HZ LYS 86 -15.825 23.645 -21.496 688 HZ2 LYS 86 1HZ LYS 86 -15.526 23.425 -19.845 689 HZ3 LYS 86 2HZ LYS 86 -14.276 23.929 -20.867 690 H LEU 87 H LEU 87 -17.581 23.026 -16.176 691 HA LEU 87 HA LEU 87 -16.711 24.191 -13.745 692 HB2 LEU 87 1HB LEU 87 -15.401 22.077 -15.453 693 HB3 LEU 87 2HB LEU 87 -14.959 22.465 -13.803 694 HG LEU 87 HG LEU 87 -17.629 21.363 -14.670 695 HD11 LEU 87 1HD1 LEU 87 -15.328 20.029 -13.253 696 HD12 LEU 87 2HD1 LEU 87 -15.834 19.735 -14.917 697 HD13 LEU 87 3HD1 LEU 87 -16.905 19.308 -13.581 698 HD21 LEU 87 3HD2 LEU 87 -17.815 22.770 -12.700 699 HD22 LEU 87 1HD2 LEU 87 -16.493 21.896 -11.926 700 HD23 LEU 87 2HD2 LEU 87 -18.016 21.072 -12.262 701 H VAL 88 H VAL 88 -15.157 25.623 -13.348 702 HA VAL 88 HA VAL 88 -13.151 26.181 -15.422 703 HB VAL 88 HB VAL 88 -13.311 28.616 -14.868 704 HG11 VAL 88 1HG1 VAL 88 -15.808 27.381 -16.026 705 HG12 VAL 88 2HG1 VAL 88 -14.332 27.788 -16.906 706 HG13 VAL 88 3HG1 VAL 88 -15.322 29.068 -16.199 707 HG21 VAL 88 3HG2 VAL 88 -15.870 27.803 -13.504 708 HG22 VAL 88 1HG2 VAL 88 -15.335 29.457 -13.802 709 HG23 VAL 88 2HG2 VAL 88 -14.420 28.419 -12.711 710 H VAL 89 H VAL 89 -11.151 26.937 -14.592 711 HA VAL 89 HA VAL 89 -10.839 26.406 -11.727 712 HB VAL 89 HB VAL 89 -9.467 24.954 -13.058 713 HG11 VAL 89 1HG1 VAL 89 -9.364 26.280 -15.099 714 HG12 VAL 89 2HG1 VAL 89 -7.762 25.751 -14.590 715 HG13 VAL 89 3HG1 VAL 89 -8.268 27.417 -14.312 716 HG21 VAL 89 3HG2 VAL 89 -7.822 27.126 -11.765 717 HG22 VAL 89 1HG2 VAL 89 -7.216 25.531 -12.213 718 HG23 VAL 89 2HG2 VAL 89 -8.474 25.684 -10.987 719 H ASN 90 H ASN 90 -10.733 28.101 -10.461 720 HA ASN 90 HA ASN 90 -9.466 30.551 -11.496 721 HB2 ASN 90 1HB ASN 90 -11.640 30.197 -9.433 722 HB3 ASN 90 2HB ASN 90 -10.731 31.696 -9.599 723 HD21 ASN 90 2HD2 ASN 90 -13.258 29.751 -10.821 724 HD22 ASN 90 1HD2 ASN 90 -13.757 30.797 -12.114 725 H GLY 91 H GLY 91 -7.402 30.330 -10.914 726 HA2 GLY 91 1HA GLY 91 -5.579 30.336 -9.507 727 HA3 GLY 91 2HA GLY 91 -6.690 30.430 -8.146 728 H ARG 92 H ARG 92 -6.565 28.761 -6.819 729 HA ARG 92 HA ARG 92 -5.872 26.133 -7.958 730 HB2 ARG 92 1HB ARG 92 -5.409 27.292 -5.213 731 HB3 ARG 92 2HB ARG 92 -5.246 25.574 -5.550 732 HG2 ARG 92 1HG ARG 92 -3.670 27.788 -6.855 733 HG3 ARG 92 2HG ARG 92 -3.085 26.682 -5.609 734 HD2 ARG 92 1HD ARG 92 -3.382 24.794 -7.093 735 HD3 ARG 92 2HD ARG 92 -4.090 25.839 -8.323 736 HE ARG 92 HE ARG 92 -1.456 26.676 -7.592 737 HH11 ARG 92 1HH1 ARG 92 -3.185 24.272 -9.428 738 HH12 ARG 92 2HH1 ARG 92 -1.968 24.112 -10.647 739 HH21 ARG 92 1HH2 ARG 92 0.209 26.452 -9.175 740 HH22 ARG 92 2HH2 ARG 92 -0.020 25.349 -10.493 741 H SER 93 H SER 93 -8.530 27.679 -7.443 742 HA SER 93 HA SER 93 -9.878 25.351 -6.243 743 HB2 SER 93 1HB SER 93 -11.693 26.993 -5.577 744 HB3 SER 93 2HB SER 93 -10.174 27.133 -4.696 745 HG SER 93 HG SER 93 -10.376 28.687 -6.987 746 H ILE 94 H ILE 94 -11.675 24.558 -7.274 747 HA ILE 94 HA ILE 94 -12.052 25.513 -10.012 748 HB ILE 94 HB ILE 94 -12.939 22.924 -8.716 749 HG12 ILE 94 1HG1 ILE 94 -10.762 23.440 -10.758 750 HG13 ILE 94 2HG1 ILE 94 -10.475 23.221 -9.033 751 HG21 ILE 94 1HG2 ILE 94 -13.077 23.788 -11.606 752 HG22 ILE 94 2HG2 ILE 94 -14.450 23.615 -10.513 753 HG23 ILE 94 3HG2 ILE 94 -13.513 22.197 -10.980 754 HD11 ILE 94 3HD1 ILE 94 -9.998 21.185 -10.205 755 HD12 ILE 94 1HD1 ILE 94 -11.601 21.186 -10.948 756 HD13 ILE 94 2HD1 ILE 94 -11.433 20.957 -9.206 757 H ASP 95 H ASP 95 -13.872 26.457 -10.671 758 HA ASP 95 HA ASP 95 -16.113 26.611 -8.766 759 HB2 ASP 95 1HB ASP 95 -15.097 28.727 -10.673 760 HB3 ASP 95 2HB ASP 95 -16.607 28.844 -9.779 761 H ILE 96 H ILE 96 -18.140 27.433 -10.004 762 HA ILE 96 HA ILE 96 -18.362 25.983 -12.552 763 HB ILE 96 HB ILE 96 -20.456 26.037 -10.373 764 HG12 ILE 96 1HG1 ILE 96 -18.778 23.698 -11.296 765 HG13 ILE 96 2HG1 ILE 96 -18.400 24.666 -9.874 766 HG21 ILE 96 1HG2 ILE 96 -21.624 24.400 -11.759 767 HG22 ILE 96 2HG2 ILE 96 -20.361 24.532 -12.984 768 HG23 ILE 96 3HG2 ILE 96 -21.389 25.919 -12.625 769 HD11 ILE 96 3HD1 ILE 96 -20.908 23.058 -10.292 770 HD12 ILE 96 1HD1 ILE 96 -20.507 24.008 -8.861 771 HD13 ILE 96 2HD1 ILE 96 -19.533 22.601 -9.286 772 H GLU 97 H GLU 97 -18.388 27.719 -13.873 773 HA GLU 97 HA GLU 97 -20.277 29.880 -13.258 774 HB2 GLU 97 1HB GLU 97 -17.886 29.826 -15.117 775 HB3 GLU 97 2HB GLU 97 -18.976 31.197 -14.929 776 HG2 GLU 97 1HG GLU 97 -18.380 31.404 -12.594 777 HG3 GLU 97 2HG GLU 97 -17.367 29.968 -12.702 778 H TYR 98 H TYR 98 -20.804 30.899 -15.756 779 HA TYR 98 HA TYR 98 -22.248 28.630 -16.953 780 HB2 TYR 98 1HB TYR 98 -23.270 31.207 -15.895 781 HB3 TYR 98 2HB TYR 98 -24.017 30.596 -17.366 782 HD1 TYR 98 HD1 TYR 98 -23.111 29.481 -13.903 783 HD2 TYR 98 HD2 TYR 98 -25.773 29.120 -17.205 784 HE1 TYR 98 HE1 TYR 98 -24.558 27.996 -12.569 785 HE2 TYR 98 HE2 TYR 98 -27.220 27.641 -15.888 786 HH TYR 98 HH TYR 98 -27.077 26.153 -13.971 787 H TYR 99 H TYR 99 -22.347 28.486 -19.091 788 HA TYR 99 HA TYR 99 -21.529 30.825 -20.686 789 HB2 TYR 99 1HB TYR 99 -20.851 29.292 -22.476 790 HB3 TYR 99 2HB TYR 99 -19.972 28.939 -20.998 791 HD1 TYR 99 HD2 TYR 99 -22.947 27.820 -22.959 792 HD2 TYR 99 HD1 TYR 99 -19.854 26.732 -20.230 793 HE1 TYR 99 HE2 TYR 99 -23.626 25.466 -23.143 794 HE2 TYR 99 HE1 TYR 99 -20.536 24.376 -20.408 795 HH TYR 99 HH TYR 99 -22.485 23.048 -21.018 796 H GLU 100 H GLU 100 -22.724 31.034 -22.782 797 HA GLU 100 HA GLU 100 -25.517 30.836 -22.197 798 HB2 GLU 100 1HB GLU 100 -25.787 31.889 -24.469 799 HB3 GLU 100 2HB GLU 100 -24.823 32.804 -23.320 800 HG2 GLU 100 1HG GLU 100 -22.777 31.990 -24.398 801 HG3 GLU 100 2HG GLU 100 -23.759 31.099 -25.563 802 H CYS 101 H CYS 101 -27.086 29.611 -23.137 803 HA CYS 101 HA CYS 101 -26.477 27.036 -24.090 804 HB2 CYS 101 1HB CYS 101 -28.645 27.748 -23.041 805 HB3 CYS 101 2HB CYS 101 -29.037 28.606 -24.521 806 HA PRO 102 HA PRO 102 -25.224 28.111 -28.246 807 HB2 PRO 102 1HB PRO 102 -25.438 25.499 -29.196 808 HB3 PRO 102 2HB PRO 102 -24.006 26.221 -28.463 809 HG2 PRO 102 1HG PRO 102 -26.041 24.422 -27.260 810 HG3 PRO 102 2HG PRO 102 -24.305 24.535 -26.938 811 HD2 PRO 102 1HD PRO 102 -26.169 25.526 -25.256 812 HD3 PRO 102 2HD PRO 102 -24.567 26.266 -25.453 813 H VAL 103 H VAL 103 -28.187 26.594 -27.340 814 HA VAL 103 HA VAL 103 -29.470 26.535 -29.854 815 HB VAL 103 HB VAL 103 -30.690 26.820 -27.096 816 HG11 VAL 103 1HG1 VAL 103 -32.739 25.942 -28.114 817 HG12 VAL 103 2HG1 VAL 103 -31.975 26.014 -29.702 818 HG13 VAL 103 3HG1 VAL 103 -32.280 27.499 -28.802 819 HG21 VAL 103 3HG2 VAL 103 -31.055 24.408 -27.253 820 HG22 VAL 103 1HG2 VAL 103 -29.341 24.811 -27.339 821 HG23 VAL 103 2HG2 VAL 103 -30.222 24.381 -28.806 822 H LYS 104 H LYS 104 -28.573 29.151 -27.825 823 HA LYS 104 HA LYS 104 -30.579 31.003 -28.628 824 HB2 LYS 104 1HB LYS 104 -29.094 31.324 -26.639 825 HB3 LYS 104 2HB LYS 104 -27.756 31.637 -27.737 826 HG2 LYS 104 1HG LYS 104 -28.937 33.579 -28.633 827 HG3 LYS 104 2HG LYS 104 -30.293 33.253 -27.555 828 HD2 LYS 104 1HD LYS 104 -28.880 35.027 -26.664 829 HD3 LYS 104 2HD LYS 104 -28.847 33.607 -25.617 830 HE2 LYS 104 1HE LYS 104 -26.699 32.976 -26.402 831 HE3 LYS 104 2HE LYS 104 -26.761 34.150 -27.715 832 HZ1 LYS 104 3HZ LYS 104 -25.358 34.788 -25.760 833 HZ2 LYS 104 1HZ LYS 104 -26.783 34.923 -24.849 834 HZ3 LYS 104 2HZ LYS 104 -26.537 35.928 -26.195 835 H ARG 105 H ARG 105 -27.892 29.625 -30.180 836 HA ARG 105 HA ARG 105 -27.858 31.658 -32.275 837 HB2 ARG 105 1HB ARG 105 -25.699 30.773 -31.556 838 HB3 ARG 105 2HB ARG 105 -26.228 29.135 -31.892 839 HG2 ARG 105 1HG ARG 105 -24.737 29.915 -33.621 840 HG3 ARG 105 2HG ARG 105 -26.352 29.667 -34.283 841 HD2 ARG 105 1HD ARG 105 -25.534 32.372 -33.312 842 HD3 ARG 105 2HD ARG 105 -24.993 31.806 -34.890 843 HE ARG 105 HE ARG 105 -27.691 31.375 -34.904 844 HH11 ARG 105 1HH1 ARG 105 -25.658 34.149 -34.320 845 HH12 ARG 105 2HH1 ARG 105 -26.781 35.287 -34.994 846 HH21 ARG 105 1HH2 ARG 105 -29.202 32.857 -35.757 847 HH22 ARG 105 2HH2 ARG 105 -28.810 34.552 -35.815 848 H LYS 106 H LYS 106 -29.921 31.377 -33.123 849 HA LYS 106 HA LYS 106 -30.687 28.754 -34.142 850 HB2 LYS 106 1HB LYS 106 -32.121 31.414 -34.298 851 HB3 LYS 106 2HB LYS 106 -32.790 29.863 -34.780 852 HG2 LYS 106 1HG LYS 106 -31.958 30.605 -31.982 853 HG3 LYS 106 2HG LYS 106 -33.612 30.601 -32.595 854 HD2 LYS 106 1HD LYS 106 -31.809 28.185 -32.510 855 HD3 LYS 106 2HD LYS 106 -33.027 28.567 -31.292 856 HE2 LYS 106 1HE LYS 106 -33.552 28.064 -34.220 857 HE3 LYS 106 2HE LYS 106 -33.837 26.916 -32.912 858 HZ1 LYS 106 3HZ LYS 106 -35.215 29.517 -33.339 859 HZ2 LYS 106 1HZ LYS 106 -35.411 28.551 -31.955 860 HZ3 LYS 106 2HZ LYS 106 -35.886 27.966 -33.470 Start of MODEL 6 1 HA MET 1 HA MET 1 -4.070 -0.824 -15.325 2 HB2 MET 1 1HB MET 1 -2.120 0.261 -16.591 3 HB3 MET 1 2HB MET 1 -1.224 0.164 -15.082 4 HG2 MET 1 1HG MET 1 -0.672 -1.683 -16.542 5 HG3 MET 1 2HG MET 1 -1.480 -2.261 -15.085 6 HE1 MET 1 2HE MET 1 -2.603 -4.715 -18.006 7 HE2 MET 1 3HE MET 1 -1.741 -4.601 -16.474 8 HE3 MET 1 1HE MET 1 -1.059 -3.866 -17.929 9 H GLU 2 H GLU 2 -4.524 0.693 -12.813 10 HA GLU 2 HA GLU 2 -2.828 -0.850 -10.965 11 HB2 GLU 2 1HB GLU 2 -4.116 1.834 -10.433 12 HB3 GLU 2 2HB GLU 2 -3.081 0.944 -9.330 13 HG2 GLU 2 1HG GLU 2 -1.684 2.570 -10.184 14 HG3 GLU 2 2HG GLU 2 -1.294 1.157 -11.161 15 HA PRO 3 HA PRO 3 -7.083 -2.528 -10.454 16 HB2 PRO 3 1HB PRO 3 -6.152 -4.788 -9.167 17 HB3 PRO 3 2HB PRO 3 -6.377 -4.647 -10.913 18 HG2 PRO 3 1HG PRO 3 -3.883 -4.360 -9.289 19 HG3 PRO 3 2HG PRO 3 -4.114 -5.157 -10.858 20 HD2 PRO 3 1HD PRO 3 -3.009 -2.720 -10.669 21 HD3 PRO 3 2HD PRO 3 -4.083 -3.149 -12.018 22 H ILE 4 H ILE 4 -8.384 -2.412 -8.689 23 HA ILE 4 HA ILE 4 -7.135 -1.469 -6.218 24 HB ILE 4 HB ILE 4 -10.066 -1.498 -6.973 25 HG12 ILE 4 1HG1 ILE 4 -8.090 0.797 -6.984 26 HG13 ILE 4 2HG1 ILE 4 -8.672 -0.033 -8.424 27 HG21 ILE 4 1HG2 ILE 4 -10.320 0.071 -5.092 28 HG22 ILE 4 2HG2 ILE 4 -8.616 -0.151 -4.695 29 HG23 ILE 4 3HG2 ILE 4 -9.734 -1.508 -4.569 30 HD11 ILE 4 3HD1 ILE 4 -10.327 1.579 -6.495 31 HD12 ILE 4 1HD1 ILE 4 -10.951 0.708 -7.895 32 HD13 ILE 4 2HD1 ILE 4 -9.837 2.056 -8.120 33 H GLY 5 H GLY 5 -6.411 -3.298 -5.212 34 HA2 GLY 5 1HA GLY 5 -8.356 -4.929 -3.898 35 HA3 GLY 5 2HA GLY 5 -7.542 -5.804 -5.186 36 H ARG 6 H ARG 6 -5.986 -3.340 -3.188 37 HA ARG 6 HA ARG 6 -4.089 -5.323 -2.283 38 HB2 ARG 6 1HB ARG 6 -3.072 -3.382 -1.014 39 HB3 ARG 6 2HB ARG 6 -3.091 -3.231 -2.764 40 HG2 ARG 6 1HG ARG 6 -5.030 -1.754 -2.616 41 HG3 ARG 6 2HG ARG 6 -5.017 -1.911 -0.858 42 HD2 ARG 6 1HD ARG 6 -2.957 -0.769 -0.675 43 HD3 ARG 6 2HD ARG 6 -2.636 -0.909 -2.403 44 HE ARG 6 HE ARG 6 -4.527 0.652 -2.733 45 HH11 ARG 6 1HH1 ARG 6 -2.828 0.596 0.334 46 HH12 ARG 6 2HH1 ARG 6 -3.278 2.218 0.768 47 HH21 ARG 6 1HH2 ARG 6 -5.130 2.777 -2.177 48 HH22 ARG 6 2HH2 ARG 6 -4.600 3.464 -0.666 49 H SER 7 H SER 7 -5.028 -6.719 -0.954 50 HA SER 7 HA SER 7 -6.679 -5.756 1.250 51 HB2 SER 7 1HB SER 7 -7.525 -7.627 -0.130 52 HB3 SER 7 2HB SER 7 -6.108 -8.580 0.305 53 HG SER 7 HG SER 7 -8.411 -8.302 1.637 54 H LEU 8 H LEU 8 -5.806 -5.432 3.187 55 HA LEU 8 HA LEU 8 -3.099 -6.059 3.756 56 HB2 LEU 8 1HB LEU 8 -5.329 -5.143 5.576 57 HB3 LEU 8 2HB LEU 8 -3.656 -5.276 6.069 58 HG LEU 8 HG LEU 8 -4.001 -2.994 5.654 59 HD11 LEU 8 1HD1 LEU 8 -2.755 -4.136 3.164 60 HD12 LEU 8 2HD1 LEU 8 -1.932 -3.820 4.691 61 HD13 LEU 8 3HD1 LEU 8 -2.579 -2.479 3.743 62 HD21 LEU 8 3HD2 LEU 8 -6.132 -3.186 4.460 63 HD22 LEU 8 1HD2 LEU 8 -5.272 -3.703 3.012 64 HD23 LEU 8 2HD2 LEU 8 -5.025 -2.076 3.650 65 H GLN 9 H GLN 9 -6.071 -7.163 5.365 66 HA GLN 9 HA GLN 9 -4.883 -9.815 5.737 67 HB2 GLN 9 1HB GLN 9 -5.646 -9.830 8.102 68 HB3 GLN 9 2HB GLN 9 -4.396 -8.628 7.806 69 HG2 GLN 9 1HG GLN 9 -6.047 -6.870 7.742 70 HG3 GLN 9 2HG GLN 9 -7.346 -8.048 7.920 71 HE21 GLN 9 2HE2 GLN 9 -7.705 -9.000 9.917 72 HE22 GLN 9 1HE2 GLN 9 -7.002 -8.382 11.375 73 H GLY 10 H GLY 10 -6.989 -8.558 4.077 74 HA2 GLY 10 1HA GLY 10 -9.034 -9.721 3.420 75 HA3 GLY 10 2HA GLY 10 -9.377 -9.928 5.136 76 H VAL 11 H VAL 11 -11.434 -8.860 4.674 77 HA VAL 11 HA VAL 11 -11.155 -5.994 4.173 78 HB VAL 11 HB VAL 11 -13.666 -5.981 4.135 79 HG11 VAL 11 1HG1 VAL 11 -13.799 -6.971 1.897 80 HG12 VAL 11 2HG1 VAL 11 -12.249 -7.769 2.164 81 HG13 VAL 11 3HG1 VAL 11 -12.335 -6.009 2.104 82 HG21 VAL 11 3HG2 VAL 11 -14.085 -8.007 5.416 83 HG22 VAL 11 1HG2 VAL 11 -13.302 -8.978 4.169 84 HG23 VAL 11 2HG2 VAL 11 -14.808 -8.131 3.811 85 H THR 12 H THR 12 -10.445 -5.055 5.968 86 HA THR 12 HA THR 12 -11.296 -5.689 8.588 87 HB THR 12 HB THR 12 -10.196 -3.015 7.705 88 HG1 THR 12 HG1 THR 12 -8.314 -4.757 8.572 89 HG21 THR 12 3HG2 THR 12 -9.147 -3.038 9.923 90 HG22 THR 12 1HG2 THR 12 -9.886 -4.603 10.261 91 HG23 THR 12 2HG2 THR 12 -10.899 -3.174 10.047 92 H GLY 13 H GLY 13 -12.652 -3.824 6.046 93 HA2 GLY 13 1HA GLY 13 -15.182 -3.667 6.774 94 HA3 GLY 13 2HA GLY 13 -14.497 -2.418 7.806 95 H ARG 14 H ARG 14 -16.360 -1.574 6.154 96 HA ARG 14 HA ARG 14 -14.849 0.166 4.413 97 HB2 ARG 14 1HB ARG 14 -16.503 -0.082 2.544 98 HB3 ARG 14 2HB ARG 14 -15.465 -1.477 2.785 99 HG2 ARG 14 1HG ARG 14 -18.155 -1.436 4.070 100 HG3 ARG 14 2HG ARG 14 -18.030 -1.753 2.339 101 HD2 ARG 14 1HD ARG 14 -16.498 -3.274 4.443 102 HD3 ARG 14 2HD ARG 14 -18.050 -3.795 3.789 103 HE ARG 14 HE ARG 14 -16.049 -3.297 1.778 104 HH11 ARG 14 1HH1 ARG 14 -17.381 -5.661 3.997 105 HH12 ARG 14 2HH1 ARG 14 -16.794 -7.029 3.092 106 HH21 ARG 14 1HH2 ARG 14 -15.288 -5.080 0.579 107 HH22 ARG 14 2HH2 ARG 14 -15.610 -6.705 1.138 108 HA PRO 15 HA PRO 15 -17.737 2.430 7.189 109 HB2 PRO 15 1HB PRO 15 -16.279 4.769 6.721 110 HB3 PRO 15 2HB PRO 15 -16.059 3.674 8.089 111 HG2 PRO 15 1HG PRO 15 -14.533 3.849 5.530 112 HG3 PRO 15 2HG PRO 15 -13.945 3.508 7.168 113 HD2 PRO 15 1HD PRO 15 -14.226 1.546 5.378 114 HD3 PRO 15 2HD PRO 15 -14.637 1.287 7.087 115 H ASP 16 H ASP 16 -19.472 3.641 6.605 116 HA ASP 16 HA ASP 16 -20.097 3.874 3.873 117 HB2 ASP 16 1HB ASP 16 -21.421 4.698 6.401 118 HB3 ASP 16 2HB ASP 16 -21.969 5.461 4.911 119 H PHE 17 H PHE 17 -18.409 5.969 5.991 120 HA PHE 17 HA PHE 17 -18.698 8.418 4.674 121 HB2 PHE 17 1HB PHE 17 -17.524 8.227 6.806 122 HB3 PHE 17 2HB PHE 17 -16.264 7.252 6.056 123 HD1 PHE 17 HD2 PHE 17 -17.805 10.626 6.032 124 HD2 PHE 17 HD1 PHE 17 -14.397 8.264 5.090 125 HE1 PHE 17 HE2 PHE 17 -16.532 12.670 5.530 126 HE2 PHE 17 HE1 PHE 17 -13.115 10.301 4.586 127 HZ PHE 17 HZ PHE 17 -14.184 12.509 4.805 128 H GLN 18 H GLN 18 -16.288 5.844 4.135 129 HA GLN 18 HA GLN 18 -15.160 7.159 1.868 130 HB2 GLN 18 1HB GLN 18 -13.765 5.249 1.617 131 HB3 GLN 18 2HB GLN 18 -13.943 5.514 3.337 132 HG2 GLN 18 1HG GLN 18 -14.192 3.255 3.256 133 HG3 GLN 18 2HG GLN 18 -15.875 3.760 3.109 134 HE21 GLN 18 2HE2 GLN 18 -13.501 3.944 0.490 135 HE22 GLN 18 1HE2 GLN 18 -14.267 2.750 -0.495 136 H LYS 19 H LYS 19 -17.638 4.756 2.389 137 HA LYS 19 HA LYS 19 -18.063 3.896 -0.234 138 HB2 LYS 19 1HB LYS 19 -19.970 4.277 2.072 139 HB3 LYS 19 2HB LYS 19 -20.439 3.513 0.557 140 HG2 LYS 19 1HG LYS 19 -18.813 1.745 0.929 141 HG3 LYS 19 2HG LYS 19 -18.271 2.537 2.411 142 HD2 LYS 19 1HD LYS 19 -19.827 0.692 2.873 143 HD3 LYS 19 2HD LYS 19 -20.473 2.249 3.399 144 HE2 LYS 19 1HE LYS 19 -21.667 2.323 1.151 145 HE3 LYS 19 2HE LYS 19 -21.239 0.621 0.988 146 HZ1 LYS 19 3HZ LYS 19 -23.463 0.928 1.903 147 HZ2 LYS 19 1HZ LYS 19 -22.821 1.793 3.214 148 HZ3 LYS 19 2HZ LYS 19 -22.449 0.149 3.018 149 H ARG 20 H ARG 20 -19.398 6.660 1.527 150 HA ARG 20 HA ARG 20 -20.940 7.667 -0.639 151 HB2 ARG 20 1HB ARG 20 -21.563 8.364 1.540 152 HB3 ARG 20 2HB ARG 20 -19.922 8.845 1.942 153 HG2 ARG 20 1HG ARG 20 -21.231 10.813 1.631 154 HG3 ARG 20 2HG ARG 20 -20.107 10.676 0.281 155 HD2 ARG 20 1HD ARG 20 -22.209 11.329 -0.612 156 HD3 ARG 20 2HD ARG 20 -21.963 9.637 -1.040 157 HE ARG 20 HE ARG 20 -23.667 9.024 0.434 158 HH11 ARG 20 1HH1 ARG 20 -23.049 12.481 0.553 159 HH12 ARG 20 2HH1 ARG 20 -24.556 12.850 1.342 160 HH21 ARG 20 1HH2 ARG 20 -25.658 9.509 1.441 161 HH22 ARG 20 2HH2 ARG 20 -26.064 11.160 1.810 162 H LEU 21 H LEU 21 -17.780 8.566 0.702 163 HA LEU 21 HA LEU 21 -17.269 10.746 -0.953 164 HB2 LEU 21 1HB LEU 21 -15.959 10.451 0.983 165 HB3 LEU 21 2HB LEU 21 -15.481 8.832 0.515 166 HG LEU 21 HG LEU 21 -14.162 9.811 -1.351 167 HD11 LEU 21 1HD1 LEU 21 -13.639 12.219 -1.264 168 HD12 LEU 21 2HD1 LEU 21 -14.850 12.422 0.001 169 HD13 LEU 21 3HD1 LEU 21 -15.340 11.917 -1.617 170 HD21 LEU 21 3HD2 LEU 21 -12.343 10.646 0.080 171 HD22 LEU 21 1HD2 LEU 21 -13.084 9.180 0.725 172 HD23 LEU 21 2HD2 LEU 21 -13.473 10.750 1.431 173 H GLU 22 H GLU 22 -16.214 7.369 -1.383 174 HA GLU 22 HA GLU 22 -14.943 7.982 -3.869 175 HB2 GLU 22 1HB GLU 22 -15.556 5.312 -2.605 176 HB3 GLU 22 2HB GLU 22 -14.532 5.560 -4.016 177 HG2 GLU 22 1HG GLU 22 -14.025 6.715 -1.281 178 HG3 GLU 22 2HG GLU 22 -13.251 5.275 -1.936 179 H GLN 23 H GLN 23 -18.115 6.832 -2.945 180 HA GLN 23 HA GLN 23 -18.944 5.874 -5.467 181 HB2 GLN 23 1HB GLN 23 -20.250 5.562 -3.386 182 HB3 GLN 23 2HB GLN 23 -20.630 7.274 -3.388 183 HG2 GLN 23 1HG GLN 23 -21.791 7.013 -5.525 184 HG3 GLN 23 2HG GLN 23 -21.431 5.287 -5.504 185 HE21 GLN 23 2HE2 GLN 23 -21.825 5.111 -2.613 186 HE22 GLN 23 1HE2 GLN 23 -23.539 5.153 -2.359 187 H MET 24 H MET 24 -19.486 9.039 -3.943 188 HA MET 24 HA MET 24 -20.472 10.301 -6.253 189 HB2 MET 24 1HB MET 24 -19.978 12.425 -5.115 190 HB3 MET 24 2HB MET 24 -20.810 11.293 -4.063 191 HG2 MET 24 1HG MET 24 -18.621 10.729 -3.046 192 HG3 MET 24 2HG MET 24 -17.884 11.985 -4.036 193 HE1 MET 24 3HE MET 24 -19.528 15.238 -2.631 194 HE2 MET 24 1HE MET 24 -20.044 14.285 -4.023 195 HE3 MET 24 2HE MET 24 -18.326 14.569 -3.735 196 H LYS 25 H LYS 25 -17.222 9.826 -5.053 197 HA LYS 25 HA LYS 25 -15.738 11.393 -6.795 198 HB2 LYS 25 1HB LYS 25 -14.952 9.929 -4.848 199 HB3 LYS 25 2HB LYS 25 -14.988 8.587 -5.978 200 HG2 LYS 25 1HG LYS 25 -12.758 9.291 -5.914 201 HG3 LYS 25 2HG LYS 25 -13.407 9.945 -7.420 202 HD2 LYS 25 1HD LYS 25 -12.076 11.626 -6.289 203 HD3 LYS 25 2HD LYS 25 -13.774 12.101 -6.298 204 HE2 LYS 25 1HE LYS 25 -12.871 12.558 -4.126 205 HE3 LYS 25 2HE LYS 25 -13.983 11.198 -3.994 206 HZ1 LYS 25 3HZ LYS 25 -11.849 10.943 -2.770 207 HZ2 LYS 25 1HZ LYS 25 -11.045 10.896 -4.256 208 HZ3 LYS 25 2HZ LYS 25 -12.177 9.685 -3.852 209 H GLU 26 H GLU 26 -16.680 7.983 -7.197 210 HA GLU 26 HA GLU 26 -15.762 7.701 -9.835 211 HB2 GLU 26 1HB GLU 26 -16.280 5.809 -8.318 212 HB3 GLU 26 2HB GLU 26 -17.989 6.198 -8.451 213 HG2 GLU 26 1HG GLU 26 -17.836 5.794 -10.892 214 HG3 GLU 26 2HG GLU 26 -16.171 5.262 -10.655 215 H LYS 27 H LYS 27 -18.920 8.611 -8.518 216 HA LYS 27 HA LYS 27 -20.468 8.685 -10.808 217 HB2 LYS 27 1HB LYS 27 -20.459 10.258 -8.268 218 HB3 LYS 27 2HB LYS 27 -21.509 10.779 -9.575 219 HG2 LYS 27 1HG LYS 27 -21.546 7.970 -8.514 220 HG3 LYS 27 2HG LYS 27 -22.522 9.266 -7.819 221 HD2 LYS 27 1HD LYS 27 -22.606 8.338 -10.693 222 HD3 LYS 27 2HD LYS 27 -23.802 7.959 -9.454 223 HE2 LYS 27 1HE LYS 27 -23.114 10.738 -10.417 224 HE3 LYS 27 2HE LYS 27 -24.509 9.801 -10.950 225 HZ1 LYS 27 3HZ LYS 27 -25.472 9.923 -8.824 226 HZ2 LYS 27 1HZ LYS 27 -24.915 11.491 -9.145 227 HZ3 LYS 27 2HZ LYS 27 -24.047 10.472 -8.100 228 H VAL 28 H VAL 28 -18.149 11.050 -9.644 229 HA VAL 28 HA VAL 28 -18.814 13.071 -11.539 230 HB VAL 28 HB VAL 28 -16.271 12.704 -9.934 231 HG11 VAL 28 1HG1 VAL 28 -15.916 15.086 -10.334 232 HG12 VAL 28 2HG1 VAL 28 -17.344 15.124 -11.368 233 HG13 VAL 28 3HG1 VAL 28 -15.937 14.170 -11.840 234 HG21 VAL 28 3HG2 VAL 28 -17.216 14.352 -8.406 235 HG22 VAL 28 1HG2 VAL 28 -18.247 12.923 -8.511 236 HG23 VAL 28 2HG2 VAL 28 -18.697 14.402 -9.362 237 H MET 29 H MET 29 -16.456 10.468 -11.382 238 HA MET 29 HA MET 29 -15.061 11.229 -13.765 239 HB2 MET 29 1HB MET 29 -15.116 8.591 -12.294 240 HB3 MET 29 2HB MET 29 -13.976 9.029 -13.557 241 HG2 MET 29 1HG MET 29 -13.113 10.832 -12.152 242 HG3 MET 29 2HG MET 29 -14.252 10.384 -10.885 243 HE1 MET 29 3HE MET 29 -11.101 10.652 -10.400 244 HE2 MET 29 1HE MET 29 -10.827 9.239 -9.384 245 HE3 MET 29 2HE MET 29 -12.269 10.227 -9.149 246 H LYS 30 H LYS 30 -18.100 9.976 -13.346 247 HA LYS 30 HA LYS 30 -18.012 8.368 -15.785 248 HB2 LYS 30 1HB LYS 30 -20.217 8.728 -13.749 249 HB3 LYS 30 2HB LYS 30 -20.326 7.721 -15.178 250 HG2 LYS 30 1HG LYS 30 -18.677 7.309 -12.716 251 HG3 LYS 30 2HG LYS 30 -19.847 6.222 -13.465 252 HD2 LYS 30 1HD LYS 30 -18.305 5.997 -15.404 253 HD3 LYS 30 2HD LYS 30 -17.126 6.967 -14.520 254 HE2 LYS 30 1HE LYS 30 -16.573 4.642 -14.257 255 HE3 LYS 30 2HE LYS 30 -17.154 5.269 -12.715 256 HZ1 LYS 30 3HZ LYS 30 -18.843 3.762 -14.638 257 HZ2 LYS 30 1HZ LYS 30 -19.256 4.217 -13.056 258 HZ3 LYS 30 2HZ LYS 30 -18.050 3.055 -13.315 259 H ASP 31 H ASP 31 -18.571 11.522 -14.930 260 HA ASP 31 HA ASP 31 -20.738 12.003 -16.787 261 HB2 ASP 31 1HB ASP 31 -20.643 13.365 -14.767 262 HB3 ASP 31 2HB ASP 31 -19.044 13.956 -15.220 263 H GLN 32 H GLN 32 -20.630 13.022 -18.707 264 HA GLN 32 HA GLN 32 -18.296 12.526 -20.251 265 HB2 GLN 32 1HB GLN 32 -20.819 14.034 -20.949 266 HB3 GLN 32 2HB GLN 32 -19.582 13.555 -22.102 267 HG2 GLN 32 1HG GLN 32 -20.025 11.219 -21.656 268 HG3 GLN 32 2HG GLN 32 -21.209 11.659 -20.424 269 HE21 GLN 32 2HE2 GLN 32 -23.202 12.457 -21.051 270 HE22 GLN 32 1HE2 GLN 32 -23.784 12.346 -22.674 271 H ASP 33 H ASP 33 -19.739 15.452 -18.896 272 HA ASP 33 HA ASP 33 -18.053 17.210 -20.438 273 HB2 ASP 33 1HB ASP 33 -20.428 17.668 -19.455 274 HB3 ASP 33 2HB ASP 33 -19.553 18.055 -17.978 275 H VAL 34 H VAL 34 -18.254 16.084 -17.104 276 HA VAL 34 HA VAL 34 -16.177 17.514 -15.967 277 HB VAL 34 HB VAL 34 -17.161 14.722 -15.413 278 HG11 VAL 34 1HG1 VAL 34 -15.127 16.293 -13.835 279 HG12 VAL 34 2HG1 VAL 34 -14.827 14.809 -14.740 280 HG13 VAL 34 3HG1 VAL 34 -15.882 14.781 -13.327 281 HG21 VAL 34 3HG2 VAL 34 -18.131 15.772 -13.428 282 HG22 VAL 34 1HG2 VAL 34 -18.698 16.552 -14.905 283 HG23 VAL 34 2HG2 VAL 34 -17.460 17.326 -13.918 284 H GLN 35 H GLN 35 -15.964 14.269 -17.479 285 HA GLN 35 HA GLN 35 -13.159 14.102 -17.158 286 HB2 GLN 35 1HB GLN 35 -13.278 12.186 -18.682 287 HB3 GLN 35 2HB GLN 35 -14.493 12.111 -17.420 288 HG2 GLN 35 1HG GLN 35 -16.098 13.090 -19.118 289 HG3 GLN 35 2HG GLN 35 -14.861 12.744 -20.325 290 HE21 GLN 35 2HE2 GLN 35 -15.552 10.759 -17.505 291 HE22 GLN 35 1HE2 GLN 35 -16.132 9.394 -18.378 292 H ALA 36 H ALA 36 -15.180 15.339 -19.741 293 HA ALA 36 HA ALA 36 -13.129 15.774 -21.640 294 HB1 ALA 36 1HB ALA 36 -15.678 17.351 -21.256 295 HB2 ALA 36 2HB ALA 36 -15.529 15.870 -22.202 296 HB3 ALA 36 3HB ALA 36 -14.671 17.327 -22.705 297 H PHE 37 H PHE 37 -14.423 17.722 -18.998 298 HA PHE 37 HA PHE 37 -12.837 20.018 -19.428 299 HB2 PHE 37 1HB PHE 37 -14.782 20.169 -18.023 300 HB3 PHE 37 2HB PHE 37 -14.168 18.920 -16.946 301 HD1 PHE 37 HD1 PHE 37 -13.288 22.298 -18.238 302 HD2 PHE 37 HD2 PHE 37 -13.106 19.532 -15.014 303 HE1 PHE 37 HE1 PHE 37 -12.277 24.029 -16.816 304 HE2 PHE 37 HE2 PHE 37 -12.102 21.261 -13.581 305 HZ PHE 37 HZ PHE 37 -11.685 23.516 -14.483 306 H LEU 38 H LEU 38 -12.357 17.092 -17.512 307 HA LEU 38 HA LEU 38 -10.004 17.786 -16.200 308 HB2 LEU 38 1HB LEU 38 -11.406 15.305 -16.864 309 HB3 LEU 38 2HB LEU 38 -9.673 15.109 -16.698 310 HG LEU 38 HG LEU 38 -10.716 14.631 -14.591 311 HD11 LEU 38 1HD1 LEU 38 -8.564 15.762 -14.523 312 HD12 LEU 38 2HD1 LEU 38 -9.569 16.245 -13.157 313 HD13 LEU 38 3HD1 LEU 38 -9.375 17.329 -14.536 314 HD21 LEU 38 3HD2 LEU 38 -12.793 15.869 -14.899 315 HD22 LEU 38 1HD2 LEU 38 -11.916 17.392 -14.748 316 HD23 LEU 38 2HD2 LEU 38 -12.020 16.296 -13.371 317 H LYS 39 H LYS 39 -10.422 16.301 -19.398 318 HA LYS 39 HA LYS 39 -7.572 16.204 -19.822 319 HB2 LYS 39 1HB LYS 39 -8.139 15.393 -22.070 320 HB3 LYS 39 2HB LYS 39 -8.960 14.483 -20.814 321 HG2 LYS 39 1HG LYS 39 -10.997 15.817 -21.238 322 HG3 LYS 39 2HG LYS 39 -10.156 16.608 -22.574 323 HD2 LYS 39 1HD LYS 39 -10.613 13.633 -22.346 324 HD3 LYS 39 2HD LYS 39 -11.613 14.735 -23.293 325 HE2 LYS 39 1HE LYS 39 -9.686 15.320 -24.670 326 HE3 LYS 39 2HE LYS 39 -8.660 14.261 -23.702 327 HZ1 LYS 39 3HZ LYS 39 -9.463 13.289 -25.841 328 HZ2 LYS 39 1HZ LYS 39 -11.034 13.304 -25.202 329 HZ3 LYS 39 2HZ LYS 39 -9.832 12.364 -24.469 330 H GLU 40 H GLU 40 -10.092 18.454 -20.354 331 HA GLU 40 HA GLU 40 -8.894 20.030 -22.382 332 HB2 GLU 40 1HB GLU 40 -11.295 20.151 -21.626 333 HB3 GLU 40 2HB GLU 40 -10.737 20.952 -20.174 334 HG2 GLU 40 1HG GLU 40 -9.866 22.796 -21.489 335 HG3 GLU 40 2HG GLU 40 -10.375 21.988 -22.971 336 H ASN 41 H ASN 41 -9.005 20.326 -18.866 337 HA ASN 41 HA ASN 41 -6.815 22.289 -18.983 338 HB2 ASN 41 1HB ASN 41 -9.016 21.808 -16.988 339 HB3 ASN 41 2HB ASN 41 -7.576 22.719 -16.547 340 HD21 ASN 41 2HD2 ASN 41 -10.454 22.665 -18.499 341 HD22 ASN 41 1HD2 ASN 41 -10.435 24.338 -18.926 342 H GLU 42 H GLU 42 -6.432 19.390 -19.152 343 HA GLU 42 HA GLU 42 -5.600 18.334 -16.665 344 HB2 GLU 42 1HB GLU 42 -4.460 16.608 -17.959 345 HB3 GLU 42 2HB GLU 42 -6.066 16.904 -18.603 346 HG2 GLU 42 1HG GLU 42 -5.127 18.213 -20.414 347 HG3 GLU 42 2HG GLU 42 -3.507 17.998 -19.749 348 H GLU 43 H GLU 43 -4.238 20.645 -18.703 349 HA GLU 43 HA GLU 43 -1.488 20.289 -18.030 350 HB2 GLU 43 1HB GLU 43 -2.272 21.406 -20.093 351 HB3 GLU 43 2HB GLU 43 -2.952 22.701 -19.120 352 HG2 GLU 43 1HG GLU 43 -0.671 23.225 -18.312 353 HG3 GLU 43 2HG GLU 43 -0.042 21.997 -19.412 354 H VAL 44 H VAL 44 -4.196 21.620 -16.443 355 HA VAL 44 HA VAL 44 -2.465 23.204 -14.649 356 HB VAL 44 HB VAL 44 -5.363 23.766 -15.307 357 HG11 VAL 44 1HG1 VAL 44 -4.658 24.502 -13.071 358 HG12 VAL 44 2HG1 VAL 44 -5.013 25.864 -14.131 359 HG13 VAL 44 3HG1 VAL 44 -3.339 25.418 -13.798 360 HG21 VAL 44 3HG2 VAL 44 -2.888 25.200 -16.260 361 HG22 VAL 44 1HG2 VAL 44 -4.555 25.671 -16.589 362 HG23 VAL 44 2HG2 VAL 44 -3.919 24.161 -17.247 363 H ILE 45 H ILE 45 -5.234 21.048 -14.901 364 HA ILE 45 HA ILE 45 -5.956 21.209 -12.142 365 HB ILE 45 HB ILE 45 -6.736 19.147 -14.201 366 HG12 ILE 45 1HG1 ILE 45 -8.207 21.615 -13.262 367 HG13 ILE 45 2HG1 ILE 45 -7.385 21.454 -14.811 368 HG21 ILE 45 1HG2 ILE 45 -8.617 18.657 -12.712 369 HG22 ILE 45 2HG2 ILE 45 -7.978 19.802 -11.533 370 HG23 ILE 45 3HG2 ILE 45 -7.070 18.342 -11.924 371 HD11 ILE 45 3HD1 ILE 45 -9.743 19.830 -13.887 372 HD12 ILE 45 1HD1 ILE 45 -8.911 19.654 -15.431 373 HD13 ILE 45 2HD1 ILE 45 -9.775 21.147 -15.059 374 H ASP 46 H ASP 46 -5.509 19.908 -10.497 375 HA ASP 46 HA ASP 46 -3.514 17.772 -10.864 376 HB2 ASP 46 1HB ASP 46 -4.144 19.616 -8.575 377 HB3 ASP 46 2HB ASP 46 -3.378 18.063 -8.266 378 H GLN 47 H GLN 47 -3.761 15.883 -9.383 379 HA GLN 47 HA GLN 47 -6.433 14.893 -9.263 380 HB2 GLN 47 1HB GLN 47 -4.011 13.931 -7.722 381 HB3 GLN 47 2HB GLN 47 -5.505 13.039 -7.967 382 HG2 GLN 47 1HG GLN 47 -5.052 12.988 -10.383 383 HG3 GLN 47 2HG GLN 47 -3.527 13.826 -10.093 384 HE21 GLN 47 2HE2 GLN 47 -3.967 11.214 -11.269 385 HE22 GLN 47 1HE2 GLN 47 -3.119 10.078 -10.265 386 H LYS 48 H LYS 48 -4.223 16.404 -7.031 387 HA LYS 48 HA LYS 48 -5.679 16.351 -4.656 388 HB2 LYS 48 1HB LYS 48 -3.899 18.547 -5.744 389 HB3 LYS 48 2HB LYS 48 -4.387 18.374 -4.067 390 HG2 LYS 48 1HG LYS 48 -3.116 16.383 -3.811 391 HG3 LYS 48 2HG LYS 48 -2.838 16.263 -5.548 392 HD2 LYS 48 1HD LYS 48 -1.781 18.450 -3.755 393 HD3 LYS 48 2HD LYS 48 -0.851 17.074 -4.351 394 HE2 LYS 48 1HE LYS 48 -1.372 17.839 -6.675 395 HE3 LYS 48 2HE LYS 48 -2.087 19.288 -5.974 396 HZ1 LYS 48 3HZ LYS 48 0.085 19.753 -4.939 397 HZ2 LYS 48 1HZ LYS 48 0.160 19.739 -6.632 398 HZ3 LYS 48 2HZ LYS 48 0.742 18.418 -5.744 399 H MET 49 H MET 49 -5.752 18.626 -7.344 400 HA MET 49 HA MET 49 -7.587 20.468 -6.347 401 HB2 MET 49 1HB MET 49 -6.140 20.683 -8.409 402 HB3 MET 49 2HB MET 49 -7.286 19.645 -9.240 403 HG2 MET 49 1HG MET 49 -9.048 21.271 -8.860 404 HG3 MET 49 2HG MET 49 -7.908 22.301 -7.996 405 HE1 MET 49 3HE MET 49 -5.438 23.377 -10.834 406 HE2 MET 49 1HE MET 49 -5.241 21.921 -9.856 407 HE3 MET 49 2HE MET 49 -5.800 23.416 -9.109 408 H ILE 50 H ILE 50 -8.045 17.403 -8.023 409 HA ILE 50 HA ILE 50 -10.807 17.621 -8.518 410 HB ILE 50 HB ILE 50 -9.080 15.170 -8.148 411 HG12 ILE 50 1HG1 ILE 50 -8.447 16.534 -10.052 412 HG13 ILE 50 2HG1 ILE 50 -9.237 15.067 -10.620 413 HG21 ILE 50 1HG2 ILE 50 -11.924 15.373 -9.128 414 HG22 ILE 50 2HG2 ILE 50 -11.353 14.533 -7.685 415 HG23 ILE 50 3HG2 ILE 50 -10.907 13.941 -9.284 416 HD11 ILE 50 3HD1 ILE 50 -9.965 16.990 -11.894 417 HD12 ILE 50 1HD1 ILE 50 -10.496 17.793 -10.417 418 HD13 ILE 50 2HD1 ILE 50 -11.310 16.327 -10.965 419 H GLU 51 H GLU 51 -9.149 15.839 -5.922 420 HA GLU 51 HA GLU 51 -11.258 15.095 -4.356 421 HB2 GLU 51 1HB GLU 51 -8.563 16.104 -3.426 422 HB3 GLU 51 2HB GLU 51 -9.688 15.185 -2.441 423 HG2 GLU 51 1HG GLU 51 -8.447 14.176 -4.986 424 HG3 GLU 51 2HG GLU 51 -7.809 13.862 -3.373 425 H LYS 52 H LYS 52 -9.534 18.199 -4.276 426 HA LYS 52 HA LYS 52 -11.007 19.249 -2.090 427 HB2 LYS 52 1HB LYS 52 -9.352 20.608 -4.200 428 HB3 LYS 52 2HB LYS 52 -10.054 21.439 -2.820 429 HG2 LYS 52 1HG LYS 52 -8.810 19.751 -1.377 430 HG3 LYS 52 2HG LYS 52 -7.914 19.347 -2.846 431 HD2 LYS 52 1HD LYS 52 -7.188 21.637 -3.075 432 HD3 LYS 52 2HD LYS 52 -8.161 22.109 -1.681 433 HE2 LYS 52 1HE LYS 52 -6.800 20.528 -0.303 434 HE3 LYS 52 2HE LYS 52 -5.754 20.300 -1.705 435 HZ1 LYS 52 3HZ LYS 52 -6.276 22.881 -0.331 436 HZ2 LYS 52 1HZ LYS 52 -5.269 22.669 -1.681 437 HZ3 LYS 52 2HZ LYS 52 -4.858 21.955 -0.197 438 H SER 53 H SER 53 -11.429 19.447 -5.580 439 HA SER 53 HA SER 53 -13.717 21.252 -5.182 440 HB2 SER 53 1HB SER 53 -12.436 20.483 -7.806 441 HB3 SER 53 2HB SER 53 -13.490 21.860 -7.479 442 HG SER 53 HG SER 53 -10.838 21.441 -6.560 443 H LEU 54 H LEU 54 -13.498 18.257 -4.802 444 HA LEU 54 HA LEU 54 -14.835 16.933 -6.890 445 HB2 LEU 54 1HB LEU 54 -13.412 16.108 -4.825 446 HB3 LEU 54 2HB LEU 54 -14.985 15.982 -4.065 447 HG LEU 54 HG LEU 54 -14.048 13.885 -5.097 448 HD11 LEU 54 1HD1 LEU 54 -16.183 13.151 -5.950 449 HD12 LEU 54 2HD1 LEU 54 -16.724 14.825 -6.063 450 HD13 LEU 54 3HD1 LEU 54 -16.377 14.116 -4.488 451 HD21 LEU 54 3HD2 LEU 54 -13.173 14.889 -7.148 452 HD22 LEU 54 1HD2 LEU 54 -14.818 15.269 -7.660 453 HD23 LEU 54 2HD2 LEU 54 -14.312 13.589 -7.494 454 H ASN 55 H ASN 55 -15.939 18.239 -3.815 455 HA ASN 55 HA ASN 55 -18.644 17.622 -4.006 456 HB2 ASN 55 1HB ASN 55 -19.039 19.392 -2.397 457 HB3 ASN 55 2HB ASN 55 -17.545 18.564 -1.978 458 HD21 ASN 55 2HD2 ASN 55 -18.985 21.515 -3.037 459 HD22 ASN 55 1HD2 ASN 55 -17.559 22.501 -2.918 460 H LYS 56 H LYS 56 -16.807 20.228 -5.494 461 HA LYS 56 HA LYS 56 -19.017 21.713 -6.464 462 HB2 LYS 56 1HB LYS 56 -16.121 21.551 -7.262 463 HB3 LYS 56 2HB LYS 56 -17.258 22.526 -8.176 464 HG2 LYS 56 1HG LYS 56 -16.738 22.847 -5.231 465 HG3 LYS 56 2HG LYS 56 -15.953 23.795 -6.499 466 HD2 LYS 56 1HD LYS 56 -18.240 24.479 -7.270 467 HD3 LYS 56 2HD LYS 56 -18.892 23.700 -5.828 468 HE2 LYS 56 1HE LYS 56 -17.514 25.178 -4.427 469 HE3 LYS 56 2HE LYS 56 -16.910 25.970 -5.881 470 HZ1 LYS 56 3HZ LYS 56 -18.684 27.256 -4.925 471 HZ2 LYS 56 1HZ LYS 56 -19.729 25.920 -4.954 472 HZ3 LYS 56 2HZ LYS 56 -19.201 26.617 -6.408 473 H LEU 57 H LEU 57 -16.878 19.362 -8.045 474 HA LEU 57 HA LEU 57 -18.198 19.413 -10.525 475 HB2 LEU 57 1HB LEU 57 -16.261 17.577 -9.211 476 HB3 LEU 57 2HB LEU 57 -17.082 17.021 -10.659 477 HG LEU 57 HG LEU 57 -16.199 18.950 -11.905 478 HD11 LEU 57 1HD1 LEU 57 -14.719 19.587 -9.359 479 HD12 LEU 57 2HD1 LEU 57 -16.013 20.545 -10.081 480 HD13 LEU 57 3HD1 LEU 57 -14.473 20.363 -10.923 481 HD21 LEU 57 3HD2 LEU 57 -13.863 18.240 -11.965 482 HD22 LEU 57 1HD2 LEU 57 -14.964 16.864 -11.917 483 HD23 LEU 57 2HD2 LEU 57 -14.094 17.349 -10.460 484 H TYR 58 H TYR 58 -18.639 17.328 -7.692 485 HA TYR 58 HA TYR 58 -20.546 15.627 -8.917 486 HB2 TYR 58 1HB TYR 58 -19.301 15.100 -6.802 487 HB3 TYR 58 2HB TYR 58 -20.327 16.269 -5.968 488 HD1 TYR 58 HD2 TYR 58 -20.635 13.302 -8.206 489 HD2 TYR 58 HD1 TYR 58 -22.234 15.463 -4.911 490 HE1 TYR 58 HE2 TYR 58 -22.325 11.553 -7.890 491 HE2 TYR 58 HE1 TYR 58 -23.939 13.719 -4.588 492 HH TYR 58 HH TYR 58 -25.048 11.962 -5.854 493 H GLU 59 H GLU 59 -20.813 18.587 -7.024 494 HA GLU 59 HA GLU 59 -23.618 18.685 -6.867 495 HB2 GLU 59 1HB GLU 59 -21.953 20.058 -5.565 496 HB3 GLU 59 2HB GLU 59 -21.721 21.033 -7.007 497 HG2 GLU 59 1HG GLU 59 -23.861 21.936 -6.885 498 HG3 GLU 59 2HG GLU 59 -24.435 20.665 -5.803 499 H TYR 60 H TYR 60 -21.320 19.896 -9.232 500 HA TYR 60 HA TYR 60 -22.998 21.296 -10.934 501 HB2 TYR 60 1HB TYR 60 -20.634 21.447 -11.218 502 HB3 TYR 60 2HB TYR 60 -20.481 19.711 -11.465 503 HD1 TYR 60 HD1 TYR 60 -21.960 22.776 -12.988 504 HD2 TYR 60 HD2 TYR 60 -20.468 18.837 -13.627 505 HE1 TYR 60 HE1 TYR 60 -22.122 23.106 -15.410 506 HE2 TYR 60 HE2 TYR 60 -20.638 19.169 -16.061 507 HH TYR 60 HH TYR 60 -21.323 22.290 -17.437 508 H ILE 61 H ILE 61 -22.090 17.845 -11.124 509 HA ILE 61 HA ILE 61 -23.597 17.403 -13.488 510 HB ILE 61 HB ILE 61 -23.150 15.029 -13.183 511 HG12 ILE 61 1HG1 ILE 61 -21.934 15.827 -10.528 512 HG13 ILE 61 2HG1 ILE 61 -23.437 14.935 -10.726 513 HG21 ILE 61 1HG2 ILE 61 -21.430 16.415 -14.173 514 HG22 ILE 61 2HG2 ILE 61 -20.689 15.154 -13.188 515 HG23 ILE 61 3HG2 ILE 61 -20.790 16.805 -12.577 516 HD11 ILE 61 3HD1 ILE 61 -21.570 13.484 -10.136 517 HD12 ILE 61 1HD1 ILE 61 -20.721 13.982 -11.600 518 HD13 ILE 61 2HD1 ILE 61 -22.235 13.081 -11.719 519 H GLU 62 H GLU 62 -24.381 17.152 -10.088 520 HA GLU 62 HA GLU 62 -26.826 15.699 -10.534 521 HB2 GLU 62 1HB GLU 62 -25.895 17.242 -8.109 522 HB3 GLU 62 2HB GLU 62 -27.260 16.136 -8.157 523 HG2 GLU 62 1HG GLU 62 -24.420 15.356 -8.727 524 HG3 GLU 62 2HG GLU 62 -25.201 15.187 -7.157 525 H GLN 63 H GLN 63 -25.849 18.947 -10.749 526 HA GLN 63 HA GLN 63 -28.468 20.080 -10.288 527 HB2 GLN 63 1HB GLN 63 -25.842 21.211 -11.190 528 HB3 GLN 63 2HB GLN 63 -27.314 22.165 -11.286 529 HG2 GLN 63 1HG GLN 63 -27.641 21.929 -8.887 530 HG3 GLN 63 2HG GLN 63 -26.191 20.935 -8.778 531 HE21 GLN 63 2HE2 GLN 63 -24.729 22.554 -10.712 532 HE22 GLN 63 1HE2 GLN 63 -24.296 24.008 -9.888 533 H SER 64 H SER 64 -28.929 21.885 -12.149 534 HA SER 64 HA SER 64 -29.957 20.345 -14.319 535 HB2 SER 64 1HB SER 64 -30.735 22.662 -15.093 536 HB3 SER 64 2HB SER 64 -31.344 22.100 -13.534 537 HG SER 64 HG SER 64 -29.114 23.822 -13.913 538 H LYS 65 H LYS 65 -28.820 19.772 -16.013 539 HA LYS 65 HA LYS 65 -26.281 20.888 -16.648 540 HB2 LYS 65 1HB LYS 65 -26.760 18.515 -16.942 541 HB3 LYS 65 2HB LYS 65 -28.022 18.887 -18.106 542 HG2 LYS 65 1HG LYS 65 -26.102 18.150 -19.303 543 HG3 LYS 65 2HG LYS 65 -26.275 19.886 -19.576 544 HD2 LYS 65 1HD LYS 65 -24.598 20.285 -17.798 545 HD3 LYS 65 2HD LYS 65 -24.379 18.541 -17.657 546 HE2 LYS 65 1HE LYS 65 -23.728 18.483 -20.050 547 HE3 LYS 65 2HE LYS 65 -23.829 20.244 -20.080 548 HZ1 LYS 65 3HZ LYS 65 -21.562 19.541 -19.738 549 HZ2 LYS 65 1HZ LYS 65 -22.013 18.625 -18.381 550 HZ3 LYS 65 2HZ LYS 65 -22.131 20.314 -18.339 551 H ASN 66 H ASN 66 -29.499 21.511 -17.732 552 HA ASN 66 HA ASN 66 -28.477 22.838 -20.158 553 HB2 ASN 66 1HB ASN 66 -30.046 20.722 -20.217 554 HB3 ASN 66 2HB ASN 66 -31.306 21.905 -19.900 555 HD21 ASN 66 2HD2 ASN 66 -30.806 20.206 -22.231 556 HD22 ASN 66 1HD2 ASN 66 -30.690 21.287 -23.575 557 H CYS 67 H CYS 67 -30.626 24.274 -20.935 558 HA CYS 67 HA CYS 67 -31.506 25.849 -18.627 559 HB2 CYS 67 1HB CYS 67 -30.874 27.890 -19.464 560 HB3 CYS 67 2HB CYS 67 -29.555 26.910 -20.051 561 H SER 68 H SER 68 -33.510 26.815 -18.925 562 HA SER 68 HA SER 68 -35.216 25.058 -20.422 563 HB2 SER 68 1HB SER 68 -35.749 25.978 -18.140 564 HB3 SER 68 2HB SER 68 -36.041 27.539 -18.904 565 HG SER 68 HG SER 68 -37.433 25.811 -20.286 566 H TYR 69 H TYR 69 -33.715 27.991 -21.158 567 HA TYR 69 HA TYR 69 -35.491 29.149 -22.968 568 HB2 TYR 69 1HB TYR 69 -33.308 30.073 -22.040 569 HB3 TYR 69 2HB TYR 69 -32.489 29.095 -23.247 570 HD1 TYR 69 HD2 TYR 69 -34.617 32.002 -22.679 571 HD2 TYR 69 HD1 TYR 69 -32.583 29.679 -25.595 572 HE1 TYR 69 HE2 TYR 69 -34.931 33.803 -24.317 573 HE2 TYR 69 HE1 TYR 69 -32.884 31.473 -27.245 574 HH TYR 69 HH TYR 69 -34.470 33.391 -27.612 575 H CYS 70 H CYS 70 -33.395 26.364 -23.231 576 HA CYS 70 HA CYS 70 -33.966 26.263 -26.124 577 HB2 CYS 70 1HB CYS 70 -31.866 25.071 -26.448 578 HB3 CYS 70 2HB CYS 70 -31.581 26.613 -25.647 579 H SER 71 H SER 71 -34.240 24.580 -23.131 580 HA SER 71 HA SER 71 -35.163 22.189 -24.573 581 HB2 SER 71 1HB SER 71 -34.816 21.058 -22.300 582 HB3 SER 71 2HB SER 71 -33.361 21.534 -23.176 583 HG SER 71 HG SER 71 -34.549 22.720 -20.911 584 H GLU 72 H GLU 72 -37.165 21.320 -24.061 585 HA GLU 72 HA GLU 72 -38.918 23.137 -22.535 586 HB2 GLU 72 1HB GLU 72 -39.246 22.885 -25.060 587 HB3 GLU 72 2HB GLU 72 -39.799 21.251 -24.719 588 HG2 GLU 72 1HG GLU 72 -41.563 22.196 -23.267 589 HG3 GLU 72 2HG GLU 72 -41.040 23.814 -23.737 590 H ASP 73 H ASP 73 -37.299 20.786 -21.671 591 HA ASP 73 HA ASP 73 -39.157 18.747 -20.941 592 HB2 ASP 73 1HB ASP 73 -36.850 18.112 -21.054 593 HB3 ASP 73 2HB ASP 73 -36.371 19.417 -19.973 594 H GLU 74 H GLU 74 -40.235 18.473 -19.068 595 HA GLU 74 HA GLU 74 -41.134 20.760 -17.706 596 HB2 GLU 74 1HB GLU 74 -42.366 18.577 -18.040 597 HB3 GLU 74 2HB GLU 74 -41.363 17.897 -16.768 598 HG2 GLU 74 1HG GLU 74 -43.508 18.535 -15.881 599 HG3 GLU 74 2HG GLU 74 -42.243 19.557 -15.200 600 H ASN 75 H ASN 75 -38.428 18.682 -17.160 601 HA ASN 75 HA ASN 75 -38.205 19.549 -14.364 602 HB2 ASN 75 1HB ASN 75 -36.543 17.441 -15.738 603 HB3 ASN 75 2HB ASN 75 -36.735 17.702 -14.010 604 HD21 ASN 75 2HD2 ASN 75 -38.131 16.402 -16.892 605 HD22 ASN 75 1HD2 ASN 75 -39.400 15.496 -16.126 606 H CYS 76 H CYS 76 -37.165 20.627 -17.282 607 HA CYS 76 HA CYS 76 -34.375 21.011 -16.517 608 HB2 CYS 76 1HB CYS 76 -33.964 21.662 -18.777 609 HB3 CYS 76 2HB CYS 76 -34.993 20.241 -18.824 610 HG CYS 76 HG CYS 76 -37.340 21.969 -19.135 611 H ASN 77 H ASN 77 -36.770 22.491 -15.360 612 HA ASN 77 HA ASN 77 -36.462 25.202 -16.195 613 HB2 ASN 77 1HB ASN 77 -38.540 24.349 -15.105 614 HB3 ASN 77 2HB ASN 77 -37.646 24.207 -13.593 615 HD21 ASN 77 2HD2 ASN 77 -37.097 26.056 -12.458 616 HD22 ASN 77 1HD2 ASN 77 -37.744 27.618 -12.839 617 H ASN 78 H ASN 78 -34.435 25.873 -16.076 618 HA ASN 78 HA ASN 78 -32.814 25.496 -13.700 619 HB2 ASN 78 1HB ASN 78 -31.943 25.314 -16.068 620 HB3 ASN 78 2HB ASN 78 -32.198 27.043 -16.233 621 HD21 ASN 78 2HD2 ASN 78 -29.785 25.377 -16.402 622 HD22 ASN 78 1HD2 ASN 78 -28.670 26.070 -15.278 623 H LEU 79 H LEU 79 -32.238 27.139 -12.273 624 HA LEU 79 HA LEU 79 -34.012 29.293 -11.939 625 HB2 LEU 79 1HB LEU 79 -32.628 30.056 -10.157 626 HB3 LEU 79 2HB LEU 79 -32.684 28.309 -10.095 627 HG LEU 79 HG LEU 79 -30.372 29.748 -11.373 628 HD11 LEU 79 1HD1 LEU 79 -29.219 29.547 -9.209 629 HD12 LEU 79 2HD1 LEU 79 -30.737 29.032 -8.472 630 HD13 LEU 79 3HD1 LEU 79 -30.592 30.655 -9.146 631 HD21 LEU 79 3HD2 LEU 79 -30.493 27.387 -11.841 632 HD22 LEU 79 1HD2 LEU 79 -30.728 27.023 -10.131 633 HD23 LEU 79 2HD2 LEU 79 -29.190 27.678 -10.690 634 H LEU 80 H LEU 80 -30.785 29.105 -13.336 635 HA LEU 80 HA LEU 80 -30.933 31.849 -14.274 636 HB2 LEU 80 1HB LEU 80 -28.887 29.659 -14.447 637 HB3 LEU 80 2HB LEU 80 -28.773 31.063 -15.494 638 HG LEU 80 HG LEU 80 -28.973 31.351 -12.504 639 HD11 LEU 80 1HD1 LEU 80 -26.464 31.099 -14.153 640 HD12 LEU 80 2HD1 LEU 80 -27.036 29.941 -12.951 641 HD13 LEU 80 3HD1 LEU 80 -26.538 31.559 -12.453 642 HD21 LEU 80 3HD2 LEU 80 -27.940 33.509 -12.958 643 HD22 LEU 80 1HD2 LEU 80 -29.432 33.319 -13.880 644 HD23 LEU 80 2HD2 LEU 80 -27.871 33.120 -14.677 645 H GLU 81 H GLU 81 -30.678 32.274 -16.654 646 HA GLU 81 HA GLU 81 -32.110 30.253 -18.232 647 HB2 GLU 81 1HB GLU 81 -33.047 33.123 -18.021 648 HB3 GLU 81 2HB GLU 81 -33.825 31.815 -18.900 649 HG2 GLU 81 1HG GLU 81 -34.333 30.686 -16.813 650 HG3 GLU 81 2HG GLU 81 -33.506 31.955 -15.912 651 H GLY 82 H GLY 82 -31.492 30.170 -20.258 652 HA2 GLY 82 1HA GLY 82 -30.523 30.790 -22.267 653 HA3 GLY 82 2HA GLY 82 -30.306 32.412 -21.625 654 H TYR 83 H TYR 83 -29.134 30.222 -19.417 655 HA TYR 83 HA TYR 83 -26.431 30.195 -20.579 656 HB2 TYR 83 1HB TYR 83 -27.232 31.049 -17.791 657 HB3 TYR 83 2HB TYR 83 -25.580 30.624 -18.222 658 HD1 TYR 83 HD2 TYR 83 -28.305 33.057 -18.851 659 HD2 TYR 83 HD1 TYR 83 -24.180 32.158 -19.364 660 HE1 TYR 83 HE2 TYR 83 -27.901 35.363 -19.607 661 HE2 TYR 83 HE1 TYR 83 -23.764 34.460 -20.115 662 HH TYR 83 HH TYR 83 -25.068 36.319 -21.153 663 H HIS 84 H HIS 84 -25.043 28.517 -19.761 664 HA HIS 84 HA HIS 84 -26.415 26.371 -18.262 665 HB2 HIS 84 1HB HIS 84 -24.475 26.019 -20.561 666 HB3 HIS 84 2HB HIS 84 -25.011 24.718 -19.513 667 HD1 HIS 84 HD1 HIS 84 -26.021 23.430 -21.521 668 HD2 HIS 84 HD2 HIS 84 -27.680 27.186 -20.895 669 HE1 HIS 84 HE1 HIS 84 -27.996 23.617 -23.095 670 HA PRO 85 HA PRO 85 -22.860 26.675 -15.637 671 HB2 PRO 85 1HB PRO 85 -22.947 24.306 -14.377 672 HB3 PRO 85 2HB PRO 85 -24.163 25.559 -14.105 673 HG2 PRO 85 1HG PRO 85 -24.322 23.098 -15.791 674 HG3 PRO 85 2HG PRO 85 -25.555 23.818 -14.742 675 HD2 PRO 85 1HD PRO 85 -25.467 24.128 -17.475 676 HD3 PRO 85 2HD PRO 85 -26.255 25.265 -16.367 677 H LYS 86 H LYS 86 -20.710 26.107 -15.494 678 HA LYS 86 HA LYS 86 -19.718 23.762 -16.922 679 HB2 LYS 86 1HB LYS 86 -18.016 25.090 -18.129 680 HB3 LYS 86 2HB LYS 86 -19.651 25.494 -18.637 681 HG2 LYS 86 1HG LYS 86 -19.617 27.553 -17.542 682 HG3 LYS 86 2HG LYS 86 -18.243 27.097 -16.537 683 HD2 LYS 86 1HD LYS 86 -16.782 27.135 -18.492 684 HD3 LYS 86 2HD LYS 86 -18.160 27.542 -19.519 685 HE2 LYS 86 1HE LYS 86 -18.416 29.658 -18.514 686 HE3 LYS 86 2HE LYS 86 -17.345 29.242 -17.177 687 HZ1 LYS 86 3HZ LYS 86 -15.487 29.222 -18.699 688 HZ2 LYS 86 1HZ LYS 86 -16.287 30.713 -18.794 689 HZ3 LYS 86 2HZ LYS 86 -16.500 29.551 -20.015 690 H LEU 87 H LEU 87 -17.463 23.295 -16.384 691 HA LEU 87 HA LEU 87 -16.792 24.159 -13.696 692 HB2 LEU 87 1HB LEU 87 -15.341 22.229 -15.513 693 HB3 LEU 87 2HB LEU 87 -14.950 22.538 -13.837 694 HG LEU 87 HG LEU 87 -16.066 20.524 -13.760 695 HD11 LEU 87 1HD1 LEU 87 -16.981 22.100 -12.144 696 HD12 LEU 87 2HD1 LEU 87 -18.188 20.923 -12.661 697 HD13 LEU 87 3HD1 LEU 87 -18.231 22.566 -13.300 698 HD21 LEU 87 3HD2 LEU 87 -18.116 20.002 -14.974 699 HD22 LEU 87 1HD2 LEU 87 -16.807 20.458 -16.066 700 HD23 LEU 87 2HD2 LEU 87 -18.096 21.609 -15.703 701 H VAL 88 H VAL 88 -15.107 25.470 -13.152 702 HA VAL 88 HA VAL 88 -13.315 26.361 -15.309 703 HB VAL 88 HB VAL 88 -13.431 28.659 -14.564 704 HG11 VAL 88 1HG1 VAL 88 -16.187 27.512 -14.981 705 HG12 VAL 88 2HG1 VAL 88 -15.050 27.994 -16.243 706 HG13 VAL 88 3HG1 VAL 88 -15.740 29.208 -15.166 707 HG21 VAL 88 3HG2 VAL 88 -14.976 29.411 -12.846 708 HG22 VAL 88 1HG2 VAL 88 -13.829 28.246 -12.183 709 HG23 VAL 88 2HG2 VAL 88 -15.483 27.748 -12.548 710 H VAL 89 H VAL 89 -11.239 27.027 -14.620 711 HA VAL 89 HA VAL 89 -10.545 25.961 -11.980 712 HB VAL 89 HB VAL 89 -9.343 24.868 -13.761 713 HG11 VAL 89 1HG1 VAL 89 -9.486 26.605 -15.465 714 HG12 VAL 89 2HG1 VAL 89 -7.828 26.045 -15.260 715 HG13 VAL 89 3HG1 VAL 89 -8.328 27.590 -14.569 716 HG21 VAL 89 3HG2 VAL 89 -7.037 25.263 -13.042 717 HG22 VAL 89 1HG2 VAL 89 -8.147 25.211 -11.672 718 HG23 VAL 89 2HG2 VAL 89 -7.537 26.760 -12.254 719 H ASN 90 H ASN 90 -10.175 27.321 -10.405 720 HA ASN 90 HA ASN 90 -9.029 29.957 -11.056 721 HB2 ASN 90 1HB ASN 90 -11.210 29.239 -9.118 722 HB3 ASN 90 2HB ASN 90 -10.191 30.644 -8.820 723 HD21 ASN 90 2HD2 ASN 90 -12.714 29.295 -10.747 724 HD22 ASN 90 1HD2 ASN 90 -13.103 30.739 -11.623 725 H GLY 91 H GLY 91 -6.941 29.640 -10.603 726 HA2 GLY 91 1HA GLY 91 -5.051 29.295 -9.344 727 HA3 GLY 91 2HA GLY 91 -6.080 29.315 -7.917 728 H ARG 92 H ARG 92 -6.258 27.468 -6.815 729 HA ARG 92 HA ARG 92 -5.585 24.970 -8.223 730 HB2 ARG 92 1HB ARG 92 -5.182 25.727 -5.326 731 HB3 ARG 92 2HB ARG 92 -5.024 24.083 -5.921 732 HG2 ARG 92 1HG ARG 92 -2.845 25.018 -5.738 733 HG3 ARG 92 2HG ARG 92 -3.225 24.889 -7.454 734 HD2 ARG 92 1HD ARG 92 -3.749 27.235 -7.563 735 HD3 ARG 92 2HD ARG 92 -3.548 27.397 -5.824 736 HE ARG 92 HE ARG 92 -1.221 26.485 -7.305 737 HH11 ARG 92 1HH1 ARG 92 -2.945 29.160 -5.860 738 HH12 ARG 92 2HH1 ARG 92 -1.552 30.189 -5.780 739 HH21 ARG 92 1HH2 ARG 92 0.623 27.829 -7.215 740 HH22 ARG 92 2HH2 ARG 92 0.478 29.439 -6.557 741 H SER 93 H SER 93 -8.175 26.521 -7.695 742 HA SER 93 HA SER 93 -9.678 24.250 -6.585 743 HB2 SER 93 1HB SER 93 -11.313 25.958 -5.693 744 HB3 SER 93 2HB SER 93 -9.737 25.962 -4.906 745 HG SER 93 HG SER 93 -9.431 27.640 -6.827 746 H ILE 94 H ILE 94 -11.471 23.612 -7.692 747 HA ILE 94 HA ILE 94 -11.960 24.950 -10.254 748 HB ILE 94 HB ILE 94 -12.920 22.245 -9.292 749 HG12 ILE 94 1HG1 ILE 94 -10.732 22.891 -11.276 750 HG13 ILE 94 2HG1 ILE 94 -10.437 22.481 -9.590 751 HG21 ILE 94 1HG2 ILE 94 -13.524 21.855 -11.625 752 HG22 ILE 94 2HG2 ILE 94 -12.989 23.484 -12.042 753 HG23 ILE 94 3HG2 ILE 94 -14.378 23.257 -10.981 754 HD11 ILE 94 3HD1 ILE 94 -11.534 20.304 -9.978 755 HD12 ILE 94 1HD1 ILE 94 -10.079 20.548 -10.944 756 HD13 ILE 94 2HD1 ILE 94 -11.673 20.719 -11.687 757 H ASP 95 H ASP 95 -13.857 25.931 -10.708 758 HA ASP 95 HA ASP 95 -15.944 25.880 -8.636 759 HB2 ASP 95 1HB ASP 95 -14.369 28.032 -8.950 760 HB3 ASP 95 2HB ASP 95 -15.543 28.373 -10.211 761 H ILE 96 H ILE 96 -17.939 27.172 -9.709 762 HA ILE 96 HA ILE 96 -18.374 25.905 -12.335 763 HB ILE 96 HB ILE 96 -20.407 26.106 -10.110 764 HG12 ILE 96 1HG1 ILE 96 -19.120 23.600 -11.191 765 HG13 ILE 96 2HG1 ILE 96 -18.488 24.458 -9.789 766 HG21 ILE 96 1HG2 ILE 96 -21.809 24.730 -11.546 767 HG22 ILE 96 2HG2 ILE 96 -20.555 24.716 -12.785 768 HG23 ILE 96 3HG2 ILE 96 -21.365 26.227 -12.367 769 HD11 ILE 96 3HD1 ILE 96 -19.873 22.602 -9.117 770 HD12 ILE 96 1HD1 ILE 96 -21.229 23.251 -10.039 771 HD13 ILE 96 2HD1 ILE 96 -20.610 24.131 -8.640 772 H GLU 97 H GLU 97 -18.477 27.546 -13.719 773 HA GLU 97 HA GLU 97 -20.041 29.918 -12.975 774 HB2 GLU 97 1HB GLU 97 -17.987 29.570 -15.166 775 HB3 GLU 97 2HB GLU 97 -18.914 31.037 -14.887 776 HG2 GLU 97 1HG GLU 97 -17.906 31.140 -12.608 777 HG3 GLU 97 2HG GLU 97 -16.868 29.793 -13.074 778 H TYR 98 H TYR 98 -20.863 30.947 -15.214 779 HA TYR 98 HA TYR 98 -22.336 28.812 -16.590 780 HB2 TYR 98 1HB TYR 98 -23.325 31.247 -15.236 781 HB3 TYR 98 2HB TYR 98 -24.041 30.903 -16.807 782 HD1 TYR 98 HD1 TYR 98 -23.229 29.159 -13.597 783 HD2 TYR 98 HD2 TYR 98 -25.888 29.548 -16.889 784 HE1 TYR 98 HE1 TYR 98 -24.741 27.518 -12.562 785 HE2 TYR 98 HE2 TYR 98 -27.407 27.906 -15.867 786 HH TYR 98 HH TYR 98 -27.170 26.921 -12.667 787 H TYR 99 H TYR 99 -22.295 28.851 -18.735 788 HA TYR 99 HA TYR 99 -21.217 31.262 -20.038 789 HB2 TYR 99 1HB TYR 99 -20.504 29.838 -21.895 790 HB3 TYR 99 2HB TYR 99 -19.808 29.266 -20.386 791 HD1 TYR 99 HD1 TYR 99 -22.232 28.534 -23.052 792 HD2 TYR 99 HD2 TYR 99 -20.429 27.131 -19.462 793 HE1 TYR 99 HE1 TYR 99 -23.097 26.276 -23.519 794 HE2 TYR 99 HE2 TYR 99 -21.280 24.876 -19.907 795 HH TYR 99 HH TYR 99 -22.960 23.758 -21.147 796 H GLU 100 H GLU 100 -22.197 31.831 -22.114 797 HA GLU 100 HA GLU 100 -25.026 31.772 -21.785 798 HB2 GLU 100 1HB GLU 100 -23.515 33.661 -22.778 799 HB3 GLU 100 2HB GLU 100 -23.744 32.785 -24.289 800 HG2 GLU 100 1HG GLU 100 -26.195 32.937 -23.939 801 HG3 GLU 100 2HG GLU 100 -25.887 33.947 -22.528 802 H CYS 101 H CYS 101 -26.529 30.696 -22.829 803 HA CYS 101 HA CYS 101 -26.027 28.244 -24.072 804 HB2 CYS 101 1HB CYS 101 -28.145 28.849 -22.947 805 HB3 CYS 101 2HB CYS 101 -28.487 30.006 -24.224 806 HA PRO 102 HA PRO 102 -24.798 29.601 -28.179 807 HB2 PRO 102 1HB PRO 102 -25.420 27.130 -29.338 808 HB3 PRO 102 2HB PRO 102 -23.852 27.596 -28.673 809 HG2 PRO 102 1HG PRO 102 -26.023 25.975 -27.440 810 HG3 PRO 102 2HG PRO 102 -24.268 25.818 -27.277 811 HD2 PRO 102 1HD PRO 102 -25.783 26.880 -25.336 812 HD3 PRO 102 2HD PRO 102 -24.144 27.477 -25.674 813 H VAL 103 H VAL 103 -27.823 28.184 -27.259 814 HA VAL 103 HA VAL 103 -29.182 28.740 -29.739 815 HB VAL 103 HB VAL 103 -30.380 28.027 -27.057 816 HG11 VAL 103 1HG1 VAL 103 -32.240 27.129 -28.405 817 HG12 VAL 103 2HG1 VAL 103 -31.461 27.754 -29.859 818 HG13 VAL 103 3HG1 VAL 103 -32.031 28.868 -28.616 819 HG21 VAL 103 3HG2 VAL 103 -30.343 25.706 -27.820 820 HG22 VAL 103 1HG2 VAL 103 -28.714 26.370 -27.694 821 HG23 VAL 103 2HG2 VAL 103 -29.479 26.196 -29.275 822 H LYS 104 H LYS 104 -28.273 30.572 -27.070 823 HA LYS 104 HA LYS 104 -30.612 32.129 -26.642 824 HB2 LYS 104 1HB LYS 104 -28.838 31.806 -24.948 825 HB3 LYS 104 2HB LYS 104 -27.737 32.744 -25.942 826 HG2 LYS 104 1HG LYS 104 -28.575 34.090 -24.131 827 HG3 LYS 104 2HG LYS 104 -29.178 34.707 -25.669 828 HD2 LYS 104 1HD LYS 104 -31.322 33.657 -25.292 829 HD3 LYS 104 2HD LYS 104 -30.723 32.908 -23.810 830 HE2 LYS 104 1HE LYS 104 -32.089 34.899 -23.357 831 HE3 LYS 104 2HE LYS 104 -30.431 35.081 -22.788 832 HZ1 LYS 104 3HZ LYS 104 -31.374 37.050 -23.955 833 HZ2 LYS 104 1HZ LYS 104 -31.397 36.146 -25.389 834 HZ3 LYS 104 2HZ LYS 104 -29.917 36.482 -24.616 835 H ARG 105 H ARG 105 -28.243 32.199 -29.089 836 HA ARG 105 HA ARG 105 -29.271 34.802 -29.984 837 HB2 ARG 105 1HB ARG 105 -26.371 33.942 -30.155 838 HB3 ARG 105 2HB ARG 105 -27.041 35.434 -30.796 839 HG2 ARG 105 1HG ARG 105 -27.650 36.106 -28.501 840 HG3 ARG 105 2HG ARG 105 -26.859 34.652 -27.897 841 HD2 ARG 105 1HD ARG 105 -24.778 35.482 -29.121 842 HD3 ARG 105 2HD ARG 105 -25.624 37.021 -29.275 843 HE ARG 105 HE ARG 105 -25.425 35.883 -26.596 844 HH11 ARG 105 1HH1 ARG 105 -24.140 38.181 -28.926 845 HH12 ARG 105 2HH1 ARG 105 -23.370 39.153 -27.712 846 HH21 ARG 105 1HH2 ARG 105 -24.405 37.123 -25.018 847 HH22 ARG 105 2HH2 ARG 105 -23.497 38.539 -25.479 848 H LYS 106 H LYS 106 -30.028 32.098 -30.707 849 HA LYS 106 HA LYS 106 -28.983 31.605 -33.345 850 HB2 LYS 106 1HB LYS 106 -31.370 30.503 -31.865 851 HB3 LYS 106 2HB LYS 106 -30.946 30.017 -33.500 852 HG2 LYS 106 1HG LYS 106 -29.218 29.671 -31.057 853 HG3 LYS 106 2HG LYS 106 -30.165 28.410 -31.848 854 HD2 LYS 106 1HD LYS 106 -28.849 28.794 -33.917 855 HD3 LYS 106 2HD LYS 106 -27.846 29.939 -33.025 856 HE2 LYS 106 1HE LYS 106 -26.717 27.828 -33.084 857 HE3 LYS 106 2HE LYS 106 -27.275 28.114 -31.437 858 HZ1 LYS 106 3HZ LYS 106 -27.689 25.840 -32.103 859 HZ2 LYS 106 1HZ LYS 106 -28.591 26.358 -33.443 860 HZ3 LYS 106 2HZ LYS 106 -29.166 26.646 -31.875 Start of MODEL 7 1 HA MET 1 HA MET 1 -8.482 -33.482 -4.424 2 HB2 MET 1 1HB MET 1 -7.628 -34.891 -6.208 3 HB3 MET 1 2HB MET 1 -8.947 -35.707 -5.380 4 HG2 MET 1 1HG MET 1 -10.462 -35.118 -7.191 5 HG3 MET 1 2HG MET 1 -9.160 -34.260 -8.013 6 HE1 MET 1 2HE MET 1 -9.648 -35.663 -10.225 7 HE2 MET 1 3HE MET 1 -10.949 -36.507 -9.387 8 HE3 MET 1 1HE MET 1 -9.722 -37.425 -10.261 9 H GLU 2 H GLU 2 -10.638 -31.761 -6.163 10 HA GLU 2 HA GLU 2 -8.585 -30.484 -7.828 11 HB2 GLU 2 1HB GLU 2 -10.504 -29.525 -9.099 12 HB3 GLU 2 2HB GLU 2 -10.412 -31.276 -9.165 13 HG2 GLU 2 1HG GLU 2 -12.231 -29.801 -7.276 14 HG3 GLU 2 2HG GLU 2 -12.710 -30.291 -8.899 15 HA PRO 3 HA PRO 3 -8.812 -27.001 -5.159 16 HB2 PRO 3 1HB PRO 3 -7.770 -25.254 -7.196 17 HB3 PRO 3 2HB PRO 3 -6.913 -25.987 -5.840 18 HG2 PRO 3 1HG PRO 3 -6.472 -26.633 -8.473 19 HG3 PRO 3 2HG PRO 3 -6.130 -27.714 -7.110 20 HD2 PRO 3 1HD PRO 3 -8.473 -27.688 -8.974 21 HD3 PRO 3 2HD PRO 3 -7.584 -29.069 -8.295 22 H ILE 4 H ILE 4 -11.135 -26.844 -5.144 23 HA ILE 4 HA ILE 4 -12.518 -25.250 -7.064 24 HB ILE 4 HB ILE 4 -13.359 -26.033 -4.266 25 HG12 ILE 4 1HG1 ILE 4 -14.007 -27.340 -6.919 26 HG13 ILE 4 2HG1 ILE 4 -12.839 -27.957 -5.751 27 HG21 ILE 4 1HG2 ILE 4 -14.654 -24.155 -5.102 28 HG22 ILE 4 2HG2 ILE 4 -15.646 -25.613 -5.062 29 HG23 ILE 4 3HG2 ILE 4 -14.998 -25.031 -6.595 30 HD11 ILE 4 3HD1 ILE 4 -14.923 -29.163 -5.587 31 HD12 ILE 4 1HD1 ILE 4 -15.809 -27.657 -5.334 32 HD13 ILE 4 2HD1 ILE 4 -14.658 -28.219 -4.121 33 H GLY 5 H GLY 5 -11.273 -24.698 -3.807 34 HA2 GLY 5 1HA GLY 5 -10.213 -22.546 -3.353 35 HA3 GLY 5 2HA GLY 5 -11.491 -21.798 -4.300 36 H ARG 6 H ARG 6 -10.421 -22.069 -1.282 37 HA ARG 6 HA ARG 6 -13.143 -22.008 -0.152 38 HB2 ARG 6 1HB ARG 6 -12.218 -22.722 1.999 39 HB3 ARG 6 2HB ARG 6 -11.871 -23.900 0.744 40 HG2 ARG 6 1HG ARG 6 -9.827 -21.832 1.386 41 HG3 ARG 6 2HG ARG 6 -10.047 -23.197 2.480 42 HD2 ARG 6 1HD ARG 6 -9.620 -24.752 0.673 43 HD3 ARG 6 2HD ARG 6 -9.503 -23.421 -0.477 44 HE ARG 6 HE ARG 6 -7.614 -22.794 1.348 45 HH11 ARG 6 1HH1 ARG 6 -8.276 -25.729 -0.457 46 HH12 ARG 6 2HH1 ARG 6 -6.608 -26.219 -0.513 47 HH21 ARG 6 1HH2 ARG 6 -5.418 -23.429 1.254 48 HH22 ARG 6 2HH2 ARG 6 -4.981 -24.899 0.430 49 H SER 7 H SER 7 -10.425 -20.216 -0.893 50 HA SER 7 HA SER 7 -11.373 -18.048 0.851 51 HB2 SER 7 1HB SER 7 -9.153 -19.054 1.588 52 HB3 SER 7 2HB SER 7 -8.472 -18.427 0.087 53 HG SER 7 HG SER 7 -9.446 -17.046 2.337 54 H LEU 8 H LEU 8 -12.622 -17.237 -0.836 55 HA LEU 8 HA LEU 8 -11.294 -16.449 -3.304 56 HB2 LEU 8 1HB LEU 8 -14.160 -16.269 -2.382 57 HB3 LEU 8 2HB LEU 8 -13.602 -15.530 -3.868 58 HG LEU 8 HG LEU 8 -12.861 -17.841 -4.604 59 HD11 LEU 8 1HD1 LEU 8 -12.839 -18.929 -2.423 60 HD12 LEU 8 2HD1 LEU 8 -13.937 -19.751 -3.531 61 HD13 LEU 8 3HD1 LEU 8 -14.581 -18.692 -2.277 62 HD21 LEU 8 3HD2 LEU 8 -15.796 -17.354 -4.112 63 HD22 LEU 8 1HD2 LEU 8 -15.124 -18.496 -5.278 64 HD23 LEU 8 2HD2 LEU 8 -14.854 -16.765 -5.481 65 H GLN 9 H GLN 9 -13.333 -14.808 -0.890 66 HA GLN 9 HA GLN 9 -11.478 -12.587 -0.825 67 HB2 GLN 9 1HB GLN 9 -13.285 -10.917 -1.203 68 HB3 GLN 9 2HB GLN 9 -12.917 -11.877 -2.627 69 HG2 GLN 9 1HG GLN 9 -14.888 -13.223 -2.284 70 HG3 GLN 9 2HG GLN 9 -15.229 -12.390 -0.768 71 HE21 GLN 9 2HE2 GLN 9 -16.853 -12.654 -3.194 72 HE22 GLN 9 1HE2 GLN 9 -17.204 -11.042 -3.704 73 H GLY 10 H GLY 10 -11.327 -11.773 1.171 74 HA2 GLY 10 1HA GLY 10 -13.285 -12.693 3.159 75 HA3 GLY 10 2HA GLY 10 -11.662 -12.107 3.505 76 H VAL 11 H VAL 11 -14.917 -11.321 3.396 77 HA VAL 11 HA VAL 11 -14.608 -8.517 2.876 78 HB VAL 11 HB VAL 11 -17.002 -8.345 3.514 79 HG11 VAL 11 1HG1 VAL 11 -17.863 -9.650 1.616 80 HG12 VAL 11 2HG1 VAL 11 -16.322 -10.505 1.520 81 HG13 VAL 11 3HG1 VAL 11 -16.392 -8.770 1.209 82 HG21 VAL 11 3HG2 VAL 11 -16.784 -11.330 3.924 83 HG22 VAL 11 1HG2 VAL 11 -18.288 -10.407 3.894 84 HG23 VAL 11 2HG2 VAL 11 -17.105 -10.125 5.171 85 H THR 12 H THR 12 -14.290 -6.923 4.267 86 HA THR 12 HA THR 12 -14.110 -7.507 7.119 87 HB THR 12 HB THR 12 -13.263 -5.091 7.180 88 HG1 THR 12 HG1 THR 12 -12.547 -4.330 5.083 89 HG21 THR 12 3HG2 THR 12 -11.749 -7.119 5.524 90 HG22 THR 12 1HG2 THR 12 -11.747 -7.001 7.284 91 HG23 THR 12 2HG2 THR 12 -11.042 -5.708 6.313 92 H GLY 13 H GLY 13 -16.475 -6.769 5.070 93 HA2 GLY 13 1HA GLY 13 -18.639 -6.340 6.312 94 HA3 GLY 13 2HA GLY 13 -17.835 -4.875 6.863 95 H ARG 14 H ARG 14 -19.507 -3.638 5.866 96 HA ARG 14 HA ARG 14 -18.878 -3.100 3.070 97 HB2 ARG 14 1HB ARG 14 -21.647 -3.714 4.102 98 HB3 ARG 14 2HB ARG 14 -21.410 -2.685 2.699 99 HG2 ARG 14 1HG ARG 14 -21.745 -4.714 1.704 100 HG3 ARG 14 2HG ARG 14 -19.986 -4.692 1.824 101 HD2 ARG 14 1HD ARG 14 -20.697 -6.839 2.525 102 HD3 ARG 14 2HD ARG 14 -20.222 -5.963 3.978 103 HE ARG 14 HE ARG 14 -23.043 -5.820 3.347 104 HH11 ARG 14 1HH1 ARG 14 -20.530 -7.524 5.075 105 HH12 ARG 14 2HH1 ARG 14 -21.617 -8.299 6.184 106 HH21 ARG 14 1HH2 ARG 14 -24.499 -6.849 4.800 107 HH22 ARG 14 2HH2 ARG 14 -23.882 -7.950 5.990 108 HA PRO 15 HA PRO 15 -18.954 0.743 5.651 109 HB2 PRO 15 1HB PRO 15 -16.878 1.859 4.238 110 HB3 PRO 15 2HB PRO 15 -16.676 0.890 5.700 111 HG2 PRO 15 1HG PRO 15 -16.386 0.086 2.836 112 HG3 PRO 15 2HG PRO 15 -15.394 -0.371 4.233 113 HD2 PRO 15 1HD PRO 15 -17.245 -2.028 3.189 114 HD3 PRO 15 2HD PRO 15 -16.896 -1.984 4.928 115 H ASP 16 H ASP 16 -20.724 1.772 4.965 116 HA ASP 16 HA ASP 16 -21.397 2.161 2.229 117 HB2 ASP 16 1HB ASP 16 -23.101 1.924 3.962 118 HB3 ASP 16 2HB ASP 16 -22.548 3.407 4.735 119 H PHE 17 H PHE 17 -19.576 3.989 4.525 120 HA PHE 17 HA PHE 17 -19.855 6.555 3.362 121 HB2 PHE 17 1HB PHE 17 -18.964 6.217 5.631 122 HB3 PHE 17 2HB PHE 17 -17.539 5.431 4.960 123 HD1 PHE 17 HD2 PHE 17 -19.393 8.640 5.036 124 HD2 PHE 17 HD1 PHE 17 -15.680 6.687 4.299 125 HE1 PHE 17 HE2 PHE 17 -18.280 10.827 4.857 126 HE2 PHE 17 HE1 PHE 17 -14.565 8.871 4.116 127 HZ PHE 17 HZ PHE 17 -15.866 10.944 4.392 128 H GLN 18 H GLN 18 -17.392 4.016 2.929 129 HA GLN 18 HA GLN 18 -15.921 5.514 1.012 130 HB2 GLN 18 1HB GLN 18 -14.551 3.620 0.741 131 HB3 GLN 18 2HB GLN 18 -15.044 3.581 2.421 132 HG2 GLN 18 1HG GLN 18 -15.366 1.405 1.927 133 HG3 GLN 18 2HG GLN 18 -16.947 2.016 1.453 134 HE21 GLN 18 2HE2 GLN 18 -13.951 2.429 -0.388 135 HE22 GLN 18 1HE2 GLN 18 -14.436 1.463 -1.734 136 H LYS 19 H LYS 19 -18.573 3.242 0.864 137 HA LYS 19 HA LYS 19 -18.660 2.824 -1.902 138 HB2 LYS 19 1HB LYS 19 -20.847 2.910 0.181 139 HB3 LYS 19 2HB LYS 19 -21.156 2.506 -1.503 140 HG2 LYS 19 1HG LYS 19 -19.589 0.612 -1.303 141 HG3 LYS 19 2HG LYS 19 -19.379 1.004 0.407 142 HD2 LYS 19 1HD LYS 19 -21.003 -0.791 0.135 143 HD3 LYS 19 2HD LYS 19 -21.786 0.658 0.767 144 HE2 LYS 19 1HE LYS 19 -22.496 1.215 -1.546 145 HE3 LYS 19 2HE LYS 19 -21.824 -0.322 -2.085 146 HZ1 LYS 19 3HZ LYS 19 -23.968 -0.038 -0.051 147 HZ2 LYS 19 1HZ LYS 19 -23.383 -1.492 -0.702 148 HZ3 LYS 19 2HZ LYS 19 -24.234 -0.400 -1.687 149 H ARG 20 H ARG 20 -20.256 5.275 0.107 150 HA ARG 20 HA ARG 20 -21.437 6.708 -2.013 151 HB2 ARG 20 1HB ARG 20 -22.314 7.087 0.141 152 HB3 ARG 20 2HB ARG 20 -20.728 7.405 0.826 153 HG2 ARG 20 1HG ARG 20 -20.609 9.519 -0.285 154 HG3 ARG 20 2HG ARG 20 -22.104 9.193 -1.162 155 HD2 ARG 20 1HD ARG 20 -23.378 9.252 0.867 156 HD3 ARG 20 2HD ARG 20 -21.910 9.352 1.839 157 HE ARG 20 HE ARG 20 -21.655 11.550 0.393 158 HH11 ARG 20 1HH1 ARG 20 -24.542 10.275 1.917 159 HH12 ARG 20 2HH1 ARG 20 -25.215 11.848 2.239 160 HH21 ARG 20 1HH2 ARG 20 -22.521 13.598 0.817 161 HH22 ARG 20 2HH2 ARG 20 -24.054 13.755 1.620 162 H LEU 21 H LEU 21 -18.382 7.181 -0.282 163 HA LEU 21 HA LEU 21 -17.565 9.541 -1.516 164 HB2 LEU 21 1HB LEU 21 -16.409 8.782 0.407 165 HB3 LEU 21 2HB LEU 21 -16.024 7.244 -0.337 166 HG LEU 21 HG LEU 21 -14.529 8.430 -1.925 167 HD11 LEU 21 1HD1 LEU 21 -15.120 10.804 -0.160 168 HD12 LEU 21 2HD1 LEU 21 -15.550 10.633 -1.862 169 HD13 LEU 21 3HD1 LEU 21 -13.854 10.735 -1.386 170 HD21 LEU 21 3HD2 LEU 21 -13.649 7.368 0.089 171 HD22 LEU 21 1HD2 LEU 21 -13.922 8.856 0.998 172 HD23 LEU 21 2HD2 LEU 21 -12.741 8.826 -0.312 173 H GLU 22 H GLU 22 -16.752 6.190 -2.433 174 HA GLU 22 HA GLU 22 -15.425 7.032 -4.805 175 HB2 GLU 22 1HB GLU 22 -16.288 4.328 -3.813 176 HB3 GLU 22 2HB GLU 22 -15.433 4.569 -5.334 177 HG2 GLU 22 1HG GLU 22 -14.445 5.302 -2.589 178 HG3 GLU 22 2HG GLU 22 -13.883 3.968 -3.588 179 H GLN 23 H GLN 23 -18.707 6.102 -4.055 180 HA GLN 23 HA GLN 23 -19.685 5.626 -6.625 181 HB2 GLN 23 1HB GLN 23 -20.960 5.411 -4.451 182 HB3 GLN 23 2HB GLN 23 -21.134 7.157 -4.458 183 HG2 GLN 23 1HG GLN 23 -23.138 6.246 -5.315 184 HG3 GLN 23 2HG GLN 23 -22.263 6.956 -6.672 185 HE21 GLN 23 2HE2 GLN 23 -23.346 4.042 -5.169 186 HE22 GLN 23 1HE2 GLN 23 -23.040 2.984 -6.506 187 H MET 24 H MET 24 -19.681 8.684 -4.798 188 HA MET 24 HA MET 24 -20.409 10.263 -7.023 189 HB2 MET 24 1HB MET 24 -19.753 12.195 -5.663 190 HB3 MET 24 2HB MET 24 -20.767 11.081 -4.765 191 HG2 MET 24 1HG MET 24 -18.773 10.198 -3.655 192 HG3 MET 24 2HG MET 24 -17.782 11.357 -4.534 193 HE1 MET 24 3HE MET 24 -19.187 14.772 -3.126 194 HE2 MET 24 1HE MET 24 -19.703 13.896 -4.570 195 HE3 MET 24 2HE MET 24 -17.989 14.035 -4.187 196 H LYS 25 H LYS 25 -17.305 9.329 -5.675 197 HA LYS 25 HA LYS 25 -15.559 10.866 -7.167 198 HB2 LYS 25 1HB LYS 25 -14.960 9.243 -5.354 199 HB3 LYS 25 2HB LYS 25 -15.224 7.936 -6.497 200 HG2 LYS 25 1HG LYS 25 -12.911 8.268 -6.443 201 HG3 LYS 25 2HG LYS 25 -13.457 9.030 -7.939 202 HD2 LYS 25 1HD LYS 25 -11.880 10.494 -6.883 203 HD3 LYS 25 2HD LYS 25 -13.487 11.211 -6.731 204 HE2 LYS 25 1HE LYS 25 -12.183 11.384 -4.647 205 HE3 LYS 25 2HE LYS 25 -13.655 10.437 -4.441 206 HZ1 LYS 25 3HZ LYS 25 -11.147 9.040 -5.077 207 HZ2 LYS 25 1HZ LYS 25 -12.480 8.497 -4.183 208 HZ3 LYS 25 2HZ LYS 25 -11.382 9.600 -3.495 209 H GLU 26 H GLU 26 -16.907 7.678 -8.009 210 HA GLU 26 HA GLU 26 -15.767 7.587 -10.591 211 HB2 GLU 26 1HB GLU 26 -16.432 5.532 -9.544 212 HB3 GLU 26 2HB GLU 26 -18.092 6.090 -9.378 213 HG2 GLU 26 1HG GLU 26 -18.394 6.040 -11.764 214 HG3 GLU 26 2HG GLU 26 -16.700 5.622 -12.000 215 H LYS 27 H LYS 27 -18.956 8.551 -9.417 216 HA LYS 27 HA LYS 27 -20.226 8.973 -11.849 217 HB2 LYS 27 1HB LYS 27 -20.558 10.201 -9.138 218 HB3 LYS 27 2HB LYS 27 -21.512 10.783 -10.493 219 HG2 LYS 27 1HG LYS 27 -22.318 8.448 -10.838 220 HG3 LYS 27 2HG LYS 27 -21.464 7.990 -9.363 221 HD2 LYS 27 1HD LYS 27 -23.821 8.403 -8.904 222 HD3 LYS 27 2HD LYS 27 -22.812 9.605 -8.096 223 HE2 LYS 27 1HE LYS 27 -23.263 11.192 -9.906 224 HE3 LYS 27 2HE LYS 27 -24.278 9.992 -10.705 225 HZ1 LYS 27 3HZ LYS 27 -25.533 11.644 -9.398 226 HZ2 LYS 27 1HZ LYS 27 -24.791 11.067 -7.985 227 HZ3 LYS 27 2HZ LYS 27 -25.808 10.050 -8.890 228 H VAL 28 H VAL 28 -18.171 11.168 -9.993 229 HA VAL 28 HA VAL 28 -18.518 13.407 -11.671 230 HB VAL 28 HB VAL 28 -16.242 12.674 -9.821 231 HG11 VAL 28 1HG1 VAL 28 -16.793 15.283 -11.233 232 HG12 VAL 28 2HG1 VAL 28 -15.424 14.209 -11.521 233 HG13 VAL 28 3HG1 VAL 28 -15.583 15.038 -9.971 234 HG21 VAL 28 3HG2 VAL 28 -17.279 14.208 -8.287 235 HG22 VAL 28 1HG2 VAL 28 -18.497 13.049 -8.827 236 HG23 VAL 28 2HG2 VAL 28 -18.470 14.681 -9.500 237 H MET 29 H MET 29 -16.105 10.785 -11.677 238 HA MET 29 HA MET 29 -14.805 11.904 -14.019 239 HB2 MET 29 1HB MET 29 -13.317 9.987 -13.919 240 HB3 MET 29 2HB MET 29 -13.478 10.709 -12.325 241 HG2 MET 29 1HG MET 29 -15.045 8.953 -11.688 242 HG3 MET 29 2HG MET 29 -14.889 8.229 -13.287 243 HE1 MET 29 3HE MET 29 -12.069 9.890 -11.097 244 HE2 MET 29 1HE MET 29 -11.437 8.492 -10.228 245 HE3 MET 29 2HE MET 29 -13.073 9.065 -9.905 246 H LYS 30 H LYS 30 -17.619 10.426 -13.626 247 HA LYS 30 HA LYS 30 -17.537 8.728 -15.998 248 HB2 LYS 30 1HB LYS 30 -18.955 8.615 -13.604 249 HB3 LYS 30 2HB LYS 30 -20.149 9.158 -14.772 250 HG2 LYS 30 1HG LYS 30 -20.297 6.806 -14.676 251 HG3 LYS 30 2HG LYS 30 -19.492 7.200 -16.197 252 HD2 LYS 30 1HD LYS 30 -17.360 6.618 -15.305 253 HD3 LYS 30 2HD LYS 30 -18.016 6.481 -13.672 254 HE2 LYS 30 1HE LYS 30 -19.404 4.600 -14.396 255 HE3 LYS 30 2HE LYS 30 -18.720 4.722 -16.017 256 HZ1 LYS 30 3HZ LYS 30 -17.377 3.882 -13.513 257 HZ2 LYS 30 1HZ LYS 30 -16.493 4.368 -14.879 258 HZ3 LYS 30 2HZ LYS 30 -17.528 3.032 -14.971 259 H ASP 31 H ASP 31 -18.613 11.842 -14.901 260 HA ASP 31 HA ASP 31 -20.636 12.280 -16.818 261 HB2 ASP 31 1HB ASP 31 -20.572 13.607 -14.788 262 HB3 ASP 31 2HB ASP 31 -19.013 14.285 -15.254 263 H GLN 32 H GLN 32 -20.671 13.431 -18.647 264 HA GLN 32 HA GLN 32 -18.457 13.044 -20.367 265 HB2 GLN 32 1HB GLN 32 -21.015 14.596 -20.823 266 HB3 GLN 32 2HB GLN 32 -19.929 13.996 -22.071 267 HG2 GLN 32 1HG GLN 32 -20.537 11.788 -21.727 268 HG3 GLN 32 2HG GLN 32 -21.170 12.110 -20.114 269 HE21 GLN 32 2HE2 GLN 32 -23.128 11.148 -20.539 270 HE22 GLN 32 1HE2 GLN 32 -24.316 11.851 -21.579 271 H ASP 33 H ASP 33 -19.975 15.948 -18.989 272 HA ASP 33 HA ASP 33 -18.262 17.758 -20.393 273 HB2 ASP 33 1HB ASP 33 -20.235 18.066 -18.151 274 HB3 ASP 33 2HB ASP 33 -19.172 19.396 -18.589 275 H VAL 34 H VAL 34 -18.362 16.458 -17.110 276 HA VAL 34 HA VAL 34 -16.296 17.941 -15.996 277 HB VAL 34 HB VAL 34 -17.196 15.127 -15.407 278 HG11 VAL 34 1HG1 VAL 34 -15.915 15.307 -13.308 279 HG12 VAL 34 2HG1 VAL 34 -15.202 16.813 -13.889 280 HG13 VAL 34 3HG1 VAL 34 -14.872 15.297 -14.731 281 HG21 VAL 34 3HG2 VAL 34 -18.181 16.185 -13.426 282 HG22 VAL 34 1HG2 VAL 34 -18.802 16.894 -14.917 283 HG23 VAL 34 2HG2 VAL 34 -17.583 17.751 -13.973 284 H GLN 35 H GLN 35 -16.039 14.731 -17.573 285 HA GLN 35 HA GLN 35 -13.237 14.593 -17.186 286 HB2 GLN 35 1HB GLN 35 -13.285 12.699 -18.729 287 HB3 GLN 35 2HB GLN 35 -14.531 12.588 -17.501 288 HG2 GLN 35 1HG GLN 35 -16.101 13.567 -19.252 289 HG3 GLN 35 2HG GLN 35 -14.823 13.210 -20.414 290 HE21 GLN 35 2HE2 GLN 35 -15.595 11.275 -17.583 291 HE22 GLN 35 1HE2 GLN 35 -16.142 9.893 -18.451 292 H ALA 36 H ALA 36 -15.217 15.873 -19.763 293 HA ALA 36 HA ALA 36 -13.184 16.334 -21.660 294 HB1 ALA 36 1HB ALA 36 -15.575 16.566 -22.173 295 HB2 ALA 36 2HB ALA 36 -14.678 18.025 -22.594 296 HB3 ALA 36 3HB ALA 36 -15.659 17.986 -21.129 297 H PHE 37 H PHE 37 -14.393 18.314 -18.983 298 HA PHE 37 HA PHE 37 -12.644 20.495 -19.351 299 HB2 PHE 37 1HB PHE 37 -14.548 20.812 -17.961 300 HB3 PHE 37 2HB PHE 37 -14.126 19.441 -16.943 301 HD1 PHE 37 HD2 PHE 37 -12.988 22.838 -17.924 302 HD2 PHE 37 HD1 PHE 37 -12.894 19.743 -15.007 303 HE1 PHE 37 HE2 PHE 37 -11.836 24.350 -16.361 304 HE2 PHE 37 HE1 PHE 37 -11.748 21.253 -13.436 305 HZ PHE 37 HZ PHE 37 -11.216 23.558 -14.115 306 H LEU 38 H LEU 38 -12.358 17.497 -17.531 307 HA LEU 38 HA LEU 38 -10.012 18.035 -16.127 308 HB2 LEU 38 1HB LEU 38 -11.535 15.647 -16.877 309 HB3 LEU 38 2HB LEU 38 -9.821 15.353 -16.653 310 HG LEU 38 HG LEU 38 -11.062 14.913 -14.602 311 HD11 LEU 38 1HD1 LEU 38 -9.325 17.369 -14.428 312 HD12 LEU 38 2HD1 LEU 38 -8.771 15.694 -14.408 313 HD13 LEU 38 3HD1 LEU 38 -9.751 16.316 -13.079 314 HD21 LEU 38 3HD2 LEU 38 -11.851 17.819 -14.751 315 HD22 LEU 38 1HD2 LEU 38 -12.123 16.754 -13.371 316 HD23 LEU 38 2HD2 LEU 38 -12.928 16.430 -14.906 317 H LYS 39 H LYS 39 -10.375 16.445 -19.303 318 HA LYS 39 HA LYS 39 -7.578 16.094 -19.649 319 HB2 LYS 39 1HB LYS 39 -8.087 15.502 -21.960 320 HB3 LYS 39 2HB LYS 39 -9.199 14.709 -20.856 321 HG2 LYS 39 1HG LYS 39 -10.925 16.333 -21.404 322 HG3 LYS 39 2HG LYS 39 -9.805 17.172 -22.480 323 HD2 LYS 39 1HD LYS 39 -9.640 15.191 -23.881 324 HD3 LYS 39 2HD LYS 39 -10.703 14.308 -22.786 325 HE2 LYS 39 1HE LYS 39 -11.969 15.045 -24.699 326 HE3 LYS 39 2HE LYS 39 -12.496 15.933 -23.273 327 HZ1 LYS 39 3HZ LYS 39 -12.159 17.254 -25.379 328 HZ2 LYS 39 1HZ LYS 39 -10.494 17.030 -25.160 329 HZ3 LYS 39 2HZ LYS 39 -11.396 17.866 -23.991 330 H GLU 40 H GLU 40 -9.760 18.700 -20.323 331 HA GLU 40 HA GLU 40 -8.049 20.163 -22.068 332 HB2 GLU 40 1HB GLU 40 -10.658 20.428 -20.896 333 HB3 GLU 40 2HB GLU 40 -9.776 21.934 -20.718 334 HG2 GLU 40 1HG GLU 40 -11.102 21.903 -22.746 335 HG3 GLU 40 2HG GLU 40 -9.381 21.999 -23.114 336 H ASN 41 H ASN 41 -8.313 19.863 -18.631 337 HA ASN 41 HA ASN 41 -6.376 22.062 -18.275 338 HB2 ASN 41 1HB ASN 41 -8.741 21.289 -16.571 339 HB3 ASN 41 2HB ASN 41 -7.442 22.318 -15.977 340 HD21 ASN 41 2HD2 ASN 41 -10.067 22.037 -18.251 341 HD22 ASN 41 1HD2 ASN 41 -10.188 23.723 -18.618 342 H GLU 42 H GLU 42 -5.926 19.163 -18.616 343 HA GLU 42 HA GLU 42 -5.361 17.973 -16.107 344 HB2 GLU 42 1HB GLU 42 -4.070 16.321 -17.412 345 HB3 GLU 42 2HB GLU 42 -5.671 16.604 -18.078 346 HG2 GLU 42 1HG GLU 42 -4.759 17.970 -19.830 347 HG3 GLU 42 2HG GLU 42 -3.148 17.873 -19.119 348 H GLU 43 H GLU 43 -3.764 20.329 -17.922 349 HA GLU 43 HA GLU 43 -1.110 19.960 -16.985 350 HB2 GLU 43 1HB GLU 43 -1.558 21.277 -18.969 351 HB3 GLU 43 2HB GLU 43 -2.585 22.371 -18.058 352 HG2 GLU 43 1HG GLU 43 -0.531 22.969 -16.708 353 HG3 GLU 43 2HG GLU 43 0.399 22.092 -17.925 354 H VAL 44 H VAL 44 -3.975 21.527 -15.767 355 HA VAL 44 HA VAL 44 -2.414 22.877 -13.673 356 HB VAL 44 HB VAL 44 -5.302 23.360 -14.404 357 HG11 VAL 44 1HG1 VAL 44 -4.992 25.470 -13.224 358 HG12 VAL 44 2HG1 VAL 44 -3.319 25.037 -12.869 359 HG13 VAL 44 3HG1 VAL 44 -4.640 24.102 -12.168 360 HG21 VAL 44 3HG2 VAL 44 -3.897 23.802 -16.347 361 HG22 VAL 44 1HG2 VAL 44 -2.849 24.830 -15.371 362 HG23 VAL 44 2HG2 VAL 44 -4.522 25.307 -15.669 363 H ILE 45 H ILE 45 -5.120 20.680 -14.186 364 HA ILE 45 HA ILE 45 -5.879 20.643 -11.415 365 HB ILE 45 HB ILE 45 -6.685 18.748 -13.618 366 HG12 ILE 45 1HG1 ILE 45 -8.119 21.190 -12.554 367 HG13 ILE 45 2HG1 ILE 45 -7.249 21.125 -14.085 368 HG21 ILE 45 1HG2 ILE 45 -8.622 18.277 -12.154 369 HG22 ILE 45 2HG2 ILE 45 -7.886 19.282 -10.903 370 HG23 ILE 45 3HG2 ILE 45 -7.083 17.803 -11.430 371 HD11 ILE 45 3HD1 ILE 45 -9.628 20.888 -14.435 372 HD12 ILE 45 1HD1 ILE 45 -9.672 19.503 -13.344 373 HD13 ILE 45 2HD1 ILE 45 -8.794 19.396 -14.869 374 H ASP 46 H ASP 46 -5.435 19.149 -9.883 375 HA ASP 46 HA ASP 46 -3.598 16.962 -10.583 376 HB2 ASP 46 1HB ASP 46 -2.029 17.552 -8.999 377 HB3 ASP 46 2HB ASP 46 -2.599 19.152 -9.459 378 H GLN 47 H GLN 47 -3.318 15.649 -8.319 379 HA GLN 47 HA GLN 47 -5.739 14.329 -7.893 380 HB2 GLN 47 1HB GLN 47 -3.235 14.429 -6.217 381 HB3 GLN 47 2HB GLN 47 -4.578 13.347 -5.885 382 HG2 GLN 47 1HG GLN 47 -4.269 12.275 -8.044 383 HG3 GLN 47 2HG GLN 47 -2.948 13.385 -8.416 384 HE21 GLN 47 2HE2 GLN 47 -0.973 13.131 -7.393 385 HE22 GLN 47 1HE2 GLN 47 -0.561 11.704 -6.507 386 H LYS 48 H LYS 48 -4.179 16.912 -6.041 387 HA LYS 48 HA LYS 48 -6.011 16.781 -3.854 388 HB2 LYS 48 1HB LYS 48 -4.141 18.993 -4.714 389 HB3 LYS 48 2HB LYS 48 -5.012 18.949 -3.194 390 HG2 LYS 48 1HG LYS 48 -2.810 17.116 -4.103 391 HG3 LYS 48 2HG LYS 48 -2.780 18.266 -2.768 392 HD2 LYS 48 1HD LYS 48 -3.214 16.433 -1.525 393 HD3 LYS 48 2HD LYS 48 -4.877 16.726 -2.037 394 HE2 LYS 48 1HE LYS 48 -4.555 15.179 -3.919 395 HE3 LYS 48 2HE LYS 48 -2.907 14.870 -3.376 396 HZ1 LYS 48 3HZ LYS 48 -4.280 13.115 -2.609 397 HZ2 LYS 48 1HZ LYS 48 -5.426 14.188 -1.961 398 HZ3 LYS 48 2HZ LYS 48 -3.886 14.060 -1.255 399 H MET 49 H MET 49 -5.690 18.839 -6.708 400 HA MET 49 HA MET 49 -7.778 20.594 -6.292 401 HB2 MET 49 1HB MET 49 -6.040 20.614 -8.120 402 HB3 MET 49 2HB MET 49 -6.978 19.373 -8.938 403 HG2 MET 49 1HG MET 49 -7.544 21.430 -9.926 404 HG3 MET 49 2HG MET 49 -8.897 20.944 -8.908 405 HE1 MET 49 3HE MET 49 -5.798 23.302 -9.269 406 HE2 MET 49 1HE MET 49 -5.457 22.478 -7.747 407 HE3 MET 49 2HE MET 49 -5.842 24.198 -7.751 408 H ILE 50 H ILE 50 -7.816 17.292 -7.524 409 HA ILE 50 HA ILE 50 -10.516 17.199 -8.320 410 HB ILE 50 HB ILE 50 -8.705 14.985 -7.345 411 HG12 ILE 50 1HG1 ILE 50 -7.966 16.113 -9.404 412 HG13 ILE 50 2HG1 ILE 50 -8.455 14.447 -9.711 413 HG21 ILE 50 1HG2 ILE 50 -11.004 14.299 -7.041 414 HG22 ILE 50 2HG2 ILE 50 -10.299 13.437 -8.408 415 HG23 ILE 50 3HG2 ILE 50 -11.398 14.786 -8.689 416 HD11 ILE 50 3HD1 ILE 50 -10.601 15.254 -10.568 417 HD12 ILE 50 1HD1 ILE 50 -9.238 15.928 -11.461 418 HD13 ILE 50 2HD1 ILE 50 -10.089 16.915 -10.273 419 H GLU 51 H GLU 51 -8.950 16.279 -5.252 420 HA GLU 51 HA GLU 51 -11.376 15.489 -3.996 421 HB2 GLU 51 1HB GLU 51 -8.755 16.314 -2.731 422 HB3 GLU 51 2HB GLU 51 -10.061 15.452 -1.926 423 HG2 GLU 51 1HG GLU 51 -9.764 13.604 -3.566 424 HG3 GLU 51 2HG GLU 51 -8.358 14.455 -4.199 425 H LYS 52 H LYS 52 -9.534 18.490 -4.053 426 HA LYS 52 HA LYS 52 -10.977 19.970 -2.174 427 HB2 LYS 52 1HB LYS 52 -8.952 20.889 -3.006 428 HB3 LYS 52 2HB LYS 52 -9.486 20.758 -4.675 429 HG2 LYS 52 1HG LYS 52 -9.601 23.038 -4.156 430 HG3 LYS 52 2HG LYS 52 -11.267 22.466 -4.092 431 HD2 LYS 52 1HD LYS 52 -11.125 23.749 -2.173 432 HD3 LYS 52 2HD LYS 52 -10.765 22.134 -1.557 433 HE2 LYS 52 1HE LYS 52 -9.188 23.718 -0.636 434 HE3 LYS 52 2HE LYS 52 -8.354 22.634 -1.749 435 HZ1 LYS 52 3HZ LYS 52 -8.361 24.325 -3.424 436 HZ2 LYS 52 1HZ LYS 52 -7.731 25.003 -2.003 437 HZ3 LYS 52 2HZ LYS 52 -9.323 25.349 -2.477 438 H SER 53 H SER 53 -11.510 19.563 -5.655 439 HA SER 53 HA SER 53 -13.938 21.175 -5.448 440 HB2 SER 53 1HB SER 53 -12.285 21.781 -7.172 441 HB3 SER 53 2HB SER 53 -12.456 20.182 -7.893 442 HG SER 53 HG SER 53 -14.730 20.731 -8.149 443 H LEU 54 H LEU 54 -13.540 18.190 -4.706 444 HA LEU 54 HA LEU 54 -14.962 16.614 -6.537 445 HB2 LEU 54 1HB LEU 54 -13.614 15.708 -4.669 446 HB3 LEU 54 2HB LEU 54 -14.819 16.289 -3.535 447 HG LEU 54 HG LEU 54 -16.476 14.761 -4.475 448 HD11 LEU 54 1HD1 LEU 54 -14.244 13.794 -6.256 449 HD12 LEU 54 2HD1 LEU 54 -15.641 14.735 -6.780 450 HD13 LEU 54 3HD1 LEU 54 -15.864 13.107 -6.141 451 HD21 LEU 54 3HD2 LEU 54 -15.475 12.657 -3.734 452 HD22 LEU 54 1HD2 LEU 54 -15.082 13.980 -2.636 453 HD23 LEU 54 2HD2 LEU 54 -13.875 13.399 -3.783 454 H ASN 55 H ASN 55 -16.058 18.648 -3.874 455 HA ASN 55 HA ASN 55 -18.793 17.848 -4.122 456 HB2 ASN 55 1HB ASN 55 -19.219 19.897 -2.664 457 HB3 ASN 55 2HB ASN 55 -18.218 18.627 -1.977 458 HD21 ASN 55 2HD2 ASN 55 -17.260 19.998 -0.513 459 HD22 ASN 55 1HD2 ASN 55 -16.103 21.199 -0.985 460 H LYS 56 H LYS 56 -16.851 20.484 -5.409 461 HA LYS 56 HA LYS 56 -18.962 21.963 -6.568 462 HB2 LYS 56 1HB LYS 56 -16.025 21.768 -7.219 463 HB3 LYS 56 2HB LYS 56 -17.115 22.820 -8.107 464 HG2 LYS 56 1HG LYS 56 -16.673 22.970 -5.135 465 HG3 LYS 56 2HG LYS 56 -15.824 23.959 -6.327 466 HD2 LYS 56 1HD LYS 56 -18.025 24.799 -7.116 467 HD3 LYS 56 2HD LYS 56 -18.793 23.900 -5.806 468 HE2 LYS 56 1HE LYS 56 -18.514 26.209 -5.156 469 HE3 LYS 56 2HE LYS 56 -17.462 25.186 -4.180 470 HZ1 LYS 56 3HZ LYS 56 -15.607 25.806 -5.606 471 HZ2 LYS 56 1HZ LYS 56 -16.321 27.178 -4.918 472 HZ3 LYS 56 2HZ LYS 56 -16.621 26.793 -6.538 473 H LEU 57 H LEU 57 -16.825 19.455 -7.861 474 HA LEU 57 HA LEU 57 -17.859 19.507 -10.489 475 HB2 LEU 57 1HB LEU 57 -16.427 17.298 -9.011 476 HB3 LEU 57 2HB LEU 57 -16.705 17.334 -10.740 477 HG LEU 57 HG LEU 57 -15.024 19.317 -9.203 478 HD11 LEU 57 1HD1 LEU 57 -13.133 18.271 -10.344 479 HD12 LEU 57 2HD1 LEU 57 -14.221 17.078 -11.054 480 HD13 LEU 57 3HD1 LEU 57 -13.979 17.121 -9.307 481 HD21 LEU 57 3HD2 LEU 57 -15.454 19.006 -12.171 482 HD22 LEU 57 1HD2 LEU 57 -14.356 20.146 -11.393 483 HD23 LEU 57 2HD2 LEU 57 -16.098 20.304 -11.165 484 H TYR 58 H TYR 58 -18.665 17.608 -7.619 485 HA TYR 58 HA TYR 58 -20.524 15.929 -8.975 486 HB2 TYR 58 1HB TYR 58 -19.386 15.427 -6.755 487 HB3 TYR 58 2HB TYR 58 -20.535 16.542 -6.019 488 HD1 TYR 58 HD1 TYR 58 -20.431 13.539 -8.212 489 HD2 TYR 58 HD2 TYR 58 -22.564 15.705 -5.240 490 HE1 TYR 58 HE1 TYR 58 -22.073 11.719 -8.077 491 HE2 TYR 58 HE2 TYR 58 -24.216 13.890 -5.092 492 HH TYR 58 HH TYR 58 -25.057 12.054 -6.367 493 H GLU 59 H GLU 59 -20.770 18.943 -7.167 494 HA GLU 59 HA GLU 59 -23.580 19.161 -7.190 495 HB2 GLU 59 1HB GLU 59 -21.969 20.520 -5.804 496 HB3 GLU 59 2HB GLU 59 -21.582 21.431 -7.257 497 HG2 GLU 59 1HG GLU 59 -23.824 22.257 -7.405 498 HG3 GLU 59 2HG GLU 59 -24.339 21.224 -6.071 499 H TYR 60 H TYR 60 -21.077 20.090 -9.467 500 HA TYR 60 HA TYR 60 -22.570 21.501 -11.335 501 HB2 TYR 60 1HB TYR 60 -20.177 21.397 -11.506 502 HB3 TYR 60 2HB TYR 60 -20.208 19.648 -11.689 503 HD1 TYR 60 HD1 TYR 60 -21.291 22.796 -13.363 504 HD2 TYR 60 HD2 TYR 60 -20.222 18.701 -13.815 505 HE1 TYR 60 HE1 TYR 60 -21.286 23.070 -15.806 506 HE2 TYR 60 HE2 TYR 60 -20.220 18.961 -16.256 507 HH TYR 60 HH TYR 60 -21.191 20.431 -17.960 508 H ILE 61 H ILE 61 -21.972 17.995 -11.171 509 HA ILE 61 HA ILE 61 -23.494 17.508 -13.533 510 HB ILE 61 HB ILE 61 -23.122 15.148 -13.147 511 HG12 ILE 61 1HG1 ILE 61 -21.877 15.956 -10.506 512 HG13 ILE 61 2HG1 ILE 61 -23.423 15.132 -10.688 513 HG21 ILE 61 1HG2 ILE 61 -20.677 15.157 -13.182 514 HG22 ILE 61 2HG2 ILE 61 -20.674 16.803 -12.553 515 HG23 ILE 61 3HG2 ILE 61 -21.341 16.473 -14.151 516 HD11 ILE 61 3HD1 ILE 61 -21.669 13.580 -10.069 517 HD12 ILE 61 1HD1 ILE 61 -20.734 14.042 -11.491 518 HD13 ILE 61 2HD1 ILE 61 -22.280 13.216 -11.682 519 H GLU 62 H GLU 62 -24.236 17.498 -10.104 520 HA GLU 62 HA GLU 62 -26.706 16.064 -10.485 521 HB2 GLU 62 1HB GLU 62 -27.120 16.384 -8.149 522 HB3 GLU 62 2HB GLU 62 -25.425 15.963 -8.346 523 HG2 GLU 62 1HG GLU 62 -24.715 18.144 -7.882 524 HG3 GLU 62 2HG GLU 62 -26.331 18.809 -8.112 525 H GLN 63 H GLN 63 -25.712 19.288 -10.888 526 HA GLN 63 HA GLN 63 -28.377 20.392 -10.585 527 HB2 GLN 63 1HB GLN 63 -25.797 21.566 -11.620 528 HB3 GLN 63 2HB GLN 63 -27.317 22.446 -11.624 529 HG2 GLN 63 1HG GLN 63 -27.422 22.176 -9.163 530 HG3 GLN 63 2HG GLN 63 -25.828 21.422 -9.219 531 HE21 GLN 63 2HE2 GLN 63 -24.027 22.686 -9.747 532 HE22 GLN 63 1HE2 GLN 63 -24.070 24.415 -9.671 533 H SER 64 H SER 64 -28.904 21.931 -12.630 534 HA SER 64 HA SER 64 -29.356 20.074 -14.808 535 HB2 SER 64 1HB SER 64 -31.237 21.436 -14.053 536 HB3 SER 64 2HB SER 64 -30.325 22.910 -14.365 537 HG SER 64 HG SER 64 -30.564 22.641 -16.490 538 H LYS 65 H LYS 65 -27.588 19.837 -16.065 539 HA LYS 65 HA LYS 65 -25.855 21.964 -16.786 540 HB2 LYS 65 1HB LYS 65 -24.923 20.422 -18.440 541 HB3 LYS 65 2HB LYS 65 -25.113 19.630 -16.884 542 HG2 LYS 65 1HG LYS 65 -27.183 18.575 -17.705 543 HG3 LYS 65 2HG LYS 65 -26.915 19.330 -19.278 544 HD2 LYS 65 1HD LYS 65 -25.003 17.428 -17.926 545 HD3 LYS 65 2HD LYS 65 -26.155 16.975 -19.183 546 HE2 LYS 65 1HE LYS 65 -23.971 19.030 -19.505 547 HE3 LYS 65 2HE LYS 65 -23.851 17.352 -20.030 548 HZ1 LYS 65 3HZ LYS 65 -24.466 18.587 -21.917 549 HZ2 LYS 65 1HZ LYS 65 -25.658 19.457 -21.079 550 HZ3 LYS 65 2HZ LYS 65 -25.888 17.814 -21.409 551 H ASN 66 H ASN 66 -28.858 20.769 -18.027 552 HA ASN 66 HA ASN 66 -28.723 22.307 -20.472 553 HB2 ASN 66 1HB ASN 66 -31.014 20.815 -19.168 554 HB3 ASN 66 2HB ASN 66 -31.114 21.631 -20.725 555 HD21 ASN 66 2HD2 ASN 66 -31.482 18.809 -20.057 556 HD22 ASN 66 1HD2 ASN 66 -30.338 17.947 -21.035 557 H CYS 67 H CYS 67 -30.994 23.622 -20.769 558 HA CYS 67 HA CYS 67 -31.565 25.172 -18.391 559 HB2 CYS 67 1HB CYS 67 -30.867 27.246 -19.107 560 HB3 CYS 67 2HB CYS 67 -29.585 26.240 -19.748 561 H SER 68 H SER 68 -33.392 26.532 -18.647 562 HA SER 68 HA SER 68 -35.543 25.174 -19.752 563 HB2 SER 68 1HB SER 68 -36.696 27.487 -19.371 564 HB3 SER 68 2HB SER 68 -36.061 26.589 -17.990 565 HG SER 68 HG SER 68 -35.484 29.027 -18.590 566 H TYR 69 H TYR 69 -33.626 27.750 -21.091 567 HA TYR 69 HA TYR 69 -35.263 28.582 -23.197 568 HB2 TYR 69 1HB TYR 69 -32.921 29.394 -22.185 569 HB3 TYR 69 2HB TYR 69 -32.322 28.541 -23.596 570 HD1 TYR 69 HD1 TYR 69 -34.376 31.374 -22.453 571 HD2 TYR 69 HD2 TYR 69 -32.626 29.426 -25.807 572 HE1 TYR 69 HE1 TYR 69 -34.825 33.357 -23.831 573 HE2 TYR 69 HE2 TYR 69 -33.074 31.406 -27.196 574 HH TYR 69 HH TYR 69 -34.590 33.361 -27.209 575 H CYS 70 H CYS 70 -33.796 25.598 -22.762 576 HA CYS 70 HA CYS 70 -34.189 24.957 -25.595 577 HB2 CYS 70 1HB CYS 70 -32.085 23.737 -25.718 578 HB3 CYS 70 2HB CYS 70 -31.793 25.427 -25.313 579 H SER 71 H SER 71 -34.951 24.226 -22.479 580 HA SER 71 HA SER 71 -35.029 21.341 -22.988 581 HB2 SER 71 1HB SER 71 -35.409 21.153 -20.500 582 HB3 SER 71 2HB SER 71 -33.836 21.782 -20.974 583 HG SER 71 HG SER 71 -35.881 22.997 -19.600 584 H GLU 72 H GLU 72 -36.852 20.811 -23.914 585 HA GLU 72 HA GLU 72 -39.360 22.039 -23.152 586 HB2 GLU 72 1HB GLU 72 -40.312 20.478 -24.890 587 HB3 GLU 72 2HB GLU 72 -39.156 21.657 -25.494 588 HG2 GLU 72 1HG GLU 72 -37.404 19.871 -25.347 589 HG3 GLU 72 2HG GLU 72 -38.701 18.729 -24.994 590 H ASP 73 H ASP 73 -38.848 21.324 -21.033 591 HA ASP 73 HA ASP 73 -40.395 18.969 -20.378 592 HB2 ASP 73 1HB ASP 73 -38.028 18.152 -20.625 593 HB3 ASP 73 2HB ASP 73 -37.555 19.278 -19.360 594 H GLU 74 H GLU 74 -40.963 18.980 -18.123 595 HA GLU 74 HA GLU 74 -41.644 21.538 -17.187 596 HB2 GLU 74 1HB GLU 74 -42.875 19.401 -16.720 597 HB3 GLU 74 2HB GLU 74 -41.616 18.991 -15.561 598 HG2 GLU 74 1HG GLU 74 -42.156 21.050 -14.304 599 HG3 GLU 74 2HG GLU 74 -43.466 21.366 -15.440 600 H ASN 75 H ASN 75 -38.808 19.640 -16.707 601 HA ASN 75 HA ASN 75 -37.920 20.851 -14.300 602 HB2 ASN 75 1HB ASN 75 -36.659 19.150 -16.391 603 HB3 ASN 75 2HB ASN 75 -35.594 20.082 -15.344 604 HD21 ASN 75 2HD2 ASN 75 -34.772 18.227 -14.385 605 HD22 ASN 75 1HD2 ASN 75 -35.684 17.299 -13.247 606 H CYS 76 H CYS 76 -38.444 23.009 -14.754 607 HA CYS 76 HA CYS 76 -36.463 24.453 -16.383 608 HB2 CYS 76 1HB CYS 76 -38.851 24.888 -16.894 609 HB3 CYS 76 2HB CYS 76 -39.110 25.388 -15.228 610 HG CYS 76 HG CYS 76 -36.726 27.275 -16.117 611 H ASN 77 H ASN 77 -36.100 23.225 -13.716 612 HA ASN 77 HA ASN 77 -36.131 25.379 -11.789 613 HB2 ASN 77 1HB ASN 77 -35.290 23.655 -10.221 614 HB3 ASN 77 2HB ASN 77 -36.753 23.156 -11.060 615 HD21 ASN 77 2HD2 ASN 77 -33.369 22.609 -10.640 616 HD22 ASN 77 1HD2 ASN 77 -33.291 21.124 -11.520 617 H ASN 78 H ASN 78 -34.293 25.427 -14.161 618 HA ASN 78 HA ASN 78 -31.652 25.387 -12.991 619 HB2 ASN 78 1HB ASN 78 -30.950 26.422 -15.160 620 HB3 ASN 78 2HB ASN 78 -31.806 24.896 -15.351 621 HD21 ASN 78 2HD2 ASN 78 -31.867 28.303 -15.941 622 HD22 ASN 78 1HD2 ASN 78 -33.314 28.323 -16.889 623 H LEU 79 H LEU 79 -30.477 27.126 -12.282 624 HA LEU 79 HA LEU 79 -31.975 29.302 -11.230 625 HB2 LEU 79 1HB LEU 79 -29.768 28.138 -10.394 626 HB3 LEU 79 2HB LEU 79 -28.985 29.334 -11.404 627 HG LEU 79 HG LEU 79 -30.869 29.995 -9.137 628 HD11 LEU 79 1HD1 LEU 79 -27.857 30.021 -9.230 629 HD12 LEU 79 2HD1 LEU 79 -28.870 28.936 -8.277 630 HD13 LEU 79 3HD1 LEU 79 -28.846 30.663 -7.919 631 HD21 LEU 79 3HD2 LEU 79 -29.988 32.261 -9.366 632 HD22 LEU 79 1HD2 LEU 79 -30.769 31.730 -10.855 633 HD23 LEU 79 2HD2 LEU 79 -29.009 31.751 -10.741 634 H LEU 80 H LEU 80 -29.152 29.384 -13.417 635 HA LEU 80 HA LEU 80 -30.024 31.946 -14.448 636 HB2 LEU 80 1HB LEU 80 -27.611 30.242 -15.063 637 HB3 LEU 80 2HB LEU 80 -27.958 31.751 -15.882 638 HG LEU 80 HG LEU 80 -27.929 32.815 -13.542 639 HD11 LEU 80 1HD1 LEU 80 -28.019 30.759 -12.242 640 HD12 LEU 80 2HD1 LEU 80 -26.551 31.670 -11.888 641 HD13 LEU 80 3HD1 LEU 80 -26.476 30.246 -12.926 642 HD21 LEU 80 3HD2 LEU 80 -25.401 31.706 -14.749 643 HD22 LEU 80 1HD2 LEU 80 -25.494 33.052 -13.614 644 HD23 LEU 80 2HD2 LEU 80 -26.215 33.199 -15.216 645 H GLU 81 H GLU 81 -31.315 32.151 -16.127 646 HA GLU 81 HA GLU 81 -31.781 29.823 -17.835 647 HB2 GLU 81 1HB GLU 81 -33.774 30.876 -16.949 648 HB3 GLU 81 2HB GLU 81 -33.269 32.445 -17.563 649 HG2 GLU 81 1HG GLU 81 -33.520 31.680 -19.836 650 HG3 GLU 81 2HG GLU 81 -33.915 30.057 -19.272 651 H GLY 82 H GLY 82 -31.387 29.795 -19.986 652 HA2 GLY 82 1HA GLY 82 -30.715 30.632 -22.068 653 HA3 GLY 82 2HA GLY 82 -30.370 32.177 -21.303 654 H TYR 83 H TYR 83 -28.994 30.170 -19.247 655 HA TYR 83 HA TYR 83 -26.454 30.048 -20.733 656 HB2 TYR 83 1HB TYR 83 -26.871 30.622 -17.791 657 HB3 TYR 83 2HB TYR 83 -25.308 30.427 -18.573 658 HD1 TYR 83 HD2 TYR 83 -24.671 32.097 -20.393 659 HD2 TYR 83 HD1 TYR 83 -27.919 32.710 -17.719 660 HE1 TYR 83 HE2 TYR 83 -24.620 34.502 -20.891 661 HE2 TYR 83 HE1 TYR 83 -27.873 35.118 -18.209 662 HH TYR 83 HH TYR 83 -26.142 36.789 -19.025 663 H HIS 84 H HIS 84 -24.937 28.406 -19.924 664 HA HIS 84 HA HIS 84 -26.214 26.163 -18.491 665 HB2 HIS 84 1HB HIS 84 -24.378 26.018 -20.883 666 HB3 HIS 84 2HB HIS 84 -24.651 24.649 -19.817 667 HD1 HIS 84 HD1 HIS 84 -25.764 23.224 -21.658 668 HD2 HIS 84 HD2 HIS 84 -27.659 26.843 -20.913 669 HE1 HIS 84 HE1 HIS 84 -27.899 23.213 -23.023 670 HA PRO 85 HA PRO 85 -22.701 26.452 -15.793 671 HB2 PRO 85 1HB PRO 85 -22.976 23.548 -15.424 672 HB3 PRO 85 2HB PRO 85 -23.114 24.847 -14.237 673 HG2 PRO 85 1HG PRO 85 -25.244 23.446 -15.104 674 HG3 PRO 85 2HG PRO 85 -25.351 25.152 -14.640 675 HD2 PRO 85 1HD PRO 85 -25.288 23.931 -17.363 676 HD3 PRO 85 2HD PRO 85 -26.180 25.349 -16.781 677 H LYS 86 H LYS 86 -20.610 26.355 -16.169 678 HA LYS 86 HA LYS 86 -19.487 24.139 -17.741 679 HB2 LYS 86 1HB LYS 86 -17.877 25.844 -18.736 680 HB3 LYS 86 2HB LYS 86 -19.527 25.914 -19.336 681 HG2 LYS 86 1HG LYS 86 -20.015 27.815 -17.976 682 HG3 LYS 86 2HG LYS 86 -18.465 27.682 -17.151 683 HD2 LYS 86 1HD LYS 86 -18.754 28.213 -20.103 684 HD3 LYS 86 2HD LYS 86 -18.597 29.481 -18.887 685 HE2 LYS 86 1HE LYS 86 -16.468 28.268 -18.164 686 HE3 LYS 86 2HE LYS 86 -16.594 27.395 -19.692 687 HZ1 LYS 86 3HZ LYS 86 -15.189 29.264 -20.033 688 HZ2 LYS 86 1HZ LYS 86 -16.302 30.324 -19.309 689 HZ3 LYS 86 2HZ LYS 86 -16.657 29.606 -20.806 690 H LEU 87 H LEU 87 -17.379 23.546 -17.107 691 HA LEU 87 HA LEU 87 -16.758 24.346 -14.393 692 HB2 LEU 87 1HB LEU 87 -15.523 22.262 -16.187 693 HB3 LEU 87 2HB LEU 87 -15.073 22.532 -14.513 694 HG LEU 87 HG LEU 87 -17.794 21.643 -15.473 695 HD11 LEU 87 1HD1 LEU 87 -16.127 19.898 -15.728 696 HD12 LEU 87 2HD1 LEU 87 -17.217 19.521 -14.392 697 HD13 LEU 87 3HD1 LEU 87 -15.598 20.136 -14.061 698 HD21 LEU 87 3HD2 LEU 87 -18.237 21.286 -13.069 699 HD22 LEU 87 1HD2 LEU 87 -17.979 22.986 -13.472 700 HD23 LEU 87 2HD2 LEU 87 -16.696 22.059 -12.696 701 H VAL 88 H VAL 88 -15.079 25.564 -13.765 702 HA VAL 88 HA VAL 88 -13.010 26.232 -15.746 703 HB VAL 88 HB VAL 88 -12.957 28.582 -14.834 704 HG11 VAL 88 1HG1 VAL 88 -13.941 28.096 -17.006 705 HG12 VAL 88 2HG1 VAL 88 -14.847 29.371 -16.191 706 HG13 VAL 88 3HG1 VAL 88 -15.486 27.728 -16.241 707 HG21 VAL 88 3HG2 VAL 88 -15.634 27.809 -13.670 708 HG22 VAL 88 1HG2 VAL 88 -14.970 29.442 -13.726 709 HG23 VAL 88 2HG2 VAL 88 -14.176 28.201 -12.757 710 H VAL 89 H VAL 89 -10.951 26.300 -14.923 711 HA VAL 89 HA VAL 89 -10.552 25.518 -12.186 712 HB VAL 89 HB VAL 89 -8.999 24.662 -13.841 713 HG11 VAL 89 1HG1 VAL 89 -7.418 26.122 -15.023 714 HG12 VAL 89 2HG1 VAL 89 -8.238 27.535 -14.359 715 HG13 VAL 89 3HG1 VAL 89 -9.089 26.463 -15.471 716 HG21 VAL 89 3HG2 VAL 89 -6.867 25.287 -12.794 717 HG22 VAL 89 1HG2 VAL 89 -8.131 24.984 -11.601 718 HG23 VAL 89 2HG2 VAL 89 -7.670 26.640 -11.997 719 H ASN 90 H ASN 90 -10.327 26.836 -10.496 720 HA ASN 90 HA ASN 90 -10.080 29.719 -11.071 721 HB2 ASN 90 1HB ASN 90 -12.392 28.605 -10.333 722 HB3 ASN 90 2HB ASN 90 -11.686 28.808 -8.737 723 HD21 ASN 90 2HD2 ASN 90 -12.951 30.404 -11.529 724 HD22 ASN 90 1HD2 ASN 90 -13.036 31.988 -10.843 725 H GLY 91 H GLY 91 -7.965 29.931 -10.472 726 HA2 GLY 91 1HA GLY 91 -6.201 30.236 -9.045 727 HA3 GLY 91 2HA GLY 91 -7.390 30.278 -7.750 728 H ARG 92 H ARG 92 -7.459 28.647 -6.346 729 HA ARG 92 HA ARG 92 -5.771 26.314 -6.921 730 HB2 ARG 92 1HB ARG 92 -6.315 27.782 -4.360 731 HB3 ARG 92 2HB ARG 92 -5.719 26.127 -4.355 732 HG2 ARG 92 1HG ARG 92 -3.848 27.574 -4.126 733 HG3 ARG 92 2HG ARG 92 -3.797 26.889 -5.751 734 HD2 ARG 92 1HD ARG 92 -4.930 28.983 -6.552 735 HD3 ARG 92 2HD ARG 92 -4.681 29.647 -4.944 736 HE ARG 92 HE ARG 92 -2.601 29.033 -6.921 737 HH11 ARG 92 1HH1 ARG 92 -3.516 30.411 -3.829 738 HH12 ARG 92 2HH1 ARG 92 -2.025 31.284 -3.639 739 HH21 ARG 92 1HH2 ARG 92 -0.678 30.191 -6.707 740 HH22 ARG 92 2HH2 ARG 92 -0.404 31.174 -5.293 741 H SER 93 H SER 93 -8.738 26.887 -7.371 742 HA SER 93 HA SER 93 -9.585 24.249 -6.462 743 HB2 SER 93 1HB SER 93 -10.388 25.956 -4.776 744 HB3 SER 93 2HB SER 93 -11.340 26.688 -6.066 745 HG SER 93 HG SER 93 -12.711 25.298 -5.099 746 H ILE 94 H ILE 94 -11.898 23.879 -7.500 747 HA ILE 94 HA ILE 94 -11.866 25.031 -10.207 748 HB ILE 94 HB ILE 94 -12.895 22.315 -9.357 749 HG12 ILE 94 1HG1 ILE 94 -10.568 22.974 -11.168 750 HG13 ILE 94 2HG1 ILE 94 -10.385 22.644 -9.449 751 HG21 ILE 94 1HG2 ILE 94 -12.779 23.612 -12.076 752 HG22 ILE 94 2HG2 ILE 94 -14.235 23.223 -11.160 753 HG23 ILE 94 3HG2 ILE 94 -13.207 21.928 -11.774 754 HD11 ILE 94 3HD1 ILE 94 -11.434 20.751 -11.541 755 HD12 ILE 94 1HD1 ILE 94 -11.344 20.410 -9.811 756 HD13 ILE 94 2HD1 ILE 94 -9.863 20.679 -10.732 757 H ASP 95 H ASP 95 -13.780 25.855 -10.991 758 HA ASP 95 HA ASP 95 -16.003 25.963 -9.093 759 HB2 ASP 95 1HB ASP 95 -14.305 28.176 -9.984 760 HB3 ASP 95 2HB ASP 95 -16.024 28.477 -10.223 761 H ILE 96 H ILE 96 -17.844 27.286 -10.236 762 HA ILE 96 HA ILE 96 -18.193 26.063 -12.881 763 HB ILE 96 HB ILE 96 -20.292 26.486 -10.751 764 HG12 ILE 96 1HG1 ILE 96 -19.241 23.873 -11.839 765 HG13 ILE 96 2HG1 ILE 96 -18.549 24.647 -10.418 766 HG21 ILE 96 1HG2 ILE 96 -21.789 25.286 -12.251 767 HG22 ILE 96 2HG2 ILE 96 -20.501 25.154 -13.450 768 HG23 ILE 96 3HG2 ILE 96 -21.159 26.738 -13.032 769 HD11 ILE 96 3HD1 ILE 96 -20.712 24.516 -9.302 770 HD12 ILE 96 1HD1 ILE 96 -20.116 22.929 -9.789 771 HD13 ILE 96 2HD1 ILE 96 -21.389 23.716 -10.722 772 H GLU 97 H GLU 97 -18.463 27.372 -14.421 773 HA GLU 97 HA GLU 97 -19.381 30.125 -13.942 774 HB2 GLU 97 1HB GLU 97 -17.086 29.375 -15.081 775 HB3 GLU 97 2HB GLU 97 -18.121 29.217 -16.491 776 HG2 GLU 97 1HG GLU 97 -18.736 31.534 -16.355 777 HG3 GLU 97 2HG GLU 97 -17.818 31.714 -14.860 778 H TYR 98 H TYR 98 -20.368 30.876 -16.284 779 HA TYR 98 HA TYR 98 -22.183 28.791 -17.248 780 HB2 TYR 98 1HB TYR 98 -22.903 31.332 -15.895 781 HB3 TYR 98 2HB TYR 98 -23.873 30.879 -17.292 782 HD1 TYR 98 HD2 TYR 98 -22.707 29.645 -13.973 783 HD2 TYR 98 HD1 TYR 98 -25.587 29.290 -17.092 784 HE1 TYR 98 HE2 TYR 98 -24.047 28.140 -12.556 785 HE2 TYR 98 HE1 TYR 98 -26.936 27.793 -15.678 786 HH TYR 98 HH TYR 98 -26.278 27.336 -12.330 787 H TYR 99 H TYR 99 -22.462 28.814 -19.410 788 HA TYR 99 HA TYR 99 -21.540 31.208 -20.865 789 HB2 TYR 99 1HB TYR 99 -20.935 29.746 -22.745 790 HB3 TYR 99 2HB TYR 99 -20.043 29.329 -21.289 791 HD1 TYR 99 HD1 TYR 99 -22.656 28.238 -23.635 792 HD2 TYR 99 HD2 TYR 99 -20.372 27.210 -20.203 793 HE1 TYR 99 HE1 TYR 99 -23.348 25.889 -23.893 794 HE2 TYR 99 HE2 TYR 99 -21.053 24.861 -20.437 795 HH TYR 99 HH TYR 99 -22.652 23.483 -21.447 796 H GLU 100 H GLU 100 -22.591 31.515 -22.994 797 HA GLU 100 HA GLU 100 -25.406 31.561 -22.558 798 HB2 GLU 100 1HB GLU 100 -23.834 32.304 -25.026 799 HB3 GLU 100 2HB GLU 100 -25.510 32.728 -24.707 800 HG2 GLU 100 1HG GLU 100 -24.774 34.013 -22.736 801 HG3 GLU 100 2HG GLU 100 -23.102 33.648 -23.155 802 H CYS 101 H CYS 101 -26.845 30.112 -23.073 803 HA CYS 101 HA CYS 101 -26.495 27.673 -24.314 804 HB2 CYS 101 1HB CYS 101 -28.512 28.381 -23.041 805 HB3 CYS 101 2HB CYS 101 -28.987 29.399 -24.393 806 HA PRO 102 HA PRO 102 -25.583 28.802 -28.563 807 HB2 PRO 102 1HB PRO 102 -26.131 26.230 -29.512 808 HB3 PRO 102 2HB PRO 102 -24.562 26.829 -28.978 809 HG2 PRO 102 1HG PRO 102 -26.553 25.173 -27.517 810 HG3 PRO 102 2HG PRO 102 -24.785 25.143 -27.436 811 HD2 PRO 102 1HD PRO 102 -26.287 26.243 -25.497 812 HD3 PRO 102 2HD PRO 102 -24.701 26.900 -25.945 813 H VAL 103 H VAL 103 -28.538 27.489 -27.367 814 HA VAL 103 HA VAL 103 -29.989 27.533 -29.827 815 HB VAL 103 HB VAL 103 -31.039 27.488 -26.990 816 HG11 VAL 103 1HG1 VAL 103 -32.763 28.130 -28.577 817 HG12 VAL 103 2HG1 VAL 103 -33.055 26.498 -27.972 818 HG13 VAL 103 3HG1 VAL 103 -32.379 26.733 -29.584 819 HG21 VAL 103 3HG2 VAL 103 -30.435 25.220 -28.882 820 HG22 VAL 103 1HG2 VAL 103 -31.185 25.063 -27.295 821 HG23 VAL 103 2HG2 VAL 103 -29.521 25.635 -27.430 822 H LYS 104 H LYS 104 -28.974 29.915 -27.634 823 HA LYS 104 HA LYS 104 -30.952 31.877 -27.865 824 HB2 LYS 104 1HB LYS 104 -27.977 31.977 -27.504 825 HB3 LYS 104 2HB LYS 104 -28.870 33.467 -27.769 826 HG2 LYS 104 1HG LYS 104 -29.591 31.531 -25.590 827 HG3 LYS 104 2HG LYS 104 -28.400 32.816 -25.369 828 HD2 LYS 104 1HD LYS 104 -30.114 34.467 -26.042 829 HD3 LYS 104 2HD LYS 104 -31.295 33.160 -26.144 830 HE2 LYS 104 1HE LYS 104 -31.124 32.727 -23.803 831 HE3 LYS 104 2HE LYS 104 -29.743 33.812 -23.646 832 HZ1 LYS 104 3HZ LYS 104 -31.170 35.674 -24.185 833 HZ2 LYS 104 1HZ LYS 104 -31.796 34.831 -22.851 834 HZ3 LYS 104 2HZ LYS 104 -32.499 34.649 -24.383 835 H ARG 105 H ARG 105 -28.113 31.265 -29.880 836 HA ARG 105 HA ARG 105 -27.483 31.928 -31.948 837 HB2 ARG 105 1HB ARG 105 -29.035 31.296 -33.711 838 HB3 ARG 105 2HB ARG 105 -29.016 30.100 -32.430 839 HG2 ARG 105 1HG ARG 105 -31.106 31.230 -31.545 840 HG3 ARG 105 2HG ARG 105 -31.160 32.095 -33.080 841 HD2 ARG 105 1HD ARG 105 -31.124 29.095 -32.778 842 HD3 ARG 105 2HD ARG 105 -32.570 30.064 -33.052 843 HE ARG 105 HE ARG 105 -31.270 30.791 -35.167 844 HH11 ARG 105 1HH1 ARG 105 -31.305 27.596 -33.721 845 HH12 ARG 105 2HH1 ARG 105 -30.972 26.775 -35.219 846 HH21 ARG 105 1HH2 ARG 105 -30.847 29.719 -37.145 847 HH22 ARG 105 2HH2 ARG 105 -30.685 27.983 -37.159 848 H LYS 106 H LYS 106 -28.392 34.132 -30.295 849 HA LYS 106 HA LYS 106 -28.939 36.065 -32.423 850 HB2 LYS 106 1HB LYS 106 -30.455 35.959 -29.806 851 HB3 LYS 106 2HB LYS 106 -30.574 37.249 -30.993 852 HG2 LYS 106 1HG LYS 106 -31.539 35.753 -32.603 853 HG3 LYS 106 2HG LYS 106 -31.292 34.375 -31.528 854 HD2 LYS 106 1HD LYS 106 -32.794 35.518 -29.875 855 HD3 LYS 106 2HD LYS 106 -33.149 36.716 -31.123 856 HE2 LYS 106 1HE LYS 106 -34.886 35.067 -31.149 857 HE3 LYS 106 2HE LYS 106 -33.904 34.858 -32.600 858 HZ1 LYS 106 3HZ LYS 106 -32.657 33.136 -31.186 859 HZ2 LYS 106 1HZ LYS 106 -34.178 32.713 -31.811 860 HZ3 LYS 106 2HZ LYS 106 -34.024 33.166 -30.186 Start of MODEL 8 1 HA MET 1 HA MET 1 -25.627 -9.958 -14.758 2 HB2 MET 1 1HB MET 1 -26.520 -8.118 -16.191 3 HB3 MET 1 2HB MET 1 -26.552 -9.696 -16.964 4 HG2 MET 1 1HG MET 1 -28.907 -9.895 -16.609 5 HG3 MET 1 2HG MET 1 -28.928 -8.432 -15.625 6 HE1 MET 1 2HE MET 1 -28.686 -6.027 -16.522 7 HE2 MET 1 3HE MET 1 -28.287 -5.612 -18.190 8 HE3 MET 1 1HE MET 1 -27.096 -6.425 -17.174 9 H GLU 2 H GLU 2 -27.022 -10.348 -12.374 10 HA GLU 2 HA GLU 2 -27.931 -7.635 -11.675 11 HB2 GLU 2 1HB GLU 2 -28.642 -10.233 -10.299 12 HB3 GLU 2 2HB GLU 2 -29.207 -8.636 -9.841 13 HG2 GLU 2 1HG GLU 2 -30.981 -9.638 -10.994 14 HG3 GLU 2 2HG GLU 2 -30.271 -8.488 -12.126 15 HA PRO 3 HA PRO 3 -24.014 -8.133 -9.323 16 HB2 PRO 3 1HB PRO 3 -23.461 -5.461 -9.293 17 HB3 PRO 3 2HB PRO 3 -22.965 -6.542 -10.598 18 HG2 PRO 3 1HG PRO 3 -25.283 -4.663 -10.474 19 HG3 PRO 3 2HG PRO 3 -24.189 -5.007 -11.826 20 HD2 PRO 3 1HD PRO 3 -26.676 -6.072 -11.643 21 HD3 PRO 3 2HD PRO 3 -25.325 -6.921 -12.420 22 H ILE 4 H ILE 4 -24.448 -8.485 -7.245 23 HA ILE 4 HA ILE 4 -26.523 -7.162 -5.830 24 HB ILE 4 HB ILE 4 -24.235 -8.781 -4.691 25 HG12 ILE 4 1HG1 ILE 4 -25.431 -10.101 -6.346 26 HG13 ILE 4 2HG1 ILE 4 -25.856 -10.671 -4.736 27 HG21 ILE 4 1HG2 ILE 4 -25.401 -7.444 -3.013 28 HG22 ILE 4 2HG2 ILE 4 -25.722 -9.165 -2.794 29 HG23 ILE 4 3HG2 ILE 4 -26.943 -8.128 -3.531 30 HD11 ILE 4 3HD1 ILE 4 -27.535 -8.877 -6.472 31 HD12 ILE 4 1HD1 ILE 4 -27.955 -9.429 -4.852 32 HD13 ILE 4 2HD1 ILE 4 -27.805 -10.593 -6.168 33 H GLY 5 H GLY 5 -23.042 -6.764 -5.987 34 HA2 GLY 5 1HA GLY 5 -21.881 -4.767 -5.719 35 HA3 GLY 5 2HA GLY 5 -23.347 -4.028 -5.095 36 H ARG 6 H ARG 6 -24.044 -5.104 -2.896 37 HA ARG 6 HA ARG 6 -21.715 -4.692 -1.221 38 HB2 ARG 6 1HB ARG 6 -23.228 -4.426 0.656 39 HB3 ARG 6 2HB ARG 6 -23.697 -3.388 -0.673 40 HG2 ARG 6 1HG ARG 6 -25.036 -6.027 -0.145 41 HG3 ARG 6 2HG ARG 6 -25.547 -4.530 0.628 42 HD2 ARG 6 1HD ARG 6 -25.789 -3.562 -1.693 43 HD3 ARG 6 2HD ARG 6 -25.563 -5.201 -2.306 44 HE ARG 6 HE ARG 6 -27.627 -4.999 -0.312 45 HH11 ARG 6 1HH1 ARG 6 -26.913 -4.752 -3.744 46 HH12 ARG 6 2HH1 ARG 6 -28.570 -4.927 -4.224 47 HH21 ARG 6 1HH2 ARG 6 -29.815 -5.210 -0.958 48 HH22 ARG 6 2HH2 ARG 6 -30.214 -5.197 -2.656 49 H SER 7 H SER 7 -20.746 -6.699 -1.801 50 HA SER 7 HA SER 7 -21.850 -9.139 -0.789 51 HB2 SER 7 1HB SER 7 -19.021 -8.465 -1.641 52 HB3 SER 7 2HB SER 7 -19.633 -10.088 -1.319 53 HG SER 7 HG SER 7 -19.635 -9.014 -3.613 54 H LEU 8 H LEU 8 -22.330 -8.957 1.312 55 HA LEU 8 HA LEU 8 -20.535 -7.650 3.132 56 HB2 LEU 8 1HB LEU 8 -23.188 -9.010 3.509 57 HB3 LEU 8 2HB LEU 8 -22.249 -8.388 4.853 58 HG LEU 8 HG LEU 8 -23.373 -6.772 2.566 59 HD11 LEU 8 1HD1 LEU 8 -24.051 -6.803 5.503 60 HD12 LEU 8 2HD1 LEU 8 -25.022 -7.527 4.221 61 HD13 LEU 8 3HD1 LEU 8 -24.786 -5.780 4.267 62 HD21 LEU 8 3HD2 LEU 8 -21.200 -5.916 3.297 63 HD22 LEU 8 1HD2 LEU 8 -21.769 -5.895 4.967 64 HD23 LEU 8 2HD2 LEU 8 -22.509 -4.831 3.770 65 H GLN 9 H GLN 9 -18.775 -9.147 2.674 66 HA GLN 9 HA GLN 9 -18.781 -11.594 4.181 67 HB2 GLN 9 1HB GLN 9 -17.163 -11.198 2.365 68 HB3 GLN 9 2HB GLN 9 -16.477 -9.854 3.269 69 HG2 GLN 9 1HG GLN 9 -15.747 -11.359 5.011 70 HG3 GLN 9 2HG GLN 9 -16.500 -12.718 4.177 71 HE21 GLN 9 2HE2 GLN 9 -13.868 -10.457 4.177 72 HE22 GLN 9 1HE2 GLN 9 -12.900 -11.266 2.986 73 H GLY 10 H GLY 10 -19.521 -11.212 6.223 74 HA2 GLY 10 1HA GLY 10 -19.078 -10.553 8.478 75 HA3 GLY 10 2HA GLY 10 -18.056 -9.253 7.867 76 H VAL 11 H VAL 11 -21.333 -10.313 8.417 77 HA VAL 11 HA VAL 11 -22.533 -8.048 7.109 78 HB VAL 11 HB VAL 11 -24.676 -8.977 7.916 79 HG11 VAL 11 1HG1 VAL 11 -22.824 -10.979 6.625 80 HG12 VAL 11 2HG1 VAL 11 -23.759 -9.733 5.797 81 HG13 VAL 11 3HG1 VAL 11 -24.586 -11.058 6.616 82 HG21 VAL 11 3HG2 VAL 11 -24.674 -11.172 9.047 83 HG22 VAL 11 1HG2 VAL 11 -23.968 -9.896 10.039 84 HG23 VAL 11 2HG2 VAL 11 -22.922 -11.057 9.220 85 H THR 12 H THR 12 -20.983 -8.231 9.948 86 HA THR 12 HA THR 12 -22.832 -6.976 11.721 87 HB THR 12 HB THR 12 -20.623 -6.531 13.027 88 HG1 THR 12 HG1 THR 12 -18.984 -6.934 11.697 89 HG21 THR 12 3HG2 THR 12 -22.257 -8.250 13.623 90 HG22 THR 12 1HG2 THR 12 -20.612 -8.852 13.830 91 HG23 THR 12 2HG2 THR 12 -21.559 -9.339 12.424 92 H GLY 13 H GLY 13 -21.028 -5.817 9.124 93 HA2 GLY 13 1HA GLY 13 -21.467 -3.063 10.061 94 HA3 GLY 13 2HA GLY 13 -19.907 -3.516 9.390 95 H ARG 14 H ARG 14 -21.900 -1.545 8.472 96 HA ARG 14 HA ARG 14 -21.956 -2.401 5.683 97 HB2 ARG 14 1HB ARG 14 -24.390 -1.419 7.182 98 HB3 ARG 14 2HB ARG 14 -24.256 -1.314 5.436 99 HG2 ARG 14 1HG ARG 14 -25.468 -3.242 5.706 100 HG3 ARG 14 2HG ARG 14 -23.827 -3.874 5.579 101 HD2 ARG 14 1HD ARG 14 -25.119 -4.923 7.399 102 HD3 ARG 14 2HD ARG 14 -23.679 -4.086 7.978 103 HE ARG 14 HE ARG 14 -25.879 -2.328 8.093 104 HH11 ARG 14 1HH1 ARG 14 -24.687 -5.234 9.637 105 HH12 ARG 14 2HH1 ARG 14 -25.409 -4.867 11.179 106 HH21 ARG 14 1HH2 ARG 14 -26.811 -1.829 10.121 107 HH22 ARG 14 2HH2 ARG 14 -26.604 -2.924 11.458 108 HA PRO 15 HA PRO 15 -20.251 1.851 6.241 109 HB2 PRO 15 1HB PRO 15 -18.551 1.554 4.100 110 HB3 PRO 15 2HB PRO 15 -18.130 1.170 5.771 111 HG2 PRO 15 1HG PRO 15 -19.016 -0.655 3.571 112 HG3 PRO 15 2HG PRO 15 -17.762 -0.904 4.800 113 HD2 PRO 15 1HD PRO 15 -20.197 -2.034 5.013 114 HD3 PRO 15 2HD PRO 15 -19.301 -1.461 6.435 115 H ASP 16 H ASP 16 -22.273 2.699 5.569 116 HA ASP 16 HA ASP 16 -23.011 2.748 2.795 117 HB2 ASP 16 1HB ASP 16 -24.715 2.882 4.535 118 HB3 ASP 16 2HB ASP 16 -24.006 4.369 5.148 119 H PHE 17 H PHE 17 -21.163 4.715 4.954 120 HA PHE 17 HA PHE 17 -21.049 7.124 3.598 121 HB2 PHE 17 1HB PHE 17 -20.103 6.755 5.839 122 HB3 PHE 17 2HB PHE 17 -18.834 5.757 5.141 123 HD1 PHE 17 HD2 PHE 17 -20.199 9.195 5.251 124 HD2 PHE 17 HD1 PHE 17 -16.880 6.716 4.268 125 HE1 PHE 17 HE2 PHE 17 -18.798 11.196 4.947 126 HE2 PHE 17 HE1 PHE 17 -15.476 8.711 3.963 127 HZ PHE 17 HZ PHE 17 -16.433 10.954 4.303 128 H GLN 18 H GLN 18 -18.937 4.271 3.203 129 HA GLN 18 HA GLN 18 -17.384 5.452 1.146 130 HB2 GLN 18 1HB GLN 18 -16.397 3.283 0.822 131 HB3 GLN 18 2HB GLN 18 -16.609 3.540 2.546 132 HG2 GLN 18 1HG GLN 18 -17.545 1.534 2.603 133 HG3 GLN 18 2HG GLN 18 -18.934 2.264 1.801 134 HE21 GLN 18 2HE2 GLN 18 -17.391 2.694 -0.695 135 HE22 GLN 18 1HE2 GLN 18 -17.287 1.135 -1.432 136 H LYS 19 H LYS 19 -20.381 3.662 1.176 137 HA LYS 19 HA LYS 19 -20.431 2.950 -1.542 138 HB2 LYS 19 1HB LYS 19 -22.567 3.293 0.539 139 HB3 LYS 19 2HB LYS 19 -23.002 3.002 -1.143 140 HG2 LYS 19 1HG LYS 19 -21.583 0.959 -1.085 141 HG3 LYS 19 2HG LYS 19 -21.370 1.222 0.647 142 HD2 LYS 19 1HD LYS 19 -24.001 0.798 -0.770 143 HD3 LYS 19 2HD LYS 19 -23.144 -0.404 0.192 144 HE2 LYS 19 1HE LYS 19 -23.343 1.078 2.154 145 HE3 LYS 19 2HE LYS 19 -24.276 2.210 1.178 146 HZ1 LYS 19 3HZ LYS 19 -25.740 0.822 2.466 147 HZ2 LYS 19 1HZ LYS 19 -25.039 -0.586 1.826 148 HZ3 LYS 19 2HZ LYS 19 -25.926 0.458 0.821 149 H ARG 20 H ARG 20 -21.823 5.767 0.140 150 HA ARG 20 HA ARG 20 -22.753 6.918 -2.295 151 HB2 ARG 20 1HB ARG 20 -23.384 8.829 -1.024 152 HB3 ARG 20 2HB ARG 20 -23.768 7.398 -0.081 153 HG2 ARG 20 1HG ARG 20 -21.853 7.753 1.327 154 HG3 ARG 20 2HG ARG 20 -21.321 9.103 0.317 155 HD2 ARG 20 1HD ARG 20 -23.824 8.941 1.981 156 HD3 ARG 20 2HD ARG 20 -22.434 9.996 2.245 157 HE ARG 20 HE ARG 20 -23.581 10.400 -0.325 158 HH11 ARG 20 1HH1 ARG 20 -23.966 11.208 3.060 159 HH12 ARG 20 2HH1 ARG 20 -24.906 12.638 2.731 160 HH21 ARG 20 1HH2 ARG 20 -24.789 12.259 -0.758 161 HH22 ARG 20 2HH2 ARG 20 -25.384 13.228 0.556 162 H LEU 21 H LEU 21 -19.780 7.068 -0.495 163 HA LEU 21 HA LEU 21 -18.700 9.392 -1.702 164 HB2 LEU 21 1HB LEU 21 -17.711 8.610 0.312 165 HB3 LEU 21 2HB LEU 21 -17.459 7.006 -0.349 166 HG LEU 21 HG LEU 21 -15.783 7.963 -1.915 167 HD11 LEU 21 1HD1 LEU 21 -14.906 10.199 -1.484 168 HD12 LEU 21 2HD1 LEU 21 -16.150 10.458 -0.259 169 HD13 LEU 21 3HD1 LEU 21 -16.606 10.260 -1.952 170 HD21 LEU 21 3HD2 LEU 21 -15.264 8.430 1.020 171 HD22 LEU 21 1HD2 LEU 21 -14.030 8.260 -0.229 172 HD23 LEU 21 2HD2 LEU 21 -15.086 6.901 0.158 173 H GLU 22 H GLU 22 -18.193 5.932 -2.388 174 HA GLU 22 HA GLU 22 -16.689 6.311 -4.739 175 HB2 GLU 22 1HB GLU 22 -18.414 3.992 -3.852 176 HB3 GLU 22 2HB GLU 22 -17.377 3.951 -5.270 177 HG2 GLU 22 1HG GLU 22 -16.386 4.472 -2.479 178 HG3 GLU 22 2HG GLU 22 -16.413 2.883 -3.242 179 H GLN 23 H GLN 23 -20.108 6.220 -4.103 180 HA GLN 23 HA GLN 23 -21.086 5.939 -6.719 181 HB2 GLN 23 1HB GLN 23 -22.370 5.784 -4.539 182 HB3 GLN 23 2HB GLN 23 -22.349 7.539 -4.492 183 HG2 GLN 23 1HG GLN 23 -23.530 7.560 -6.668 184 HG3 GLN 23 2HG GLN 23 -23.652 5.804 -6.571 185 HE21 GLN 23 2HE2 GLN 23 -24.936 4.871 -4.940 186 HE22 GLN 23 1HE2 GLN 23 -26.191 5.783 -4.176 187 H MET 24 H MET 24 -20.702 8.901 -4.751 188 HA MET 24 HA MET 24 -21.303 10.669 -6.861 189 HB2 MET 24 1HB MET 24 -20.390 12.439 -5.441 190 HB3 MET 24 2HB MET 24 -21.453 11.381 -4.530 191 HG2 MET 24 1HG MET 24 -19.521 10.256 -3.582 192 HG3 MET 24 2HG MET 24 -18.450 11.298 -4.516 193 HE1 MET 24 3HE MET 24 -19.143 14.813 -2.939 194 HE2 MET 24 1HE MET 24 -19.930 14.109 -4.352 195 HE3 MET 24 2HE MET 24 -18.193 13.904 -4.117 196 H LYS 25 H LYS 25 -18.252 9.373 -5.667 197 HA LYS 25 HA LYS 25 -16.509 10.894 -7.232 198 HB2 LYS 25 1HB LYS 25 -15.962 9.302 -5.316 199 HB3 LYS 25 2HB LYS 25 -16.068 8.004 -6.495 200 HG2 LYS 25 1HG LYS 25 -13.761 8.820 -6.025 201 HG3 LYS 25 2HG LYS 25 -14.228 8.858 -7.726 202 HD2 LYS 25 1HD LYS 25 -14.492 11.182 -7.722 203 HD3 LYS 25 2HD LYS 25 -14.564 11.258 -5.962 204 HE2 LYS 25 1HE LYS 25 -12.443 12.096 -6.971 205 HE3 LYS 25 2HE LYS 25 -12.245 10.826 -5.765 206 HZ1 LYS 25 3HZ LYS 25 -11.825 9.230 -7.439 207 HZ2 LYS 25 1HZ LYS 25 -10.859 10.575 -7.810 208 HZ3 LYS 25 2HZ LYS 25 -12.284 10.289 -8.680 209 H GLU 26 H GLU 26 -17.972 7.716 -7.882 210 HA GLU 26 HA GLU 26 -16.984 7.242 -10.431 211 HB2 GLU 26 1HB GLU 26 -18.259 5.564 -9.243 212 HB3 GLU 26 2HB GLU 26 -19.683 6.592 -9.237 213 HG2 GLU 26 1HG GLU 26 -20.141 5.047 -10.895 214 HG3 GLU 26 2HG GLU 26 -19.559 6.444 -11.796 215 H LYS 27 H LYS 27 -19.914 8.966 -9.462 216 HA LYS 27 HA LYS 27 -20.973 9.497 -11.967 217 HB2 LYS 27 1HB LYS 27 -21.159 11.000 -9.362 218 HB3 LYS 27 2HB LYS 27 -22.074 11.470 -10.787 219 HG2 LYS 27 1HG LYS 27 -23.219 9.350 -10.807 220 HG3 LYS 27 2HG LYS 27 -22.210 8.753 -9.490 221 HD2 LYS 27 1HD LYS 27 -24.359 9.395 -8.616 222 HD3 LYS 27 2HD LYS 27 -23.140 10.528 -8.033 223 HE2 LYS 27 1HE LYS 27 -23.803 12.135 -9.742 224 HE3 LYS 27 2HE LYS 27 -24.999 10.994 -10.360 225 HZ1 LYS 27 3HZ LYS 27 -26.174 11.111 -8.275 226 HZ2 LYS 27 1HZ LYS 27 -25.981 12.675 -8.896 227 HZ3 LYS 27 2HZ LYS 27 -24.999 12.141 -7.621 228 H VAL 28 H VAL 28 -18.745 11.482 -10.040 229 HA VAL 28 HA VAL 28 -18.703 13.671 -11.810 230 HB VAL 28 HB VAL 28 -16.607 12.820 -9.805 231 HG11 VAL 28 1HG1 VAL 28 -17.039 15.478 -11.162 232 HG12 VAL 28 2HG1 VAL 28 -15.701 14.366 -11.454 233 HG13 VAL 28 3HG1 VAL 28 -15.868 15.153 -9.884 234 HG21 VAL 28 3HG2 VAL 28 -17.649 14.437 -8.311 235 HG22 VAL 28 1HG2 VAL 28 -18.813 13.203 -8.806 236 HG23 VAL 28 2HG2 VAL 28 -18.861 14.804 -9.542 237 H MET 29 H MET 29 -16.655 10.801 -11.528 238 HA MET 29 HA MET 29 -14.834 11.901 -13.529 239 HB2 MET 29 1HB MET 29 -13.368 10.008 -13.020 240 HB3 MET 29 2HB MET 29 -13.780 10.923 -11.579 241 HG2 MET 29 1HG MET 29 -15.516 9.182 -11.093 242 HG3 MET 29 2HG MET 29 -14.824 8.234 -12.414 243 HE1 MET 29 3HE MET 29 -14.374 6.196 -10.755 244 HE2 MET 29 1HE MET 29 -15.091 7.135 -9.445 245 HE3 MET 29 2HE MET 29 -13.519 6.365 -9.220 246 H LYS 30 H LYS 30 -17.635 10.455 -13.645 247 HA LYS 30 HA LYS 30 -17.041 8.790 -15.981 248 HB2 LYS 30 1HB LYS 30 -18.430 7.514 -14.673 249 HB3 LYS 30 2HB LYS 30 -19.220 8.901 -13.959 250 HG2 LYS 30 1HG LYS 30 -19.735 8.108 -16.803 251 HG3 LYS 30 2HG LYS 30 -20.595 7.357 -15.457 252 HD2 LYS 30 1HD LYS 30 -20.423 10.324 -15.632 253 HD3 LYS 30 2HD LYS 30 -21.593 9.468 -16.649 254 HE2 LYS 30 1HE LYS 30 -22.524 8.441 -14.588 255 HE3 LYS 30 2HE LYS 30 -21.399 9.415 -13.639 256 HZ1 LYS 30 3HZ LYS 30 -22.416 11.413 -14.711 257 HZ2 LYS 30 1HZ LYS 30 -23.468 10.554 -13.690 258 HZ3 LYS 30 2HZ LYS 30 -23.601 10.393 -15.370 259 H ASP 31 H ASP 31 -18.619 11.702 -14.917 260 HA ASP 31 HA ASP 31 -20.381 12.106 -17.036 261 HB2 ASP 31 1HB ASP 31 -19.558 13.480 -14.696 262 HB3 ASP 31 2HB ASP 31 -19.478 14.615 -16.033 263 H GLN 32 H GLN 32 -20.214 12.979 -18.987 264 HA GLN 32 HA GLN 32 -17.733 12.805 -20.297 265 HB2 GLN 32 1HB GLN 32 -20.303 14.071 -21.256 266 HB3 GLN 32 2HB GLN 32 -18.949 13.606 -22.275 267 HG2 GLN 32 1HG GLN 32 -20.594 11.712 -20.611 268 HG3 GLN 32 2HG GLN 32 -20.797 11.991 -22.339 269 HE21 GLN 32 2HE2 GLN 32 -18.826 10.525 -19.880 270 HE22 GLN 32 1HE2 GLN 32 -17.841 9.589 -20.948 271 H ASP 33 H ASP 33 -19.652 15.613 -19.296 272 HA ASP 33 HA ASP 33 -18.104 17.616 -20.496 273 HB2 ASP 33 1HB ASP 33 -19.499 17.878 -17.826 274 HB3 ASP 33 2HB ASP 33 -19.179 19.149 -19.000 275 H VAL 34 H VAL 34 -17.803 15.950 -17.438 276 HA VAL 34 HA VAL 34 -15.766 17.539 -16.316 277 HB VAL 34 HB VAL 34 -16.497 14.655 -15.772 278 HG11 VAL 34 1HG1 VAL 34 -14.862 16.568 -14.117 279 HG12 VAL 34 2HG1 VAL 34 -14.270 15.123 -14.936 280 HG13 VAL 34 3HG1 VAL 34 -15.413 14.974 -13.596 281 HG21 VAL 34 3HG2 VAL 34 -17.343 17.200 -14.389 282 HG22 VAL 34 1HG2 VAL 34 -17.761 15.563 -13.882 283 HG23 VAL 34 2HG2 VAL 34 -18.355 16.187 -15.419 284 H GLN 35 H GLN 35 -15.719 14.672 -18.382 285 HA GLN 35 HA GLN 35 -12.988 14.043 -18.264 286 HB2 GLN 35 1HB GLN 35 -14.715 13.852 -20.741 287 HB3 GLN 35 2HB GLN 35 -13.296 12.890 -20.362 288 HG2 GLN 35 1HG GLN 35 -15.893 12.818 -18.857 289 HG3 GLN 35 2HG GLN 35 -15.396 11.665 -20.095 290 HE21 GLN 35 2HE2 GLN 35 -16.032 11.340 -17.267 291 HE22 GLN 35 1HE2 GLN 35 -14.659 10.557 -16.559 292 H ALA 36 H ALA 36 -14.740 16.070 -20.594 293 HA ALA 36 HA ALA 36 -12.519 16.780 -22.153 294 HB1 ALA 36 1HB ALA 36 -14.859 16.996 -22.897 295 HB2 ALA 36 2HB ALA 36 -13.940 18.483 -23.123 296 HB3 ALA 36 3HB ALA 36 -15.072 18.343 -21.778 297 H PHE 37 H PHE 37 -13.915 18.227 -19.285 298 HA PHE 37 HA PHE 37 -12.356 20.610 -19.357 299 HB2 PHE 37 1HB PHE 37 -14.466 20.419 -18.094 300 HB3 PHE 37 2HB PHE 37 -13.698 19.264 -17.006 301 HD1 PHE 37 HD1 PHE 37 -13.433 22.735 -18.263 302 HD2 PHE 37 HD2 PHE 37 -12.543 20.001 -15.128 303 HE1 PHE 37 HE1 PHE 37 -12.659 24.597 -16.872 304 HE2 PHE 37 HE2 PHE 37 -11.781 21.868 -13.717 305 HZ PHE 37 HZ PHE 37 -11.843 24.167 -14.588 306 H LEU 38 H LEU 38 -12.037 17.489 -17.759 307 HA LEU 38 HA LEU 38 -9.822 18.036 -16.157 308 HB2 LEU 38 1HB LEU 38 -11.274 15.698 -17.065 309 HB3 LEU 38 2HB LEU 38 -9.557 15.376 -16.917 310 HG LEU 38 HG LEU 38 -10.673 14.786 -14.866 311 HD11 LEU 38 1HD1 LEU 38 -8.413 15.758 -14.759 312 HD12 LEU 38 2HD1 LEU 38 -9.358 16.105 -13.310 313 HD13 LEU 38 3HD1 LEU 38 -9.129 17.356 -14.534 314 HD21 LEU 38 3HD2 LEU 38 -11.827 16.458 -13.504 315 HD22 LEU 38 1HD2 LEU 38 -12.619 16.245 -15.067 316 HD23 LEU 38 2HD2 LEU 38 -11.600 17.655 -14.781 317 H LYS 39 H LYS 39 -9.989 16.847 -19.489 318 HA LYS 39 HA LYS 39 -7.125 16.646 -19.659 319 HB2 LYS 39 1HB LYS 39 -7.507 16.102 -22.029 320 HB3 LYS 39 2HB LYS 39 -8.468 15.106 -20.949 321 HG2 LYS 39 1HG LYS 39 -10.423 16.522 -21.418 322 HG3 LYS 39 2HG LYS 39 -9.446 17.460 -22.552 323 HD2 LYS 39 1HD LYS 39 -9.992 14.498 -22.750 324 HD3 LYS 39 2HD LYS 39 -10.813 15.748 -23.684 325 HE2 LYS 39 1HE LYS 39 -8.775 16.355 -24.786 326 HE3 LYS 39 2HE LYS 39 -7.834 15.305 -23.729 327 HZ1 LYS 39 3HZ LYS 39 -8.298 14.388 -25.986 328 HZ2 LYS 39 1HZ LYS 39 -9.939 14.304 -25.565 329 HZ3 LYS 39 2HZ LYS 39 -8.791 13.391 -24.708 330 H GLU 40 H GLU 40 -9.523 19.060 -20.309 331 HA GLU 40 HA GLU 40 -8.029 20.720 -22.033 332 HB2 GLU 40 1HB GLU 40 -10.489 20.944 -21.547 333 HB3 GLU 40 2HB GLU 40 -10.059 21.610 -19.984 334 HG2 GLU 40 1HG GLU 40 -8.961 23.476 -21.011 335 HG3 GLU 40 2HG GLU 40 -9.207 22.787 -22.614 336 H ASN 41 H ASN 41 -8.520 20.819 -18.539 337 HA ASN 41 HA ASN 41 -6.355 22.801 -18.319 338 HB2 ASN 41 1HB ASN 41 -8.662 22.088 -16.503 339 HB3 ASN 41 2HB ASN 41 -7.320 23.103 -15.974 340 HD21 ASN 41 2HD2 ASN 41 -10.124 22.878 -17.996 341 HD22 ASN 41 1HD2 ASN 41 -10.227 24.562 -18.383 342 H GLU 42 H GLU 42 -5.821 19.962 -18.658 343 HA GLU 42 HA GLU 42 -5.390 18.613 -16.240 344 HB2 GLU 42 1HB GLU 42 -3.883 17.144 -17.540 345 HB3 GLU 42 2HB GLU 42 -5.435 17.404 -18.324 346 HG2 GLU 42 1HG GLU 42 -4.521 18.760 -19.970 347 HG3 GLU 42 2HG GLU 42 -3.058 19.073 -19.035 348 H GLU 43 H GLU 43 -3.406 20.936 -17.962 349 HA GLU 43 HA GLU 43 -0.979 20.323 -16.613 350 HB2 GLU 43 1HB GLU 43 -1.169 21.537 -18.801 351 HB3 GLU 43 2HB GLU 43 -1.771 22.931 -17.915 352 HG2 GLU 43 1HG GLU 43 0.559 23.225 -18.397 353 HG3 GLU 43 2HG GLU 43 0.341 23.019 -16.660 354 H VAL 44 H VAL 44 -3.744 22.252 -15.870 355 HA VAL 44 HA VAL 44 -2.326 23.645 -13.716 356 HB VAL 44 HB VAL 44 -5.174 24.079 -14.609 357 HG11 VAL 44 1HG1 VAL 44 -3.256 25.826 -13.066 358 HG12 VAL 44 2HG1 VAL 44 -4.617 24.932 -12.389 359 HG13 VAL 44 3HG1 VAL 44 -4.907 26.253 -13.521 360 HG21 VAL 44 3HG2 VAL 44 -4.347 25.958 -15.943 361 HG22 VAL 44 1HG2 VAL 44 -3.674 24.427 -16.506 362 HG23 VAL 44 2HG2 VAL 44 -2.688 25.519 -15.535 363 H ILE 45 H ILE 45 -5.137 21.586 -14.293 364 HA ILE 45 HA ILE 45 -5.880 21.398 -11.550 365 HB ILE 45 HB ILE 45 -6.634 19.597 -13.852 366 HG12 ILE 45 1HG1 ILE 45 -8.060 21.977 -12.653 367 HG13 ILE 45 2HG1 ILE 45 -7.194 21.981 -14.184 368 HG21 ILE 45 1HG2 ILE 45 -8.552 18.968 -12.471 369 HG22 ILE 45 2HG2 ILE 45 -7.941 19.978 -11.160 370 HG23 ILE 45 3HG2 ILE 45 -7.033 18.556 -11.673 371 HD11 ILE 45 3HD1 ILE 45 -9.578 21.826 -14.526 372 HD12 ILE 45 1HD1 ILE 45 -9.642 20.360 -13.542 373 HD13 ILE 45 2HD1 ILE 45 -8.775 20.351 -15.078 374 H ASP 46 H ASP 46 -5.547 19.826 -10.089 375 HA ASP 46 HA ASP 46 -3.526 17.781 -10.730 376 HB2 ASP 46 1HB ASP 46 -2.635 19.548 -9.237 377 HB3 ASP 46 2HB ASP 46 -3.941 19.229 -8.104 378 H GLN 47 H GLN 47 -3.661 15.873 -9.323 379 HA GLN 47 HA GLN 47 -6.145 14.640 -9.204 380 HB2 GLN 47 1HB GLN 47 -3.604 14.190 -7.652 381 HB3 GLN 47 2HB GLN 47 -4.985 13.101 -7.549 382 HG2 GLN 47 1HG GLN 47 -4.739 12.384 -9.748 383 HG3 GLN 47 2HG GLN 47 -3.751 13.778 -10.190 384 HE21 GLN 47 2HE2 GLN 47 -1.582 13.789 -9.713 385 HE22 GLN 47 1HE2 GLN 47 -0.728 12.372 -9.195 386 H LYS 48 H LYS 48 -4.347 16.357 -6.687 387 HA LYS 48 HA LYS 48 -6.223 15.934 -4.605 388 HB2 LYS 48 1HB LYS 48 -4.092 18.024 -5.023 389 HB3 LYS 48 2HB LYS 48 -5.009 17.852 -3.537 390 HG2 LYS 48 1HG LYS 48 -4.126 15.613 -3.221 391 HG3 LYS 48 2HG LYS 48 -3.265 15.725 -4.757 392 HD2 LYS 48 1HD LYS 48 -1.757 16.145 -2.892 393 HD3 LYS 48 2HD LYS 48 -1.950 17.592 -3.884 394 HE2 LYS 48 1HE LYS 48 -3.580 18.462 -2.268 395 HE3 LYS 48 2HE LYS 48 -3.354 17.022 -1.276 396 HZ1 LYS 48 3HZ LYS 48 -1.044 17.621 -0.980 397 HZ2 LYS 48 1HZ LYS 48 -2.050 18.886 -0.459 398 HZ3 LYS 48 2HZ LYS 48 -1.241 18.997 -1.952 399 H MET 49 H MET 49 -5.797 18.422 -7.025 400 HA MET 49 HA MET 49 -7.641 20.313 -6.118 401 HB2 MET 49 1HB MET 49 -5.960 20.479 -8.040 402 HB3 MET 49 2HB MET 49 -7.157 19.659 -9.020 403 HG2 MET 49 1HG MET 49 -8.711 21.461 -8.709 404 HG3 MET 49 2HG MET 49 -7.603 22.258 -7.590 405 HE1 MET 49 3HE MET 49 -7.431 24.604 -10.723 406 HE2 MET 49 1HE MET 49 -7.785 24.495 -8.998 407 HE3 MET 49 2HE MET 49 -8.861 23.731 -10.170 408 H ILE 50 H ILE 50 -8.049 17.383 -8.018 409 HA ILE 50 HA ILE 50 -10.758 17.687 -8.708 410 HB ILE 50 HB ILE 50 -9.150 15.167 -8.255 411 HG12 ILE 50 1HG1 ILE 50 -8.279 16.586 -10.043 412 HG13 ILE 50 2HG1 ILE 50 -9.013 15.137 -10.721 413 HG21 ILE 50 1HG2 ILE 50 -11.845 15.513 -9.568 414 HG22 ILE 50 2HG2 ILE 50 -11.515 14.664 -8.058 415 HG23 ILE 50 3HG2 ILE 50 -10.890 14.033 -9.579 416 HD11 ILE 50 3HD1 ILE 50 -9.586 17.093 -12.032 417 HD12 ILE 50 1HD1 ILE 50 -10.272 17.870 -10.606 418 HD13 ILE 50 2HD1 ILE 50 -11.026 16.418 -11.268 419 H GLU 51 H GLU 51 -9.238 15.958 -6.003 420 HA GLU 51 HA GLU 51 -11.652 15.228 -4.728 421 HB2 GLU 51 1HB GLU 51 -8.882 15.624 -3.577 422 HB3 GLU 51 2HB GLU 51 -10.218 14.840 -2.744 423 HG2 GLU 51 1HG GLU 51 -10.253 13.051 -4.307 424 HG3 GLU 51 2HG GLU 51 -9.112 13.881 -5.365 425 H LYS 52 H LYS 52 -9.537 18.004 -4.443 426 HA LYS 52 HA LYS 52 -10.651 19.238 -2.194 427 HB2 LYS 52 1HB LYS 52 -8.486 19.819 -3.289 428 HB3 LYS 52 2HB LYS 52 -9.382 20.547 -4.610 429 HG2 LYS 52 1HG LYS 52 -8.692 22.320 -3.241 430 HG3 LYS 52 2HG LYS 52 -10.407 22.091 -2.891 431 HD2 LYS 52 1HD LYS 52 -9.941 21.021 -0.833 432 HD3 LYS 52 2HD LYS 52 -8.237 20.817 -1.242 433 HE2 LYS 52 1HE LYS 52 -9.653 23.421 -0.681 434 HE3 LYS 52 2HE LYS 52 -8.494 22.608 0.370 435 HZ1 LYS 52 3HZ LYS 52 -7.255 24.239 -0.720 436 HZ2 LYS 52 1HZ LYS 52 -7.999 23.952 -2.213 437 HZ3 LYS 52 2HZ LYS 52 -6.901 22.827 -1.587 438 H SER 53 H SER 53 -11.468 19.481 -5.619 439 HA SER 53 HA SER 53 -13.683 21.293 -4.939 440 HB2 SER 53 1HB SER 53 -12.480 20.790 -7.669 441 HB3 SER 53 2HB SER 53 -13.582 22.086 -7.206 442 HG SER 53 HG SER 53 -10.972 21.725 -6.148 443 H LEU 54 H LEU 54 -13.595 18.276 -4.778 444 HA LEU 54 HA LEU 54 -15.105 17.187 -6.896 445 HB2 LEU 54 1HB LEU 54 -13.759 15.909 -5.175 446 HB3 LEU 54 2HB LEU 54 -15.061 16.209 -4.042 447 HG LEU 54 HG LEU 54 -16.608 14.962 -5.526 448 HD11 LEU 54 1HD1 LEU 54 -14.122 14.344 -7.100 449 HD12 LEU 54 2HD1 LEU 54 -15.475 15.336 -7.641 450 HD13 LEU 54 3HD1 LEU 54 -15.709 13.614 -7.341 451 HD21 LEU 54 3HD2 LEU 54 -15.787 12.755 -5.002 452 HD22 LEU 54 1HD2 LEU 54 -15.452 13.850 -3.660 453 HD23 LEU 54 2HD2 LEU 54 -14.156 13.388 -4.765 454 H ASN 55 H ASN 55 -15.925 18.983 -4.063 455 HA ASN 55 HA ASN 55 -18.701 18.403 -4.005 456 HB2 ASN 55 1HB ASN 55 -18.895 20.397 -2.575 457 HB3 ASN 55 2HB ASN 55 -17.560 19.372 -2.067 458 HD21 ASN 55 2HD2 ASN 55 -18.017 22.179 -1.534 459 HD22 ASN 55 1HD2 ASN 55 -16.640 23.027 -2.172 460 H LYS 56 H LYS 56 -16.767 20.913 -5.564 461 HA LYS 56 HA LYS 56 -18.915 22.313 -6.782 462 HB2 LYS 56 1HB LYS 56 -15.975 22.095 -7.452 463 HB3 LYS 56 2HB LYS 56 -17.082 23.119 -8.356 464 HG2 LYS 56 1HG LYS 56 -16.794 23.393 -5.389 465 HG3 LYS 56 2HG LYS 56 -15.665 24.175 -6.499 466 HD2 LYS 56 1HD LYS 56 -17.600 25.261 -7.621 467 HD3 LYS 56 2HD LYS 56 -18.657 24.568 -6.392 468 HE2 LYS 56 1HE LYS 56 -17.605 25.827 -4.666 469 HE3 LYS 56 2HE LYS 56 -16.314 26.339 -5.750 470 HZ1 LYS 56 3HZ LYS 56 -19.156 27.064 -6.195 471 HZ2 LYS 56 1HZ LYS 56 -17.782 27.738 -6.928 472 HZ3 LYS 56 2HZ LYS 56 -18.099 28.025 -5.289 473 H LEU 57 H LEU 57 -16.656 19.862 -7.978 474 HA LEU 57 HA LEU 57 -17.629 19.630 -10.580 475 HB2 LEU 57 1HB LEU 57 -16.400 17.476 -8.856 476 HB3 LEU 57 2HB LEU 57 -16.535 17.435 -10.602 477 HG LEU 57 HG LEU 57 -14.890 19.428 -9.042 478 HD11 LEU 57 1HD1 LEU 57 -13.947 17.211 -8.867 479 HD12 LEU 57 2HD1 LEU 57 -12.969 18.189 -9.963 480 HD13 LEU 57 3HD1 LEU 57 -14.084 16.984 -10.610 481 HD21 LEU 57 3HD2 LEU 57 -15.051 18.897 -12.006 482 HD22 LEU 57 1HD2 LEU 57 -13.980 20.053 -11.212 483 HD23 LEU 57 2HD2 LEU 57 -15.726 20.300 -11.177 484 H TYR 58 H TYR 58 -18.634 18.019 -7.604 485 HA TYR 58 HA TYR 58 -20.367 16.177 -8.902 486 HB2 TYR 58 1HB TYR 58 -19.354 15.800 -6.659 487 HB3 TYR 58 2HB TYR 58 -20.414 17.050 -6.010 488 HD1 TYR 58 HD1 TYR 58 -20.812 14.101 -8.252 489 HD2 TYR 58 HD2 TYR 58 -22.203 16.205 -4.831 490 HE1 TYR 58 HE1 TYR 58 -22.587 12.437 -7.966 491 HE2 TYR 58 HE2 TYR 58 -23.983 14.542 -4.524 492 HH TYR 58 HH TYR 58 -25.201 12.921 -5.745 493 H GLU 59 H GLU 59 -20.926 19.226 -7.155 494 HA GLU 59 HA GLU 59 -23.729 19.229 -7.423 495 HB2 GLU 59 1HB GLU 59 -22.450 20.704 -5.885 496 HB3 GLU 59 2HB GLU 59 -21.881 21.617 -7.275 497 HG2 GLU 59 1HG GLU 59 -24.145 22.299 -7.794 498 HG3 GLU 59 2HG GLU 59 -24.764 21.318 -6.465 499 H TYR 60 H TYR 60 -21.143 20.302 -9.502 500 HA TYR 60 HA TYR 60 -22.546 21.669 -11.468 501 HB2 TYR 60 1HB TYR 60 -20.160 21.696 -11.457 502 HB3 TYR 60 2HB TYR 60 -20.073 19.945 -11.574 503 HD1 TYR 60 HD2 TYR 60 -21.012 23.000 -13.447 504 HD2 TYR 60 HD1 TYR 60 -19.971 18.885 -13.672 505 HE1 TYR 60 HE2 TYR 60 -20.801 23.190 -15.882 506 HE2 TYR 60 HE1 TYR 60 -19.746 19.066 -16.117 507 HH TYR 60 HH TYR 60 -20.697 20.625 -17.957 508 H ILE 61 H ILE 61 -21.741 18.197 -11.342 509 HA ILE 61 HA ILE 61 -23.066 17.664 -13.805 510 HB ILE 61 HB ILE 61 -22.586 15.326 -13.402 511 HG12 ILE 61 1HG1 ILE 61 -21.570 16.179 -10.683 512 HG13 ILE 61 2HG1 ILE 61 -23.097 15.347 -10.957 513 HG21 ILE 61 1HG2 ILE 61 -20.163 15.474 -13.276 514 HG22 ILE 61 2HG2 ILE 61 -20.285 17.090 -12.581 515 HG23 ILE 61 3HG2 ILE 61 -20.812 16.802 -14.240 516 HD11 ILE 61 3HD1 ILE 61 -20.369 14.271 -11.597 517 HD12 ILE 61 1HD1 ILE 61 -21.897 13.430 -11.852 518 HD13 ILE 61 2HD1 ILE 61 -21.365 13.820 -10.215 519 H GLU 62 H GLU 62 -24.090 17.521 -10.446 520 HA GLU 62 HA GLU 62 -26.366 15.859 -11.027 521 HB2 GLU 62 1HB GLU 62 -27.022 16.216 -8.711 522 HB3 GLU 62 2HB GLU 62 -25.325 15.780 -8.817 523 HG2 GLU 62 1HG GLU 62 -24.629 17.976 -8.336 524 HG3 GLU 62 2HG GLU 62 -26.253 18.622 -8.579 525 H GLN 63 H GLN 63 -25.711 19.236 -11.140 526 HA GLN 63 HA GLN 63 -28.425 20.105 -10.961 527 HB2 GLN 63 1HB GLN 63 -25.890 21.393 -11.931 528 HB3 GLN 63 2HB GLN 63 -27.446 22.183 -12.151 529 HG2 GLN 63 1HG GLN 63 -27.817 22.166 -9.752 530 HG3 GLN 63 2HG GLN 63 -26.286 21.323 -9.511 531 HE21 GLN 63 2HE2 GLN 63 -24.367 22.434 -9.755 532 HE22 GLN 63 1HE2 GLN 63 -24.299 24.163 -9.795 533 H SER 64 H SER 64 -29.068 21.587 -13.022 534 HA SER 64 HA SER 64 -29.869 19.657 -14.953 535 HB2 SER 64 1HB SER 64 -31.249 21.629 -14.201 536 HB3 SER 64 2HB SER 64 -30.159 22.666 -15.119 537 HG SER 64 HG SER 64 -31.202 22.151 -16.852 538 H LYS 65 H LYS 65 -28.628 18.932 -16.508 539 HA LYS 65 HA LYS 65 -26.175 20.080 -17.306 540 HB2 LYS 65 1HB LYS 65 -26.772 17.658 -17.468 541 HB3 LYS 65 2HB LYS 65 -27.881 18.056 -18.771 542 HG2 LYS 65 1HG LYS 65 -25.926 17.231 -19.788 543 HG3 LYS 65 2HG LYS 65 -25.900 18.980 -20.026 544 HD2 LYS 65 1HD LYS 65 -23.698 18.201 -19.375 545 HD3 LYS 65 2HD LYS 65 -24.388 19.192 -18.090 546 HE2 LYS 65 1HE LYS 65 -24.976 17.235 -16.820 547 HE3 LYS 65 2HE LYS 65 -24.480 16.179 -18.142 548 HZ1 LYS 65 3HZ LYS 65 -22.760 16.219 -16.505 549 HZ2 LYS 65 1HZ LYS 65 -22.723 17.916 -16.506 550 HZ3 LYS 65 2HZ LYS 65 -22.210 17.057 -17.875 551 H ASN 66 H ASN 66 -29.378 19.952 -18.785 552 HA ASN 66 HA ASN 66 -28.527 21.891 -20.810 553 HB2 ASN 66 1HB ASN 66 -30.500 19.754 -20.703 554 HB3 ASN 66 2HB ASN 66 -31.205 21.267 -21.266 555 HD21 ASN 66 2HD2 ASN 66 -30.536 18.683 -22.612 556 HD22 ASN 66 1HD2 ASN 66 -29.577 19.144 -23.989 557 H CYS 67 H CYS 67 -31.069 23.049 -21.256 558 HA CYS 67 HA CYS 67 -31.885 24.256 -18.757 559 HB2 CYS 67 1HB CYS 67 -31.334 26.479 -19.222 560 HB3 CYS 67 2HB CYS 67 -29.894 25.613 -19.735 561 H SER 68 H SER 68 -33.810 25.642 -19.114 562 HA SER 68 HA SER 68 -35.666 24.065 -20.564 563 HB2 SER 68 1HB SER 68 -36.219 26.866 -19.590 564 HB3 SER 68 2HB SER 68 -37.333 25.501 -19.696 565 HG SER 68 HG SER 68 -35.300 26.025 -17.825 566 H TYR 69 H TYR 69 -33.862 26.887 -21.378 567 HA TYR 69 HA TYR 69 -35.313 27.868 -23.560 568 HB2 TYR 69 1HB TYR 69 -33.167 28.713 -22.305 569 HB3 TYR 69 2HB TYR 69 -32.320 27.826 -23.558 570 HD1 TYR 69 HD1 TYR 69 -32.584 28.506 -25.943 571 HD2 TYR 69 HD2 TYR 69 -34.182 30.803 -22.741 572 HE1 TYR 69 HE1 TYR 69 -32.774 30.448 -27.436 573 HE2 TYR 69 HE2 TYR 69 -34.381 32.748 -24.227 574 HH TYR 69 HH TYR 69 -34.277 32.591 -27.498 575 H CYS 70 H CYS 70 -33.560 24.940 -23.217 576 HA CYS 70 HA CYS 70 -33.655 24.545 -26.131 577 HB2 CYS 70 1HB CYS 70 -31.547 23.288 -26.028 578 HB3 CYS 70 2HB CYS 70 -31.342 24.965 -25.542 579 H SER 71 H SER 71 -34.158 23.199 -22.966 580 HA SER 71 HA SER 71 -34.644 20.566 -24.162 581 HB2 SER 71 1HB SER 71 -34.497 19.730 -21.805 582 HB3 SER 71 2HB SER 71 -33.011 20.470 -22.400 583 HG SER 71 HG SER 71 -34.237 21.062 -20.205 584 H GLU 72 H GLU 72 -36.261 19.414 -22.319 585 HA GLU 72 HA GLU 72 -38.761 20.896 -22.766 586 HB2 GLU 72 1HB GLU 72 -38.302 18.622 -23.873 587 HB3 GLU 72 2HB GLU 72 -38.491 17.935 -22.267 588 HG2 GLU 72 1HG GLU 72 -40.535 17.749 -23.557 589 HG3 GLU 72 2HG GLU 72 -40.764 18.794 -22.155 590 H ASP 73 H ASP 73 -36.748 20.856 -20.405 591 HA ASP 73 HA ASP 73 -38.145 19.732 -18.200 592 HB2 ASP 73 1HB ASP 73 -36.076 21.939 -18.231 593 HB3 ASP 73 2HB ASP 73 -36.653 21.121 -16.792 594 H GLU 74 H GLU 74 -39.931 20.423 -17.322 595 HA GLU 74 HA GLU 74 -41.057 22.991 -17.991 596 HB2 GLU 74 1HB GLU 74 -42.377 20.883 -17.742 597 HB3 GLU 74 2HB GLU 74 -42.006 20.909 -16.026 598 HG2 GLU 74 1HG GLU 74 -43.219 22.985 -15.770 599 HG3 GLU 74 2HG GLU 74 -43.556 23.019 -17.503 600 H ASN 75 H ASN 75 -39.657 21.425 -15.190 601 HA ASN 75 HA ASN 75 -39.857 23.945 -13.715 602 HB2 ASN 75 1HB ASN 75 -39.308 21.133 -12.743 603 HB3 ASN 75 2HB ASN 75 -39.186 22.562 -11.720 604 HD21 ASN 75 2HD2 ASN 75 -40.947 20.263 -11.468 605 HD22 ASN 75 1HD2 ASN 75 -42.562 20.889 -11.496 606 H CYS 76 H CYS 76 -38.246 24.947 -14.870 607 HA CYS 76 HA CYS 76 -35.720 24.097 -15.479 608 HB2 CYS 76 1HB CYS 76 -35.016 26.488 -15.294 609 HB3 CYS 76 2HB CYS 76 -36.482 26.242 -16.232 610 HG CYS 76 HG CYS 76 -38.141 26.972 -13.990 611 H ASN 77 H ASN 77 -34.283 23.113 -14.276 612 HA ASN 77 HA ASN 77 -33.977 23.733 -11.459 613 HB2 ASN 77 1HB ASN 77 -32.772 21.676 -13.295 614 HB3 ASN 77 2HB ASN 77 -32.076 21.980 -11.706 615 HD21 ASN 77 2HD2 ASN 77 -33.482 19.629 -12.867 616 HD22 ASN 77 1HD2 ASN 77 -34.759 19.284 -11.753 617 H ASN 78 H ASN 78 -32.880 24.936 -14.334 618 HA ASN 78 HA ASN 78 -30.249 25.746 -13.472 619 HB2 ASN 78 1HB ASN 78 -31.900 26.747 -15.808 620 HB3 ASN 78 2HB ASN 78 -30.177 27.005 -15.564 621 HD21 ASN 78 2HD2 ASN 78 -28.743 25.329 -15.964 622 HD22 ASN 78 1HD2 ASN 78 -29.205 23.901 -16.825 623 H LEU 79 H LEU 79 -30.017 27.303 -11.988 624 HA LEU 79 HA LEU 79 -32.007 29.147 -11.260 625 HB2 LEU 79 1HB LEU 79 -30.055 28.563 -9.853 626 HB3 LEU 79 2HB LEU 79 -29.009 29.418 -10.972 627 HG LEU 79 HG LEU 79 -30.162 31.526 -10.433 628 HD11 LEU 79 1HD1 LEU 79 -32.347 30.606 -9.863 629 HD12 LEU 79 2HD1 LEU 79 -31.723 31.614 -8.559 630 HD13 LEU 79 3HD1 LEU 79 -31.664 29.857 -8.419 631 HD21 LEU 79 3HD2 LEU 79 -28.161 30.905 -9.201 632 HD22 LEU 79 1HD2 LEU 79 -29.138 30.011 -8.036 633 HD23 LEU 79 2HD2 LEU 79 -29.291 31.763 -8.158 634 H LEU 80 H LEU 80 -29.039 29.666 -13.157 635 HA LEU 80 HA LEU 80 -30.189 32.033 -14.378 636 HB2 LEU 80 1HB LEU 80 -27.531 30.654 -14.777 637 HB3 LEU 80 2HB LEU 80 -28.033 32.067 -15.683 638 HG LEU 80 HG LEU 80 -28.255 33.245 -13.421 639 HD11 LEU 80 1HD1 LEU 80 -26.572 30.899 -12.554 640 HD12 LEU 80 2HD1 LEU 80 -28.209 31.254 -12.007 641 HD13 LEU 80 3HD1 LEU 80 -26.889 32.353 -11.607 642 HD21 LEU 80 3HD2 LEU 80 -26.490 33.736 -14.996 643 HD22 LEU 80 1HD2 LEU 80 -25.556 32.355 -14.418 644 HD23 LEU 80 2HD2 LEU 80 -25.850 33.729 -13.352 645 H GLU 81 H GLU 81 -31.951 31.156 -15.480 646 HA GLU 81 HA GLU 81 -31.687 28.980 -17.304 647 HB2 GLU 81 1HB GLU 81 -33.823 29.468 -16.228 648 HB3 GLU 81 2HB GLU 81 -33.874 31.048 -16.993 649 HG2 GLU 81 1HG GLU 81 -35.343 29.335 -18.031 650 HG3 GLU 81 2HG GLU 81 -34.205 30.099 -19.136 651 H GLY 82 H GLY 82 -31.871 29.076 -19.600 652 HA2 GLY 82 1HA GLY 82 -31.359 30.008 -21.680 653 HA3 GLY 82 2HA GLY 82 -31.106 31.564 -20.896 654 H TYR 83 H TYR 83 -29.480 29.696 -18.946 655 HA TYR 83 HA TYR 83 -26.989 29.717 -20.519 656 HB2 TYR 83 1HB TYR 83 -27.332 30.324 -17.567 657 HB3 TYR 83 2HB TYR 83 -25.801 30.279 -18.431 658 HD1 TYR 83 HD2 TYR 83 -28.978 32.142 -18.058 659 HD2 TYR 83 HD1 TYR 83 -25.036 32.160 -19.664 660 HE1 TYR 83 HE2 TYR 83 -29.187 34.546 -18.538 661 HE2 TYR 83 HE1 TYR 83 -25.236 34.559 -20.141 662 HH TYR 83 HH TYR 83 -27.815 36.472 -18.911 663 H HIS 84 H HIS 84 -25.335 28.204 -19.595 664 HA HIS 84 HA HIS 84 -26.518 25.972 -18.070 665 HB2 HIS 84 1HB HIS 84 -24.516 25.788 -20.334 666 HB3 HIS 84 2HB HIS 84 -24.872 24.463 -19.241 667 HD1 HIS 84 HD1 HIS 84 -25.685 22.983 -21.206 668 HD2 HIS 84 HD2 HIS 84 -27.871 26.478 -20.671 669 HE1 HIS 84 HE1 HIS 84 -27.650 22.861 -22.807 670 HA PRO 85 HA PRO 85 -22.991 26.637 -15.440 671 HB2 PRO 85 1HB PRO 85 -22.834 24.217 -14.237 672 HB3 PRO 85 2HB PRO 85 -24.094 25.392 -13.845 673 HG2 PRO 85 1HG PRO 85 -24.237 22.959 -15.568 674 HG3 PRO 85 2HG PRO 85 -25.440 23.614 -14.443 675 HD2 PRO 85 1HD PRO 85 -25.533 23.948 -17.169 676 HD3 PRO 85 2HD PRO 85 -26.288 25.052 -16.005 677 H LYS 86 H LYS 86 -20.812 26.394 -15.602 678 HA LYS 86 HA LYS 86 -19.741 24.073 -17.013 679 HB2 LYS 86 1HB LYS 86 -18.293 25.405 -18.412 680 HB3 LYS 86 2HB LYS 86 -19.962 25.874 -18.698 681 HG2 LYS 86 1HG LYS 86 -19.672 27.879 -17.391 682 HG3 LYS 86 2HG LYS 86 -18.037 27.389 -16.940 683 HD2 LYS 86 1HD LYS 86 -17.469 27.388 -19.387 684 HD3 LYS 86 2HD LYS 86 -19.047 28.112 -19.686 685 HE2 LYS 86 1HE LYS 86 -16.997 29.310 -17.845 686 HE3 LYS 86 2HE LYS 86 -17.107 29.706 -19.557 687 HZ1 LYS 86 3HZ LYS 86 -19.311 30.561 -19.219 688 HZ2 LYS 86 1HZ LYS 86 -18.264 31.314 -18.126 689 HZ3 LYS 86 2HZ LYS 86 -19.304 30.092 -17.598 690 H LEU 87 H LEU 87 -17.534 23.672 -16.554 691 HA LEU 87 HA LEU 87 -16.823 24.497 -13.877 692 HB2 LEU 87 1HB LEU 87 -15.519 22.570 -15.800 693 HB3 LEU 87 2HB LEU 87 -14.983 22.847 -14.154 694 HG LEU 87 HG LEU 87 -17.702 21.780 -14.899 695 HD11 LEU 87 1HD1 LEU 87 -16.849 19.623 -14.098 696 HD12 LEU 87 2HD1 LEU 87 -15.244 20.333 -13.920 697 HD13 LEU 87 3HD1 LEU 87 -15.975 20.193 -15.519 698 HD21 LEU 87 3HD2 LEU 87 -17.693 22.951 -12.783 699 HD22 LEU 87 1HD2 LEU 87 -16.280 22.036 -12.252 700 HD23 LEU 87 2HD2 LEU 87 -17.818 21.213 -12.510 701 H VAL 88 H VAL 88 -15.072 25.705 -13.298 702 HA VAL 88 HA VAL 88 -13.220 26.581 -15.409 703 HB VAL 88 HB VAL 88 -13.147 28.860 -14.459 704 HG11 VAL 88 1HG1 VAL 88 -14.532 28.490 -16.395 705 HG12 VAL 88 2HG1 VAL 88 -15.310 29.654 -15.320 706 HG13 VAL 88 3HG1 VAL 88 -15.875 27.985 -15.370 707 HG21 VAL 88 3HG2 VAL 88 -14.906 29.625 -12.937 708 HG22 VAL 88 1HG2 VAL 88 -13.910 28.370 -12.200 709 HG23 VAL 88 2HG2 VAL 88 -15.515 27.973 -12.815 710 H VAL 89 H VAL 89 -11.113 26.991 -14.701 711 HA VAL 89 HA VAL 89 -10.581 26.045 -11.977 712 HB VAL 89 HB VAL 89 -8.935 25.952 -14.481 713 HG11 VAL 89 1HG1 VAL 89 -6.961 25.348 -13.132 714 HG12 VAL 89 2HG1 VAL 89 -7.831 25.832 -11.676 715 HG13 VAL 89 3HG1 VAL 89 -7.439 27.031 -12.909 716 HG21 VAL 89 3HG2 VAL 89 -10.246 24.042 -13.941 717 HG22 VAL 89 1HG2 VAL 89 -9.612 24.015 -12.296 718 HG23 VAL 89 2HG2 VAL 89 -8.548 23.666 -13.657 719 H ASN 90 H ASN 90 -10.304 27.525 -10.534 720 HA ASN 90 HA ASN 90 -9.128 30.111 -11.317 721 HB2 ASN 90 1HB ASN 90 -11.196 29.431 -9.216 722 HB3 ASN 90 2HB ASN 90 -10.340 30.972 -9.237 723 HD21 ASN 90 2HD2 ASN 90 -13.173 30.439 -9.516 724 HD22 ASN 90 1HD2 ASN 90 -13.639 31.099 -11.043 725 H GLY 91 H GLY 91 -7.008 29.729 -10.877 726 HA2 GLY 91 1HA GLY 91 -5.128 29.595 -9.554 727 HA3 GLY 91 2HA GLY 91 -6.175 29.642 -8.140 728 H ARG 92 H ARG 92 -6.262 27.847 -6.951 729 HA ARG 92 HA ARG 92 -5.609 25.295 -8.270 730 HB2 ARG 92 1HB ARG 92 -4.927 26.306 -5.523 731 HB3 ARG 92 2HB ARG 92 -4.962 24.584 -5.873 732 HG2 ARG 92 1HG ARG 92 -3.244 26.633 -7.262 733 HG3 ARG 92 2HG ARG 92 -2.705 25.473 -6.044 734 HD2 ARG 92 1HD ARG 92 -3.416 23.635 -7.542 735 HD3 ARG 92 2HD ARG 92 -3.835 24.829 -8.766 736 HE ARG 92 HE ARG 92 -1.238 25.383 -8.239 737 HH11 ARG 92 1HH1 ARG 92 -2.956 22.457 -9.105 738 HH12 ARG 92 2HH1 ARG 92 -1.586 21.734 -9.895 739 HH21 ARG 92 1HH2 ARG 92 0.569 24.400 -9.271 740 HH22 ARG 92 2HH2 ARG 92 0.390 22.828 -9.983 741 H SER 93 H SER 93 -8.157 26.887 -7.590 742 HA SER 93 HA SER 93 -9.597 24.583 -6.463 743 HB2 SER 93 1HB SER 93 -10.385 27.493 -6.161 744 HB3 SER 93 2HB SER 93 -11.170 26.101 -5.412 745 HG SER 93 HG SER 93 -8.569 27.129 -4.907 746 H ILE 94 H ILE 94 -11.349 23.870 -7.591 747 HA ILE 94 HA ILE 94 -11.807 25.112 -10.203 748 HB ILE 94 HB ILE 94 -12.833 22.466 -9.144 749 HG12 ILE 94 1HG1 ILE 94 -10.505 23.023 -10.995 750 HG13 ILE 94 2HG1 ILE 94 -10.349 22.607 -9.294 751 HG21 ILE 94 1HG2 ILE 94 -12.773 23.606 -11.940 752 HG22 ILE 94 2HG2 ILE 94 -14.203 23.353 -10.941 753 HG23 ILE 94 3HG2 ILE 94 -13.276 21.968 -11.517 754 HD11 ILE 94 3HD1 ILE 94 -11.504 20.452 -9.810 755 HD12 ILE 94 1HD1 ILE 94 -9.922 20.658 -10.568 756 HD13 ILE 94 2HD1 ILE 94 -11.394 20.885 -11.518 757 H ASP 95 H ASP 95 -13.768 26.005 -10.774 758 HA ASP 95 HA ASP 95 -15.785 26.165 -8.643 759 HB2 ASP 95 1HB ASP 95 -14.099 28.235 -9.201 760 HB3 ASP 95 2HB ASP 95 -15.442 28.593 -10.279 761 H ILE 96 H ILE 96 -17.734 27.509 -9.666 762 HA ILE 96 HA ILE 96 -18.379 26.127 -12.180 763 HB ILE 96 HB ILE 96 -20.242 26.722 -9.877 764 HG12 ILE 96 1HG1 ILE 96 -19.300 24.041 -10.914 765 HG13 ILE 96 2HG1 ILE 96 -18.522 24.879 -9.572 766 HG21 ILE 96 1HG2 ILE 96 -21.358 26.855 -12.049 767 HG22 ILE 96 2HG2 ILE 96 -21.891 25.432 -11.150 768 HG23 ILE 96 3HG2 ILE 96 -20.735 25.260 -12.471 769 HD11 ILE 96 3HD1 ILE 96 -21.384 23.958 -9.657 770 HD12 ILE 96 1HD1 ILE 96 -20.594 24.784 -8.313 771 HD13 ILE 96 2HD1 ILE 96 -20.055 23.177 -8.796 772 H GLU 97 H GLU 97 -19.091 27.319 -13.757 773 HA GLU 97 HA GLU 97 -19.853 30.119 -13.259 774 HB2 GLU 97 1HB GLU 97 -17.536 29.207 -14.513 775 HB3 GLU 97 2HB GLU 97 -18.607 29.608 -15.846 776 HG2 GLU 97 1HG GLU 97 -18.046 31.502 -13.594 777 HG3 GLU 97 2HG GLU 97 -17.052 31.426 -15.051 778 H TYR 98 H TYR 98 -20.923 30.995 -15.409 779 HA TYR 98 HA TYR 98 -22.572 28.860 -16.606 780 HB2 TYR 98 1HB TYR 98 -23.416 31.314 -15.202 781 HB3 TYR 98 2HB TYR 98 -24.250 30.994 -16.721 782 HD1 TYR 98 HD2 TYR 98 -23.514 29.611 -13.365 783 HD2 TYR 98 HD1 TYR 98 -25.887 29.280 -16.887 784 HE1 TYR 98 HE2 TYR 98 -24.991 28.014 -12.214 785 HE2 TYR 98 HE1 TYR 98 -27.368 27.691 -15.742 786 HH TYR 98 HH TYR 98 -27.180 27.086 -12.342 787 H TYR 99 H TYR 99 -23.196 29.159 -18.755 788 HA TYR 99 HA TYR 99 -22.192 31.536 -20.135 789 HB2 TYR 99 1HB TYR 99 -21.234 30.211 -21.953 790 HB3 TYR 99 2HB TYR 99 -20.449 29.816 -20.430 791 HD1 TYR 99 HD1 TYR 99 -20.900 27.664 -19.331 792 HD2 TYR 99 HD2 TYR 99 -22.490 28.565 -23.166 793 HE1 TYR 99 HE1 TYR 99 -21.352 25.289 -19.689 794 HE2 TYR 99 HE2 TYR 99 -22.957 26.180 -23.539 795 HH TYR 99 HH TYR 99 -22.053 23.964 -22.666 796 H GLU 100 H GLU 100 -23.265 31.964 -22.127 797 HA GLU 100 HA GLU 100 -26.021 31.475 -22.030 798 HB2 GLU 100 1HB GLU 100 -24.434 32.337 -24.452 799 HB3 GLU 100 2HB GLU 100 -26.149 32.596 -24.173 800 HG2 GLU 100 1HG GLU 100 -25.409 34.637 -23.575 801 HG3 GLU 100 2HG GLU 100 -25.213 33.833 -22.018 802 H CYS 101 H CYS 101 -27.299 29.966 -22.835 803 HA CYS 101 HA CYS 101 -26.489 27.503 -23.814 804 HB2 CYS 101 1HB CYS 101 -28.751 28.057 -22.949 805 HB3 CYS 101 2HB CYS 101 -29.076 28.967 -24.416 806 HA PRO 102 HA PRO 102 -24.960 28.608 -27.892 807 HB2 PRO 102 1HB PRO 102 -24.916 26.015 -28.849 808 HB3 PRO 102 2HB PRO 102 -23.622 26.762 -27.908 809 HG2 PRO 102 1HG PRO 102 -25.822 24.947 -27.005 810 HG3 PRO 102 2HG PRO 102 -24.115 24.968 -26.523 811 HD2 PRO 102 1HD PRO 102 -26.017 25.993 -24.944 812 HD3 PRO 102 2HD PRO 102 -24.420 26.760 -25.075 813 H VAL 103 H VAL 103 -27.783 26.697 -27.236 814 HA VAL 103 HA VAL 103 -28.855 26.576 -29.852 815 HB VAL 103 HB VAL 103 -30.316 26.467 -27.205 816 HG11 VAL 103 1HG1 VAL 103 -32.016 25.203 -28.431 817 HG12 VAL 103 2HG1 VAL 103 -31.124 25.459 -29.930 818 HG13 VAL 103 3HG1 VAL 103 -31.829 26.833 -29.077 819 HG21 VAL 103 3HG2 VAL 103 -28.516 24.818 -27.334 820 HG22 VAL 103 1HG2 VAL 103 -29.155 24.238 -28.873 821 HG23 VAL 103 2HG2 VAL 103 -30.099 24.041 -27.395 822 H LYS 104 H LYS 104 -28.663 29.086 -27.516 823 HA LYS 104 HA LYS 104 -30.892 30.631 -28.475 824 HB2 LYS 104 1HB LYS 104 -30.012 30.826 -26.161 825 HB3 LYS 104 2HB LYS 104 -28.525 31.505 -26.810 826 HG2 LYS 104 1HG LYS 104 -29.799 33.385 -27.733 827 HG3 LYS 104 2HG LYS 104 -31.277 32.704 -27.051 828 HD2 LYS 104 1HD LYS 104 -30.311 32.894 -24.803 829 HD3 LYS 104 2HD LYS 104 -28.856 33.613 -25.500 830 HE2 LYS 104 1HE LYS 104 -30.282 35.358 -24.664 831 HE3 LYS 104 2HE LYS 104 -30.245 35.434 -26.422 832 HZ1 LYS 104 3HZ LYS 104 -32.420 34.414 -24.687 833 HZ2 LYS 104 1HZ LYS 104 -32.371 34.117 -26.357 834 HZ3 LYS 104 2HZ LYS 104 -32.483 35.703 -25.784 835 H ARG 105 H ARG 105 -27.706 30.033 -29.461 836 HA ARG 105 HA ARG 105 -27.601 32.469 -31.092 837 HB2 ARG 105 1HB ARG 105 -25.660 31.942 -29.620 838 HB3 ARG 105 2HB ARG 105 -25.425 30.452 -30.519 839 HG2 ARG 105 1HG ARG 105 -24.934 31.695 -32.530 840 HG3 ARG 105 2HG ARG 105 -25.266 33.218 -31.696 841 HD2 ARG 105 1HD ARG 105 -23.429 32.694 -30.116 842 HD3 ARG 105 2HD ARG 105 -23.065 31.252 -31.062 843 HE ARG 105 HE ARG 105 -22.975 33.283 -32.882 844 HH11 ARG 105 1HH1 ARG 105 -21.376 32.633 -29.827 845 HH12 ARG 105 2HH1 ARG 105 -19.944 33.537 -30.237 846 HH21 ARG 105 1HH2 ARG 105 -21.073 34.424 -33.447 847 HH22 ARG 105 2HH2 ARG 105 -19.756 34.502 -32.312 848 H LYS 106 H LYS 106 -28.835 32.014 -32.842 849 HA LYS 106 HA LYS 106 -28.272 29.513 -34.297 850 HB2 LYS 106 1HB LYS 106 -30.726 31.278 -34.340 851 HB3 LYS 106 2HB LYS 106 -30.510 29.828 -35.310 852 HG2 LYS 106 1HG LYS 106 -30.465 28.454 -33.340 853 HG3 LYS 106 2HG LYS 106 -30.495 29.881 -32.303 854 HD2 LYS 106 1HD LYS 106 -32.714 30.457 -33.145 855 HD3 LYS 106 2HD LYS 106 -32.686 29.045 -34.204 856 HE2 LYS 106 1HE LYS 106 -32.511 28.952 -31.194 857 HE3 LYS 106 2HE LYS 106 -33.986 28.691 -32.124 858 HZ1 LYS 106 3HZ LYS 106 -32.868 26.809 -33.220 859 HZ2 LYS 106 1HZ LYS 106 -33.018 26.587 -31.546 860 HZ3 LYS 106 2HZ LYS 106 -31.524 27.029 -32.215 Start of MODEL 9 1 HA MET 1 HA MET 1 -24.925 -14.637 -8.122 2 HB2 MET 1 1HB MET 1 -24.954 -11.944 -9.493 3 HB3 MET 1 2HB MET 1 -23.520 -12.948 -9.350 4 HG2 MET 1 1HG MET 1 -24.432 -13.264 -11.518 5 HG3 MET 1 2HG MET 1 -24.723 -14.733 -10.590 6 HE1 MET 1 2HE MET 1 -26.207 -14.042 -13.341 7 HE2 MET 1 3HE MET 1 -27.845 -14.554 -12.938 8 HE3 MET 1 1HE MET 1 -26.467 -15.520 -12.412 9 H GLU 2 H GLU 2 -23.081 -14.314 -6.912 10 HA GLU 2 HA GLU 2 -23.106 -12.008 -5.072 11 HB2 GLU 2 1HB GLU 2 -21.999 -14.790 -4.692 12 HB3 GLU 2 2HB GLU 2 -21.643 -13.452 -3.610 13 HG2 GLU 2 1HG GLU 2 -23.996 -13.255 -3.047 14 HG3 GLU 2 2HG GLU 2 -24.386 -14.551 -4.177 15 HA PRO 3 HA PRO 3 -19.747 -11.088 -8.091 16 HB2 PRO 3 1HB PRO 3 -19.372 -8.601 -6.813 17 HB3 PRO 3 2HB PRO 3 -20.292 -8.901 -8.289 18 HG2 PRO 3 1HG PRO 3 -21.246 -8.624 -5.482 19 HG3 PRO 3 2HG PRO 3 -22.034 -8.134 -6.993 20 HD2 PRO 3 1HD PRO 3 -22.852 -10.297 -5.655 21 HD3 PRO 3 2HD PRO 3 -22.805 -10.285 -7.432 22 H ILE 4 H ILE 4 -17.878 -12.060 -7.654 23 HA ILE 4 HA ILE 4 -16.831 -12.048 -4.948 24 HB ILE 4 HB ILE 4 -15.834 -13.472 -7.417 25 HG12 ILE 4 1HG1 ILE 4 -17.998 -14.306 -6.658 26 HG13 ILE 4 2HG1 ILE 4 -16.740 -15.485 -6.300 27 HG21 ILE 4 1HG2 ILE 4 -14.960 -13.769 -4.545 28 HG22 ILE 4 2HG2 ILE 4 -14.015 -13.044 -5.845 29 HG23 ILE 4 3HG2 ILE 4 -14.418 -14.761 -5.900 30 HD11 ILE 4 3HD1 ILE 4 -17.945 -13.550 -4.329 31 HD12 ILE 4 1HD1 ILE 4 -16.721 -14.770 -3.974 32 HD13 ILE 4 2HD1 ILE 4 -18.339 -15.264 -4.470 33 H GLY 5 H GLY 5 -15.864 -10.216 -4.430 34 HA2 GLY 5 1HA GLY 5 -13.421 -9.532 -5.898 35 HA3 GLY 5 2HA GLY 5 -14.589 -8.251 -5.582 36 H ARG 6 H ARG 6 -12.556 -7.411 -4.404 37 HA ARG 6 HA ARG 6 -13.001 -8.018 -1.604 38 HB2 ARG 6 1HB ARG 6 -10.664 -8.406 -1.075 39 HB3 ARG 6 2HB ARG 6 -11.219 -9.595 -2.244 40 HG2 ARG 6 1HG ARG 6 -10.129 -8.338 -4.039 41 HG3 ARG 6 2HG ARG 6 -9.566 -7.151 -2.860 42 HD2 ARG 6 1HD ARG 6 -8.817 -10.067 -3.029 43 HD3 ARG 6 2HD ARG 6 -7.771 -8.674 -3.314 44 HE ARG 6 HE ARG 6 -8.895 -9.414 -0.677 45 HH11 ARG 6 1HH1 ARG 6 -6.347 -8.027 -2.660 46 HH12 ARG 6 2HH1 ARG 6 -5.297 -7.717 -1.304 47 HH21 ARG 6 1HH2 ARG 6 -7.527 -8.988 1.090 48 HH22 ARG 6 2HH2 ARG 6 -5.967 -8.276 0.827 49 H SER 7 H SER 7 -12.836 -6.263 -0.356 50 HA SER 7 HA SER 7 -12.141 -3.743 -1.544 51 HB2 SER 7 1HB SER 7 -12.835 -4.383 1.335 52 HB3 SER 7 2HB SER 7 -12.830 -2.786 0.588 53 HG SER 7 HG SER 7 -14.431 -3.737 -0.920 54 H LEU 8 H LEU 8 -10.052 -3.462 -1.922 55 HA LEU 8 HA LEU 8 -7.893 -4.754 -0.928 56 HB2 LEU 8 1HB LEU 8 -7.970 -1.862 -1.776 57 HB3 LEU 8 2HB LEU 8 -6.525 -2.849 -1.665 58 HG LEU 8 HG LEU 8 -8.837 -3.363 -3.537 59 HD11 LEU 8 1HD1 LEU 8 -7.249 -2.687 -5.286 60 HD12 LEU 8 2HD1 LEU 8 -6.092 -2.226 -4.036 61 HD13 LEU 8 3HD1 LEU 8 -7.628 -1.371 -4.175 62 HD21 LEU 8 3HD2 LEU 8 -6.137 -4.693 -3.313 63 HD22 LEU 8 1HD2 LEU 8 -7.358 -5.027 -4.541 64 HD23 LEU 8 2HD2 LEU 8 -7.682 -5.407 -2.849 65 H GLN 9 H GLN 9 -8.759 -1.476 0.220 66 HA GLN 9 HA GLN 9 -7.158 -2.039 2.616 67 HB2 GLN 9 1HB GLN 9 -8.062 0.597 1.452 68 HB3 GLN 9 2HB GLN 9 -7.127 0.418 2.932 69 HG2 GLN 9 1HG GLN 9 -5.306 -0.594 1.672 70 HG3 GLN 9 2HG GLN 9 -6.243 -0.441 0.186 71 HE21 GLN 9 2HE2 GLN 9 -4.723 0.852 -0.797 72 HE22 GLN 9 1HE2 GLN 9 -4.459 2.503 -0.327 73 H GLY 10 H GLY 10 -10.283 -2.137 1.673 74 HA2 GLY 10 1HA GLY 10 -11.346 -0.971 4.153 75 HA3 GLY 10 2HA GLY 10 -12.284 -1.312 2.706 76 H VAL 11 H VAL 11 -10.138 -3.199 4.846 77 HA VAL 11 HA VAL 11 -12.156 -5.331 4.833 78 HB VAL 11 HB VAL 11 -9.305 -5.468 5.838 79 HG11 VAL 11 1HG1 VAL 11 -10.743 -7.108 6.892 80 HG12 VAL 11 2HG1 VAL 11 -9.656 -7.902 5.754 81 HG13 VAL 11 3HG1 VAL 11 -11.343 -7.629 5.317 82 HG21 VAL 11 3HG2 VAL 11 -10.472 -6.392 3.217 83 HG22 VAL 11 1HG2 VAL 11 -8.832 -6.721 3.781 84 HG23 VAL 11 2HG2 VAL 11 -9.336 -5.063 3.450 85 H THR 12 H THR 12 -10.087 -3.497 7.048 86 HA THR 12 HA THR 12 -11.057 -4.539 9.449 87 HB THR 12 HB THR 12 -8.971 -3.239 9.247 88 HG1 THR 12 HG1 THR 12 -10.679 -3.153 11.235 89 HG21 THR 12 3HG2 THR 12 -9.031 -0.796 9.174 90 HG22 THR 12 1HG2 THR 12 -10.783 -0.842 8.983 91 HG23 THR 12 2HG2 THR 12 -9.741 -1.497 7.719 92 H GLY 13 H GLY 13 -12.399 -2.125 7.326 93 HA2 GLY 13 1HA GLY 13 -14.857 -2.147 8.830 94 HA3 GLY 13 2HA GLY 13 -14.030 -0.594 8.841 95 H ARG 14 H ARG 14 -16.618 -1.271 7.681 96 HA ARG 14 HA ARG 14 -16.116 -0.236 5.000 97 HB2 ARG 14 1HB ARG 14 -17.856 -2.660 5.531 98 HB3 ARG 14 2HB ARG 14 -17.834 -1.767 4.021 99 HG2 ARG 14 1HG ARG 14 -16.457 -3.515 3.512 100 HG3 ARG 14 2HG ARG 14 -15.280 -2.325 4.069 101 HD2 ARG 14 1HD ARG 14 -14.762 -4.460 5.048 102 HD3 ARG 14 2HD ARG 14 -15.345 -3.378 6.310 103 HE ARG 14 HE ARG 14 -17.503 -4.872 5.308 104 HH11 ARG 14 1HH1 ARG 14 -14.594 -5.307 7.216 105 HH12 ARG 14 2HH1 ARG 14 -15.229 -6.660 8.104 106 HH21 ARG 14 1HH2 ARG 14 -18.327 -6.669 6.439 107 HH22 ARG 14 2HH2 ARG 14 -17.350 -7.433 7.659 108 HA PRO 15 HA PRO 15 -19.648 1.864 7.152 109 HB2 PRO 15 1HB PRO 15 -18.687 4.366 6.999 110 HB3 PRO 15 2HB PRO 15 -18.200 3.265 8.294 111 HG2 PRO 15 1HG PRO 15 -16.752 3.975 5.766 112 HG3 PRO 15 2HG PRO 15 -16.117 3.833 7.416 113 HD2 PRO 15 1HD PRO 15 -15.876 1.860 5.548 114 HD3 PRO 15 2HD PRO 15 -15.961 1.546 7.291 115 H ASP 16 H ASP 16 -21.191 3.336 6.192 116 HA ASP 16 HA ASP 16 -21.363 3.141 3.360 117 HB2 ASP 16 1HB ASP 16 -23.415 4.273 3.510 118 HB3 ASP 16 2HB ASP 16 -23.301 3.420 5.044 119 H PHE 17 H PHE 17 -20.021 5.462 5.540 120 HA PHE 17 HA PHE 17 -20.021 7.812 4.135 121 HB2 PHE 17 1HB PHE 17 -19.114 7.563 6.411 122 HB3 PHE 17 2HB PHE 17 -17.726 6.697 5.760 123 HD1 PHE 17 HD2 PHE 17 -19.423 9.972 5.878 124 HD2 PHE 17 HD1 PHE 17 -15.878 7.859 4.830 125 HE1 PHE 17 HE2 PHE 17 -18.239 12.107 5.576 126 HE2 PHE 17 HE1 PHE 17 -14.690 9.992 4.529 127 HZ PHE 17 HZ PHE 17 -15.870 12.119 4.900 128 H GLN 18 H GLN 18 -17.615 5.199 3.853 129 HA GLN 18 HA GLN 18 -16.091 6.512 1.869 130 HB2 GLN 18 1HB GLN 18 -15.033 4.353 1.461 131 HB3 GLN 18 2HB GLN 18 -15.115 4.715 3.175 132 HG2 GLN 18 1HG GLN 18 -16.733 3.106 3.574 133 HG3 GLN 18 2HG GLN 18 -17.219 3.033 1.882 134 HE21 GLN 18 2HE2 GLN 18 -14.643 2.804 0.741 135 HE22 GLN 18 1HE2 GLN 18 -14.014 1.261 1.172 136 H LYS 19 H LYS 19 -18.899 4.421 1.735 137 HA LYS 19 HA LYS 19 -18.691 3.969 -1.077 138 HB2 LYS 19 1HB LYS 19 -20.927 3.491 0.880 139 HB3 LYS 19 2HB LYS 19 -21.059 3.111 -0.835 140 HG2 LYS 19 1HG LYS 19 -19.161 1.931 1.178 141 HG3 LYS 19 2HG LYS 19 -20.440 1.111 0.275 142 HD2 LYS 19 1HD LYS 19 -19.257 1.385 -1.786 143 HD3 LYS 19 2HD LYS 19 -18.062 2.433 -1.021 144 HE2 LYS 19 1HE LYS 19 -17.013 0.344 -1.232 145 HE3 LYS 19 2HE LYS 19 -17.496 0.460 0.459 146 HZ1 LYS 19 3HZ LYS 19 -18.966 -1.013 -1.661 147 HZ2 LYS 19 1HZ LYS 19 -19.419 -0.915 -0.029 148 HZ3 LYS 19 2HZ LYS 19 -17.989 -1.716 -0.467 149 H ARG 20 H ARG 20 -20.277 6.405 0.908 150 HA ARG 20 HA ARG 20 -21.725 7.630 -1.231 151 HB2 ARG 20 1HB ARG 20 -20.543 9.320 0.937 152 HB3 ARG 20 2HB ARG 20 -22.136 9.406 0.206 153 HG2 ARG 20 1HG ARG 20 -21.223 7.309 2.148 154 HG3 ARG 20 2HG ARG 20 -22.201 8.720 2.551 155 HD2 ARG 20 1HD ARG 20 -22.996 6.562 0.602 156 HD3 ARG 20 2HD ARG 20 -23.533 6.653 2.278 157 HE ARG 20 HE ARG 20 -24.306 8.458 0.094 158 HH11 ARG 20 1HH1 ARG 20 -24.620 7.412 3.426 159 HH12 ARG 20 2HH1 ARG 20 -26.140 8.231 3.667 160 HH21 ARG 20 1HH2 ARG 20 -26.287 9.550 0.414 161 HH22 ARG 20 2HH2 ARG 20 -27.086 9.457 1.955 162 H LEU 21 H LEU 21 -18.601 8.134 0.258 163 HA LEU 21 HA LEU 21 -17.568 10.162 -1.329 164 HB2 LEU 21 1HB LEU 21 -16.406 9.550 0.623 165 HB3 LEU 21 2HB LEU 21 -16.331 7.863 0.159 166 HG LEU 21 HG LEU 21 -14.696 8.435 -1.599 167 HD11 LEU 21 1HD1 LEU 21 -14.817 11.200 -0.387 168 HD12 LEU 21 2HD1 LEU 21 -15.358 10.752 -2.005 169 HD13 LEU 21 3HD1 LEU 21 -13.647 10.652 -1.587 170 HD21 LEU 21 3HD2 LEU 21 -13.991 9.340 1.190 171 HD22 LEU 21 1HD2 LEU 21 -12.831 8.917 -0.068 172 HD23 LEU 21 2HD2 LEU 21 -13.924 7.690 0.571 173 H GLU 22 H GLU 22 -17.279 6.643 -1.802 174 HA GLU 22 HA GLU 22 -15.938 6.785 -4.277 175 HB2 GLU 22 1HB GLU 22 -17.642 4.619 -3.047 176 HB3 GLU 22 2HB GLU 22 -16.792 4.418 -4.571 177 HG2 GLU 22 1HG GLU 22 -14.664 4.816 -3.424 178 HG3 GLU 22 2HG GLU 22 -15.530 4.983 -1.898 179 H GLN 23 H GLN 23 -19.363 6.706 -3.441 180 HA GLN 23 HA GLN 23 -20.359 6.218 -6.023 181 HB2 GLN 23 1HB GLN 23 -21.525 6.179 -3.680 182 HB3 GLN 23 2HB GLN 23 -21.866 7.868 -4.025 183 HG2 GLN 23 1HG GLN 23 -23.742 6.527 -4.666 184 HG3 GLN 23 2HG GLN 23 -22.981 7.195 -6.108 185 HE21 GLN 23 2HE2 GLN 23 -21.651 4.505 -4.309 186 HE22 GLN 23 1HE2 GLN 23 -21.937 3.300 -5.520 187 H MET 24 H MET 24 -20.008 9.282 -4.221 188 HA MET 24 HA MET 24 -20.855 10.902 -6.380 189 HB2 MET 24 1HB MET 24 -19.986 12.791 -5.117 190 HB3 MET 24 2HB MET 24 -20.910 11.723 -4.073 191 HG2 MET 24 1HG MET 24 -18.842 10.790 -3.196 192 HG3 MET 24 2HG MET 24 -17.908 11.834 -4.265 193 HE1 MET 24 3HE MET 24 -18.819 15.396 -2.857 194 HE2 MET 24 1HE MET 24 -19.657 14.525 -4.140 195 HE3 MET 24 2HE MET 24 -17.894 14.508 -4.070 196 H LYS 25 H LYS 25 -17.699 9.802 -5.287 197 HA LYS 25 HA LYS 25 -16.065 11.298 -6.996 198 HB2 LYS 25 1HB LYS 25 -15.370 9.782 -5.072 199 HB3 LYS 25 2HB LYS 25 -15.569 8.434 -6.178 200 HG2 LYS 25 1HG LYS 25 -13.272 8.958 -6.129 201 HG3 LYS 25 2HG LYS 25 -13.890 9.546 -7.675 202 HD2 LYS 25 1HD LYS 25 -14.035 11.808 -6.767 203 HD3 LYS 25 2HD LYS 25 -13.452 11.225 -5.206 204 HE2 LYS 25 1HE LYS 25 -11.358 10.511 -6.294 205 HE3 LYS 25 2HE LYS 25 -11.940 11.186 -7.814 206 HZ1 LYS 25 3HZ LYS 25 -10.514 12.769 -6.798 207 HZ2 LYS 25 1HZ LYS 25 -11.315 12.663 -5.308 208 HZ3 LYS 25 2HZ LYS 25 -12.091 13.362 -6.642 209 H GLU 26 H GLU 26 -17.650 8.176 -7.432 210 HA GLU 26 HA GLU 26 -16.666 7.655 -10.026 211 HB2 GLU 26 1HB GLU 26 -17.653 5.979 -8.424 212 HB3 GLU 26 2HB GLU 26 -19.239 6.634 -8.813 213 HG2 GLU 26 1HG GLU 26 -18.941 5.998 -11.145 214 HG3 GLU 26 2HG GLU 26 -17.337 5.365 -10.769 215 H LYS 27 H LYS 27 -19.688 9.086 -8.842 216 HA LYS 27 HA LYS 27 -21.030 9.487 -11.222 217 HB2 LYS 27 1HB LYS 27 -20.926 11.067 -8.672 218 HB3 LYS 27 2HB LYS 27 -21.899 11.618 -10.027 219 HG2 LYS 27 1HG LYS 27 -22.189 8.859 -8.888 220 HG3 LYS 27 2HG LYS 27 -23.061 10.247 -8.233 221 HD2 LYS 27 1HD LYS 27 -23.161 9.392 -11.125 222 HD3 LYS 27 2HD LYS 27 -24.354 8.925 -9.912 223 HE2 LYS 27 1HE LYS 27 -23.679 11.772 -10.648 224 HE3 LYS 27 2HE LYS 27 -25.048 10.871 -11.297 225 HZ1 LYS 27 3HZ LYS 27 -24.617 11.464 -8.413 226 HZ2 LYS 27 1HZ LYS 27 -25.962 10.683 -9.086 227 HZ3 LYS 27 2HZ LYS 27 -25.664 12.323 -9.430 228 H VAL 28 H VAL 28 -18.710 11.674 -9.663 229 HA VAL 28 HA VAL 28 -18.791 13.711 -11.568 230 HB VAL 28 HB VAL 28 -16.484 12.890 -9.788 231 HG11 VAL 28 1HG1 VAL 28 -15.692 15.183 -10.061 232 HG12 VAL 28 2HG1 VAL 28 -17.014 15.510 -11.183 233 HG13 VAL 28 3HG1 VAL 28 -15.758 14.349 -11.617 234 HG21 VAL 28 3HG2 VAL 28 -18.583 13.398 -8.591 235 HG22 VAL 28 1HG2 VAL 28 -18.609 14.985 -9.358 236 HG23 VAL 28 2HG2 VAL 28 -17.303 14.564 -8.248 237 H MET 29 H MET 29 -16.801 10.777 -11.404 238 HA MET 29 HA MET 29 -15.293 11.605 -13.736 239 HB2 MET 29 1HB MET 29 -14.001 9.576 -13.427 240 HB3 MET 29 2HB MET 29 -14.152 10.444 -11.904 241 HG2 MET 29 1HG MET 29 -15.897 8.903 -11.193 242 HG3 MET 29 2HG MET 29 -15.769 8.043 -12.727 243 HE1 MET 29 3HE MET 29 -12.329 8.223 -9.646 244 HE2 MET 29 1HE MET 29 -13.881 9.026 -9.409 245 HE3 MET 29 2HE MET 29 -12.784 9.580 -10.676 246 H LYS 30 H LYS 30 -18.300 10.702 -13.690 247 HA LYS 30 HA LYS 30 -17.997 8.949 -16.039 248 HB2 LYS 30 1HB LYS 30 -19.839 8.779 -13.752 249 HB3 LYS 30 2HB LYS 30 -20.603 8.572 -15.321 250 HG2 LYS 30 1HG LYS 30 -20.046 6.410 -14.644 251 HG3 LYS 30 2HG LYS 30 -18.788 6.850 -15.799 252 HD2 LYS 30 1HD LYS 30 -17.303 7.434 -13.928 253 HD3 LYS 30 2HD LYS 30 -18.558 6.938 -12.791 254 HE2 LYS 30 1HE LYS 30 -17.179 5.073 -12.916 255 HE3 LYS 30 2HE LYS 30 -18.487 4.685 -14.030 256 HZ1 LYS 30 3HZ LYS 30 -15.743 5.583 -14.688 257 HZ2 LYS 30 1HZ LYS 30 -16.998 5.572 -15.831 258 HZ3 LYS 30 2HZ LYS 30 -16.491 4.122 -15.107 259 H ASP 31 H ASP 31 -18.733 12.055 -15.186 260 HA ASP 31 HA ASP 31 -20.906 12.414 -17.074 261 HB2 ASP 31 1HB ASP 31 -20.862 13.789 -15.037 262 HB3 ASP 31 2HB ASP 31 -19.321 14.479 -15.536 263 H GLN 32 H GLN 32 -20.769 13.200 -19.078 264 HA GLN 32 HA GLN 32 -18.361 12.861 -20.498 265 HB2 GLN 32 1HB GLN 32 -19.609 13.821 -22.416 266 HB3 GLN 32 2HB GLN 32 -20.492 12.546 -21.586 267 HG2 GLN 32 1HG GLN 32 -22.038 14.006 -20.698 268 HG3 GLN 32 2HG GLN 32 -20.955 15.390 -20.829 269 HE21 GLN 32 2HE2 GLN 32 -22.420 16.655 -21.853 270 HE22 GLN 32 1HE2 GLN 32 -22.931 16.380 -23.490 271 H ASP 33 H ASP 33 -19.976 15.780 -19.315 272 HA ASP 33 HA ASP 33 -18.268 17.556 -20.778 273 HB2 ASP 33 1HB ASP 33 -20.188 18.063 -18.495 274 HB3 ASP 33 2HB ASP 33 -19.345 19.328 -19.383 275 H VAL 34 H VAL 34 -18.391 16.239 -17.532 276 HA VAL 34 HA VAL 34 -16.259 17.653 -16.404 277 HB VAL 34 HB VAL 34 -17.182 14.814 -15.920 278 HG11 VAL 34 1HG1 VAL 34 -15.936 14.902 -13.819 279 HG12 VAL 34 2HG1 VAL 34 -15.269 16.470 -14.280 280 HG13 VAL 34 3HG1 VAL 34 -14.860 15.029 -15.212 281 HG21 VAL 34 3HG2 VAL 34 -18.208 15.783 -13.913 282 HG22 VAL 34 1HG2 VAL 34 -18.830 16.524 -15.387 283 HG23 VAL 34 2HG2 VAL 34 -17.643 17.380 -14.402 284 H GLN 35 H GLN 35 -16.280 14.684 -18.367 285 HA GLN 35 HA GLN 35 -13.549 14.098 -18.341 286 HB2 GLN 35 1HB GLN 35 -15.336 13.815 -20.761 287 HB3 GLN 35 2HB GLN 35 -13.894 12.885 -20.388 288 HG2 GLN 35 1HG GLN 35 -16.459 12.816 -18.825 289 HG3 GLN 35 2HG GLN 35 -15.961 11.635 -20.032 290 HE21 GLN 35 2HE2 GLN 35 -16.546 11.369 -17.175 291 HE22 GLN 35 1HE2 GLN 35 -15.144 10.637 -16.477 292 H ALA 36 H ALA 36 -15.400 16.105 -20.588 293 HA ALA 36 HA ALA 36 -13.343 16.839 -22.309 294 HB1 ALA 36 1HB ALA 36 -15.686 17.206 -22.827 295 HB2 ALA 36 2HB ALA 36 -14.788 18.720 -22.949 296 HB3 ALA 36 3HB ALA 36 -15.802 18.407 -21.540 297 H PHE 37 H PHE 37 -14.492 18.469 -19.363 298 HA PHE 37 HA PHE 37 -12.684 20.648 -19.558 299 HB2 PHE 37 1HB PHE 37 -14.642 20.893 -18.191 300 HB3 PHE 37 2HB PHE 37 -14.193 19.507 -17.201 301 HD1 PHE 37 HD2 PHE 37 -13.065 22.920 -18.156 302 HD2 PHE 37 HD1 PHE 37 -12.959 19.808 -15.258 303 HE1 PHE 37 HE2 PHE 37 -11.887 24.414 -16.595 304 HE2 PHE 37 HE1 PHE 37 -11.785 21.296 -13.695 305 HZ PHE 37 HZ PHE 37 -11.245 23.601 -14.360 306 H LEU 38 H LEU 38 -12.536 17.535 -17.903 307 HA LEU 38 HA LEU 38 -10.239 17.972 -16.389 308 HB2 LEU 38 1HB LEU 38 -11.794 15.667 -17.256 309 HB3 LEU 38 2HB LEU 38 -10.090 15.305 -17.074 310 HG LEU 38 HG LEU 38 -11.315 14.799 -15.030 311 HD11 LEU 38 1HD1 LEU 38 -9.006 15.492 -14.817 312 HD12 LEU 38 2HD1 LEU 38 -9.953 16.093 -13.454 313 HD13 LEU 38 3HD1 LEU 38 -9.499 17.185 -14.764 314 HD21 LEU 38 3HD2 LEU 38 -12.327 16.576 -13.695 315 HD22 LEU 38 1HD2 LEU 38 -13.128 16.413 -15.258 316 HD23 LEU 38 2HD2 LEU 38 -11.993 17.735 -14.983 317 H LYS 39 H LYS 39 -10.538 16.753 -19.723 318 HA LYS 39 HA LYS 39 -7.663 16.537 -19.941 319 HB2 LYS 39 1HB LYS 39 -7.982 15.509 -21.978 320 HB3 LYS 39 2HB LYS 39 -9.493 15.120 -21.169 321 HG2 LYS 39 1HG LYS 39 -10.704 16.669 -22.424 322 HG3 LYS 39 2HG LYS 39 -9.249 17.525 -22.936 323 HD2 LYS 39 1HD LYS 39 -10.166 14.790 -23.808 324 HD3 LYS 39 2HD LYS 39 -10.069 16.250 -24.793 325 HE2 LYS 39 1HE LYS 39 -7.815 14.601 -23.671 326 HE3 LYS 39 2HE LYS 39 -8.182 14.929 -25.362 327 HZ1 LYS 39 3HZ LYS 39 -7.743 17.370 -24.701 328 HZ2 LYS 39 1HZ LYS 39 -6.420 16.330 -24.915 329 HZ3 LYS 39 2HZ LYS 39 -6.950 16.708 -23.354 330 H GLU 40 H GLU 40 -10.067 18.927 -20.554 331 HA GLU 40 HA GLU 40 -8.657 20.526 -22.422 332 HB2 GLU 40 1HB GLU 40 -11.147 20.620 -21.442 333 HB3 GLU 40 2HB GLU 40 -10.412 21.791 -20.362 334 HG2 GLU 40 1HG GLU 40 -10.241 21.985 -23.354 335 HG3 GLU 40 2HG GLU 40 -11.539 22.711 -22.412 336 H ASN 41 H ASN 41 -8.732 20.311 -18.928 337 HA ASN 41 HA ASN 41 -6.462 22.181 -18.783 338 HB2 ASN 41 1HB ASN 41 -8.748 21.684 -16.880 339 HB3 ASN 41 2HB ASN 41 -7.252 22.453 -16.350 340 HD21 ASN 41 2HD2 ASN 41 -10.082 22.766 -18.354 341 HD22 ASN 41 1HD2 ASN 41 -9.932 24.466 -18.634 342 H GLU 42 H GLU 42 -6.280 19.348 -19.305 343 HA GLU 42 HA GLU 42 -5.746 17.833 -17.001 344 HB2 GLU 42 1HB GLU 42 -4.481 16.331 -18.535 345 HB3 GLU 42 2HB GLU 42 -6.097 16.725 -19.102 346 HG2 GLU 42 1HG GLU 42 -5.151 18.385 -20.630 347 HG3 GLU 42 2HG GLU 42 -3.531 17.969 -20.069 348 H GLU 43 H GLU 43 -3.899 20.233 -18.615 349 HA GLU 43 HA GLU 43 -1.368 19.530 -17.480 350 HB2 GLU 43 1HB GLU 43 -1.496 20.784 -19.559 351 HB3 GLU 43 2HB GLU 43 -2.371 22.079 -18.757 352 HG2 GLU 43 1HG GLU 43 -0.371 22.447 -17.326 353 HG3 GLU 43 2HG GLU 43 0.490 21.271 -18.318 354 H VAL 44 H VAL 44 -4.083 21.521 -16.565 355 HA VAL 44 HA VAL 44 -2.520 22.941 -14.548 356 HB VAL 44 HB VAL 44 -5.439 23.360 -15.181 357 HG11 VAL 44 1HG1 VAL 44 -4.641 24.343 -13.103 358 HG12 VAL 44 2HG1 VAL 44 -5.051 25.586 -14.284 359 HG13 VAL 44 3HG1 VAL 44 -3.362 25.181 -13.983 360 HG21 VAL 44 3HG2 VAL 44 -3.078 24.716 -16.473 361 HG22 VAL 44 1HG2 VAL 44 -4.773 25.140 -16.714 362 HG23 VAL 44 2HG2 VAL 44 -4.168 23.573 -17.253 363 H ILE 45 H ILE 45 -5.225 20.704 -14.824 364 HA ILE 45 HA ILE 45 -6.018 20.911 -12.097 365 HB ILE 45 HB ILE 45 -6.670 18.775 -14.126 366 HG12 ILE 45 1HG1 ILE 45 -8.267 21.182 -13.232 367 HG13 ILE 45 2HG1 ILE 45 -7.377 21.072 -14.749 368 HG21 ILE 45 1HG2 ILE 45 -7.030 17.951 -11.871 369 HG22 ILE 45 2HG2 ILE 45 -8.579 18.251 -12.661 370 HG23 ILE 45 3HG2 ILE 45 -7.959 19.396 -11.472 371 HD11 ILE 45 3HD1 ILE 45 -9.733 20.683 -15.102 372 HD12 ILE 45 1HD1 ILE 45 -9.714 19.361 -13.932 373 HD13 ILE 45 2HD1 ILE 45 -8.810 19.218 -15.440 374 H ASP 46 H ASP 46 -5.642 19.592 -10.402 375 HA ASP 46 HA ASP 46 -3.596 17.491 -10.708 376 HB2 ASP 46 1HB ASP 46 -2.814 19.534 -9.451 377 HB3 ASP 46 2HB ASP 46 -4.072 19.217 -8.266 378 H GLN 47 H GLN 47 -3.770 15.820 -8.974 379 HA GLN 47 HA GLN 47 -6.319 14.684 -8.738 380 HB2 GLN 47 1HB GLN 47 -3.837 14.348 -7.057 381 HB3 GLN 47 2HB GLN 47 -5.260 13.322 -6.907 382 HG2 GLN 47 1HG GLN 47 -4.979 12.607 -9.228 383 HG3 GLN 47 2HG GLN 47 -3.546 13.624 -9.362 384 HE21 GLN 47 2HE2 GLN 47 -4.888 10.733 -7.989 385 HE22 GLN 47 1HE2 GLN 47 -3.388 10.023 -7.504 386 H LYS 48 H LYS 48 -4.428 16.689 -6.547 387 HA LYS 48 HA LYS 48 -6.198 16.664 -4.349 388 HB2 LYS 48 1HB LYS 48 -4.122 18.672 -5.231 389 HB3 LYS 48 2HB LYS 48 -4.943 18.723 -3.677 390 HG2 LYS 48 1HG LYS 48 -3.970 16.673 -3.001 391 HG3 LYS 48 2HG LYS 48 -3.354 16.356 -4.621 392 HD2 LYS 48 1HD LYS 48 -1.890 18.334 -4.417 393 HD3 LYS 48 2HD LYS 48 -2.475 18.566 -2.767 394 HE2 LYS 48 1HE LYS 48 -1.547 16.485 -2.066 395 HE3 LYS 48 2HE LYS 48 -1.164 16.030 -3.725 396 HZ1 LYS 48 3HZ LYS 48 0.791 16.772 -2.531 397 HZ2 LYS 48 1HZ LYS 48 0.067 18.273 -2.212 398 HZ3 LYS 48 2HZ LYS 48 0.443 17.830 -3.807 399 H MET 49 H MET 49 -5.908 18.781 -7.140 400 HA MET 49 HA MET 49 -7.738 20.756 -6.472 401 HB2 MET 49 1HB MET 49 -6.220 20.749 -8.470 402 HB3 MET 49 2HB MET 49 -7.292 19.585 -9.228 403 HG2 MET 49 1HG MET 49 -9.090 21.174 -9.220 404 HG3 MET 49 2HG MET 49 -8.096 22.323 -8.328 405 HE1 MET 49 3HE MET 49 -5.283 22.041 -9.658 406 HE2 MET 49 1HE MET 49 -6.012 23.618 -9.359 407 HE3 MET 49 2HE MET 49 -5.342 23.242 -10.948 408 H ILE 50 H ILE 50 -8.206 17.561 -7.874 409 HA ILE 50 HA ILE 50 -10.980 17.800 -8.382 410 HB ILE 50 HB ILE 50 -9.359 15.296 -7.864 411 HG12 ILE 50 1HG1 ILE 50 -8.527 16.646 -9.763 412 HG13 ILE 50 2HG1 ILE 50 -9.203 15.109 -10.293 413 HG21 ILE 50 1HG2 ILE 50 -11.754 14.932 -7.579 414 HG22 ILE 50 2HG2 ILE 50 -11.164 14.126 -9.033 415 HG23 ILE 50 3HG2 ILE 50 -12.059 15.640 -9.166 416 HD11 ILE 50 3HD1 ILE 50 -11.266 16.258 -10.951 417 HD12 ILE 50 1HD1 ILE 50 -9.853 16.912 -11.778 418 HD13 ILE 50 2HD1 ILE 50 -10.571 17.792 -10.430 419 H GLU 51 H GLU 51 -9.123 16.596 -5.616 420 HA GLU 51 HA GLU 51 -11.349 15.632 -4.149 421 HB2 GLU 51 1HB GLU 51 -8.752 16.629 -2.972 422 HB3 GLU 51 2HB GLU 51 -9.862 15.461 -2.272 423 HG2 GLU 51 1HG GLU 51 -8.110 15.076 -4.687 424 HG3 GLU 51 2HG GLU 51 -7.912 14.338 -3.100 425 H LYS 52 H LYS 52 -9.590 18.686 -4.149 426 HA LYS 52 HA LYS 52 -11.010 19.885 -2.008 427 HB2 LYS 52 1HB LYS 52 -9.366 21.028 -4.262 428 HB3 LYS 52 2HB LYS 52 -10.109 22.040 -3.032 429 HG2 LYS 52 1HG LYS 52 -8.155 19.822 -2.459 430 HG3 LYS 52 2HG LYS 52 -7.730 21.530 -2.597 431 HD2 LYS 52 1HD LYS 52 -9.305 22.028 -0.755 432 HD3 LYS 52 2HD LYS 52 -9.613 20.300 -0.585 433 HE2 LYS 52 1HE LYS 52 -7.274 19.919 -0.042 434 HE3 LYS 52 2HE LYS 52 -6.925 21.632 -0.274 435 HZ1 LYS 52 3HZ LYS 52 -8.485 22.118 1.549 436 HZ2 LYS 52 1HZ LYS 52 -7.169 21.172 2.054 437 HZ3 LYS 52 2HZ LYS 52 -8.686 20.455 1.807 438 H SER 53 H SER 53 -11.649 19.569 -5.408 439 HA SER 53 HA SER 53 -13.864 21.488 -5.192 440 HB2 SER 53 1HB SER 53 -12.623 20.437 -7.737 441 HB3 SER 53 2HB SER 53 -13.668 21.846 -7.543 442 HG SER 53 HG SER 53 -10.970 21.503 -6.807 443 H LEU 54 H LEU 54 -13.721 18.494 -4.509 444 HA LEU 54 HA LEU 54 -15.218 17.028 -6.365 445 HB2 LEU 54 1HB LEU 54 -14.233 16.696 -3.703 446 HB3 LEU 54 2HB LEU 54 -15.907 16.185 -3.746 447 HG LEU 54 HG LEU 54 -13.716 15.151 -5.531 448 HD11 LEU 54 1HD1 LEU 54 -15.129 13.886 -3.190 449 HD12 LEU 54 2HD1 LEU 54 -13.440 14.390 -3.248 450 HD13 LEU 54 3HD1 LEU 54 -14.000 13.062 -4.265 451 HD21 LEU 54 3HD2 LEU 54 -15.363 13.505 -6.260 452 HD22 LEU 54 1HD2 LEU 54 -15.891 15.144 -6.637 453 HD23 LEU 54 2HD2 LEU 54 -16.590 14.286 -5.264 454 H ASN 55 H ASN 55 -16.225 18.858 -3.525 455 HA ASN 55 HA ASN 55 -18.980 18.534 -3.757 456 HB2 ASN 55 1HB ASN 55 -19.183 20.617 -2.443 457 HB3 ASN 55 2HB ASN 55 -17.971 19.532 -1.774 458 HD21 ASN 55 2HD2 ASN 55 -15.783 20.083 -1.941 459 HD22 ASN 55 1HD2 ASN 55 -15.280 21.705 -2.287 460 H LYS 56 H LYS 56 -16.839 20.848 -5.337 461 HA LYS 56 HA LYS 56 -18.862 22.411 -6.564 462 HB2 LYS 56 1HB LYS 56 -16.011 21.959 -7.462 463 HB3 LYS 56 2HB LYS 56 -17.064 23.271 -7.974 464 HG2 LYS 56 1HG LYS 56 -16.826 23.150 -5.095 465 HG3 LYS 56 2HG LYS 56 -15.258 23.309 -5.886 466 HD2 LYS 56 1HD LYS 56 -16.042 25.505 -5.472 467 HD3 LYS 56 2HD LYS 56 -16.219 25.208 -7.200 468 HE2 LYS 56 1HE LYS 56 -18.579 24.817 -6.939 469 HE3 LYS 56 2HE LYS 56 -18.443 24.948 -5.184 470 HZ1 LYS 56 3HZ LYS 56 -19.268 27.006 -6.152 471 HZ2 LYS 56 1HZ LYS 56 -17.887 27.131 -7.132 472 HZ3 LYS 56 2HZ LYS 56 -17.742 27.250 -5.449 473 H LEU 57 H LEU 57 -16.805 19.778 -7.749 474 HA LEU 57 HA LEU 57 -17.808 19.711 -10.367 475 HB2 LEU 57 1HB LEU 57 -16.557 17.486 -8.753 476 HB3 LEU 57 2HB LEU 57 -16.767 17.484 -10.495 477 HG LEU 57 HG LEU 57 -15.017 19.395 -8.942 478 HD11 LEU 57 1HD1 LEU 57 -14.298 17.087 -10.740 479 HD12 LEU 57 2HD1 LEU 57 -14.132 17.122 -8.986 480 HD13 LEU 57 3HD1 LEU 57 -13.164 18.206 -9.985 481 HD21 LEU 57 3HD2 LEU 57 -14.232 20.132 -11.123 482 HD22 LEU 57 1HD2 LEU 57 -15.964 20.411 -10.952 483 HD23 LEU 57 2HD2 LEU 57 -15.382 19.053 -11.914 484 H TYR 58 H TYR 58 -18.760 17.938 -7.450 485 HA TYR 58 HA TYR 58 -20.632 16.278 -8.798 486 HB2 TYR 58 1HB TYR 58 -19.583 15.840 -6.515 487 HB3 TYR 58 2HB TYR 58 -20.750 16.992 -5.867 488 HD1 TYR 58 HD2 TYR 58 -20.677 14.010 -8.096 489 HD2 TYR 58 HD1 TYR 58 -22.737 16.125 -5.037 490 HE1 TYR 58 HE2 TYR 58 -22.363 12.232 -8.016 491 HE2 TYR 58 HE1 TYR 58 -24.442 14.351 -4.947 492 HH TYR 58 HH TYR 58 -25.343 12.606 -6.436 493 H GLU 59 H GLU 59 -20.946 19.282 -6.935 494 HA GLU 59 HA GLU 59 -23.700 19.640 -7.136 495 HB2 GLU 59 1HB GLU 59 -22.182 21.042 -5.771 496 HB3 GLU 59 2HB GLU 59 -21.527 21.744 -7.242 497 HG2 GLU 59 1HG GLU 59 -23.059 23.291 -6.297 498 HG3 GLU 59 2HG GLU 59 -23.784 22.629 -7.759 499 H TYR 60 H TYR 60 -21.113 20.374 -9.398 500 HA TYR 60 HA TYR 60 -22.493 21.807 -11.331 501 HB2 TYR 60 1HB TYR 60 -20.121 21.684 -11.434 502 HB3 TYR 60 2HB TYR 60 -20.142 19.927 -11.505 503 HD1 TYR 60 HD1 TYR 60 -21.283 22.907 -13.438 504 HD2 TYR 60 HD2 TYR 60 -19.905 18.885 -13.561 505 HE1 TYR 60 HE1 TYR 60 -21.199 23.015 -15.890 506 HE2 TYR 60 HE2 TYR 60 -19.818 18.984 -16.016 507 HH TYR 60 HH TYR 60 -20.197 21.942 -17.753 508 H ILE 61 H ILE 61 -21.980 18.276 -11.177 509 HA ILE 61 HA ILE 61 -23.422 17.861 -13.612 510 HB ILE 61 HB ILE 61 -23.131 15.466 -13.198 511 HG12 ILE 61 1HG1 ILE 61 -21.821 16.340 -10.610 512 HG13 ILE 61 2HG1 ILE 61 -23.353 15.482 -10.743 513 HG21 ILE 61 1HG2 ILE 61 -20.654 17.118 -12.727 514 HG22 ILE 61 2HG2 ILE 61 -21.375 16.743 -14.293 515 HG23 ILE 61 3HG2 ILE 61 -20.683 15.454 -13.307 516 HD11 ILE 61 3HD1 ILE 61 -21.539 13.987 -10.126 517 HD12 ILE 61 1HD1 ILE 61 -20.666 14.425 -11.596 518 HD13 ILE 61 2HD1 ILE 61 -22.203 13.566 -11.706 519 H GLU 62 H GLU 62 -24.284 17.746 -10.216 520 HA GLU 62 HA GLU 62 -26.731 16.295 -10.643 521 HB2 GLU 62 1HB GLU 62 -25.834 17.932 -8.265 522 HB3 GLU 62 2HB GLU 62 -27.202 16.826 -8.291 523 HG2 GLU 62 1HG GLU 62 -24.393 15.960 -8.872 524 HG3 GLU 62 2HG GLU 62 -25.072 15.972 -7.248 525 H GLN 63 H GLN 63 -25.767 19.580 -10.848 526 HA GLN 63 HA GLN 63 -28.422 20.683 -10.639 527 HB2 GLN 63 1HB GLN 63 -25.807 21.818 -11.622 528 HB3 GLN 63 2HB GLN 63 -27.310 22.724 -11.678 529 HG2 GLN 63 1HG GLN 63 -27.511 22.581 -9.266 530 HG3 GLN 63 2HG GLN 63 -26.033 21.621 -9.190 531 HE21 GLN 63 2HE2 GLN 63 -24.057 22.612 -9.625 532 HE22 GLN 63 1HE2 GLN 63 -23.864 24.329 -9.562 533 H SER 64 H SER 64 -28.756 22.334 -12.725 534 HA SER 64 HA SER 64 -29.559 20.566 -14.820 535 HB2 SER 64 1HB SER 64 -30.329 22.702 -15.918 536 HB3 SER 64 2HB SER 64 -30.995 22.427 -14.309 537 HG SER 64 HG SER 64 -28.669 23.985 -14.764 538 H LYS 65 H LYS 65 -27.839 19.686 -15.873 539 HA LYS 65 HA LYS 65 -25.522 21.058 -16.696 540 HB2 LYS 65 1HB LYS 65 -26.860 18.574 -17.780 541 HB3 LYS 65 2HB LYS 65 -25.315 19.166 -18.369 542 HG2 LYS 65 1HG LYS 65 -25.836 18.430 -15.500 543 HG3 LYS 65 2HG LYS 65 -25.172 17.323 -16.701 544 HD2 LYS 65 1HD LYS 65 -23.953 19.944 -15.839 545 HD3 LYS 65 2HD LYS 65 -23.405 18.340 -15.353 546 HE2 LYS 65 1HE LYS 65 -23.442 19.425 -18.168 547 HE3 LYS 65 2HE LYS 65 -22.019 19.261 -17.145 548 HZ1 LYS 65 3HZ LYS 65 -22.342 17.454 -18.813 549 HZ2 LYS 65 1HZ LYS 65 -23.714 16.967 -17.949 550 HZ3 LYS 65 2HZ LYS 65 -22.192 16.906 -17.211 551 H ASN 66 H ASN 66 -28.710 20.892 -17.967 552 HA ASN 66 HA ASN 66 -27.877 22.281 -20.426 553 HB2 ASN 66 1HB ASN 66 -29.188 19.971 -20.356 554 HB3 ASN 66 2HB ASN 66 -30.569 21.036 -20.130 555 HD21 ASN 66 2HD2 ASN 66 -30.019 19.307 -22.350 556 HD22 ASN 66 1HD2 ASN 66 -29.909 20.319 -23.751 557 H CYS 67 H CYS 67 -30.417 23.324 -21.129 558 HA CYS 67 HA CYS 67 -31.370 24.792 -18.812 559 HB2 CYS 67 1HB CYS 67 -30.791 26.920 -19.434 560 HB3 CYS 67 2HB CYS 67 -29.392 26.045 -20.019 561 H SER 68 H SER 68 -33.313 25.953 -19.200 562 HA SER 68 HA SER 68 -35.127 24.413 -20.757 563 HB2 SER 68 1HB SER 68 -35.701 25.500 -18.597 564 HB3 SER 68 2HB SER 68 -35.587 27.073 -19.380 565 HG SER 68 HG SER 68 -37.594 26.788 -19.882 566 H TYR 69 H TYR 69 -33.279 27.222 -21.450 567 HA TYR 69 HA TYR 69 -34.908 28.381 -23.444 568 HB2 TYR 69 1HB TYR 69 -32.841 29.294 -22.142 569 HB3 TYR 69 2HB TYR 69 -31.925 28.605 -23.473 570 HD1 TYR 69 HD2 TYR 69 -34.587 31.039 -22.645 571 HD2 TYR 69 HD1 TYR 69 -31.776 29.720 -25.551 572 HE1 TYR 69 HE2 TYR 69 -35.048 33.042 -23.989 573 HE2 TYR 69 HE1 TYR 69 -32.229 31.713 -26.906 574 HH TYR 69 HH TYR 69 -34.229 33.345 -27.170 575 H CYS 70 H CYS 70 -33.050 25.544 -23.445 576 HA CYS 70 HA CYS 70 -33.278 25.449 -26.386 577 HB2 CYS 70 1HB CYS 70 -31.305 23.948 -26.436 578 HB3 CYS 70 2HB CYS 70 -30.927 25.568 -25.864 579 H SER 71 H SER 71 -33.448 23.690 -23.350 580 HA SER 71 HA SER 71 -35.289 21.826 -24.680 581 HB2 SER 71 1HB SER 71 -33.486 21.227 -22.322 582 HB3 SER 71 2HB SER 71 -34.612 20.102 -23.078 583 HG SER 71 HG SER 71 -33.347 19.958 -24.829 584 H GLU 72 H GLU 72 -37.223 22.578 -24.129 585 HA GLU 72 HA GLU 72 -37.586 24.044 -21.659 586 HB2 GLU 72 1HB GLU 72 -38.489 24.758 -23.905 587 HB3 GLU 72 2HB GLU 72 -39.639 23.439 -23.771 588 HG2 GLU 72 1HG GLU 72 -40.627 24.429 -21.818 589 HG3 GLU 72 2HG GLU 72 -39.395 25.690 -21.791 590 H ASP 73 H ASP 73 -37.034 21.799 -20.746 591 HA ASP 73 HA ASP 73 -39.352 20.108 -20.377 592 HB2 ASP 73 1HB ASP 73 -37.064 19.128 -20.482 593 HB3 ASP 73 2HB ASP 73 -36.664 19.976 -18.992 594 H GLU 74 H GLU 74 -40.564 19.975 -18.547 595 HA GLU 74 HA GLU 74 -40.616 22.404 -16.972 596 HB2 GLU 74 1HB GLU 74 -42.670 21.507 -17.990 597 HB3 GLU 74 2HB GLU 74 -42.509 20.050 -17.023 598 HG2 GLU 74 1HG GLU 74 -42.719 21.450 -14.984 599 HG3 GLU 74 2HG GLU 74 -43.032 22.837 -16.028 600 H ASN 75 H ASN 75 -39.515 19.178 -16.582 601 HA ASN 75 HA ASN 75 -39.883 19.199 -13.687 602 HB2 ASN 75 1HB ASN 75 -40.390 17.131 -14.906 603 HB3 ASN 75 2HB ASN 75 -38.738 17.072 -15.509 604 HD21 ASN 75 2HD2 ASN 75 -37.090 16.420 -14.152 605 HD22 ASN 75 1HD2 ASN 75 -37.382 15.696 -12.606 606 H CYS 76 H CYS 76 -37.343 19.425 -16.085 607 HA CYS 76 HA CYS 76 -35.133 19.047 -14.389 608 HB2 CYS 76 1HB CYS 76 -35.336 20.683 -16.924 609 HB3 CYS 76 2HB CYS 76 -33.832 20.171 -16.159 610 HG CYS 76 HG CYS 76 -36.196 18.050 -17.443 611 H ASN 77 H ASN 77 -34.434 20.210 -12.766 612 HA ASN 77 HA ASN 77 -35.426 22.850 -12.238 613 HB2 ASN 77 1HB ASN 77 -35.025 21.279 -10.408 614 HB3 ASN 77 2HB ASN 77 -33.319 21.201 -10.824 615 HD21 ASN 77 2HD2 ASN 77 -32.631 21.928 -8.846 616 HD22 ASN 77 1HD2 ASN 77 -32.849 23.556 -8.303 617 H ASN 78 H ASN 78 -34.692 24.181 -13.857 618 HA ASN 78 HA ASN 78 -31.790 24.478 -14.171 619 HB2 ASN 78 1HB ASN 78 -33.154 24.215 -16.220 620 HB3 ASN 78 2HB ASN 78 -34.035 25.675 -15.807 621 HD21 ASN 78 2HD2 ASN 78 -30.583 25.338 -15.295 622 HD22 ASN 78 1HD2 ASN 78 -30.111 26.467 -16.517 623 H LEU 79 H LEU 79 -30.816 25.976 -13.041 624 HA LEU 79 HA LEU 79 -32.297 27.849 -11.464 625 HB2 LEU 79 1HB LEU 79 -29.311 27.653 -11.888 626 HB3 LEU 79 2HB LEU 79 -30.109 28.589 -10.640 627 HG LEU 79 HG LEU 79 -30.065 25.581 -10.878 628 HD11 LEU 79 1HD1 LEU 79 -28.829 25.700 -8.776 629 HD12 LEU 79 2HD1 LEU 79 -28.862 27.462 -8.855 630 HD13 LEU 79 3HD1 LEU 79 -27.985 26.539 -10.077 631 HD21 LEU 79 3HD2 LEU 79 -32.227 26.356 -10.042 632 HD22 LEU 79 1HD2 LEU 79 -31.408 27.315 -8.808 633 HD23 LEU 79 2HD2 LEU 79 -31.293 25.555 -8.778 634 H LEU 80 H LEU 80 -29.491 28.598 -13.496 635 HA LEU 80 HA LEU 80 -30.714 31.105 -14.269 636 HB2 LEU 80 1HB LEU 80 -28.024 29.888 -14.899 637 HB3 LEU 80 2HB LEU 80 -28.574 31.399 -15.594 638 HG LEU 80 HG LEU 80 -28.821 32.239 -13.198 639 HD11 LEU 80 1HD1 LEU 80 -27.438 31.141 -11.519 640 HD12 LEU 80 2HD1 LEU 80 -27.086 29.838 -12.653 641 HD13 LEU 80 3HD1 LEU 80 -28.734 30.078 -12.071 642 HD21 LEU 80 3HD2 LEU 80 -26.080 31.563 -14.252 643 HD22 LEU 80 1HD2 LEU 80 -26.447 32.798 -13.048 644 HD23 LEU 80 2HD2 LEU 80 -27.049 32.967 -14.697 645 H GLU 81 H GLU 81 -32.377 30.722 -15.630 646 HA GLU 81 HA GLU 81 -32.259 28.698 -17.647 647 HB2 GLU 81 1HB GLU 81 -34.394 29.383 -16.633 648 HB3 GLU 81 2HB GLU 81 -34.210 30.989 -17.333 649 HG2 GLU 81 1HG GLU 81 -34.127 29.844 -19.586 650 HG3 GLU 81 2HG GLU 81 -34.663 28.385 -18.753 651 H GLY 82 H GLY 82 -31.446 28.826 -19.583 652 HA2 GLY 82 1HA GLY 82 -31.070 29.940 -21.674 653 HA3 GLY 82 2HA GLY 82 -31.013 31.465 -20.800 654 H TYR 83 H TYR 83 -29.396 29.603 -18.810 655 HA TYR 83 HA TYR 83 -26.814 29.886 -20.216 656 HB2 TYR 83 1HB TYR 83 -27.579 30.453 -17.353 657 HB3 TYR 83 2HB TYR 83 -25.909 30.126 -17.803 658 HD1 TYR 83 HD1 TYR 83 -28.745 32.314 -18.935 659 HD2 TYR 83 HD2 TYR 83 -24.568 31.945 -18.207 660 HE1 TYR 83 HE1 TYR 83 -28.432 34.676 -19.541 661 HE2 TYR 83 HE2 TYR 83 -24.249 34.302 -18.811 662 HH TYR 83 HH TYR 83 -25.347 36.024 -20.114 663 H HIS 84 H HIS 84 -25.151 28.341 -19.488 664 HA HIS 84 HA HIS 84 -26.248 25.901 -18.237 665 HB2 HIS 84 1HB HIS 84 -24.236 26.077 -20.494 666 HB3 HIS 84 2HB HIS 84 -24.507 24.619 -19.557 667 HD1 HIS 84 HD1 HIS 84 -25.374 23.219 -21.527 668 HD2 HIS 84 HD2 HIS 84 -27.515 26.719 -20.884 669 HE1 HIS 84 HE1 HIS 84 -27.362 23.159 -23.115 670 HA PRO 85 HA PRO 85 -23.000 26.411 -15.309 671 HB2 PRO 85 1HB PRO 85 -22.609 23.848 -14.511 672 HB3 PRO 85 2HB PRO 85 -24.033 24.788 -14.054 673 HG2 PRO 85 1HG PRO 85 -23.733 22.703 -16.165 674 HG3 PRO 85 2HG PRO 85 -25.086 22.996 -15.060 675 HD2 PRO 85 1HD PRO 85 -25.059 23.796 -17.676 676 HD3 PRO 85 2HD PRO 85 -25.998 24.612 -16.414 677 H LYS 86 H LYS 86 -20.803 26.411 -15.203 678 HA LYS 86 HA LYS 86 -19.371 24.978 -17.336 679 HB2 LYS 86 1HB LYS 86 -19.852 27.204 -18.088 680 HB3 LYS 86 2HB LYS 86 -19.230 27.897 -16.612 681 HG2 LYS 86 1HG LYS 86 -16.982 27.111 -17.214 682 HG3 LYS 86 2HG LYS 86 -17.637 26.474 -18.726 683 HD2 LYS 86 1HD LYS 86 -18.357 28.722 -19.367 684 HD3 LYS 86 2HD LYS 86 -17.719 29.363 -17.852 685 HE2 LYS 86 1HE LYS 86 -15.469 28.641 -18.516 686 HE3 LYS 86 2HE LYS 86 -16.119 28.038 -20.038 687 HZ1 LYS 86 3HZ LYS 86 -16.051 30.863 -19.123 688 HZ2 LYS 86 1HZ LYS 86 -16.873 30.338 -20.512 689 HZ3 LYS 86 2HZ LYS 86 -15.187 30.185 -20.412 690 H LEU 87 H LEU 87 -17.564 24.033 -16.716 691 HA LEU 87 HA LEU 87 -16.607 24.366 -14.011 692 HB2 LEU 87 1HB LEU 87 -16.581 22.335 -16.014 693 HB3 LEU 87 2HB LEU 87 -14.923 22.685 -15.569 694 HG LEU 87 HG LEU 87 -15.239 21.988 -13.353 695 HD11 LEU 87 1HD1 LEU 87 -18.205 22.129 -13.882 696 HD12 LEU 87 2HD1 LEU 87 -17.267 23.173 -12.812 697 HD13 LEU 87 3HD1 LEU 87 -17.476 21.466 -12.420 698 HD21 LEU 87 3HD2 LEU 87 -16.914 20.233 -15.140 699 HD22 LEU 87 1HD2 LEU 87 -16.261 19.754 -13.571 700 HD23 LEU 87 2HD2 LEU 87 -15.169 20.134 -14.902 701 H VAL 88 H VAL 88 -14.981 25.677 -13.451 702 HA VAL 88 HA VAL 88 -13.004 26.410 -15.508 703 HB VAL 88 HB VAL 88 -12.857 28.684 -14.577 704 HG11 VAL 88 1HG1 VAL 88 -14.852 29.570 -15.582 705 HG12 VAL 88 2HG1 VAL 88 -15.662 28.011 -15.436 706 HG13 VAL 88 3HG1 VAL 88 -14.290 28.196 -16.530 707 HG21 VAL 88 3HG2 VAL 88 -15.303 27.925 -12.984 708 HG22 VAL 88 1HG2 VAL 88 -14.590 29.534 -13.085 709 HG23 VAL 88 2HG2 VAL 88 -13.692 28.217 -12.328 710 H VAL 89 H VAL 89 -10.900 26.626 -14.809 711 HA VAL 89 HA VAL 89 -10.379 25.664 -12.103 712 HB VAL 89 HB VAL 89 -9.180 24.502 -13.864 713 HG11 VAL 89 1HG1 VAL 89 -9.094 26.249 -15.548 714 HG12 VAL 89 2HG1 VAL 89 -7.479 25.620 -15.228 715 HG13 VAL 89 3HG1 VAL 89 -7.967 27.176 -14.556 716 HG21 VAL 89 3HG2 VAL 89 -7.385 26.240 -12.176 717 HG22 VAL 89 1HG2 VAL 89 -6.872 24.783 -13.028 718 HG23 VAL 89 2HG2 VAL 89 -8.067 24.674 -11.737 719 H ASN 90 H ASN 90 -9.963 27.035 -10.542 720 HA ASN 90 HA ASN 90 -8.822 29.659 -11.231 721 HB2 ASN 90 1HB ASN 90 -10.932 28.972 -9.180 722 HB3 ASN 90 2HB ASN 90 -10.062 30.501 -9.178 723 HD21 ASN 90 2HD2 ASN 90 -12.906 29.915 -9.522 724 HD22 ASN 90 1HD2 ASN 90 -13.357 30.634 -11.031 725 H GLY 91 H GLY 91 -6.720 29.201 -10.769 726 HA2 GLY 91 1HA GLY 91 -4.879 29.100 -9.384 727 HA3 GLY 91 2HA GLY 91 -5.971 29.139 -8.008 728 H ARG 92 H ARG 92 -6.344 27.301 -6.906 729 HA ARG 92 HA ARG 92 -5.267 24.810 -8.063 730 HB2 ARG 92 1HB ARG 92 -5.320 25.743 -5.196 731 HB3 ARG 92 2HB ARG 92 -4.987 24.080 -5.651 732 HG2 ARG 92 1HG ARG 92 -3.366 26.472 -6.498 733 HG3 ARG 92 2HG ARG 92 -2.950 25.362 -5.194 734 HD2 ARG 92 1HD ARG 92 -1.807 24.230 -6.748 735 HD3 ARG 92 2HD ARG 92 -3.381 23.668 -7.311 736 HE ARG 92 HE ARG 92 -2.763 26.157 -8.497 737 HH11 ARG 92 1HH1 ARG 92 -1.863 22.768 -8.635 738 HH12 ARG 92 2HH1 ARG 92 -1.342 22.844 -10.296 739 HH21 ARG 92 1HH2 ARG 92 -2.048 26.270 -10.662 740 HH22 ARG 92 2HH2 ARG 92 -1.425 24.842 -11.445 741 H SER 93 H SER 93 -8.094 26.259 -7.612 742 HA SER 93 HA SER 93 -9.438 23.724 -6.995 743 HB2 SER 93 1HB SER 93 -11.274 25.326 -5.988 744 HB3 SER 93 2HB SER 93 -9.894 24.817 -5.016 745 HG SER 93 HG SER 93 -9.593 26.880 -4.764 746 H ILE 94 H ILE 94 -11.654 23.592 -7.807 747 HA ILE 94 HA ILE 94 -11.880 24.964 -10.405 748 HB ILE 94 HB ILE 94 -12.979 22.275 -9.552 749 HG12 ILE 94 1HG1 ILE 94 -10.749 22.866 -11.504 750 HG13 ILE 94 2HG1 ILE 94 -10.468 22.469 -9.814 751 HG21 ILE 94 1HG2 ILE 94 -14.374 23.370 -11.236 752 HG22 ILE 94 2HG2 ILE 94 -13.549 21.961 -11.903 753 HG23 ILE 94 3HG2 ILE 94 -12.961 23.584 -12.268 754 HD11 ILE 94 3HD1 ILE 94 -10.134 20.508 -11.104 755 HD12 ILE 94 1HD1 ILE 94 -11.688 20.711 -11.920 756 HD13 ILE 94 2HD1 ILE 94 -11.641 20.311 -10.204 757 H ASP 95 H ASP 95 -13.816 25.963 -10.940 758 HA ASP 95 HA ASP 95 -15.879 25.996 -8.842 759 HB2 ASP 95 1HB ASP 95 -14.223 28.105 -9.228 760 HB3 ASP 95 2HB ASP 95 -15.489 28.493 -10.384 761 H ILE 96 H ILE 96 -17.819 27.389 -9.829 762 HA ILE 96 HA ILE 96 -18.435 26.164 -12.441 763 HB ILE 96 HB ILE 96 -20.363 26.539 -10.148 764 HG12 ILE 96 1HG1 ILE 96 -19.228 23.941 -11.185 765 HG13 ILE 96 2HG1 ILE 96 -18.532 24.802 -9.819 766 HG21 ILE 96 1HG2 ILE 96 -20.658 25.095 -12.781 767 HG22 ILE 96 2HG2 ILE 96 -21.411 26.632 -12.351 768 HG23 ILE 96 3HG2 ILE 96 -21.865 25.156 -11.498 769 HD11 ILE 96 3HD1 ILE 96 -20.618 24.586 -8.603 770 HD12 ILE 96 1HD1 ILE 96 -19.992 23.014 -9.095 771 HD13 ILE 96 2HD1 ILE 96 -21.338 23.742 -9.974 772 H GLU 97 H GLU 97 -18.561 27.738 -13.859 773 HA GLU 97 HA GLU 97 -19.796 30.310 -13.172 774 HB2 GLU 97 1HB GLU 97 -18.367 29.406 -15.686 775 HB3 GLU 97 2HB GLU 97 -18.947 31.034 -15.371 776 HG2 GLU 97 1HG GLU 97 -17.101 29.896 -13.377 777 HG3 GLU 97 2HG GLU 97 -16.429 30.250 -14.966 778 H TYR 98 H TYR 98 -21.013 31.134 -15.344 779 HA TYR 98 HA TYR 98 -22.604 28.967 -16.492 780 HB2 TYR 98 1HB TYR 98 -23.601 31.152 -14.786 781 HB3 TYR 98 2HB TYR 98 -24.487 30.936 -16.292 782 HD1 TYR 98 HD1 TYR 98 -23.522 29.328 -13.118 783 HD2 TYR 98 HD2 TYR 98 -25.909 29.033 -16.639 784 HE1 TYR 98 HE1 TYR 98 -24.801 27.497 -12.092 785 HE2 TYR 98 HE2 TYR 98 -27.189 27.198 -15.613 786 HH TYR 98 HH TYR 98 -26.873 26.364 -12.276 787 H TYR 99 H TYR 99 -22.579 29.121 -18.631 788 HA TYR 99 HA TYR 99 -22.132 31.773 -19.829 789 HB2 TYR 99 1HB TYR 99 -21.360 30.531 -21.861 790 HB3 TYR 99 2HB TYR 99 -20.332 30.299 -20.452 791 HD1 TYR 99 HD1 TYR 99 -20.258 28.192 -19.319 792 HD2 TYR 99 HD2 TYR 99 -22.657 28.677 -22.781 793 HE1 TYR 99 HE1 TYR 99 -20.453 25.750 -19.498 794 HE2 TYR 99 HE2 TYR 99 -22.870 26.231 -22.991 795 HH TYR 99 HH TYR 99 -21.332 24.173 -22.182 796 H GLU 100 H GLU 100 -23.397 32.415 -21.549 797 HA GLU 100 HA GLU 100 -26.079 31.541 -21.423 798 HB2 GLU 100 1HB GLU 100 -26.221 32.989 -23.606 799 HB3 GLU 100 2HB GLU 100 -25.991 33.746 -22.037 800 HG2 GLU 100 1HG GLU 100 -23.653 33.026 -23.743 801 HG3 GLU 100 2HG GLU 100 -24.556 34.514 -24.022 802 H CYS 101 H CYS 101 -27.195 30.230 -22.571 803 HA CYS 101 HA CYS 101 -26.276 28.008 -23.808 804 HB2 CYS 101 1HB CYS 101 -28.630 28.536 -23.101 805 HB3 CYS 101 2HB CYS 101 -28.818 29.425 -24.606 806 HA PRO 102 HA PRO 102 -24.351 29.405 -27.562 807 HB2 PRO 102 1HB PRO 102 -24.282 26.904 -28.745 808 HB3 PRO 102 2HB PRO 102 -23.072 27.533 -27.625 809 HG2 PRO 102 1HG PRO 102 -25.370 25.698 -27.099 810 HG3 PRO 102 2HG PRO 102 -23.726 25.659 -26.435 811 HD2 PRO 102 1HD PRO 102 -25.790 26.589 -25.000 812 HD3 PRO 102 2HD PRO 102 -24.177 27.323 -24.887 813 H VAL 103 H VAL 103 -27.471 28.035 -27.318 814 HA VAL 103 HA VAL 103 -28.144 27.873 -30.060 815 HB VAL 103 HB VAL 103 -29.469 26.845 -28.173 816 HG11 VAL 103 1HG1 VAL 103 -30.528 29.646 -27.854 817 HG12 VAL 103 2HG1 VAL 103 -29.548 28.763 -26.682 818 HG13 VAL 103 3HG1 VAL 103 -31.172 28.200 -27.077 819 HG21 VAL 103 3HG2 VAL 103 -31.012 28.549 -30.127 820 HG22 VAL 103 1HG2 VAL 103 -31.643 27.154 -29.251 821 HG23 VAL 103 2HG2 VAL 103 -30.356 26.941 -30.440 822 H LYS 104 H LYS 104 -27.680 30.543 -27.948 823 HA LYS 104 HA LYS 104 -29.242 32.414 -29.475 824 HB2 LYS 104 1HB LYS 104 -27.204 32.723 -27.279 825 HB3 LYS 104 2HB LYS 104 -27.886 34.113 -28.112 826 HG2 LYS 104 1HG LYS 104 -29.422 32.051 -26.545 827 HG3 LYS 104 2HG LYS 104 -29.043 33.694 -26.025 828 HD2 LYS 104 1HD LYS 104 -30.698 32.980 -28.445 829 HD3 LYS 104 2HD LYS 104 -31.354 33.460 -26.881 830 HE2 LYS 104 1HE LYS 104 -29.539 35.158 -28.592 831 HE3 LYS 104 2HE LYS 104 -31.294 35.305 -28.534 832 HZ1 LYS 104 3HZ LYS 104 -31.069 35.760 -26.119 833 HZ2 LYS 104 1HZ LYS 104 -30.346 36.936 -27.103 834 HZ3 LYS 104 2HZ LYS 104 -29.383 35.796 -26.314 835 H ARG 105 H ARG 105 -26.045 31.108 -29.645 836 HA ARG 105 HA ARG 105 -25.546 32.783 -32.000 837 HB2 ARG 105 1HB ARG 105 -23.608 32.253 -29.754 838 HB3 ARG 105 2HB ARG 105 -23.053 32.661 -31.368 839 HG2 ARG 105 1HG ARG 105 -23.034 34.708 -30.352 840 HG3 ARG 105 2HG ARG 105 -24.634 34.710 -31.094 841 HD2 ARG 105 1HD ARG 105 -25.625 34.033 -28.969 842 HD3 ARG 105 2HD ARG 105 -24.026 34.010 -28.226 843 HE ARG 105 HE ARG 105 -25.326 36.444 -29.283 844 HH11 ARG 105 1HH1 ARG 105 -23.306 34.804 -26.934 845 HH12 ARG 105 2HH1 ARG 105 -22.980 36.252 -26.032 846 HH21 ARG 105 1HH2 ARG 105 -24.897 38.336 -28.086 847 HH22 ARG 105 2HH2 ARG 105 -23.870 38.261 -26.685 848 H LYS 106 H LYS 106 -26.452 30.836 -32.972 849 HA LYS 106 HA LYS 106 -26.251 28.948 -34.205 850 HB2 LYS 106 1HB LYS 106 -23.284 29.480 -33.967 851 HB3 LYS 106 2HB LYS 106 -24.051 28.417 -35.139 852 HG2 LYS 106 1HG LYS 106 -24.462 31.393 -34.944 853 HG3 LYS 106 2HG LYS 106 -23.425 30.572 -36.108 854 HD2 LYS 106 1HD LYS 106 -26.372 29.997 -35.885 855 HD3 LYS 106 2HD LYS 106 -25.737 31.282 -36.909 856 HE2 LYS 106 1HE LYS 106 -25.993 29.443 -38.341 857 HE3 LYS 106 2HE LYS 106 -24.270 29.501 -37.976 858 HZ1 LYS 106 3HZ LYS 106 -25.126 27.248 -37.873 859 HZ2 LYS 106 1HZ LYS 106 -26.256 27.702 -36.692 860 HZ3 LYS 106 2HZ LYS 106 -24.597 27.746 -36.345 Start of MODEL 10 1 HA MET 1 HA MET 1 -11.699 -16.888 -15.480 2 HB2 MET 1 1HB MET 1 -10.174 -17.618 -13.691 3 HB3 MET 1 2HB MET 1 -9.476 -16.007 -13.623 4 HG2 MET 1 1HG MET 1 -11.568 -15.084 -12.861 5 HG3 MET 1 2HG MET 1 -12.355 -16.651 -13.037 6 HE1 MET 1 2HE MET 1 -11.813 -18.753 -11.556 7 HE2 MET 1 3HE MET 1 -10.636 -18.773 -10.244 8 HE3 MET 1 1HE MET 1 -10.091 -18.644 -11.917 9 H GLU 2 H GLU 2 -13.007 -15.256 -15.908 10 HA GLU 2 HA GLU 2 -12.099 -12.795 -16.914 11 HB2 GLU 2 1HB GLU 2 -14.801 -13.753 -15.994 12 HB3 GLU 2 2HB GLU 2 -14.555 -12.113 -16.573 13 HG2 GLU 2 1HG GLU 2 -15.422 -13.633 -18.307 14 HG3 GLU 2 2HG GLU 2 -13.871 -12.912 -18.730 15 HA PRO 3 HA PRO 3 -11.228 -10.461 -13.329 16 HB2 PRO 3 1HB PRO 3 -12.102 -8.034 -14.722 17 HB3 PRO 3 2HB PRO 3 -10.483 -8.504 -14.196 18 HG2 PRO 3 1HG PRO 3 -11.191 -8.446 -16.797 19 HG3 PRO 3 2HG PRO 3 -10.025 -9.617 -16.156 20 HD2 PRO 3 1HD PRO 3 -12.917 -10.002 -16.832 21 HD3 PRO 3 2HD PRO 3 -11.538 -11.084 -17.115 22 H ILE 4 H ILE 4 -12.917 -11.180 -11.974 23 HA ILE 4 HA ILE 4 -15.050 -9.188 -11.654 24 HB ILE 4 HB ILE 4 -16.058 -11.304 -12.085 25 HG12 ILE 4 1HG1 ILE 4 -17.228 -11.770 -9.924 26 HG13 ILE 4 2HG1 ILE 4 -16.109 -10.666 -9.135 27 HG21 ILE 4 1HG2 ILE 4 -14.352 -12.476 -9.895 28 HG22 ILE 4 2HG2 ILE 4 -14.160 -12.748 -11.627 29 HG23 ILE 4 3HG2 ILE 4 -15.608 -13.321 -10.800 30 HD11 ILE 4 3HD1 ILE 4 -16.921 -8.837 -10.507 31 HD12 ILE 4 1HD1 ILE 4 -18.250 -9.604 -9.636 32 HD13 ILE 4 2HD1 ILE 4 -18.012 -9.936 -11.352 33 H GLY 5 H GLY 5 -14.580 -7.794 -10.101 34 HA2 GLY 5 1HA GLY 5 -12.674 -8.580 -8.025 35 HA3 GLY 5 2HA GLY 5 -13.148 -6.936 -8.426 36 H ARG 6 H ARG 6 -15.846 -6.997 -8.281 37 HA ARG 6 HA ARG 6 -16.202 -7.132 -5.420 38 HB2 ARG 6 1HB ARG 6 -17.833 -6.046 -7.687 39 HB3 ARG 6 2HB ARG 6 -18.579 -6.298 -6.119 40 HG2 ARG 6 1HG ARG 6 -17.871 -4.004 -6.342 41 HG3 ARG 6 2HG ARG 6 -16.919 -4.805 -5.096 42 HD2 ARG 6 1HD ARG 6 -15.060 -5.054 -6.635 43 HD3 ARG 6 2HD ARG 6 -16.018 -4.355 -7.940 44 HE ARG 6 HE ARG 6 -16.057 -2.413 -6.051 45 HH11 ARG 6 1HH1 ARG 6 -13.434 -4.230 -7.523 46 HH12 ARG 6 2HH1 ARG 6 -12.299 -2.926 -7.396 47 HH21 ARG 6 1HH2 ARG 6 -14.552 -0.699 -5.907 48 HH22 ARG 6 2HH2 ARG 6 -12.929 -0.932 -6.485 49 H SER 7 H SER 7 -16.171 -9.318 -4.974 50 HA SER 7 HA SER 7 -18.407 -10.903 -6.013 51 HB2 SER 7 1HB SER 7 -17.155 -12.840 -4.989 52 HB3 SER 7 2HB SER 7 -16.288 -12.019 -6.289 53 HG SER 7 HG SER 7 -14.795 -11.461 -4.920 54 H LEU 8 H LEU 8 -19.313 -12.475 -4.280 55 HA LEU 8 HA LEU 8 -19.968 -10.788 -1.956 56 HB2 LEU 8 1HB LEU 8 -21.547 -13.042 -3.201 57 HB3 LEU 8 2HB LEU 8 -22.052 -12.089 -1.819 58 HG LEU 8 HG LEU 8 -21.620 -11.017 -4.607 59 HD11 LEU 8 1HD1 LEU 8 -24.166 -11.558 -3.089 60 HD12 LEU 8 2HD1 LEU 8 -23.564 -12.479 -4.467 61 HD13 LEU 8 3HD1 LEU 8 -24.046 -10.797 -4.676 62 HD21 LEU 8 3HD2 LEU 8 -22.682 -9.699 -2.110 63 HD22 LEU 8 1HD2 LEU 8 -22.684 -8.983 -3.723 64 HD23 LEU 8 2HD2 LEU 8 -21.157 -9.340 -2.919 65 H GLN 9 H GLN 9 -17.893 -13.099 -2.598 66 HA GLN 9 HA GLN 9 -18.510 -14.886 -0.379 67 HB2 GLN 9 1HB GLN 9 -16.333 -14.900 -2.469 68 HB3 GLN 9 2HB GLN 9 -16.400 -16.055 -1.145 69 HG2 GLN 9 1HG GLN 9 -18.623 -16.782 -1.935 70 HG3 GLN 9 2HG GLN 9 -18.469 -15.676 -3.300 71 HE21 GLN 9 2HE2 GLN 9 -17.285 -18.599 -1.824 72 HE22 GLN 9 1HE2 GLN 9 -16.482 -19.216 -3.231 73 H GLY 10 H GLY 10 -17.702 -12.003 -0.060 74 HA2 GLY 10 1HA GLY 10 -15.548 -12.538 1.876 75 HA3 GLY 10 2HA GLY 10 -15.457 -11.141 0.812 76 H VAL 11 H VAL 11 -17.342 -12.641 3.390 77 HA VAL 11 HA VAL 11 -19.117 -10.501 3.831 78 HB VAL 11 HB VAL 11 -18.132 -12.542 5.834 79 HG11 VAL 11 1HG1 VAL 11 -19.168 -10.611 6.909 80 HG12 VAL 11 2HG1 VAL 11 -20.195 -12.038 7.053 81 HG13 VAL 11 3HG1 VAL 11 -20.588 -10.785 5.876 82 HG21 VAL 11 3HG2 VAL 11 -19.123 -13.623 3.901 83 HG22 VAL 11 1HG2 VAL 11 -20.537 -12.577 4.012 84 HG23 VAL 11 2HG2 VAL 11 -20.211 -13.754 5.284 85 H THR 12 H THR 12 -18.522 -8.518 4.291 86 HA THR 12 HA THR 12 -16.558 -8.059 6.410 87 HB THR 12 HB THR 12 -15.672 -6.125 4.925 88 HG1 THR 12 HG1 THR 12 -16.728 -7.878 2.927 89 HG21 THR 12 3HG2 THR 12 -14.322 -8.061 5.580 90 HG22 THR 12 1HG2 THR 12 -13.978 -7.582 3.918 91 HG23 THR 12 2HG2 THR 12 -14.992 -8.989 4.239 92 H GLY 13 H GLY 13 -16.482 -5.594 6.869 93 HA2 GLY 13 1HA GLY 13 -19.160 -4.651 7.313 94 HA3 GLY 13 2HA GLY 13 -17.674 -3.810 7.732 95 H ARG 14 H ARG 14 -19.497 -2.176 6.851 96 HA ARG 14 HA ARG 14 -18.651 -1.516 4.129 97 HB2 ARG 14 1HB ARG 14 -21.498 -1.940 5.008 98 HB3 ARG 14 2HB ARG 14 -21.125 -0.792 3.737 99 HG2 ARG 14 1HG ARG 14 -21.711 -2.723 2.602 100 HG3 ARG 14 2HG ARG 14 -19.949 -2.739 2.572 101 HD2 ARG 14 1HD ARG 14 -21.041 -4.942 3.090 102 HD3 ARG 14 2HD ARG 14 -19.852 -4.394 4.270 103 HE ARG 14 HE ARG 14 -21.591 -3.947 5.791 104 HH11 ARG 14 1HH1 ARG 14 -22.797 -5.286 2.788 105 HH12 ARG 14 2HH1 ARG 14 -24.287 -5.838 3.487 106 HH21 ARG 14 1HH2 ARG 14 -23.556 -4.640 6.708 107 HH22 ARG 14 2HH2 ARG 14 -24.728 -5.457 5.716 108 HA PRO 15 HA PRO 15 -18.505 2.238 6.820 109 HB2 PRO 15 1HB PRO 15 -16.354 3.229 5.413 110 HB3 PRO 15 2HB PRO 15 -16.220 2.245 6.873 111 HG2 PRO 15 1HG PRO 15 -15.977 1.427 4.010 112 HG3 PRO 15 2HG PRO 15 -15.017 0.913 5.409 113 HD2 PRO 15 1HD PRO 15 -16.954 -0.645 4.388 114 HD3 PRO 15 2HD PRO 15 -16.630 -0.579 6.131 115 H ASP 16 H ASP 16 -19.846 3.808 6.263 116 HA ASP 16 HA ASP 16 -20.978 4.036 3.703 117 HB2 ASP 16 1HB ASP 16 -21.003 5.998 6.005 118 HB3 ASP 16 2HB ASP 16 -21.995 6.154 4.561 119 H PHE 17 H PHE 17 -18.233 5.612 5.160 120 HA PHE 17 HA PHE 17 -18.005 7.860 3.537 121 HB2 PHE 17 1HB PHE 17 -16.626 7.514 5.527 122 HB3 PHE 17 2HB PHE 17 -15.791 6.183 4.735 123 HD1 PHE 17 HD1 PHE 17 -16.315 9.833 4.697 124 HD2 PHE 17 HD2 PHE 17 -13.998 6.575 3.234 125 HE1 PHE 17 HE1 PHE 17 -14.658 11.417 3.796 126 HE2 PHE 17 HE2 PHE 17 -12.339 8.150 2.334 127 HZ PHE 17 HZ PHE 17 -12.670 10.575 2.614 128 H GLN 18 H GLN 18 -16.573 4.622 3.031 129 HA GLN 18 HA GLN 18 -15.417 5.390 0.545 130 HB2 GLN 18 1HB GLN 18 -14.696 3.143 0.310 131 HB3 GLN 18 2HB GLN 18 -14.571 3.525 2.012 132 HG2 GLN 18 1HG GLN 18 -15.469 1.432 2.111 133 HG3 GLN 18 2HG GLN 18 -16.924 2.420 2.161 134 HE21 GLN 18 2HE2 GLN 18 -15.060 1.842 -0.779 135 HE22 GLN 18 1HE2 GLN 18 -16.268 0.897 -1.565 136 H LYS 19 H LYS 19 -18.477 4.018 1.505 137 HA LYS 19 HA LYS 19 -19.299 3.140 -1.050 138 HB2 LYS 19 1HB LYS 19 -20.842 3.900 1.420 139 HB3 LYS 19 2HB LYS 19 -21.638 3.351 -0.051 140 HG2 LYS 19 1HG LYS 19 -20.016 1.331 0.159 141 HG3 LYS 19 2HG LYS 19 -19.899 1.844 1.843 142 HD2 LYS 19 1HD LYS 19 -21.627 0.165 1.615 143 HD3 LYS 19 2HD LYS 19 -22.359 1.720 2.016 144 HE2 LYS 19 1HE LYS 19 -23.636 0.589 0.276 145 HE3 LYS 19 2HE LYS 19 -22.908 2.070 -0.344 146 HZ1 LYS 19 3HZ LYS 19 -21.963 -0.711 -0.802 147 HZ2 LYS 19 1HZ LYS 19 -21.104 0.671 -1.281 148 HZ3 LYS 19 2HZ LYS 19 -22.625 0.344 -1.951 149 H ARG 20 H ARG 20 -19.958 6.162 0.730 150 HA ARG 20 HA ARG 20 -21.363 7.355 -1.428 151 HB2 ARG 20 1HB ARG 20 -21.128 9.466 -0.221 152 HB3 ARG 20 2HB ARG 20 -21.659 8.179 0.848 153 HG2 ARG 20 1HG ARG 20 -19.470 7.990 1.803 154 HG3 ARG 20 2HG ARG 20 -18.814 9.136 0.630 155 HD2 ARG 20 1HD ARG 20 -20.961 9.767 2.644 156 HD3 ARG 20 2HD ARG 20 -19.250 10.138 2.856 157 HE ARG 20 HE ARG 20 -20.646 11.205 0.517 158 HH11 ARG 20 1HH1 ARG 20 -19.134 11.774 3.628 159 HH12 ARG 20 2HH1 ARG 20 -19.020 13.492 3.387 160 HH21 ARG 20 1HH2 ARG 20 -20.499 13.457 0.209 161 HH22 ARG 20 2HH2 ARG 20 -19.780 14.452 1.438 162 H LEU 21 H LEU 21 -17.998 7.148 -0.540 163 HA LEU 21 HA LEU 21 -16.978 9.198 -2.165 164 HB2 LEU 21 1HB LEU 21 -15.582 8.271 -0.483 165 HB3 LEU 21 2HB LEU 21 -15.783 6.646 -1.109 166 HG LEU 21 HG LEU 21 -14.518 7.315 -3.135 167 HD11 LEU 21 1HD1 LEU 21 -14.041 9.856 -1.581 168 HD12 LEU 21 2HD1 LEU 21 -14.929 9.704 -3.096 169 HD13 LEU 21 3HD1 LEU 21 -13.195 9.385 -3.055 170 HD21 LEU 21 3HD2 LEU 21 -13.426 6.164 -1.284 171 HD22 LEU 21 1HD2 LEU 21 -13.088 7.712 -0.510 172 HD23 LEU 21 2HD2 LEU 21 -12.329 7.314 -2.051 173 H GLU 22 H GLU 22 -17.246 5.688 -2.810 174 HA GLU 22 HA GLU 22 -16.393 5.773 -5.473 175 HB2 GLU 22 1HB GLU 22 -18.418 3.917 -4.204 176 HB3 GLU 22 2HB GLU 22 -17.698 3.674 -5.786 177 HG2 GLU 22 1HG GLU 22 -15.472 3.553 -4.676 178 HG3 GLU 22 2HG GLU 22 -16.304 3.618 -3.121 179 H GLN 23 H GLN 23 -19.595 6.141 -4.070 180 HA GLN 23 HA GLN 23 -21.095 6.129 -6.421 181 HB2 GLN 23 1HB GLN 23 -21.960 5.947 -4.083 182 HB3 GLN 23 2HB GLN 23 -21.703 7.671 -3.900 183 HG2 GLN 23 1HG GLN 23 -23.306 8.139 -5.639 184 HG3 GLN 23 2HG GLN 23 -23.518 6.417 -5.947 185 HE21 GLN 23 2HE2 GLN 23 -23.423 5.724 -3.115 186 HE22 GLN 23 1HE2 GLN 23 -24.940 6.216 -2.443 187 H MET 24 H MET 24 -20.033 8.952 -4.517 188 HA MET 24 HA MET 24 -20.957 10.811 -6.435 189 HB2 MET 24 1HB MET 24 -19.735 12.496 -5.170 190 HB3 MET 24 2HB MET 24 -20.671 11.457 -4.112 191 HG2 MET 24 1HG MET 24 -18.572 10.197 -3.635 192 HG3 MET 24 2HG MET 24 -17.700 11.413 -4.569 193 HE1 MET 24 3HE MET 24 -19.322 14.066 -3.806 194 HE2 MET 24 1HE MET 24 -17.558 13.994 -3.869 195 HE3 MET 24 2HE MET 24 -18.367 14.656 -2.448 196 H LYS 25 H LYS 25 -17.809 9.320 -5.893 197 HA LYS 25 HA LYS 25 -16.359 10.933 -7.693 198 HB2 LYS 25 1HB LYS 25 -15.509 9.222 -5.920 199 HB3 LYS 25 2HB LYS 25 -15.683 8.045 -7.215 200 HG2 LYS 25 1HG LYS 25 -13.401 8.869 -7.068 201 HG3 LYS 25 2HG LYS 25 -14.145 9.330 -8.604 202 HD2 LYS 25 1HD LYS 25 -14.648 11.548 -7.668 203 HD3 LYS 25 2HD LYS 25 -13.852 11.083 -6.165 204 HE2 LYS 25 1HE LYS 25 -12.508 11.157 -8.861 205 HE3 LYS 25 2HE LYS 25 -12.443 12.456 -7.671 206 HZ1 LYS 25 3HZ LYS 25 -10.500 10.962 -7.627 207 HZ2 LYS 25 1HZ LYS 25 -11.499 9.679 -7.152 208 HZ3 LYS 25 2HZ LYS 25 -11.304 11.039 -6.148 209 H GLU 26 H GLU 26 -18.087 7.879 -8.082 210 HA GLU 26 HA GLU 26 -17.478 7.416 -10.778 211 HB2 GLU 26 1HB GLU 26 -18.428 5.639 -9.534 212 HB3 GLU 26 2HB GLU 26 -19.796 6.620 -9.027 213 HG2 GLU 26 1HG GLU 26 -20.790 6.516 -11.156 214 HG3 GLU 26 2HG GLU 26 -19.316 5.892 -11.894 215 H LYS 27 H LYS 27 -20.273 9.031 -9.294 216 HA LYS 27 HA LYS 27 -21.647 9.698 -11.604 217 HB2 LYS 27 1HB LYS 27 -21.479 11.015 -8.909 218 HB3 LYS 27 2HB LYS 27 -22.481 11.690 -10.186 219 HG2 LYS 27 1HG LYS 27 -23.747 9.621 -10.316 220 HG3 LYS 27 2HG LYS 27 -22.707 8.890 -9.095 221 HD2 LYS 27 1HD LYS 27 -24.814 9.639 -8.125 222 HD3 LYS 27 2HD LYS 27 -23.453 10.542 -7.461 223 HE2 LYS 27 1HE LYS 27 -23.941 12.397 -8.972 224 HE3 LYS 27 2HE LYS 27 -25.290 11.490 -9.655 225 HZ1 LYS 27 3HZ LYS 27 -25.154 12.067 -6.767 226 HZ2 LYS 27 1HZ LYS 27 -26.512 11.689 -7.707 227 HZ3 LYS 27 2HZ LYS 27 -25.775 13.212 -7.851 228 H VAL 28 H VAL 28 -19.041 11.472 -9.995 229 HA VAL 28 HA VAL 28 -19.108 13.687 -11.762 230 HB VAL 28 HB VAL 28 -16.849 12.679 -10.021 231 HG11 VAL 28 1HG1 VAL 28 -15.999 14.100 -11.797 232 HG12 VAL 28 2HG1 VAL 28 -15.927 14.940 -10.246 233 HG13 VAL 28 3HG1 VAL 28 -17.199 15.332 -11.403 234 HG21 VAL 28 3HG2 VAL 28 -18.855 14.881 -9.542 235 HG22 VAL 28 1HG2 VAL 28 -17.548 14.406 -8.455 236 HG23 VAL 28 2HG2 VAL 28 -18.883 13.291 -8.780 237 H MET 29 H MET 29 -17.257 10.660 -11.724 238 HA MET 29 HA MET 29 -15.616 11.462 -13.949 239 HB2 MET 29 1HB MET 29 -15.868 8.940 -12.348 240 HB3 MET 29 2HB MET 29 -14.955 8.953 -13.850 241 HG2 MET 29 1HG MET 29 -13.577 10.802 -12.911 242 HG3 MET 29 2HG MET 29 -14.422 10.580 -11.378 243 HE1 MET 29 3HE MET 29 -11.159 10.350 -11.940 244 HE2 MET 29 1HE MET 29 -10.813 9.042 -10.810 245 HE3 MET 29 2HE MET 29 -11.925 10.330 -10.353 246 H LYS 30 H LYS 30 -18.764 10.337 -13.795 247 HA LYS 30 HA LYS 30 -18.515 8.934 -16.363 248 HB2 LYS 30 1HB LYS 30 -20.449 8.777 -14.126 249 HB3 LYS 30 2HB LYS 30 -21.099 8.548 -15.741 250 HG2 LYS 30 1HG LYS 30 -20.563 6.415 -14.779 251 HG3 LYS 30 2HG LYS 30 -19.462 6.742 -16.118 252 HD2 LYS 30 1HD LYS 30 -17.749 7.462 -14.496 253 HD3 LYS 30 2HD LYS 30 -18.858 7.074 -13.179 254 HE2 LYS 30 1HE LYS 30 -17.734 5.143 -15.204 255 HE3 LYS 30 2HE LYS 30 -17.259 5.282 -13.513 256 HZ1 LYS 30 3HZ LYS 30 -20.059 4.695 -14.249 257 HZ2 LYS 30 1HZ LYS 30 -19.257 4.377 -12.792 258 HZ3 LYS 30 2HZ LYS 30 -18.909 3.453 -14.170 259 H ASP 31 H ASP 31 -19.170 12.002 -15.295 260 HA ASP 31 HA ASP 31 -21.316 12.556 -17.150 261 HB2 ASP 31 1HB ASP 31 -21.214 13.805 -15.040 262 HB3 ASP 31 2HB ASP 31 -19.653 14.473 -15.509 263 H GLN 32 H GLN 32 -21.165 13.448 -19.117 264 HA GLN 32 HA GLN 32 -18.739 13.118 -20.531 265 HB2 GLN 32 1HB GLN 32 -19.990 14.045 -22.451 266 HB3 GLN 32 2HB GLN 32 -20.890 12.787 -21.612 267 HG2 GLN 32 1HG GLN 32 -22.187 14.514 -20.449 268 HG3 GLN 32 2HG GLN 32 -21.303 15.754 -21.330 269 HE21 GLN 32 2HE2 GLN 32 -24.134 15.223 -21.257 270 HE22 GLN 32 1HE2 GLN 32 -24.625 14.922 -22.892 271 H ASP 33 H ASP 33 -20.401 15.980 -19.289 272 HA ASP 33 HA ASP 33 -18.731 17.811 -20.724 273 HB2 ASP 33 1HB ASP 33 -20.677 18.245 -18.447 274 HB3 ASP 33 2HB ASP 33 -19.848 19.541 -19.305 275 H VAL 34 H VAL 34 -18.854 16.525 -17.455 276 HA VAL 34 HA VAL 34 -16.780 17.960 -16.282 277 HB VAL 34 HB VAL 34 -17.645 15.091 -15.934 278 HG11 VAL 34 1HG1 VAL 34 -16.313 15.036 -13.867 279 HG12 VAL 34 2HG1 VAL 34 -15.613 16.601 -14.290 280 HG13 VAL 34 3HG1 VAL 34 -15.296 15.191 -15.302 281 HG21 VAL 34 3HG2 VAL 34 -18.562 15.951 -13.825 282 HG22 VAL 34 1HG2 VAL 34 -19.234 16.786 -15.226 283 HG23 VAL 34 2HG2 VAL 34 -17.992 17.565 -14.244 284 H GLN 35 H GLN 35 -16.580 15.010 -18.275 285 HA GLN 35 HA GLN 35 -13.765 14.741 -18.130 286 HB2 GLN 35 1HB GLN 35 -15.475 13.828 -20.440 287 HB3 GLN 35 2HB GLN 35 -13.965 13.127 -19.867 288 HG2 GLN 35 1HG GLN 35 -15.210 12.693 -17.696 289 HG3 GLN 35 2HG GLN 35 -16.670 13.022 -18.612 290 HE21 GLN 35 2HE2 GLN 35 -15.838 10.597 -17.310 291 HE22 GLN 35 1HE2 GLN 35 -15.790 9.370 -18.531 292 H ALA 36 H ALA 36 -15.871 16.551 -20.220 293 HA ALA 36 HA ALA 36 -14.003 17.296 -22.196 294 HB1 ALA 36 1HB ALA 36 -16.411 17.634 -22.461 295 HB2 ALA 36 2HB ALA 36 -15.526 19.139 -22.703 296 HB3 ALA 36 3HB ALA 36 -16.384 18.855 -21.189 297 H PHE 37 H PHE 37 -14.954 18.884 -19.172 298 HA PHE 37 HA PHE 37 -13.115 21.019 -19.366 299 HB2 PHE 37 1HB PHE 37 -14.977 21.169 -17.834 300 HB3 PHE 37 2HB PHE 37 -14.426 19.742 -16.958 301 HD1 PHE 37 HD2 PHE 37 -13.191 23.110 -17.969 302 HD2 PHE 37 HD1 PHE 37 -13.244 20.048 -15.020 303 HE1 PHE 37 HE2 PHE 37 -11.876 24.546 -16.474 304 HE2 PHE 37 HE1 PHE 37 -11.922 21.480 -13.511 305 HZ PHE 37 HZ PHE 37 -11.236 23.734 -14.240 306 H LEU 38 H LEU 38 -12.943 17.821 -17.866 307 HA LEU 38 HA LEU 38 -10.479 18.054 -16.599 308 HB2 LEU 38 1HB LEU 38 -12.205 15.861 -17.466 309 HB3 LEU 38 2HB LEU 38 -10.505 15.436 -17.422 310 HG LEU 38 HG LEU 38 -11.497 14.829 -15.332 311 HD11 LEU 38 1HD1 LEU 38 -10.141 16.133 -13.767 312 HD12 LEU 38 2HD1 LEU 38 -9.859 17.337 -15.025 313 HD13 LEU 38 3HD1 LEU 38 -9.237 15.698 -15.217 314 HD21 LEU 38 3HD2 LEU 38 -12.556 16.486 -13.857 315 HD22 LEU 38 1HD2 LEU 38 -13.444 16.275 -15.367 316 HD23 LEU 38 2HD2 LEU 38 -12.418 17.692 -15.136 317 H LYS 39 H LYS 39 -11.180 17.072 -19.942 318 HA LYS 39 HA LYS 39 -8.430 16.511 -20.487 319 HB2 LYS 39 1HB LYS 39 -9.066 16.124 -22.762 320 HB3 LYS 39 2HB LYS 39 -10.311 15.436 -21.733 321 HG2 LYS 39 1HG LYS 39 -11.854 17.092 -22.283 322 HG3 LYS 39 2HG LYS 39 -10.605 18.181 -22.891 323 HD2 LYS 39 1HD LYS 39 -11.720 17.316 -24.791 324 HD3 LYS 39 2HD LYS 39 -10.168 16.484 -24.703 325 HE2 LYS 39 1HE LYS 39 -11.748 14.814 -25.210 326 HE3 LYS 39 2HE LYS 39 -11.394 14.624 -23.494 327 HZ1 LYS 39 3HZ LYS 39 -13.707 16.209 -24.451 328 HZ2 LYS 39 1HZ LYS 39 -13.437 15.572 -22.906 329 HZ3 LYS 39 2HZ LYS 39 -13.817 14.537 -24.196 330 H GLU 40 H GLU 40 -10.449 19.341 -20.712 331 HA GLU 40 HA GLU 40 -8.784 20.866 -22.421 332 HB2 GLU 40 1HB GLU 40 -11.125 21.483 -21.839 333 HB3 GLU 40 2HB GLU 40 -10.596 21.864 -20.215 334 HG2 GLU 40 1HG GLU 40 -9.176 23.626 -21.036 335 HG3 GLU 40 2HG GLU 40 -9.576 23.215 -22.701 336 H ASN 41 H ASN 41 -9.110 20.817 -18.900 337 HA ASN 41 HA ASN 41 -6.623 22.371 -18.678 338 HB2 ASN 41 1HB ASN 41 -8.931 21.945 -16.783 339 HB3 ASN 41 2HB ASN 41 -7.429 22.724 -16.291 340 HD21 ASN 41 2HD2 ASN 41 -10.281 22.975 -18.269 341 HD22 ASN 41 1HD2 ASN 41 -10.140 24.661 -18.618 342 H GLU 42 H GLU 42 -6.639 19.514 -19.210 343 HA GLU 42 HA GLU 42 -6.195 17.954 -16.932 344 HB2 GLU 42 1HB GLU 42 -5.036 16.389 -18.480 345 HB3 GLU 42 2HB GLU 42 -6.607 16.918 -19.065 346 HG2 GLU 42 1HG GLU 42 -5.524 18.512 -20.553 347 HG3 GLU 42 2HG GLU 42 -3.944 18.002 -19.960 348 H GLU 43 H GLU 43 -4.079 20.177 -18.571 349 HA GLU 43 HA GLU 43 -1.708 19.155 -17.268 350 HB2 GLU 43 1HB GLU 43 -1.660 20.093 -19.577 351 HB3 GLU 43 2HB GLU 43 -2.041 21.671 -18.905 352 HG2 GLU 43 1HG GLU 43 0.323 21.494 -19.367 353 HG3 GLU 43 2HG GLU 43 0.047 21.631 -17.631 354 H VAL 44 H VAL 44 -4.150 21.474 -16.614 355 HA VAL 44 HA VAL 44 -2.416 23.101 -14.914 356 HB VAL 44 HB VAL 44 -5.342 23.524 -15.540 357 HG11 VAL 44 1HG1 VAL 44 -3.226 25.387 -14.469 358 HG12 VAL 44 2HG1 VAL 44 -4.592 24.724 -13.571 359 HG13 VAL 44 3HG1 VAL 44 -4.872 25.853 -14.897 360 HG21 VAL 44 3HG2 VAL 44 -4.644 25.094 -17.254 361 HG22 VAL 44 1HG2 VAL 44 -4.001 23.488 -17.602 362 HG23 VAL 44 2HG2 VAL 44 -2.949 24.733 -16.925 363 H ILE 45 H ILE 45 -5.127 20.901 -14.737 364 HA ILE 45 HA ILE 45 -5.504 21.370 -11.895 365 HB ILE 45 HB ILE 45 -6.861 19.341 -13.678 366 HG12 ILE 45 1HG1 ILE 45 -7.812 22.099 -12.881 367 HG13 ILE 45 2HG1 ILE 45 -7.180 21.674 -14.467 368 HG21 ILE 45 1HG2 ILE 45 -7.054 18.834 -11.306 369 HG22 ILE 45 2HG2 ILE 45 -8.609 19.360 -11.951 370 HG23 ILE 45 3HG2 ILE 45 -7.633 20.468 -10.987 371 HD11 ILE 45 3HD1 ILE 45 -9.017 20.121 -14.802 372 HD12 ILE 45 1HD1 ILE 45 -9.609 21.746 -14.457 373 HD13 ILE 45 2HD1 ILE 45 -9.644 20.510 -13.200 374 H ASP 46 H ASP 46 -5.200 19.780 -10.301 375 HA ASP 46 HA ASP 46 -3.591 17.450 -11.124 376 HB2 ASP 46 1HB ASP 46 -2.304 19.078 -9.743 377 HB3 ASP 46 2HB ASP 46 -3.492 18.880 -8.465 378 H GLN 47 H GLN 47 -3.826 15.603 -9.639 379 HA GLN 47 HA GLN 47 -6.490 14.805 -9.416 380 HB2 GLN 47 1HB GLN 47 -3.948 13.765 -8.208 381 HB3 GLN 47 2HB GLN 47 -5.492 12.927 -8.052 382 HG2 GLN 47 1HG GLN 47 -4.065 13.571 -10.626 383 HG3 GLN 47 2HG GLN 47 -4.150 11.989 -9.853 384 HE21 GLN 47 2HE2 GLN 47 -5.871 14.383 -11.688 385 HE22 GLN 47 1HE2 GLN 47 -7.223 13.390 -12.094 386 H LYS 48 H LYS 48 -4.252 16.114 -6.979 387 HA LYS 48 HA LYS 48 -5.956 15.691 -4.764 388 HB2 LYS 48 1HB LYS 48 -3.763 17.708 -5.224 389 HB3 LYS 48 2HB LYS 48 -4.622 17.562 -3.702 390 HG2 LYS 48 1HG LYS 48 -3.896 15.091 -3.781 391 HG3 LYS 48 2HG LYS 48 -2.740 15.637 -4.997 392 HD2 LYS 48 1HD LYS 48 -2.991 16.691 -2.181 393 HD3 LYS 48 2HD LYS 48 -1.727 15.617 -2.778 394 HE2 LYS 48 1HE LYS 48 -0.974 17.353 -4.321 395 HE3 LYS 48 2HE LYS 48 -2.249 18.428 -3.747 396 HZ1 LYS 48 3HZ LYS 48 -0.070 17.325 -2.058 397 HZ2 LYS 48 1HZ LYS 48 -1.251 18.438 -1.569 398 HZ3 LYS 48 2HZ LYS 48 -0.085 18.886 -2.716 399 H MET 49 H MET 49 -5.640 18.325 -7.058 400 HA MET 49 HA MET 49 -7.456 20.097 -5.791 401 HB2 MET 49 1HB MET 49 -5.777 20.182 -8.028 402 HB3 MET 49 2HB MET 49 -7.398 20.383 -8.679 403 HG2 MET 49 1HG MET 49 -7.793 22.303 -7.368 404 HG3 MET 49 2HG MET 49 -6.365 22.006 -6.377 405 HE1 MET 49 3HE MET 49 -6.348 23.591 -10.706 406 HE2 MET 49 1HE MET 49 -7.785 23.402 -9.702 407 HE3 MET 49 2HE MET 49 -6.939 21.977 -10.309 408 H ILE 50 H ILE 50 -7.807 17.457 -8.052 409 HA ILE 50 HA ILE 50 -10.520 17.804 -8.723 410 HB ILE 50 HB ILE 50 -8.849 15.286 -8.547 411 HG12 ILE 50 1HG1 ILE 50 -8.134 16.956 -10.226 412 HG13 ILE 50 2HG1 ILE 50 -8.709 15.466 -10.971 413 HG21 ILE 50 1HG2 ILE 50 -10.584 14.196 -9.890 414 HG22 ILE 50 2HG2 ILE 50 -11.587 15.639 -9.759 415 HG23 ILE 50 3HG2 ILE 50 -11.201 14.702 -8.316 416 HD11 ILE 50 3HD1 ILE 50 -10.247 18.047 -10.723 417 HD12 ILE 50 1HD1 ILE 50 -10.859 16.556 -11.442 418 HD13 ILE 50 2HD1 ILE 50 -9.503 17.403 -12.186 419 H GLU 51 H GLU 51 -8.937 15.967 -6.130 420 HA GLU 51 HA GLU 51 -11.326 14.966 -4.995 421 HB2 GLU 51 1HB GLU 51 -8.694 15.432 -3.579 422 HB3 GLU 51 2HB GLU 51 -9.970 14.325 -3.093 423 HG2 GLU 51 1HG GLU 51 -8.188 14.105 -5.503 424 HG3 GLU 51 2HG GLU 51 -8.196 13.069 -4.079 425 H LYS 52 H LYS 52 -9.376 17.834 -4.357 426 HA LYS 52 HA LYS 52 -10.771 18.681 -2.048 427 HB2 LYS 52 1HB LYS 52 -8.529 19.496 -2.611 428 HB3 LYS 52 2HB LYS 52 -9.167 20.297 -4.038 429 HG2 LYS 52 1HG LYS 52 -8.809 21.907 -2.289 430 HG3 LYS 52 2HG LYS 52 -10.538 21.735 -2.591 431 HD2 LYS 52 1HD LYS 52 -10.751 20.287 -0.646 432 HD3 LYS 52 2HD LYS 52 -9.015 20.395 -0.357 433 HE2 LYS 52 1HE LYS 52 -10.139 21.903 1.134 434 HE3 LYS 52 2HE LYS 52 -9.263 22.841 -0.073 435 HZ1 LYS 52 3HZ LYS 52 -12.184 22.313 0.019 436 HZ2 LYS 52 1HZ LYS 52 -11.402 23.033 -1.302 437 HZ3 LYS 52 2HZ LYS 52 -11.400 23.805 0.204 438 H SER 53 H SER 53 -11.139 19.458 -5.487 439 HA SER 53 HA SER 53 -13.466 21.111 -4.833 440 HB2 SER 53 1HB SER 53 -11.960 20.797 -7.442 441 HB3 SER 53 2HB SER 53 -13.302 21.909 -7.161 442 HG SER 53 HG SER 53 -11.560 22.332 -5.235 443 H LEU 54 H LEU 54 -13.242 18.056 -4.939 444 HA LEU 54 HA LEU 54 -14.827 17.107 -7.050 445 HB2 LEU 54 1HB LEU 54 -13.459 15.692 -5.522 446 HB3 LEU 54 2HB LEU 54 -14.614 16.010 -4.243 447 HG LEU 54 HG LEU 54 -16.370 14.898 -5.598 448 HD11 LEU 54 1HD1 LEU 54 -15.734 13.565 -7.524 449 HD12 LEU 54 2HD1 LEU 54 -14.084 14.181 -7.420 450 HD13 LEU 54 3HD1 LEU 54 -15.413 15.276 -7.804 451 HD21 LEU 54 3HD2 LEU 54 -15.539 12.617 -5.264 452 HD22 LEU 54 1HD2 LEU 54 -15.196 13.658 -3.882 453 HD23 LEU 54 2HD2 LEU 54 -13.913 13.256 -5.023 454 H ASN 55 H ASN 55 -15.550 18.611 -4.003 455 HA ASN 55 HA ASN 55 -18.322 18.173 -3.903 456 HB2 ASN 55 1HB ASN 55 -18.403 20.123 -2.415 457 HB3 ASN 55 2HB ASN 55 -17.041 19.089 -2.001 458 HD21 ASN 55 2HD2 ASN 55 -17.518 21.939 -1.479 459 HD22 ASN 55 1HD2 ASN 55 -16.150 22.770 -2.152 460 H LYS 56 H LYS 56 -16.350 20.555 -5.565 461 HA LYS 56 HA LYS 56 -18.555 22.088 -6.536 462 HB2 LYS 56 1HB LYS 56 -15.615 22.027 -7.169 463 HB3 LYS 56 2HB LYS 56 -16.732 23.055 -8.061 464 HG2 LYS 56 1HG LYS 56 -16.583 23.129 -5.069 465 HG3 LYS 56 2HG LYS 56 -15.492 24.082 -6.082 466 HD2 LYS 56 1HD LYS 56 -17.177 25.431 -6.876 467 HD3 LYS 56 2HD LYS 56 -18.416 24.201 -6.637 468 HE2 LYS 56 1HE LYS 56 -17.053 25.378 -4.261 469 HE3 LYS 56 2HE LYS 56 -18.298 26.313 -5.087 470 HZ1 LYS 56 3HZ LYS 56 -19.836 24.460 -4.781 471 HZ2 LYS 56 1HZ LYS 56 -19.248 25.020 -3.290 472 HZ3 LYS 56 2HZ LYS 56 -18.639 23.587 -3.953 473 H LEU 57 H LEU 57 -16.471 19.570 -7.920 474 HA LEU 57 HA LEU 57 -17.626 19.565 -10.485 475 HB2 LEU 57 1HB LEU 57 -16.115 17.561 -8.867 476 HB3 LEU 57 2HB LEU 57 -16.934 17.010 -10.314 477 HG LEU 57 HG LEU 57 -14.624 17.463 -10.820 478 HD11 LEU 57 1HD1 LEU 57 -16.244 17.948 -12.560 479 HD12 LEU 57 2HD1 LEU 57 -14.880 19.062 -12.645 480 HD13 LEU 57 3HD1 LEU 57 -16.414 19.599 -11.961 481 HD21 LEU 57 3HD2 LEU 57 -13.676 19.725 -10.638 482 HD22 LEU 57 1HD2 LEU 57 -14.097 19.048 -9.063 483 HD23 LEU 57 2HD2 LEU 57 -15.140 20.256 -9.812 484 H TYR 58 H TYR 58 -18.480 17.898 -7.515 485 HA TYR 58 HA TYR 58 -20.621 16.373 -8.586 486 HB2 TYR 58 1HB TYR 58 -19.303 16.053 -6.388 487 HB3 TYR 58 2HB TYR 58 -20.392 17.261 -5.717 488 HD1 TYR 58 HD1 TYR 58 -20.717 14.220 -7.846 489 HD2 TYR 58 HD2 TYR 58 -22.101 16.385 -4.460 490 HE1 TYR 58 HE1 TYR 58 -22.343 12.442 -7.392 491 HE2 TYR 58 HE2 TYR 58 -23.742 14.616 -3.986 492 HH TYR 58 HH TYR 58 -24.876 12.820 -5.040 493 H GLU 59 H GLU 59 -20.457 19.442 -6.839 494 HA GLU 59 HA GLU 59 -23.211 20.007 -6.777 495 HB2 GLU 59 1HB GLU 59 -21.526 21.119 -5.374 496 HB3 GLU 59 2HB GLU 59 -20.832 21.876 -6.798 497 HG2 GLU 59 1HG GLU 59 -22.878 23.146 -7.129 498 HG3 GLU 59 2HG GLU 59 -23.600 22.358 -5.725 499 H TYR 60 H TYR 60 -20.704 20.617 -9.149 500 HA TYR 60 HA TYR 60 -22.015 22.327 -10.892 501 HB2 TYR 60 1HB TYR 60 -19.738 21.966 -11.312 502 HB3 TYR 60 2HB TYR 60 -19.908 20.216 -11.262 503 HD1 TYR 60 HD2 TYR 60 -20.982 23.163 -13.287 504 HD2 TYR 60 HD1 TYR 60 -19.951 19.037 -13.244 505 HE1 TYR 60 HE2 TYR 60 -21.108 23.108 -15.742 506 HE2 TYR 60 HE1 TYR 60 -20.075 18.970 -15.696 507 HH TYR 60 HH TYR 60 -21.142 20.208 -17.518 508 H ILE 61 H ILE 61 -21.900 18.764 -11.023 509 HA ILE 61 HA ILE 61 -23.576 18.638 -13.305 510 HB ILE 61 HB ILE 61 -23.710 16.191 -12.827 511 HG12 ILE 61 1HG1 ILE 61 -21.876 16.903 -10.523 512 HG13 ILE 61 2HG1 ILE 61 -23.517 16.289 -10.375 513 HG21 ILE 61 1HG2 ILE 61 -21.349 15.775 -13.324 514 HG22 ILE 61 2HG2 ILE 61 -20.969 17.432 -12.858 515 HG23 ILE 61 3HG2 ILE 61 -21.995 17.125 -14.258 516 HD11 ILE 61 3HD1 ILE 61 -21.870 14.546 -9.981 517 HD12 ILE 61 1HD1 ILE 61 -21.196 14.812 -11.590 518 HD13 ILE 61 2HD1 ILE 61 -22.840 14.197 -11.413 519 H GLU 62 H GLU 62 -24.259 18.637 -9.862 520 HA GLU 62 HA GLU 62 -26.854 17.462 -10.267 521 HB2 GLU 62 1HB GLU 62 -27.204 17.685 -7.901 522 HB3 GLU 62 2HB GLU 62 -25.590 17.056 -8.191 523 HG2 GLU 62 1HG GLU 62 -24.611 19.184 -7.698 524 HG3 GLU 62 2HG GLU 62 -26.205 19.935 -7.582 525 H GLN 63 H GLN 63 -25.621 20.728 -10.221 526 HA GLN 63 HA GLN 63 -28.142 21.886 -9.473 527 HB2 GLN 63 1HB GLN 63 -25.665 23.110 -10.670 528 HB3 GLN 63 2HB GLN 63 -27.082 24.041 -10.218 529 HG2 GLN 63 1HG GLN 63 -26.801 23.378 -7.902 530 HG3 GLN 63 2HG GLN 63 -25.398 22.402 -8.343 531 HE21 GLN 63 2HE2 GLN 63 -23.492 23.432 -8.961 532 HE22 GLN 63 1HE2 GLN 63 -23.191 25.094 -8.592 533 H SER 64 H SER 64 -26.565 21.107 -12.459 534 HA SER 64 HA SER 64 -28.843 21.284 -14.070 535 HB2 SER 64 1HB SER 64 -27.038 23.689 -13.986 536 HB3 SER 64 2HB SER 64 -27.923 23.265 -15.436 537 HG SER 64 HG SER 64 -29.315 23.397 -13.020 538 H LYS 65 H LYS 65 -28.325 19.676 -15.464 539 HA LYS 65 HA LYS 65 -25.635 19.486 -16.545 540 HB2 LYS 65 1HB LYS 65 -28.148 17.901 -17.100 541 HB3 LYS 65 2HB LYS 65 -26.648 17.655 -17.979 542 HG2 LYS 65 1HG LYS 65 -26.560 16.011 -16.374 543 HG3 LYS 65 2HG LYS 65 -25.608 17.300 -15.639 544 HD2 LYS 65 1HD LYS 65 -27.042 16.453 -13.948 545 HD3 LYS 65 2HD LYS 65 -27.701 18.014 -14.438 546 HE2 LYS 65 1HE LYS 65 -29.442 16.289 -14.161 547 HE3 LYS 65 2HE LYS 65 -29.371 16.934 -15.803 548 HZ1 LYS 65 3HZ LYS 65 -29.569 14.427 -15.527 549 HZ2 LYS 65 1HZ LYS 65 -27.941 14.453 -15.048 550 HZ3 LYS 65 2HZ LYS 65 -28.386 14.996 -16.597 551 H ASN 66 H ASN 66 -28.899 20.086 -17.723 552 HA ASN 66 HA ASN 66 -27.760 21.546 -20.012 553 HB2 ASN 66 1HB ASN 66 -29.885 20.994 -21.208 554 HB3 ASN 66 2HB ASN 66 -28.940 19.576 -20.785 555 HD21 ASN 66 2HD2 ASN 66 -30.693 18.220 -20.910 556 HD22 ASN 66 1HD2 ASN 66 -31.957 18.216 -19.727 557 H CYS 67 H CYS 67 -30.329 22.643 -20.745 558 HA CYS 67 HA CYS 67 -31.230 24.164 -18.472 559 HB2 CYS 67 1HB CYS 67 -30.607 26.309 -19.181 560 HB3 CYS 67 2HB CYS 67 -29.153 25.359 -19.447 561 H SER 68 H SER 68 -33.042 25.599 -19.115 562 HA SER 68 HA SER 68 -34.987 24.202 -20.520 563 HB2 SER 68 1HB SER 68 -35.507 25.948 -18.878 564 HB3 SER 68 2HB SER 68 -34.867 27.179 -19.963 565 HG SER 68 HG SER 68 -37.041 27.184 -20.265 566 H TYR 69 H TYR 69 -32.667 26.530 -21.689 567 HA TYR 69 HA TYR 69 -33.918 27.018 -24.209 568 HB2 TYR 69 1HB TYR 69 -31.784 28.080 -22.747 569 HB3 TYR 69 2HB TYR 69 -31.077 27.486 -24.242 570 HD1 TYR 69 HD2 TYR 69 -32.531 28.099 -26.403 571 HD2 TYR 69 HD1 TYR 69 -32.529 30.263 -22.741 572 HE1 TYR 69 HE2 TYR 69 -33.348 30.101 -27.585 573 HE2 TYR 69 HE1 TYR 69 -33.349 32.263 -23.908 574 HH TYR 69 HH TYR 69 -34.683 32.210 -26.916 575 H CYS 70 H CYS 70 -32.643 24.249 -23.119 576 HA CYS 70 HA CYS 70 -32.285 23.298 -25.837 577 HB2 CYS 70 1HB CYS 70 -30.151 22.199 -25.419 578 HB3 CYS 70 2HB CYS 70 -29.991 23.931 -25.154 579 H SER 71 H SER 71 -34.031 23.013 -23.378 580 HA SER 71 HA SER 71 -33.990 20.079 -23.276 581 HB2 SER 71 1HB SER 71 -33.089 21.032 -21.154 582 HB3 SER 71 2HB SER 71 -34.594 21.922 -20.942 583 HG SER 71 HG SER 71 -34.699 20.039 -19.748 584 H GLU 72 H GLU 72 -36.069 19.115 -23.004 585 HA GLU 72 HA GLU 72 -38.190 20.626 -24.219 586 HB2 GLU 72 1HB GLU 72 -37.672 18.099 -24.470 587 HB3 GLU 72 2HB GLU 72 -38.508 17.920 -22.933 588 HG2 GLU 72 1HG GLU 72 -39.999 17.488 -24.794 589 HG3 GLU 72 2HG GLU 72 -40.510 18.915 -23.896 590 H ASP 73 H ASP 73 -37.185 19.740 -21.040 591 HA ASP 73 HA ASP 73 -39.700 20.419 -19.786 592 HB2 ASP 73 1HB ASP 73 -36.997 19.781 -18.585 593 HB3 ASP 73 2HB ASP 73 -38.472 20.028 -17.668 594 H GLU 74 H GLU 74 -40.258 22.376 -19.133 595 HA GLU 74 HA GLU 74 -38.127 24.290 -18.502 596 HB2 GLU 74 1HB GLU 74 -39.759 26.085 -19.260 597 HB3 GLU 74 2HB GLU 74 -38.909 25.167 -20.489 598 HG2 GLU 74 1HG GLU 74 -41.108 25.389 -21.209 599 HG3 GLU 74 2HG GLU 74 -40.934 23.726 -20.685 600 H ASN 75 H ASN 75 -40.598 22.499 -17.377 601 HA ASN 75 HA ASN 75 -41.942 24.406 -15.709 602 HB2 ASN 75 1HB ASN 75 -43.058 22.355 -16.513 603 HB3 ASN 75 2HB ASN 75 -41.944 21.384 -15.558 604 HD21 ASN 75 2HD2 ASN 75 -44.681 23.486 -15.514 605 HD22 ASN 75 1HD2 ASN 75 -45.130 23.213 -13.858 606 H CYS 76 H CYS 76 -39.374 22.044 -15.238 607 HA CYS 76 HA CYS 76 -38.650 23.301 -12.725 608 HB2 CYS 76 1HB CYS 76 -38.727 21.169 -11.471 609 HB3 CYS 76 2HB CYS 76 -40.324 21.687 -12.001 610 HG CYS 76 HG CYS 76 -38.570 18.947 -12.827 611 H ASN 77 H ASN 77 -37.451 22.901 -15.371 612 HA ASN 77 HA ASN 77 -35.630 20.715 -15.289 613 HB2 ASN 77 1HB ASN 77 -36.458 21.838 -17.384 614 HB3 ASN 77 2HB ASN 77 -35.402 23.195 -16.995 615 HD21 ASN 77 2HD2 ASN 77 -33.169 22.950 -17.193 616 HD22 ASN 77 1HD2 ASN 77 -32.460 21.599 -18.015 617 H ASN 78 H ASN 78 -35.050 24.226 -15.108 618 HA ASN 78 HA ASN 78 -33.037 23.896 -13.100 619 HB2 ASN 78 1HB ASN 78 -31.087 24.315 -14.300 620 HB3 ASN 78 2HB ASN 78 -31.965 23.249 -15.387 621 HD21 ASN 78 2HD2 ASN 78 -30.567 26.303 -14.929 622 HD22 ASN 78 1HD2 ASN 78 -30.959 26.982 -16.471 623 H LEU 79 H LEU 79 -32.141 25.992 -12.413 624 HA LEU 79 HA LEU 79 -34.265 27.896 -12.363 625 HB2 LEU 79 1HB LEU 79 -32.741 27.275 -10.454 626 HB3 LEU 79 2HB LEU 79 -31.481 28.193 -11.246 627 HG LEU 79 HG LEU 79 -32.729 29.311 -9.335 628 HD11 LEU 79 1HD1 LEU 79 -32.724 31.504 -10.408 629 HD12 LEU 79 2HD1 LEU 79 -32.613 30.731 -11.989 630 HD13 LEU 79 3HD1 LEU 79 -31.293 30.565 -10.832 631 HD21 LEU 79 3HD2 LEU 79 -34.978 28.672 -9.912 632 HD22 LEU 79 1HD2 LEU 79 -34.857 29.518 -11.454 633 HD23 LEU 79 2HD2 LEU 79 -34.834 30.430 -9.943 634 H LEU 80 H LEU 80 -30.866 28.117 -13.444 635 HA LEU 80 HA LEU 80 -31.378 30.706 -14.626 636 HB2 LEU 80 1HB LEU 80 -28.942 28.975 -14.337 637 HB3 LEU 80 2HB LEU 80 -28.926 30.384 -15.383 638 HG LEU 80 HG LEU 80 -29.735 30.599 -12.492 639 HD11 LEU 80 1HD1 LEU 80 -27.430 31.290 -12.004 640 HD12 LEU 80 2HD1 LEU 80 -26.953 30.822 -13.637 641 HD13 LEU 80 3HD1 LEU 80 -27.522 29.600 -12.500 642 HD21 LEU 80 3HD2 LEU 80 -29.053 32.917 -12.818 643 HD22 LEU 80 1HD2 LEU 80 -30.289 32.448 -13.986 644 HD23 LEU 80 2HD2 LEU 80 -28.600 32.554 -14.483 645 H GLU 81 H GLU 81 -32.970 30.073 -16.147 646 HA GLU 81 HA GLU 81 -32.494 28.184 -18.186 647 HB2 GLU 81 1HB GLU 81 -34.373 29.336 -19.379 648 HB3 GLU 81 2HB GLU 81 -34.753 28.817 -17.746 649 HG2 GLU 81 1HG GLU 81 -34.639 31.034 -16.917 650 HG3 GLU 81 2HG GLU 81 -33.920 31.627 -18.415 651 H GLY 82 H GLY 82 -31.377 28.280 -19.990 652 HA2 GLY 82 1HA GLY 82 -30.604 29.322 -21.973 653 HA3 GLY 82 2HA GLY 82 -30.715 30.876 -21.161 654 H TYR 83 H TYR 83 -29.350 29.127 -18.871 655 HA TYR 83 HA TYR 83 -26.622 29.514 -19.910 656 HB2 TYR 83 1HB TYR 83 -27.807 30.333 -17.268 657 HB3 TYR 83 2HB TYR 83 -26.076 30.066 -17.440 658 HD1 TYR 83 HD1 TYR 83 -28.908 32.095 -18.755 659 HD2 TYR 83 HD2 TYR 83 -24.690 31.726 -18.335 660 HE1 TYR 83 HE1 TYR 83 -28.626 34.384 -19.610 661 HE2 TYR 83 HE2 TYR 83 -24.401 34.013 -19.187 662 HH TYR 83 HH TYR 83 -25.725 35.584 -20.691 663 H HIS 84 H HIS 84 -24.973 28.198 -18.972 664 HA HIS 84 HA HIS 84 -25.893 25.935 -17.330 665 HB2 HIS 84 1HB HIS 84 -23.847 25.820 -19.554 666 HB3 HIS 84 2HB HIS 84 -24.076 24.549 -18.368 667 HD1 HIS 84 HD1 HIS 84 -24.883 22.704 -19.906 668 HD2 HIS 84 HD2 HIS 84 -27.011 26.244 -20.296 669 HE1 HIS 84 HE1 HIS 84 -26.656 22.287 -21.671 670 HA PRO 85 HA PRO 85 -22.358 27.066 -14.887 671 HB2 PRO 85 1HB PRO 85 -21.964 24.707 -13.583 672 HB3 PRO 85 2HB PRO 85 -23.243 25.847 -13.162 673 HG2 PRO 85 1HG PRO 85 -23.414 23.263 -14.584 674 HG3 PRO 85 2HG PRO 85 -24.631 24.091 -13.600 675 HD2 PRO 85 1HD PRO 85 -24.521 24.000 -16.406 676 HD3 PRO 85 2HD PRO 85 -25.545 25.066 -15.432 677 H LYS 86 H LYS 86 -20.106 26.799 -14.931 678 HA LYS 86 HA LYS 86 -19.018 24.519 -16.387 679 HB2 LYS 86 1HB LYS 86 -19.355 26.495 -17.983 680 HB3 LYS 86 2HB LYS 86 -18.113 27.323 -17.053 681 HG2 LYS 86 1HG LYS 86 -16.596 25.390 -17.529 682 HG3 LYS 86 2HG LYS 86 -17.832 24.787 -18.630 683 HD2 LYS 86 1HD LYS 86 -16.226 25.988 -19.930 684 HD3 LYS 86 2HD LYS 86 -17.689 26.969 -19.851 685 HE2 LYS 86 1HE LYS 86 -16.738 28.454 -18.298 686 HE3 LYS 86 2HE LYS 86 -15.418 27.350 -17.926 687 HZ1 LYS 86 3HZ LYS 86 -14.720 29.212 -19.332 688 HZ2 LYS 86 1HZ LYS 86 -15.806 28.719 -20.537 689 HZ3 LYS 86 2HZ LYS 86 -14.503 27.719 -20.114 690 H LEU 87 H LEU 87 -17.007 23.919 -15.670 691 HA LEU 87 HA LEU 87 -16.175 25.044 -13.154 692 HB2 LEU 87 1HB LEU 87 -14.828 22.910 -14.822 693 HB3 LEU 87 2HB LEU 87 -14.436 23.320 -13.168 694 HG LEU 87 HG LEU 87 -15.646 21.349 -12.983 695 HD11 LEU 87 1HD1 LEU 87 -17.784 21.927 -11.953 696 HD12 LEU 87 2HD1 LEU 87 -17.655 23.558 -12.614 697 HD13 LEU 87 3HD1 LEU 87 -16.479 22.992 -11.427 698 HD21 LEU 87 3HD2 LEU 87 -16.401 21.279 -15.323 699 HD22 LEU 87 1HD2 LEU 87 -17.689 22.414 -14.924 700 HD23 LEU 87 2HD2 LEU 87 -17.667 20.813 -14.187 701 H VAL 88 H VAL 88 -14.426 26.297 -12.766 702 HA VAL 88 HA VAL 88 -12.619 26.877 -15.015 703 HB VAL 88 HB VAL 88 -12.459 29.231 -14.302 704 HG11 VAL 88 1HG1 VAL 88 -15.268 28.362 -14.961 705 HG12 VAL 88 2HG1 VAL 88 -13.970 28.660 -16.119 706 HG13 VAL 88 3HG1 VAL 88 -14.622 29.990 -15.162 707 HG21 VAL 88 3HG2 VAL 88 -14.742 28.557 -12.458 708 HG22 VAL 88 1HG2 VAL 88 -14.131 30.179 -12.785 709 HG23 VAL 88 2HG2 VAL 88 -13.103 28.995 -11.978 710 H VAL 89 H VAL 89 -10.465 27.289 -14.420 711 HA VAL 89 HA VAL 89 -9.834 26.412 -11.704 712 HB VAL 89 HB VAL 89 -8.703 25.130 -13.408 713 HG11 VAL 89 1HG1 VAL 89 -8.731 26.727 -15.231 714 HG12 VAL 89 2HG1 VAL 89 -7.093 26.131 -14.958 715 HG13 VAL 89 3HG1 VAL 89 -7.553 27.738 -14.392 716 HG21 VAL 89 3HG2 VAL 89 -6.800 27.007 -12.010 717 HG22 VAL 89 1HG2 VAL 89 -6.370 25.445 -12.707 718 HG23 VAL 89 2HG2 VAL 89 -7.489 25.526 -11.346 719 H ASN 90 H ASN 90 -9.545 27.924 -10.255 720 HA ASN 90 HA ASN 90 -8.261 30.438 -11.087 721 HB2 ASN 90 1HB ASN 90 -10.398 29.964 -9.001 722 HB3 ASN 90 2HB ASN 90 -9.448 31.444 -9.075 723 HD21 ASN 90 2HD2 ASN 90 -12.321 31.056 -9.420 724 HD22 ASN 90 1HD2 ASN 90 -12.700 31.667 -10.993 725 H GLY 91 H GLY 91 -6.198 29.953 -10.642 726 HA2 GLY 91 1HA GLY 91 -4.311 29.750 -9.347 727 HA3 GLY 91 2HA GLY 91 -5.328 30.013 -7.939 728 H ARG 92 H ARG 92 -5.712 28.355 -6.625 729 HA ARG 92 HA ARG 92 -4.997 25.655 -7.579 730 HB2 ARG 92 1HB ARG 92 -4.602 26.959 -4.890 731 HB3 ARG 92 2HB ARG 92 -4.543 25.214 -5.098 732 HG2 ARG 92 1HG ARG 92 -2.802 27.124 -6.636 733 HG3 ARG 92 2HG ARG 92 -2.324 26.369 -5.114 734 HD2 ARG 92 1HD ARG 92 -3.155 24.859 -7.589 735 HD3 ARG 92 2HD ARG 92 -1.483 25.180 -7.126 736 HE ARG 92 HE ARG 92 -2.567 23.978 -4.927 737 HH11 ARG 92 1HH1 ARG 92 -2.335 23.098 -8.315 738 HH12 ARG 92 2HH1 ARG 92 -2.230 21.400 -7.992 739 HH21 ARG 92 1HH2 ARG 92 -2.434 21.747 -4.504 740 HH22 ARG 92 2HH2 ARG 92 -2.304 20.619 -5.821 741 H SER 93 H SER 93 -7.586 27.233 -7.450 742 HA SER 93 HA SER 93 -9.113 25.081 -6.188 743 HB2 SER 93 1HB SER 93 -10.780 26.885 -5.459 744 HB3 SER 93 2HB SER 93 -9.286 26.749 -4.534 745 HG SER 93 HG SER 93 -8.945 28.455 -6.598 746 H ILE 94 H ILE 94 -10.964 24.479 -7.220 747 HA ILE 94 HA ILE 94 -11.368 25.625 -9.879 748 HB ILE 94 HB ILE 94 -12.498 23.083 -8.684 749 HG12 ILE 94 1HG1 ILE 94 -10.241 23.443 -10.669 750 HG13 ILE 94 2HG1 ILE 94 -10.008 23.132 -8.953 751 HG21 ILE 94 1HG2 ILE 94 -13.081 22.504 -10.987 752 HG22 ILE 94 2HG2 ILE 94 -12.482 24.070 -11.535 753 HG23 ILE 94 3HG2 ILE 94 -13.891 23.987 -10.478 754 HD11 ILE 94 3HD1 ILE 94 -11.265 21.299 -10.982 755 HD12 ILE 94 1HD1 ILE 94 -11.216 20.985 -9.245 756 HD13 ILE 94 2HD1 ILE 94 -9.713 21.098 -10.162 757 H ASP 95 H ASP 95 -13.168 26.709 -10.438 758 HA ASP 95 HA ASP 95 -15.246 27.063 -8.374 759 HB2 ASP 95 1HB ASP 95 -13.546 29.015 -8.936 760 HB3 ASP 95 2HB ASP 95 -14.591 29.238 -10.333 761 H ILE 96 H ILE 96 -17.205 28.305 -9.599 762 HA ILE 96 HA ILE 96 -17.738 26.812 -12.078 763 HB ILE 96 HB ILE 96 -19.671 27.006 -9.761 764 HG12 ILE 96 1HG1 ILE 96 -18.268 24.571 -10.879 765 HG13 ILE 96 2HG1 ILE 96 -17.787 25.408 -9.408 766 HG21 ILE 96 1HG2 ILE 96 -21.078 25.500 -11.117 767 HG22 ILE 96 2HG2 ILE 96 -19.925 25.654 -12.444 768 HG23 ILE 96 3HG2 ILE 96 -20.821 27.066 -11.886 769 HD11 ILE 96 3HD1 ILE 96 -20.406 24.007 -9.881 770 HD12 ILE 96 1HD1 ILE 96 -19.965 24.892 -8.420 771 HD13 ILE 96 2HD1 ILE 96 -19.070 23.442 -8.875 772 H GLU 97 H GLU 97 -18.146 28.288 -13.589 773 HA GLU 97 HA GLU 97 -19.586 30.742 -12.832 774 HB2 GLU 97 1HB GLU 97 -18.751 31.742 -14.847 775 HB3 GLU 97 2HB GLU 97 -17.394 30.970 -14.039 776 HG2 GLU 97 1HG GLU 97 -17.328 29.213 -15.599 777 HG3 GLU 97 2HG GLU 97 -18.925 29.610 -16.232 778 H TYR 98 H TYR 98 -20.870 31.529 -14.983 779 HA TYR 98 HA TYR 98 -22.361 29.230 -16.042 780 HB2 TYR 98 1HB TYR 98 -23.396 31.516 -14.515 781 HB3 TYR 98 2HB TYR 98 -24.265 31.207 -16.015 782 HD1 TYR 98 HD1 TYR 98 -23.262 29.722 -12.774 783 HD2 TYR 98 HD2 TYR 98 -25.742 29.344 -16.224 784 HE1 TYR 98 HE1 TYR 98 -24.533 27.933 -11.662 785 HE2 TYR 98 HE2 TYR 98 -27.012 27.559 -15.112 786 HH TYR 98 HH TYR 98 -26.710 26.865 -11.769 787 H TYR 99 H TYR 99 -22.325 29.171 -18.158 788 HA TYR 99 HA TYR 99 -21.948 31.683 -19.657 789 HB2 TYR 99 1HB TYR 99 -20.949 30.356 -21.446 790 HB3 TYR 99 2HB TYR 99 -20.096 30.045 -19.940 791 HD1 TYR 99 HD1 TYR 99 -22.399 28.644 -22.439 792 HD2 TYR 99 HD2 TYR 99 -20.158 27.860 -18.902 793 HE1 TYR 99 HE1 TYR 99 -22.790 26.238 -22.732 794 HE2 TYR 99 HE2 TYR 99 -20.555 25.452 -19.184 795 HH TYR 99 HH TYR 99 -21.997 23.935 -20.276 796 H GLU 100 H GLU 100 -23.238 31.905 -21.625 797 HA GLU 100 HA GLU 100 -25.805 30.658 -21.206 798 HB2 GLU 100 1HB GLU 100 -26.513 32.163 -23.149 799 HB3 GLU 100 2HB GLU 100 -26.105 32.905 -21.613 800 HG2 GLU 100 1HG GLU 100 -23.827 33.368 -22.560 801 HG3 GLU 100 2HG GLU 100 -24.460 32.845 -24.122 802 H CYS 101 H CYS 101 -26.751 29.233 -22.325 803 HA CYS 101 HA CYS 101 -25.518 27.244 -23.727 804 HB2 CYS 101 1HB CYS 101 -27.904 27.443 -22.758 805 HB3 CYS 101 2HB CYS 101 -28.342 28.092 -24.330 806 HA PRO 102 HA PRO 102 -24.597 29.186 -27.681 807 HB2 PRO 102 1HB PRO 102 -23.673 26.922 -28.897 808 HB3 PRO 102 2HB PRO 102 -22.705 27.899 -27.789 809 HG2 PRO 102 1HG PRO 102 -24.223 25.376 -27.260 810 HG3 PRO 102 2HG PRO 102 -22.603 25.843 -26.710 811 HD2 PRO 102 1HD PRO 102 -24.755 26.009 -25.102 812 HD3 PRO 102 2HD PRO 102 -23.425 27.183 -25.017 813 H VAL 103 H VAL 103 -26.862 26.757 -26.990 814 HA VAL 103 HA VAL 103 -27.796 26.179 -29.605 815 HB VAL 103 HB VAL 103 -29.264 25.972 -26.965 816 HG11 VAL 103 1HG1 VAL 103 -30.678 24.332 -28.098 817 HG12 VAL 103 2HG1 VAL 103 -29.832 24.646 -29.613 818 HG13 VAL 103 3HG1 VAL 103 -30.795 25.918 -28.860 819 HG21 VAL 103 3HG2 VAL 103 -27.609 23.955 -28.480 820 HG22 VAL 103 1HG2 VAL 103 -28.608 23.590 -27.071 821 HG23 VAL 103 2HG2 VAL 103 -27.231 24.679 -26.917 822 H LYS 104 H LYS 104 -28.198 28.888 -27.517 823 HA LYS 104 HA LYS 104 -30.721 29.782 -28.468 824 HB2 LYS 104 1HB LYS 104 -30.198 31.905 -27.423 825 HB3 LYS 104 2HB LYS 104 -29.735 30.590 -26.353 826 HG2 LYS 104 1HG LYS 104 -27.395 30.855 -27.138 827 HG3 LYS 104 2HG LYS 104 -27.914 32.261 -28.064 828 HD2 LYS 104 1HD LYS 104 -28.228 31.973 -25.079 829 HD3 LYS 104 2HD LYS 104 -26.896 32.819 -25.862 830 HE2 LYS 104 1HE LYS 104 -28.482 34.374 -26.885 831 HE3 LYS 104 2HE LYS 104 -29.819 33.520 -26.116 832 HZ1 LYS 104 3HZ LYS 104 -29.103 35.556 -24.926 833 HZ2 LYS 104 1HZ LYS 104 -27.603 34.819 -24.625 834 HZ3 LYS 104 2HZ LYS 104 -29.025 34.155 -23.975 835 H ARG 105 H ARG 105 -27.514 29.927 -29.740 836 HA ARG 105 HA ARG 105 -28.403 31.767 -31.851 837 HB2 ARG 105 1HB ARG 105 -25.974 31.930 -32.448 838 HB3 ARG 105 2HB ARG 105 -26.374 32.559 -30.858 839 HG2 ARG 105 1HG ARG 105 -25.378 30.747 -29.765 840 HG3 ARG 105 2HG ARG 105 -25.336 29.774 -31.233 841 HD2 ARG 105 1HD ARG 105 -23.119 30.624 -30.640 842 HD3 ARG 105 2HD ARG 105 -23.667 31.247 -32.194 843 HE ARG 105 HE ARG 105 -24.409 33.155 -30.358 844 HH11 ARG 105 1HH1 ARG 105 -21.396 31.612 -31.285 845 HH12 ARG 105 2HH1 ARG 105 -20.425 33.021 -30.954 846 HH21 ARG 105 1HH2 ARG 105 -23.147 34.994 -29.918 847 HH22 ARG 105 2HH2 ARG 105 -21.426 34.956 -30.174 848 H LYS 106 H LYS 106 -29.025 30.901 -33.685 849 HA LYS 106 HA LYS 106 -27.688 28.473 -34.641 850 HB2 LYS 106 1HB LYS 106 -29.843 27.482 -35.325 851 HB3 LYS 106 2HB LYS 106 -29.710 27.648 -33.582 852 HG2 LYS 106 1HG LYS 106 -31.067 29.797 -35.133 853 HG3 LYS 106 2HG LYS 106 -31.914 28.278 -34.846 854 HD2 LYS 106 1HD LYS 106 -30.610 29.670 -32.548 855 HD3 LYS 106 2HD LYS 106 -32.141 30.288 -33.166 856 HE2 LYS 106 1HE LYS 106 -32.579 28.764 -31.350 857 HE3 LYS 106 2HE LYS 106 -33.133 28.046 -32.858 858 HZ1 LYS 106 3HZ LYS 106 -31.085 26.728 -32.911 859 HZ2 LYS 106 1HZ LYS 106 -32.000 26.414 -31.521 860 HZ3 LYS 106 2HZ LYS 106 -30.616 27.389 -31.422 Start of MODEL 11 1 HA MET 1 HA MET 1 -13.688 -14.078 -17.396 2 HB2 MET 1 1HB MET 1 -13.873 -16.132 -18.622 3 HB3 MET 1 2HB MET 1 -12.734 -15.101 -19.471 4 HG2 MET 1 1HG MET 1 -12.007 -17.395 -17.664 5 HG3 MET 1 2HG MET 1 -12.032 -17.440 -19.425 6 HE1 MET 1 2HE MET 1 -9.481 -18.376 -17.832 7 HE2 MET 1 3HE MET 1 -8.215 -17.580 -18.768 8 HE3 MET 1 1HE MET 1 -9.590 -18.313 -19.592 9 H GLU 2 H GLU 2 -11.776 -14.201 -15.127 10 HA GLU 2 HA GLU 2 -11.874 -16.828 -13.997 11 HB2 GLU 2 1HB GLU 2 -11.209 -14.161 -12.733 12 HB3 GLU 2 2HB GLU 2 -10.909 -15.735 -12.009 13 HG2 GLU 2 1HG GLU 2 -9.678 -14.723 -14.561 14 HG3 GLU 2 2HG GLU 2 -8.890 -14.773 -12.984 15 HA PRO 3 HA PRO 3 -15.831 -16.716 -11.963 16 HB2 PRO 3 1HB PRO 3 -14.437 -18.040 -9.701 17 HB3 PRO 3 2HB PRO 3 -15.845 -18.578 -10.622 18 HG2 PRO 3 1HG PRO 3 -13.462 -19.728 -10.963 19 HG3 PRO 3 2HG PRO 3 -14.559 -19.461 -12.332 20 HD2 PRO 3 1HD PRO 3 -12.120 -17.928 -11.529 21 HD3 PRO 3 2HD PRO 3 -12.690 -18.371 -13.152 22 H ILE 4 H ILE 4 -16.294 -14.686 -11.359 23 HA ILE 4 HA ILE 4 -14.658 -13.012 -9.836 24 HB ILE 4 HB ILE 4 -17.637 -12.798 -10.299 25 HG12 ILE 4 1HG1 ILE 4 -15.304 -11.595 -11.812 26 HG13 ILE 4 2HG1 ILE 4 -16.322 -12.918 -12.377 27 HG21 ILE 4 1HG2 ILE 4 -16.884 -11.395 -8.438 28 HG22 ILE 4 2HG2 ILE 4 -17.373 -10.426 -9.825 29 HG23 ILE 4 3HG2 ILE 4 -15.661 -10.667 -9.482 30 HD11 ILE 4 3HD1 ILE 4 -17.255 -10.107 -11.821 31 HD12 ILE 4 1HD1 ILE 4 -18.238 -11.430 -12.450 32 HD13 ILE 4 2HD1 ILE 4 -16.908 -10.786 -13.412 33 H GLY 5 H GLY 5 -14.228 -12.971 -7.757 34 HA2 GLY 5 1HA GLY 5 -16.329 -13.790 -5.856 35 HA3 GLY 5 2HA GLY 5 -14.685 -14.395 -5.685 36 H ARG 6 H ARG 6 -16.759 -12.157 -4.527 37 HA ARG 6 HA ARG 6 -14.846 -9.978 -4.326 38 HB2 ARG 6 1HB ARG 6 -17.337 -9.631 -4.751 39 HB3 ARG 6 2HB ARG 6 -17.588 -10.088 -3.071 40 HG2 ARG 6 1HG ARG 6 -17.556 -7.688 -3.270 41 HG3 ARG 6 2HG ARG 6 -16.135 -8.225 -2.370 42 HD2 ARG 6 1HD ARG 6 -14.821 -8.095 -4.469 43 HD3 ARG 6 2HD ARG 6 -16.238 -7.433 -5.279 44 HE ARG 6 HE ARG 6 -15.400 -5.967 -2.929 45 HH11 ARG 6 1HH1 ARG 6 -15.054 -6.330 -6.394 46 HH12 ARG 6 2HH1 ARG 6 -14.471 -4.711 -6.640 47 HH21 ARG 6 1HH2 ARG 6 -14.612 -3.849 -3.237 48 HH22 ARG 6 2HH2 ARG 6 -14.208 -3.308 -4.836 49 H SER 7 H SER 7 -13.697 -9.491 -2.555 50 HA SER 7 HA SER 7 -13.275 -11.400 -0.546 51 HB2 SER 7 1HB SER 7 -12.572 -8.463 -0.414 52 HB3 SER 7 2HB SER 7 -11.762 -9.793 0.412 53 HG SER 7 HG SER 7 -10.511 -9.490 -1.330 54 H LEU 8 H LEU 8 -15.595 -8.868 -0.792 55 HA LEU 8 HA LEU 8 -16.079 -8.705 2.043 56 HB2 LEU 8 1HB LEU 8 -17.425 -7.476 -0.346 57 HB3 LEU 8 2HB LEU 8 -18.085 -7.323 1.273 58 HG LEU 8 HG LEU 8 -15.397 -6.320 0.337 59 HD11 LEU 8 1HD1 LEU 8 -17.909 -4.869 1.162 60 HD12 LEU 8 2HD1 LEU 8 -17.252 -4.977 -0.472 61 HD13 LEU 8 3HD1 LEU 8 -16.364 -4.111 0.780 62 HD21 LEU 8 3HD2 LEU 8 -16.704 -6.140 3.049 63 HD22 LEU 8 1HD2 LEU 8 -15.207 -5.340 2.572 64 HD23 LEU 8 2HD2 LEU 8 -15.281 -7.100 2.641 65 H GLN 9 H GLN 9 -16.549 -10.864 2.514 66 HA GLN 9 HA GLN 9 -19.046 -11.984 1.557 67 HB2 GLN 9 1HB GLN 9 -17.343 -13.573 2.118 68 HB3 GLN 9 2HB GLN 9 -17.071 -12.823 3.686 69 HG2 GLN 9 1HG GLN 9 -19.248 -13.553 4.447 70 HG3 GLN 9 2HG GLN 9 -19.592 -14.244 2.862 71 HE21 GLN 9 2HE2 GLN 9 -19.906 -16.285 3.758 72 HE22 GLN 9 1HE2 GLN 9 -18.582 -17.262 4.292 73 H GLY 10 H GLY 10 -17.726 -10.644 4.543 74 HA2 GLY 10 1HA GLY 10 -20.442 -9.740 5.258 75 HA3 GLY 10 2HA GLY 10 -19.378 -10.452 6.468 76 H VAL 11 H VAL 11 -20.357 -7.602 5.021 77 HA VAL 11 HA VAL 11 -17.883 -6.162 5.201 78 HB VAL 11 HB VAL 11 -20.649 -4.974 5.058 79 HG11 VAL 11 1HG1 VAL 11 -19.504 -3.109 3.955 80 HG12 VAL 11 2HG1 VAL 11 -17.962 -3.932 4.177 81 HG13 VAL 11 3HG1 VAL 11 -18.877 -3.386 5.582 82 HG21 VAL 11 3HG2 VAL 11 -18.884 -5.871 2.777 83 HG22 VAL 11 1HG2 VAL 11 -20.391 -4.970 2.621 84 HG23 VAL 11 2HG2 VAL 11 -20.410 -6.612 3.265 85 H THR 12 H THR 12 -17.044 -6.130 7.208 86 HA THR 12 HA THR 12 -18.720 -5.691 9.519 87 HB THR 12 HB THR 12 -16.895 -7.282 9.731 88 HG1 THR 12 HG1 THR 12 -16.144 -6.552 11.692 89 HG21 THR 12 3HG2 THR 12 -15.299 -6.375 8.162 90 HG22 THR 12 1HG2 THR 12 -14.537 -6.526 9.745 91 HG23 THR 12 2HG2 THR 12 -15.068 -4.945 9.167 92 H GLY 13 H GLY 13 -16.323 -3.881 7.648 93 HA2 GLY 13 1HA GLY 13 -16.799 -1.552 9.395 94 HA3 GLY 13 2HA GLY 13 -15.427 -1.746 8.309 95 H ARG 14 H ARG 14 -17.883 0.195 8.661 96 HA ARG 14 HA ARG 14 -18.302 0.518 5.792 97 HB2 ARG 14 1HB ARG 14 -20.663 0.576 7.678 98 HB3 ARG 14 2HB ARG 14 -20.691 0.698 5.930 99 HG2 ARG 14 1HG ARG 14 -21.392 -1.451 6.205 100 HG3 ARG 14 2HG ARG 14 -19.652 -1.714 6.069 101 HD2 ARG 14 1HD ARG 14 -20.582 -2.999 7.925 102 HD3 ARG 14 2HD ARG 14 -19.471 -1.761 8.512 103 HE ARG 14 HE ARG 14 -22.176 -0.838 8.484 104 HH11 ARG 14 1HH1 ARG 14 -19.875 -2.752 10.323 105 HH12 ARG 14 2HH1 ARG 14 -20.728 -2.545 11.820 106 HH21 ARG 14 1HH2 ARG 14 -23.266 -0.547 10.457 107 HH22 ARG 14 2HH2 ARG 14 -22.649 -1.297 11.904 108 HA PRO 15 HA PRO 15 -17.669 4.560 8.147 109 HB2 PRO 15 1HB PRO 15 -15.662 4.887 5.999 110 HB3 PRO 15 2HB PRO 15 -15.527 5.229 7.727 111 HG2 PRO 15 1HG PRO 15 -14.295 3.125 6.613 112 HG3 PRO 15 2HG PRO 15 -14.970 3.055 8.251 113 HD2 PRO 15 1HD PRO 15 -16.060 1.926 5.706 114 HD3 PRO 15 2HD PRO 15 -16.087 1.253 7.345 115 H ASP 16 H ASP 16 -19.503 5.520 7.483 116 HA ASP 16 HA ASP 16 -20.575 5.550 4.916 117 HB2 ASP 16 1HB ASP 16 -20.975 7.509 7.186 118 HB3 ASP 16 2HB ASP 16 -21.948 7.492 5.719 119 H PHE 17 H PHE 17 -18.380 7.802 6.465 120 HA PHE 17 HA PHE 17 -18.497 9.921 4.694 121 HB2 PHE 17 1HB PHE 17 -17.267 10.085 6.776 122 HB3 PHE 17 2HB PHE 17 -16.114 8.869 6.234 123 HD1 PHE 17 HD2 PHE 17 -17.404 12.255 5.424 124 HD2 PHE 17 HD1 PHE 17 -14.174 9.504 5.125 125 HE1 PHE 17 HE2 PHE 17 -15.987 14.028 4.469 126 HE2 PHE 17 HE1 PHE 17 -12.749 11.266 4.174 127 HZ PHE 17 HZ PHE 17 -13.652 13.533 3.844 128 H GLN 18 H GLN 18 -16.181 7.170 4.534 129 HA GLN 18 HA GLN 18 -15.118 8.107 2.059 130 HB2 GLN 18 1HB GLN 18 -13.775 6.176 2.007 131 HB3 GLN 18 2HB GLN 18 -13.849 6.687 3.685 132 HG2 GLN 18 1HG GLN 18 -15.418 4.946 4.202 133 HG3 GLN 18 2HG GLN 18 -15.535 4.495 2.500 134 HE21 GLN 18 2HE2 GLN 18 -12.661 4.835 2.043 135 HE22 GLN 18 1HE2 GLN 18 -11.897 3.481 2.784 136 H LYS 19 H LYS 19 -17.665 5.904 2.967 137 HA LYS 19 HA LYS 19 -18.042 4.577 0.538 138 HB2 LYS 19 1HB LYS 19 -19.958 5.354 2.726 139 HB3 LYS 19 2HB LYS 19 -20.475 4.434 1.319 140 HG2 LYS 19 1HG LYS 19 -18.947 2.654 1.878 141 HG3 LYS 19 2HG LYS 19 -18.316 3.586 3.240 142 HD2 LYS 19 1HD LYS 19 -19.894 1.932 4.039 143 HD3 LYS 19 2HD LYS 19 -20.568 3.547 4.260 144 HE2 LYS 19 1HE LYS 19 -22.280 2.079 3.413 145 HE3 LYS 19 2HE LYS 19 -21.854 3.250 2.166 146 HZ1 LYS 19 3HZ LYS 19 -20.953 0.422 2.316 147 HZ2 LYS 19 1HZ LYS 19 -20.413 1.541 1.162 148 HZ3 LYS 19 2HZ LYS 19 -22.044 1.077 1.198 149 H ARG 20 H ARG 20 -19.478 7.610 1.722 150 HA ARG 20 HA ARG 20 -20.787 8.095 -0.790 151 HB2 ARG 20 1HB ARG 20 -21.486 10.210 0.162 152 HB3 ARG 20 2HB ARG 20 -21.719 8.927 1.335 153 HG2 ARG 20 1HG ARG 20 -19.686 9.617 2.501 154 HG3 ARG 20 2HG ARG 20 -19.464 10.918 1.326 155 HD2 ARG 20 1HD ARG 20 -21.620 11.868 1.968 156 HD3 ARG 20 2HD ARG 20 -21.849 10.570 3.135 157 HE ARG 20 HE ARG 20 -19.544 12.365 3.411 158 HH11 ARG 20 1HH1 ARG 20 -22.534 11.025 4.617 159 HH12 ARG 20 2HH1 ARG 20 -22.481 11.892 6.124 160 HH21 ARG 20 1HH2 ARG 20 -19.435 13.514 5.421 161 HH22 ARG 20 2HH2 ARG 20 -20.717 13.304 6.580 162 H LEU 21 H LEU 21 -17.748 8.959 0.673 163 HA LEU 21 HA LEU 21 -17.011 11.101 -0.975 164 HB2 LEU 21 1HB LEU 21 -15.722 10.722 0.959 165 HB3 LEU 21 2HB LEU 21 -15.454 9.039 0.558 166 HG LEU 21 HG LEU 21 -13.967 9.735 -1.294 167 HD11 LEU 21 1HD1 LEU 21 -13.192 12.070 -1.381 168 HD12 LEU 21 2HD1 LEU 21 -14.407 12.507 -0.179 169 HD13 LEU 21 3HD1 LEU 21 -14.906 11.925 -1.767 170 HD21 LEU 21 3HD2 LEU 21 -13.044 9.178 0.890 171 HD22 LEU 21 1HD2 LEU 21 -13.239 10.853 1.410 172 HD23 LEU 21 2HD2 LEU 21 -12.108 10.458 0.116 173 H GLU 22 H GLU 22 -16.288 7.624 -1.311 174 HA GLU 22 HA GLU 22 -15.130 7.967 -3.898 175 HB2 GLU 22 1HB GLU 22 -15.987 5.507 -2.374 176 HB3 GLU 22 2HB GLU 22 -15.228 5.445 -3.961 177 HG2 GLU 22 1HG GLU 22 -13.992 6.720 -1.530 178 HG3 GLU 22 2HG GLU 22 -13.661 5.080 -2.079 179 H GLN 23 H GLN 23 -18.331 7.344 -2.702 180 HA GLN 23 HA GLN 23 -19.519 6.331 -5.040 181 HB2 GLN 23 1HB GLN 23 -20.525 6.440 -2.721 182 HB3 GLN 23 2HB GLN 23 -20.834 8.143 -3.018 183 HG2 GLN 23 1HG GLN 23 -22.254 7.564 -4.912 184 HG3 GLN 23 2HG GLN 23 -21.948 5.851 -4.618 185 HE21 GLN 23 2HE2 GLN 23 -22.842 4.871 -2.782 186 HE22 GLN 23 1HE2 GLN 23 -24.168 5.594 -1.929 187 H MET 24 H MET 24 -19.470 9.669 -3.796 188 HA MET 24 HA MET 24 -20.502 10.818 -6.166 189 HB2 MET 24 1HB MET 24 -19.795 12.964 -5.250 190 HB3 MET 24 2HB MET 24 -20.575 11.994 -4.012 191 HG2 MET 24 1HG MET 24 -18.323 11.363 -3.183 192 HG3 MET 24 2HG MET 24 -17.627 12.487 -4.345 193 HE1 MET 24 3HE MET 24 -19.810 14.839 -4.263 194 HE2 MET 24 1HE MET 24 -18.075 15.137 -4.273 195 HE3 MET 24 2HE MET 24 -19.097 15.919 -3.064 196 H LYS 25 H LYS 25 -17.264 10.184 -5.012 197 HA LYS 25 HA LYS 25 -15.679 11.396 -6.932 198 HB2 LYS 25 1HB LYS 25 -14.915 10.182 -4.894 199 HB3 LYS 25 2HB LYS 25 -15.314 8.666 -5.678 200 HG2 LYS 25 1HG LYS 25 -13.040 8.816 -5.957 201 HG3 LYS 25 2HG LYS 25 -13.658 9.428 -7.493 202 HD2 LYS 25 1HD LYS 25 -12.905 11.517 -7.110 203 HD3 LYS 25 2HD LYS 25 -13.285 11.449 -5.387 204 HE2 LYS 25 1HE LYS 25 -10.942 10.096 -6.722 205 HE3 LYS 25 2HE LYS 25 -10.864 11.599 -5.803 206 HZ1 LYS 25 3HZ LYS 25 -11.753 8.985 -4.684 207 HZ2 LYS 25 1HZ LYS 25 -11.524 10.430 -3.829 208 HZ3 LYS 25 2HZ LYS 25 -10.199 9.631 -4.505 209 H GLU 26 H GLU 26 -17.167 8.191 -6.970 210 HA GLU 26 HA GLU 26 -16.087 7.268 -9.371 211 HB2 GLU 26 1HB GLU 26 -17.265 5.983 -7.505 212 HB3 GLU 26 2HB GLU 26 -18.775 6.481 -8.251 213 HG2 GLU 26 1HG GLU 26 -16.844 5.230 -10.064 214 HG3 GLU 26 2HG GLU 26 -17.472 4.185 -8.794 215 H LYS 27 H LYS 27 -19.231 8.797 -8.728 216 HA LYS 27 HA LYS 27 -20.227 8.704 -11.324 217 HB2 LYS 27 1HB LYS 27 -20.750 10.580 -9.043 218 HB3 LYS 27 2HB LYS 27 -21.528 10.819 -10.600 219 HG2 LYS 27 1HG LYS 27 -22.355 8.446 -10.416 220 HG3 LYS 27 2HG LYS 27 -21.781 8.468 -8.749 221 HD2 LYS 27 1HD LYS 27 -24.162 8.987 -8.854 222 HD3 LYS 27 2HD LYS 27 -23.244 10.379 -8.278 223 HE2 LYS 27 1HE LYS 27 -23.376 11.429 -10.435 224 HE3 LYS 27 2HE LYS 27 -24.113 9.992 -11.140 225 HZ1 LYS 27 3HZ LYS 27 -25.746 11.724 -10.679 226 HZ2 LYS 27 1HZ LYS 27 -25.346 11.696 -9.028 227 HZ3 LYS 27 2HZ LYS 27 -26.054 10.335 -9.755 228 H VAL 28 H VAL 28 -18.114 11.111 -9.841 229 HA VAL 28 HA VAL 28 -18.238 12.947 -12.016 230 HB VAL 28 HB VAL 28 -16.128 12.668 -9.859 231 HG11 VAL 28 1HG1 VAL 28 -15.632 15.020 -10.343 232 HG12 VAL 28 2HG1 VAL 28 -16.792 14.984 -11.672 233 HG13 VAL 28 3HG1 VAL 28 -15.339 13.987 -11.742 234 HG21 VAL 28 3HG2 VAL 28 -18.392 13.007 -8.963 235 HG22 VAL 28 1HG2 VAL 28 -18.553 14.458 -9.956 236 HG23 VAL 28 2HG2 VAL 28 -17.341 14.395 -8.672 237 H MET 29 H MET 29 -16.241 10.199 -11.191 238 HA MET 29 HA MET 29 -14.141 10.747 -13.024 239 HB2 MET 29 1HB MET 29 -14.953 8.265 -11.524 240 HB3 MET 29 2HB MET 29 -13.578 8.291 -12.620 241 HG2 MET 29 1HG MET 29 -13.909 10.058 -10.207 242 HG3 MET 29 2HG MET 29 -12.932 8.593 -10.275 243 HE1 MET 29 3HE MET 29 -11.835 11.455 -9.338 244 HE2 MET 29 1HE MET 29 -10.266 11.481 -10.144 245 HE3 MET 29 2HE MET 29 -10.840 10.000 -9.379 246 H LYS 30 H LYS 30 -17.302 9.553 -13.506 247 HA LYS 30 HA LYS 30 -16.451 8.485 -16.118 248 HB2 LYS 30 1HB LYS 30 -18.428 7.455 -14.169 249 HB3 LYS 30 2HB LYS 30 -18.846 7.323 -15.870 250 HG2 LYS 30 1HG LYS 30 -17.805 5.297 -15.311 251 HG3 LYS 30 2HG LYS 30 -16.589 6.216 -16.197 252 HD2 LYS 30 1HD LYS 30 -15.459 5.286 -14.352 253 HD3 LYS 30 2HD LYS 30 -15.739 6.978 -13.924 254 HE2 LYS 30 1HE LYS 30 -16.256 5.589 -12.028 255 HE3 LYS 30 2HE LYS 30 -17.745 6.290 -12.663 256 HZ1 LYS 30 3HZ LYS 30 -18.146 4.180 -13.843 257 HZ2 LYS 30 1HZ LYS 30 -18.091 3.982 -12.157 258 HZ3 LYS 30 2HZ LYS 30 -16.763 3.521 -13.112 259 H ASP 31 H ASP 31 -17.554 11.204 -15.046 260 HA ASP 31 HA ASP 31 -19.845 11.510 -16.789 261 HB2 ASP 31 1HB ASP 31 -19.786 12.772 -14.681 262 HB3 ASP 31 2HB ASP 31 -18.337 13.617 -15.230 263 H GLN 32 H GLN 32 -19.884 12.444 -18.732 264 HA GLN 32 HA GLN 32 -17.569 12.306 -20.319 265 HB2 GLN 32 1HB GLN 32 -19.093 13.424 -22.046 266 HB3 GLN 32 2HB GLN 32 -19.597 11.865 -21.405 267 HG2 GLN 32 1HG GLN 32 -21.193 12.898 -19.958 268 HG3 GLN 32 2HG GLN 32 -20.591 14.506 -20.353 269 HE21 GLN 32 2HE2 GLN 32 -23.270 13.302 -20.603 270 HE22 GLN 32 1HE2 GLN 32 -23.717 13.531 -22.262 271 H ASP 33 H ASP 33 -19.359 15.131 -19.081 272 HA ASP 33 HA ASP 33 -17.782 16.995 -20.565 273 HB2 ASP 33 1HB ASP 33 -19.812 17.256 -18.372 274 HB3 ASP 33 2HB ASP 33 -18.844 18.646 -18.852 275 H VAL 34 H VAL 34 -17.703 15.667 -17.331 276 HA VAL 34 HA VAL 34 -15.698 17.268 -16.226 277 HB VAL 34 HB VAL 34 -16.342 14.352 -15.744 278 HG11 VAL 34 1HG1 VAL 34 -15.077 14.528 -13.664 279 HG12 VAL 34 2HG1 VAL 34 -14.571 16.162 -14.103 280 HG13 VAL 34 3HG1 VAL 34 -14.034 14.784 -15.065 281 HG21 VAL 34 3HG2 VAL 34 -18.134 15.877 -15.178 282 HG22 VAL 34 1HG2 VAL 34 -17.027 16.862 -14.222 283 HG23 VAL 34 2HG2 VAL 34 -17.411 15.218 -13.712 284 H GLN 35 H GLN 35 -15.429 14.353 -18.252 285 HA GLN 35 HA GLN 35 -12.642 14.045 -18.124 286 HB2 GLN 35 1HB GLN 35 -14.295 13.503 -20.585 287 HB3 GLN 35 2HB GLN 35 -12.812 12.704 -20.092 288 HG2 GLN 35 1HG GLN 35 -15.482 12.491 -18.735 289 HG3 GLN 35 2HG GLN 35 -14.732 11.285 -19.772 290 HE21 GLN 35 2HE2 GLN 35 -15.606 11.227 -16.974 291 HE22 GLN 35 1HE2 GLN 35 -14.233 10.685 -16.075 292 H ALA 36 H ALA 36 -14.658 15.808 -20.427 293 HA ALA 36 HA ALA 36 -12.685 16.672 -22.181 294 HB1 ALA 36 1HB ALA 36 -15.185 18.174 -21.421 295 HB2 ALA 36 2HB ALA 36 -15.110 16.850 -22.584 296 HB3 ALA 36 3HB ALA 36 -14.254 18.358 -22.908 297 H PHE 37 H PHE 37 -13.869 18.230 -19.224 298 HA PHE 37 HA PHE 37 -12.186 20.515 -19.504 299 HB2 PHE 37 1HB PHE 37 -14.218 20.666 -18.193 300 HB3 PHE 37 2HB PHE 37 -13.647 19.405 -17.104 301 HD1 PHE 37 HD2 PHE 37 -12.681 22.765 -18.376 302 HD2 PHE 37 HD1 PHE 37 -12.600 19.998 -15.145 303 HE1 PHE 37 HE2 PHE 37 -11.657 24.481 -16.944 304 HE2 PHE 37 HE1 PHE 37 -11.582 21.713 -13.703 305 HZ PHE 37 HZ PHE 37 -11.109 23.953 -14.600 306 H LEU 38 H LEU 38 -11.953 17.474 -17.721 307 HA LEU 38 HA LEU 38 -9.653 18.057 -16.241 308 HB2 LEU 38 1HB LEU 38 -11.167 15.672 -16.959 309 HB3 LEU 38 2HB LEU 38 -9.454 15.362 -16.743 310 HG LEU 38 HG LEU 38 -10.638 14.964 -14.669 311 HD11 LEU 38 1HD1 LEU 38 -9.329 16.366 -13.201 312 HD12 LEU 38 2HD1 LEU 38 -9.043 17.512 -14.511 313 HD13 LEU 38 3HD1 LEU 38 -8.360 15.887 -14.594 314 HD21 LEU 38 3HD2 LEU 38 -11.793 16.759 -13.489 315 HD22 LEU 38 1HD2 LEU 38 -12.548 16.448 -15.052 316 HD23 LEU 38 2HD2 LEU 38 -11.502 17.851 -14.843 317 H LYS 39 H LYS 39 -9.988 16.605 -19.452 318 HA LYS 39 HA LYS 39 -7.167 16.216 -19.749 319 HB2 LYS 39 1HB LYS 39 -7.672 15.586 -22.047 320 HB3 LYS 39 2HB LYS 39 -8.792 14.808 -20.940 321 HG2 LYS 39 1HG LYS 39 -10.470 16.542 -21.485 322 HG3 LYS 39 2HG LYS 39 -9.349 17.203 -22.677 323 HD2 LYS 39 1HD LYS 39 -10.943 15.757 -23.776 324 HD3 LYS 39 2HD LYS 39 -9.341 15.018 -23.831 325 HE2 LYS 39 1HE LYS 39 -9.937 13.597 -21.929 326 HE3 LYS 39 2HE LYS 39 -11.537 14.335 -21.875 327 HZ1 LYS 39 3HZ LYS 39 -11.647 12.246 -23.026 328 HZ2 LYS 39 1HZ LYS 39 -10.415 12.712 -24.097 329 HZ3 LYS 39 2HZ LYS 39 -11.916 13.498 -24.141 330 H GLU 40 H GLU 40 -9.382 18.796 -20.408 331 HA GLU 40 HA GLU 40 -7.785 20.304 -22.177 332 HB2 GLU 40 1HB GLU 40 -10.244 20.627 -21.620 333 HB3 GLU 40 2HB GLU 40 -9.713 21.393 -20.133 334 HG2 GLU 40 1HG GLU 40 -10.225 23.055 -21.776 335 HG3 GLU 40 2HG GLU 40 -8.501 23.068 -21.436 336 H ASN 41 H ASN 41 -8.255 20.490 -18.677 337 HA ASN 41 HA ASN 41 -5.948 22.307 -18.501 338 HB2 ASN 41 1HB ASN 41 -8.376 21.928 -16.761 339 HB3 ASN 41 2HB ASN 41 -6.950 22.787 -16.182 340 HD21 ASN 41 2HD2 ASN 41 -9.638 22.827 -18.363 341 HD22 ASN 41 1HD2 ASN 41 -9.510 24.492 -18.826 342 H GLU 42 H GLU 42 -5.648 19.433 -18.700 343 HA GLU 42 HA GLU 42 -5.263 18.232 -16.183 344 HB2 GLU 42 1HB GLU 42 -3.873 16.574 -17.365 345 HB3 GLU 42 2HB GLU 42 -5.398 16.878 -18.186 346 HG2 GLU 42 1HG GLU 42 -4.362 18.096 -19.895 347 HG3 GLU 42 2HG GLU 42 -2.867 18.272 -18.974 348 H GLU 43 H GLU 43 -3.326 20.448 -17.977 349 HA GLU 43 HA GLU 43 -0.845 19.990 -16.683 350 HB2 GLU 43 1HB GLU 43 -1.004 21.203 -18.806 351 HB3 GLU 43 2HB GLU 43 -1.940 22.471 -18.029 352 HG2 GLU 43 1HG GLU 43 0.358 23.167 -18.362 353 HG3 GLU 43 2HG GLU 43 -0.020 23.052 -16.643 354 H VAL 44 H VAL 44 -3.684 21.883 -15.946 355 HA VAL 44 HA VAL 44 -2.307 23.276 -13.774 356 HB VAL 44 HB VAL 44 -5.168 23.635 -14.661 357 HG11 VAL 44 1HG1 VAL 44 -4.660 24.553 -12.476 358 HG12 VAL 44 2HG1 VAL 44 -4.917 25.854 -13.642 359 HG13 VAL 44 3HG1 VAL 44 -3.280 25.427 -13.142 360 HG21 VAL 44 3HG2 VAL 44 -2.717 25.093 -15.645 361 HG22 VAL 44 1HG2 VAL 44 -4.386 25.519 -16.027 362 HG23 VAL 44 2HG2 VAL 44 -3.716 23.984 -16.584 363 H ILE 45 H ILE 45 -5.026 21.100 -14.353 364 HA ILE 45 HA ILE 45 -5.846 21.038 -11.611 365 HB ILE 45 HB ILE 45 -6.579 19.158 -13.857 366 HG12 ILE 45 1HG1 ILE 45 -8.081 21.568 -12.822 367 HG13 ILE 45 2HG1 ILE 45 -7.133 21.544 -14.308 368 HG21 ILE 45 1HG2 ILE 45 -7.035 18.230 -11.645 369 HG22 ILE 45 2HG2 ILE 45 -8.534 18.620 -12.489 370 HG23 ILE 45 3HG2 ILE 45 -7.935 19.684 -11.215 371 HD11 ILE 45 3HD1 ILE 45 -8.607 19.847 -15.230 372 HD12 ILE 45 1HD1 ILE 45 -9.512 21.280 -14.743 373 HD13 ILE 45 2HD1 ILE 45 -9.541 19.834 -13.734 374 H ASP 46 H ASP 46 -5.519 19.455 -10.101 375 HA ASP 46 HA ASP 46 -3.809 17.186 -10.829 376 HB2 ASP 46 1HB ASP 46 -2.473 17.412 -8.872 377 HB3 ASP 46 2HB ASP 46 -2.535 19.015 -9.597 378 H GLN 47 H GLN 47 -3.855 15.615 -8.788 379 HA GLN 47 HA GLN 47 -6.442 14.565 -8.708 380 HB2 GLN 47 1HB GLN 47 -4.045 14.042 -6.956 381 HB3 GLN 47 2HB GLN 47 -5.524 13.093 -6.885 382 HG2 GLN 47 1HG GLN 47 -5.230 12.385 -9.175 383 HG3 GLN 47 2HG GLN 47 -3.812 13.419 -9.344 384 HE21 GLN 47 2HE2 GLN 47 -4.144 10.500 -9.638 385 HE22 GLN 47 1HE2 GLN 47 -2.991 9.794 -8.546 386 H LYS 48 H LYS 48 -4.730 16.608 -6.395 387 HA LYS 48 HA LYS 48 -6.710 16.313 -4.355 388 HB2 LYS 48 1HB LYS 48 -4.432 18.250 -4.707 389 HB3 LYS 48 2HB LYS 48 -5.503 18.272 -3.314 390 HG2 LYS 48 1HG LYS 48 -4.862 15.892 -2.888 391 HG3 LYS 48 2HG LYS 48 -3.656 16.051 -4.167 392 HD2 LYS 48 1HD LYS 48 -2.588 17.871 -2.924 393 HD3 LYS 48 2HD LYS 48 -3.806 17.714 -1.655 394 HE2 LYS 48 1HE LYS 48 -1.785 15.632 -2.478 395 HE3 LYS 48 2HE LYS 48 -1.778 16.577 -0.991 396 HZ1 LYS 48 3HZ LYS 48 -2.661 14.436 -0.494 397 HZ2 LYS 48 1HZ LYS 48 -3.754 14.505 -1.790 398 HZ3 LYS 48 2HZ LYS 48 -3.959 15.528 -0.454 399 H MET 49 H MET 49 -6.041 18.720 -6.851 400 HA MET 49 HA MET 49 -7.983 20.592 -6.220 401 HB2 MET 49 1HB MET 49 -6.300 20.772 -8.081 402 HB3 MET 49 2HB MET 49 -7.297 19.667 -9.015 403 HG2 MET 49 1HG MET 49 -9.152 21.256 -8.882 404 HG3 MET 49 2HG MET 49 -8.117 22.356 -7.976 405 HE1 MET 49 3HE MET 49 -5.320 22.080 -9.428 406 HE2 MET 49 1HE MET 49 -6.055 23.617 -8.976 407 HE3 MET 49 2HE MET 49 -5.442 23.383 -10.611 408 H ILE 50 H ILE 50 -8.243 17.483 -7.826 409 HA ILE 50 HA ILE 50 -10.900 17.675 -8.703 410 HB ILE 50 HB ILE 50 -9.284 15.252 -7.908 411 HG12 ILE 50 1HG1 ILE 50 -8.400 16.482 -9.824 412 HG13 ILE 50 2HG1 ILE 50 -9.081 14.944 -10.349 413 HG21 ILE 50 1HG2 ILE 50 -11.917 15.327 -9.378 414 HG22 ILE 50 2HG2 ILE 50 -11.680 14.766 -7.721 415 HG23 ILE 50 3HG2 ILE 50 -10.940 13.893 -9.063 416 HD11 ILE 50 3HD1 ILE 50 -11.099 16.091 -11.090 417 HD12 ILE 50 1HD1 ILE 50 -9.661 16.735 -11.880 418 HD13 ILE 50 2HD1 ILE 50 -10.421 17.631 -10.563 419 H GLU 51 H GLU 51 -9.615 16.167 -5.724 420 HA GLU 51 HA GLU 51 -12.203 15.641 -4.683 421 HB2 GLU 51 1HB GLU 51 -9.572 15.785 -3.212 422 HB3 GLU 51 2HB GLU 51 -11.068 15.114 -2.575 423 HG2 GLU 51 1HG GLU 51 -10.985 13.554 -4.615 424 HG3 GLU 51 2HG GLU 51 -9.292 14.035 -4.726 425 H LYS 52 H LYS 52 -9.973 18.333 -4.309 426 HA LYS 52 HA LYS 52 -11.345 19.631 -2.208 427 HB2 LYS 52 1HB LYS 52 -9.071 20.272 -2.823 428 HB3 LYS 52 2HB LYS 52 -9.620 20.789 -4.412 429 HG2 LYS 52 1HG LYS 52 -9.306 22.731 -3.073 430 HG3 LYS 52 2HG LYS 52 -11.042 22.499 -3.284 431 HD2 LYS 52 1HD LYS 52 -10.848 21.187 -1.035 432 HD3 LYS 52 2HD LYS 52 -9.357 22.111 -0.844 433 HE2 LYS 52 1HE LYS 52 -11.057 23.356 0.235 434 HE3 LYS 52 2HE LYS 52 -10.732 24.184 -1.288 435 HZ1 LYS 52 3HZ LYS 52 -12.992 22.333 -0.737 436 HZ2 LYS 52 1HZ LYS 52 -12.666 23.039 -2.241 437 HZ3 LYS 52 2HZ LYS 52 -13.100 24.015 -0.925 438 H SER 53 H SER 53 -11.958 19.363 -5.598 439 HA SER 53 HA SER 53 -14.105 21.375 -5.395 440 HB2 SER 53 1HB SER 53 -12.844 20.392 -7.953 441 HB3 SER 53 2HB SER 53 -13.797 21.854 -7.696 442 HG SER 53 HG SER 53 -11.148 21.299 -6.875 443 H LEU 54 H LEU 54 -13.899 18.339 -4.876 444 HA LEU 54 HA LEU 54 -15.331 16.929 -6.814 445 HB2 LEU 54 1HB LEU 54 -14.190 16.340 -4.384 446 HB3 LEU 54 2HB LEU 54 -15.897 16.170 -4.034 447 HG LEU 54 HG LEU 54 -15.110 14.028 -4.591 448 HD11 LEU 54 1HD1 LEU 54 -17.252 14.508 -5.575 449 HD12 LEU 54 2HD1 LEU 54 -16.314 13.437 -6.617 450 HD13 LEU 54 3HD1 LEU 54 -16.464 15.150 -7.018 451 HD21 LEU 54 3HD2 LEU 54 -14.020 13.594 -6.830 452 HD22 LEU 54 1HD2 LEU 54 -13.036 14.414 -5.619 453 HD23 LEU 54 2HD2 LEU 54 -13.769 15.337 -6.929 454 H ASN 55 H ASN 55 -16.382 18.758 -4.013 455 HA ASN 55 HA ASN 55 -19.123 18.340 -4.114 456 HB2 ASN 55 1HB ASN 55 -19.350 20.493 -2.941 457 HB3 ASN 55 2HB ASN 55 -18.047 19.523 -2.265 458 HD21 ASN 55 2HD2 ASN 55 -18.599 22.446 -2.279 459 HD22 ASN 55 1HD2 ASN 55 -17.146 23.176 -2.884 460 H LYS 56 H LYS 56 -17.176 20.724 -5.867 461 HA LYS 56 HA LYS 56 -19.402 21.953 -7.151 462 HB2 LYS 56 1HB LYS 56 -16.436 22.008 -7.690 463 HB3 LYS 56 2HB LYS 56 -17.590 22.880 -8.688 464 HG2 LYS 56 1HG LYS 56 -17.234 23.275 -5.723 465 HG3 LYS 56 2HG LYS 56 -16.529 24.295 -6.979 466 HD2 LYS 56 1HD LYS 56 -18.808 24.794 -7.804 467 HD3 LYS 56 2HD LYS 56 -19.472 23.845 -6.474 468 HE2 LYS 56 1HE LYS 56 -19.561 26.163 -5.872 469 HE3 LYS 56 2HE LYS 56 -18.329 25.376 -4.886 470 HZ1 LYS 56 3HZ LYS 56 -16.629 26.276 -6.336 471 HZ2 LYS 56 1HZ LYS 56 -17.591 27.527 -5.723 472 HZ3 LYS 56 2HZ LYS 56 -17.801 27.003 -7.322 473 H LEU 57 H LEU 57 -16.961 19.603 -8.218 474 HA LEU 57 HA LEU 57 -17.880 19.277 -10.837 475 HB2 LEU 57 1HB LEU 57 -16.562 17.245 -9.034 476 HB3 LEU 57 2HB LEU 57 -16.718 17.099 -10.774 477 HG LEU 57 HG LEU 57 -15.154 19.262 -9.356 478 HD11 LEU 57 1HD1 LEU 57 -13.179 18.085 -10.187 479 HD12 LEU 57 2HD1 LEU 57 -14.209 16.805 -10.827 480 HD13 LEU 57 3HD1 LEU 57 -14.115 17.074 -9.086 481 HD21 LEU 57 3HD2 LEU 57 -14.293 19.769 -11.590 482 HD22 LEU 57 1HD2 LEU 57 -16.041 19.989 -11.511 483 HD23 LEU 57 2HD2 LEU 57 -15.367 18.554 -12.283 484 H TYR 58 H TYR 58 -18.821 17.632 -7.857 485 HA TYR 58 HA TYR 58 -20.579 15.777 -9.104 486 HB2 TYR 58 1HB TYR 58 -19.484 15.649 -6.782 487 HB3 TYR 58 2HB TYR 58 -20.782 16.711 -6.250 488 HD1 TYR 58 HD1 TYR 58 -20.478 13.646 -8.344 489 HD2 TYR 58 HD2 TYR 58 -22.509 15.620 -5.177 490 HE1 TYR 58 HE1 TYR 58 -21.906 11.674 -8.050 491 HE2 TYR 58 HE2 TYR 58 -23.949 13.652 -4.864 492 HH TYR 58 HH TYR 58 -24.749 11.728 -6.244 493 H GLU 59 H GLU 59 -21.001 18.931 -7.582 494 HA GLU 59 HA GLU 59 -23.798 19.111 -7.727 495 HB2 GLU 59 1HB GLU 59 -22.322 20.648 -6.458 496 HB3 GLU 59 2HB GLU 59 -21.746 21.321 -7.974 497 HG2 GLU 59 1HG GLU 59 -23.981 22.153 -8.467 498 HG3 GLU 59 2HG GLU 59 -24.579 21.448 -6.962 499 H TYR 60 H TYR 60 -21.261 19.868 -10.021 500 HA TYR 60 HA TYR 60 -22.817 21.062 -12.026 501 HB2 TYR 60 1HB TYR 60 -20.444 21.327 -12.060 502 HB3 TYR 60 2HB TYR 60 -20.184 19.589 -12.093 503 HD1 TYR 60 HD2 TYR 60 -21.623 22.373 -14.104 504 HD2 TYR 60 HD1 TYR 60 -19.866 18.498 -14.125 505 HE1 TYR 60 HE2 TYR 60 -21.493 22.449 -16.558 506 HE2 TYR 60 HE1 TYR 60 -19.730 18.566 -16.581 507 HH TYR 60 HH TYR 60 -20.739 19.681 -18.443 508 H ILE 61 H ILE 61 -21.777 17.672 -11.632 509 HA ILE 61 HA ILE 61 -22.814 16.896 -14.157 510 HB ILE 61 HB ILE 61 -22.303 14.611 -13.526 511 HG12 ILE 61 1HG1 ILE 61 -21.692 15.740 -10.781 512 HG13 ILE 61 2HG1 ILE 61 -23.043 14.682 -11.178 513 HG21 ILE 61 1HG2 ILE 61 -20.202 16.607 -12.695 514 HG22 ILE 61 2HG2 ILE 61 -20.494 15.992 -14.321 515 HG23 ILE 61 3HG2 ILE 61 -19.891 14.911 -13.065 516 HD11 ILE 61 3HD1 ILE 61 -21.491 12.903 -11.753 517 HD12 ILE 61 1HD1 ILE 61 -21.230 13.472 -10.104 518 HD13 ILE 61 2HD1 ILE 61 -20.130 13.967 -11.393 519 H GLU 62 H GLU 62 -24.212 16.921 -10.933 520 HA GLU 62 HA GLU 62 -26.404 15.215 -11.761 521 HB2 GLU 62 1HB GLU 62 -26.042 16.722 -9.169 522 HB3 GLU 62 2HB GLU 62 -27.269 15.505 -9.494 523 HG2 GLU 62 1HG GLU 62 -25.258 13.974 -10.019 524 HG3 GLU 62 2HG GLU 62 -24.331 15.174 -9.121 525 H GLN 63 H GLN 63 -25.734 18.606 -11.497 526 HA GLN 63 HA GLN 63 -28.487 19.415 -11.564 527 HB2 GLN 63 1HB GLN 63 -27.730 21.595 -11.535 528 HB3 GLN 63 2HB GLN 63 -26.384 20.763 -10.774 529 HG2 GLN 63 1HG GLN 63 -25.236 20.743 -12.983 530 HG3 GLN 63 2HG GLN 63 -26.551 21.730 -13.621 531 HE21 GLN 63 2HE2 GLN 63 -25.067 21.940 -10.435 532 HE22 GLN 63 1HE2 GLN 63 -24.441 23.537 -10.634 533 H SER 64 H SER 64 -29.389 20.682 -13.413 534 HA SER 64 HA SER 64 -29.397 19.046 -15.702 535 HB2 SER 64 1HB SER 64 -30.765 21.009 -16.653 536 HB3 SER 64 2HB SER 64 -31.394 20.196 -15.217 537 HG SER 64 HG SER 64 -29.859 22.588 -15.234 538 H LYS 65 H LYS 65 -27.977 18.956 -17.301 539 HA LYS 65 HA LYS 65 -25.941 20.924 -17.687 540 HB2 LYS 65 1HB LYS 65 -25.987 18.327 -18.188 541 HB3 LYS 65 2HB LYS 65 -26.618 18.845 -19.741 542 HG2 LYS 65 1HG LYS 65 -24.001 19.773 -18.573 543 HG3 LYS 65 2HG LYS 65 -24.175 18.443 -19.715 544 HD2 LYS 65 1HD LYS 65 -25.173 20.024 -21.339 545 HD3 LYS 65 2HD LYS 65 -24.878 21.338 -20.197 546 HE2 LYS 65 1HE LYS 65 -23.110 21.310 -21.824 547 HE3 LYS 65 2HE LYS 65 -22.462 20.788 -20.268 548 HZ1 LYS 65 3HZ LYS 65 -23.257 18.989 -22.496 549 HZ2 LYS 65 1HZ LYS 65 -22.616 18.496 -21.004 550 HZ3 LYS 65 2HZ LYS 65 -21.666 19.397 -22.069 551 H ASN 66 H ASN 66 -29.026 20.165 -19.096 552 HA ASN 66 HA ASN 66 -28.783 22.108 -21.234 553 HB2 ASN 66 1HB ASN 66 -31.136 21.495 -21.738 554 HB3 ASN 66 2HB ASN 66 -30.083 20.083 -21.667 555 HD21 ASN 66 2HD2 ASN 66 -33.013 20.409 -21.287 556 HD22 ASN 66 1HD2 ASN 66 -33.345 19.699 -19.736 557 H CYS 67 H CYS 67 -31.317 23.211 -21.240 558 HA CYS 67 HA CYS 67 -31.905 24.363 -18.685 559 HB2 CYS 67 1HB CYS 67 -31.251 26.558 -18.995 560 HB3 CYS 67 2HB CYS 67 -29.922 25.706 -19.759 561 H SER 68 H SER 68 -33.778 25.868 -18.884 562 HA SER 68 HA SER 68 -35.757 24.455 -20.387 563 HB2 SER 68 1HB SER 68 -36.176 25.502 -18.152 564 HB3 SER 68 2HB SER 68 -36.076 27.086 -18.917 565 HG SER 68 HG SER 68 -37.952 25.033 -19.533 566 H TYR 69 H TYR 69 -33.869 27.277 -20.948 567 HA TYR 69 HA TYR 69 -35.447 28.532 -22.927 568 HB2 TYR 69 1HB TYR 69 -33.291 29.257 -21.588 569 HB3 TYR 69 2HB TYR 69 -32.470 28.649 -23.013 570 HD1 TYR 69 HD1 TYR 69 -35.044 31.081 -21.900 571 HD2 TYR 69 HD2 TYR 69 -32.307 29.959 -24.959 572 HE1 TYR 69 HE1 TYR 69 -35.463 33.210 -23.048 573 HE2 TYR 69 HE2 TYR 69 -32.722 32.091 -26.110 574 HH TYR 69 HH TYR 69 -34.332 33.829 -26.248 575 H CYS 70 H CYS 70 -33.840 25.572 -23.022 576 HA CYS 70 HA CYS 70 -34.046 25.576 -25.959 577 HB2 CYS 70 1HB CYS 70 -32.031 24.147 -26.118 578 HB3 CYS 70 2HB CYS 70 -31.683 25.759 -25.504 579 H SER 71 H SER 71 -35.181 24.254 -23.210 580 HA SER 71 HA SER 71 -35.733 21.701 -24.552 581 HB2 SER 71 1HB SER 71 -35.470 22.170 -21.569 582 HB3 SER 71 2HB SER 71 -35.812 20.625 -22.353 583 HG SER 71 HG SER 71 -33.738 20.975 -23.482 584 H GLU 72 H GLU 72 -37.846 21.002 -24.550 585 HA GLU 72 HA GLU 72 -39.809 23.065 -24.086 586 HB2 GLU 72 1HB GLU 72 -39.763 21.476 -26.074 587 HB3 GLU 72 2HB GLU 72 -40.362 20.245 -24.970 588 HG2 GLU 72 1HG GLU 72 -42.162 21.289 -26.266 589 HG3 GLU 72 2HG GLU 72 -42.347 21.545 -24.530 590 H ASP 73 H ASP 73 -38.911 22.706 -21.763 591 HA ASP 73 HA ASP 73 -41.132 21.625 -20.267 592 HB2 ASP 73 1HB ASP 73 -39.741 19.655 -20.278 593 HB3 ASP 73 2HB ASP 73 -38.311 20.599 -19.878 594 H GLU 74 H GLU 74 -41.621 23.044 -18.732 595 HA GLU 74 HA GLU 74 -39.642 25.136 -18.194 596 HB2 GLU 74 1HB GLU 74 -42.631 25.125 -17.777 597 HB3 GLU 74 2HB GLU 74 -41.562 26.487 -17.456 598 HG2 GLU 74 1HG GLU 74 -40.893 26.437 -19.854 599 HG3 GLU 74 2HG GLU 74 -42.136 25.216 -20.122 600 H ASN 75 H ASN 75 -40.635 22.343 -16.799 601 HA ASN 75 HA ASN 75 -40.506 23.337 -14.058 602 HB2 ASN 75 1HB ASN 75 -42.043 21.452 -14.684 603 HB3 ASN 75 2HB ASN 75 -40.624 20.468 -15.027 604 HD21 ASN 75 2HD2 ASN 75 -41.283 18.974 -13.455 605 HD22 ASN 75 1HD2 ASN 75 -41.091 19.300 -11.759 606 H CYS 76 H CYS 76 -38.369 24.192 -15.112 607 HA CYS 76 HA CYS 76 -36.220 22.269 -15.284 608 HB2 CYS 76 1HB CYS 76 -36.469 24.158 -16.884 609 HB3 CYS 76 2HB CYS 76 -36.181 25.283 -15.564 610 HG CYS 76 HG CYS 76 -33.800 25.411 -16.682 611 H ASN 77 H ASN 77 -34.775 21.837 -13.753 612 HA ASN 77 HA ASN 77 -35.040 23.024 -11.141 613 HB2 ASN 77 1HB ASN 77 -34.656 20.630 -11.352 614 HB3 ASN 77 2HB ASN 77 -33.154 20.914 -12.222 615 HD21 ASN 77 2HD2 ASN 77 -34.743 21.007 -9.127 616 HD22 ASN 77 1HD2 ASN 77 -33.300 21.142 -8.170 617 H ASN 78 H ASN 78 -33.188 23.637 -13.906 618 HA ASN 78 HA ASN 78 -30.720 24.461 -12.898 619 HB2 ASN 78 1HB ASN 78 -31.115 24.125 -15.276 620 HB3 ASN 78 2HB ASN 78 -32.250 25.467 -15.303 621 HD21 ASN 78 2HD2 ASN 78 -31.142 26.584 -16.821 622 HD22 ASN 78 1HD2 ASN 78 -29.621 27.350 -16.524 623 H LEU 79 H LEU 79 -29.953 26.303 -12.032 624 HA LEU 79 HA LEU 79 -31.873 28.152 -10.925 625 HB2 LEU 79 1HB LEU 79 -28.863 28.095 -10.720 626 HB3 LEU 79 2HB LEU 79 -29.923 29.130 -9.786 627 HG LEU 79 HG LEU 79 -29.868 26.113 -9.639 628 HD11 LEU 79 1HD1 LEU 79 -27.845 27.117 -8.709 629 HD12 LEU 79 2HD1 LEU 79 -28.865 26.441 -7.439 630 HD13 LEU 79 3HD1 LEU 79 -28.830 28.184 -7.707 631 HD21 LEU 79 3HD2 LEU 79 -31.373 28.153 -8.004 632 HD22 LEU 79 1HD2 LEU 79 -31.321 26.418 -7.686 633 HD23 LEU 79 2HD2 LEU 79 -32.073 27.021 -9.162 634 H LEU 80 H LEU 80 -28.941 28.484 -12.927 635 HA LEU 80 HA LEU 80 -29.713 31.178 -13.669 636 HB2 LEU 80 1HB LEU 80 -27.318 29.463 -14.300 637 HB3 LEU 80 2HB LEU 80 -27.600 30.982 -15.120 638 HG LEU 80 HG LEU 80 -25.991 31.283 -13.346 639 HD11 LEU 80 1HD1 LEU 80 -27.037 33.101 -12.132 640 HD12 LEU 80 2HD1 LEU 80 -28.633 32.526 -12.617 641 HD13 LEU 80 3HD1 LEU 80 -27.503 33.126 -13.832 642 HD21 LEU 80 3HD2 LEU 80 -26.633 29.447 -11.892 643 HD22 LEU 80 1HD2 LEU 80 -28.131 30.280 -11.475 644 HD23 LEU 80 2HD2 LEU 80 -26.578 30.964 -10.993 645 H GLU 81 H GLU 81 -31.680 30.597 -14.742 646 HA GLU 81 HA GLU 81 -31.637 28.778 -16.932 647 HB2 GLU 81 1HB GLU 81 -33.641 29.183 -15.519 648 HB3 GLU 81 2HB GLU 81 -33.770 30.792 -16.217 649 HG2 GLU 81 1HG GLU 81 -35.242 28.958 -17.187 650 HG3 GLU 81 2HG GLU 81 -34.341 29.970 -18.316 651 H GLY 82 H GLY 82 -31.708 29.166 -19.087 652 HA2 GLY 82 1HA GLY 82 -31.436 30.455 -21.032 653 HA3 GLY 82 2HA GLY 82 -31.131 31.872 -20.031 654 H TYR 83 H TYR 83 -29.375 29.720 -18.509 655 HA TYR 83 HA TYR 83 -27.006 30.005 -20.241 656 HB2 TYR 83 1HB TYR 83 -27.064 30.052 -17.214 657 HB3 TYR 83 2HB TYR 83 -25.643 30.242 -18.232 658 HD1 TYR 83 HD1 TYR 83 -25.333 32.320 -19.541 659 HD2 TYR 83 HD2 TYR 83 -28.519 31.876 -16.763 660 HE1 TYR 83 HE1 TYR 83 -25.639 34.758 -19.508 661 HE2 TYR 83 HE2 TYR 83 -28.837 34.309 -16.728 662 HH TYR 83 HH TYR 83 -27.505 36.334 -17.170 663 H HIS 84 H HIS 84 -25.290 28.382 -19.706 664 HA HIS 84 HA HIS 84 -26.321 25.920 -18.446 665 HB2 HIS 84 1HB HIS 84 -24.573 26.127 -20.908 666 HB3 HIS 84 2HB HIS 84 -24.753 24.650 -19.977 667 HD1 HIS 84 HD1 HIS 84 -25.827 23.356 -21.923 668 HD2 HIS 84 HD2 HIS 84 -27.918 26.767 -20.819 669 HE1 HIS 84 HE1 HIS 84 -27.964 23.373 -23.289 670 HA PRO 85 HA PRO 85 -22.804 26.338 -15.848 671 HB2 PRO 85 1HB PRO 85 -22.386 23.749 -15.143 672 HB3 PRO 85 2HB PRO 85 -23.731 24.714 -14.527 673 HG2 PRO 85 1HG PRO 85 -23.700 22.680 -16.721 674 HG3 PRO 85 2HG PRO 85 -24.910 22.943 -15.450 675 HD2 PRO 85 1HD PRO 85 -25.222 23.830 -18.000 676 HD3 PRO 85 2HD PRO 85 -25.919 24.661 -16.594 677 H LYS 86 H LYS 86 -20.633 26.385 -15.981 678 HA LYS 86 HA LYS 86 -19.275 24.564 -17.840 679 HB2 LYS 86 1HB LYS 86 -19.548 26.794 -18.898 680 HB3 LYS 86 2HB LYS 86 -18.714 27.524 -17.532 681 HG2 LYS 86 1HG LYS 86 -16.825 25.840 -18.157 682 HG3 LYS 86 2HG LYS 86 -17.642 25.827 -19.719 683 HD2 LYS 86 1HD LYS 86 -16.660 28.294 -18.298 684 HD3 LYS 86 2HD LYS 86 -15.814 27.476 -19.604 685 HE2 LYS 86 1HE LYS 86 -18.579 28.608 -19.848 686 HE3 LYS 86 2HE LYS 86 -17.121 29.484 -20.291 687 HZ1 LYS 86 3HZ LYS 86 -16.621 27.838 -21.945 688 HZ2 LYS 86 1HZ LYS 86 -18.202 28.396 -22.197 689 HZ3 LYS 86 2HZ LYS 86 -17.943 26.883 -21.474 690 H LEU 87 H LEU 87 -17.401 23.725 -17.069 691 HA LEU 87 HA LEU 87 -16.671 24.327 -14.337 692 HB2 LEU 87 1HB LEU 87 -15.459 22.398 -16.320 693 HB3 LEU 87 2HB LEU 87 -15.026 22.506 -14.626 694 HG LEU 87 HG LEU 87 -17.720 21.689 -15.714 695 HD11 LEU 87 1HD1 LEU 87 -15.566 20.097 -14.331 696 HD12 LEU 87 2HD1 LEU 87 -16.002 19.993 -16.037 697 HD13 LEU 87 3HD1 LEU 87 -17.156 19.495 -14.800 698 HD21 LEU 87 3HD2 LEU 87 -16.722 21.856 -12.871 699 HD22 LEU 87 1HD2 LEU 87 -18.273 21.190 -13.385 700 HD23 LEU 87 2HD2 LEU 87 -17.931 22.906 -13.614 701 H VAL 88 H VAL 88 -15.045 25.603 -13.710 702 HA VAL 88 HA VAL 88 -13.005 26.369 -15.687 703 HB VAL 88 HB VAL 88 -12.994 28.673 -14.684 704 HG11 VAL 88 1HG1 VAL 88 -15.531 27.810 -16.060 705 HG12 VAL 88 2HG1 VAL 88 -14.016 28.263 -16.845 706 HG13 VAL 88 3HG1 VAL 88 -14.940 29.467 -15.946 707 HG21 VAL 88 3HG2 VAL 88 -14.145 28.228 -12.606 708 HG22 VAL 88 1HG2 VAL 88 -15.602 27.753 -13.483 709 HG23 VAL 88 2HG2 VAL 88 -15.043 29.425 -13.542 710 H VAL 89 H VAL 89 -10.956 26.859 -14.816 711 HA VAL 89 HA VAL 89 -10.549 25.714 -12.161 712 HB VAL 89 HB VAL 89 -9.196 24.709 -13.881 713 HG11 VAL 89 1HG1 VAL 89 -9.152 26.583 -15.465 714 HG12 VAL 89 2HG1 VAL 89 -7.544 25.918 -15.176 715 HG13 VAL 89 3HG1 VAL 89 -8.019 27.435 -14.412 716 HG21 VAL 89 3HG2 VAL 89 -6.974 24.998 -12.917 717 HG22 VAL 89 1HG2 VAL 89 -8.212 24.914 -11.664 718 HG23 VAL 89 2HG2 VAL 89 -7.512 26.471 -12.108 719 H ASN 90 H ASN 90 -10.385 27.017 -10.491 720 HA ASN 90 HA ASN 90 -9.167 29.675 -10.871 721 HB2 ASN 90 1HB ASN 90 -11.504 28.876 -9.128 722 HB3 ASN 90 2HB ASN 90 -10.615 30.376 -8.895 723 HD21 ASN 90 2HD2 ASN 90 -13.412 29.889 -9.632 724 HD22 ASN 90 1HD2 ASN 90 -13.661 30.749 -11.109 725 H GLY 91 H GLY 91 -7.134 29.249 -10.182 726 HA2 GLY 91 1HA GLY 91 -5.425 28.879 -8.691 727 HA3 GLY 91 2HA GLY 91 -6.622 28.960 -7.408 728 H ARG 92 H ARG 92 -6.939 27.164 -6.274 729 HA ARG 92 HA ARG 92 -6.235 24.593 -7.529 730 HB2 ARG 92 1HB ARG 92 -6.082 25.496 -4.661 731 HB3 ARG 92 2HB ARG 92 -6.082 23.790 -5.095 732 HG2 ARG 92 1HG ARG 92 -4.100 25.815 -6.108 733 HG3 ARG 92 2HG ARG 92 -3.821 24.715 -4.755 734 HD2 ARG 92 1HD ARG 92 -3.763 22.842 -6.120 735 HD3 ARG 92 2HD ARG 92 -4.675 23.628 -7.410 736 HE ARG 92 HE ARG 92 -2.276 25.005 -7.136 737 HH11 ARG 92 1HH1 ARG 92 -3.251 21.728 -7.995 738 HH12 ARG 92 2HH1 ARG 92 -1.963 21.543 -9.145 739 HH21 ARG 92 1HH2 ARG 92 -0.609 24.725 -8.624 740 HH22 ARG 92 2HH2 ARG 92 -0.461 23.230 -9.497 741 H SER 93 H SER 93 -8.799 26.281 -7.339 742 HA SER 93 HA SER 93 -10.492 24.028 -6.516 743 HB2 SER 93 1HB SER 93 -12.229 25.770 -5.890 744 HB3 SER 93 2HB SER 93 -10.820 25.685 -4.833 745 HG SER 93 HG SER 93 -10.517 27.423 -6.941 746 H ILE 94 H ILE 94 -11.879 23.318 -7.970 747 HA ILE 94 HA ILE 94 -12.102 24.711 -10.521 748 HB ILE 94 HB ILE 94 -13.128 21.993 -9.670 749 HG12 ILE 94 1HG1 ILE 94 -10.765 22.640 -11.441 750 HG13 ILE 94 2HG1 ILE 94 -10.612 22.357 -9.710 751 HG21 ILE 94 1HG2 ILE 94 -14.427 22.933 -11.507 752 HG22 ILE 94 2HG2 ILE 94 -13.443 21.579 -12.062 753 HG23 ILE 94 3HG2 ILE 94 -12.946 23.233 -12.415 754 HD11 ILE 94 3HD1 ILE 94 -11.568 20.396 -11.787 755 HD12 ILE 94 1HD1 ILE 94 -11.557 20.100 -10.046 756 HD13 ILE 94 2HD1 ILE 94 -10.037 20.362 -10.903 757 H ASP 95 H ASP 95 -13.926 25.734 -11.174 758 HA ASP 95 HA ASP 95 -16.108 25.860 -9.210 759 HB2 ASP 95 1HB ASP 95 -14.364 27.887 -9.732 760 HB3 ASP 95 2HB ASP 95 -15.646 28.242 -10.883 761 H ILE 96 H ILE 96 -17.999 27.167 -10.312 762 HA ILE 96 HA ILE 96 -18.482 25.953 -12.951 763 HB ILE 96 HB ILE 96 -20.514 26.145 -10.722 764 HG12 ILE 96 1HG1 ILE 96 -19.198 23.661 -11.838 765 HG13 ILE 96 2HG1 ILE 96 -18.669 24.460 -10.359 766 HG21 ILE 96 1HG2 ILE 96 -21.890 24.744 -12.209 767 HG22 ILE 96 2HG2 ILE 96 -20.645 24.871 -13.452 768 HG23 ILE 96 3HG2 ILE 96 -21.513 26.313 -12.922 769 HD11 ILE 96 3HD1 ILE 96 -20.848 24.062 -9.363 770 HD12 ILE 96 1HD1 ILE 96 -20.089 22.559 -9.881 771 HD13 ILE 96 2HD1 ILE 96 -21.387 23.271 -10.843 772 H GLU 97 H GLU 97 -18.482 27.654 -14.256 773 HA GLU 97 HA GLU 97 -19.918 30.090 -13.485 774 HB2 GLU 97 1HB GLU 97 -18.109 29.487 -15.838 775 HB3 GLU 97 2HB GLU 97 -18.920 31.025 -15.584 776 HG2 GLU 97 1HG GLU 97 -16.888 29.788 -13.747 777 HG3 GLU 97 2HG GLU 97 -16.584 31.091 -14.892 778 H TYR 98 H TYR 98 -21.010 31.088 -15.599 779 HA TYR 98 HA TYR 98 -22.558 28.966 -16.909 780 HB2 TYR 98 1HB TYR 98 -23.569 31.278 -15.318 781 HB3 TYR 98 2HB TYR 98 -24.498 30.747 -16.718 782 HD1 TYR 98 HD1 TYR 98 -23.360 29.870 -13.353 783 HD2 TYR 98 HD2 TYR 98 -25.614 28.592 -16.732 784 HE1 TYR 98 HE1 TYR 98 -24.370 28.089 -11.991 785 HE2 TYR 98 HE2 TYR 98 -26.635 26.805 -15.373 786 HH TYR 98 HH TYR 98 -26.048 25.497 -13.294 787 H TYR 99 H TYR 99 -22.721 29.175 -19.008 788 HA TYR 99 HA TYR 99 -22.174 31.809 -20.206 789 HB2 TYR 99 1HB TYR 99 -21.544 30.534 -22.271 790 HB3 TYR 99 2HB TYR 99 -20.474 30.252 -20.905 791 HD1 TYR 99 HD2 TYR 99 -23.125 28.765 -23.002 792 HD2 TYR 99 HD1 TYR 99 -20.264 28.087 -19.928 793 HE1 TYR 99 HE2 TYR 99 -23.436 26.340 -23.255 794 HE2 TYR 99 HE1 TYR 99 -20.559 25.669 -20.171 795 HH TYR 99 HH TYR 99 -22.239 24.094 -20.990 796 H GLU 100 H GLU 100 -23.476 32.427 -22.011 797 HA GLU 100 HA GLU 100 -26.207 31.859 -21.573 798 HB2 GLU 100 1HB GLU 100 -24.819 33.296 -23.836 799 HB3 GLU 100 2HB GLU 100 -26.568 33.187 -23.682 800 HG2 GLU 100 1HG GLU 100 -26.283 34.223 -21.383 801 HG3 GLU 100 2HG GLU 100 -24.626 34.582 -21.866 802 H CYS 101 H CYS 101 -27.517 30.411 -22.370 803 HA CYS 101 HA CYS 101 -26.884 28.116 -23.679 804 HB2 CYS 101 1HB CYS 101 -29.084 28.610 -22.670 805 HB3 CYS 101 2HB CYS 101 -29.454 29.689 -24.008 806 HA PRO 102 HA PRO 102 -25.402 29.487 -27.631 807 HB2 PRO 102 1HB PRO 102 -25.454 26.993 -28.823 808 HB3 PRO 102 2HB PRO 102 -24.139 27.620 -27.825 809 HG2 PRO 102 1HG PRO 102 -26.365 25.775 -27.090 810 HG3 PRO 102 2HG PRO 102 -24.670 25.745 -26.580 811 HD2 PRO 102 1HD PRO 102 -26.622 26.652 -24.972 812 HD3 PRO 102 2HD PRO 102 -24.996 27.367 -24.968 813 H VAL 103 H VAL 103 -28.483 28.053 -27.116 814 HA VAL 103 HA VAL 103 -29.381 27.974 -29.800 815 HB VAL 103 HB VAL 103 -30.483 26.864 -27.762 816 HG11 VAL 103 1HG1 VAL 103 -31.753 29.589 -27.526 817 HG12 VAL 103 2HG1 VAL 103 -30.674 28.836 -26.350 818 HG13 VAL 103 3HG1 VAL 103 -32.260 28.135 -26.668 819 HG21 VAL 103 3HG2 VAL 103 -32.704 26.951 -28.789 820 HG22 VAL 103 1HG2 VAL 103 -31.430 26.790 -30.002 821 HG23 VAL 103 2HG2 VAL 103 -32.207 28.351 -29.741 822 H LYS 104 H LYS 104 -28.827 30.551 -27.595 823 HA LYS 104 HA LYS 104 -30.619 32.467 -28.668 824 HB2 LYS 104 1HB LYS 104 -27.981 32.828 -27.244 825 HB3 LYS 104 2HB LYS 104 -29.062 34.147 -27.662 826 HG2 LYS 104 1HG LYS 104 -30.815 33.008 -26.263 827 HG3 LYS 104 2HG LYS 104 -29.538 31.918 -25.709 828 HD2 LYS 104 1HD LYS 104 -28.250 33.821 -24.897 829 HD3 LYS 104 2HD LYS 104 -29.499 34.926 -25.471 830 HE2 LYS 104 1HE LYS 104 -31.095 33.707 -23.935 831 HE3 LYS 104 2HE LYS 104 -29.681 32.901 -23.253 832 HZ1 LYS 104 3HZ LYS 104 -30.255 35.814 -23.255 833 HZ2 LYS 104 1HZ LYS 104 -28.768 35.152 -22.772 834 HZ3 LYS 104 2HZ LYS 104 -30.187 34.786 -21.909 835 H ARG 105 H ARG 105 -27.665 31.133 -29.768 836 HA ARG 105 HA ARG 105 -26.996 33.273 -31.567 837 HB2 ARG 105 1HB ARG 105 -25.312 31.708 -30.595 838 HB3 ARG 105 2HB ARG 105 -26.030 30.407 -31.532 839 HG2 ARG 105 1HG ARG 105 -25.421 31.532 -33.597 840 HG3 ARG 105 2HG ARG 105 -24.731 32.871 -32.674 841 HD2 ARG 105 1HD ARG 105 -23.148 31.313 -31.630 842 HD3 ARG 105 2HD ARG 105 -23.817 29.998 -32.594 843 HE ARG 105 HE ARG 105 -22.984 32.067 -34.312 844 HH11 ARG 105 1HH1 ARG 105 -21.666 29.660 -32.138 845 HH12 ARG 105 2HH1 ARG 105 -20.172 29.498 -33.012 846 HH21 ARG 105 1HH2 ARG 105 -21.004 31.869 -35.468 847 HH22 ARG 105 2HH2 ARG 105 -19.800 30.750 -34.906 848 H LYS 106 H LYS 106 -28.767 33.627 -32.839 849 HA LYS 106 HA LYS 106 -30.056 31.403 -34.190 850 HB2 LYS 106 1HB LYS 106 -30.682 34.356 -34.334 851 HB3 LYS 106 2HB LYS 106 -31.695 33.046 -34.922 852 HG2 LYS 106 1HG LYS 106 -30.986 33.594 -32.047 853 HG3 LYS 106 2HG LYS 106 -32.536 33.913 -32.824 854 HD2 LYS 106 1HD LYS 106 -31.277 31.189 -32.507 855 HD3 LYS 106 2HD LYS 106 -32.546 31.844 -31.472 856 HE2 LYS 106 1HE LYS 106 -32.784 31.392 -34.445 857 HE3 LYS 106 2HE LYS 106 -33.408 30.308 -33.204 858 HZ1 LYS 106 3HZ LYS 106 -34.269 33.107 -33.714 859 HZ2 LYS 106 1HZ LYS 106 -34.807 32.160 -32.410 860 HZ3 LYS 106 2HZ LYS 106 -35.164 31.697 -34.001 Start of MODEL 12 1 HA MET 1 HA MET 1 -15.766 -16.826 -18.385 2 HB2 MET 1 1HB MET 1 -16.395 -16.658 -16.024 3 HB3 MET 1 2HB MET 1 -17.060 -18.120 -16.739 4 HG2 MET 1 1HG MET 1 -15.257 -19.427 -15.718 5 HG3 MET 1 2HG MET 1 -14.617 -17.958 -14.985 6 HE1 MET 1 2HE MET 1 -15.329 -20.637 -13.397 7 HE2 MET 1 3HE MET 1 -16.119 -19.984 -11.962 8 HE3 MET 1 1HE MET 1 -14.675 -19.202 -12.608 9 H GLU 2 H GLU 2 -14.890 -14.948 -17.372 10 HA GLU 2 HA GLU 2 -12.067 -15.255 -16.581 11 HB2 GLU 2 1HB GLU 2 -12.420 -14.076 -18.738 12 HB3 GLU 2 2HB GLU 2 -13.383 -12.871 -17.895 13 HG2 GLU 2 1HG GLU 2 -11.442 -12.223 -16.578 14 HG3 GLU 2 2HG GLU 2 -10.471 -13.447 -17.396 15 HA PRO 3 HA PRO 3 -14.336 -13.796 -12.885 16 HB2 PRO 3 1HB PRO 3 -12.239 -15.179 -11.397 17 HB3 PRO 3 2HB PRO 3 -13.979 -15.480 -11.413 18 HG2 PRO 3 1HG PRO 3 -12.191 -17.196 -12.508 19 HG3 PRO 3 2HG PRO 3 -13.836 -16.987 -13.142 20 HD2 PRO 3 1HD PRO 3 -11.257 -15.835 -14.149 21 HD3 PRO 3 2HD PRO 3 -12.613 -16.531 -15.063 22 H ILE 4 H ILE 4 -13.900 -11.670 -12.721 23 HA ILE 4 HA ILE 4 -11.206 -10.743 -12.133 24 HB ILE 4 HB ILE 4 -13.818 -9.226 -12.329 25 HG12 ILE 4 1HG1 ILE 4 -13.126 -10.193 -14.469 26 HG13 ILE 4 2HG1 ILE 4 -12.947 -8.442 -14.498 27 HG21 ILE 4 1HG2 ILE 4 -11.001 -8.165 -12.139 28 HG22 ILE 4 2HG2 ILE 4 -12.234 -8.066 -10.883 29 HG23 ILE 4 3HG2 ILE 4 -12.452 -7.196 -12.402 30 HD11 ILE 4 3HD1 ILE 4 -10.719 -10.420 -14.066 31 HD12 ILE 4 1HD1 ILE 4 -10.556 -8.667 -14.150 32 HD13 ILE 4 2HD1 ILE 4 -11.073 -9.573 -15.572 33 H GLY 5 H GLY 5 -14.251 -11.355 -10.552 34 HA2 GLY 5 1HA GLY 5 -13.451 -10.147 -8.049 35 HA3 GLY 5 2HA GLY 5 -14.929 -11.051 -8.352 36 H ARG 6 H ARG 6 -11.424 -11.604 -8.279 37 HA ARG 6 HA ARG 6 -11.900 -14.264 -7.153 38 HB2 ARG 6 1HB ARG 6 -9.444 -14.586 -7.578 39 HB3 ARG 6 2HB ARG 6 -10.422 -14.319 -9.014 40 HG2 ARG 6 1HG ARG 6 -9.671 -12.053 -9.182 41 HG3 ARG 6 2HG ARG 6 -8.831 -12.171 -7.635 42 HD2 ARG 6 1HD ARG 6 -7.359 -12.359 -9.648 43 HD3 ARG 6 2HD ARG 6 -7.251 -13.712 -8.522 44 HE ARG 6 HE ARG 6 -8.936 -14.783 -10.166 45 HH11 ARG 6 1HH1 ARG 6 -6.355 -12.588 -11.083 46 HH12 ARG 6 2HH1 ARG 6 -6.102 -13.342 -12.633 47 HH21 ARG 6 1HH2 ARG 6 -8.617 -15.752 -12.188 48 HH22 ARG 6 2HH2 ARG 6 -7.391 -15.149 -13.264 49 H SER 7 H SER 7 -11.562 -11.271 -5.973 50 HA SER 7 HA SER 7 -9.691 -11.831 -3.854 51 HB2 SER 7 1HB SER 7 -11.624 -9.518 -4.109 52 HB3 SER 7 2HB SER 7 -10.212 -9.604 -3.055 53 HG SER 7 HG SER 7 -10.344 -9.312 -5.853 54 H LEU 8 H LEU 8 -10.981 -13.845 -3.342 55 HA LEU 8 HA LEU 8 -13.501 -13.539 -2.017 56 HB2 LEU 8 1HB LEU 8 -11.606 -15.838 -2.368 57 HB3 LEU 8 2HB LEU 8 -12.970 -15.964 -1.276 58 HG LEU 8 HG LEU 8 -13.662 -16.961 -3.289 59 HD11 LEU 8 1HD1 LEU 8 -15.477 -15.523 -4.074 60 HD12 LEU 8 2HD1 LEU 8 -14.741 -14.150 -3.247 61 HD13 LEU 8 3HD1 LEU 8 -15.346 -15.521 -2.317 62 HD21 LEU 8 3HD2 LEU 8 -11.940 -16.153 -4.772 63 HD22 LEU 8 1HD2 LEU 8 -12.620 -14.527 -4.724 64 HD23 LEU 8 2HD2 LEU 8 -13.528 -15.840 -5.473 65 H GLN 9 H GLN 9 -10.595 -12.560 -1.036 66 HA GLN 9 HA GLN 9 -10.642 -13.472 1.690 67 HB2 GLN 9 1HB GLN 9 -9.094 -11.217 0.389 68 HB3 GLN 9 2HB GLN 9 -8.831 -11.819 2.023 69 HG2 GLN 9 1HG GLN 9 -8.203 -13.995 1.135 70 HG3 GLN 9 2HG GLN 9 -8.499 -13.421 -0.504 71 HE21 GLN 9 2HE2 GLN 9 -6.067 -14.474 0.703 72 HE22 GLN 9 1HE2 GLN 9 -4.862 -13.252 0.486 73 H GLY 10 H GLY 10 -11.728 -10.683 -0.130 74 HA2 GLY 10 1HA GLY 10 -13.252 -9.046 0.358 75 HA3 GLY 10 2HA GLY 10 -13.821 -10.099 1.642 76 H VAL 11 H VAL 11 -14.219 -8.041 2.717 77 HA VAL 11 HA VAL 11 -11.875 -7.270 4.285 78 HB VAL 11 HB VAL 11 -12.767 -4.893 4.339 79 HG11 VAL 11 1HG1 VAL 11 -11.698 -4.267 2.209 80 HG12 VAL 11 2HG1 VAL 11 -11.716 -5.963 1.722 81 HG13 VAL 11 3HG1 VAL 11 -10.755 -5.454 3.112 82 HG21 VAL 11 3HG2 VAL 11 -14.280 -5.833 1.900 83 HG22 VAL 11 1HG2 VAL 11 -14.117 -4.157 2.426 84 HG23 VAL 11 2HG2 VAL 11 -14.991 -5.315 3.429 85 H THR 12 H THR 12 -12.269 -7.530 6.368 86 HA THR 12 HA THR 12 -14.898 -8.112 7.318 87 HB THR 12 HB THR 12 -12.958 -9.236 8.294 88 HG1 THR 12 HG1 THR 12 -14.911 -8.737 9.573 89 HG21 THR 12 3HG2 THR 12 -11.329 -7.416 8.133 90 HG22 THR 12 1HG2 THR 12 -11.410 -8.055 9.776 91 HG23 THR 12 2HG2 THR 12 -12.194 -6.525 9.386 92 H GLY 13 H GLY 13 -12.888 -5.292 7.183 93 HA2 GLY 13 1HA GLY 13 -14.776 -3.778 8.843 94 HA3 GLY 13 2HA GLY 13 -13.187 -3.223 8.326 95 H ARG 14 H ARG 14 -16.218 -2.418 7.960 96 HA ARG 14 HA ARG 14 -15.901 -1.576 5.192 97 HB2 ARG 14 1HB ARG 14 -18.230 -3.192 6.216 98 HB3 ARG 14 2HB ARG 14 -18.270 -2.278 4.715 99 HG2 ARG 14 1HG ARG 14 -16.620 -3.633 3.729 100 HG3 ARG 14 2HG ARG 14 -16.201 -4.375 5.276 101 HD2 ARG 14 1HD ARG 14 -18.845 -4.646 3.872 102 HD3 ARG 14 2HD ARG 14 -17.554 -5.846 3.841 103 HE ARG 14 HE ARG 14 -18.799 -5.011 6.380 104 HH11 ARG 14 1HH1 ARG 14 -17.880 -7.504 4.113 105 HH12 ARG 14 2HH1 ARG 14 -18.322 -8.815 5.160 106 HH21 ARG 14 1HH2 ARG 14 -19.360 -6.726 7.789 107 HH22 ARG 14 2HH2 ARG 14 -19.143 -8.371 7.267 108 HA PRO 15 HA PRO 15 -17.604 1.895 7.674 109 HB2 PRO 15 1HB PRO 15 -16.043 3.726 6.413 110 HB3 PRO 15 2HB PRO 15 -15.492 2.813 7.822 111 HG2 PRO 15 1HG PRO 15 -14.954 2.312 4.914 112 HG3 PRO 15 2HG PRO 15 -13.828 2.260 6.284 113 HD2 PRO 15 1HD PRO 15 -14.906 0.008 5.228 114 HD3 PRO 15 2HD PRO 15 -14.547 0.174 6.960 115 H ASP 16 H ASP 16 -19.379 2.977 6.953 116 HA ASP 16 HA ASP 16 -20.167 2.778 4.205 117 HB2 ASP 16 1HB ASP 16 -22.183 3.854 4.813 118 HB3 ASP 16 2HB ASP 16 -21.746 2.887 6.215 119 H PHE 17 H PHE 17 -18.385 5.027 6.075 120 HA PHE 17 HA PHE 17 -18.757 7.415 4.720 121 HB2 PHE 17 1HB PHE 17 -17.491 7.334 6.772 122 HB3 PHE 17 2HB PHE 17 -16.266 6.310 6.031 123 HD1 PHE 17 HD2 PHE 17 -17.833 9.672 5.701 124 HD2 PHE 17 HD1 PHE 17 -14.366 7.269 5.139 125 HE1 PHE 17 HE2 PHE 17 -16.554 11.673 5.054 126 HE2 PHE 17 HE1 PHE 17 -13.084 9.264 4.488 127 HZ PHE 17 HZ PHE 17 -14.177 11.470 4.445 128 H GLN 18 H GLN 18 -16.303 4.903 4.042 129 HA GLN 18 HA GLN 18 -15.170 6.263 1.850 130 HB2 GLN 18 1HB GLN 18 -14.054 4.204 1.296 131 HB3 GLN 18 2HB GLN 18 -14.011 4.444 3.034 132 HG2 GLN 18 1HG GLN 18 -15.558 2.752 3.435 133 HG3 GLN 18 2HG GLN 18 -16.122 2.746 1.764 134 HE21 GLN 18 2HE2 GLN 18 -13.559 2.711 0.507 135 HE22 GLN 18 1HE2 GLN 18 -12.856 1.169 0.822 136 H LYS 19 H LYS 19 -17.921 4.143 2.132 137 HA LYS 19 HA LYS 19 -18.156 3.468 -0.595 138 HB2 LYS 19 1HB LYS 19 -20.335 3.656 1.488 139 HB3 LYS 19 2HB LYS 19 -20.476 2.850 -0.069 140 HG2 LYS 19 1HG LYS 19 -18.518 1.401 0.711 141 HG3 LYS 19 2HG LYS 19 -18.846 2.053 2.318 142 HD2 LYS 19 1HD LYS 19 -20.747 0.489 0.569 143 HD3 LYS 19 2HD LYS 19 -19.992 -0.057 2.066 144 HE2 LYS 19 1HE LYS 19 -21.219 1.596 3.333 145 HE3 LYS 19 2HE LYS 19 -21.897 2.271 1.852 146 HZ1 LYS 19 3HZ LYS 19 -22.465 -0.376 3.070 147 HZ2 LYS 19 1HZ LYS 19 -22.893 0.008 1.471 148 HZ3 LYS 19 2HZ LYS 19 -23.548 0.895 2.754 149 H ARG 20 H ARG 20 -19.365 6.209 1.298 150 HA ARG 20 HA ARG 20 -20.845 7.368 -0.866 151 HB2 ARG 20 1HB ARG 20 -19.627 9.165 1.149 152 HB3 ARG 20 2HB ARG 20 -21.264 9.140 0.521 153 HG2 ARG 20 1HG ARG 20 -21.816 7.285 1.980 154 HG3 ARG 20 2HG ARG 20 -20.149 7.242 2.571 155 HD2 ARG 20 1HD ARG 20 -20.502 9.695 3.186 156 HD3 ARG 20 2HD ARG 20 -22.220 9.382 2.951 157 HE ARG 20 HE ARG 20 -21.635 7.463 4.676 158 HH11 ARG 20 1HH1 ARG 20 -20.535 10.791 4.626 159 HH12 ARG 20 2HH1 ARG 20 -20.467 10.934 6.360 160 HH21 ARG 20 1HH2 ARG 20 -21.499 7.613 6.934 161 HH22 ARG 20 2HH2 ARG 20 -21.017 9.110 7.684 162 H LEU 21 H LEU 21 -17.690 7.916 0.594 163 HA LEU 21 HA LEU 21 -16.819 10.075 -0.895 164 HB2 LEU 21 1HB LEU 21 -15.608 9.495 1.025 165 HB3 LEU 21 2HB LEU 21 -15.418 7.832 0.514 166 HG LEU 21 HG LEU 21 -13.824 8.562 -1.223 167 HD11 LEU 21 1HD1 LEU 21 -12.907 10.843 -1.116 168 HD12 LEU 21 2HD1 LEU 21 -14.147 11.275 0.061 169 HD13 LEU 21 3HD1 LEU 21 -14.607 10.832 -1.583 170 HD21 LEU 21 3HD2 LEU 21 -11.988 9.105 0.311 171 HD22 LEU 21 1HD2 LEU 21 -13.003 7.801 0.927 172 HD23 LEU 21 2HD2 LEU 21 -13.160 9.427 1.589 173 H GLU 22 H GLU 22 -16.252 6.617 -1.563 174 HA GLU 22 HA GLU 22 -14.811 7.199 -3.962 175 HB2 GLU 22 1HB GLU 22 -15.960 4.603 -2.924 176 HB3 GLU 22 2HB GLU 22 -14.918 4.740 -4.337 177 HG2 GLU 22 1HG GLU 22 -13.160 5.711 -2.892 178 HG3 GLU 22 2HG GLU 22 -14.196 5.424 -1.494 179 H GLN 23 H GLN 23 -18.143 6.381 -3.200 180 HA GLN 23 HA GLN 23 -19.009 5.804 -5.815 181 HB2 GLN 23 1HB GLN 23 -20.269 5.383 -3.674 182 HB3 GLN 23 2HB GLN 23 -20.655 7.093 -3.644 183 HG2 GLN 23 1HG GLN 23 -21.783 6.855 -5.813 184 HG3 GLN 23 2HG GLN 23 -21.447 5.125 -5.776 185 HE21 GLN 23 2HE2 GLN 23 -21.850 5.027 -2.862 186 HE22 GLN 23 1HE2 GLN 23 -23.567 5.088 -2.626 187 H MET 24 H MET 24 -19.314 8.822 -3.934 188 HA MET 24 HA MET 24 -20.391 10.325 -6.051 189 HB2 MET 24 1HB MET 24 -19.834 12.313 -4.752 190 HB3 MET 24 2HB MET 24 -20.585 11.090 -3.747 191 HG2 MET 24 1HG MET 24 -18.365 10.469 -2.900 192 HG3 MET 24 2HG MET 24 -17.650 11.741 -3.887 193 HE1 MET 24 3HE MET 24 -19.237 14.961 -2.264 194 HE2 MET 24 1HE MET 24 -19.928 14.023 -3.590 195 HE3 MET 24 2HE MET 24 -18.193 14.342 -3.544 196 H LYS 25 H LYS 25 -17.066 9.754 -5.053 197 HA LYS 25 HA LYS 25 -15.906 11.620 -6.831 198 HB2 LYS 25 1HB LYS 25 -14.739 10.587 -4.874 199 HB3 LYS 25 2HB LYS 25 -14.649 9.084 -5.777 200 HG2 LYS 25 1HG LYS 25 -12.544 10.256 -5.899 201 HG3 LYS 25 2HG LYS 25 -13.298 10.204 -7.492 202 HD2 LYS 25 1HD LYS 25 -13.829 12.573 -5.778 203 HD3 LYS 25 2HD LYS 25 -12.232 12.426 -6.507 204 HE2 LYS 25 1HE LYS 25 -13.156 12.372 -8.704 205 HE3 LYS 25 2HE LYS 25 -14.797 12.230 -8.078 206 HZ1 LYS 25 3HZ LYS 25 -13.039 14.584 -7.654 207 HZ2 LYS 25 1HZ LYS 25 -14.668 14.449 -7.227 208 HZ3 LYS 25 2HZ LYS 25 -14.221 14.484 -8.858 209 H GLU 26 H GLU 26 -16.598 8.133 -7.099 210 HA GLU 26 HA GLU 26 -15.499 7.816 -9.676 211 HB2 GLU 26 1HB GLU 26 -16.189 5.985 -8.018 212 HB3 GLU 26 2HB GLU 26 -17.822 6.212 -8.634 213 HG2 GLU 26 1HG GLU 26 -16.636 5.896 -10.958 214 HG3 GLU 26 2HG GLU 26 -15.432 5.067 -9.973 215 H LYS 27 H LYS 27 -18.721 8.698 -8.542 216 HA LYS 27 HA LYS 27 -20.071 8.735 -10.985 217 HB2 LYS 27 1HB LYS 27 -20.385 10.328 -8.458 218 HB3 LYS 27 2HB LYS 27 -21.408 10.645 -9.851 219 HG2 LYS 27 1HG LYS 27 -22.097 8.255 -9.806 220 HG3 LYS 27 2HG LYS 27 -21.173 8.066 -8.315 221 HD2 LYS 27 1HD LYS 27 -23.529 8.420 -7.824 222 HD3 LYS 27 2HD LYS 27 -22.562 9.778 -7.245 223 HE2 LYS 27 1HE LYS 27 -23.190 11.083 -9.195 224 HE3 LYS 27 2HE LYS 27 -24.102 9.719 -9.838 225 HZ1 LYS 27 3HZ LYS 27 -25.449 11.453 -8.674 226 HZ2 LYS 27 1HZ LYS 27 -24.703 10.987 -7.227 227 HZ3 LYS 27 2HZ LYS 27 -25.658 9.878 -8.083 228 H VAL 28 H VAL 28 -18.124 11.243 -9.430 229 HA VAL 28 HA VAL 28 -18.489 13.215 -11.407 230 HB VAL 28 HB VAL 28 -16.152 12.820 -9.524 231 HG11 VAL 28 1HG1 VAL 28 -17.021 15.278 -11.036 232 HG12 VAL 28 2HG1 VAL 28 -15.592 14.302 -11.382 233 HG13 VAL 28 3HG1 VAL 28 -15.704 15.194 -9.864 234 HG21 VAL 28 3HG2 VAL 28 -18.319 13.028 -8.375 235 HG22 VAL 28 1HG2 VAL 28 -18.599 14.555 -9.212 236 HG23 VAL 28 2HG2 VAL 28 -17.264 14.411 -8.067 237 H MET 29 H MET 29 -16.245 10.532 -11.054 238 HA MET 29 HA MET 29 -14.676 11.334 -13.362 239 HB2 MET 29 1HB MET 29 -14.533 8.783 -11.742 240 HB3 MET 29 2HB MET 29 -13.356 9.324 -12.929 241 HG2 MET 29 1HG MET 29 -13.997 10.644 -10.303 242 HG3 MET 29 2HG MET 29 -12.545 9.727 -10.696 243 HE1 MET 29 3HE MET 29 -10.814 12.062 -13.332 244 HE2 MET 29 1HE MET 29 -11.914 10.723 -13.648 245 HE3 MET 29 2HE MET 29 -10.679 10.566 -12.402 246 H LYS 30 H LYS 30 -17.614 9.902 -12.995 247 HA LYS 30 HA LYS 30 -17.412 8.092 -15.265 248 HB2 LYS 30 1HB LYS 30 -19.040 8.225 -13.033 249 HB3 LYS 30 2HB LYS 30 -20.085 8.815 -14.317 250 HG2 LYS 30 1HG LYS 30 -20.515 6.708 -14.820 251 HG3 LYS 30 2HG LYS 30 -18.840 6.556 -15.365 252 HD2 LYS 30 1HD LYS 30 -19.151 4.836 -13.775 253 HD3 LYS 30 2HD LYS 30 -18.240 6.116 -12.959 254 HE2 LYS 30 1HE LYS 30 -20.106 6.830 -11.740 255 HE3 LYS 30 2HE LYS 30 -21.233 5.968 -12.785 256 HZ1 LYS 30 3HZ LYS 30 -19.232 4.481 -11.208 257 HZ2 LYS 30 1HZ LYS 30 -20.724 3.952 -11.814 258 HZ3 LYS 30 2HZ LYS 30 -20.675 5.000 -10.483 259 H ASP 31 H ASP 31 -18.566 11.250 -14.425 260 HA ASP 31 HA ASP 31 -20.411 11.634 -16.500 261 HB2 ASP 31 1HB ASP 31 -20.320 12.965 -14.407 262 HB3 ASP 31 2HB ASP 31 -18.865 13.754 -15.010 263 H GLN 32 H GLN 32 -20.189 12.029 -18.551 264 HA GLN 32 HA GLN 32 -17.731 11.976 -19.891 265 HB2 GLN 32 1HB GLN 32 -20.347 13.041 -20.969 266 HB3 GLN 32 2HB GLN 32 -18.995 12.436 -21.909 267 HG2 GLN 32 1HG GLN 32 -20.479 10.681 -21.951 268 HG3 GLN 32 2HG GLN 32 -19.376 10.235 -20.657 269 HE21 GLN 32 2HE2 GLN 32 -21.965 12.622 -20.425 270 HE22 GLN 32 1HE2 GLN 32 -22.907 11.736 -19.278 271 H ASP 33 H ASP 33 -19.837 14.623 -19.021 272 HA ASP 33 HA ASP 33 -18.586 16.677 -20.501 273 HB2 ASP 33 1HB ASP 33 -20.859 16.522 -19.057 274 HB3 ASP 33 2HB ASP 33 -19.836 17.341 -17.890 275 H VAL 34 H VAL 34 -18.286 15.654 -17.133 276 HA VAL 34 HA VAL 34 -16.301 17.374 -16.245 277 HB VAL 34 HB VAL 34 -16.978 14.532 -15.513 278 HG11 VAL 34 1HG1 VAL 34 -14.624 14.781 -15.006 279 HG12 VAL 34 2HG1 VAL 34 -15.572 14.770 -13.517 280 HG13 VAL 34 3HG1 VAL 34 -14.944 16.293 -14.155 281 HG21 VAL 34 3HG2 VAL 34 -17.374 17.167 -14.113 282 HG22 VAL 34 1HG2 VAL 34 -17.857 15.589 -13.490 283 HG23 VAL 34 2HG2 VAL 34 -18.608 16.228 -14.953 284 H GLN 35 H GLN 35 -15.941 14.246 -17.874 285 HA GLN 35 HA GLN 35 -13.145 14.068 -17.665 286 HB2 GLN 35 1HB GLN 35 -14.889 12.898 -19.831 287 HB3 GLN 35 2HB GLN 35 -13.294 12.331 -19.335 288 HG2 GLN 35 1HG GLN 35 -14.282 11.996 -17.053 289 HG3 GLN 35 2HG GLN 35 -15.856 12.242 -17.794 290 HE21 GLN 35 2HE2 GLN 35 -14.732 9.917 -16.472 291 HE22 GLN 35 1HE2 GLN 35 -14.828 8.627 -17.614 292 H ALA 36 H ALA 36 -15.207 15.392 -20.170 293 HA ALA 36 HA ALA 36 -13.246 16.031 -22.064 294 HB1 ALA 36 1HB ALA 36 -15.790 17.537 -21.458 295 HB2 ALA 36 2HB ALA 36 -15.642 16.153 -22.542 296 HB3 ALA 36 3HB ALA 36 -14.835 17.671 -22.935 297 H PHE 37 H PHE 37 -14.395 17.828 -19.258 298 HA PHE 37 HA PHE 37 -12.760 20.107 -19.696 299 HB2 PHE 37 1HB PHE 37 -14.729 20.238 -18.276 300 HB3 PHE 37 2HB PHE 37 -14.051 19.045 -17.172 301 HD1 PHE 37 HD1 PHE 37 -13.395 22.414 -18.592 302 HD2 PHE 37 HD2 PHE 37 -12.823 19.729 -15.350 303 HE1 PHE 37 HE1 PHE 37 -12.348 24.220 -17.293 304 HE2 PHE 37 HE2 PHE 37 -11.781 21.533 -14.035 305 HZ PHE 37 HZ PHE 37 -11.538 23.782 -15.009 306 H LEU 38 H LEU 38 -12.370 17.114 -17.873 307 HA LEU 38 HA LEU 38 -9.968 17.773 -16.572 308 HB2 LEU 38 1HB LEU 38 -11.490 15.318 -17.102 309 HB3 LEU 38 2HB LEU 38 -9.767 15.070 -16.905 310 HG LEU 38 HG LEU 38 -10.861 14.725 -14.801 311 HD11 LEU 38 1HD1 LEU 38 -9.387 17.345 -14.818 312 HD12 LEU 38 2HD1 LEU 38 -8.668 15.739 -14.708 313 HD13 LEU 38 3HD1 LEU 38 -9.685 16.343 -13.400 314 HD21 LEU 38 3HD2 LEU 38 -11.963 17.507 -15.117 315 HD22 LEU 38 1HD2 LEU 38 -12.097 16.511 -13.668 316 HD23 LEU 38 2HD2 LEU 38 -12.880 16.000 -15.163 317 H LYS 39 H LYS 39 -10.539 16.177 -19.692 318 HA LYS 39 HA LYS 39 -7.780 15.628 -20.153 319 HB2 LYS 39 1HB LYS 39 -8.450 15.148 -22.478 320 HB3 LYS 39 2HB LYS 39 -9.498 14.351 -21.317 321 HG2 LYS 39 1HG LYS 39 -11.209 16.039 -21.669 322 HG3 LYS 39 2HG LYS 39 -10.149 16.896 -22.787 323 HD2 LYS 39 1HD LYS 39 -11.028 14.045 -23.198 324 HD3 LYS 39 2HD LYS 39 -11.902 15.431 -23.852 325 HE2 LYS 39 1HE LYS 39 -8.980 14.953 -24.383 326 HE3 LYS 39 2HE LYS 39 -10.252 14.282 -25.402 327 HZ1 LYS 39 3HZ LYS 39 -10.971 16.442 -25.997 328 HZ2 LYS 39 1HZ LYS 39 -9.287 16.429 -26.183 329 HZ3 LYS 39 2HZ LYS 39 -9.990 17.191 -24.835 330 H GLU 40 H GLU 40 -9.832 18.359 -20.741 331 HA GLU 40 HA GLU 40 -7.975 19.661 -22.496 332 HB2 GLU 40 1HB GLU 40 -10.670 20.012 -21.633 333 HB3 GLU 40 2HB GLU 40 -9.793 21.516 -21.385 334 HG2 GLU 40 1HG GLU 40 -10.937 21.203 -23.619 335 HG3 GLU 40 2HG GLU 40 -9.246 21.702 -23.659 336 H ASN 41 H ASN 41 -8.578 19.634 -19.064 337 HA ASN 41 HA ASN 41 -6.558 21.758 -18.759 338 HB2 ASN 41 1HB ASN 41 -9.046 21.210 -17.169 339 HB3 ASN 41 2HB ASN 41 -7.716 22.150 -16.498 340 HD21 ASN 41 2HD2 ASN 41 -10.259 22.050 -18.848 341 HD22 ASN 41 1HD2 ASN 41 -10.188 23.718 -19.291 342 H GLU 42 H GLU 42 -6.213 18.800 -18.863 343 HA GLU 42 HA GLU 42 -5.576 17.849 -16.279 344 HB2 GLU 42 1HB GLU 42 -4.296 16.107 -17.404 345 HB3 GLU 42 2HB GLU 42 -5.837 16.347 -18.216 346 HG2 GLU 42 1HG GLU 42 -4.829 17.450 -20.028 347 HG3 GLU 42 2HG GLU 42 -3.310 17.658 -19.155 348 H GLU 43 H GLU 43 -4.078 20.089 -18.336 349 HA GLU 43 HA GLU 43 -1.384 19.852 -17.473 350 HB2 GLU 43 1HB GLU 43 -2.207 21.024 -19.550 351 HB3 GLU 43 2HB GLU 43 -2.802 22.311 -18.514 352 HG2 GLU 43 1HG GLU 43 -0.729 23.027 -19.376 353 HG3 GLU 43 2HG GLU 43 -0.457 22.599 -17.687 354 H VAL 44 H VAL 44 -4.239 21.391 -16.237 355 HA VAL 44 HA VAL 44 -2.645 22.937 -14.300 356 HB VAL 44 HB VAL 44 -5.535 23.404 -15.030 357 HG11 VAL 44 1HG1 VAL 44 -3.501 25.171 -13.679 358 HG12 VAL 44 2HG1 VAL 44 -4.823 24.322 -12.879 359 HG13 VAL 44 3HG1 VAL 44 -5.174 25.601 -14.041 360 HG21 VAL 44 3HG2 VAL 44 -4.143 23.668 -17.022 361 HG22 VAL 44 1HG2 VAL 44 -3.094 24.780 -16.142 362 HG23 VAL 44 2HG2 VAL 44 -4.771 25.222 -16.466 363 H ILE 45 H ILE 45 -5.298 20.655 -14.634 364 HA ILE 45 HA ILE 45 -6.079 20.865 -11.875 365 HB ILE 45 HB ILE 45 -6.867 18.790 -13.913 366 HG12 ILE 45 1HG1 ILE 45 -8.340 21.275 -13.016 367 HG13 ILE 45 2HG1 ILE 45 -7.477 21.114 -14.540 368 HG21 ILE 45 1HG2 ILE 45 -7.216 18.026 -11.622 369 HG22 ILE 45 2HG2 ILE 45 -8.757 18.334 -12.424 370 HG23 ILE 45 3HG2 ILE 45 -8.117 19.500 -11.265 371 HD11 ILE 45 3HD1 ILE 45 -9.869 19.512 -13.678 372 HD12 ILE 45 1HD1 ILE 45 -8.986 19.297 -15.188 373 HD13 ILE 45 2HD1 ILE 45 -9.844 20.807 -14.876 374 H ASP 46 H ASP 46 -5.558 19.637 -10.234 375 HA ASP 46 HA ASP 46 -3.586 17.479 -10.600 376 HB2 ASP 46 1HB ASP 46 -3.034 19.623 -9.216 377 HB3 ASP 46 2HB ASP 46 -4.111 18.933 -8.010 378 H GLN 47 H GLN 47 -3.804 15.704 -8.975 379 HA GLN 47 HA GLN 47 -6.420 14.706 -8.696 380 HB2 GLN 47 1HB GLN 47 -3.887 14.062 -7.191 381 HB3 GLN 47 2HB GLN 47 -5.377 13.138 -7.033 382 HG2 GLN 47 1HG GLN 47 -5.265 12.664 -9.469 383 HG3 GLN 47 2HG GLN 47 -3.691 13.458 -9.504 384 HE21 GLN 47 2HE2 GLN 47 -2.634 11.597 -10.143 385 HE22 GLN 47 1HE2 GLN 47 -2.378 10.260 -9.078 386 H LYS 48 H LYS 48 -4.338 16.593 -6.609 387 HA LYS 48 HA LYS 48 -5.892 16.543 -4.261 388 HB2 LYS 48 1HB LYS 48 -4.132 18.791 -5.248 389 HB3 LYS 48 2HB LYS 48 -4.596 18.471 -3.590 390 HG2 LYS 48 1HG LYS 48 -2.812 16.772 -5.321 391 HG3 LYS 48 2HG LYS 48 -2.315 17.780 -3.964 392 HD2 LYS 48 1HD LYS 48 -4.264 15.514 -3.638 393 HD3 LYS 48 2HD LYS 48 -2.522 15.264 -3.564 394 HE2 LYS 48 1HE LYS 48 -3.240 15.518 -1.330 395 HE3 LYS 48 2HE LYS 48 -2.472 17.041 -1.769 396 HZ1 LYS 48 3HZ LYS 48 -4.544 17.359 -0.549 397 HZ2 LYS 48 1HZ LYS 48 -5.402 16.541 -1.764 398 HZ3 LYS 48 2HZ LYS 48 -4.636 18.020 -2.099 399 H MET 49 H MET 49 -5.842 18.718 -7.016 400 HA MET 49 HA MET 49 -7.721 20.601 -6.266 401 HB2 MET 49 1HB MET 49 -6.317 20.755 -8.285 402 HB3 MET 49 2HB MET 49 -7.201 19.416 -9.000 403 HG2 MET 49 1HG MET 49 -8.198 21.201 -10.002 404 HG3 MET 49 2HG MET 49 -9.257 20.925 -8.625 405 HE1 MET 49 3HE MET 49 -6.516 23.176 -10.222 406 HE2 MET 49 1HE MET 49 -5.687 22.600 -8.775 407 HE3 MET 49 2HE MET 49 -6.135 24.302 -8.923 408 H ILE 50 H ILE 50 -8.093 17.450 -7.770 409 HA ILE 50 HA ILE 50 -10.834 17.496 -8.315 410 HB ILE 50 HB ILE 50 -8.962 15.212 -7.707 411 HG12 ILE 50 1HG1 ILE 50 -8.437 16.531 -9.710 412 HG13 ILE 50 2HG1 ILE 50 -8.943 14.896 -10.120 413 HG21 ILE 50 1HG2 ILE 50 -11.743 15.063 -8.840 414 HG22 ILE 50 2HG2 ILE 50 -11.240 14.509 -7.243 415 HG23 ILE 50 3HG2 ILE 50 -10.610 13.720 -8.691 416 HD11 ILE 50 3HD1 ILE 50 -9.891 16.548 -11.640 417 HD12 ILE 50 1HD1 ILE 50 -10.667 17.361 -10.282 418 HD13 ILE 50 2HD1 ILE 50 -11.153 15.724 -10.724 419 H GLU 51 H GLU 51 -9.071 16.495 -5.444 420 HA GLU 51 HA GLU 51 -11.248 15.547 -3.927 421 HB2 GLU 51 1HB GLU 51 -8.735 16.852 -2.863 422 HB3 GLU 51 2HB GLU 51 -9.797 15.758 -1.995 423 HG2 GLU 51 1HG GLU 51 -9.152 13.939 -3.483 424 HG3 GLU 51 2HG GLU 51 -8.097 15.038 -4.372 425 H LYS 52 H LYS 52 -9.622 18.689 -4.041 426 HA LYS 52 HA LYS 52 -11.102 19.958 -2.025 427 HB2 LYS 52 1HB LYS 52 -9.689 21.127 -4.427 428 HB3 LYS 52 2HB LYS 52 -10.318 22.078 -3.090 429 HG2 LYS 52 1HG LYS 52 -8.506 19.876 -2.359 430 HG3 LYS 52 2HG LYS 52 -7.786 21.203 -3.265 431 HD2 LYS 52 1HD LYS 52 -7.602 21.511 -0.826 432 HD3 LYS 52 2HD LYS 52 -8.523 22.797 -1.601 433 HE2 LYS 52 1HE LYS 52 -10.103 20.512 -0.613 434 HE3 LYS 52 2HE LYS 52 -9.314 21.485 0.627 435 HZ1 LYS 52 3HZ LYS 52 -10.403 23.435 -0.189 436 HZ2 LYS 52 1HZ LYS 52 -11.582 22.242 0.066 437 HZ3 LYS 52 2HZ LYS 52 -11.063 22.599 -1.508 438 H SER 53 H SER 53 -11.587 19.872 -5.529 439 HA SER 53 HA SER 53 -13.999 21.490 -5.250 440 HB2 SER 53 1HB SER 53 -13.952 21.442 -7.768 441 HB3 SER 53 2HB SER 53 -12.520 22.153 -7.025 442 HG SER 53 HG SER 53 -11.416 20.221 -7.390 443 H LEU 54 H LEU 54 -13.647 18.524 -4.490 444 HA LEU 54 HA LEU 54 -15.049 16.837 -6.165 445 HB2 LEU 54 1HB LEU 54 -14.054 16.735 -3.560 446 HB3 LEU 54 2HB LEU 54 -15.768 16.408 -3.387 447 HG LEU 54 HG LEU 54 -13.828 14.891 -5.110 448 HD11 LEU 54 1HD1 LEU 54 -13.583 14.381 -2.759 449 HD12 LEU 54 2HD1 LEU 54 -14.342 13.028 -3.599 450 HD13 LEU 54 3HD1 LEU 54 -15.320 14.117 -2.616 451 HD21 LEU 54 3HD2 LEU 54 -15.975 15.001 -6.200 452 HD22 LEU 54 1HD2 LEU 54 -16.779 14.487 -4.717 453 HD23 LEU 54 2HD2 LEU 54 -15.697 13.380 -5.563 454 H ASN 55 H ASN 55 -16.316 18.855 -3.566 455 HA ASN 55 HA ASN 55 -19.032 18.278 -3.947 456 HB2 ASN 55 1HB ASN 55 -19.365 20.565 -2.798 457 HB3 ASN 55 2HB ASN 55 -18.562 19.284 -1.903 458 HD21 ASN 55 2HD2 ASN 55 -17.575 20.729 -0.535 459 HD22 ASN 55 1HD2 ASN 55 -16.248 21.726 -1.035 460 H LYS 56 H LYS 56 -17.015 20.834 -5.335 461 HA LYS 56 HA LYS 56 -19.033 22.229 -6.696 462 HB2 LYS 56 1HB LYS 56 -16.147 21.868 -7.534 463 HB3 LYS 56 2HB LYS 56 -17.234 23.134 -8.086 464 HG2 LYS 56 1HG LYS 56 -16.509 22.790 -5.194 465 HG3 LYS 56 2HG LYS 56 -15.537 23.753 -6.307 466 HD2 LYS 56 1HD LYS 56 -18.483 24.213 -5.876 467 HD3 LYS 56 2HD LYS 56 -17.234 25.024 -4.930 468 HE2 LYS 56 1HE LYS 56 -16.262 25.820 -7.117 469 HE3 LYS 56 2HE LYS 56 -17.720 25.209 -7.897 470 HZ1 LYS 56 3HZ LYS 56 -17.800 27.607 -7.359 471 HZ2 LYS 56 1HZ LYS 56 -17.716 27.223 -5.709 472 HZ3 LYS 56 2HZ LYS 56 -19.054 26.726 -6.631 473 H LEU 57 H LEU 57 -16.845 19.669 -7.848 474 HA LEU 57 HA LEU 57 -17.898 19.436 -10.431 475 HB2 LEU 57 1HB LEU 57 -16.342 17.619 -8.646 476 HB3 LEU 57 2HB LEU 57 -17.061 16.952 -10.095 477 HG LEU 57 HG LEU 57 -14.781 17.481 -10.560 478 HD11 LEU 57 1HD1 LEU 57 -16.580 19.547 -11.799 479 HD12 LEU 57 2HD1 LEU 57 -16.359 17.887 -12.349 480 HD13 LEU 57 3HD1 LEU 57 -15.015 19.026 -12.423 481 HD21 LEU 57 3HD2 LEU 57 -15.383 20.281 -9.630 482 HD22 LEU 57 1HD2 LEU 57 -13.879 19.747 -10.382 483 HD23 LEU 57 2HD2 LEU 57 -14.357 19.101 -8.812 484 H TYR 58 H TYR 58 -18.782 17.791 -7.423 485 HA TYR 58 HA TYR 58 -20.616 15.992 -8.605 486 HB2 TYR 58 1HB TYR 58 -19.543 15.853 -6.278 487 HB3 TYR 58 2HB TYR 58 -20.798 16.978 -5.763 488 HD1 TYR 58 HD2 TYR 58 -20.345 13.699 -7.457 489 HD2 TYR 58 HD1 TYR 58 -22.872 16.149 -5.073 490 HE1 TYR 58 HE2 TYR 58 -21.896 11.820 -7.196 491 HE2 TYR 58 HE1 TYR 58 -24.438 14.272 -4.796 492 HH TYR 58 HH TYR 58 -25.057 12.217 -5.854 493 H GLU 59 H GLU 59 -21.003 19.160 -7.079 494 HA GLU 59 HA GLU 59 -23.790 19.366 -7.249 495 HB2 GLU 59 1HB GLU 59 -22.193 20.912 -6.033 496 HB3 GLU 59 2HB GLU 59 -21.817 21.630 -7.592 497 HG2 GLU 59 1HG GLU 59 -23.419 22.996 -6.440 498 HG3 GLU 59 2HG GLU 59 -24.186 22.257 -7.846 499 H TYR 60 H TYR 60 -21.250 19.939 -9.574 500 HA TYR 60 HA TYR 60 -22.776 21.253 -11.559 501 HB2 TYR 60 1HB TYR 60 -20.374 21.433 -11.513 502 HB3 TYR 60 2HB TYR 60 -20.189 19.693 -11.659 503 HD1 TYR 60 HD1 TYR 60 -21.183 22.760 -13.473 504 HD2 TYR 60 HD2 TYR 60 -20.151 18.633 -13.787 505 HE1 TYR 60 HE1 TYR 60 -20.947 23.007 -15.901 506 HE2 TYR 60 HE2 TYR 60 -19.928 18.877 -16.235 507 HH TYR 60 HH TYR 60 -20.632 20.327 -18.024 508 H ILE 61 H ILE 61 -21.911 17.829 -11.101 509 HA ILE 61 HA ILE 61 -23.029 17.076 -13.630 510 HB ILE 61 HB ILE 61 -22.598 14.764 -12.968 511 HG12 ILE 61 1HG1 ILE 61 -21.730 15.957 -10.325 512 HG13 ILE 61 2HG1 ILE 61 -23.132 14.925 -10.577 513 HG21 ILE 61 1HG2 ILE 61 -20.347 16.666 -12.354 514 HG22 ILE 61 2HG2 ILE 61 -20.815 16.074 -13.948 515 HG23 ILE 61 3HG2 ILE 61 -20.163 14.957 -12.748 516 HD11 ILE 61 3HD1 ILE 61 -21.645 13.097 -11.246 517 HD12 ILE 61 1HD1 ILE 61 -21.311 13.667 -9.611 518 HD13 ILE 61 2HD1 ILE 61 -20.253 14.137 -10.944 519 H GLU 62 H GLU 62 -24.218 17.187 -10.345 520 HA GLU 62 HA GLU 62 -26.504 15.521 -10.906 521 HB2 GLU 62 1HB GLU 62 -25.924 17.280 -8.516 522 HB3 GLU 62 2HB GLU 62 -27.193 16.068 -8.619 523 HG2 GLU 62 1HG GLU 62 -24.278 15.432 -8.919 524 HG3 GLU 62 2HG GLU 62 -25.125 15.396 -7.374 525 H GLN 63 H GLN 63 -25.767 18.921 -10.966 526 HA GLN 63 HA GLN 63 -28.535 19.741 -10.967 527 HB2 GLN 63 1HB GLN 63 -27.743 21.977 -11.238 528 HB3 GLN 63 2HB GLN 63 -26.676 21.179 -10.093 529 HG2 GLN 63 1HG GLN 63 -24.991 20.904 -11.788 530 HG3 GLN 63 2HG GLN 63 -26.067 21.578 -13.011 531 HE21 GLN 63 2HE2 GLN 63 -24.138 22.269 -10.197 532 HE22 GLN 63 1HE2 GLN 63 -24.078 23.983 -10.417 533 H SER 64 H SER 64 -29.179 21.322 -12.813 534 HA SER 64 HA SER 64 -29.289 19.745 -15.200 535 HB2 SER 64 1HB SER 64 -30.315 22.556 -14.742 536 HB3 SER 64 2HB SER 64 -30.825 21.439 -16.008 537 HG SER 64 HG SER 64 -32.092 21.702 -13.886 538 H LYS 65 H LYS 65 -27.698 19.740 -16.660 539 HA LYS 65 HA LYS 65 -25.878 21.963 -16.918 540 HB2 LYS 65 1HB LYS 65 -26.148 19.512 -18.663 541 HB3 LYS 65 2HB LYS 65 -24.796 20.634 -18.646 542 HG2 LYS 65 1HG LYS 65 -24.295 19.979 -16.338 543 HG3 LYS 65 2HG LYS 65 -25.629 18.821 -16.391 544 HD2 LYS 65 1HD LYS 65 -24.506 17.766 -18.366 545 HD3 LYS 65 2HD LYS 65 -23.128 18.824 -18.066 546 HE2 LYS 65 1HE LYS 65 -22.869 17.867 -15.839 547 HE3 LYS 65 2HE LYS 65 -24.253 16.812 -16.128 548 HZ1 LYS 65 3HZ LYS 65 -22.347 15.532 -16.575 549 HZ2 LYS 65 1HZ LYS 65 -21.624 16.770 -17.479 550 HZ3 LYS 65 2HZ LYS 65 -22.971 15.957 -18.097 551 H ASN 66 H ASN 66 -28.591 20.607 -18.670 552 HA ASN 66 HA ASN 66 -28.376 22.471 -20.857 553 HB2 ASN 66 1HB ASN 66 -30.586 21.514 -21.537 554 HB3 ASN 66 2HB ASN 66 -29.325 20.303 -21.335 555 HD21 ASN 66 2HD2 ASN 66 -32.372 21.462 -20.223 556 HD22 ASN 66 1HD2 ASN 66 -32.660 20.213 -19.067 557 H CYS 67 H CYS 67 -30.824 23.485 -21.311 558 HA CYS 67 HA CYS 67 -31.767 24.749 -18.889 559 HB2 CYS 67 1HB CYS 67 -31.080 26.906 -19.247 560 HB3 CYS 67 2HB CYS 67 -29.706 26.044 -19.920 561 H SER 68 H SER 68 -33.609 26.118 -19.254 562 HA SER 68 HA SER 68 -35.475 24.689 -20.860 563 HB2 SER 68 1HB SER 68 -36.052 25.716 -18.686 564 HB3 SER 68 2HB SER 68 -35.827 27.315 -19.391 565 HG SER 68 HG SER 68 -37.537 25.747 -20.837 566 H TYR 69 H TYR 69 -33.507 27.419 -21.472 567 HA TYR 69 HA TYR 69 -35.101 28.583 -23.540 568 HB2 TYR 69 1HB TYR 69 -32.981 29.420 -22.091 569 HB3 TYR 69 2HB TYR 69 -32.184 29.004 -23.600 570 HD1 TYR 69 HD2 TYR 69 -32.700 30.218 -25.663 571 HD2 TYR 69 HD1 TYR 69 -34.511 31.296 -21.969 572 HE1 TYR 69 HE2 TYR 69 -33.398 32.364 -26.637 573 HE2 TYR 69 HE1 TYR 69 -35.211 33.445 -22.933 574 HH TYR 69 HH TYR 69 -34.624 34.936 -24.716 575 H CYS 70 H CYS 70 -33.501 25.704 -23.431 576 HA CYS 70 HA CYS 70 -33.423 25.652 -26.364 577 HB2 CYS 70 1HB CYS 70 -31.459 24.109 -26.290 578 HB3 CYS 70 2HB CYS 70 -31.112 25.758 -25.786 579 H SER 71 H SER 71 -33.614 23.676 -23.400 580 HA SER 71 HA SER 71 -34.645 21.432 -24.882 581 HB2 SER 71 1HB SER 71 -35.019 20.503 -22.520 582 HB3 SER 71 2HB SER 71 -33.347 20.835 -22.981 583 HG SER 71 HG SER 71 -34.787 21.873 -20.961 584 H GLU 72 H GLU 72 -36.783 20.571 -24.599 585 HA GLU 72 HA GLU 72 -38.738 22.694 -24.597 586 HB2 GLU 72 1HB GLU 72 -40.305 20.991 -25.345 587 HB3 GLU 72 2HB GLU 72 -38.811 20.869 -26.265 588 HG2 GLU 72 1HG GLU 72 -38.125 18.941 -25.085 589 HG3 GLU 72 2HG GLU 72 -39.374 19.159 -23.862 590 H ASP 73 H ASP 73 -37.397 20.739 -22.281 591 HA ASP 73 HA ASP 73 -39.486 19.741 -20.775 592 HB2 ASP 73 1HB ASP 73 -36.779 20.732 -19.879 593 HB3 ASP 73 2HB ASP 73 -37.885 19.830 -18.850 594 H GLU 74 H GLU 74 -41.192 20.860 -20.113 595 HA GLU 74 HA GLU 74 -41.106 23.535 -19.144 596 HB2 GLU 74 1HB GLU 74 -43.376 23.002 -18.242 597 HB3 GLU 74 2HB GLU 74 -43.196 22.628 -19.952 598 HG2 GLU 74 1HG GLU 74 -43.000 20.298 -19.500 599 HG3 GLU 74 2HG GLU 74 -42.897 20.588 -17.764 600 H ASN 75 H ASN 75 -40.369 20.466 -17.854 601 HA ASN 75 HA ASN 75 -40.592 21.252 -15.074 602 HB2 ASN 75 1HB ASN 75 -39.935 18.989 -14.552 603 HB3 ASN 75 2HB ASN 75 -41.128 18.926 -15.845 604 HD21 ASN 75 2HD2 ASN 75 -40.508 18.252 -17.893 605 HD22 ASN 75 1HD2 ASN 75 -38.980 17.501 -18.200 606 H CYS 76 H CYS 76 -38.505 22.096 -17.355 607 HA CYS 76 HA CYS 76 -35.982 21.398 -16.254 608 HB2 CYS 76 1HB CYS 76 -36.332 22.066 -18.632 609 HB3 CYS 76 2HB CYS 76 -36.642 23.711 -18.088 610 HG CYS 76 HG CYS 76 -34.145 24.406 -17.533 611 H ASN 77 H ASN 77 -35.296 22.057 -14.361 612 HA ASN 77 HA ASN 77 -35.758 24.864 -13.611 613 HB2 ASN 77 1HB ASN 77 -35.661 24.237 -11.287 614 HB3 ASN 77 2HB ASN 77 -36.836 23.194 -12.078 615 HD21 ASN 77 2HD2 ASN 77 -36.362 21.016 -12.360 616 HD22 ASN 77 1HD2 ASN 77 -35.082 20.232 -11.495 617 H ASN 78 H ASN 78 -33.997 26.033 -12.886 618 HA ASN 78 HA ASN 78 -31.417 24.813 -12.573 619 HB2 ASN 78 1HB ASN 78 -31.965 25.138 -15.153 620 HB3 ASN 78 2HB ASN 78 -31.524 26.806 -14.808 621 HD21 ASN 78 2HD2 ASN 78 -30.233 24.806 -16.489 622 HD22 ASN 78 1HD2 ASN 78 -28.619 24.643 -15.898 623 H LEU 79 H LEU 79 -29.739 26.594 -12.233 624 HA LEU 79 HA LEU 79 -30.868 28.530 -10.437 625 HB2 LEU 79 1HB LEU 79 -28.023 28.262 -11.422 626 HB3 LEU 79 2HB LEU 79 -28.556 29.217 -10.053 627 HG LEU 79 HG LEU 79 -28.703 26.206 -10.241 628 HD11 LEU 79 1HD1 LEU 79 -26.414 26.996 -10.045 629 HD12 LEU 79 2HD1 LEU 79 -26.942 26.247 -8.537 630 HD13 LEU 79 3HD1 LEU 79 -26.862 28.004 -8.669 631 HD21 LEU 79 3HD2 LEU 79 -29.295 26.333 -7.857 632 HD22 LEU 79 1HD2 LEU 79 -30.501 27.107 -8.885 633 HD23 LEU 79 2HD2 LEU 79 -29.353 28.092 -7.979 634 H LEU 80 H LEU 80 -28.416 29.239 -12.889 635 HA LEU 80 HA LEU 80 -29.886 31.618 -13.675 636 HB2 LEU 80 1HB LEU 80 -27.163 30.556 -14.415 637 HB3 LEU 80 2HB LEU 80 -27.884 31.924 -15.237 638 HG LEU 80 HG LEU 80 -28.006 33.091 -13.008 639 HD11 LEU 80 1HD1 LEU 80 -26.181 30.860 -12.127 640 HD12 LEU 80 2HD1 LEU 80 -27.843 31.091 -11.585 641 HD13 LEU 80 3HD1 LEU 80 -26.613 32.295 -11.198 642 HD21 LEU 80 3HD2 LEU 80 -25.641 33.693 -13.016 643 HD22 LEU 80 1HD2 LEU 80 -26.289 33.593 -14.654 644 HD23 LEU 80 2HD2 LEU 80 -25.284 32.287 -14.019 645 H GLU 81 H GLU 81 -31.678 30.875 -14.830 646 HA GLU 81 HA GLU 81 -31.349 28.917 -16.899 647 HB2 GLU 81 1HB GLU 81 -33.581 30.262 -15.638 648 HB3 GLU 81 2HB GLU 81 -33.771 30.187 -17.386 649 HG2 GLU 81 1HG GLU 81 -33.289 27.864 -15.536 650 HG3 GLU 81 2HG GLU 81 -34.806 28.276 -16.333 651 H GLY 82 H GLY 82 -31.804 29.259 -19.130 652 HA2 GLY 82 1HA GLY 82 -31.472 30.433 -21.125 653 HA3 GLY 82 2HA GLY 82 -31.201 31.900 -20.190 654 H TYR 83 H TYR 83 -29.379 29.911 -18.579 655 HA TYR 83 HA TYR 83 -27.017 30.180 -20.320 656 HB2 TYR 83 1HB TYR 83 -27.118 30.413 -17.299 657 HB3 TYR 83 2HB TYR 83 -25.684 30.577 -18.301 658 HD1 TYR 83 HD2 TYR 83 -28.885 32.163 -17.368 659 HD2 TYR 83 HD1 TYR 83 -25.153 32.643 -19.348 660 HE1 TYR 83 HE2 TYR 83 -29.272 34.584 -17.494 661 HE2 TYR 83 HE1 TYR 83 -25.527 35.070 -19.476 662 HH TYR 83 HH TYR 83 -27.262 36.681 -19.382 663 H HIS 84 H HIS 84 -25.227 28.649 -19.550 664 HA HIS 84 HA HIS 84 -26.322 26.203 -18.317 665 HB2 HIS 84 1HB HIS 84 -24.391 26.386 -20.635 666 HB3 HIS 84 2HB HIS 84 -24.639 24.920 -19.701 667 HD1 HIS 84 HD1 HIS 84 -25.577 23.568 -21.665 668 HD2 HIS 84 HD2 HIS 84 -27.690 27.055 -20.864 669 HE1 HIS 84 HE1 HIS 84 -27.612 23.544 -23.174 670 HA PRO 85 HA PRO 85 -22.781 26.693 -15.652 671 HB2 PRO 85 1HB PRO 85 -22.776 24.238 -14.528 672 HB3 PRO 85 2HB PRO 85 -23.981 25.463 -14.113 673 HG2 PRO 85 1HG PRO 85 -24.218 23.107 -15.935 674 HG3 PRO 85 2HG PRO 85 -25.398 23.756 -14.783 675 HD2 PRO 85 1HD PRO 85 -25.472 24.220 -17.482 676 HD3 PRO 85 2HD PRO 85 -26.170 25.313 -16.273 677 H LYS 86 H LYS 86 -20.680 26.574 -16.196 678 HA LYS 86 HA LYS 86 -19.716 24.074 -17.379 679 HB2 LYS 86 1HB LYS 86 -18.387 25.170 -19.024 680 HB3 LYS 86 2HB LYS 86 -20.021 25.788 -19.183 681 HG2 LYS 86 1HG LYS 86 -19.372 27.821 -18.003 682 HG3 LYS 86 2HG LYS 86 -17.732 27.194 -17.820 683 HD2 LYS 86 1HD LYS 86 -17.619 27.018 -20.319 684 HD3 LYS 86 2HD LYS 86 -19.158 27.875 -20.388 685 HE2 LYS 86 1HE LYS 86 -17.398 29.461 -20.730 686 HE3 LYS 86 2HE LYS 86 -18.098 29.746 -19.137 687 HZ1 LYS 86 3HZ LYS 86 -15.634 29.801 -19.192 688 HZ2 LYS 86 1HZ LYS 86 -15.634 28.154 -19.600 689 HZ3 LYS 86 2HZ LYS 86 -16.260 28.657 -18.112 690 H LEU 87 H LEU 87 -17.556 23.582 -16.944 691 HA LEU 87 HA LEU 87 -16.763 24.504 -14.336 692 HB2 LEU 87 1HB LEU 87 -15.530 22.462 -16.181 693 HB3 LEU 87 2HB LEU 87 -15.043 22.746 -14.521 694 HG LEU 87 HG LEU 87 -17.806 21.837 -15.316 695 HD11 LEU 87 1HD1 LEU 87 -17.115 19.619 -14.570 696 HD12 LEU 87 2HD1 LEU 87 -15.473 20.209 -14.318 697 HD13 LEU 87 3HD1 LEU 87 -16.151 20.157 -15.945 698 HD21 LEU 87 3HD2 LEU 87 -17.698 22.983 -13.170 699 HD22 LEU 87 1HD2 LEU 87 -16.376 21.931 -12.660 700 HD23 LEU 87 2HD2 LEU 87 -17.982 21.258 -12.941 701 H VAL 88 H VAL 88 -14.992 25.631 -13.792 702 HA VAL 88 HA VAL 88 -13.047 26.355 -15.870 703 HB VAL 88 HB VAL 88 -12.896 28.653 -14.957 704 HG11 VAL 88 1HG1 VAL 88 -15.640 27.899 -15.946 705 HG12 VAL 88 2HG1 VAL 88 -14.238 28.289 -16.942 706 HG13 VAL 88 3HG1 VAL 88 -14.974 29.531 -15.928 707 HG21 VAL 88 3HG2 VAL 88 -13.770 28.230 -12.722 708 HG22 VAL 88 1HG2 VAL 88 -15.368 27.908 -13.398 709 HG23 VAL 88 2HG2 VAL 88 -14.669 29.523 -13.517 710 H VAL 89 H VAL 89 -10.940 26.843 -15.018 711 HA VAL 89 HA VAL 89 -10.570 25.833 -12.292 712 HB VAL 89 HB VAL 89 -9.368 24.501 -13.884 713 HG11 VAL 89 1HG1 VAL 89 -8.041 27.040 -14.815 714 HG12 VAL 89 2HG1 VAL 89 -9.189 26.061 -15.730 715 HG13 VAL 89 3HG1 VAL 89 -7.603 25.408 -15.319 716 HG21 VAL 89 3HG2 VAL 89 -7.509 26.314 -12.354 717 HG22 VAL 89 1HG2 VAL 89 -7.068 24.742 -13.024 718 HG23 VAL 89 2HG2 VAL 89 -8.283 24.850 -11.749 719 H ASN 90 H ASN 90 -10.314 27.327 -10.810 720 HA ASN 90 HA ASN 90 -8.887 29.806 -11.520 721 HB2 ASN 90 1HB ASN 90 -11.401 29.487 -9.874 722 HB3 ASN 90 2HB ASN 90 -10.416 30.942 -9.844 723 HD21 ASN 90 2HD2 ASN 90 -13.191 30.530 -10.720 724 HD22 ASN 90 1HD2 ASN 90 -13.257 31.081 -12.361 725 H GLY 91 H GLY 91 -6.979 29.468 -10.581 726 HA2 GLY 91 1HA GLY 91 -5.432 29.343 -8.881 727 HA3 GLY 91 2HA GLY 91 -6.754 29.607 -7.754 728 H ARG 92 H ARG 92 -7.025 28.044 -6.343 729 HA ARG 92 HA ARG 92 -6.112 25.342 -6.998 730 HB2 ARG 92 1HB ARG 92 -5.039 26.458 -5.092 731 HB3 ARG 92 2HB ARG 92 -6.608 26.709 -4.344 732 HG2 ARG 92 1HG ARG 92 -5.414 24.875 -3.320 733 HG3 ARG 92 2HG ARG 92 -6.897 24.332 -4.099 734 HD2 ARG 92 1HD ARG 92 -5.189 22.740 -4.597 735 HD3 ARG 92 2HD ARG 92 -5.538 23.645 -6.067 736 HE ARG 92 HE ARG 92 -3.317 24.642 -4.496 737 HH11 ARG 92 1HH1 ARG 92 -4.350 22.587 -7.121 738 HH12 ARG 92 2HH1 ARG 92 -2.786 22.512 -7.868 739 HH21 ARG 92 1HH2 ARG 92 -1.237 24.521 -5.433 740 HH22 ARG 92 2HH2 ARG 92 -1.000 23.590 -6.885 741 H SER 93 H SER 93 -8.756 26.742 -7.615 742 HA SER 93 HA SER 93 -10.432 24.563 -6.598 743 HB2 SER 93 1HB SER 93 -10.898 26.514 -5.197 744 HB3 SER 93 2HB SER 93 -11.233 27.480 -6.630 745 HG SER 93 HG SER 93 -12.795 25.470 -6.922 746 H ILE 94 H ILE 94 -11.680 23.650 -8.067 747 HA ILE 94 HA ILE 94 -11.945 24.834 -10.711 748 HB ILE 94 HB ILE 94 -12.994 22.201 -9.629 749 HG12 ILE 94 1HG1 ILE 94 -10.687 22.746 -11.509 750 HG13 ILE 94 2HG1 ILE 94 -10.507 22.403 -9.792 751 HG21 ILE 94 1HG2 ILE 94 -13.401 21.643 -12.006 752 HG22 ILE 94 2HG2 ILE 94 -12.971 23.297 -12.444 753 HG23 ILE 94 3HG2 ILE 94 -14.390 22.991 -11.444 754 HD11 ILE 94 3HD1 ILE 94 -11.534 20.202 -10.159 755 HD12 ILE 94 1HD1 ILE 94 -10.052 20.430 -11.087 756 HD13 ILE 94 2HD1 ILE 94 -11.622 20.549 -11.886 757 H ASP 95 H ASP 95 -13.641 26.088 -11.206 758 HA ASP 95 HA ASP 95 -15.849 26.158 -9.263 759 HB2 ASP 95 1HB ASP 95 -14.105 28.182 -9.742 760 HB3 ASP 95 2HB ASP 95 -15.366 28.557 -10.912 761 H ILE 96 H ILE 96 -17.744 27.487 -10.348 762 HA ILE 96 HA ILE 96 -18.239 26.327 -13.007 763 HB ILE 96 HB ILE 96 -20.245 26.344 -10.743 764 HG12 ILE 96 1HG1 ILE 96 -18.835 23.957 -11.949 765 HG13 ILE 96 2HG1 ILE 96 -18.326 24.732 -10.453 766 HG21 ILE 96 1HG2 ILE 96 -21.233 26.545 -12.969 767 HG22 ILE 96 2HG2 ILE 96 -21.604 24.978 -12.250 768 HG23 ILE 96 3HG2 ILE 96 -20.360 25.106 -13.493 769 HD11 ILE 96 3HD1 ILE 96 -21.008 23.465 -10.928 770 HD12 ILE 96 1HD1 ILE 96 -20.442 24.186 -9.421 771 HD13 ILE 96 2HD1 ILE 96 -19.661 22.737 -10.054 772 H GLU 97 H GLU 97 -18.579 27.985 -14.332 773 HA GLU 97 HA GLU 97 -20.301 30.173 -13.370 774 HB2 GLU 97 1HB GLU 97 -19.216 31.670 -14.963 775 HB3 GLU 97 2HB GLU 97 -18.043 31.004 -13.836 776 HG2 GLU 97 1HG GLU 97 -17.139 29.567 -15.472 777 HG3 GLU 97 2HG GLU 97 -18.491 29.848 -16.571 778 H TYR 98 H TYR 98 -21.531 31.221 -15.142 779 HA TYR 98 HA TYR 98 -22.668 29.087 -16.795 780 HB2 TYR 98 1HB TYR 98 -23.788 31.528 -15.485 781 HB3 TYR 98 2HB TYR 98 -24.606 30.847 -16.891 782 HD1 TYR 98 HD2 TYR 98 -23.398 30.012 -13.473 783 HD2 TYR 98 HD1 TYR 98 -26.053 29.023 -16.650 784 HE1 TYR 98 HE2 TYR 98 -24.540 28.401 -12.007 785 HE2 TYR 98 HE1 TYR 98 -27.205 27.411 -15.186 786 HH TYR 98 HH TYR 98 -26.666 26.064 -13.124 787 H TYR 99 H TYR 99 -22.884 29.297 -18.959 788 HA TYR 99 HA TYR 99 -22.072 31.870 -20.145 789 HB2 TYR 99 1HB TYR 99 -21.302 30.673 -22.122 790 HB3 TYR 99 2HB TYR 99 -20.477 30.065 -20.694 791 HD1 TYR 99 HD1 TYR 99 -20.887 27.792 -19.894 792 HD2 TYR 99 HD2 TYR 99 -22.861 29.276 -23.363 793 HE1 TYR 99 HE1 TYR 99 -21.512 25.499 -20.515 794 HE2 TYR 99 HE2 TYR 99 -23.495 26.986 -23.988 795 HH TYR 99 HH TYR 99 -23.004 24.295 -21.837 796 H GLU 100 H GLU 100 -23.304 32.649 -21.890 797 HA GLU 100 HA GLU 100 -26.063 32.137 -21.694 798 HB2 GLU 100 1HB GLU 100 -24.541 33.510 -23.916 799 HB3 GLU 100 2HB GLU 100 -26.287 33.539 -23.720 800 HG2 GLU 100 1HG GLU 100 -25.849 34.558 -21.430 801 HG3 GLU 100 2HG GLU 100 -24.196 34.806 -21.991 802 H CYS 101 H CYS 101 -27.247 30.582 -22.496 803 HA CYS 101 HA CYS 101 -26.481 28.420 -23.994 804 HB2 CYS 101 1HB CYS 101 -28.697 28.750 -22.868 805 HB3 CYS 101 2HB CYS 101 -29.170 29.800 -24.193 806 HA PRO 102 HA PRO 102 -25.438 30.049 -28.030 807 HB2 PRO 102 1HB PRO 102 -26.030 27.688 -29.400 808 HB3 PRO 102 2HB PRO 102 -24.466 28.108 -28.698 809 HG2 PRO 102 1HG PRO 102 -26.631 26.373 -27.611 810 HG3 PRO 102 2HG PRO 102 -24.872 26.197 -27.478 811 HD2 PRO 102 1HD PRO 102 -26.356 27.075 -25.424 812 HD3 PRO 102 2HD PRO 102 -24.729 27.717 -25.735 813 H VAL 103 H VAL 103 -28.412 28.335 -27.350 814 HA VAL 103 HA VAL 103 -29.810 29.274 -29.683 815 HB VAL 103 HB VAL 103 -31.091 28.168 -27.187 816 HG11 VAL 103 1HG1 VAL 103 -32.605 29.044 -28.871 817 HG12 VAL 103 2HG1 VAL 103 -32.750 27.290 -28.751 818 HG13 VAL 103 3HG1 VAL 103 -31.864 28.012 -30.095 819 HG21 VAL 103 3HG2 VAL 103 -29.272 26.668 -27.731 820 HG22 VAL 103 1HG2 VAL 103 -29.805 26.593 -29.412 821 HG23 VAL 103 2HG2 VAL 103 -30.818 25.918 -28.134 822 H LYS 104 H LYS 104 -29.036 30.520 -26.619 823 HA LYS 104 HA LYS 104 -31.324 32.268 -26.363 824 HB2 LYS 104 1HB LYS 104 -30.082 31.249 -24.407 825 HB3 LYS 104 2HB LYS 104 -28.736 32.307 -24.790 826 HG2 LYS 104 1HG LYS 104 -31.445 33.460 -24.277 827 HG3 LYS 104 2HG LYS 104 -30.417 32.964 -22.932 828 HD2 LYS 104 1HD LYS 104 -28.630 34.431 -23.803 829 HD3 LYS 104 2HD LYS 104 -29.722 34.961 -25.084 830 HE2 LYS 104 1HE LYS 104 -31.250 35.871 -23.438 831 HE3 LYS 104 2HE LYS 104 -30.229 35.277 -22.128 832 HZ1 LYS 104 3HZ LYS 104 -28.434 36.721 -23.016 833 HZ2 LYS 104 1HZ LYS 104 -29.785 37.582 -22.448 834 HZ3 LYS 104 2HZ LYS 104 -29.551 37.380 -24.113 835 H ARG 105 H ARG 105 -27.982 32.409 -27.409 836 HA ARG 105 HA ARG 105 -27.944 35.235 -27.867 837 HB2 ARG 105 1HB ARG 105 -26.179 33.119 -29.119 838 HB3 ARG 105 2HB ARG 105 -25.851 34.841 -29.029 839 HG2 ARG 105 1HG ARG 105 -25.769 34.634 -26.554 840 HG3 ARG 105 2HG ARG 105 -25.929 32.885 -26.746 841 HD2 ARG 105 1HD ARG 105 -23.699 34.633 -27.783 842 HD3 ARG 105 2HD ARG 105 -23.596 33.449 -26.483 843 HE ARG 105 HE ARG 105 -24.454 32.297 -28.970 844 HH11 ARG 105 1HH1 ARG 105 -21.623 33.358 -27.191 845 HH12 ARG 105 2HH1 ARG 105 -20.550 32.246 -27.994 846 HH21 ARG 105 1HH2 ARG 105 -23.044 30.891 -30.056 847 HH22 ARG 105 2HH2 ARG 105 -21.361 30.853 -29.631 848 H LYS 106 H LYS 106 -29.502 35.952 -29.204 849 HA LYS 106 HA LYS 106 -29.560 34.855 -31.923 850 HB2 LYS 106 1HB LYS 106 -32.018 34.815 -31.920 851 HB3 LYS 106 2HB LYS 106 -31.353 33.712 -30.723 852 HG2 LYS 106 1HG LYS 106 -31.760 35.454 -28.992 853 HG3 LYS 106 2HG LYS 106 -32.590 36.407 -30.225 854 HD2 LYS 106 1HD LYS 106 -34.108 34.458 -30.596 855 HD3 LYS 106 2HD LYS 106 -33.345 33.669 -29.215 856 HE2 LYS 106 1HE LYS 106 -35.420 34.746 -28.542 857 HE3 LYS 106 2HE LYS 106 -34.040 35.531 -27.778 858 HZ1 LYS 106 3HZ LYS 106 -35.770 37.055 -28.721 859 HZ2 LYS 106 1HZ LYS 106 -35.298 36.544 -30.263 860 HZ3 LYS 106 2HZ LYS 106 -34.194 37.347 -29.261 Start of MODEL 13 1 HA MET 1 HA MET 1 0.886 -8.581 -14.008 2 HB2 MET 1 1HB MET 1 1.338 -6.161 -13.742 3 HB3 MET 1 2HB MET 1 2.756 -7.061 -14.249 4 HG2 MET 1 1HG MET 1 1.010 -5.514 -16.143 5 HG3 MET 1 2HG MET 1 2.424 -4.835 -15.338 6 HE1 MET 1 2HE MET 1 5.364 -6.885 -16.844 7 HE2 MET 1 3HE MET 1 4.519 -7.191 -15.326 8 HE3 MET 1 1HE MET 1 4.895 -5.535 -15.809 9 H GLU 2 H GLU 2 -1.104 -8.261 -13.397 10 HA GLU 2 HA GLU 2 -2.970 -6.725 -15.050 11 HB2 GLU 2 1HB GLU 2 -3.337 -9.626 -14.268 12 HB3 GLU 2 2HB GLU 2 -4.644 -8.600 -14.837 13 HG2 GLU 2 1HG GLU 2 -3.570 -8.344 -16.975 14 HG3 GLU 2 2HG GLU 2 -2.165 -9.248 -16.410 15 HA PRO 3 HA PRO 3 -4.762 -5.782 -11.038 16 HB2 PRO 3 1HB PRO 3 -7.445 -5.892 -11.567 17 HB3 PRO 3 2HB PRO 3 -6.425 -4.516 -11.996 18 HG2 PRO 3 1HG PRO 3 -7.371 -6.779 -13.708 19 HG3 PRO 3 2HG PRO 3 -7.257 -5.051 -14.092 20 HD2 PRO 3 1HD PRO 3 -5.412 -6.827 -14.937 21 HD3 PRO 3 2HD PRO 3 -4.986 -5.158 -14.502 22 H ILE 4 H ILE 4 -3.990 -7.747 -10.132 23 HA ILE 4 HA ILE 4 -5.512 -10.179 -10.381 24 HB ILE 4 HB ILE 4 -3.243 -9.516 -8.497 25 HG12 ILE 4 1HG1 ILE 4 -2.517 -9.250 -10.795 26 HG13 ILE 4 2HG1 ILE 4 -1.817 -10.717 -10.124 27 HG21 ILE 4 1HG2 ILE 4 -4.405 -12.166 -9.330 28 HG22 ILE 4 2HG2 ILE 4 -4.476 -11.431 -7.727 29 HG23 ILE 4 3HG2 ILE 4 -2.929 -11.957 -8.389 30 HD11 ILE 4 3HD1 ILE 4 -4.208 -10.589 -11.945 31 HD12 ILE 4 1HD1 ILE 4 -3.475 -12.055 -11.291 32 HD13 ILE 4 2HD1 ILE 4 -2.568 -11.039 -12.415 33 H GLY 5 H GLY 5 -4.990 -7.680 -7.983 34 HA2 GLY 5 1HA GLY 5 -7.415 -7.621 -6.787 35 HA3 GLY 5 2HA GLY 5 -6.623 -8.977 -5.992 36 H ARG 6 H ARG 6 -7.352 -5.919 -5.481 37 HA ARG 6 HA ARG 6 -4.767 -5.250 -4.250 38 HB2 ARG 6 1HB ARG 6 -5.726 -2.921 -4.077 39 HB3 ARG 6 2HB ARG 6 -5.432 -3.501 -5.708 40 HG2 ARG 6 1HG ARG 6 -7.476 -2.530 -5.962 41 HG3 ARG 6 2HG ARG 6 -7.958 -4.185 -5.594 42 HD2 ARG 6 1HD ARG 6 -8.168 -3.488 -3.195 43 HD3 ARG 6 2HD ARG 6 -7.898 -1.826 -3.720 44 HE ARG 6 HE ARG 6 -10.176 -3.472 -4.636 45 HH11 ARG 6 1HH1 ARG 6 -8.797 -0.376 -3.718 46 HH12 ARG 6 2HH1 ARG 6 -10.328 0.443 -3.751 47 HH21 ARG 6 1HH2 ARG 6 -12.182 -2.401 -4.637 48 HH22 ARG 6 2HH2 ARG 6 -12.260 -0.706 -4.273 49 H SER 7 H SER 7 -7.142 -6.994 -3.351 50 HA SER 7 HA SER 7 -7.335 -5.827 -0.654 51 HB2 SER 7 1HB SER 7 -9.522 -6.015 -1.893 52 HB3 SER 7 2HB SER 7 -9.293 -7.760 -1.930 53 HG SER 7 HG SER 7 -9.232 -7.675 0.397 54 H LEU 8 H LEU 8 -5.660 -6.813 0.358 55 HA LEU 8 HA LEU 8 -4.916 -9.531 -0.186 56 HB2 LEU 8 1HB LEU 8 -3.359 -7.647 0.477 57 HB3 LEU 8 2HB LEU 8 -4.005 -7.774 2.097 58 HG LEU 8 HG LEU 8 -1.765 -8.895 1.649 59 HD11 LEU 8 1HD1 LEU 8 -2.262 -10.812 3.063 60 HD12 LEU 8 2HD1 LEU 8 -3.987 -10.594 2.767 61 HD13 LEU 8 3HD1 LEU 8 -3.079 -9.363 3.645 62 HD21 LEU 8 3HD2 LEU 8 -1.854 -11.143 0.679 63 HD22 LEU 8 1HD2 LEU 8 -2.290 -9.901 -0.495 64 HD23 LEU 8 2HD2 LEU 8 -3.547 -10.885 0.255 65 H GLN 9 H GLN 9 -6.589 -7.806 2.371 66 HA GLN 9 HA GLN 9 -7.184 -10.342 3.711 67 HB2 GLN 9 1HB GLN 9 -7.585 -9.034 5.727 68 HB3 GLN 9 2HB GLN 9 -5.989 -8.670 5.090 69 HG2 GLN 9 1HG GLN 9 -8.407 -6.946 4.602 70 HG3 GLN 9 2HG GLN 9 -7.287 -6.707 5.939 71 HE21 GLN 9 2HE2 GLN 9 -5.232 -5.938 5.525 72 HE22 GLN 9 1HE2 GLN 9 -4.794 -5.204 4.020 73 H GLY 10 H GLY 10 -9.336 -9.830 5.092 74 HA2 GLY 10 1HA GLY 10 -11.386 -9.209 3.088 75 HA3 GLY 10 2HA GLY 10 -11.637 -10.160 4.548 76 H VAL 11 H VAL 11 -11.438 -6.976 3.189 77 HA VAL 11 HA VAL 11 -11.422 -5.452 5.549 78 HB VAL 11 HB VAL 11 -12.678 -4.688 2.907 79 HG11 VAL 11 1HG1 VAL 11 -13.306 -3.209 4.732 80 HG12 VAL 11 2HG1 VAL 11 -12.212 -2.389 3.621 81 HG13 VAL 11 3HG1 VAL 11 -11.609 -2.996 5.163 82 HG21 VAL 11 3HG2 VAL 11 -10.383 -5.408 2.570 83 HG22 VAL 11 1HG2 VAL 11 -9.839 -4.338 3.863 84 HG23 VAL 11 2HG2 VAL 11 -10.512 -3.660 2.381 85 H THR 12 H THR 12 -12.856 -5.724 7.118 86 HA THR 12 HA THR 12 -15.663 -6.215 6.396 87 HB THR 12 HB THR 12 -15.478 -6.792 9.072 88 HG1 THR 12 HG1 THR 12 -13.070 -7.650 7.788 89 HG21 THR 12 3HG2 THR 12 -15.532 -9.143 8.365 90 HG22 THR 12 1HG2 THR 12 -15.030 -8.666 6.744 91 HG23 THR 12 2HG2 THR 12 -16.597 -8.150 7.370 92 H GLY 13 H GLY 13 -13.817 -3.705 7.064 93 HA2 GLY 13 1HA GLY 13 -15.936 -2.367 8.630 94 HA3 GLY 13 2HA GLY 13 -14.236 -1.914 8.713 95 H ARG 14 H ARG 14 -17.125 -1.022 7.453 96 HA ARG 14 HA ARG 14 -15.865 0.575 5.363 97 HB2 ARG 14 1HB ARG 14 -18.162 -1.317 4.831 98 HB3 ARG 14 2HB ARG 14 -17.812 0.057 3.796 99 HG2 ARG 14 1HG ARG 14 -16.740 -1.626 2.675 100 HG3 ARG 14 2HG ARG 14 -15.429 -1.005 3.677 101 HD2 ARG 14 1HD ARG 14 -15.302 -3.334 3.894 102 HD3 ARG 14 2HD ARG 14 -16.090 -2.781 5.370 103 HE ARG 14 HE ARG 14 -17.456 -4.061 3.097 104 HH11 ARG 14 1HH1 ARG 14 -17.387 -3.141 6.467 105 HH12 ARG 14 2HH1 ARG 14 -18.676 -4.209 6.921 106 HH21 ARG 14 1HH2 ARG 14 -19.130 -5.480 3.684 107 HH22 ARG 14 2HH2 ARG 14 -19.666 -5.557 5.335 108 HA PRO 15 HA PRO 15 -18.760 3.085 7.932 109 HB2 PRO 15 1HB PRO 15 -17.280 5.361 7.457 110 HB3 PRO 15 2HB PRO 15 -17.033 4.282 8.834 111 HG2 PRO 15 1HG PRO 15 -15.563 4.395 6.225 112 HG3 PRO 15 2HG PRO 15 -14.919 4.181 7.865 113 HD2 PRO 15 1HD PRO 15 -15.200 2.097 6.209 114 HD3 PRO 15 2HD PRO 15 -15.540 1.939 7.945 115 H ASP 16 H ASP 16 -20.197 4.723 7.261 116 HA ASP 16 HA ASP 16 -21.073 4.544 4.608 117 HB2 ASP 16 1HB ASP 16 -21.641 6.700 6.654 118 HB3 ASP 16 2HB ASP 16 -22.514 6.509 5.138 119 H PHE 17 H PHE 17 -18.779 6.664 6.101 120 HA PHE 17 HA PHE 17 -18.717 8.777 4.311 121 HB2 PHE 17 1HB PHE 17 -17.486 8.824 6.410 122 HB3 PHE 17 2HB PHE 17 -16.421 7.540 5.846 123 HD1 PHE 17 HD2 PHE 17 -17.444 11.046 5.207 124 HD2 PHE 17 HD1 PHE 17 -14.507 8.026 4.594 125 HE1 PHE 17 HE2 PHE 17 -15.918 12.726 4.253 126 HE2 PHE 17 HE1 PHE 17 -12.978 9.699 3.640 127 HZ PHE 17 HZ PHE 17 -13.681 12.051 3.469 128 H GLN 18 H GLN 18 -16.862 5.728 4.173 129 HA GLN 18 HA GLN 18 -15.541 6.500 1.765 130 HB2 GLN 18 1HB GLN 18 -14.527 4.353 1.781 131 HB3 GLN 18 2HB GLN 18 -14.631 4.869 3.447 132 HG2 GLN 18 1HG GLN 18 -15.296 2.718 3.687 133 HG3 GLN 18 2HG GLN 18 -16.862 3.480 3.417 134 HE21 GLN 18 2HE2 GLN 18 -14.517 2.900 0.844 135 HE22 GLN 18 1HE2 GLN 18 -15.453 1.704 0.034 136 H LYS 19 H LYS 19 -18.427 4.711 2.553 137 HA LYS 19 HA LYS 19 -18.894 3.524 0.059 138 HB2 LYS 19 1HB LYS 19 -20.846 4.415 2.181 139 HB3 LYS 19 2HB LYS 19 -21.250 3.363 0.830 140 HG2 LYS 19 1HG LYS 19 -19.609 1.728 1.655 141 HG3 LYS 19 2HG LYS 19 -19.294 2.776 3.038 142 HD2 LYS 19 1HD LYS 19 -20.831 1.079 3.733 143 HD3 LYS 19 2HD LYS 19 -21.715 2.604 3.625 144 HE2 LYS 19 1HE LYS 19 -22.580 1.956 1.439 145 HE3 LYS 19 2HE LYS 19 -21.677 0.443 1.519 146 HZ1 LYS 19 3HZ LYS 19 -23.853 1.271 3.363 147 HZ2 LYS 19 1HZ LYS 19 -22.973 -0.180 3.462 148 HZ3 LYS 19 2HZ LYS 19 -23.979 0.117 2.129 149 H ARG 20 H ARG 20 -20.042 6.606 1.421 150 HA ARG 20 HA ARG 20 -21.394 7.357 -0.975 151 HB2 ARG 20 1HB ARG 20 -21.672 9.546 0.037 152 HB3 ARG 20 2HB ARG 20 -22.062 8.283 1.196 153 HG2 ARG 20 1HG ARG 20 -20.150 8.673 2.452 154 HG3 ARG 20 2HG ARG 20 -19.340 9.521 1.134 155 HD2 ARG 20 1HD ARG 20 -21.793 10.522 2.556 156 HD3 ARG 20 2HD ARG 20 -20.144 11.010 2.953 157 HE ARG 20 HE ARG 20 -20.563 11.441 0.219 158 HH11 ARG 20 1HH1 ARG 20 -21.579 12.717 3.317 159 HH12 ARG 20 2HH1 ARG 20 -21.972 14.287 2.680 160 HH21 ARG 20 1HH2 ARG 20 -21.037 13.507 -0.613 161 HH22 ARG 20 2HH2 ARG 20 -21.672 14.740 0.432 162 H LEU 21 H LEU 21 -18.168 7.797 0.288 163 HA LEU 21 HA LEU 21 -17.364 9.904 -1.399 164 HB2 LEU 21 1HB LEU 21 -16.068 9.438 0.529 165 HB3 LEU 21 2HB LEU 21 -15.857 7.758 0.073 166 HG LEU 21 HG LEU 21 -14.458 8.487 -1.838 167 HD11 LEU 21 1HD1 LEU 21 -13.619 10.779 -1.894 168 HD12 LEU 21 2HD1 LEU 21 -14.681 11.210 -0.553 169 HD13 LEU 21 3HD1 LEU 21 -15.369 10.741 -2.108 170 HD21 LEU 21 3HD2 LEU 21 -13.529 9.448 0.868 171 HD22 LEU 21 1HD2 LEU 21 -12.496 9.043 -0.504 172 HD23 LEU 21 2HD2 LEU 21 -13.453 7.786 0.278 173 H GLU 22 H GLU 22 -16.853 6.387 -1.687 174 HA GLU 22 HA GLU 22 -15.680 6.506 -4.257 175 HB2 GLU 22 1HB GLU 22 -17.182 4.227 -2.954 176 HB3 GLU 22 2HB GLU 22 -16.132 4.088 -4.355 177 HG2 GLU 22 1HG GLU 22 -15.273 4.927 -1.595 178 HG3 GLU 22 2HG GLU 22 -15.037 3.333 -2.307 179 H GLN 23 H GLN 23 -18.948 6.441 -3.119 180 HA GLN 23 HA GLN 23 -20.243 5.712 -5.529 181 HB2 GLN 23 1HB GLN 23 -21.187 5.667 -3.186 182 HB3 GLN 23 2HB GLN 23 -21.336 7.408 -3.288 183 HG2 GLN 23 1HG GLN 23 -22.995 7.288 -4.930 184 HG3 GLN 23 2HG GLN 23 -22.643 5.594 -5.277 185 HE21 GLN 23 2HE2 GLN 23 -22.752 6.782 -2.014 186 HE22 GLN 23 1HE2 GLN 23 -24.232 6.012 -1.555 187 H MET 24 H MET 24 -19.819 8.881 -3.956 188 HA MET 24 HA MET 24 -20.816 10.350 -6.170 189 HB2 MET 24 1HB MET 24 -19.942 12.333 -5.030 190 HB3 MET 24 2HB MET 24 -20.865 11.313 -3.941 191 HG2 MET 24 1HG MET 24 -18.721 10.400 -3.089 192 HG3 MET 24 2HG MET 24 -17.873 11.567 -4.102 193 HE1 MET 24 3HE MET 24 -19.751 14.101 -3.924 194 HE2 MET 24 1HE MET 24 -17.997 14.208 -3.748 195 HE3 MET 24 2HE MET 24 -19.053 14.975 -2.560 196 H LYS 25 H LYS 25 -17.616 9.334 -5.197 197 HA LYS 25 HA LYS 25 -16.030 10.853 -6.906 198 HB2 LYS 25 1HB LYS 25 -15.496 8.985 -5.081 199 HB3 LYS 25 2HB LYS 25 -15.372 7.972 -6.510 200 HG2 LYS 25 1HG LYS 25 -13.191 8.739 -5.978 201 HG3 LYS 25 2HG LYS 25 -13.717 9.612 -7.422 202 HD2 LYS 25 1HD LYS 25 -14.251 11.555 -6.129 203 HD3 LYS 25 2HD LYS 25 -13.966 10.687 -4.619 204 HE2 LYS 25 1HE LYS 25 -11.913 11.402 -6.709 205 HE3 LYS 25 2HE LYS 25 -12.086 12.117 -5.105 206 HZ1 LYS 25 3HZ LYS 25 -10.378 10.557 -4.871 207 HZ2 LYS 25 1HZ LYS 25 -11.177 9.390 -5.816 208 HZ3 LYS 25 2HZ LYS 25 -11.741 9.751 -4.261 209 H GLU 26 H GLU 26 -17.460 7.665 -7.434 210 HA GLU 26 HA GLU 26 -16.581 7.355 -10.089 211 HB2 GLU 26 1HB GLU 26 -17.277 5.506 -8.603 212 HB3 GLU 26 2HB GLU 26 -18.934 6.082 -8.684 213 HG2 GLU 26 1HG GLU 26 -19.029 5.609 -11.043 214 HG3 GLU 26 2HG GLU 26 -17.329 5.140 -11.046 215 H LYS 27 H LYS 27 -19.510 8.721 -8.671 216 HA LYS 27 HA LYS 27 -20.983 9.006 -11.049 217 HB2 LYS 27 1HB LYS 27 -21.103 10.210 -8.337 218 HB3 LYS 27 2HB LYS 27 -21.953 11.048 -9.630 219 HG2 LYS 27 1HG LYS 27 -23.228 9.048 -10.129 220 HG3 LYS 27 2HG LYS 27 -22.337 8.149 -8.900 221 HD2 LYS 27 1HD LYS 27 -24.564 8.877 -8.128 222 HD3 LYS 27 2HD LYS 27 -23.256 9.548 -7.157 223 HE2 LYS 27 1HE LYS 27 -24.954 11.234 -7.601 224 HE3 LYS 27 2HE LYS 27 -23.429 11.661 -8.371 225 HZ1 LYS 27 3HZ LYS 27 -25.391 12.052 -9.781 226 HZ2 LYS 27 1HZ LYS 27 -25.714 10.385 -9.780 227 HZ3 LYS 27 2HZ LYS 27 -24.287 10.969 -10.485 228 H VAL 28 H VAL 28 -18.556 11.101 -9.558 229 HA VAL 28 HA VAL 28 -18.905 13.240 -11.402 230 HB VAL 28 HB VAL 28 -16.498 12.538 -9.705 231 HG11 VAL 28 1HG1 VAL 28 -15.862 14.902 -10.026 232 HG12 VAL 28 2HG1 VAL 28 -17.184 15.079 -11.179 233 HG13 VAL 28 3HG1 VAL 28 -15.846 13.983 -11.531 234 HG21 VAL 28 3HG2 VAL 28 -18.724 14.512 -9.208 235 HG22 VAL 28 1HG2 VAL 28 -17.318 14.248 -8.176 236 HG23 VAL 28 2HG2 VAL 28 -18.516 12.964 -8.388 237 H MET 29 H MET 29 -16.858 10.388 -11.257 238 HA MET 29 HA MET 29 -15.422 11.017 -13.662 239 HB2 MET 29 1HB MET 29 -15.659 8.425 -12.124 240 HB3 MET 29 2HB MET 29 -14.551 8.700 -13.461 241 HG2 MET 29 1HG MET 29 -14.540 10.154 -10.826 242 HG3 MET 29 2HG MET 29 -13.428 8.879 -11.315 243 HE1 MET 29 3HE MET 29 -12.442 11.651 -10.194 244 HE2 MET 29 1HE MET 29 -11.146 12.054 -11.322 245 HE3 MET 29 2HE MET 29 -11.333 10.396 -10.747 246 H LYS 30 H LYS 30 -18.532 10.357 -13.307 247 HA LYS 30 HA LYS 30 -18.767 8.502 -15.563 248 HB2 LYS 30 1HB LYS 30 -20.251 8.919 -13.162 249 HB3 LYS 30 2HB LYS 30 -21.303 9.304 -14.513 250 HG2 LYS 30 1HG LYS 30 -21.630 7.021 -13.928 251 HG3 LYS 30 2HG LYS 30 -20.784 7.077 -15.474 252 HD2 LYS 30 1HD LYS 30 -18.849 6.236 -14.604 253 HD3 LYS 30 2HD LYS 30 -19.145 6.916 -13.003 254 HE2 LYS 30 1HE LYS 30 -19.329 4.517 -12.894 255 HE3 LYS 30 2HE LYS 30 -20.917 5.239 -12.651 256 HZ1 LYS 30 3HZ LYS 30 -21.184 4.833 -15.167 257 HZ2 LYS 30 1HZ LYS 30 -21.326 3.516 -14.104 258 HZ3 LYS 30 2HZ LYS 30 -19.894 3.749 -14.975 259 H ASP 31 H ASP 31 -18.785 11.796 -14.890 260 HA ASP 31 HA ASP 31 -20.953 12.472 -16.677 261 HB2 ASP 31 1HB ASP 31 -20.693 13.759 -14.633 262 HB3 ASP 31 2HB ASP 31 -19.074 14.249 -15.126 263 H GLN 32 H GLN 32 -20.820 13.557 -18.556 264 HA GLN 32 HA GLN 32 -18.559 12.925 -20.173 265 HB2 GLN 32 1HB GLN 32 -20.993 14.602 -20.808 266 HB3 GLN 32 2HB GLN 32 -19.846 13.975 -21.985 267 HG2 GLN 32 1HG GLN 32 -20.493 11.722 -21.512 268 HG3 GLN 32 2HG GLN 32 -21.508 12.246 -20.170 269 HE21 GLN 32 2HE2 GLN 32 -23.332 11.293 -21.054 270 HE22 GLN 32 1HE2 GLN 32 -24.155 11.971 -22.415 271 H ASP 33 H ASP 33 -19.929 15.957 -18.916 272 HA ASP 33 HA ASP 33 -18.117 17.650 -20.298 273 HB2 ASP 33 1HB ASP 33 -19.688 18.197 -17.773 274 HB3 ASP 33 2HB ASP 33 -18.861 19.409 -18.742 275 H VAL 34 H VAL 34 -18.167 16.208 -17.083 276 HA VAL 34 HA VAL 34 -15.896 17.334 -15.988 277 HB VAL 34 HB VAL 34 -17.039 14.561 -15.683 278 HG11 VAL 34 1HG1 VAL 34 -15.627 14.272 -13.709 279 HG12 VAL 34 2HG1 VAL 34 -14.810 15.798 -14.062 280 HG13 VAL 34 3HG1 VAL 34 -14.646 14.435 -15.168 281 HG21 VAL 34 3HG2 VAL 34 -18.415 16.386 -14.847 282 HG22 VAL 34 1HG2 VAL 34 -17.055 17.006 -13.912 283 HG23 VAL 34 2HG2 VAL 34 -17.768 15.447 -13.501 284 H GLN 35 H GLN 35 -16.099 14.478 -18.135 285 HA GLN 35 HA GLN 35 -13.373 13.834 -18.177 286 HB2 GLN 35 1HB GLN 35 -15.173 13.624 -20.592 287 HB3 GLN 35 2HB GLN 35 -13.797 12.614 -20.181 288 HG2 GLN 35 1HG GLN 35 -16.415 12.708 -18.716 289 HG3 GLN 35 2HG GLN 35 -15.901 11.460 -19.844 290 HE21 GLN 35 2HE2 GLN 35 -16.650 11.355 -17.010 291 HE22 GLN 35 1HE2 GLN 35 -15.334 10.561 -16.221 292 H ALA 36 H ALA 36 -15.218 15.908 -20.394 293 HA ALA 36 HA ALA 36 -13.051 16.592 -22.059 294 HB1 ALA 36 1HB ALA 36 -15.374 16.831 -22.759 295 HB2 ALA 36 2HB ALA 36 -14.502 18.356 -22.922 296 HB3 ALA 36 3HB ALA 36 -15.610 18.114 -21.571 297 H PHE 37 H PHE 37 -14.417 18.190 -19.216 298 HA PHE 37 HA PHE 37 -12.823 20.507 -19.337 299 HB2 PHE 37 1HB PHE 37 -14.798 20.406 -17.929 300 HB3 PHE 37 2HB PHE 37 -14.078 19.124 -16.960 301 HD1 PHE 37 HD2 PHE 37 -13.616 22.664 -17.961 302 HD2 PHE 37 HD1 PHE 37 -12.796 19.631 -15.100 303 HE1 PHE 37 HE2 PHE 37 -12.651 24.354 -16.457 304 HE2 PHE 37 HE1 PHE 37 -11.832 21.315 -13.585 305 HZ PHE 37 HZ PHE 37 -11.760 23.681 -14.263 306 H LEU 38 H LEU 38 -12.323 17.354 -17.855 307 HA LEU 38 HA LEU 38 -9.991 17.957 -16.423 308 HB2 LEU 38 1HB LEU 38 -11.427 15.546 -17.247 309 HB3 LEU 38 2HB LEU 38 -9.695 15.311 -17.119 310 HG LEU 38 HG LEU 38 -10.810 14.692 -15.050 311 HD11 LEU 38 1HD1 LEU 38 -8.550 15.604 -14.926 312 HD12 LEU 38 2HD1 LEU 38 -9.491 16.048 -13.501 313 HD13 LEU 38 3HD1 LEU 38 -9.210 17.232 -14.776 314 HD21 LEU 38 3HD2 LEU 38 -12.758 16.143 -15.202 315 HD22 LEU 38 1HD2 LEU 38 -11.735 17.559 -14.948 316 HD23 LEU 38 2HD2 LEU 38 -11.925 16.367 -13.662 317 H LYS 39 H LYS 39 -10.385 16.601 -19.689 318 HA LYS 39 HA LYS 39 -7.594 16.306 -20.134 319 HB2 LYS 39 1HB LYS 39 -8.167 15.965 -22.491 320 HB3 LYS 39 2HB LYS 39 -9.243 15.049 -21.446 321 HG2 LYS 39 1HG LYS 39 -11.014 16.620 -21.777 322 HG3 LYS 39 2HG LYS 39 -9.940 17.722 -22.640 323 HD2 LYS 39 1HD LYS 39 -10.576 14.930 -23.585 324 HD3 LYS 39 2HD LYS 39 -11.477 16.361 -24.090 325 HE2 LYS 39 1HE LYS 39 -8.505 16.001 -24.450 326 HE3 LYS 39 2HE LYS 39 -9.703 15.656 -25.694 327 HZ1 LYS 39 3HZ LYS 39 -8.794 17.829 -26.045 328 HZ2 LYS 39 1HZ LYS 39 -9.149 18.306 -24.459 329 HZ3 LYS 39 2HZ LYS 39 -10.401 18.004 -25.549 330 H GLU 40 H GLU 40 -9.790 18.949 -20.469 331 HA GLU 40 HA GLU 40 -8.109 20.485 -22.197 332 HB2 GLU 40 1HB GLU 40 -10.756 20.621 -21.132 333 HB3 GLU 40 2HB GLU 40 -9.945 22.151 -20.835 334 HG2 GLU 40 1HG GLU 40 -11.202 22.069 -22.967 335 HG3 GLU 40 2HG GLU 40 -9.491 22.437 -23.165 336 H ASN 41 H ASN 41 -8.542 20.194 -18.747 337 HA ASN 41 HA ASN 41 -6.600 22.377 -18.369 338 HB2 ASN 41 1HB ASN 41 -8.936 21.547 -16.642 339 HB3 ASN 41 2HB ASN 41 -7.691 22.672 -16.115 340 HD21 ASN 41 2HD2 ASN 41 -10.390 22.167 -18.240 341 HD22 ASN 41 1HD2 ASN 41 -10.625 23.830 -18.658 342 H GLU 42 H GLU 42 -6.110 19.455 -18.708 343 HA GLU 42 HA GLU 42 -5.637 18.319 -16.148 344 HB2 GLU 42 1HB GLU 42 -4.550 16.505 -17.311 345 HB3 GLU 42 2HB GLU 42 -6.020 16.957 -18.157 346 HG2 GLU 42 1HG GLU 42 -4.770 18.081 -19.863 347 HG3 GLU 42 2HG GLU 42 -3.265 17.859 -18.968 348 H GLU 43 H GLU 43 -3.861 20.529 -18.034 349 HA GLU 43 HA GLU 43 -1.258 19.937 -17.024 350 HB2 GLU 43 1HB GLU 43 -1.979 21.374 -19.097 351 HB3 GLU 43 2HB GLU 43 -2.128 22.674 -17.926 352 HG2 GLU 43 1HG GLU 43 0.383 21.100 -18.462 353 HG3 GLU 43 2HG GLU 43 0.016 22.691 -19.119 354 H VAL 44 H VAL 44 -3.958 21.949 -16.060 355 HA VAL 44 HA VAL 44 -2.369 23.207 -13.950 356 HB VAL 44 HB VAL 44 -5.247 23.778 -14.664 357 HG11 VAL 44 1HG1 VAL 44 -3.166 25.375 -13.172 358 HG12 VAL 44 2HG1 VAL 44 -4.582 24.589 -12.478 359 HG13 VAL 44 3HG1 VAL 44 -4.784 25.946 -13.587 360 HG21 VAL 44 3HG2 VAL 44 -4.433 25.625 -16.024 361 HG22 VAL 44 1HG2 VAL 44 -3.822 24.085 -16.634 362 HG23 VAL 44 2HG2 VAL 44 -2.766 25.146 -15.699 363 H ILE 45 H ILE 45 -5.211 21.191 -14.406 364 HA ILE 45 HA ILE 45 -5.641 21.001 -11.532 365 HB ILE 45 HB ILE 45 -7.218 19.806 -13.812 366 HG12 ILE 45 1HG1 ILE 45 -7.791 22.263 -12.150 367 HG13 ILE 45 2HG1 ILE 45 -7.168 22.291 -13.796 368 HG21 ILE 45 1HG2 ILE 45 -8.984 19.508 -12.138 369 HG22 ILE 45 2HG2 ILE 45 -7.890 20.103 -10.890 370 HG23 ILE 45 3HG2 ILE 45 -7.532 18.595 -11.727 371 HD11 ILE 45 3HD1 ILE 45 -9.543 22.713 -13.759 372 HD12 ILE 45 1HD1 ILE 45 -9.816 21.189 -12.912 373 HD13 ILE 45 2HD1 ILE 45 -9.198 21.181 -14.565 374 H ASP 46 H ASP 46 -5.438 19.140 -10.364 375 HA ASP 46 HA ASP 46 -4.379 16.772 -11.743 376 HB2 ASP 46 1HB ASP 46 -2.576 16.521 -10.292 377 HB3 ASP 46 2HB ASP 46 -2.623 18.268 -10.506 378 H GLN 47 H GLN 47 -4.237 14.959 -9.831 379 HA GLN 47 HA GLN 47 -6.921 14.322 -9.326 380 HB2 GLN 47 1HB GLN 47 -4.408 13.195 -8.104 381 HB3 GLN 47 2HB GLN 47 -6.006 12.479 -7.933 382 HG2 GLN 47 1HG GLN 47 -6.085 12.331 -10.442 383 HG3 GLN 47 2HG GLN 47 -4.382 12.782 -10.441 384 HE21 GLN 47 2HE2 GLN 47 -5.702 10.334 -11.337 385 HE22 GLN 47 1HE2 GLN 47 -4.962 9.045 -10.448 386 H LYS 48 H LYS 48 -4.466 15.807 -7.259 387 HA LYS 48 HA LYS 48 -5.910 15.662 -4.839 388 HB2 LYS 48 1HB LYS 48 -3.936 17.782 -5.712 389 HB3 LYS 48 2HB LYS 48 -4.491 17.519 -4.066 390 HG2 LYS 48 1HG LYS 48 -3.491 15.254 -4.143 391 HG3 LYS 48 2HG LYS 48 -2.841 15.638 -5.738 392 HD2 LYS 48 1HD LYS 48 -2.236 17.099 -3.169 393 HD3 LYS 48 2HD LYS 48 -1.160 15.974 -3.999 394 HE2 LYS 48 1HE LYS 48 -2.177 18.586 -5.119 395 HE3 LYS 48 2HE LYS 48 -0.579 18.325 -4.427 396 HZ1 LYS 48 3HZ LYS 48 -0.157 16.681 -6.175 397 HZ2 LYS 48 1HZ LYS 48 -0.481 18.218 -6.814 398 HZ3 LYS 48 2HZ LYS 48 -1.675 17.017 -6.860 399 H MET 49 H MET 49 -5.686 18.235 -7.279 400 HA MET 49 HA MET 49 -7.514 19.995 -6.124 401 HB2 MET 49 1HB MET 49 -5.950 20.425 -8.078 402 HB3 MET 49 2HB MET 49 -7.134 19.612 -9.090 403 HG2 MET 49 1HG MET 49 -8.814 21.256 -8.464 404 HG3 MET 49 2HG MET 49 -7.636 22.062 -7.433 405 HE1 MET 49 3HE MET 49 -5.466 23.289 -8.353 406 HE2 MET 49 1HE MET 49 -5.042 23.373 -10.064 407 HE3 MET 49 2HE MET 49 -4.995 21.826 -9.218 408 H ILE 50 H ILE 50 -8.001 17.205 -8.218 409 HA ILE 50 HA ILE 50 -10.735 17.597 -8.753 410 HB ILE 50 HB ILE 50 -9.126 15.044 -8.634 411 HG12 ILE 50 1HG1 ILE 50 -8.442 16.629 -10.370 412 HG13 ILE 50 2HG1 ILE 50 -9.191 15.202 -11.082 413 HG21 ILE 50 1HG2 ILE 50 -11.933 15.460 -9.658 414 HG22 ILE 50 2HG2 ILE 50 -11.457 14.493 -8.262 415 HG23 ILE 50 3HG2 ILE 50 -10.971 13.997 -9.883 416 HD11 ILE 50 3HD1 ILE 50 -9.926 17.205 -12.218 417 HD12 ILE 50 1HD1 ILE 50 -10.488 17.894 -10.694 418 HD13 ILE 50 2HD1 ILE 50 -11.277 16.465 -11.360 419 H GLU 51 H GLU 51 -9.111 15.733 -6.194 420 HA GLU 51 HA GLU 51 -11.552 14.875 -5.001 421 HB2 GLU 51 1HB GLU 51 -8.806 15.040 -3.751 422 HB3 GLU 51 2HB GLU 51 -10.172 14.121 -3.133 423 HG2 GLU 51 1HG GLU 51 -10.124 12.861 -5.334 424 HG3 GLU 51 2HG GLU 51 -8.554 13.617 -5.609 425 H LYS 52 H LYS 52 -9.504 17.668 -4.623 426 HA LYS 52 HA LYS 52 -10.724 18.575 -2.195 427 HB2 LYS 52 1HB LYS 52 -8.654 19.520 -4.042 428 HB3 LYS 52 2HB LYS 52 -9.609 20.812 -3.333 429 HG2 LYS 52 1HG LYS 52 -7.712 20.504 -1.960 430 HG3 LYS 52 2HG LYS 52 -9.095 19.857 -1.088 431 HD2 LYS 52 1HD LYS 52 -7.302 18.088 -2.726 432 HD3 LYS 52 2HD LYS 52 -6.904 18.513 -1.063 433 HE2 LYS 52 1HE LYS 52 -9.123 17.602 -0.373 434 HE3 LYS 52 2HE LYS 52 -9.361 17.057 -2.032 435 HZ1 LYS 52 3HZ LYS 52 -8.533 15.220 -0.834 436 HZ2 LYS 52 1HZ LYS 52 -7.314 16.136 -0.096 437 HZ3 LYS 52 2HZ LYS 52 -7.227 15.784 -1.752 438 H SER 53 H SER 53 -11.114 19.311 -5.613 439 HA SER 53 HA SER 53 -13.354 21.095 -5.011 440 HB2 SER 53 1HB SER 53 -12.142 20.413 -7.698 441 HB3 SER 53 2HB SER 53 -13.251 21.739 -7.342 442 HG SER 53 HG SER 53 -10.572 21.418 -6.473 443 H LEU 54 H LEU 54 -13.304 18.091 -4.746 444 HA LEU 54 HA LEU 54 -14.851 16.829 -6.695 445 HB2 LEU 54 1HB LEU 54 -13.601 15.781 -4.762 446 HB3 LEU 54 2HB LEU 54 -14.926 16.296 -3.731 447 HG LEU 54 HG LEU 54 -16.471 14.882 -5.030 448 HD11 LEU 54 1HD1 LEU 54 -15.584 13.253 -6.617 449 HD12 LEU 54 2HD1 LEU 54 -13.987 13.991 -6.477 450 HD13 LEU 54 3HD1 LEU 54 -15.328 14.909 -7.167 451 HD21 LEU 54 3HD2 LEU 54 -14.056 13.443 -3.960 452 HD22 LEU 54 1HD2 LEU 54 -15.645 12.729 -4.228 453 HD23 LEU 54 2HD2 LEU 54 -15.442 13.998 -3.021 454 H ASN 55 H ASN 55 -15.746 18.648 -3.828 455 HA ASN 55 HA ASN 55 -18.502 18.184 -3.831 456 HB2 ASN 55 1HB ASN 55 -16.919 20.583 -2.902 457 HB3 ASN 55 2HB ASN 55 -18.624 20.333 -2.547 458 HD21 ASN 55 2HD2 ASN 55 -16.292 20.573 -0.785 459 HD22 ASN 55 1HD2 ASN 55 -16.284 19.132 0.177 460 H LYS 56 H LYS 56 -16.541 20.636 -5.447 461 HA LYS 56 HA LYS 56 -18.658 22.123 -6.563 462 HB2 LYS 56 1HB LYS 56 -15.788 21.760 -7.424 463 HB3 LYS 56 2HB LYS 56 -16.896 22.869 -8.219 464 HG2 LYS 56 1HG LYS 56 -16.125 22.979 -5.311 465 HG3 LYS 56 2HG LYS 56 -15.445 23.986 -6.593 466 HD2 LYS 56 1HD LYS 56 -17.689 24.880 -7.054 467 HD3 LYS 56 2HD LYS 56 -18.337 23.898 -5.739 468 HE2 LYS 56 1HE LYS 56 -16.889 25.080 -4.155 469 HE3 LYS 56 2HE LYS 56 -16.261 26.067 -5.474 470 HZ1 LYS 56 3HZ LYS 56 -19.114 25.964 -4.668 471 HZ2 LYS 56 1HZ LYS 56 -18.424 27.003 -5.819 472 HZ3 LYS 56 2HZ LYS 56 -18.021 27.164 -4.174 473 H LEU 57 H LEU 57 -16.614 19.570 -7.988 474 HA LEU 57 HA LEU 57 -17.916 19.536 -10.479 475 HB2 LEU 57 1HB LEU 57 -16.152 17.625 -9.024 476 HB3 LEU 57 2HB LEU 57 -16.993 17.065 -10.454 477 HG LEU 57 HG LEU 57 -15.924 18.836 -11.785 478 HD11 LEU 57 1HD1 LEU 57 -14.365 19.464 -9.280 479 HD12 LEU 57 2HD1 LEU 57 -15.632 20.479 -9.973 480 HD13 LEU 57 3HD1 LEU 57 -14.143 20.191 -10.874 481 HD21 LEU 57 3HD2 LEU 57 -13.960 17.177 -10.211 482 HD22 LEU 57 1HD2 LEU 57 -13.681 17.903 -11.794 483 HD23 LEU 57 2HD2 LEU 57 -14.884 16.627 -11.609 484 H TYR 58 H TYR 58 -18.535 17.740 -7.510 485 HA TYR 58 HA TYR 58 -20.524 16.034 -8.584 486 HB2 TYR 58 1HB TYR 58 -19.257 15.744 -6.399 487 HB3 TYR 58 2HB TYR 58 -20.337 16.953 -5.714 488 HD1 TYR 58 HD2 TYR 58 -20.502 13.762 -7.637 489 HD2 TYR 58 HD1 TYR 58 -22.234 16.198 -4.611 490 HE1 TYR 58 HE2 TYR 58 -22.123 11.989 -7.151 491 HE2 TYR 58 HE1 TYR 58 -23.867 14.425 -4.114 492 HH TYR 58 HH TYR 58 -24.889 12.456 -5.305 493 H GLU 59 H GLU 59 -20.672 19.188 -6.965 494 HA GLU 59 HA GLU 59 -23.488 19.421 -6.922 495 HB2 GLU 59 1HB GLU 59 -21.848 20.860 -5.658 496 HB3 GLU 59 2HB GLU 59 -21.473 21.668 -7.175 497 HG2 GLU 59 1HG GLU 59 -23.008 23.045 -6.045 498 HG3 GLU 59 2HG GLU 59 -23.912 22.255 -7.335 499 H TYR 60 H TYR 60 -21.044 20.177 -9.298 500 HA TYR 60 HA TYR 60 -22.619 21.657 -11.098 501 HB2 TYR 60 1HB TYR 60 -20.265 21.842 -11.233 502 HB3 TYR 60 2HB TYR 60 -20.058 20.102 -11.371 503 HD1 TYR 60 HD2 TYR 60 -21.552 23.000 -13.191 504 HD2 TYR 60 HD1 TYR 60 -19.735 19.155 -13.451 505 HE1 TYR 60 HE2 TYR 60 -21.456 23.211 -15.639 506 HE2 TYR 60 HE1 TYR 60 -19.629 19.364 -15.900 507 HH TYR 60 HH TYR 60 -20.857 20.661 -17.705 508 H ILE 61 H ILE 61 -21.763 18.202 -11.063 509 HA ILE 61 HA ILE 61 -23.118 17.654 -13.499 510 HB ILE 61 HB ILE 61 -22.798 15.289 -12.971 511 HG12 ILE 61 1HG1 ILE 61 -21.785 16.306 -10.304 512 HG13 ILE 61 2HG1 ILE 61 -23.229 15.334 -10.558 513 HG21 ILE 61 1HG2 ILE 61 -20.353 15.318 -12.874 514 HG22 ILE 61 2HG2 ILE 61 -20.392 16.998 -12.339 515 HG23 ILE 61 3HG2 ILE 61 -20.968 16.571 -13.952 516 HD11 ILE 61 3HD1 ILE 61 -20.401 14.468 -11.077 517 HD12 ILE 61 1HD1 ILE 61 -21.842 13.488 -11.343 518 HD13 ILE 61 2HD1 ILE 61 -21.407 13.991 -9.709 519 H GLU 62 H GLU 62 -24.112 17.693 -10.159 520 HA GLU 62 HA GLU 62 -26.586 16.292 -10.628 521 HB2 GLU 62 1HB GLU 62 -25.552 17.844 -8.257 522 HB3 GLU 62 2HB GLU 62 -27.078 16.969 -8.273 523 HG2 GLU 62 1HG GLU 62 -24.443 15.670 -8.843 524 HG3 GLU 62 2HG GLU 62 -25.123 15.791 -7.221 525 H GLN 63 H GLN 63 -25.510 19.570 -10.691 526 HA GLN 63 HA GLN 63 -28.174 20.665 -10.418 527 HB2 GLN 63 1HB GLN 63 -27.199 22.806 -10.502 528 HB3 GLN 63 2HB GLN 63 -26.046 21.815 -9.624 529 HG2 GLN 63 1HG GLN 63 -24.743 21.577 -11.727 530 HG3 GLN 63 2HG GLN 63 -25.857 22.709 -12.491 531 HE21 GLN 63 2HE2 GLN 63 -24.657 22.857 -9.193 532 HE22 GLN 63 1HE2 GLN 63 -23.801 24.346 -9.378 533 H SER 64 H SER 64 -29.193 21.985 -12.044 534 HA SER 64 HA SER 64 -29.481 20.620 -14.474 535 HB2 SER 64 1HB SER 64 -30.338 23.456 -13.867 536 HB3 SER 64 2HB SER 64 -31.038 22.364 -15.064 537 HG SER 64 HG SER 64 -32.033 22.624 -12.814 538 H LYS 65 H LYS 65 -27.948 20.522 -15.954 539 HA LYS 65 HA LYS 65 -26.148 22.710 -16.484 540 HB2 LYS 65 1HB LYS 65 -26.506 20.032 -17.826 541 HB3 LYS 65 2HB LYS 65 -25.253 21.190 -18.246 542 HG2 LYS 65 1HG LYS 65 -24.308 20.996 -16.009 543 HG3 LYS 65 2HG LYS 65 -25.580 19.848 -15.570 544 HD2 LYS 65 1HD LYS 65 -24.811 18.276 -17.200 545 HD3 LYS 65 2HD LYS 65 -23.671 19.447 -17.863 546 HE2 LYS 65 1HE LYS 65 -22.526 19.458 -15.646 547 HE3 LYS 65 2HE LYS 65 -23.584 18.131 -15.159 548 HZ1 LYS 65 3HZ LYS 65 -22.636 16.703 -16.709 549 HZ2 LYS 65 1HZ LYS 65 -21.303 17.551 -16.110 550 HZ3 LYS 65 2HZ LYS 65 -21.958 17.963 -17.618 551 H ASN 66 H ASN 66 -28.861 21.135 -18.062 552 HA ASN 66 HA ASN 66 -28.596 22.709 -20.455 553 HB2 ASN 66 1HB ASN 66 -30.717 21.603 -21.132 554 HB3 ASN 66 2HB ASN 66 -29.458 20.462 -20.680 555 HD21 ASN 66 2HD2 ASN 66 -32.367 20.140 -20.758 556 HD22 ASN 66 1HD2 ASN 66 -32.833 19.652 -19.170 557 H CYS 67 H CYS 67 -30.749 23.805 -21.232 558 HA CYS 67 HA CYS 67 -32.005 25.237 -19.040 559 HB2 CYS 67 1HB CYS 67 -31.291 27.347 -19.574 560 HB3 CYS 67 2HB CYS 67 -29.872 26.447 -20.070 561 H SER 68 H SER 68 -33.896 26.428 -19.762 562 HA SER 68 HA SER 68 -35.362 24.617 -21.445 563 HB2 SER 68 1HB SER 68 -36.235 27.097 -19.954 564 HB3 SER 68 2HB SER 68 -37.333 26.035 -20.835 565 HG SER 68 HG SER 68 -36.956 24.428 -19.411 566 H TYR 69 H TYR 69 -33.689 27.504 -21.987 567 HA TYR 69 HA TYR 69 -35.133 28.387 -24.281 568 HB2 TYR 69 1HB TYR 69 -33.067 29.378 -22.755 569 HB3 TYR 69 2HB TYR 69 -32.276 28.990 -24.277 570 HD1 TYR 69 HD1 TYR 69 -33.230 29.950 -26.412 571 HD2 TYR 69 HD2 TYR 69 -34.397 31.315 -22.558 572 HE1 TYR 69 HE1 TYR 69 -34.117 32.012 -27.420 573 HE2 TYR 69 HE2 TYR 69 -35.287 33.383 -23.551 574 HH TYR 69 HH TYR 69 -35.008 34.733 -25.560 575 H CYS 70 H CYS 70 -33.499 25.595 -23.795 576 HA CYS 70 HA CYS 70 -33.249 25.217 -26.678 577 HB2 CYS 70 1HB CYS 70 -31.058 24.126 -26.497 578 HB3 CYS 70 2HB CYS 70 -30.986 25.809 -25.984 579 H SER 71 H SER 71 -33.626 23.868 -23.485 580 HA SER 71 HA SER 71 -34.365 21.286 -24.685 581 HB2 SER 71 1HB SER 71 -33.541 21.836 -21.821 582 HB3 SER 71 2HB SER 71 -33.821 20.258 -22.556 583 HG SER 71 HG SER 71 -31.937 20.362 -23.558 584 H GLU 72 H GLU 72 -36.274 20.251 -23.853 585 HA GLU 72 HA GLU 72 -38.259 22.222 -22.970 586 HB2 GLU 72 1HB GLU 72 -39.924 20.685 -23.834 587 HB3 GLU 72 2HB GLU 72 -38.710 21.016 -25.062 588 HG2 GLU 72 1HG GLU 72 -37.646 18.894 -24.636 589 HG3 GLU 72 2HG GLU 72 -38.769 18.565 -23.317 590 H ASP 73 H ASP 73 -36.280 20.223 -21.489 591 HA ASP 73 HA ASP 73 -37.781 18.480 -19.924 592 HB2 ASP 73 1HB ASP 73 -35.289 19.998 -19.135 593 HB3 ASP 73 2HB ASP 73 -35.929 18.592 -18.296 594 H GLU 74 H GLU 74 -39.577 19.083 -18.932 595 HA GLU 74 HA GLU 74 -39.868 21.708 -17.742 596 HB2 GLU 74 1HB GLU 74 -41.685 20.511 -19.007 597 HB3 GLU 74 2HB GLU 74 -41.763 19.348 -17.694 598 HG2 GLU 74 1HG GLU 74 -43.535 20.943 -17.469 599 HG3 GLU 74 2HG GLU 74 -42.381 21.150 -16.154 600 H ASN 75 H ASN 75 -39.007 18.536 -16.783 601 HA ASN 75 HA ASN 75 -39.691 18.976 -13.987 602 HB2 ASN 75 1HB ASN 75 -38.705 16.575 -15.513 603 HB3 ASN 75 2HB ASN 75 -38.839 16.586 -13.758 604 HD21 ASN 75 2HD2 ASN 75 -40.845 16.539 -12.805 605 HD22 ASN 75 1HD2 ASN 75 -42.295 16.211 -13.695 606 H CYS 76 H CYS 76 -37.514 20.480 -15.313 607 HA CYS 76 HA CYS 76 -35.519 19.868 -13.254 608 HB2 CYS 76 1HB CYS 76 -33.680 20.372 -14.758 609 HB3 CYS 76 2HB CYS 76 -34.643 19.060 -15.428 610 HG CYS 76 HG CYS 76 -36.077 21.256 -16.968 611 H ASN 77 H ASN 77 -35.123 21.589 -12.004 612 HA ASN 77 HA ASN 77 -36.281 24.126 -12.763 613 HB2 ASN 77 1HB ASN 77 -35.852 24.866 -10.536 614 HB3 ASN 77 2HB ASN 77 -36.413 23.206 -10.409 615 HD21 ASN 77 2HD2 ASN 77 -34.932 21.586 -9.802 616 HD22 ASN 77 1HD2 ASN 77 -33.426 21.979 -9.038 617 H ASN 78 H ASN 78 -35.233 25.589 -13.894 618 HA ASN 78 HA ASN 78 -32.315 25.687 -13.616 619 HB2 ASN 78 1HB ASN 78 -32.408 27.024 -15.808 620 HB3 ASN 78 2HB ASN 78 -32.674 25.291 -15.895 621 HD21 ASN 78 2HD2 ASN 78 -34.649 24.512 -16.484 622 HD22 ASN 78 1HD2 ASN 78 -35.884 25.511 -17.165 623 H LEU 79 H LEU 79 -31.742 27.118 -12.225 624 HA LEU 79 HA LEU 79 -33.238 29.265 -11.266 625 HB2 LEU 79 1HB LEU 79 -31.093 28.095 -10.360 626 HB3 LEU 79 2HB LEU 79 -30.232 29.265 -11.333 627 HG LEU 79 HG LEU 79 -32.184 30.010 -9.155 628 HD11 LEU 79 1HD1 LEU 79 -30.176 30.521 -7.821 629 HD12 LEU 79 2HD1 LEU 79 -29.178 29.787 -9.078 630 HD13 LEU 79 3HD1 LEU 79 -30.336 28.803 -8.182 631 HD21 LEU 79 3HD2 LEU 79 -31.832 31.736 -10.865 632 HD22 LEU 79 1HD2 LEU 79 -30.090 31.634 -10.602 633 HD23 LEU 79 2HD2 LEU 79 -31.145 32.207 -9.310 634 H LEU 80 H LEU 80 -30.354 29.432 -13.346 635 HA LEU 80 HA LEU 80 -31.253 31.959 -14.444 636 HB2 LEU 80 1HB LEU 80 -28.811 30.278 -15.035 637 HB3 LEU 80 2HB LEU 80 -29.170 31.797 -15.828 638 HG LEU 80 HG LEU 80 -29.158 32.808 -13.449 639 HD11 LEU 80 1HD1 LEU 80 -27.712 31.660 -11.860 640 HD12 LEU 80 2HD1 LEU 80 -27.610 30.271 -12.942 641 HD13 LEU 80 3HD1 LEU 80 -29.155 30.709 -12.211 642 HD21 LEU 80 3HD2 LEU 80 -26.773 33.190 -13.584 643 HD22 LEU 80 1HD2 LEU 80 -27.490 33.238 -15.194 644 HD23 LEU 80 2HD2 LEU 80 -26.591 31.812 -14.672 645 H GLU 81 H GLU 81 -31.396 32.223 -16.807 646 HA GLU 81 HA GLU 81 -31.950 29.789 -18.302 647 HB2 GLU 81 1HB GLU 81 -34.138 30.473 -17.591 648 HB3 GLU 81 2HB GLU 81 -33.807 32.151 -17.997 649 HG2 GLU 81 1HG GLU 81 -35.242 31.213 -19.641 650 HG3 GLU 81 2HG GLU 81 -33.675 31.528 -20.367 651 H GLY 82 H GLY 82 -31.681 30.063 -20.564 652 HA2 GLY 82 1HA GLY 82 -30.510 30.912 -22.372 653 HA3 GLY 82 2HA GLY 82 -30.463 32.471 -21.554 654 H TYR 83 H TYR 83 -29.425 30.084 -19.480 655 HA TYR 83 HA TYR 83 -26.616 30.398 -20.259 656 HB2 TYR 83 1HB TYR 83 -27.834 30.964 -17.560 657 HB3 TYR 83 2HB TYR 83 -26.119 30.638 -17.768 658 HD1 TYR 83 HD1 TYR 83 -28.823 33.033 -18.418 659 HD2 TYR 83 HD2 TYR 83 -24.657 32.268 -18.779 660 HE1 TYR 83 HE1 TYR 83 -28.436 35.407 -18.921 661 HE2 TYR 83 HE2 TYR 83 -24.259 34.639 -19.285 662 HH TYR 83 HH TYR 83 -26.690 37.035 -18.872 663 H HIS 84 H HIS 84 -25.214 28.794 -19.473 664 HA HIS 84 HA HIS 84 -26.450 26.432 -18.201 665 HB2 HIS 84 1HB HIS 84 -24.396 26.442 -20.425 666 HB3 HIS 84 2HB HIS 84 -24.823 25.023 -19.487 667 HD1 HIS 84 HD1 HIS 84 -25.496 23.840 -21.688 668 HD2 HIS 84 HD2 HIS 84 -27.804 27.181 -20.765 669 HE1 HIS 84 HE1 HIS 84 -27.433 23.856 -23.322 670 HA PRO 85 HA PRO 85 -22.877 26.932 -15.545 671 HB2 PRO 85 1HB PRO 85 -22.956 24.577 -14.249 672 HB3 PRO 85 2HB PRO 85 -24.134 25.857 -13.941 673 HG2 PRO 85 1HG PRO 85 -24.418 23.374 -15.574 674 HG3 PRO 85 2HG PRO 85 -25.592 24.154 -14.500 675 HD2 PRO 85 1HD PRO 85 -25.589 24.399 -17.244 676 HD3 PRO 85 2HD PRO 85 -26.317 25.577 -16.135 677 H LYS 86 H LYS 86 -20.736 26.484 -15.687 678 HA LYS 86 HA LYS 86 -19.869 23.970 -16.891 679 HB2 LYS 86 1HB LYS 86 -18.332 25.068 -18.423 680 HB3 LYS 86 2HB LYS 86 -19.968 25.618 -18.749 681 HG2 LYS 86 1HG LYS 86 -19.550 27.696 -17.611 682 HG3 LYS 86 2HG LYS 86 -17.953 27.142 -17.113 683 HD2 LYS 86 1HD LYS 86 -18.862 27.604 -19.955 684 HD3 LYS 86 2HD LYS 86 -17.816 28.672 -19.017 685 HE2 LYS 86 1HE LYS 86 -16.192 26.802 -18.812 686 HE3 LYS 86 2HE LYS 86 -17.216 25.848 -19.886 687 HZ1 LYS 86 3HZ LYS 86 -16.906 27.548 -21.602 688 HZ2 LYS 86 1HZ LYS 86 -15.423 26.884 -21.109 689 HZ3 LYS 86 2HZ LYS 86 -15.887 28.418 -20.560 690 H LEU 87 H LEU 87 -17.777 23.360 -16.293 691 HA LEU 87 HA LEU 87 -16.875 24.412 -13.791 692 HB2 LEU 87 1HB LEU 87 -15.634 22.375 -15.640 693 HB3 LEU 87 2HB LEU 87 -15.063 22.739 -14.024 694 HG LEU 87 HG LEU 87 -17.776 21.591 -14.684 695 HD11 LEU 87 1HD1 LEU 87 -15.964 20.018 -15.133 696 HD12 LEU 87 2HD1 LEU 87 -16.911 19.527 -13.727 697 HD13 LEU 87 3HD1 LEU 87 -15.329 20.280 -13.508 698 HD21 LEU 87 3HD2 LEU 87 -17.778 22.964 -12.672 699 HD22 LEU 87 1HD2 LEU 87 -16.399 22.058 -12.040 700 HD23 LEU 87 2HD2 LEU 87 -17.953 21.255 -12.273 701 H VAL 88 H VAL 88 -15.190 25.739 -13.390 702 HA VAL 88 HA VAL 88 -13.497 26.546 -15.657 703 HB VAL 88 HB VAL 88 -13.479 28.858 -14.873 704 HG11 VAL 88 1HG1 VAL 88 -16.280 27.823 -15.279 705 HG12 VAL 88 2HG1 VAL 88 -15.134 28.267 -16.544 706 HG13 VAL 88 3HG1 VAL 88 -15.770 29.501 -15.458 707 HG21 VAL 88 3HG2 VAL 88 -15.020 29.633 -13.134 708 HG22 VAL 88 1HG2 VAL 88 -13.853 28.472 -12.501 709 HG23 VAL 88 2HG2 VAL 88 -15.508 27.964 -12.829 710 H VAL 89 H VAL 89 -11.348 27.039 -15.118 711 HA VAL 89 HA VAL 89 -10.503 26.009 -12.533 712 HB VAL 89 HB VAL 89 -9.200 25.271 -14.446 713 HG11 VAL 89 1HG1 VAL 89 -8.585 28.188 -14.898 714 HG12 VAL 89 2HG1 VAL 89 -9.493 27.117 -15.965 715 HG13 VAL 89 3HG1 VAL 89 -7.770 26.847 -15.704 716 HG21 VAL 89 3HG2 VAL 89 -8.078 25.508 -12.300 717 HG22 VAL 89 1HG2 VAL 89 -7.635 27.167 -12.706 718 HG23 VAL 89 2HG2 VAL 89 -6.969 25.824 -13.637 719 H ASN 90 H ASN 90 -10.327 27.269 -10.851 720 HA ASN 90 HA ASN 90 -9.959 30.164 -11.281 721 HB2 ASN 90 1HB ASN 90 -12.085 28.827 -10.041 722 HB3 ASN 90 2HB ASN 90 -11.121 29.460 -8.713 723 HD21 ASN 90 2HD2 ASN 90 -13.089 30.241 -11.450 724 HD22 ASN 90 1HD2 ASN 90 -13.279 31.924 -11.102 725 H GLY 91 H GLY 91 -7.773 30.305 -10.994 726 HA2 GLY 91 1HA GLY 91 -5.786 30.415 -9.844 727 HA3 GLY 91 2HA GLY 91 -6.714 30.210 -8.363 728 H ARG 92 H ARG 92 -6.484 28.373 -7.279 729 HA ARG 92 HA ARG 92 -5.318 26.065 -8.698 730 HB2 ARG 92 1HB ARG 92 -4.951 26.891 -5.811 731 HB3 ARG 92 2HB ARG 92 -4.350 25.391 -6.507 732 HG2 ARG 92 1HG ARG 92 -3.547 28.166 -7.364 733 HG3 ARG 92 2HG ARG 92 -2.598 27.084 -6.342 734 HD2 ARG 92 1HD ARG 92 -2.350 25.513 -8.131 735 HD3 ARG 92 2HD ARG 92 -3.480 26.410 -9.145 736 HE ARG 92 HE ARG 92 -1.319 28.075 -8.405 737 HH11 ARG 92 1HH1 ARG 92 -1.982 25.286 -10.426 738 HH12 ARG 92 2HH1 ARG 92 -0.805 25.725 -11.624 739 HH21 ARG 92 1HH2 ARG 92 0.247 28.634 -9.988 740 HH22 ARG 92 2HH2 ARG 92 0.458 27.611 -11.387 741 H SER 93 H SER 93 -8.126 26.998 -8.109 742 HA SER 93 HA SER 93 -9.088 24.454 -7.002 743 HB2 SER 93 1HB SER 93 -11.005 25.821 -5.996 744 HB3 SER 93 2HB SER 93 -9.439 25.965 -5.196 745 HG SER 93 HG SER 93 -9.825 27.780 -7.226 746 H ILE 94 H ILE 94 -11.324 23.948 -7.704 747 HA ILE 94 HA ILE 94 -11.767 24.987 -10.423 748 HB ILE 94 HB ILE 94 -12.832 22.441 -9.183 749 HG12 ILE 94 1HG1 ILE 94 -10.581 22.718 -11.179 750 HG13 ILE 94 2HG1 ILE 94 -10.307 22.608 -9.446 751 HG21 ILE 94 1HG2 ILE 94 -12.766 23.376 -12.052 752 HG22 ILE 94 2HG2 ILE 94 -14.197 23.286 -11.025 753 HG23 ILE 94 3HG2 ILE 94 -13.354 21.810 -11.493 754 HD11 ILE 94 3HD1 ILE 94 -11.522 20.519 -11.234 755 HD12 ILE 94 1HD1 ILE 94 -11.468 20.408 -9.473 756 HD13 ILE 94 2HD1 ILE 94 -9.966 20.457 -10.401 757 H ASP 95 H ASP 95 -13.697 25.955 -10.961 758 HA ASP 95 HA ASP 95 -15.697 26.218 -8.806 759 HB2 ASP 95 1HB ASP 95 -14.078 28.253 -9.398 760 HB3 ASP 95 2HB ASP 95 -15.251 28.495 -10.682 761 H ILE 96 H ILE 96 -17.710 27.424 -9.882 762 HA ILE 96 HA ILE 96 -18.328 26.087 -12.436 763 HB ILE 96 HB ILE 96 -20.275 26.292 -10.136 764 HG12 ILE 96 1HG1 ILE 96 -18.869 23.778 -11.044 765 HG13 ILE 96 2HG1 ILE 96 -18.287 24.756 -9.698 766 HG21 ILE 96 1HG2 ILE 96 -20.357 24.743 -12.723 767 HG22 ILE 96 2HG2 ILE 96 -21.271 26.207 -12.359 768 HG23 ILE 96 3HG2 ILE 96 -21.596 24.718 -11.469 769 HD11 ILE 96 3HD1 ILE 96 -20.952 23.373 -9.889 770 HD12 ILE 96 1HD1 ILE 96 -20.436 24.412 -8.561 771 HD13 ILE 96 2HD1 ILE 96 -19.582 22.903 -8.880 772 H GLU 97 H GLU 97 -18.766 27.673 -13.844 773 HA GLU 97 HA GLU 97 -20.343 29.970 -12.892 774 HB2 GLU 97 1HB GLU 97 -18.039 30.094 -14.852 775 HB3 GLU 97 2HB GLU 97 -19.041 31.450 -14.348 776 HG2 GLU 97 1HG GLU 97 -18.278 30.995 -11.997 777 HG3 GLU 97 2HG GLU 97 -17.113 29.864 -12.678 778 H TYR 98 H TYR 98 -21.508 31.091 -14.645 779 HA TYR 98 HA TYR 98 -22.630 29.050 -16.419 780 HB2 TYR 98 1HB TYR 98 -23.703 31.437 -15.033 781 HB3 TYR 98 2HB TYR 98 -24.403 31.059 -16.604 782 HD1 TYR 98 HD2 TYR 98 -23.619 29.497 -13.304 783 HD2 TYR 98 HD1 TYR 98 -26.118 29.503 -16.759 784 HE1 TYR 98 HE2 TYR 98 -25.075 27.814 -12.241 785 HE2 TYR 98 HE1 TYR 98 -27.578 27.831 -15.702 786 HH TYR 98 HH TYR 98 -27.404 26.072 -13.954 787 H TYR 99 H TYR 99 -22.608 29.189 -18.568 788 HA TYR 99 HA TYR 99 -21.693 31.712 -19.793 789 HB2 TYR 99 1HB TYR 99 -20.772 30.447 -21.634 790 HB3 TYR 99 2HB TYR 99 -20.139 29.777 -20.138 791 HD1 TYR 99 HD2 TYR 99 -20.953 27.573 -19.331 792 HD2 TYR 99 HD1 TYR 99 -22.125 29.140 -23.109 793 HE1 TYR 99 HE2 TYR 99 -21.677 25.330 -20.029 794 HE2 TYR 99 HE1 TYR 99 -22.851 26.902 -23.821 795 HH TYR 99 HH TYR 99 -22.287 24.491 -23.193 796 H GLU 100 H GLU 100 -22.680 32.152 -21.943 797 HA GLU 100 HA GLU 100 -25.519 31.924 -21.658 798 HB2 GLU 100 1HB GLU 100 -23.861 33.788 -22.743 799 HB3 GLU 100 2HB GLU 100 -24.438 32.982 -24.193 800 HG2 GLU 100 1HG GLU 100 -26.459 33.773 -22.184 801 HG3 GLU 100 2HG GLU 100 -25.680 35.057 -23.101 802 H CYS 101 H CYS 101 -26.940 30.744 -22.805 803 HA CYS 101 HA CYS 101 -26.247 28.315 -23.974 804 HB2 CYS 101 1HB CYS 101 -28.533 29.009 -23.140 805 HB3 CYS 101 2HB CYS 101 -28.723 29.947 -24.613 806 HA PRO 102 HA PRO 102 -24.550 29.846 -27.815 807 HB2 PRO 102 1HB PRO 102 -24.134 27.417 -28.980 808 HB3 PRO 102 2HB PRO 102 -23.073 28.098 -27.744 809 HG2 PRO 102 1HG PRO 102 -25.256 26.071 -27.458 810 HG3 PRO 102 2HG PRO 102 -23.643 26.092 -26.719 811 HD2 PRO 102 1HD PRO 102 -25.857 26.833 -25.367 812 HD3 PRO 102 2HD PRO 102 -24.276 27.585 -25.078 813 H VAL 103 H VAL 103 -27.437 28.174 -27.392 814 HA VAL 103 HA VAL 103 -28.199 28.000 -30.169 815 HB VAL 103 HB VAL 103 -29.935 27.704 -27.709 816 HG11 VAL 103 1HG1 VAL 103 -30.319 26.698 -30.523 817 HG12 VAL 103 2HG1 VAL 103 -31.187 28.038 -29.772 818 HG13 VAL 103 3HG1 VAL 103 -31.393 26.399 -29.156 819 HG21 VAL 103 3HG2 VAL 103 -28.385 25.611 -29.224 820 HG22 VAL 103 1HG2 VAL 103 -29.553 25.289 -27.943 821 HG23 VAL 103 2HG2 VAL 103 -28.069 26.171 -27.582 822 H LYS 104 H LYS 104 -28.092 30.402 -27.809 823 HA LYS 104 HA LYS 104 -30.443 31.856 -28.594 824 HB2 LYS 104 1HB LYS 104 -29.439 31.974 -26.310 825 HB3 LYS 104 2HB LYS 104 -28.071 32.838 -26.998 826 HG2 LYS 104 1HG LYS 104 -29.525 34.454 -26.056 827 HG3 LYS 104 2HG LYS 104 -29.692 34.570 -27.811 828 HD2 LYS 104 1HD LYS 104 -31.588 32.690 -27.095 829 HD3 LYS 104 2HD LYS 104 -31.669 33.874 -25.791 830 HE2 LYS 104 1HE LYS 104 -33.230 34.505 -27.506 831 HE3 LYS 104 2HE LYS 104 -31.898 35.662 -27.502 832 HZ1 LYS 104 3HZ LYS 104 -32.097 33.349 -29.354 833 HZ2 LYS 104 1HZ LYS 104 -30.944 34.591 -29.401 834 HZ3 LYS 104 2HZ LYS 104 -32.569 34.926 -29.747 835 H ARG 105 H ARG 105 -27.126 31.724 -29.588 836 HA ARG 105 HA ARG 105 -27.665 33.873 -31.507 837 HB2 ARG 105 1HB ARG 105 -26.205 34.478 -29.408 838 HB3 ARG 105 2HB ARG 105 -24.945 33.613 -30.276 839 HG2 ARG 105 1HG ARG 105 -26.494 35.897 -31.462 840 HG3 ARG 105 2HG ARG 105 -24.982 36.103 -30.580 841 HD2 ARG 105 1HD ARG 105 -23.791 34.798 -32.194 842 HD3 ARG 105 2HD ARG 105 -25.287 34.332 -32.998 843 HE ARG 105 HE ARG 105 -25.303 37.040 -33.157 844 HH11 ARG 105 1HH1 ARG 105 -22.939 34.600 -34.008 845 HH12 ARG 105 2HH1 ARG 105 -22.298 35.496 -35.351 846 HH21 ARG 105 1HH2 ARG 105 -24.485 38.216 -34.934 847 HH22 ARG 105 2HH2 ARG 105 -23.202 37.543 -35.898 848 H LYS 106 H LYS 106 -27.579 32.948 -33.433 849 HA LYS 106 HA LYS 106 -25.374 31.084 -34.002 850 HB2 LYS 106 1HB LYS 106 -26.915 29.745 -35.404 851 HB3 LYS 106 2HB LYS 106 -27.357 29.727 -33.704 852 HG2 LYS 106 1HG LYS 106 -29.103 31.369 -34.125 853 HG3 LYS 106 2HG LYS 106 -28.652 31.422 -35.829 854 HD2 LYS 106 1HD LYS 106 -29.229 29.066 -36.070 855 HD3 LYS 106 2HD LYS 106 -29.645 28.983 -34.358 856 HE2 LYS 106 1HE LYS 106 -31.636 29.199 -35.778 857 HE3 LYS 106 2HE LYS 106 -31.446 30.574 -34.690 858 HZ1 LYS 106 3HZ LYS 106 -30.665 31.916 -36.457 859 HZ2 LYS 106 1HZ LYS 106 -32.062 31.144 -37.023 860 HZ3 LYS 106 2HZ LYS 106 -30.536 30.593 -37.513 Start of MODEL 14 1 HA MET 1 HA MET 1 -11.706 -20.097 -18.816 2 HB2 MET 1 1HB MET 1 -11.194 -21.519 -20.733 3 HB3 MET 1 2HB MET 1 -9.728 -22.089 -19.948 4 HG2 MET 1 1HG MET 1 -11.524 -23.730 -19.819 5 HG3 MET 1 2HG MET 1 -11.038 -23.166 -18.221 6 HE1 MET 1 2HE MET 1 -13.758 -24.760 -18.864 7 HE2 MET 1 3HE MET 1 -14.901 -23.870 -17.858 8 HE3 MET 1 1HE MET 1 -13.294 -24.254 -17.241 9 H GLU 2 H GLU 2 -11.627 -19.754 -16.706 10 HA GLU 2 HA GLU 2 -10.237 -21.551 -15.006 11 HB2 GLU 2 1HB GLU 2 -8.379 -19.974 -15.623 12 HB3 GLU 2 2HB GLU 2 -9.302 -18.676 -14.880 13 HG2 GLU 2 1HG GLU 2 -7.615 -19.449 -13.354 14 HG3 GLU 2 2HG GLU 2 -9.211 -19.871 -12.732 15 HA PRO 3 HA PRO 3 -14.067 -19.685 -13.272 16 HB2 PRO 3 1HB PRO 3 -14.943 -22.004 -12.145 17 HB3 PRO 3 2HB PRO 3 -15.289 -21.546 -13.815 18 HG2 PRO 3 1HG PRO 3 -13.210 -23.414 -12.751 19 HG3 PRO 3 2HG PRO 3 -14.248 -23.590 -14.178 20 HD2 PRO 3 1HD PRO 3 -11.657 -22.815 -14.345 21 HD3 PRO 3 2HD PRO 3 -12.901 -22.255 -15.481 22 H ILE 4 H ILE 4 -12.598 -18.533 -11.873 23 HA ILE 4 HA ILE 4 -12.436 -19.776 -9.227 24 HB ILE 4 HB ILE 4 -10.217 -19.972 -10.229 25 HG12 ILE 4 1HG1 ILE 4 -10.280 -17.814 -8.110 26 HG13 ILE 4 2HG1 ILE 4 -10.442 -19.540 -7.803 27 HG21 ILE 4 1HG2 ILE 4 -10.329 -16.975 -10.520 28 HG22 ILE 4 2HG2 ILE 4 -10.299 -18.161 -11.827 29 HG23 ILE 4 3HG2 ILE 4 -8.896 -17.972 -10.775 30 HD11 ILE 4 3HD1 ILE 4 -8.197 -18.781 -7.321 31 HD12 ILE 4 1HD1 ILE 4 -8.032 -18.161 -8.965 32 HD13 ILE 4 2HD1 ILE 4 -8.189 -19.897 -8.687 33 H GLY 5 H GLY 5 -13.082 -18.503 -7.611 34 HA2 GLY 5 1HA GLY 5 -13.298 -15.603 -8.106 35 HA3 GLY 5 2HA GLY 5 -14.604 -16.503 -7.341 36 H ARG 6 H ARG 6 -11.448 -15.128 -6.950 37 HA ARG 6 HA ARG 6 -10.917 -16.370 -4.414 38 HB2 ARG 6 1HB ARG 6 -9.554 -13.943 -5.580 39 HB3 ARG 6 2HB ARG 6 -8.915 -15.056 -4.377 40 HG2 ARG 6 1HG ARG 6 -9.043 -16.853 -6.130 41 HG3 ARG 6 2HG ARG 6 -9.397 -15.576 -7.296 42 HD2 ARG 6 1HD ARG 6 -7.061 -16.010 -7.404 43 HD3 ARG 6 2HD ARG 6 -7.269 -14.464 -6.584 44 HE ARG 6 HE ARG 6 -7.167 -16.211 -4.529 45 HH11 ARG 6 1HH1 ARG 6 -5.095 -15.679 -7.300 46 HH12 ARG 6 2HH1 ARG 6 -3.661 -16.232 -6.495 47 HH21 ARG 6 1HH2 ARG 6 -5.308 -16.925 -3.463 48 HH22 ARG 6 2HH2 ARG 6 -3.781 -16.962 -4.291 49 H SER 7 H SER 7 -11.517 -15.721 -2.464 50 HA SER 7 HA SER 7 -13.150 -13.339 -2.257 51 HB2 SER 7 1HB SER 7 -12.444 -15.411 -0.166 52 HB3 SER 7 2HB SER 7 -13.645 -14.132 0.017 53 HG SER 7 HG SER 7 -14.527 -15.158 -2.040 54 H LEU 8 H LEU 8 -11.362 -11.861 -2.679 55 HA LEU 8 HA LEU 8 -9.398 -11.524 -0.586 56 HB2 LEU 8 1HB LEU 8 -8.914 -10.956 -2.967 57 HB3 LEU 8 2HB LEU 8 -10.094 -9.662 -2.868 58 HG LEU 8 HG LEU 8 -8.717 -8.570 -1.120 59 HD11 LEU 8 1HD1 LEU 8 -6.743 -10.756 -1.752 60 HD12 LEU 8 2HD1 LEU 8 -7.627 -10.565 -0.239 61 HD13 LEU 8 3HD1 LEU 8 -6.442 -9.354 -0.726 62 HD21 LEU 8 3HD2 LEU 8 -8.469 -7.926 -3.459 63 HD22 LEU 8 1HD2 LEU 8 -7.248 -9.179 -3.682 64 HD23 LEU 8 2HD2 LEU 8 -6.931 -7.818 -2.603 65 H GLN 9 H GLN 9 -11.024 -11.454 1.085 66 HA GLN 9 HA GLN 9 -11.773 -8.794 1.808 67 HB2 GLN 9 1HB GLN 9 -14.199 -9.270 2.003 68 HB3 GLN 9 2HB GLN 9 -13.648 -9.288 0.333 69 HG2 GLN 9 1HG GLN 9 -13.505 -11.789 0.520 70 HG3 GLN 9 2HG GLN 9 -14.309 -11.641 2.081 71 HE21 GLN 9 2HE2 GLN 9 -16.473 -10.995 2.150 72 HE22 GLN 9 1HE2 GLN 9 -17.486 -11.056 0.747 73 H GLY 10 H GLY 10 -12.543 -8.711 3.988 74 HA2 GLY 10 1HA GLY 10 -12.499 -11.172 5.538 75 HA3 GLY 10 2HA GLY 10 -11.227 -10.008 5.893 76 H VAL 11 H VAL 11 -12.355 -10.185 8.051 77 HA VAL 11 HA VAL 11 -14.890 -8.791 8.219 78 HB VAL 11 HB VAL 11 -13.133 -9.730 10.486 79 HG11 VAL 11 1HG1 VAL 11 -14.752 -8.027 11.142 80 HG12 VAL 11 2HG1 VAL 11 -15.233 -9.598 11.788 81 HG13 VAL 11 3HG1 VAL 11 -16.047 -8.941 10.369 82 HG21 VAL 11 3HG2 VAL 11 -13.786 -11.600 9.034 83 HG22 VAL 11 1HG2 VAL 11 -15.475 -11.112 9.175 84 HG23 VAL 11 2HG2 VAL 11 -14.603 -11.685 10.596 85 H THR 12 H THR 12 -14.797 -6.698 7.889 86 HA THR 12 HA THR 12 -13.110 -5.051 9.600 87 HB THR 12 HB THR 12 -13.188 -4.626 6.595 88 HG1 THR 12 HG1 THR 12 -11.657 -6.295 8.097 89 HG21 THR 12 3HG2 THR 12 -12.819 -2.583 7.896 90 HG22 THR 12 1HG2 THR 12 -11.363 -3.046 7.014 91 HG23 THR 12 2HG2 THR 12 -11.482 -3.362 8.745 92 H GLY 13 H GLY 13 -13.932 -2.816 9.702 93 HA2 GLY 13 1HA GLY 13 -16.793 -2.692 9.466 94 HA3 GLY 13 2HA GLY 13 -15.730 -1.397 10.005 95 H ARG 14 H ARG 14 -17.917 -0.928 8.344 96 HA ARG 14 HA ARG 14 -16.552 0.082 5.961 97 HB2 ARG 14 1HB ARG 14 -19.146 -1.476 5.852 98 HB3 ARG 14 2HB ARG 14 -18.479 -0.555 4.516 99 HG2 ARG 14 1HG ARG 14 -17.828 -2.677 3.970 100 HG3 ARG 14 2HG ARG 14 -16.410 -2.114 4.854 101 HD2 ARG 14 1HD ARG 14 -17.105 -4.393 5.502 102 HD3 ARG 14 2HD ARG 14 -17.145 -3.256 6.848 103 HE ARG 14 HE ARG 14 -19.683 -3.380 5.620 104 HH11 ARG 14 1HH1 ARG 14 -17.556 -5.248 7.679 105 HH12 ARG 14 2HH1 ARG 14 -18.854 -6.122 8.431 106 HH21 ARG 14 1HH2 ARG 14 -21.388 -4.501 6.620 107 HH22 ARG 14 2HH2 ARG 14 -21.037 -5.704 7.833 108 HA PRO 15 HA PRO 15 -19.068 3.401 7.974 109 HB2 PRO 15 1HB PRO 15 -17.364 5.313 6.908 110 HB3 PRO 15 2HB PRO 15 -17.222 4.620 8.524 111 HG2 PRO 15 1HG PRO 15 -15.757 3.910 6.023 112 HG3 PRO 15 2HG PRO 15 -15.156 4.004 7.689 113 HD2 PRO 15 1HD PRO 15 -15.690 1.644 6.539 114 HD3 PRO 15 2HD PRO 15 -16.030 1.933 8.257 115 H ASP 16 H ASP 16 -20.715 4.366 6.916 116 HA ASP 16 HA ASP 16 -21.056 3.832 4.142 117 HB2 ASP 16 1HB ASP 16 -22.882 4.003 5.930 118 HB3 ASP 16 2HB ASP 16 -22.740 5.747 5.737 119 H PHE 17 H PHE 17 -19.846 6.501 5.965 120 HA PHE 17 HA PHE 17 -20.170 8.631 4.235 121 HB2 PHE 17 1HB PHE 17 -19.226 8.977 6.419 122 HB3 PHE 17 2HB PHE 17 -17.834 7.971 6.031 123 HD1 PHE 17 HD2 PHE 17 -19.559 11.082 4.898 124 HD2 PHE 17 HD1 PHE 17 -15.885 8.968 5.307 125 HE1 PHE 17 HE2 PHE 17 -18.332 13.067 4.118 126 HE2 PHE 17 HE1 PHE 17 -14.655 10.949 4.525 127 HZ PHE 17 HZ PHE 17 -15.876 13.001 3.931 128 H GLN 18 H GLN 18 -17.371 6.393 4.302 129 HA GLN 18 HA GLN 18 -16.156 7.560 2.030 130 HB2 GLN 18 1HB GLN 18 -14.686 5.641 1.993 131 HB3 GLN 18 2HB GLN 18 -14.865 6.250 3.626 132 HG2 GLN 18 1HG GLN 18 -16.158 4.430 4.299 133 HG3 GLN 18 2HG GLN 18 -16.517 3.954 2.639 134 HE21 GLN 18 2HE2 GLN 18 -13.896 4.136 1.598 135 HE22 GLN 18 1HE2 GLN 18 -12.947 2.884 2.312 136 H LYS 19 H LYS 19 -18.491 5.020 2.449 137 HA LYS 19 HA LYS 19 -18.421 3.848 -0.075 138 HB2 LYS 19 1HB LYS 19 -20.746 4.301 1.801 139 HB3 LYS 19 2HB LYS 19 -20.812 3.264 0.382 140 HG2 LYS 19 1HG LYS 19 -19.215 1.762 1.317 141 HG3 LYS 19 2HG LYS 19 -18.869 2.871 2.647 142 HD2 LYS 19 1HD LYS 19 -20.323 1.072 3.393 143 HD3 LYS 19 2HD LYS 19 -21.176 2.616 3.443 144 HE2 LYS 19 1HE LYS 19 -22.105 2.034 1.170 145 HE3 LYS 19 2HE LYS 19 -21.450 0.414 1.410 146 HZ1 LYS 19 3HZ LYS 19 -22.771 0.372 3.528 147 HZ2 LYS 19 1HZ LYS 19 -23.679 0.348 2.095 148 HZ3 LYS 19 2HZ LYS 19 -23.544 1.781 2.988 149 H ARG 20 H ARG 20 -20.148 6.702 1.089 150 HA ARG 20 HA ARG 20 -21.354 7.270 -1.469 151 HB2 ARG 20 1HB ARG 20 -21.003 9.301 0.710 152 HB3 ARG 20 2HB ARG 20 -22.329 9.125 -0.433 153 HG2 ARG 20 1HG ARG 20 -23.050 7.108 0.714 154 HG3 ARG 20 2HG ARG 20 -21.697 7.286 1.839 155 HD2 ARG 20 1HD ARG 20 -23.864 8.109 2.737 156 HD3 ARG 20 2HD ARG 20 -22.597 9.332 2.695 157 HE ARG 20 HE ARG 20 -23.955 9.649 0.330 158 HH11 ARG 20 1HH1 ARG 20 -24.853 9.627 3.714 159 HH12 ARG 20 2HH1 ARG 20 -26.095 10.833 3.526 160 HH21 ARG 20 1HH2 ARG 20 -25.598 11.222 0.071 161 HH22 ARG 20 2HH2 ARG 20 -26.499 11.754 1.457 162 H LEU 21 H LEU 21 -18.687 8.452 0.455 163 HA LEU 21 HA LEU 21 -17.831 10.603 -1.081 164 HB2 LEU 21 1HB LEU 21 -16.850 10.240 1.036 165 HB3 LEU 21 2HB LEU 21 -16.337 8.620 0.609 166 HG LEU 21 HG LEU 21 -14.687 9.568 -0.958 167 HD11 LEU 21 1HD1 LEU 21 -14.178 11.962 -0.868 168 HD12 LEU 21 2HD1 LEU 21 -15.558 12.216 0.200 169 HD13 LEU 21 3HD1 LEU 21 -15.815 11.674 -1.459 170 HD21 LEU 21 3HD2 LEU 21 -14.068 8.995 1.341 171 HD22 LEU 21 1HD2 LEU 21 -14.477 10.632 1.855 172 HD23 LEU 21 2HD2 LEU 21 -13.138 10.368 0.737 173 H GLU 22 H GLU 22 -16.766 7.212 -1.382 174 HA GLU 22 HA GLU 22 -15.229 7.737 -3.735 175 HB2 GLU 22 1HB GLU 22 -16.135 5.136 -2.482 176 HB3 GLU 22 2HB GLU 22 -14.996 5.260 -3.817 177 HG2 GLU 22 1HG GLU 22 -13.405 6.408 -2.453 178 HG3 GLU 22 2HG GLU 22 -14.560 6.550 -1.132 179 H GLN 23 H GLN 23 -18.487 6.735 -3.068 180 HA GLN 23 HA GLN 23 -19.285 5.815 -5.599 181 HB2 GLN 23 1HB GLN 23 -20.611 5.603 -3.528 182 HB3 GLN 23 2HB GLN 23 -20.884 7.331 -3.537 183 HG2 GLN 23 1HG GLN 23 -22.012 7.042 -5.756 184 HG3 GLN 23 2HG GLN 23 -21.916 5.300 -5.486 185 HE21 GLN 23 2HE2 GLN 23 -22.281 5.556 -2.609 186 HE22 GLN 23 1HE2 GLN 23 -23.953 5.938 -2.355 187 H MET 24 H MET 24 -19.656 9.028 -4.140 188 HA MET 24 HA MET 24 -20.686 10.269 -6.436 189 HB2 MET 24 1HB MET 24 -20.216 12.390 -5.327 190 HB3 MET 24 2HB MET 24 -20.979 11.252 -4.230 191 HG2 MET 24 1HG MET 24 -18.802 10.772 -3.233 192 HG3 MET 24 2HG MET 24 -18.049 11.929 -4.326 193 HE1 MET 24 3HE MET 24 -19.625 15.315 -3.139 194 HE2 MET 24 1HE MET 24 -20.176 14.260 -4.442 195 HE3 MET 24 2HE MET 24 -18.452 14.558 -4.215 196 H LYS 25 H LYS 25 -17.388 9.896 -5.252 197 HA LYS 25 HA LYS 25 -16.037 11.408 -7.146 198 HB2 LYS 25 1HB LYS 25 -14.868 10.361 -5.285 199 HB3 LYS 25 2HB LYS 25 -15.257 8.760 -5.900 200 HG2 LYS 25 1HG LYS 25 -12.949 9.330 -6.376 201 HG3 LYS 25 2HG LYS 25 -13.873 9.181 -7.872 202 HD2 LYS 25 1HD LYS 25 -12.600 11.113 -8.182 203 HD3 LYS 25 2HD LYS 25 -14.191 11.711 -7.702 204 HE2 LYS 25 1HE LYS 25 -12.500 12.942 -6.517 205 HE3 LYS 25 2HE LYS 25 -13.377 11.918 -5.387 206 HZ1 LYS 25 3HZ LYS 25 -10.759 11.215 -6.579 207 HZ2 LYS 25 1HZ LYS 25 -11.567 10.367 -5.354 208 HZ3 LYS 25 2HZ LYS 25 -10.942 11.919 -5.057 209 H GLU 26 H GLU 26 -16.915 7.964 -7.299 210 HA GLU 26 HA GLU 26 -16.115 7.420 -9.902 211 HB2 GLU 26 1HB GLU 26 -16.875 5.734 -8.253 212 HB3 GLU 26 2HB GLU 26 -18.522 6.312 -8.444 213 HG2 GLU 26 1HG GLU 26 -17.742 5.765 -11.024 214 HG3 GLU 26 2HG GLU 26 -16.986 4.480 -10.082 215 H LYS 27 H LYS 27 -19.259 8.539 -8.725 216 HA LYS 27 HA LYS 27 -20.711 8.665 -11.067 217 HB2 LYS 27 1HB LYS 27 -20.767 10.075 -8.468 218 HB3 LYS 27 2HB LYS 27 -21.643 10.848 -9.782 219 HG2 LYS 27 1HG LYS 27 -22.079 7.950 -9.211 220 HG3 LYS 27 2HG LYS 27 -22.856 9.178 -8.210 221 HD2 LYS 27 1HD LYS 27 -23.070 9.015 -11.216 222 HD3 LYS 27 2HD LYS 27 -24.281 8.409 -10.084 223 HE2 LYS 27 1HE LYS 27 -24.625 10.640 -9.209 224 HE3 LYS 27 2HE LYS 27 -23.344 11.273 -10.238 225 HZ1 LYS 27 3HZ LYS 27 -25.877 10.058 -11.205 226 HZ2 LYS 27 1HZ LYS 27 -24.655 10.729 -12.174 227 HZ3 LYS 27 2HZ LYS 27 -25.554 11.723 -11.128 228 H VAL 28 H VAL 28 -18.440 11.047 -9.790 229 HA VAL 28 HA VAL 28 -19.031 13.051 -11.728 230 HB VAL 28 HB VAL 28 -16.623 12.706 -9.925 231 HG11 VAL 28 1HG1 VAL 28 -16.120 15.047 -10.406 232 HG12 VAL 28 2HG1 VAL 28 -17.433 15.089 -11.583 233 HG13 VAL 28 3HG1 VAL 28 -16.031 14.056 -11.861 234 HG21 VAL 28 3HG2 VAL 28 -18.703 13.062 -8.717 235 HG22 VAL 28 1HG2 VAL 28 -19.054 14.479 -9.706 236 HG23 VAL 28 2HG2 VAL 28 -17.675 14.492 -8.607 237 H MET 29 H MET 29 -16.693 10.464 -11.458 238 HA MET 29 HA MET 29 -15.159 11.225 -13.763 239 HB2 MET 29 1HB MET 29 -15.238 8.487 -12.489 240 HB3 MET 29 2HB MET 29 -13.922 9.217 -13.394 241 HG2 MET 29 1HG MET 29 -14.903 10.125 -10.704 242 HG3 MET 29 2HG MET 29 -13.480 9.131 -10.992 243 HE1 MET 29 3HE MET 29 -10.762 11.483 -11.922 244 HE2 MET 29 1HE MET 29 -11.458 9.989 -12.551 245 HE3 MET 29 2HE MET 29 -11.227 10.192 -10.812 246 H LYS 30 H LYS 30 -18.236 10.290 -13.644 247 HA LYS 30 HA LYS 30 -18.066 8.444 -15.909 248 HB2 LYS 30 1HB LYS 30 -20.380 9.151 -14.108 249 HB3 LYS 30 2HB LYS 30 -20.485 8.056 -15.476 250 HG2 LYS 30 1HG LYS 30 -18.946 7.686 -12.927 251 HG3 LYS 30 2HG LYS 30 -20.287 6.718 -13.543 252 HD2 LYS 30 1HD LYS 30 -18.846 6.075 -15.469 253 HD3 LYS 30 2HD LYS 30 -17.512 6.929 -14.689 254 HE2 LYS 30 1HE LYS 30 -17.470 4.493 -14.283 255 HE3 LYS 30 2HE LYS 30 -17.596 5.442 -12.803 256 HZ1 LYS 30 3HZ LYS 30 -20.049 4.446 -14.087 257 HZ2 LYS 30 1HZ LYS 30 -19.747 4.774 -12.449 258 HZ3 LYS 30 2HZ LYS 30 -19.104 3.381 -13.170 259 H ASP 31 H ASP 31 -18.741 11.724 -15.205 260 HA ASP 31 HA ASP 31 -20.664 12.059 -17.337 261 HB2 ASP 31 1HB ASP 31 -20.782 13.445 -15.285 262 HB3 ASP 31 2HB ASP 31 -19.251 14.192 -15.735 263 H GLN 32 H GLN 32 -20.301 12.639 -19.357 264 HA GLN 32 HA GLN 32 -17.722 12.378 -20.443 265 HB2 GLN 32 1HB GLN 32 -18.792 13.127 -22.570 266 HB3 GLN 32 2HB GLN 32 -19.621 11.801 -21.769 267 HG2 GLN 32 1HG GLN 32 -21.267 13.384 -20.878 268 HG3 GLN 32 2HG GLN 32 -20.437 14.698 -21.711 269 HE21 GLN 32 2HE2 GLN 32 -23.183 13.654 -21.986 270 HE22 GLN 32 1HE2 GLN 32 -23.360 13.263 -23.665 271 H ASP 33 H ASP 33 -19.592 15.239 -19.598 272 HA ASP 33 HA ASP 33 -17.823 17.069 -20.914 273 HB2 ASP 33 1HB ASP 33 -19.981 17.491 -18.846 274 HB3 ASP 33 2HB ASP 33 -19.049 18.807 -19.555 275 H VAL 34 H VAL 34 -18.214 15.860 -17.626 276 HA VAL 34 HA VAL 34 -16.234 17.369 -16.367 277 HB VAL 34 HB VAL 34 -17.190 14.549 -15.900 278 HG11 VAL 34 1HG1 VAL 34 -15.965 14.587 -13.768 279 HG12 VAL 34 2HG1 VAL 34 -15.192 16.098 -14.252 280 HG13 VAL 34 3HG1 VAL 34 -14.880 14.615 -15.159 281 HG21 VAL 34 3HG2 VAL 34 -17.532 17.106 -14.340 282 HG22 VAL 34 1HG2 VAL 34 -18.225 15.537 -13.927 283 HG23 VAL 34 2HG2 VAL 34 -18.740 16.369 -15.394 284 H GLN 35 H GLN 35 -15.946 14.252 -18.050 285 HA GLN 35 HA GLN 35 -13.174 13.949 -17.745 286 HB2 GLN 35 1HB GLN 35 -14.814 12.974 -20.084 287 HB3 GLN 35 2HB GLN 35 -13.318 12.280 -19.466 288 HG2 GLN 35 1HG GLN 35 -14.572 11.901 -17.308 289 HG3 GLN 35 2HG GLN 35 -16.033 12.271 -18.212 290 HE21 GLN 35 2HE2 GLN 35 -15.227 9.829 -16.897 291 HE22 GLN 35 1HE2 GLN 35 -15.270 8.598 -18.105 292 H ALA 36 H ALA 36 -15.100 15.452 -20.264 293 HA ALA 36 HA ALA 36 -13.056 16.157 -22.038 294 HB1 ALA 36 1HB ALA 36 -14.590 17.822 -22.915 295 HB2 ALA 36 2HB ALA 36 -15.582 17.703 -21.462 296 HB3 ALA 36 3HB ALA 36 -15.457 16.327 -22.557 297 H PHE 37 H PHE 37 -14.320 17.843 -19.201 298 HA PHE 37 HA PHE 37 -12.664 20.124 -19.434 299 HB2 PHE 37 1HB PHE 37 -14.645 20.217 -18.075 300 HB3 PHE 37 2HB PHE 37 -14.070 18.902 -17.059 301 HD1 PHE 37 HD1 PHE 37 -13.066 22.323 -18.165 302 HD2 PHE 37 HD2 PHE 37 -13.073 19.407 -15.064 303 HE1 PHE 37 HE1 PHE 37 -12.051 23.960 -16.629 304 HE2 PHE 37 HE2 PHE 37 -12.063 21.041 -13.524 305 HZ PHE 37 HZ PHE 37 -11.547 23.319 -14.307 306 H LEU 38 H LEU 38 -12.312 17.046 -17.729 307 HA LEU 38 HA LEU 38 -9.960 17.650 -16.337 308 HB2 LEU 38 1HB LEU 38 -11.413 15.201 -17.068 309 HB3 LEU 38 2HB LEU 38 -9.690 14.982 -16.830 310 HG LEU 38 HG LEU 38 -10.762 14.489 -14.769 311 HD11 LEU 38 1HD1 LEU 38 -8.678 15.698 -14.555 312 HD12 LEU 38 2HD1 LEU 38 -9.783 16.160 -13.260 313 HD13 LEU 38 3HD1 LEU 38 -9.534 17.236 -14.635 314 HD21 LEU 38 3HD2 LEU 38 -12.132 17.162 -15.012 315 HD22 LEU 38 1HD2 LEU 38 -12.194 16.109 -13.597 316 HD23 LEU 38 2HD2 LEU 38 -12.890 15.571 -15.127 317 H LYS 39 H LYS 39 -10.413 16.233 -19.559 318 HA LYS 39 HA LYS 39 -7.600 15.883 -19.987 319 HB2 LYS 39 1HB LYS 39 -8.225 15.439 -22.351 320 HB3 LYS 39 2HB LYS 39 -9.119 14.456 -21.200 321 HG2 LYS 39 1HG LYS 39 -11.066 15.837 -21.458 322 HG3 LYS 39 2HG LYS 39 -10.177 16.964 -22.484 323 HD2 LYS 39 1HD LYS 39 -10.491 14.062 -23.192 324 HD3 LYS 39 2HD LYS 39 -11.699 15.269 -23.638 325 HE2 LYS 39 1HE LYS 39 -8.777 15.436 -24.364 326 HE3 LYS 39 2HE LYS 39 -10.026 14.781 -25.421 327 HZ1 LYS 39 3HZ LYS 39 -9.677 17.031 -26.033 328 HZ2 LYS 39 1HZ LYS 39 -9.792 17.575 -24.428 329 HZ3 LYS 39 2HZ LYS 39 -11.164 16.975 -25.219 330 H GLU 40 H GLU 40 -9.812 18.483 -20.388 331 HA GLU 40 HA GLU 40 -8.236 19.909 -22.311 332 HB2 GLU 40 1HB GLU 40 -10.843 20.093 -21.223 333 HB3 GLU 40 2HB GLU 40 -10.044 21.631 -20.929 334 HG2 GLU 40 1HG GLU 40 -11.215 21.725 -23.018 335 HG3 GLU 40 2HG GLU 40 -9.481 21.751 -23.329 336 H ASN 41 H ASN 41 -8.521 19.866 -18.835 337 HA ASN 41 HA ASN 41 -6.446 21.953 -18.720 338 HB2 ASN 41 1HB ASN 41 -8.823 21.521 -16.918 339 HB3 ASN 41 2HB ASN 41 -7.421 22.449 -16.400 340 HD21 ASN 41 2HD2 ASN 41 -10.211 22.374 -18.428 341 HD22 ASN 41 1HD2 ASN 41 -10.142 24.029 -18.942 342 H GLU 42 H GLU 42 -6.164 19.025 -18.838 343 HA GLU 42 HA GLU 42 -5.618 17.950 -16.297 344 HB2 GLU 42 1HB GLU 42 -4.288 16.238 -17.521 345 HB3 GLU 42 2HB GLU 42 -5.903 16.476 -18.172 346 HG2 GLU 42 1HG GLU 42 -5.047 17.744 -20.010 347 HG3 GLU 42 2HG GLU 42 -3.425 17.732 -19.321 348 H GLU 43 H GLU 43 -3.794 20.057 -18.316 349 HA GLU 43 HA GLU 43 -1.243 19.636 -17.144 350 HB2 GLU 43 1HB GLU 43 -1.594 20.729 -19.346 351 HB3 GLU 43 2HB GLU 43 -2.326 22.101 -18.526 352 HG2 GLU 43 1HG GLU 43 -0.094 22.222 -17.234 353 HG3 GLU 43 2HG GLU 43 0.527 21.215 -18.542 354 H VAL 44 H VAL 44 -4.039 21.531 -16.315 355 HA VAL 44 HA VAL 44 -2.524 23.162 -14.421 356 HB VAL 44 HB VAL 44 -5.455 23.361 -15.123 357 HG11 VAL 44 1HG1 VAL 44 -5.256 25.640 -14.257 358 HG12 VAL 44 2HG1 VAL 44 -3.568 25.333 -13.849 359 HG13 VAL 44 3HG1 VAL 44 -4.849 24.437 -13.031 360 HG21 VAL 44 3HG2 VAL 44 -3.136 24.861 -16.340 361 HG22 VAL 44 1HG2 VAL 44 -4.845 25.160 -16.663 362 HG23 VAL 44 2HG2 VAL 44 -4.110 23.631 -17.143 363 H ILE 45 H ILE 45 -5.229 20.904 -14.553 364 HA ILE 45 HA ILE 45 -5.793 21.115 -11.739 365 HB ILE 45 HB ILE 45 -6.841 19.112 -13.740 366 HG12 ILE 45 1HG1 ILE 45 -8.098 21.713 -12.846 367 HG13 ILE 45 2HG1 ILE 45 -7.252 21.499 -14.376 368 HG21 ILE 45 1HG2 ILE 45 -7.908 19.991 -11.063 369 HG22 ILE 45 2HG2 ILE 45 -7.183 18.427 -11.437 370 HG23 ILE 45 3HG2 ILE 45 -8.717 18.886 -12.175 371 HD11 ILE 45 3HD1 ILE 45 -9.739 20.053 -13.505 372 HD12 ILE 45 1HD1 ILE 45 -8.878 19.791 -15.022 373 HD13 ILE 45 2HD1 ILE 45 -9.638 21.349 -14.696 374 H ASP 46 H ASP 46 -5.359 19.660 -10.153 375 HA ASP 46 HA ASP 46 -3.836 17.252 -10.874 376 HB2 ASP 46 1HB ASP 46 -2.319 17.536 -9.090 377 HB3 ASP 46 2HB ASP 46 -2.432 19.128 -9.828 378 H GLN 47 H GLN 47 -3.784 15.790 -8.748 379 HA GLN 47 HA GLN 47 -6.399 14.873 -8.438 380 HB2 GLN 47 1HB GLN 47 -3.943 14.315 -6.774 381 HB3 GLN 47 2HB GLN 47 -5.464 13.448 -6.601 382 HG2 GLN 47 1HG GLN 47 -5.297 12.619 -8.860 383 HG3 GLN 47 2HG GLN 47 -3.840 13.572 -9.132 384 HE21 GLN 47 2HE2 GLN 47 -1.917 12.934 -8.204 385 HE22 GLN 47 1HE2 GLN 47 -1.677 11.348 -7.558 386 H LYS 48 H LYS 48 -4.402 16.785 -6.204 387 HA LYS 48 HA LYS 48 -6.206 16.808 -4.054 388 HB2 LYS 48 1HB LYS 48 -4.065 18.763 -4.883 389 HB3 LYS 48 2HB LYS 48 -4.986 18.931 -3.396 390 HG2 LYS 48 1HG LYS 48 -4.172 16.768 -2.636 391 HG3 LYS 48 2HG LYS 48 -3.267 16.575 -4.138 392 HD2 LYS 48 1HD LYS 48 -1.911 18.514 -3.598 393 HD3 LYS 48 2HD LYS 48 -2.852 18.787 -2.128 394 HE2 LYS 48 1HE LYS 48 -2.109 16.661 -1.228 395 HE3 LYS 48 2HE LYS 48 -1.233 16.312 -2.719 396 HZ1 LYS 48 3HZ LYS 48 0.246 17.121 -0.999 397 HZ2 LYS 48 1HZ LYS 48 -0.654 18.551 -0.850 398 HZ3 LYS 48 2HZ LYS 48 0.185 18.219 -2.287 399 H MET 49 H MET 49 -5.880 18.978 -6.816 400 HA MET 49 HA MET 49 -7.794 20.876 -6.091 401 HB2 MET 49 1HB MET 49 -6.152 20.953 -8.023 402 HB3 MET 49 2HB MET 49 -7.264 19.916 -8.902 403 HG2 MET 49 1HG MET 49 -8.989 21.604 -8.765 404 HG3 MET 49 2HG MET 49 -7.929 22.626 -7.798 405 HE1 MET 49 3HE MET 49 -5.094 23.480 -10.379 406 HE2 MET 49 1HE MET 49 -5.144 22.186 -9.182 407 HE3 MET 49 2HE MET 49 -5.717 23.800 -8.759 408 H ILE 50 H ILE 50 -8.112 17.820 -7.850 409 HA ILE 50 HA ILE 50 -10.866 17.983 -8.410 410 HB ILE 50 HB ILE 50 -9.084 15.570 -8.034 411 HG12 ILE 50 1HG1 ILE 50 -8.488 17.049 -9.911 412 HG13 ILE 50 2HG1 ILE 50 -9.080 15.491 -10.475 413 HG21 ILE 50 1HG2 ILE 50 -10.821 14.271 -9.167 414 HG22 ILE 50 2HG2 ILE 50 -11.879 15.682 -9.158 415 HG23 ILE 50 3HG2 ILE 50 -11.398 14.933 -7.636 416 HD11 ILE 50 3HD1 ILE 50 -11.265 16.497 -10.934 417 HD12 ILE 50 1HD1 ILE 50 -9.969 17.290 -11.828 418 HD13 ILE 50 2HD1 ILE 50 -10.647 18.058 -10.393 419 H GLU 51 H GLU 51 -9.106 16.578 -5.674 420 HA GLU 51 HA GLU 51 -11.310 15.402 -4.409 421 HB2 GLU 51 1HB GLU 51 -8.805 16.460 -3.093 422 HB3 GLU 51 2HB GLU 51 -9.912 15.274 -2.418 423 HG2 GLU 51 1HG GLU 51 -8.069 14.950 -4.768 424 HG3 GLU 51 2HG GLU 51 -8.024 14.102 -3.225 425 H LYS 52 H LYS 52 -10.009 18.677 -4.183 426 HA LYS 52 HA LYS 52 -11.744 19.416 -2.022 427 HB2 LYS 52 1HB LYS 52 -10.232 21.170 -3.959 428 HB3 LYS 52 2HB LYS 52 -11.076 21.735 -2.527 429 HG2 LYS 52 1HG LYS 52 -9.508 20.004 -1.322 430 HG3 LYS 52 2HG LYS 52 -8.511 20.256 -2.757 431 HD2 LYS 52 1HD LYS 52 -9.476 22.337 -0.801 432 HD3 LYS 52 2HD LYS 52 -7.812 21.819 -1.075 433 HE2 LYS 52 1HE LYS 52 -7.807 22.794 -3.267 434 HE3 LYS 52 2HE LYS 52 -9.534 23.138 -3.169 435 HZ1 LYS 52 3HZ LYS 52 -7.404 24.370 -1.501 436 HZ2 LYS 52 1HZ LYS 52 -9.066 24.666 -1.329 437 HZ3 LYS 52 2HZ LYS 52 -8.265 25.130 -2.748 438 H SER 53 H SER 53 -11.789 19.809 -5.529 439 HA SER 53 HA SER 53 -14.278 21.313 -5.381 440 HB2 SER 53 1HB SER 53 -12.573 20.576 -7.770 441 HB3 SER 53 2HB SER 53 -13.918 21.718 -7.766 442 HG SER 53 HG SER 53 -12.489 22.668 -5.915 443 H LEU 54 H LEU 54 -13.946 18.290 -4.907 444 HA LEU 54 HA LEU 54 -15.258 16.909 -6.970 445 HB2 LEU 54 1HB LEU 54 -14.028 15.830 -5.116 446 HB3 LEU 54 2HB LEU 54 -15.290 16.330 -4.006 447 HG LEU 54 HG LEU 54 -16.910 14.920 -5.193 448 HD11 LEU 54 1HD1 LEU 54 -16.155 13.348 -6.901 449 HD12 LEU 54 2HD1 LEU 54 -14.547 14.072 -6.863 450 HD13 LEU 54 3HD1 LEU 54 -15.929 15.018 -7.418 451 HD21 LEU 54 3HD2 LEU 54 -16.004 12.752 -4.515 452 HD22 LEU 54 1HD2 LEU 54 -15.686 13.991 -3.302 453 HD23 LEU 54 2HD2 LEU 54 -14.395 13.463 -4.382 454 H ASN 55 H ASN 55 -16.462 18.682 -4.174 455 HA ASN 55 HA ASN 55 -19.192 18.065 -4.478 456 HB2 ASN 55 1HB ASN 55 -19.640 20.077 -3.138 457 HB3 ASN 55 2HB ASN 55 -18.335 19.128 -2.440 458 HD21 ASN 55 2HD2 ASN 55 -19.036 21.969 -2.156 459 HD22 ASN 55 1HD2 ASN 55 -17.610 22.848 -2.590 460 H LYS 56 H LYS 56 -17.173 20.586 -5.900 461 HA LYS 56 HA LYS 56 -19.178 22.021 -7.241 462 HB2 LYS 56 1HB LYS 56 -16.254 21.600 -7.869 463 HB3 LYS 56 2HB LYS 56 -17.281 22.687 -8.792 464 HG2 LYS 56 1HG LYS 56 -16.906 22.937 -5.822 465 HG3 LYS 56 2HG LYS 56 -15.862 23.741 -6.999 466 HD2 LYS 56 1HD LYS 56 -17.799 24.884 -7.946 467 HD3 LYS 56 2HD LYS 56 -18.856 24.063 -6.796 468 HE2 LYS 56 1HE LYS 56 -17.809 25.189 -4.949 469 HE3 LYS 56 2HE LYS 56 -16.583 25.879 -6.013 470 HZ1 LYS 56 3HZ LYS 56 -18.168 27.255 -7.046 471 HZ2 LYS 56 1HZ LYS 56 -18.449 27.402 -5.379 472 HZ3 LYS 56 2HZ LYS 56 -19.473 26.441 -6.328 473 H LEU 57 H LEU 57 -17.065 19.416 -8.426 474 HA LEU 57 HA LEU 57 -18.225 19.338 -10.995 475 HB2 LEU 57 1HB LEU 57 -16.415 17.542 -9.455 476 HB3 LEU 57 2HB LEU 57 -17.173 16.920 -10.907 477 HG LEU 57 HG LEU 57 -16.172 18.754 -12.214 478 HD11 LEU 57 1HD1 LEU 57 -15.988 20.443 -10.486 479 HD12 LEU 57 2HD1 LEU 57 -14.415 20.138 -11.226 480 HD13 LEU 57 3HD1 LEU 57 -14.787 19.469 -9.637 481 HD21 LEU 57 3HD2 LEU 57 -14.214 17.136 -10.598 482 HD22 LEU 57 1HD2 LEU 57 -13.862 17.947 -12.124 483 HD23 LEU 57 2HD2 LEU 57 -15.030 16.627 -12.078 484 H TYR 58 H TYR 58 -18.958 17.585 -8.009 485 HA TYR 58 HA TYR 58 -20.796 15.784 -9.223 486 HB2 TYR 58 1HB TYR 58 -19.699 15.494 -6.951 487 HB3 TYR 58 2HB TYR 58 -20.849 16.679 -6.339 488 HD1 TYR 58 HD2 TYR 58 -20.656 13.405 -8.083 489 HD2 TYR 58 HD1 TYR 58 -22.984 15.992 -5.635 490 HE1 TYR 58 HE2 TYR 58 -22.307 11.618 -7.778 491 HE2 TYR 58 HE1 TYR 58 -24.647 14.206 -5.326 492 HH TYR 58 HH TYR 58 -25.365 12.105 -6.690 493 H GLU 59 H GLU 59 -21.149 18.890 -7.562 494 HA GLU 59 HA GLU 59 -23.917 19.168 -7.676 495 HB2 GLU 59 1HB GLU 59 -22.428 20.719 -6.474 496 HB3 GLU 59 2HB GLU 59 -21.785 21.292 -8.005 497 HG2 GLU 59 1HG GLU 59 -23.944 22.215 -8.597 498 HG3 GLU 59 2HG GLU 59 -24.639 21.593 -7.099 499 H TYR 60 H TYR 60 -21.440 19.867 -10.056 500 HA TYR 60 HA TYR 60 -23.018 21.131 -11.980 501 HB2 TYR 60 1HB TYR 60 -20.642 21.328 -12.059 502 HB3 TYR 60 2HB TYR 60 -20.432 19.585 -12.144 503 HD1 TYR 60 HD1 TYR 60 -21.702 22.506 -14.048 504 HD2 TYR 60 HD2 TYR 60 -20.275 18.504 -14.215 505 HE1 TYR 60 HE1 TYR 60 -21.599 22.651 -16.498 506 HE2 TYR 60 HE2 TYR 60 -20.173 18.635 -16.670 507 HH TYR 60 HH TYR 60 -21.148 19.920 -18.493 508 H ILE 61 H ILE 61 -22.154 17.688 -11.663 509 HA ILE 61 HA ILE 61 -23.436 17.021 -14.132 510 HB ILE 61 HB ILE 61 -22.985 14.697 -13.573 511 HG12 ILE 61 1HG1 ILE 61 -21.948 15.761 -10.935 512 HG13 ILE 61 2HG1 ILE 61 -23.415 14.810 -11.141 513 HG21 ILE 61 1HG2 ILE 61 -21.236 16.019 -14.586 514 HG22 ILE 61 2HG2 ILE 61 -20.537 14.863 -13.451 515 HG23 ILE 61 3HG2 ILE 61 -20.690 16.561 -13.000 516 HD11 ILE 61 3HD1 ILE 61 -20.631 13.872 -11.788 517 HD12 ILE 61 1HD1 ILE 61 -22.111 12.920 -11.892 518 HD13 ILE 61 2HD1 ILE 61 -21.532 13.476 -10.323 519 H GLU 62 H GLU 62 -24.417 17.055 -10.782 520 HA GLU 62 HA GLU 62 -26.782 15.467 -11.287 521 HB2 GLU 62 1HB GLU 62 -25.925 16.984 -8.820 522 HB3 GLU 62 2HB GLU 62 -27.288 15.875 -8.914 523 HG2 GLU 62 1HG GLU 62 -24.463 15.085 -9.520 524 HG3 GLU 62 2HG GLU 62 -25.192 14.932 -7.924 525 H GLN 63 H GLN 63 -25.908 18.793 -11.323 526 HA GLN 63 HA GLN 63 -28.695 19.628 -11.312 527 HB2 GLN 63 1HB GLN 63 -27.948 21.876 -11.455 528 HB3 GLN 63 2HB GLN 63 -26.874 21.071 -10.324 529 HG2 GLN 63 1HG GLN 63 -25.128 20.970 -11.951 530 HG3 GLN 63 2HG GLN 63 -26.207 21.573 -13.212 531 HE21 GLN 63 2HE2 GLN 63 -23.678 22.666 -12.173 532 HE22 GLN 63 1HE2 GLN 63 -24.045 24.273 -11.660 533 H SER 64 H SER 64 -28.989 21.416 -13.274 534 HA SER 64 HA SER 64 -29.323 19.693 -15.515 535 HB2 SER 64 1HB SER 64 -29.776 22.672 -15.272 536 HB3 SER 64 2HB SER 64 -30.339 21.649 -16.596 537 HG SER 64 HG SER 64 -31.260 21.864 -13.975 538 H LYS 65 H LYS 65 -27.965 19.290 -17.075 539 HA LYS 65 HA LYS 65 -25.540 20.794 -17.447 540 HB2 LYS 65 1HB LYS 65 -26.752 18.561 -19.102 541 HB3 LYS 65 2HB LYS 65 -25.115 19.185 -19.273 542 HG2 LYS 65 1HG LYS 65 -24.472 18.332 -17.157 543 HG3 LYS 65 2HG LYS 65 -26.142 17.964 -16.725 544 HD2 LYS 65 1HD LYS 65 -25.004 15.921 -17.327 545 HD3 LYS 65 2HD LYS 65 -26.209 16.302 -18.556 546 HE2 LYS 65 1HE LYS 65 -24.224 15.589 -19.671 547 HE3 LYS 65 2HE LYS 65 -24.388 17.325 -19.920 548 HZ1 LYS 65 3HZ LYS 65 -22.800 17.626 -18.059 549 HZ2 LYS 65 1HZ LYS 65 -22.129 16.840 -19.403 550 HZ3 LYS 65 2HZ LYS 65 -22.561 15.950 -18.019 551 H ASN 66 H ASN 66 -28.712 20.612 -18.788 552 HA ASN 66 HA ASN 66 -28.063 22.564 -20.874 553 HB2 ASN 66 1HB ASN 66 -30.433 20.777 -20.356 554 HB3 ASN 66 2HB ASN 66 -30.543 22.126 -21.479 555 HD21 ASN 66 2HD2 ASN 66 -30.654 19.163 -21.817 556 HD22 ASN 66 1HD2 ASN 66 -29.481 18.813 -23.047 557 H CYS 67 H CYS 67 -30.562 23.840 -21.027 558 HA CYS 67 HA CYS 67 -31.129 24.899 -18.386 559 HB2 CYS 67 1HB CYS 67 -30.683 27.153 -18.812 560 HB3 CYS 67 2HB CYS 67 -29.286 26.346 -19.493 561 H SER 68 H SER 68 -33.077 26.228 -18.401 562 HA SER 68 HA SER 68 -35.087 24.845 -19.847 563 HB2 SER 68 1HB SER 68 -35.368 25.827 -17.559 564 HB3 SER 68 2HB SER 68 -35.413 27.425 -18.302 565 HG SER 68 HG SER 68 -37.142 25.931 -19.615 566 H TYR 69 H TYR 69 -33.184 27.507 -20.652 567 HA TYR 69 HA TYR 69 -34.973 28.793 -22.480 568 HB2 TYR 69 1HB TYR 69 -32.758 29.595 -21.250 569 HB3 TYR 69 2HB TYR 69 -32.020 29.040 -22.742 570 HD1 TYR 69 HD2 TYR 69 -34.439 31.416 -21.312 571 HD2 TYR 69 HD1 TYR 69 -32.230 30.289 -24.767 572 HE1 TYR 69 HE2 TYR 69 -35.043 33.539 -22.382 573 HE2 TYR 69 HE1 TYR 69 -32.830 32.413 -25.850 574 HH TYR 69 HH TYR 69 -34.566 34.128 -25.709 575 H CYS 70 H CYS 70 -33.427 25.873 -22.552 576 HA CYS 70 HA CYS 70 -33.709 25.794 -25.468 577 HB2 CYS 70 1HB CYS 70 -31.716 24.328 -25.674 578 HB3 CYS 70 2HB CYS 70 -31.333 25.965 -25.161 579 H SER 71 H SER 71 -33.564 23.959 -22.445 580 HA SER 71 HA SER 71 -34.739 21.633 -23.689 581 HB2 SER 71 1HB SER 71 -34.798 20.776 -21.315 582 HB3 SER 71 2HB SER 71 -33.191 21.210 -21.895 583 HG SER 71 HG SER 71 -34.835 22.512 -20.026 584 H GLU 72 H GLU 72 -36.842 21.136 -23.746 585 HA GLU 72 HA GLU 72 -38.679 23.208 -22.800 586 HB2 GLU 72 1HB GLU 72 -40.316 22.093 -24.337 587 HB3 GLU 72 2HB GLU 72 -38.902 22.775 -25.128 588 HG2 GLU 72 1HG GLU 72 -37.947 20.381 -24.932 589 HG3 GLU 72 2HG GLU 72 -39.630 19.914 -24.693 590 H ASP 73 H ASP 73 -37.489 20.368 -21.723 591 HA ASP 73 HA ASP 73 -39.836 19.338 -20.440 592 HB2 ASP 73 1HB ASP 73 -37.970 17.833 -20.738 593 HB3 ASP 73 2HB ASP 73 -36.888 18.931 -19.884 594 H GLU 74 H GLU 74 -40.908 20.647 -19.134 595 HA GLU 74 HA GLU 74 -39.568 22.728 -17.657 596 HB2 GLU 74 1HB GLU 74 -42.477 21.949 -17.863 597 HB3 GLU 74 2HB GLU 74 -41.890 23.331 -16.946 598 HG2 GLU 74 1HG GLU 74 -40.986 24.309 -18.992 599 HG3 GLU 74 2HG GLU 74 -41.572 22.923 -19.912 600 H ASN 75 H ASN 75 -39.769 19.583 -17.012 601 HA ASN 75 HA ASN 75 -40.731 19.574 -14.329 602 HB2 ASN 75 1HB ASN 75 -39.062 17.637 -15.918 603 HB3 ASN 75 2HB ASN 75 -39.393 17.379 -14.207 604 HD21 ASN 75 2HD2 ASN 75 -40.676 17.355 -17.417 605 HD22 ASN 75 1HD2 ASN 75 -42.222 16.666 -17.011 606 H CYS 76 H CYS 76 -37.541 19.887 -15.810 607 HA CYS 76 HA CYS 76 -36.294 20.260 -13.219 608 HB2 CYS 76 1HB CYS 76 -35.171 20.471 -16.022 609 HB3 CYS 76 2HB CYS 76 -34.224 20.634 -14.549 610 HG CYS 76 HG CYS 76 -35.691 17.844 -14.123 611 H ASN 77 H ASN 77 -36.579 22.144 -12.224 612 HA ASN 77 HA ASN 77 -36.466 24.581 -13.854 613 HB2 ASN 77 1HB ASN 77 -37.346 25.751 -11.806 614 HB3 ASN 77 2HB ASN 77 -38.458 24.604 -12.537 615 HD21 ASN 77 2HD2 ASN 77 -39.652 24.310 -10.715 616 HD22 ASN 77 1HD2 ASN 77 -39.056 23.464 -9.321 617 H ASN 78 H ASN 78 -35.018 26.233 -13.319 618 HA ASN 78 HA ASN 78 -32.899 25.548 -11.421 619 HB2 ASN 78 1HB ASN 78 -32.371 26.190 -14.337 620 HB3 ASN 78 2HB ASN 78 -31.142 26.000 -13.096 621 HD21 ASN 78 2HD2 ASN 78 -33.303 24.417 -15.249 622 HD22 ASN 78 1HD2 ASN 78 -32.743 22.806 -14.967 623 H LEU 79 H LEU 79 -31.566 27.357 -10.858 624 HA LEU 79 HA LEU 79 -32.794 29.922 -11.160 625 HB2 LEU 79 1HB LEU 79 -30.810 30.761 -9.945 626 HB3 LEU 79 2HB LEU 79 -31.641 29.465 -9.113 627 HG LEU 79 HG LEU 79 -29.819 27.952 -10.246 628 HD11 LEU 79 1HD1 LEU 79 -28.468 30.644 -10.214 629 HD12 LEU 79 2HD1 LEU 79 -28.848 29.686 -11.643 630 HD13 LEU 79 3HD1 LEU 79 -27.665 29.095 -10.473 631 HD21 LEU 79 3HD2 LEU 79 -29.213 29.779 -7.931 632 HD22 LEU 79 1HD2 LEU 79 -28.418 28.243 -8.276 633 HD23 LEU 79 2HD2 LEU 79 -30.130 28.277 -7.851 634 H LEU 80 H LEU 80 -30.527 28.045 -12.873 635 HA LEU 80 HA LEU 80 -29.334 30.248 -14.293 636 HB2 LEU 80 1HB LEU 80 -28.195 28.467 -15.597 637 HB3 LEU 80 2HB LEU 80 -27.925 28.366 -13.872 638 HG LEU 80 HG LEU 80 -30.027 26.670 -14.148 639 HD11 LEU 80 1HD1 LEU 80 -28.368 26.392 -16.649 640 HD12 LEU 80 2HD1 LEU 80 -30.063 26.869 -16.569 641 HD13 LEU 80 3HD1 LEU 80 -29.582 25.243 -16.083 642 HD21 LEU 80 3HD2 LEU 80 -27.946 26.256 -12.936 643 HD22 LEU 80 1HD2 LEU 80 -27.109 25.984 -14.464 644 HD23 LEU 80 2HD2 LEU 80 -28.387 24.882 -13.949 645 H GLU 81 H GLU 81 -30.065 31.133 -16.089 646 HA GLU 81 HA GLU 81 -31.938 29.675 -17.776 647 HB2 GLU 81 1HB GLU 81 -33.330 30.855 -16.155 648 HB3 GLU 81 2HB GLU 81 -32.492 32.361 -16.497 649 HG2 GLU 81 1HG GLU 81 -33.374 32.370 -18.748 650 HG3 GLU 81 2HG GLU 81 -34.165 30.822 -18.459 651 H GLY 82 H GLY 82 -31.252 29.856 -19.769 652 HA2 GLY 82 1HA GLY 82 -30.489 30.866 -21.718 653 HA3 GLY 82 2HA GLY 82 -30.259 32.359 -20.820 654 H TYR 83 H TYR 83 -28.822 30.290 -18.879 655 HA TYR 83 HA TYR 83 -26.257 30.285 -20.322 656 HB2 TYR 83 1HB TYR 83 -26.702 30.887 -17.384 657 HB3 TYR 83 2HB TYR 83 -25.132 30.766 -18.174 658 HD1 TYR 83 HD1 TYR 83 -24.372 32.515 -19.697 659 HD2 TYR 83 HD2 TYR 83 -28.096 32.838 -17.671 660 HE1 TYR 83 HE1 TYR 83 -24.464 34.906 -20.257 661 HE2 TYR 83 HE2 TYR 83 -28.198 35.231 -18.223 662 HH TYR 83 HH TYR 83 -26.819 37.034 -18.875 663 H HIS 84 H HIS 84 -24.726 28.659 -19.510 664 HA HIS 84 HA HIS 84 -26.023 26.387 -18.140 665 HB2 HIS 84 1HB HIS 84 -24.083 26.307 -20.455 666 HB3 HIS 84 2HB HIS 84 -24.417 24.914 -19.439 667 HD1 HIS 84 HD1 HIS 84 -25.429 23.552 -21.388 668 HD2 HIS 84 HD2 HIS 84 -27.368 27.147 -20.615 669 HE1 HIS 84 HE1 HIS 84 -27.509 23.574 -22.836 670 HA PRO 85 HA PRO 85 -22.556 26.654 -15.395 671 HB2 PRO 85 1HB PRO 85 -22.502 24.091 -14.488 672 HB3 PRO 85 2HB PRO 85 -23.688 25.283 -13.946 673 HG2 PRO 85 1HG PRO 85 -23.981 23.097 -15.959 674 HG3 PRO 85 2HG PRO 85 -25.133 23.657 -14.734 675 HD2 PRO 85 1HD PRO 85 -25.295 24.346 -17.363 676 HD3 PRO 85 2HD PRO 85 -25.881 25.385 -16.050 677 H LYS 86 H LYS 86 -20.400 26.304 -15.457 678 HA LYS 86 HA LYS 86 -19.302 24.231 -17.182 679 HB2 LYS 86 1HB LYS 86 -19.552 26.054 -18.716 680 HB3 LYS 86 2HB LYS 86 -18.892 27.197 -17.557 681 HG2 LYS 86 1HG LYS 86 -16.710 26.099 -17.733 682 HG3 LYS 86 2HG LYS 86 -17.389 24.976 -18.913 683 HD2 LYS 86 1HD LYS 86 -17.808 26.753 -20.461 684 HD3 LYS 86 2HD LYS 86 -17.375 27.968 -19.256 685 HE2 LYS 86 1HE LYS 86 -15.543 27.696 -20.783 686 HE3 LYS 86 2HE LYS 86 -15.091 27.038 -19.214 687 HZ1 LYS 86 3HZ LYS 86 -14.380 25.558 -20.951 688 HZ2 LYS 86 1HZ LYS 86 -15.945 25.493 -21.597 689 HZ3 LYS 86 2HZ LYS 86 -15.629 24.809 -20.077 690 H LEU 87 H LEU 87 -17.429 23.424 -16.381 691 HA LEU 87 HA LEU 87 -16.528 24.321 -13.825 692 HB2 LEU 87 1HB LEU 87 -15.247 22.355 -15.727 693 HB3 LEU 87 2HB LEU 87 -14.732 22.638 -14.080 694 HG LEU 87 HG LEU 87 -15.933 20.692 -13.882 695 HD11 LEU 87 1HD1 LEU 87 -18.050 21.187 -12.777 696 HD12 LEU 87 2HD1 LEU 87 -18.011 22.824 -13.435 697 HD13 LEU 87 3HD1 LEU 87 -16.781 22.307 -12.281 698 HD21 LEU 87 3HD2 LEU 87 -17.974 21.778 -15.808 699 HD22 LEU 87 1HD2 LEU 87 -18.011 20.187 -15.050 700 HD23 LEU 87 2HD2 LEU 87 -16.716 20.597 -16.178 701 H VAL 88 H VAL 88 -14.967 25.696 -13.339 702 HA VAL 88 HA VAL 88 -13.077 26.516 -15.445 703 HB VAL 88 HB VAL 88 -13.101 28.804 -14.557 704 HG11 VAL 88 1HG1 VAL 88 -14.554 28.287 -16.432 705 HG12 VAL 88 2HG1 VAL 88 -15.299 29.490 -15.378 706 HG13 VAL 88 3HG1 VAL 88 -15.839 27.813 -15.319 707 HG21 VAL 88 3HG2 VAL 88 -13.741 28.350 -12.266 708 HG22 VAL 88 1HG2 VAL 88 -15.341 27.826 -12.793 709 HG23 VAL 88 2HG2 VAL 88 -14.857 29.510 -12.989 710 H VAL 89 H VAL 89 -10.993 27.074 -14.714 711 HA VAL 89 HA VAL 89 -10.410 26.191 -11.991 712 HB VAL 89 HB VAL 89 -9.010 25.097 -13.592 713 HG11 VAL 89 1HG1 VAL 89 -8.293 27.835 -14.634 714 HG12 VAL 89 2HG1 VAL 89 -9.206 26.582 -15.479 715 HG13 VAL 89 3HG1 VAL 89 -7.500 26.332 -15.107 716 HG21 VAL 89 3HG2 VAL 89 -6.765 25.789 -12.868 717 HG22 VAL 89 1HG2 VAL 89 -7.906 25.716 -11.525 718 HG23 VAL 89 2HG2 VAL 89 -7.447 27.277 -12.208 719 H ASN 90 H ASN 90 -10.452 27.698 -10.510 720 HA ASN 90 HA ASN 90 -9.703 30.454 -11.230 721 HB2 ASN 90 1HB ASN 90 -11.650 29.358 -9.214 722 HB3 ASN 90 2HB ASN 90 -10.981 30.975 -9.030 723 HD21 ASN 90 2HD2 ASN 90 -13.722 30.076 -9.507 724 HD22 ASN 90 1HD2 ASN 90 -14.244 30.891 -10.935 725 H GLY 91 H GLY 91 -7.551 30.455 -10.808 726 HA2 GLY 91 1HA GLY 91 -5.659 30.610 -9.510 727 HA3 GLY 91 2HA GLY 91 -6.701 30.541 -8.094 728 H ARG 92 H ARG 92 -6.943 28.654 -7.000 729 HA ARG 92 HA ARG 92 -5.442 26.342 -8.045 730 HB2 ARG 92 1HB ARG 92 -5.737 27.281 -5.189 731 HB3 ARG 92 2HB ARG 92 -5.014 25.748 -5.652 732 HG2 ARG 92 1HG ARG 92 -3.999 28.485 -6.387 733 HG3 ARG 92 2HG ARG 92 -3.313 27.404 -5.173 734 HD2 ARG 92 1HD ARG 92 -3.443 26.978 -8.151 735 HD3 ARG 92 2HD ARG 92 -2.002 27.217 -7.162 736 HE ARG 92 HE ARG 92 -3.226 24.985 -6.123 737 HH11 ARG 92 1HH1 ARG 92 -1.864 25.926 -9.221 738 HH12 ARG 92 2HH1 ARG 92 -1.547 24.283 -9.705 739 HH21 ARG 92 1HH2 ARG 92 -2.826 22.834 -6.791 740 HH22 ARG 92 2HH2 ARG 92 -2.107 22.541 -8.349 741 H SER 93 H SER 93 -8.474 27.350 -7.658 742 HA SER 93 HA SER 93 -9.439 24.715 -6.753 743 HB2 SER 93 1HB SER 93 -9.855 26.457 -5.044 744 HB3 SER 93 2HB SER 93 -10.747 27.398 -6.237 745 HG SER 93 HG SER 93 -12.239 25.661 -6.380 746 H ILE 94 H ILE 94 -11.305 23.907 -7.772 747 HA ILE 94 HA ILE 94 -11.855 25.074 -10.397 748 HB ILE 94 HB ILE 94 -12.783 22.438 -9.230 749 HG12 ILE 94 1HG1 ILE 94 -10.584 22.963 -11.242 750 HG13 ILE 94 2HG1 ILE 94 -10.304 22.667 -9.530 751 HG21 ILE 94 1HG2 ILE 94 -14.266 23.240 -10.981 752 HG22 ILE 94 2HG2 ILE 94 -13.330 21.862 -11.563 753 HG23 ILE 94 3HG2 ILE 94 -12.890 23.498 -12.056 754 HD11 ILE 94 3HD1 ILE 94 -11.322 20.445 -9.773 755 HD12 ILE 94 1HD1 ILE 94 -9.907 20.664 -10.806 756 HD13 ILE 94 2HD1 ILE 94 -11.530 20.749 -11.499 757 H ASP 95 H ASP 95 -13.880 25.829 -10.975 758 HA ASP 95 HA ASP 95 -15.930 25.931 -8.879 759 HB2 ASP 95 1HB ASP 95 -14.370 28.057 -9.121 760 HB3 ASP 95 2HB ASP 95 -15.402 28.386 -10.501 761 H ILE 96 H ILE 96 -17.909 27.156 -9.928 762 HA ILE 96 HA ILE 96 -18.296 26.000 -12.612 763 HB ILE 96 HB ILE 96 -20.369 26.256 -10.431 764 HG12 ILE 96 1HG1 ILE 96 -19.106 23.757 -11.570 765 HG13 ILE 96 2HG1 ILE 96 -18.591 24.517 -10.067 766 HG21 ILE 96 1HG2 ILE 96 -21.311 26.489 -12.675 767 HG22 ILE 96 2HG2 ILE 96 -21.801 24.965 -11.936 768 HG23 ILE 96 3HG2 ILE 96 -20.534 24.982 -13.164 769 HD11 ILE 96 3HD1 ILE 96 -20.803 24.151 -9.128 770 HD12 ILE 96 1HD1 ILE 96 -20.060 22.642 -9.654 771 HD13 ILE 96 2HD1 ILE 96 -21.321 23.392 -10.635 772 H GLU 97 H GLU 97 -18.056 27.742 -13.854 773 HA GLU 97 HA GLU 97 -19.552 30.186 -13.240 774 HB2 GLU 97 1HB GLU 97 -17.376 29.528 -15.223 775 HB3 GLU 97 2HB GLU 97 -18.325 31.002 -15.354 776 HG2 GLU 97 1HG GLU 97 -16.682 30.204 -12.965 777 HG3 GLU 97 2HG GLU 97 -16.185 31.349 -14.211 778 H TYR 98 H TYR 98 -20.085 31.117 -15.763 779 HA TYR 98 HA TYR 98 -21.883 29.080 -16.857 780 HB2 TYR 98 1HB TYR 98 -22.612 31.771 -15.770 781 HB3 TYR 98 2HB TYR 98 -23.574 31.053 -17.063 782 HD1 TYR 98 HD1 TYR 98 -22.482 30.687 -13.567 783 HD2 TYR 98 HD2 TYR 98 -25.027 29.202 -16.646 784 HE1 TYR 98 HE1 TYR 98 -23.703 29.355 -11.900 785 HE2 TYR 98 HE2 TYR 98 -26.252 27.867 -14.975 786 HH TYR 98 HH TYR 98 -25.902 28.321 -11.630 787 H TYR 99 H TYR 99 -22.206 29.130 -18.996 788 HA TYR 99 HA TYR 99 -21.158 31.450 -20.464 789 HB2 TYR 99 1HB TYR 99 -20.600 29.950 -22.342 790 HB3 TYR 99 2HB TYR 99 -19.704 29.535 -20.888 791 HD1 TYR 99 HD1 TYR 99 -22.463 28.505 -23.112 792 HD2 TYR 99 HD2 TYR 99 -19.953 27.407 -19.850 793 HE1 TYR 99 HE1 TYR 99 -23.213 26.173 -23.335 794 HE2 TYR 99 HE2 TYR 99 -20.701 25.078 -20.055 795 HH TYR 99 HH TYR 99 -22.510 23.790 -20.943 796 H GLU 100 H GLU 100 -22.320 32.021 -22.364 797 HA GLU 100 HA GLU 100 -25.111 31.939 -21.972 798 HB2 GLU 100 1HB GLU 100 -23.532 32.805 -24.400 799 HB3 GLU 100 2HB GLU 100 -25.229 33.163 -24.106 800 HG2 GLU 100 1HG GLU 100 -24.603 34.423 -22.099 801 HG3 GLU 100 2HG GLU 100 -22.905 34.084 -22.429 802 H CYS 101 H CYS 101 -26.557 30.498 -22.562 803 HA CYS 101 HA CYS 101 -26.187 28.113 -23.863 804 HB2 CYS 101 1HB CYS 101 -28.274 28.828 -22.696 805 HB3 CYS 101 2HB CYS 101 -28.667 29.837 -24.077 806 HA PRO 102 HA PRO 102 -25.025 29.414 -27.947 807 HB2 PRO 102 1HB PRO 102 -25.020 26.929 -29.075 808 HB3 PRO 102 2HB PRO 102 -23.718 27.548 -28.053 809 HG2 PRO 102 1HG PRO 102 -25.983 25.727 -27.341 810 HG3 PRO 102 2HG PRO 102 -24.280 25.634 -26.863 811 HD2 PRO 102 1HD PRO 102 -26.190 26.592 -25.221 812 HD3 PRO 102 2HD PRO 102 -24.530 27.222 -25.211 813 H VAL 103 H VAL 103 -28.071 28.547 -27.081 814 HA VAL 103 HA VAL 103 -29.109 28.082 -29.749 815 HB VAL 103 HB VAL 103 -30.064 27.002 -27.640 816 HG11 VAL 103 1HG1 VAL 103 -30.165 28.953 -26.214 817 HG12 VAL 103 2HG1 VAL 103 -31.784 28.291 -26.444 818 HG13 VAL 103 3HG1 VAL 103 -31.290 29.737 -27.323 819 HG21 VAL 103 3HG2 VAL 103 -31.946 28.459 -29.491 820 HG22 VAL 103 1HG2 VAL 103 -32.364 27.077 -28.478 821 HG23 VAL 103 2HG2 VAL 103 -31.195 26.890 -29.786 822 H LYS 104 H LYS 104 -28.434 30.739 -27.700 823 HA LYS 104 HA LYS 104 -30.509 32.487 -28.530 824 HB2 LYS 104 1HB LYS 104 -27.786 33.154 -27.399 825 HB3 LYS 104 2HB LYS 104 -29.119 34.287 -27.565 826 HG2 LYS 104 1HG LYS 104 -30.437 32.658 -26.089 827 HG3 LYS 104 2HG LYS 104 -28.867 31.945 -25.713 828 HD2 LYS 104 1HD LYS 104 -29.667 34.825 -25.284 829 HD3 LYS 104 2HD LYS 104 -29.498 33.595 -24.031 830 HE2 LYS 104 1HE LYS 104 -27.126 33.404 -24.513 831 HE3 LYS 104 2HE LYS 104 -27.278 34.572 -25.827 832 HZ1 LYS 104 3HZ LYS 104 -26.409 35.603 -23.822 833 HZ2 LYS 104 1HZ LYS 104 -27.786 35.127 -22.946 834 HZ3 LYS 104 2HZ LYS 104 -27.927 36.249 -24.211 835 H ARG 105 H ARG 105 -27.091 32.243 -29.523 836 HA ARG 105 HA ARG 105 -27.839 33.479 -32.084 837 HB2 ARG 105 1HB ARG 105 -25.648 34.348 -30.221 838 HB3 ARG 105 2HB ARG 105 -25.539 34.650 -31.949 839 HG2 ARG 105 1HG ARG 105 -27.646 35.897 -31.853 840 HG3 ARG 105 2HG ARG 105 -27.716 35.615 -30.113 841 HD2 ARG 105 1HD ARG 105 -25.726 36.881 -29.750 842 HD3 ARG 105 2HD ARG 105 -25.419 36.991 -31.482 843 HE ARG 105 HE ARG 105 -27.790 38.203 -31.305 844 HH11 ARG 105 1HH1 ARG 105 -24.902 38.547 -29.354 845 HH12 ARG 105 2HH1 ARG 105 -25.175 40.223 -29.009 846 HH21 ARG 105 1HH2 ARG 105 -28.146 40.428 -30.871 847 HH22 ARG 105 2HH2 ARG 105 -27.012 41.302 -29.877 848 H LYS 106 H LYS 106 -27.322 30.730 -31.318 849 HA LYS 106 HA LYS 106 -26.183 28.879 -31.975 850 HB2 LYS 106 1HB LYS 106 -25.496 30.718 -34.271 851 HB3 LYS 106 2HB LYS 106 -25.138 28.995 -34.256 852 HG2 LYS 106 1HG LYS 106 -27.431 28.424 -34.230 853 HG3 LYS 106 2HG LYS 106 -27.912 30.089 -33.896 854 HD2 LYS 106 1HD LYS 106 -27.139 30.788 -36.071 855 HD3 LYS 106 2HD LYS 106 -26.526 29.170 -36.406 856 HE2 LYS 106 1HE LYS 106 -29.420 29.836 -35.896 857 HE3 LYS 106 2HE LYS 106 -28.703 29.666 -37.496 858 HZ1 LYS 106 3HZ LYS 106 -28.847 27.536 -35.427 859 HZ2 LYS 106 1HZ LYS 106 -28.138 27.377 -36.958 860 HZ3 LYS 106 2HZ LYS 106 -29.808 27.638 -36.821 Start of MODEL 15 1 HA MET 1 HA MET 1 -36.170 -21.217 -5.974 2 HB2 MET 1 1HB MET 1 -36.217 -19.556 -3.443 3 HB3 MET 1 2HB MET 1 -35.901 -18.907 -5.045 4 HG2 MET 1 1HG MET 1 -38.438 -20.256 -4.157 5 HG3 MET 1 2HG MET 1 -38.200 -18.521 -4.354 6 HE1 MET 1 2HE MET 1 -37.786 -18.130 -8.201 7 HE2 MET 1 3HE MET 1 -36.521 -18.251 -6.978 8 HE3 MET 1 1HE MET 1 -37.968 -17.297 -6.658 9 H GLU 2 H GLU 2 -34.442 -20.175 -3.065 10 HA GLU 2 HA GLU 2 -31.934 -21.171 -4.189 11 HB2 GLU 2 1HB GLU 2 -32.540 -18.308 -3.433 12 HB3 GLU 2 2HB GLU 2 -30.895 -18.924 -3.552 13 HG2 GLU 2 1HG GLU 2 -31.065 -19.273 -5.854 14 HG3 GLU 2 2HG GLU 2 -32.825 -19.188 -5.827 15 HA PRO 3 HA PRO 3 -31.213 -22.291 0.009 16 HB2 PRO 3 1HB PRO 3 -28.527 -22.428 0.106 17 HB3 PRO 3 2HB PRO 3 -29.491 -23.568 -0.843 18 HG2 PRO 3 1HG PRO 3 -27.997 -21.137 -1.752 19 HG3 PRO 3 2HG PRO 3 -28.075 -22.743 -2.499 20 HD2 PRO 3 1HD PRO 3 -29.564 -20.622 -3.346 21 HD3 PRO 3 2HD PRO 3 -30.091 -22.308 -3.511 22 H ILE 4 H ILE 4 -29.752 -21.727 1.951 23 HA ILE 4 HA ILE 4 -30.233 -18.950 2.524 24 HB ILE 4 HB ILE 4 -30.432 -21.133 4.025 25 HG12 ILE 4 1HG1 ILE 4 -31.095 -18.746 4.579 26 HG13 ILE 4 2HG1 ILE 4 -30.687 -19.778 5.940 27 HG21 ILE 4 1HG2 ILE 4 -28.606 -21.286 5.658 28 HG22 ILE 4 2HG2 ILE 4 -27.662 -20.164 4.679 29 HG23 ILE 4 3HG2 ILE 4 -28.109 -21.741 4.028 30 HD11 ILE 4 3HD1 ILE 4 -28.498 -18.725 6.085 31 HD12 ILE 4 1HD1 ILE 4 -29.798 -17.542 6.227 32 HD13 ILE 4 2HD1 ILE 4 -28.900 -17.690 4.714 33 H GLY 5 H GLY 5 -27.857 -20.346 0.862 34 HA2 GLY 5 1HA GLY 5 -25.453 -19.358 1.924 35 HA3 GLY 5 2HA GLY 5 -25.744 -19.718 0.228 36 H ARG 6 H ARG 6 -28.056 -17.743 0.349 37 HA ARG 6 HA ARG 6 -26.580 -15.405 -0.405 38 HB2 ARG 6 1HB ARG 6 -29.543 -15.880 -0.044 39 HB3 ARG 6 2HB ARG 6 -28.858 -14.368 -0.619 40 HG2 ARG 6 1HG ARG 6 -27.900 -15.544 -2.543 41 HG3 ARG 6 2HG ARG 6 -28.631 -17.046 -1.969 42 HD2 ARG 6 1HD ARG 6 -29.966 -15.934 -3.728 43 HD3 ARG 6 2HD ARG 6 -30.839 -16.120 -2.208 44 HE ARG 6 HE ARG 6 -29.995 -13.673 -1.873 45 HH11 ARG 6 1HH1 ARG 6 -31.113 -15.118 -4.867 46 HH12 ARG 6 2HH1 ARG 6 -31.723 -13.614 -5.501 47 HH21 ARG 6 1HH2 ARG 6 -30.805 -11.719 -2.684 48 HH22 ARG 6 2HH2 ARG 6 -31.574 -11.680 -4.248 49 H SER 7 H SER 7 -25.441 -15.092 1.625 50 HA SER 7 HA SER 7 -27.011 -14.298 3.917 51 HB2 SER 7 1HB SER 7 -24.016 -14.266 3.502 52 HB3 SER 7 2HB SER 7 -24.850 -14.027 5.038 53 HG SER 7 HG SER 7 -25.576 -16.313 3.680 54 H LEU 8 H LEU 8 -28.091 -12.456 3.370 55 HA LEU 8 HA LEU 8 -26.899 -10.220 2.085 56 HB2 LEU 8 1HB LEU 8 -29.328 -10.696 2.097 57 HB3 LEU 8 2HB LEU 8 -29.375 -10.343 3.812 58 HG LEU 8 HG LEU 8 -28.697 -8.013 3.332 59 HD11 LEU 8 1HD1 LEU 8 -27.501 -8.437 1.235 60 HD12 LEU 8 2HD1 LEU 8 -28.732 -7.187 1.045 61 HD13 LEU 8 3HD1 LEU 8 -29.030 -8.819 0.444 62 HD21 LEU 8 3HD2 LEU 8 -30.833 -7.300 2.396 63 HD22 LEU 8 1HD2 LEU 8 -31.062 -8.611 3.555 64 HD23 LEU 8 2HD2 LEU 8 -31.141 -8.939 1.823 65 H GLN 9 H GLN 9 -27.140 -11.309 5.357 66 HA GLN 9 HA GLN 9 -26.193 -8.806 6.483 67 HB2 GLN 9 1HB GLN 9 -27.849 -10.431 7.572 68 HB3 GLN 9 2HB GLN 9 -26.462 -11.461 7.889 69 HG2 GLN 9 1HG GLN 9 -25.438 -9.661 9.194 70 HG3 GLN 9 2HG GLN 9 -26.854 -8.654 8.891 71 HE21 GLN 9 2HE2 GLN 9 -28.806 -9.161 9.898 72 HE22 GLN 9 1HE2 GLN 9 -28.884 -10.220 11.269 73 H GLY 10 H GLY 10 -24.672 -10.722 4.579 74 HA2 GLY 10 1HA GLY 10 -22.428 -11.660 6.092 75 HA3 GLY 10 2HA GLY 10 -22.552 -11.599 4.341 76 H VAL 11 H VAL 11 -23.303 -8.623 4.827 77 HA VAL 11 HA VAL 11 -20.592 -7.627 4.615 78 HB VAL 11 HB VAL 11 -23.175 -6.054 4.641 79 HG11 VAL 11 1HG1 VAL 11 -21.859 -4.304 3.557 80 HG12 VAL 11 2HG1 VAL 11 -20.416 -5.310 3.673 81 HG13 VAL 11 3HG1 VAL 11 -21.194 -4.713 5.139 82 HG21 VAL 11 3HG2 VAL 11 -22.965 -6.022 2.184 83 HG22 VAL 11 1HG2 VAL 11 -23.220 -7.649 2.817 84 HG23 VAL 11 2HG2 VAL 11 -21.610 -7.146 2.305 85 H THR 12 H THR 12 -19.597 -7.726 6.556 86 HA THR 12 HA THR 12 -20.869 -7.245 9.036 87 HB THR 12 HB THR 12 -18.415 -7.114 9.840 88 HG1 THR 12 HG1 THR 12 -16.880 -7.759 8.342 89 HG21 THR 12 3HG2 THR 12 -19.447 -9.576 8.423 90 HG22 THR 12 1HG2 THR 12 -19.812 -9.102 10.084 91 HG23 THR 12 2HG2 THR 12 -18.167 -9.555 9.636 92 H GLY 13 H GLY 13 -18.372 -5.336 7.327 93 HA2 GLY 13 1HA GLY 13 -19.637 -2.906 8.335 94 HA3 GLY 13 2HA GLY 13 -17.983 -3.215 8.841 95 H ARG 14 H ARG 14 -19.688 -1.439 6.808 96 HA ARG 14 HA ARG 14 -17.383 -0.885 5.202 97 HB2 ARG 14 1HB ARG 14 -18.572 -2.642 3.894 98 HB3 ARG 14 2HB ARG 14 -19.988 -1.600 3.835 99 HG2 ARG 14 1HG ARG 14 -18.915 -0.032 2.476 100 HG3 ARG 14 2HG ARG 14 -17.322 -0.706 2.814 101 HD2 ARG 14 1HD ARG 14 -17.911 -2.738 1.598 102 HD3 ARG 14 2HD ARG 14 -19.518 -2.090 1.277 103 HE ARG 14 HE ARG 14 -18.404 -0.341 -0.051 104 HH11 ARG 14 1HH1 ARG 14 -16.684 -3.319 0.587 105 HH12 ARG 14 2HH1 ARG 14 -15.650 -3.176 -0.801 106 HH21 ARG 14 1HH2 ARG 14 -17.087 -0.151 -1.881 107 HH22 ARG 14 2HH2 ARG 14 -15.902 -1.377 -2.226 108 HA PRO 15 HA PRO 15 -19.501 2.695 7.124 109 HB2 PRO 15 1HB PRO 15 -17.338 4.337 6.396 110 HB3 PRO 15 2HB PRO 15 -17.582 3.544 7.956 111 HG2 PRO 15 1HG PRO 15 -15.932 2.680 5.624 112 HG3 PRO 15 2HG PRO 15 -15.604 2.511 7.360 113 HD2 PRO 15 1HD PRO 15 -16.406 0.418 5.929 114 HD3 PRO 15 2HD PRO 15 -17.033 0.680 7.571 115 H ASP 16 H ASP 16 -20.806 4.158 6.260 116 HA ASP 16 HA ASP 16 -21.189 4.374 3.477 117 HB2 ASP 16 1HB ASP 16 -22.832 6.082 3.991 118 HB3 ASP 16 2HB ASP 16 -22.975 4.776 5.162 119 H PHE 17 H PHE 17 -19.129 6.048 5.676 120 HA PHE 17 HA PHE 17 -18.599 8.420 4.364 121 HB2 PHE 17 1HB PHE 17 -17.602 7.909 6.516 122 HB3 PHE 17 2HB PHE 17 -16.686 6.579 5.816 123 HD1 PHE 17 HD1 PHE 17 -17.026 10.246 5.915 124 HD2 PHE 17 HD2 PHE 17 -14.624 6.944 4.728 125 HE1 PHE 17 HE1 PHE 17 -15.154 11.774 5.463 126 HE2 PHE 17 HE2 PHE 17 -12.745 8.465 4.273 127 HZ PHE 17 HZ PHE 17 -13.011 10.887 4.641 128 H GLN 18 H GLN 18 -16.827 5.340 3.914 129 HA GLN 18 HA GLN 18 -15.440 6.362 1.642 130 HB2 GLN 18 1HB GLN 18 -14.520 4.146 1.376 131 HB3 GLN 18 2HB GLN 18 -14.483 4.593 3.070 132 HG2 GLN 18 1HG GLN 18 -15.813 2.911 3.673 133 HG3 GLN 18 2HG GLN 18 -16.896 3.148 2.304 134 HE21 GLN 18 2HE2 GLN 18 -14.899 2.846 0.259 135 HE22 GLN 18 1HE2 GLN 18 -14.448 1.177 0.234 136 H LYS 19 H LYS 19 -18.419 4.583 2.100 137 HA LYS 19 HA LYS 19 -18.714 3.676 -0.553 138 HB2 LYS 19 1HB LYS 19 -20.814 4.297 1.525 139 HB3 LYS 19 2HB LYS 19 -21.151 3.527 -0.017 140 HG2 LYS 19 1HG LYS 19 -19.569 1.704 0.634 141 HG3 LYS 19 2HG LYS 19 -19.474 2.441 2.234 142 HD2 LYS 19 1HD LYS 19 -21.957 1.361 0.896 143 HD3 LYS 19 2HD LYS 19 -21.085 0.621 2.239 144 HE2 LYS 19 1HE LYS 19 -21.576 2.654 3.590 145 HE3 LYS 19 2HE LYS 19 -22.553 3.251 2.251 146 HZ1 LYS 19 3HZ LYS 19 -23.048 0.818 3.879 147 HZ2 LYS 19 1HZ LYS 19 -23.915 1.204 2.471 148 HZ3 LYS 19 2HZ LYS 19 -23.989 2.227 3.821 149 H ARG 20 H ARG 20 -19.855 6.635 1.056 150 HA ARG 20 HA ARG 20 -21.043 7.683 -1.314 151 HB2 ARG 20 1HB ARG 20 -21.366 9.726 -0.102 152 HB3 ARG 20 2HB ARG 20 -21.691 8.391 0.993 153 HG2 ARG 20 1HG ARG 20 -19.528 8.686 2.043 154 HG3 ARG 20 2HG ARG 20 -19.126 9.967 0.896 155 HD2 ARG 20 1HD ARG 20 -19.821 11.005 2.925 156 HD3 ARG 20 2HD ARG 20 -21.107 11.228 1.741 157 HE ARG 20 HE ARG 20 -21.338 8.985 3.597 158 HH11 ARG 20 1HH1 ARG 20 -22.351 12.203 2.647 159 HH12 ARG 20 2HH1 ARG 20 -23.797 12.162 3.621 160 HH21 ARG 20 1HH2 ARG 20 -23.209 8.952 4.906 161 HH22 ARG 20 2HH2 ARG 20 -24.284 10.324 4.882 162 H LEU 21 H LEU 21 -17.887 7.984 0.212 163 HA LEU 21 HA LEU 21 -16.889 10.102 -1.345 164 HB2 LEU 21 1HB LEU 21 -15.737 9.542 0.644 165 HB3 LEU 21 2HB LEU 21 -15.583 7.860 0.179 166 HG LEU 21 HG LEU 21 -14.005 8.539 -1.612 167 HD11 LEU 21 1HD1 LEU 21 -14.234 11.252 -0.307 168 HD12 LEU 21 2HD1 LEU 21 -14.713 10.829 -1.953 169 HD13 LEU 21 3HD1 LEU 21 -13.010 10.792 -1.491 170 HD21 LEU 21 3HD2 LEU 21 -13.196 7.739 0.536 171 HD22 LEU 21 1HD2 LEU 21 -13.255 9.378 1.185 172 HD23 LEU 21 2HD2 LEU 21 -12.125 8.982 -0.112 173 H GLU 22 H GLU 22 -16.496 6.586 -1.723 174 HA GLU 22 HA GLU 22 -15.110 6.720 -4.177 175 HB2 GLU 22 1HB GLU 22 -16.789 4.513 -2.982 176 HB3 GLU 22 2HB GLU 22 -15.810 4.325 -4.427 177 HG2 GLU 22 1HG GLU 22 -14.732 5.087 -1.723 178 HG3 GLU 22 2HG GLU 22 -14.747 3.449 -2.376 179 H GLN 23 H GLN 23 -18.506 6.612 -3.343 180 HA GLN 23 HA GLN 23 -19.577 6.047 -5.877 181 HB2 GLN 23 1HB GLN 23 -20.839 5.958 -3.747 182 HB3 GLN 23 2HB GLN 23 -20.795 7.709 -3.669 183 HG2 GLN 23 1HG GLN 23 -22.073 7.832 -5.747 184 HG3 GLN 23 2HG GLN 23 -22.145 6.070 -5.801 185 HE21 GLN 23 2HE2 GLN 23 -22.414 5.888 -2.888 186 HE22 GLN 23 1HE2 GLN 23 -24.051 6.326 -2.539 187 H MET 24 H MET 24 -19.330 9.187 -4.214 188 HA MET 24 HA MET 24 -20.217 10.683 -6.417 189 HB2 MET 24 1HB MET 24 -19.435 12.647 -5.243 190 HB3 MET 24 2HB MET 24 -20.241 11.558 -4.128 191 HG2 MET 24 1HG MET 24 -18.041 10.772 -3.367 192 HG3 MET 24 2HG MET 24 -17.276 11.950 -4.432 193 HE1 MET 24 3HE MET 24 -18.708 15.317 -2.883 194 HE2 MET 24 1HE MET 24 -19.496 14.332 -4.117 195 HE3 MET 24 2HE MET 24 -17.759 14.627 -4.199 196 H LYS 25 H LYS 25 -16.964 9.816 -5.368 197 HA LYS 25 HA LYS 25 -15.537 11.293 -7.289 198 HB2 LYS 25 1HB LYS 25 -14.509 10.220 -5.311 199 HB3 LYS 25 2HB LYS 25 -14.812 8.642 -6.020 200 HG2 LYS 25 1HG LYS 25 -12.537 9.141 -6.394 201 HG3 LYS 25 2HG LYS 25 -13.358 9.335 -7.942 202 HD2 LYS 25 1HD LYS 25 -13.440 11.763 -7.586 203 HD3 LYS 25 2HD LYS 25 -12.594 11.558 -6.049 204 HE2 LYS 25 1HE LYS 25 -10.709 10.527 -7.277 205 HE3 LYS 25 2HE LYS 25 -11.548 10.863 -8.786 206 HZ1 LYS 25 3HZ LYS 25 -9.948 12.559 -8.401 207 HZ2 LYS 25 1HZ LYS 25 -10.516 12.847 -6.832 208 HZ3 LYS 25 2HZ LYS 25 -11.475 13.241 -8.173 209 H GLU 26 H GLU 26 -16.886 8.037 -7.331 210 HA GLU 26 HA GLU 26 -15.893 7.173 -9.804 211 HB2 GLU 26 1HB GLU 26 -17.081 5.818 -7.991 212 HB3 GLU 26 2HB GLU 26 -18.586 6.416 -8.673 213 HG2 GLU 26 1HG GLU 26 -18.351 4.367 -9.691 214 HG3 GLU 26 2HG GLU 26 -17.685 5.470 -10.895 215 H LYS 27 H LYS 27 -18.898 8.827 -8.952 216 HA LYS 27 HA LYS 27 -20.060 8.740 -11.521 217 HB2 LYS 27 1HB LYS 27 -20.554 10.550 -9.157 218 HB3 LYS 27 2HB LYS 27 -21.502 10.632 -10.633 219 HG2 LYS 27 1HG LYS 27 -22.041 8.189 -10.276 220 HG3 LYS 27 2HG LYS 27 -21.313 8.359 -8.676 221 HD2 LYS 27 1HD LYS 27 -23.701 8.635 -8.481 222 HD3 LYS 27 2HD LYS 27 -22.924 10.194 -8.195 223 HE2 LYS 27 1HE LYS 27 -23.433 10.895 -10.460 224 HE3 LYS 27 2HE LYS 27 -24.132 9.318 -10.817 225 HZ1 LYS 27 3HZ LYS 27 -25.189 11.376 -8.951 226 HZ2 LYS 27 1HZ LYS 27 -25.779 9.784 -9.018 227 HZ3 LYS 27 2HZ LYS 27 -25.906 10.795 -10.372 228 H VAL 28 H VAL 28 -18.034 11.105 -9.899 229 HA VAL 28 HA VAL 28 -18.409 13.157 -11.836 230 HB VAL 28 HB VAL 28 -16.326 12.830 -9.666 231 HG11 VAL 28 1HG1 VAL 28 -15.830 15.214 -10.008 232 HG12 VAL 28 2HG1 VAL 28 -16.882 15.216 -11.423 233 HG13 VAL 28 3HG1 VAL 28 -15.414 14.238 -11.419 234 HG21 VAL 28 3HG2 VAL 28 -17.636 14.475 -8.468 235 HG22 VAL 28 1HG2 VAL 28 -18.661 13.108 -8.918 236 HG23 VAL 28 2HG2 VAL 28 -18.751 14.618 -9.828 237 H MET 29 H MET 29 -15.857 10.755 -11.241 238 HA MET 29 HA MET 29 -14.142 11.776 -13.295 239 HB2 MET 29 1HB MET 29 -14.148 9.045 -12.000 240 HB3 MET 29 2HB MET 29 -12.851 9.711 -12.981 241 HG2 MET 29 1HG MET 29 -13.793 10.788 -10.333 242 HG3 MET 29 2HG MET 29 -12.347 9.817 -10.600 243 HE1 MET 29 3HE MET 29 -10.180 12.261 -12.801 244 HE2 MET 29 1HE MET 29 -11.337 11.066 -13.392 245 HE3 MET 29 2HE MET 29 -10.259 10.665 -12.054 246 H LYS 30 H LYS 30 -16.960 9.914 -13.352 247 HA LYS 30 HA LYS 30 -16.269 8.880 -16.010 248 HB2 LYS 30 1HB LYS 30 -17.825 7.757 -13.775 249 HB3 LYS 30 2HB LYS 30 -18.508 7.501 -15.377 250 HG2 LYS 30 1HG LYS 30 -17.012 5.669 -14.592 251 HG3 LYS 30 2HG LYS 30 -16.523 6.392 -16.124 252 HD2 LYS 30 1HD LYS 30 -14.502 6.328 -15.044 253 HD3 LYS 30 2HD LYS 30 -15.071 7.923 -14.549 254 HE2 LYS 30 1HE LYS 30 -14.321 6.980 -12.568 255 HE3 LYS 30 2HE LYS 30 -16.064 6.719 -12.518 256 HZ1 LYS 30 3HZ LYS 30 -14.963 4.729 -11.857 257 HZ2 LYS 30 1HZ LYS 30 -13.982 4.729 -13.242 258 HZ3 LYS 30 2HZ LYS 30 -15.650 4.452 -13.383 259 H ASP 31 H ASP 31 -17.599 11.515 -14.892 260 HA ASP 31 HA ASP 31 -19.895 11.596 -16.670 261 HB2 ASP 31 1HB ASP 31 -19.945 12.968 -14.636 262 HB3 ASP 31 2HB ASP 31 -18.501 13.822 -15.168 263 H GLN 32 H GLN 32 -19.896 12.332 -18.712 264 HA GLN 32 HA GLN 32 -17.490 12.247 -20.156 265 HB2 GLN 32 1HB GLN 32 -20.147 13.377 -21.035 266 HB3 GLN 32 2HB GLN 32 -18.825 12.902 -22.094 267 HG2 GLN 32 1HG GLN 32 -19.046 10.588 -21.273 268 HG3 GLN 32 2HG GLN 32 -20.433 11.091 -20.312 269 HE21 GLN 32 2HE2 GLN 32 -21.872 9.781 -21.348 270 HE22 GLN 32 1HE2 GLN 32 -22.380 10.036 -22.988 271 H ASP 33 H ASP 33 -19.371 14.966 -18.952 272 HA ASP 33 HA ASP 33 -17.981 16.961 -20.453 273 HB2 ASP 33 1HB ASP 33 -19.505 17.337 -17.869 274 HB3 ASP 33 2HB ASP 33 -19.112 18.576 -19.048 275 H VAL 34 H VAL 34 -17.867 15.805 -17.122 276 HA VAL 34 HA VAL 34 -15.940 17.506 -16.098 277 HB VAL 34 HB VAL 34 -16.502 14.625 -15.382 278 HG11 VAL 34 1HG1 VAL 34 -15.378 15.078 -13.267 279 HG12 VAL 34 2HG1 VAL 34 -14.931 16.686 -13.840 280 HG13 VAL 34 3HG1 VAL 34 -14.268 15.254 -14.627 281 HG21 VAL 34 3HG2 VAL 34 -17.395 17.232 -14.160 282 HG22 VAL 34 1HG2 VAL 34 -17.733 15.629 -13.511 283 HG23 VAL 34 2HG2 VAL 34 -18.395 16.102 -15.074 284 H GLN 35 H GLN 35 -15.373 14.241 -17.487 285 HA GLN 35 HA GLN 35 -12.561 14.442 -17.256 286 HB2 GLN 35 1HB GLN 35 -12.546 12.526 -18.916 287 HB3 GLN 35 2HB GLN 35 -13.365 12.262 -17.387 288 HG2 GLN 35 1HG GLN 35 -15.491 12.929 -18.674 289 HG3 GLN 35 2HG GLN 35 -14.521 12.615 -20.114 290 HE21 GLN 35 2HE2 GLN 35 -15.748 11.243 -17.159 291 HE22 GLN 35 1HE2 GLN 35 -15.680 9.589 -17.656 292 H ALA 36 H ALA 36 -14.752 15.450 -19.773 293 HA ALA 36 HA ALA 36 -12.834 15.971 -21.777 294 HB1 ALA 36 1HB ALA 36 -15.258 16.040 -22.191 295 HB2 ALA 36 2HB ALA 36 -14.462 17.527 -22.706 296 HB3 ALA 36 3HB ALA 36 -15.377 17.494 -21.198 297 H PHE 37 H PHE 37 -14.106 17.950 -19.150 298 HA PHE 37 HA PHE 37 -12.449 20.197 -19.591 299 HB2 PHE 37 1HB PHE 37 -14.438 20.437 -18.286 300 HB3 PHE 37 2HB PHE 37 -13.930 19.179 -17.167 301 HD1 PHE 37 HD1 PHE 37 -12.957 22.545 -18.403 302 HD2 PHE 37 HD2 PHE 37 -12.863 19.737 -15.216 303 HE1 PHE 37 HE1 PHE 37 -11.980 24.256 -16.934 304 HE2 PHE 37 HE2 PHE 37 -11.891 21.444 -13.736 305 HZ PHE 37 HZ PHE 37 -11.445 23.707 -14.593 306 H LEU 38 H LEU 38 -12.116 17.306 -17.596 307 HA LEU 38 HA LEU 38 -9.840 18.024 -16.165 308 HB2 LEU 38 1HB LEU 38 -11.292 15.571 -16.737 309 HB3 LEU 38 2HB LEU 38 -9.573 15.300 -16.538 310 HG LEU 38 HG LEU 38 -10.690 14.976 -14.426 311 HD11 LEU 38 1HD1 LEU 38 -9.145 17.563 -14.476 312 HD12 LEU 38 2HD1 LEU 38 -8.466 15.939 -14.348 313 HD13 LEU 38 3HD1 LEU 38 -9.461 16.585 -13.042 314 HD21 LEU 38 3HD2 LEU 38 -11.701 17.798 -14.746 315 HD22 LEU 38 1HD2 LEU 38 -11.889 16.794 -13.308 316 HD23 LEU 38 2HD2 LEU 38 -12.671 16.327 -14.820 317 H LYS 39 H LYS 39 -10.047 16.271 -19.270 318 HA LYS 39 HA LYS 39 -7.197 16.059 -19.440 319 HB2 LYS 39 1HB LYS 39 -7.591 15.288 -21.780 320 HB3 LYS 39 2HB LYS 39 -8.445 14.367 -20.556 321 HG2 LYS 39 1HG LYS 39 -10.517 15.444 -21.109 322 HG3 LYS 39 2HG LYS 39 -9.690 16.533 -22.226 323 HD2 LYS 39 1HD LYS 39 -9.191 14.779 -23.726 324 HD3 LYS 39 2HD LYS 39 -9.606 13.543 -22.539 325 HE2 LYS 39 1HE LYS 39 -11.597 15.504 -23.656 326 HE3 LYS 39 2HE LYS 39 -11.300 13.919 -24.369 327 HZ1 LYS 39 3HZ LYS 39 -13.201 13.891 -22.863 328 HZ2 LYS 39 1HZ LYS 39 -12.216 14.411 -21.586 329 HZ3 LYS 39 2HZ LYS 39 -11.960 12.889 -22.283 330 H GLU 40 H GLU 40 -9.517 18.430 -20.403 331 HA GLU 40 HA GLU 40 -7.859 19.843 -22.225 332 HB2 GLU 40 1HB GLU 40 -10.479 20.068 -21.321 333 HB3 GLU 40 2HB GLU 40 -9.701 21.507 -20.683 334 HG2 GLU 40 1HG GLU 40 -9.748 20.669 -23.575 335 HG3 GLU 40 2HG GLU 40 -10.754 21.914 -22.844 336 H ASN 41 H ASN 41 -8.329 19.979 -18.739 337 HA ASN 41 HA ASN 41 -6.238 22.055 -18.574 338 HB2 ASN 41 1HB ASN 41 -8.650 21.558 -16.827 339 HB3 ASN 41 2HB ASN 41 -7.328 22.627 -16.362 340 HD21 ASN 41 2HD2 ASN 41 -10.004 22.144 -18.515 341 HD22 ASN 41 1HD2 ASN 41 -10.064 23.764 -19.129 342 H GLU 42 H GLU 42 -5.849 19.126 -18.619 343 HA GLU 42 HA GLU 42 -5.359 18.236 -15.959 344 HB2 GLU 42 1HB GLU 42 -4.200 16.346 -16.958 345 HB3 GLU 42 2HB GLU 42 -5.714 16.652 -17.794 346 HG2 GLU 42 1HG GLU 42 -4.534 17.696 -19.622 347 HG3 GLU 42 2HG GLU 42 -3.000 17.516 -18.767 348 H GLU 43 H GLU 43 -3.701 20.311 -18.031 349 HA GLU 43 HA GLU 43 -1.044 19.998 -17.110 350 HB2 GLU 43 1HB GLU 43 -1.708 21.224 -19.179 351 HB3 GLU 43 2HB GLU 43 -2.439 22.468 -18.177 352 HG2 GLU 43 1HG GLU 43 -0.361 23.325 -18.830 353 HG3 GLU 43 2HG GLU 43 -0.148 22.803 -17.159 354 H VAL 44 H VAL 44 -3.882 21.549 -15.893 355 HA VAL 44 HA VAL 44 -2.327 23.040 -13.889 356 HB VAL 44 HB VAL 44 -5.213 23.461 -14.696 357 HG11 VAL 44 1HG1 VAL 44 -4.925 25.642 -13.589 358 HG12 VAL 44 2HG1 VAL 44 -3.307 25.155 -13.085 359 HG13 VAL 44 3HG1 VAL 44 -4.721 24.292 -12.477 360 HG21 VAL 44 3HG2 VAL 44 -3.738 23.871 -16.588 361 HG22 VAL 44 1HG2 VAL 44 -2.748 24.945 -15.600 362 HG23 VAL 44 2HG2 VAL 44 -4.412 25.386 -15.981 363 H ILE 45 H ILE 45 -5.039 20.829 -14.300 364 HA ILE 45 HA ILE 45 -5.702 20.977 -11.476 365 HB ILE 45 HB ILE 45 -6.973 19.306 -13.638 366 HG12 ILE 45 1HG1 ILE 45 -7.831 21.983 -12.524 367 HG13 ILE 45 2HG1 ILE 45 -7.055 21.752 -14.088 368 HG21 ILE 45 1HG2 ILE 45 -7.969 20.092 -10.902 369 HG22 ILE 45 2HG2 ILE 45 -7.414 18.488 -11.382 370 HG23 ILE 45 3HG2 ILE 45 -8.871 19.169 -12.105 371 HD11 ILE 45 3HD1 ILE 45 -9.707 20.618 -13.256 372 HD12 ILE 45 1HD1 ILE 45 -8.934 20.397 -14.824 373 HD13 ILE 45 2HD1 ILE 45 -9.456 22.004 -14.316 374 H ASP 46 H ASP 46 -5.486 19.380 -10.002 375 HA ASP 46 HA ASP 46 -4.160 16.891 -10.847 376 HB2 ASP 46 1HB ASP 46 -2.814 16.884 -8.875 377 HB3 ASP 46 2HB ASP 46 -2.661 18.496 -9.563 378 H GLN 47 H GLN 47 -4.372 15.281 -8.801 379 HA GLN 47 HA GLN 47 -7.078 14.572 -8.724 380 HB2 GLN 47 1HB GLN 47 -4.797 13.731 -6.937 381 HB3 GLN 47 2HB GLN 47 -6.394 13.000 -6.890 382 HG2 GLN 47 1HG GLN 47 -6.119 12.363 -9.268 383 HG3 GLN 47 2HG GLN 47 -4.470 12.985 -9.201 384 HE21 GLN 47 2HE2 GLN 47 -3.584 10.961 -9.637 385 HE22 GLN 47 1HE2 GLN 47 -3.570 9.693 -8.458 386 H LYS 48 H LYS 48 -5.076 16.257 -6.333 387 HA LYS 48 HA LYS 48 -7.062 16.172 -4.305 388 HB2 LYS 48 1HB LYS 48 -4.525 17.748 -4.631 389 HB3 LYS 48 2HB LYS 48 -5.572 17.930 -3.230 390 HG2 LYS 48 1HG LYS 48 -4.358 15.328 -4.135 391 HG3 LYS 48 2HG LYS 48 -3.712 16.362 -2.860 392 HD2 LYS 48 1HD LYS 48 -5.464 15.913 -1.419 393 HD3 LYS 48 2HD LYS 48 -6.558 15.470 -2.728 394 HE2 LYS 48 1HE LYS 48 -4.173 13.842 -1.867 395 HE3 LYS 48 2HE LYS 48 -5.828 13.550 -1.333 396 HZ1 LYS 48 3HZ LYS 48 -6.436 13.283 -3.719 397 HZ2 LYS 48 1HZ LYS 48 -5.359 12.102 -3.143 398 HZ3 LYS 48 2HZ LYS 48 -4.782 13.363 -4.106 399 H MET 49 H MET 49 -6.167 18.620 -6.696 400 HA MET 49 HA MET 49 -7.970 20.599 -5.911 401 HB2 MET 49 1HB MET 49 -6.241 20.774 -7.755 402 HB3 MET 49 2HB MET 49 -7.357 19.889 -8.780 403 HG2 MET 49 1HG MET 49 -9.001 21.634 -8.566 404 HG3 MET 49 2HG MET 49 -7.971 22.486 -7.421 405 HE1 MET 49 3HE MET 49 -5.139 22.516 -8.476 406 HE2 MET 49 1HE MET 49 -5.999 23.991 -8.030 407 HE3 MET 49 2HE MET 49 -5.128 23.906 -9.563 408 H ILE 50 H ILE 50 -8.453 17.578 -7.623 409 HA ILE 50 HA ILE 50 -11.167 18.067 -8.361 410 HB ILE 50 HB ILE 50 -9.682 15.450 -8.067 411 HG12 ILE 50 1HG1 ILE 50 -8.794 16.964 -9.813 412 HG13 ILE 50 2HG1 ILE 50 -9.508 15.507 -10.497 413 HG21 ILE 50 1HG2 ILE 50 -11.506 14.473 -9.388 414 HG22 ILE 50 2HG2 ILE 50 -12.367 16.011 -9.322 415 HG23 ILE 50 3HG2 ILE 50 -12.072 15.101 -7.840 416 HD11 ILE 50 3HD1 ILE 50 -10.784 18.225 -10.375 417 HD12 ILE 50 1HD1 ILE 50 -11.541 16.768 -11.015 418 HD13 ILE 50 2HD1 ILE 50 -10.114 17.439 -11.804 419 H GLU 51 H GLU 51 -9.641 16.225 -5.696 420 HA GLU 51 HA GLU 51 -11.981 15.494 -4.360 421 HB2 GLU 51 1HB GLU 51 -9.168 15.981 -3.454 422 HB3 GLU 51 2HB GLU 51 -10.420 15.720 -2.254 423 HG2 GLU 51 1HG GLU 51 -9.571 13.611 -2.545 424 HG3 GLU 51 2HG GLU 51 -10.967 13.609 -3.616 425 H LYS 52 H LYS 52 -10.017 18.416 -4.021 426 HA LYS 52 HA LYS 52 -11.456 19.660 -1.975 427 HB2 LYS 52 1HB LYS 52 -9.255 20.426 -2.758 428 HB3 LYS 52 2HB LYS 52 -9.965 20.925 -4.287 429 HG2 LYS 52 1HG LYS 52 -9.687 22.875 -2.974 430 HG3 LYS 52 2HG LYS 52 -11.411 22.505 -2.993 431 HD2 LYS 52 1HD LYS 52 -11.137 21.379 -0.793 432 HD3 LYS 52 2HD LYS 52 -9.459 21.923 -0.769 433 HE2 LYS 52 1HE LYS 52 -10.308 24.265 -0.983 434 HE3 LYS 52 2HE LYS 52 -11.940 23.628 -0.780 435 HZ1 LYS 52 3HZ LYS 52 -9.715 23.541 1.181 436 HZ2 LYS 52 1HZ LYS 52 -11.161 22.672 1.369 437 HZ3 LYS 52 2HZ LYS 52 -11.192 24.367 1.327 438 H SER 53 H SER 53 -11.960 19.629 -5.451 439 HA SER 53 HA SER 53 -14.291 21.395 -5.144 440 HB2 SER 53 1HB SER 53 -13.000 20.575 -7.750 441 HB3 SER 53 2HB SER 53 -14.035 21.968 -7.430 442 HG SER 53 HG SER 53 -11.340 21.549 -6.696 443 H LEU 54 H LEU 54 -14.007 18.358 -4.691 444 HA LEU 54 HA LEU 54 -15.346 16.962 -6.706 445 HB2 LEU 54 1HB LEU 54 -14.346 16.423 -4.115 446 HB3 LEU 54 2HB LEU 54 -16.021 15.910 -4.121 447 HG LEU 54 HG LEU 54 -13.899 14.985 -6.054 448 HD11 LEU 54 1HD1 LEU 54 -13.563 14.102 -3.814 449 HD12 LEU 54 2HD1 LEU 54 -14.123 12.834 -4.905 450 HD13 LEU 54 3HD1 LEU 54 -15.243 13.570 -3.759 451 HD21 LEU 54 3HD2 LEU 54 -16.755 14.085 -5.724 452 HD22 LEU 54 1HD2 LEU 54 -15.568 13.401 -6.834 453 HD23 LEU 54 2HD2 LEU 54 -16.131 15.057 -7.056 454 H ASN 55 H ASN 55 -16.521 18.559 -3.816 455 HA ASN 55 HA ASN 55 -19.239 18.018 -4.073 456 HB2 ASN 55 1HB ASN 55 -19.626 19.982 -2.663 457 HB3 ASN 55 2HB ASN 55 -18.270 19.034 -2.064 458 HD21 ASN 55 2HD2 ASN 55 -16.172 19.866 -2.240 459 HD22 ASN 55 1HD2 ASN 55 -15.886 21.551 -2.537 460 H LYS 56 H LYS 56 -17.312 20.588 -5.567 461 HA LYS 56 HA LYS 56 -19.519 21.889 -6.791 462 HB2 LYS 56 1HB LYS 56 -16.558 21.975 -7.376 463 HB3 LYS 56 2HB LYS 56 -17.738 22.984 -8.197 464 HG2 LYS 56 1HG LYS 56 -17.653 23.028 -5.226 465 HG3 LYS 56 2HG LYS 56 -16.386 23.859 -6.128 466 HD2 LYS 56 1HD LYS 56 -18.191 25.392 -5.581 467 HD3 LYS 56 2HD LYS 56 -18.093 25.149 -7.323 468 HE2 LYS 56 1HE LYS 56 -19.946 23.559 -7.196 469 HE3 LYS 56 2HE LYS 56 -20.045 23.808 -5.456 470 HZ1 LYS 56 3HZ LYS 56 -20.701 26.067 -5.804 471 HZ2 LYS 56 1HZ LYS 56 -21.697 25.076 -6.758 472 HZ3 LYS 56 2HZ LYS 56 -20.429 25.953 -7.473 473 H LEU 57 H LEU 57 -17.070 19.619 -8.008 474 HA LEU 57 HA LEU 57 -18.010 19.493 -10.651 475 HB2 LEU 57 1HB LEU 57 -16.575 17.397 -9.020 476 HB3 LEU 57 2HB LEU 57 -16.775 17.348 -10.760 477 HG LEU 57 HG LEU 57 -15.249 19.477 -9.254 478 HD11 LEU 57 1HD1 LEU 57 -14.275 17.135 -10.883 479 HD12 LEU 57 2HD1 LEU 57 -14.125 17.330 -9.137 480 HD13 LEU 57 3HD1 LEU 57 -13.262 18.420 -10.222 481 HD21 LEU 57 3HD2 LEU 57 -15.555 18.941 -12.207 482 HD22 LEU 57 1HD2 LEU 57 -14.461 20.127 -11.492 483 HD23 LEU 57 2HD2 LEU 57 -16.206 20.319 -11.319 484 H TYR 58 H TYR 58 -18.851 17.653 -7.768 485 HA TYR 58 HA TYR 58 -20.583 15.820 -9.061 486 HB2 TYR 58 1HB TYR 58 -19.532 15.597 -6.751 487 HB3 TYR 58 2HB TYR 58 -20.780 16.702 -6.184 488 HD1 TYR 58 HD2 TYR 58 -20.353 13.492 -8.008 489 HD2 TYR 58 HD1 TYR 58 -22.819 15.843 -5.466 490 HE1 TYR 58 HE2 TYR 58 -21.884 11.592 -7.757 491 HE2 TYR 58 HE1 TYR 58 -24.364 13.948 -5.203 492 HH TYR 58 HH TYR 58 -24.986 11.894 -6.558 493 H GLU 59 H GLU 59 -21.080 18.940 -7.476 494 HA GLU 59 HA GLU 59 -23.870 19.064 -7.650 495 HB2 GLU 59 1HB GLU 59 -22.487 20.635 -6.347 496 HB3 GLU 59 2HB GLU 59 -21.858 21.316 -7.839 497 HG2 GLU 59 1HG GLU 59 -24.063 22.126 -8.429 498 HG3 GLU 59 2HG GLU 59 -24.743 21.383 -6.982 499 H TYR 60 H TYR 60 -21.348 19.791 -9.980 500 HA TYR 60 HA TYR 60 -22.976 20.991 -11.950 501 HB2 TYR 60 1HB TYR 60 -20.633 21.346 -12.091 502 HB3 TYR 60 2HB TYR 60 -20.290 19.621 -12.056 503 HD1 TYR 60 HD2 TYR 60 -21.667 22.353 -14.147 504 HD2 TYR 60 HD1 TYR 60 -20.231 18.348 -14.053 505 HE1 TYR 60 HE2 TYR 60 -21.621 22.316 -16.604 506 HE2 TYR 60 HE1 TYR 60 -20.178 18.306 -16.510 507 HH TYR 60 HH TYR 60 -21.243 19.455 -18.403 508 H ILE 61 H ILE 61 -21.983 17.614 -11.439 509 HA ILE 61 HA ILE 61 -23.077 16.790 -13.947 510 HB ILE 61 HB ILE 61 -22.558 14.516 -13.296 511 HG12 ILE 61 1HG1 ILE 61 -21.790 15.681 -10.607 512 HG13 ILE 61 2HG1 ILE 61 -23.186 14.655 -10.912 513 HG21 ILE 61 1HG2 ILE 61 -20.145 14.771 -13.026 514 HG22 ILE 61 2HG2 ILE 61 -20.373 16.454 -12.556 515 HG23 ILE 61 3HG2 ILE 61 -20.789 15.931 -14.188 516 HD11 ILE 61 3HD1 ILE 61 -20.310 13.859 -11.264 517 HD12 ILE 61 1HD1 ILE 61 -21.710 12.825 -11.555 518 HD13 ILE 61 2HD1 ILE 61 -21.357 13.397 -9.922 519 H GLU 62 H GLU 62 -24.305 16.949 -10.682 520 HA GLU 62 HA GLU 62 -26.562 15.245 -11.246 521 HB2 GLU 62 1HB GLU 62 -26.084 17.086 -8.895 522 HB3 GLU 62 2HB GLU 62 -27.322 15.841 -9.000 523 HG2 GLU 62 1HG GLU 62 -24.371 15.301 -9.139 524 HG3 GLU 62 2HG GLU 62 -25.324 15.216 -7.660 525 H GLN 63 H GLN 63 -25.857 18.649 -11.398 526 HA GLN 63 HA GLN 63 -28.629 19.440 -11.539 527 HB2 GLN 63 1HB GLN 63 -27.829 21.681 -11.925 528 HB3 GLN 63 2HB GLN 63 -26.890 20.958 -10.628 529 HG2 GLN 63 1HG GLN 63 -25.059 20.538 -12.174 530 HG3 GLN 63 2HG GLN 63 -26.005 21.238 -13.489 531 HE21 GLN 63 2HE2 GLN 63 -24.295 21.897 -10.527 532 HE22 GLN 63 1HE2 GLN 63 -24.154 23.604 -10.759 533 H SER 64 H SER 64 -28.918 21.148 -13.545 534 HA SER 64 HA SER 64 -29.240 19.367 -15.775 535 HB2 SER 64 1HB SER 64 -29.872 22.327 -15.618 536 HB3 SER 64 2HB SER 64 -30.559 21.148 -16.733 537 HG SER 64 HG SER 64 -31.641 21.854 -14.549 538 H LYS 65 H LYS 65 -27.759 19.090 -17.360 539 HA LYS 65 HA LYS 65 -25.652 21.005 -17.816 540 HB2 LYS 65 1HB LYS 65 -26.483 18.444 -19.130 541 HB3 LYS 65 2HB LYS 65 -25.387 19.522 -19.975 542 HG2 LYS 65 1HG LYS 65 -23.951 18.057 -18.921 543 HG3 LYS 65 2HG LYS 65 -23.986 19.422 -17.807 544 HD2 LYS 65 1HD LYS 65 -25.583 18.250 -16.394 545 HD3 LYS 65 2HD LYS 65 -25.625 16.903 -17.533 546 HE2 LYS 65 1HE LYS 65 -23.237 17.834 -15.943 547 HE3 LYS 65 2HE LYS 65 -24.190 16.383 -15.642 548 HZ1 LYS 65 3HZ LYS 65 -22.236 15.737 -16.804 549 HZ2 LYS 65 1HZ LYS 65 -22.448 16.939 -17.985 550 HZ3 LYS 65 2HZ LYS 65 -23.513 15.628 -17.908 551 H ASN 66 H ASN 66 -28.812 20.395 -19.046 552 HA ASN 66 HA ASN 66 -28.465 22.306 -21.236 553 HB2 ASN 66 1HB ASN 66 -30.426 20.148 -20.630 554 HB3 ASN 66 2HB ASN 66 -31.009 21.536 -21.540 555 HD21 ASN 66 2HD2 ASN 66 -30.644 18.740 -22.342 556 HD22 ASN 66 1HD2 ASN 66 -29.599 18.784 -23.719 557 H CYS 67 H CYS 67 -31.049 23.309 -21.414 558 HA CYS 67 HA CYS 67 -31.814 24.390 -18.861 559 HB2 CYS 67 1HB CYS 67 -31.250 26.600 -19.122 560 HB3 CYS 67 2HB CYS 67 -29.892 25.862 -19.950 561 H SER 68 H SER 68 -33.770 25.669 -19.036 562 HA SER 68 HA SER 68 -35.578 24.167 -20.697 563 HB2 SER 68 1HB SER 68 -36.168 26.520 -18.879 564 HB3 SER 68 2HB SER 68 -37.347 25.379 -19.525 565 HG SER 68 HG SER 68 -36.354 23.739 -18.339 566 H TYR 69 H TYR 69 -34.027 27.220 -20.955 567 HA TYR 69 HA TYR 69 -35.747 28.563 -22.706 568 HB2 TYR 69 1HB TYR 69 -33.572 29.322 -21.480 569 HB3 TYR 69 2HB TYR 69 -32.760 28.759 -22.931 570 HD1 TYR 69 HD1 TYR 69 -33.153 29.872 -25.090 571 HD2 TYR 69 HD2 TYR 69 -34.874 31.332 -21.488 572 HE1 TYR 69 HE1 TYR 69 -33.627 32.012 -26.195 573 HE2 TYR 69 HE2 TYR 69 -35.354 33.479 -22.579 574 HH TYR 69 HH TYR 69 -34.464 34.808 -24.533 575 H CYS 70 H CYS 70 -33.755 25.810 -23.211 576 HA CYS 70 HA CYS 70 -34.095 26.105 -26.125 577 HB2 CYS 70 1HB CYS 70 -32.145 24.567 -26.389 578 HB3 CYS 70 2HB CYS 70 -31.750 26.126 -25.678 579 H SER 71 H SER 71 -33.831 23.643 -23.571 580 HA SER 71 HA SER 71 -35.111 21.721 -25.330 581 HB2 SER 71 1HB SER 71 -34.615 20.463 -22.916 582 HB3 SER 71 2HB SER 71 -33.554 20.444 -24.328 583 HG SER 71 HG SER 71 -33.164 21.571 -21.906 584 H GLU 72 H GLU 72 -36.518 20.121 -23.864 585 HA GLU 72 HA GLU 72 -38.792 21.769 -23.065 586 HB2 GLU 72 1HB GLU 72 -40.042 19.607 -23.189 587 HB3 GLU 72 2HB GLU 72 -39.316 20.114 -24.704 588 HG2 GLU 72 1HG GLU 72 -38.060 18.106 -22.854 589 HG3 GLU 72 2HG GLU 72 -39.147 17.668 -24.169 590 H ASP 73 H ASP 73 -36.409 21.284 -21.417 591 HA ASP 73 HA ASP 73 -36.915 19.499 -19.319 592 HB2 ASP 73 1HB ASP 73 -35.407 22.118 -19.168 593 HB3 ASP 73 2HB ASP 73 -35.285 20.784 -18.029 594 H GLU 74 H GLU 74 -38.747 19.506 -18.202 595 HA GLU 74 HA GLU 74 -40.302 21.825 -17.689 596 HB2 GLU 74 1HB GLU 74 -41.190 19.487 -17.805 597 HB3 GLU 74 2HB GLU 74 -40.423 19.166 -16.258 598 HG2 GLU 74 1HG GLU 74 -42.764 19.614 -15.936 599 HG3 GLU 74 2HG GLU 74 -41.811 20.916 -15.227 600 H ASN 75 H ASN 75 -37.539 20.504 -16.217 601 HA ASN 75 HA ASN 75 -37.884 21.636 -13.617 602 HB2 ASN 75 1HB ASN 75 -35.372 20.754 -15.060 603 HB3 ASN 75 2HB ASN 75 -35.437 21.234 -13.368 604 HD21 ASN 75 2HD2 ASN 75 -36.501 19.894 -11.883 605 HD22 ASN 75 1HD2 ASN 75 -36.800 18.224 -12.229 606 H CYS 76 H CYS 76 -38.706 23.678 -14.619 607 HA CYS 76 HA CYS 76 -36.734 25.445 -15.781 608 HB2 CYS 76 1HB CYS 76 -39.589 26.033 -14.969 609 HB3 CYS 76 2HB CYS 76 -38.578 27.000 -16.041 610 HG CYS 76 HG CYS 76 -38.455 24.245 -17.528 611 H ASN 77 H ASN 77 -36.746 24.440 -12.883 612 HA ASN 77 HA ASN 77 -36.833 26.972 -11.448 613 HB2 ASN 77 1HB ASN 77 -36.391 24.135 -10.502 614 HB3 ASN 77 2HB ASN 77 -36.307 25.540 -9.442 615 HD21 ASN 77 2HD2 ASN 77 -38.364 23.419 -11.228 616 HD22 ASN 77 1HD2 ASN 77 -39.868 24.037 -10.635 617 H ASN 78 H ASN 78 -34.761 25.804 -13.487 618 HA ASN 78 HA ASN 78 -32.251 25.876 -12.215 619 HB2 ASN 78 1HB ASN 78 -32.956 26.765 -15.026 620 HB3 ASN 78 2HB ASN 78 -31.336 26.420 -14.444 621 HD21 ASN 78 2HD2 ASN 78 -32.899 25.259 -16.627 622 HD22 ASN 78 1HD2 ASN 78 -32.957 23.555 -16.306 623 H LEU 79 H LEU 79 -31.617 27.501 -10.961 624 HA LEU 79 HA LEU 79 -32.698 30.048 -10.926 625 HB2 LEU 79 1HB LEU 79 -30.901 30.714 -9.472 626 HB3 LEU 79 2HB LEU 79 -31.484 29.126 -9.036 627 HG LEU 79 HG LEU 79 -28.967 29.573 -10.642 628 HD11 LEU 79 1HD1 LEU 79 -29.286 29.155 -7.677 629 HD12 LEU 79 2HD1 LEU 79 -28.800 30.657 -8.461 630 HD13 LEU 79 3HD1 LEU 79 -27.759 29.235 -8.556 631 HD21 LEU 79 3HD2 LEU 79 -29.798 27.340 -10.903 632 HD22 LEU 79 1HD2 LEU 79 -30.094 27.194 -9.169 633 HD23 LEU 79 2HD2 LEU 79 -28.443 27.289 -9.776 634 H LEU 80 H LEU 80 -29.579 29.067 -12.357 635 HA LEU 80 HA LEU 80 -29.478 31.558 -13.844 636 HB2 LEU 80 1HB LEU 80 -27.605 29.254 -13.497 637 HB3 LEU 80 2HB LEU 80 -27.416 30.311 -14.880 638 HG LEU 80 HG LEU 80 -25.905 31.043 -13.191 639 HD11 LEU 80 1HD1 LEU 80 -26.664 33.334 -12.784 640 HD12 LEU 80 2HD1 LEU 80 -28.297 32.872 -13.264 641 HD13 LEU 80 3HD1 LEU 80 -26.983 32.818 -14.439 642 HD21 LEU 80 3HD2 LEU 80 -28.259 31.189 -11.317 643 HD22 LEU 80 1HD2 LEU 80 -26.611 31.704 -10.957 644 HD23 LEU 80 2HD2 LEU 80 -26.958 30.001 -11.258 645 H GLU 81 H GLU 81 -31.700 30.690 -14.741 646 HA GLU 81 HA GLU 81 -31.504 28.773 -16.856 647 HB2 GLU 81 1HB GLU 81 -33.612 30.205 -15.578 648 HB3 GLU 81 2HB GLU 81 -33.716 30.520 -17.305 649 HG2 GLU 81 1HG GLU 81 -33.853 27.883 -15.880 650 HG3 GLU 81 2HG GLU 81 -35.065 28.641 -16.909 651 H GLY 82 H GLY 82 -32.001 29.317 -19.125 652 HA2 GLY 82 1HA GLY 82 -31.525 30.494 -21.062 653 HA3 GLY 82 2HA GLY 82 -31.187 31.914 -20.080 654 H TYR 83 H TYR 83 -29.378 29.758 -18.589 655 HA TYR 83 HA TYR 83 -27.085 30.033 -20.424 656 HB2 TYR 83 1HB TYR 83 -26.903 29.975 -17.407 657 HB3 TYR 83 2HB TYR 83 -25.624 30.352 -18.551 658 HD1 TYR 83 HD2 TYR 83 -25.781 32.530 -19.857 659 HD2 TYR 83 HD1 TYR 83 -28.276 31.643 -16.531 660 HE1 TYR 83 HE2 TYR 83 -26.285 34.926 -19.601 661 HE2 TYR 83 HE1 TYR 83 -28.782 34.028 -16.263 662 HH TYR 83 HH TYR 83 -27.827 36.170 -16.808 663 H HIS 84 H HIS 84 -25.318 28.405 -19.833 664 HA HIS 84 HA HIS 84 -26.407 25.937 -18.641 665 HB2 HIS 84 1HB HIS 84 -24.648 26.156 -21.094 666 HB3 HIS 84 2HB HIS 84 -24.869 24.661 -20.199 667 HD1 HIS 84 HD1 HIS 84 -26.007 23.416 -22.147 668 HD2 HIS 84 HD2 HIS 84 -27.971 26.901 -21.018 669 HE1 HIS 84 HE1 HIS 84 -28.146 23.520 -23.509 670 HA PRO 85 HA PRO 85 -22.819 26.346 -16.089 671 HB2 PRO 85 1HB PRO 85 -22.678 23.855 -15.069 672 HB3 PRO 85 2HB PRO 85 -23.950 24.994 -14.610 673 HG2 PRO 85 1HG PRO 85 -24.052 22.718 -16.550 674 HG3 PRO 85 2HG PRO 85 -25.255 23.221 -15.349 675 HD2 PRO 85 1HD PRO 85 -25.420 23.836 -18.006 676 HD3 PRO 85 2HD PRO 85 -26.127 24.838 -16.725 677 H LYS 86 H LYS 86 -20.686 26.275 -16.471 678 HA LYS 86 HA LYS 86 -19.590 23.952 -17.875 679 HB2 LYS 86 1HB LYS 86 -19.934 25.848 -19.483 680 HB3 LYS 86 2HB LYS 86 -18.823 26.807 -18.519 681 HG2 LYS 86 1HG LYS 86 -17.023 25.273 -18.994 682 HG3 LYS 86 2HG LYS 86 -18.127 24.206 -19.862 683 HD2 LYS 86 1HD LYS 86 -16.951 25.463 -21.497 684 HD3 LYS 86 2HD LYS 86 -18.582 26.123 -21.426 685 HE2 LYS 86 1HE LYS 86 -17.807 27.968 -20.058 686 HE3 LYS 86 2HE LYS 86 -16.180 27.286 -20.020 687 HZ1 LYS 86 3HZ LYS 86 -16.296 29.030 -21.654 688 HZ2 LYS 86 1HZ LYS 86 -17.615 28.292 -22.422 689 HZ3 LYS 86 2HZ LYS 86 -16.093 27.549 -22.447 690 H LEU 87 H LEU 87 -17.725 23.229 -17.058 691 HA LEU 87 HA LEU 87 -16.953 24.158 -14.483 692 HB2 LEU 87 1HB LEU 87 -15.677 22.116 -16.302 693 HB3 LEU 87 2HB LEU 87 -15.250 22.368 -14.619 694 HG LEU 87 HG LEU 87 -17.954 21.459 -15.605 695 HD11 LEU 87 1HD1 LEU 87 -17.337 19.295 -14.641 696 HD12 LEU 87 2HD1 LEU 87 -15.728 19.917 -14.277 697 HD13 LEU 87 3HD1 LEU 87 -16.252 19.755 -15.954 698 HD21 LEU 87 3HD2 LEU 87 -18.392 21.017 -13.234 699 HD22 LEU 87 1HD2 LEU 87 -18.085 22.728 -13.535 700 HD23 LEU 87 2HD2 LEU 87 -16.828 21.717 -12.819 701 H VAL 88 H VAL 88 -15.240 25.321 -13.846 702 HA VAL 88 HA VAL 88 -13.202 26.065 -15.837 703 HB VAL 88 HB VAL 88 -13.142 28.363 -15.002 704 HG11 VAL 88 1HG1 VAL 88 -15.910 27.527 -15.843 705 HG12 VAL 88 2HG1 VAL 88 -14.565 27.924 -16.913 706 HG13 VAL 88 3HG1 VAL 88 -15.279 29.172 -15.890 707 HG21 VAL 88 3HG2 VAL 88 -13.872 28.034 -12.731 708 HG22 VAL 88 1HG2 VAL 88 -15.473 27.535 -13.279 709 HG23 VAL 88 2HG2 VAL 88 -14.936 29.199 -13.520 710 H VAL 89 H VAL 89 -11.128 26.421 -14.956 711 HA VAL 89 HA VAL 89 -10.839 25.548 -12.174 712 HB VAL 89 HB VAL 89 -9.552 24.182 -13.682 713 HG11 VAL 89 1HG1 VAL 89 -7.748 25.092 -15.074 714 HG12 VAL 89 2HG1 VAL 89 -8.248 26.725 -14.636 715 HG13 VAL 89 3HG1 VAL 89 -9.334 25.690 -15.564 716 HG21 VAL 89 3HG2 VAL 89 -8.551 24.652 -11.514 717 HG22 VAL 89 1HG2 VAL 89 -7.748 26.075 -12.176 718 HG23 VAL 89 2HG2 VAL 89 -7.304 24.465 -12.749 719 H ASN 90 H ASN 90 -10.508 27.054 -10.685 720 HA ASN 90 HA ASN 90 -9.347 29.615 -11.574 721 HB2 ASN 90 1HB ASN 90 -11.531 29.082 -9.559 722 HB3 ASN 90 2HB ASN 90 -10.669 30.612 -9.637 723 HD21 ASN 90 2HD2 ASN 90 -13.488 30.002 -10.054 724 HD22 ASN 90 1HD2 ASN 90 -13.873 30.581 -11.634 725 H GLY 91 H GLY 91 -7.269 29.125 -11.036 726 HA2 GLY 91 1HA GLY 91 -5.423 29.127 -9.693 727 HA3 GLY 91 2HA GLY 91 -6.442 29.869 -8.478 728 H ARG 92 H ARG 92 -7.574 28.492 -7.014 729 HA ARG 92 HA ARG 92 -5.856 26.269 -6.297 730 HB2 ARG 92 1HB ARG 92 -6.398 26.625 -4.039 731 HB3 ARG 92 2HB ARG 92 -6.106 28.211 -4.742 732 HG2 ARG 92 1HG ARG 92 -8.799 26.970 -4.367 733 HG3 ARG 92 2HG ARG 92 -8.077 28.152 -3.272 734 HD2 ARG 92 1HD ARG 92 -7.920 29.719 -5.172 735 HD3 ARG 92 2HD ARG 92 -8.739 28.542 -6.179 736 HE ARG 92 HE ARG 92 -10.570 28.809 -4.330 737 HH11 ARG 92 1HH1 ARG 92 -8.590 31.340 -5.726 738 HH12 ARG 92 2HH1 ARG 92 -9.832 32.550 -5.629 739 HH21 ARG 92 1HH2 ARG 92 -12.223 30.397 -4.213 740 HH22 ARG 92 2HH2 ARG 92 -11.898 32.001 -4.800 741 H SER 93 H SER 93 -8.928 26.813 -7.472 742 HA SER 93 HA SER 93 -9.755 24.121 -6.797 743 HB2 SER 93 1HB SER 93 -11.966 24.966 -5.932 744 HB3 SER 93 2HB SER 93 -10.593 25.282 -4.877 745 HG SER 93 HG SER 93 -12.267 27.027 -6.148 746 H ILE 94 H ILE 94 -11.968 23.667 -7.744 747 HA ILE 94 HA ILE 94 -12.065 24.818 -10.448 748 HB ILE 94 HB ILE 94 -13.103 22.154 -9.444 749 HG12 ILE 94 1HG1 ILE 94 -10.726 22.673 -11.236 750 HG13 ILE 94 2HG1 ILE 94 -10.580 22.504 -9.494 751 HG21 ILE 94 1HG2 ILE 94 -13.376 21.612 -11.820 752 HG22 ILE 94 2HG2 ILE 94 -12.885 23.254 -12.243 753 HG23 ILE 94 3HG2 ILE 94 -14.375 22.983 -11.339 754 HD11 ILE 94 3HD1 ILE 94 -10.019 20.433 -10.534 755 HD12 ILE 94 1HD1 ILE 94 -11.539 20.425 -11.438 756 HD13 ILE 94 2HD1 ILE 94 -11.553 20.242 -9.684 757 H ASP 95 H ASP 95 -13.979 25.650 -11.210 758 HA ASP 95 HA ASP 95 -16.198 25.807 -9.296 759 HB2 ASP 95 1HB ASP 95 -14.496 27.887 -9.623 760 HB3 ASP 95 2HB ASP 95 -15.650 28.227 -10.904 761 H ILE 96 H ILE 96 -18.038 27.129 -10.514 762 HA ILE 96 HA ILE 96 -18.352 25.923 -13.183 763 HB ILE 96 HB ILE 96 -20.511 26.131 -11.072 764 HG12 ILE 96 1HG1 ILE 96 -19.157 23.638 -12.112 765 HG13 ILE 96 2HG1 ILE 96 -18.704 24.435 -10.609 766 HG21 ILE 96 1HG2 ILE 96 -21.833 24.766 -12.624 767 HG22 ILE 96 2HG2 ILE 96 -20.516 24.830 -13.795 768 HG23 ILE 96 3HG2 ILE 96 -21.370 26.308 -13.346 769 HD11 ILE 96 3HD1 ILE 96 -20.149 22.548 -10.194 770 HD12 ILE 96 1HD1 ILE 96 -21.388 23.236 -11.243 771 HD13 ILE 96 2HD1 ILE 96 -20.950 24.050 -9.741 772 H GLU 97 H GLU 97 -18.490 27.555 -14.604 773 HA GLU 97 HA GLU 97 -19.990 29.960 -13.796 774 HB2 GLU 97 1HB GLU 97 -17.814 29.753 -15.888 775 HB3 GLU 97 2HB GLU 97 -18.667 31.220 -15.424 776 HG2 GLU 97 1HG GLU 97 -17.772 30.813 -13.082 777 HG3 GLU 97 2HG GLU 97 -16.710 29.617 -13.818 778 H TYR 98 H TYR 98 -21.263 30.976 -15.456 779 HA TYR 98 HA TYR 98 -22.479 28.884 -17.128 780 HB2 TYR 98 1HB TYR 98 -23.581 31.248 -15.667 781 HB3 TYR 98 2HB TYR 98 -24.451 30.592 -17.051 782 HD1 TYR 98 HD1 TYR 98 -23.211 29.830 -13.655 783 HD2 TYR 98 HD2 TYR 98 -25.672 28.563 -16.894 784 HE1 TYR 98 HE1 TYR 98 -24.230 28.132 -12.200 785 HE2 TYR 98 HE2 TYR 98 -26.701 26.855 -15.439 786 HH TYR 98 HH TYR 98 -26.050 25.575 -13.330 787 H TYR 99 H TYR 99 -22.470 29.058 -19.243 788 HA TYR 99 HA TYR 99 -21.998 31.704 -20.442 789 HB2 TYR 99 1HB TYR 99 -21.324 30.545 -22.481 790 HB3 TYR 99 2HB TYR 99 -20.383 29.943 -21.124 791 HD1 TYR 99 HD2 TYR 99 -20.698 27.650 -20.309 792 HD2 TYR 99 HD1 TYR 99 -22.902 29.131 -23.639 793 HE1 TYR 99 HE2 TYR 99 -21.321 25.352 -20.914 794 HE2 TYR 99 HE1 TYR 99 -23.525 26.838 -24.253 795 HH TYR 99 HH TYR 99 -22.543 24.511 -23.882 796 H GLU 100 H GLU 100 -23.417 32.349 -22.210 797 HA GLU 100 HA GLU 100 -26.103 31.730 -21.492 798 HB2 GLU 100 1HB GLU 100 -26.784 33.352 -23.116 799 HB3 GLU 100 2HB GLU 100 -25.376 33.975 -22.274 800 HG2 GLU 100 1HG GLU 100 -23.968 33.332 -24.173 801 HG3 GLU 100 2HG GLU 100 -25.400 32.748 -25.021 802 H CYS 101 H CYS 101 -27.596 30.527 -22.458 803 HA CYS 101 HA CYS 101 -27.049 28.278 -23.909 804 HB2 CYS 101 1HB CYS 101 -29.198 28.816 -22.790 805 HB3 CYS 101 2HB CYS 101 -29.576 29.923 -24.103 806 HA PRO 102 HA PRO 102 -25.595 29.873 -27.757 807 HB2 PRO 102 1HB PRO 102 -25.646 27.523 -29.167 808 HB3 PRO 102 2HB PRO 102 -24.381 27.963 -28.016 809 HG2 PRO 102 1HG PRO 102 -26.772 26.211 -27.625 810 HG3 PRO 102 2HG PRO 102 -25.106 25.974 -27.066 811 HD2 PRO 102 1HD PRO 102 -27.031 26.854 -25.417 812 HD3 PRO 102 2HD PRO 102 -25.358 27.435 -25.291 813 H VAL 103 H VAL 103 -28.710 28.440 -27.412 814 HA VAL 103 HA VAL 103 -29.560 28.637 -30.110 815 HB VAL 103 HB VAL 103 -30.726 27.300 -28.323 816 HG11 VAL 103 1HG1 VAL 103 -30.769 28.941 -26.545 817 HG12 VAL 103 2HG1 VAL 103 -32.411 28.439 -26.947 818 HG13 VAL 103 3HG1 VAL 103 -31.801 29.994 -27.513 819 HG21 VAL 103 3HG2 VAL 103 -32.977 27.705 -29.204 820 HG22 VAL 103 1HG2 VAL 103 -31.762 27.683 -30.480 821 HG23 VAL 103 2HG2 VAL 103 -32.418 29.220 -29.914 822 H LYS 104 H LYS 104 -29.164 30.930 -27.566 823 HA LYS 104 HA LYS 104 -30.905 32.941 -28.632 824 HB2 LYS 104 1HB LYS 104 -28.721 32.985 -26.558 825 HB3 LYS 104 2HB LYS 104 -29.610 34.426 -27.022 826 HG2 LYS 104 1HG LYS 104 -31.669 33.470 -26.241 827 HG3 LYS 104 2HG LYS 104 -30.872 31.931 -25.913 828 HD2 LYS 104 1HD LYS 104 -31.246 33.365 -23.896 829 HD3 LYS 104 2HD LYS 104 -29.570 32.890 -24.162 830 HE2 LYS 104 1HE LYS 104 -29.643 35.206 -23.533 831 HE3 LYS 104 2HE LYS 104 -29.153 35.084 -25.220 832 HZ1 LYS 104 3HZ LYS 104 -31.507 35.563 -25.818 833 HZ2 LYS 104 1HZ LYS 104 -30.720 36.834 -25.016 834 HZ3 LYS 104 2HZ LYS 104 -31.824 35.861 -24.177 835 H ARG 105 H ARG 105 -27.424 32.355 -28.630 836 HA ARG 105 HA ARG 105 -27.050 34.670 -30.385 837 HB2 ARG 105 1HB ARG 105 -25.746 34.278 -28.176 838 HB3 ARG 105 2HB ARG 105 -24.837 33.093 -29.101 839 HG2 ARG 105 1HG ARG 105 -23.724 35.278 -28.983 840 HG3 ARG 105 2HG ARG 105 -24.097 34.791 -30.639 841 HD2 ARG 105 1HD ARG 105 -25.618 36.447 -30.927 842 HD3 ARG 105 2HD ARG 105 -26.158 36.387 -29.251 843 HE ARG 105 HE ARG 105 -24.132 37.653 -28.680 844 HH11 ARG 105 1HH1 ARG 105 -25.170 37.644 -32.033 845 HH12 ARG 105 2HH1 ARG 105 -24.470 39.195 -32.385 846 HH21 ARG 105 1HH2 ARG 105 -23.202 39.683 -29.147 847 HH22 ARG 105 2HH2 ARG 105 -23.302 40.328 -30.760 848 H LYS 106 H LYS 106 -27.679 33.770 -32.342 849 HA LYS 106 HA LYS 106 -26.349 31.347 -33.278 850 HB2 LYS 106 1HB LYS 106 -28.452 33.073 -34.599 851 HB3 LYS 106 2HB LYS 106 -27.835 31.558 -35.239 852 HG2 LYS 106 1HG LYS 106 -28.695 30.407 -33.223 853 HG3 LYS 106 2HG LYS 106 -29.419 31.934 -32.709 854 HD2 LYS 106 1HD LYS 106 -30.752 32.001 -34.749 855 HD3 LYS 106 2HD LYS 106 -30.005 30.500 -35.296 856 HE2 LYS 106 1HE LYS 106 -32.137 29.955 -34.396 857 HE3 LYS 106 2HE LYS 106 -30.917 29.391 -33.257 858 HZ1 LYS 106 3HZ LYS 106 -32.906 30.564 -32.293 859 HZ2 LYS 106 1HZ LYS 106 -32.291 32.002 -32.950 860 HZ3 LYS 106 2HZ LYS 106 -31.398 31.147 -31.790 Start of MODEL 16 1 HA MET 1 HA MET 1 -9.736 -19.181 -13.863 2 HB2 MET 1 1HB MET 1 -11.666 -17.798 -13.222 3 HB3 MET 1 2HB MET 1 -11.158 -17.474 -14.873 4 HG2 MET 1 1HG MET 1 -12.990 -18.837 -15.719 5 HG3 MET 1 2HG MET 1 -13.488 -19.204 -14.070 6 HE1 MET 1 2HE MET 1 -16.333 -16.828 -15.369 7 HE2 MET 1 3HE MET 1 -15.970 -18.390 -14.638 8 HE3 MET 1 1HE MET 1 -15.452 -18.044 -16.293 9 H GLU 2 H GLU 2 -10.258 -19.674 -11.713 10 HA GLU 2 HA GLU 2 -11.961 -22.070 -11.423 11 HB2 GLU 2 1HB GLU 2 -9.468 -22.325 -10.984 12 HB3 GLU 2 2HB GLU 2 -9.677 -21.237 -9.619 13 HG2 GLU 2 1HG GLU 2 -11.366 -22.857 -8.716 14 HG3 GLU 2 2HG GLU 2 -10.876 -23.966 -9.996 15 HA PRO 3 HA PRO 3 -14.792 -19.807 -8.848 16 HB2 PRO 3 1HB PRO 3 -14.957 -21.756 -6.808 17 HB3 PRO 3 2HB PRO 3 -16.029 -21.592 -8.199 18 HG2 PRO 3 1HG PRO 3 -13.691 -23.390 -7.807 19 HG3 PRO 3 2HG PRO 3 -15.194 -23.673 -8.706 20 HD2 PRO 3 1HD PRO 3 -12.906 -23.171 -9.980 21 HD3 PRO 3 2HD PRO 3 -14.443 -22.499 -10.571 22 H ILE 4 H ILE 4 -14.024 -18.108 -7.776 23 HA ILE 4 HA ILE 4 -11.863 -18.367 -5.868 24 HB ILE 4 HB ILE 4 -13.482 -15.899 -6.541 25 HG12 ILE 4 1HG1 ILE 4 -11.186 -15.360 -7.737 26 HG13 ILE 4 2HG1 ILE 4 -11.056 -17.112 -7.809 27 HG21 ILE 4 1HG2 ILE 4 -10.828 -16.212 -5.143 28 HG22 ILE 4 2HG2 ILE 4 -12.355 -15.736 -4.399 29 HG23 ILE 4 3HG2 ILE 4 -11.582 -14.677 -5.579 30 HD11 ILE 4 3HD1 ILE 4 -13.118 -17.240 -9.068 31 HD12 ILE 4 1HD1 ILE 4 -11.976 -16.154 -9.859 32 HD13 ILE 4 2HD1 ILE 4 -13.328 -15.494 -8.937 33 H GLY 5 H GLY 5 -15.300 -18.065 -5.929 34 HA2 GLY 5 1HA GLY 5 -16.564 -18.856 -4.010 35 HA3 GLY 5 2HA GLY 5 -15.355 -18.092 -2.987 36 H ARG 6 H ARG 6 -16.279 -16.454 -1.963 37 HA ARG 6 HA ARG 6 -17.526 -14.377 -3.578 38 HB2 ARG 6 1HB ARG 6 -19.320 -14.225 -1.666 39 HB3 ARG 6 2HB ARG 6 -19.538 -15.343 -3.005 40 HG2 ARG 6 1HG ARG 6 -18.557 -17.130 -1.577 41 HG3 ARG 6 2HG ARG 6 -18.566 -15.984 -0.234 42 HD2 ARG 6 1HD ARG 6 -20.940 -15.811 -0.292 43 HD3 ARG 6 2HD ARG 6 -21.027 -16.687 -1.818 44 HE ARG 6 HE ARG 6 -19.990 -18.579 -0.366 45 HH11 ARG 6 1HH1 ARG 6 -22.393 -16.249 0.661 46 HH12 ARG 6 2HH1 ARG 6 -23.171 -17.330 1.776 47 HH21 ARG 6 1HH2 ARG 6 -21.008 -20.025 1.083 48 HH22 ARG 6 2HH2 ARG 6 -22.363 -19.483 2.019 49 H SER 7 H SER 7 -17.201 -12.327 -2.812 50 HA SER 7 HA SER 7 -15.093 -12.167 -0.816 51 HB2 SER 7 1HB SER 7 -16.161 -10.011 -2.651 52 HB3 SER 7 2HB SER 7 -14.650 -9.973 -1.740 53 HG SER 7 HG SER 7 -15.296 -11.325 -4.085 54 H LEU 8 H LEU 8 -18.104 -12.400 -0.252 55 HA LEU 8 HA LEU 8 -18.624 -9.957 1.209 56 HB2 LEU 8 1HB LEU 8 -20.705 -11.271 1.926 57 HB3 LEU 8 2HB LEU 8 -20.565 -10.785 0.249 58 HG LEU 8 HG LEU 8 -19.704 -13.131 -0.224 59 HD11 LEU 8 1HD1 LEU 8 -19.144 -13.734 2.082 60 HD12 LEU 8 2HD1 LEU 8 -20.284 -14.873 1.364 61 HD13 LEU 8 3HD1 LEU 8 -20.853 -13.660 2.511 62 HD21 LEU 8 3HD2 LEU 8 -22.520 -12.760 0.781 63 HD22 LEU 8 1HD2 LEU 8 -21.971 -14.086 -0.244 64 HD23 LEU 8 2HD2 LEU 8 -21.930 -12.429 -0.847 65 H GLN 9 H GLN 9 -16.341 -11.605 1.943 66 HA GLN 9 HA GLN 9 -17.128 -12.603 4.588 67 HB2 GLN 9 1HB GLN 9 -14.804 -13.398 2.827 68 HB3 GLN 9 2HB GLN 9 -15.082 -14.004 4.451 69 HG2 GLN 9 1HG GLN 9 -17.129 -15.066 3.746 70 HG3 GLN 9 2HG GLN 9 -16.958 -14.381 2.129 71 HE21 GLN 9 2HE2 GLN 9 -15.423 -15.233 0.727 72 HE22 GLN 9 1HE2 GLN 9 -14.644 -16.752 1.023 73 H GLY 10 H GLY 10 -16.394 -11.519 6.270 74 HA2 GLY 10 1HA GLY 10 -14.770 -10.622 7.666 75 HA3 GLY 10 2HA GLY 10 -13.658 -10.586 6.309 76 H VAL 11 H VAL 11 -14.501 -8.935 4.541 77 HA VAL 11 HA VAL 11 -14.055 -6.435 5.814 78 HB VAL 11 HB VAL 11 -14.799 -6.910 2.924 79 HG11 VAL 11 1HG1 VAL 11 -15.000 -4.582 3.583 80 HG12 VAL 11 2HG1 VAL 11 -13.586 -4.793 2.550 81 HG13 VAL 11 3HG1 VAL 11 -13.387 -4.620 4.292 82 HG21 VAL 11 3HG2 VAL 11 -12.062 -6.798 4.189 83 HG22 VAL 11 1HG2 VAL 11 -12.413 -6.982 2.469 84 HG23 VAL 11 2HG2 VAL 11 -12.859 -8.258 3.603 85 H THR 12 H THR 12 -15.763 -5.931 7.133 86 HA THR 12 HA THR 12 -18.372 -5.458 5.896 87 HB THR 12 HB THR 12 -19.024 -4.881 8.290 88 HG1 THR 12 HG1 THR 12 -17.584 -5.357 9.892 89 HG21 THR 12 3HG2 THR 12 -17.978 -7.659 7.727 90 HG22 THR 12 1HG2 THR 12 -19.571 -7.041 7.290 91 HG23 THR 12 2HG2 THR 12 -19.136 -7.237 8.988 92 H GLY 13 H GLY 13 -15.745 -3.864 5.660 93 HA2 GLY 13 1HA GLY 13 -16.374 -1.304 6.807 94 HA3 GLY 13 2HA GLY 13 -15.048 -1.661 5.712 95 H ARG 14 H ARG 14 -18.569 -1.217 5.791 96 HA ARG 14 HA ARG 14 -18.365 0.281 3.287 97 HB2 ARG 14 1HB ARG 14 -19.850 -2.241 3.699 98 HB3 ARG 14 2HB ARG 14 -20.735 -0.961 2.884 99 HG2 ARG 14 1HG ARG 14 -19.828 -2.020 1.097 100 HG3 ARG 14 2HG ARG 14 -18.563 -0.840 1.429 101 HD2 ARG 14 1HD ARG 14 -17.249 -2.496 2.581 102 HD3 ARG 14 2HD ARG 14 -18.552 -3.679 2.439 103 HE ARG 14 HE ARG 14 -17.596 -2.625 -0.073 104 HH11 ARG 14 1HH1 ARG 14 -17.204 -5.138 2.340 105 HH12 ARG 14 2HH1 ARG 14 -16.466 -6.250 1.229 106 HH21 ARG 14 1HH2 ARG 14 -16.642 -4.091 -1.527 107 HH22 ARG 14 2HH2 ARG 14 -16.155 -5.666 -0.956 108 HA PRO 15 HA PRO 15 -21.304 2.303 6.364 109 HB2 PRO 15 1HB PRO 15 -19.940 4.655 6.530 110 HB3 PRO 15 2HB PRO 15 -19.697 3.320 7.663 111 HG2 PRO 15 1HG PRO 15 -18.068 4.102 5.276 112 HG3 PRO 15 2HG PRO 15 -17.526 3.587 6.887 113 HD2 PRO 15 1HD PRO 15 -17.547 1.912 4.769 114 HD3 PRO 15 2HD PRO 15 -17.862 1.352 6.424 115 H ASP 16 H ASP 16 -22.642 4.148 5.752 116 HA ASP 16 HA ASP 16 -23.005 4.311 2.947 117 HB2 ASP 16 1HB ASP 16 -24.826 5.779 3.364 118 HB3 ASP 16 2HB ASP 16 -24.810 4.627 4.691 119 H PHE 17 H PHE 17 -21.037 6.047 5.131 120 HA PHE 17 HA PHE 17 -20.645 8.432 3.698 121 HB2 PHE 17 1HB PHE 17 -19.863 8.165 5.997 122 HB3 PHE 17 2HB PHE 17 -18.731 6.918 5.489 123 HD1 PHE 17 HD2 PHE 17 -19.487 10.516 5.363 124 HD2 PHE 17 HD1 PHE 17 -16.636 7.477 4.501 125 HE1 PHE 17 HE2 PHE 17 -17.772 12.237 4.984 126 HE2 PHE 17 HE1 PHE 17 -14.915 9.194 4.128 127 HZ PHE 17 HZ PHE 17 -15.483 11.580 4.364 128 H GLN 18 H GLN 18 -18.805 5.371 3.633 129 HA GLN 18 HA GLN 18 -17.052 6.324 1.601 130 HB2 GLN 18 1HB GLN 18 -16.061 4.158 1.612 131 HB3 GLN 18 2HB GLN 18 -16.467 4.539 3.270 132 HG2 GLN 18 1HG GLN 18 -17.150 2.368 3.162 133 HG3 GLN 18 2HG GLN 18 -18.648 3.200 2.755 134 HE21 GLN 18 2HE2 GLN 18 -15.917 2.774 0.567 135 HE22 GLN 18 1HE2 GLN 18 -16.749 1.755 -0.551 136 H LYS 19 H LYS 19 -20.060 4.557 1.651 137 HA LYS 19 HA LYS 19 -20.090 3.738 -1.039 138 HB2 LYS 19 1HB LYS 19 -22.305 4.309 0.919 139 HB3 LYS 19 2HB LYS 19 -22.622 3.741 -0.714 140 HG2 LYS 19 1HG LYS 19 -21.125 1.780 -0.177 141 HG3 LYS 19 2HG LYS 19 -21.178 2.321 1.501 142 HD2 LYS 19 1HD LYS 19 -23.577 1.606 -0.182 143 HD3 LYS 19 2HD LYS 19 -22.839 0.565 1.034 144 HE2 LYS 19 1HE LYS 19 -23.342 2.234 2.756 145 HE3 LYS 19 2HE LYS 19 -24.088 3.262 1.535 146 HZ1 LYS 19 3HZ LYS 19 -25.002 0.541 2.288 147 HZ2 LYS 19 1HZ LYS 19 -25.717 1.534 1.114 148 HZ3 LYS 19 2HZ LYS 19 -25.745 1.994 2.745 149 H ARG 20 H ARG 20 -21.443 6.658 0.524 150 HA ARG 20 HA ARG 20 -22.374 7.796 -1.884 151 HB2 ARG 20 1HB ARG 20 -22.846 9.730 -0.668 152 HB3 ARG 20 2HB ARG 20 -22.933 8.472 0.555 153 HG2 ARG 20 1HG ARG 20 -20.688 9.033 1.310 154 HG3 ARG 20 2HG ARG 20 -20.574 10.276 0.064 155 HD2 ARG 20 1HD ARG 20 -21.147 11.461 1.984 156 HD3 ARG 20 2HD ARG 20 -22.677 11.271 1.131 157 HE ARG 20 HE ARG 20 -23.099 9.361 2.699 158 HH11 ARG 20 1HH1 ARG 20 -20.929 11.986 3.557 159 HH12 ARG 20 2HH1 ARG 20 -21.188 11.809 5.266 160 HH21 ARG 20 1HH2 ARG 20 -23.409 9.106 4.963 161 HH22 ARG 20 2HH2 ARG 20 -22.583 10.180 6.063 162 H LEU 21 H LEU 21 -19.266 7.760 -0.313 163 HA LEU 21 HA LEU 21 -18.074 9.881 -1.766 164 HB2 LEU 21 1HB LEU 21 -17.062 9.240 0.273 165 HB3 LEU 21 2HB LEU 21 -16.981 7.554 -0.201 166 HG LEU 21 HG LEU 21 -15.293 8.180 -1.926 167 HD11 LEU 21 1HD1 LEU 21 -14.176 10.358 -1.708 168 HD12 LEU 21 2HD1 LEU 21 -15.392 10.854 -0.532 169 HD13 LEU 21 3HD1 LEU 21 -15.861 10.524 -2.200 170 HD21 LEU 21 3HD2 LEU 21 -13.454 8.454 -0.337 171 HD22 LEU 21 1HD2 LEU 21 -14.624 7.256 0.220 172 HD23 LEU 21 2HD2 LEU 21 -14.612 8.871 0.928 173 H GLU 22 H GLU 22 -17.872 6.330 -2.162 174 HA GLU 22 HA GLU 22 -16.429 6.429 -4.587 175 HB2 GLU 22 1HB GLU 22 -18.290 4.294 -3.525 176 HB3 GLU 22 2HB GLU 22 -17.250 4.095 -4.929 177 HG2 GLU 22 1HG GLU 22 -15.303 4.591 -3.417 178 HG3 GLU 22 2HG GLU 22 -16.428 4.471 -2.065 179 H GLN 23 H GLN 23 -19.834 6.517 -3.820 180 HA GLN 23 HA GLN 23 -20.918 6.179 -6.376 181 HB2 GLN 23 1HB GLN 23 -22.181 6.113 -4.259 182 HB3 GLN 23 2HB GLN 23 -21.966 7.838 -4.082 183 HG2 GLN 23 1HG GLN 23 -23.379 8.320 -5.882 184 HG3 GLN 23 2HG GLN 23 -23.335 6.657 -6.467 185 HE21 GLN 23 2HE2 GLN 23 -23.632 7.332 -3.084 186 HE22 GLN 23 1HE2 GLN 23 -25.279 6.827 -2.919 187 H MET 24 H MET 24 -20.285 9.210 -4.613 188 HA MET 24 HA MET 24 -20.942 10.867 -6.802 189 HB2 MET 24 1HB MET 24 -19.946 12.690 -5.551 190 HB3 MET 24 2HB MET 24 -20.951 11.702 -4.508 191 HG2 MET 24 1HG MET 24 -18.924 10.601 -3.659 192 HG3 MET 24 2HG MET 24 -17.949 11.680 -4.657 193 HE1 MET 24 3HE MET 24 -18.887 15.188 -3.100 194 HE2 MET 24 1HE MET 24 -19.705 14.371 -4.431 195 HE3 MET 24 2HE MET 24 -17.944 14.362 -4.342 196 H LYS 25 H LYS 25 -17.870 9.525 -5.711 197 HA LYS 25 HA LYS 25 -16.201 10.910 -7.512 198 HB2 LYS 25 1HB LYS 25 -15.625 9.361 -5.477 199 HB3 LYS 25 2HB LYS 25 -15.629 8.083 -6.683 200 HG2 LYS 25 1HG LYS 25 -13.385 8.849 -6.375 201 HG3 LYS 25 2HG LYS 25 -13.939 9.363 -7.972 202 HD2 LYS 25 1HD LYS 25 -14.374 11.590 -7.153 203 HD3 LYS 25 2HD LYS 25 -13.980 11.097 -5.506 204 HE2 LYS 25 1HE LYS 25 -12.064 11.120 -7.833 205 HE3 LYS 25 2HE LYS 25 -12.166 12.353 -6.575 206 HZ1 LYS 25 3HZ LYS 25 -10.378 10.761 -6.150 207 HZ2 LYS 25 1HZ LYS 25 -11.498 9.487 -6.111 208 HZ3 LYS 25 2HZ LYS 25 -11.555 10.703 -4.929 209 H GLU 26 H GLU 26 -17.930 7.865 -7.742 210 HA GLU 26 HA GLU 26 -17.073 6.979 -10.246 211 HB2 GLU 26 1HB GLU 26 -18.487 5.793 -8.473 212 HB3 GLU 26 2HB GLU 26 -19.864 6.655 -9.134 213 HG2 GLU 26 1HG GLU 26 -18.135 4.943 -10.866 214 HG3 GLU 26 2HG GLU 26 -19.420 4.248 -9.886 215 H LYS 27 H LYS 27 -19.827 9.004 -9.353 216 HA LYS 27 HA LYS 27 -20.841 9.491 -11.900 217 HB2 LYS 27 1HB LYS 27 -20.997 10.888 -9.279 218 HB3 LYS 27 2HB LYS 27 -21.491 11.786 -10.706 219 HG2 LYS 27 1HG LYS 27 -22.616 9.128 -9.846 220 HG3 LYS 27 2HG LYS 27 -23.376 10.700 -9.595 221 HD2 LYS 27 1HD LYS 27 -22.810 9.323 -12.213 222 HD3 LYS 27 2HD LYS 27 -24.382 9.722 -11.523 223 HE2 LYS 27 1HE LYS 27 -23.916 12.093 -11.766 224 HE3 LYS 27 2HE LYS 27 -22.303 11.734 -12.375 225 HZ1 LYS 27 3HZ LYS 27 -23.574 10.425 -14.175 226 HZ2 LYS 27 1HZ LYS 27 -23.510 12.120 -14.282 227 HZ3 LYS 27 2HZ LYS 27 -24.908 11.353 -13.699 228 H VAL 28 H VAL 28 -18.562 11.492 -10.022 229 HA VAL 28 HA VAL 28 -18.338 13.510 -11.969 230 HB VAL 28 HB VAL 28 -16.382 12.750 -9.788 231 HG11 VAL 28 1HG1 VAL 28 -16.633 15.308 -11.362 232 HG12 VAL 28 2HG1 VAL 28 -15.330 14.129 -11.508 233 HG13 VAL 28 3HG1 VAL 28 -15.540 15.031 -10.006 234 HG21 VAL 28 3HG2 VAL 28 -18.539 13.297 -8.860 235 HG22 VAL 28 1HG2 VAL 28 -18.627 14.761 -9.840 236 HG23 VAL 28 2HG2 VAL 28 -17.418 14.628 -8.562 237 H MET 29 H MET 29 -16.436 10.587 -11.368 238 HA MET 29 HA MET 29 -14.399 11.345 -13.246 239 HB2 MET 29 1HB MET 29 -14.912 8.856 -11.650 240 HB3 MET 29 2HB MET 29 -13.637 8.924 -12.858 241 HG2 MET 29 1HG MET 29 -13.882 10.766 -10.493 242 HG3 MET 29 2HG MET 29 -12.830 9.354 -10.579 243 HE1 MET 29 3HE MET 29 -10.298 12.344 -10.787 244 HE2 MET 29 1HE MET 29 -10.722 10.857 -9.941 245 HE3 MET 29 2HE MET 29 -11.777 12.266 -9.832 246 H LYS 30 H LYS 30 -17.477 10.151 -13.738 247 HA LYS 30 HA LYS 30 -16.612 9.006 -16.304 248 HB2 LYS 30 1HB LYS 30 -18.402 7.839 -14.270 249 HB3 LYS 30 2HB LYS 30 -18.921 7.671 -15.942 250 HG2 LYS 30 1HG LYS 30 -17.695 5.743 -15.565 251 HG3 LYS 30 2HG LYS 30 -16.542 6.802 -16.374 252 HD2 LYS 30 1HD LYS 30 -15.332 5.884 -14.598 253 HD3 LYS 30 2HD LYS 30 -15.808 7.481 -14.013 254 HE2 LYS 30 1HE LYS 30 -16.147 5.795 -12.295 255 HE3 LYS 30 2HE LYS 30 -17.683 6.487 -12.813 256 HZ1 LYS 30 3HZ LYS 30 -18.205 4.290 -12.845 257 HZ2 LYS 30 1HZ LYS 30 -16.629 3.780 -13.214 258 HZ3 LYS 30 2HZ LYS 30 -17.617 4.427 -14.426 259 H ASP 31 H ASP 31 -18.101 11.610 -15.098 260 HA ASP 31 HA ASP 31 -20.334 11.670 -16.948 261 HB2 ASP 31 1HB ASP 31 -19.931 12.938 -14.570 262 HB3 ASP 31 2HB ASP 31 -19.519 14.214 -15.714 263 H GLN 32 H GLN 32 -20.464 12.800 -18.797 264 HA GLN 32 HA GLN 32 -18.158 12.688 -20.371 265 HB2 GLN 32 1HB GLN 32 -20.719 14.160 -20.986 266 HB3 GLN 32 2HB GLN 32 -19.536 13.587 -22.152 267 HG2 GLN 32 1HG GLN 32 -20.065 11.306 -21.666 268 HG3 GLN 32 2HG GLN 32 -21.106 11.785 -20.324 269 HE21 GLN 32 2HE2 GLN 32 -21.742 10.215 -22.692 270 HE22 GLN 32 1HE2 GLN 32 -23.047 11.048 -23.476 271 H ASP 33 H ASP 33 -19.933 15.504 -19.138 272 HA ASP 33 HA ASP 33 -18.365 17.404 -20.548 273 HB2 ASP 33 1HB ASP 33 -20.653 17.825 -19.571 274 HB3 ASP 33 2HB ASP 33 -19.888 17.916 -17.987 275 H VAL 34 H VAL 34 -18.094 15.969 -17.369 276 HA VAL 34 HA VAL 34 -16.066 17.617 -16.337 277 HB VAL 34 HB VAL 34 -16.641 14.700 -15.743 278 HG11 VAL 34 1HG1 VAL 34 -15.489 15.087 -13.623 279 HG12 VAL 34 2HG1 VAL 34 -15.064 16.717 -14.154 280 HG13 VAL 34 3HG1 VAL 34 -14.412 15.315 -15.003 281 HG21 VAL 34 3HG2 VAL 34 -17.580 17.226 -14.387 282 HG22 VAL 34 1HG2 VAL 34 -17.866 15.585 -13.805 283 HG23 VAL 34 2HG2 VAL 34 -18.566 16.111 -15.334 284 H GLN 35 H GLN 35 -15.987 14.737 -18.375 285 HA GLN 35 HA GLN 35 -13.225 14.235 -18.401 286 HB2 GLN 35 1HB GLN 35 -15.079 13.935 -20.772 287 HB3 GLN 35 2HB GLN 35 -13.595 13.046 -20.455 288 HG2 GLN 35 1HG GLN 35 -16.076 12.895 -18.775 289 HG3 GLN 35 2HG GLN 35 -15.635 11.749 -20.036 290 HE21 GLN 35 2HE2 GLN 35 -16.020 11.458 -17.132 291 HE22 GLN 35 1HE2 GLN 35 -14.565 10.731 -16.540 292 H ALA 36 H ALA 36 -15.231 16.315 -20.420 293 HA ALA 36 HA ALA 36 -13.257 17.222 -22.178 294 HB1 ALA 36 1HB ALA 36 -15.674 17.556 -22.508 295 HB2 ALA 36 2HB ALA 36 -14.756 19.047 -22.703 296 HB3 ALA 36 3HB ALA 36 -15.669 18.761 -21.220 297 H PHE 37 H PHE 37 -14.373 18.631 -19.120 298 HA PHE 37 HA PHE 37 -12.683 20.874 -19.142 299 HB2 PHE 37 1HB PHE 37 -14.560 20.820 -17.654 300 HB3 PHE 37 2HB PHE 37 -13.966 19.364 -16.864 301 HD1 PHE 37 HD2 PHE 37 -12.728 22.807 -17.616 302 HD2 PHE 37 HD1 PHE 37 -13.051 19.644 -14.796 303 HE1 PHE 37 HE2 PHE 37 -11.609 24.205 -15.934 304 HE2 PHE 37 HE1 PHE 37 -11.931 21.035 -13.102 305 HZ PHE 37 HZ PHE 37 -11.209 23.322 -13.673 306 H LEU 38 H LEU 38 -12.210 17.621 -17.829 307 HA LEU 38 HA LEU 38 -9.839 18.114 -16.432 308 HB2 LEU 38 1HB LEU 38 -11.266 15.750 -17.415 309 HB3 LEU 38 2HB LEU 38 -9.535 15.529 -17.239 310 HG LEU 38 HG LEU 38 -10.662 14.813 -15.228 311 HD11 LEU 38 1HD1 LEU 38 -9.485 16.200 -13.588 312 HD12 LEU 38 2HD1 LEU 38 -9.213 17.424 -14.828 313 HD13 LEU 38 3HD1 LEU 38 -8.466 15.832 -14.980 314 HD21 LEU 38 3HD2 LEU 38 -11.727 17.628 -15.038 315 HD22 LEU 38 1HD2 LEU 38 -11.933 16.356 -13.835 316 HD23 LEU 38 2HD2 LEU 38 -12.678 16.194 -15.426 317 H LYS 39 H LYS 39 -10.328 17.166 -19.810 318 HA LYS 39 HA LYS 39 -7.464 17.085 -20.259 319 HB2 LYS 39 1HB LYS 39 -8.035 16.633 -22.618 320 HB3 LYS 39 2HB LYS 39 -8.810 15.517 -21.505 321 HG2 LYS 39 1HG LYS 39 -10.905 16.725 -21.726 322 HG3 LYS 39 2HG LYS 39 -10.129 17.889 -22.804 323 HD2 LYS 39 1HD LYS 39 -11.380 16.232 -24.079 324 HD3 LYS 39 2HD LYS 39 -9.652 16.088 -24.397 325 HE2 LYS 39 1HE LYS 39 -10.637 13.890 -24.137 326 HE3 LYS 39 2HE LYS 39 -9.532 14.220 -22.804 327 HZ1 LYS 39 3HZ LYS 39 -12.496 14.406 -22.727 328 HZ2 LYS 39 1HZ LYS 39 -11.466 14.826 -21.445 329 HZ3 LYS 39 2HZ LYS 39 -11.538 13.221 -21.978 330 H GLU 40 H GLU 40 -10.002 19.388 -20.509 331 HA GLU 40 HA GLU 40 -8.829 21.256 -22.244 332 HB2 GLU 40 1HB GLU 40 -11.174 21.322 -21.319 333 HB3 GLU 40 2HB GLU 40 -10.500 21.868 -19.797 334 HG2 GLU 40 1HG GLU 40 -9.552 23.836 -21.010 335 HG3 GLU 40 2HG GLU 40 -10.444 23.310 -22.437 336 H ASN 41 H ASN 41 -8.669 20.933 -18.741 337 HA ASN 41 HA ASN 41 -6.370 22.783 -18.714 338 HB2 ASN 41 1HB ASN 41 -8.447 22.159 -16.607 339 HB3 ASN 41 2HB ASN 41 -6.996 23.109 -16.285 340 HD21 ASN 41 2HD2 ASN 41 -10.069 23.000 -17.863 341 HD22 ASN 41 1HD2 ASN 41 -10.172 24.677 -18.256 342 H GLU 42 H GLU 42 -6.094 20.054 -19.344 343 HA GLU 42 HA GLU 42 -5.642 18.257 -17.302 344 HB2 GLU 42 1HB GLU 42 -4.062 17.132 -18.879 345 HB3 GLU 42 2HB GLU 42 -5.627 17.526 -19.583 346 HG2 GLU 42 1HG GLU 42 -4.747 19.305 -20.820 347 HG3 GLU 42 2HG GLU 42 -3.251 19.331 -19.884 348 H GLU 43 H GLU 43 -3.436 20.720 -18.531 349 HA GLU 43 HA GLU 43 -1.230 19.672 -16.985 350 HB2 GLU 43 1HB GLU 43 -1.071 20.667 -19.325 351 HB3 GLU 43 2HB GLU 43 -1.286 22.235 -18.564 352 HG2 GLU 43 1HG GLU 43 1.047 21.825 -18.962 353 HG3 GLU 43 2HG GLU 43 0.731 21.848 -17.229 354 H VAL 44 H VAL 44 -3.788 21.772 -16.434 355 HA VAL 44 HA VAL 44 -2.291 23.437 -14.539 356 HB VAL 44 HB VAL 44 -5.164 23.741 -15.426 357 HG11 VAL 44 1HG1 VAL 44 -4.700 24.824 -13.306 358 HG12 VAL 44 2HG1 VAL 44 -4.912 26.037 -14.567 359 HG13 VAL 44 3HG1 VAL 44 -3.293 25.632 -13.998 360 HG21 VAL 44 3HG2 VAL 44 -2.687 25.110 -16.472 361 HG22 VAL 44 1HG2 VAL 44 -4.347 25.517 -16.912 362 HG23 VAL 44 2HG2 VAL 44 -3.681 23.939 -17.339 363 H ILE 45 H ILE 45 -4.949 21.150 -14.757 364 HA ILE 45 HA ILE 45 -5.648 21.385 -11.960 365 HB ILE 45 HB ILE 45 -6.581 19.387 -14.035 366 HG12 ILE 45 1HG1 ILE 45 -7.963 21.894 -13.078 367 HG13 ILE 45 2HG1 ILE 45 -7.079 21.761 -14.596 368 HG21 ILE 45 1HG2 ILE 45 -6.949 18.611 -11.748 369 HG22 ILE 45 2HG2 ILE 45 -8.477 19.017 -12.532 370 HG23 ILE 45 3HG2 ILE 45 -7.763 20.126 -11.362 371 HD11 ILE 45 3HD1 ILE 45 -9.480 21.523 -14.922 372 HD12 ILE 45 1HD1 ILE 45 -9.498 20.142 -13.826 373 HD13 ILE 45 2HD1 ILE 45 -8.624 20.046 -15.356 374 H ASP 46 H ASP 46 -5.368 19.773 -10.404 375 HA ASP 46 HA ASP 46 -3.638 17.512 -11.146 376 HB2 ASP 46 1HB ASP 46 -2.539 17.615 -8.992 377 HB3 ASP 46 2HB ASP 46 -2.407 19.189 -9.766 378 H GLN 47 H GLN 47 -3.896 15.669 -9.513 379 HA GLN 47 HA GLN 47 -6.569 14.830 -9.647 380 HB2 GLN 47 1HB GLN 47 -4.208 13.753 -8.124 381 HB3 GLN 47 2HB GLN 47 -5.783 12.976 -8.078 382 HG2 GLN 47 1HG GLN 47 -5.700 12.733 -10.530 383 HG3 GLN 47 2HG GLN 47 -4.077 13.421 -10.517 384 HE21 GLN 47 2HE2 GLN 47 -3.254 11.512 -11.434 385 HE22 GLN 47 1HE2 GLN 47 -3.028 10.081 -10.479 386 H LYS 48 H LYS 48 -4.703 16.174 -6.993 387 HA LYS 48 HA LYS 48 -6.717 15.704 -5.032 388 HB2 LYS 48 1HB LYS 48 -4.226 17.375 -5.070 389 HB3 LYS 48 2HB LYS 48 -5.317 17.355 -3.694 390 HG2 LYS 48 1HG LYS 48 -3.911 14.963 -4.861 391 HG3 LYS 48 2HG LYS 48 -3.467 15.816 -3.383 392 HD2 LYS 48 1HD LYS 48 -5.496 15.177 -2.305 393 HD3 LYS 48 2HD LYS 48 -6.170 14.554 -3.808 394 HE2 LYS 48 1HE LYS 48 -4.364 12.834 -3.823 395 HE3 LYS 48 2HE LYS 48 -3.868 13.419 -2.233 396 HZ1 LYS 48 3HZ LYS 48 -6.017 12.835 -1.349 397 HZ2 LYS 48 1HZ LYS 48 -5.344 11.473 -2.108 398 HZ3 LYS 48 2HZ LYS 48 -6.569 12.359 -2.882 399 H MET 49 H MET 49 -5.863 18.421 -7.084 400 HA MET 49 HA MET 49 -7.604 20.346 -6.139 401 HB2 MET 49 1HB MET 49 -6.039 20.652 -8.038 402 HB3 MET 49 2HB MET 49 -7.083 19.653 -9.036 403 HG2 MET 49 1HG MET 49 -8.891 21.268 -8.750 404 HG3 MET 49 2HG MET 49 -7.817 22.265 -7.773 405 HE1 MET 49 3HE MET 49 -5.121 23.385 -10.352 406 HE2 MET 49 1HE MET 49 -5.054 22.016 -9.240 407 HE3 MET 49 2HE MET 49 -5.727 23.558 -8.705 408 H ILE 50 H ILE 50 -8.266 17.614 -8.285 409 HA ILE 50 HA ILE 50 -10.976 18.114 -8.776 410 HB ILE 50 HB ILE 50 -9.498 15.481 -8.645 411 HG12 ILE 50 1HG1 ILE 50 -8.673 17.044 -10.350 412 HG13 ILE 50 2HG1 ILE 50 -9.463 15.655 -11.087 413 HG21 ILE 50 1HG2 ILE 50 -12.233 16.053 -9.786 414 HG22 ILE 50 2HG2 ILE 50 -11.883 15.101 -8.342 415 HG23 ILE 50 3HG2 ILE 50 -11.353 14.530 -9.924 416 HD11 ILE 50 3HD1 ILE 50 -10.042 17.728 -12.221 417 HD12 ILE 50 1HD1 ILE 50 -10.694 18.375 -10.716 418 HD13 ILE 50 2HD1 ILE 50 -11.461 16.984 -11.483 419 H GLU 51 H GLU 51 -9.400 16.245 -6.201 420 HA GLU 51 HA GLU 51 -11.844 15.452 -4.986 421 HB2 GLU 51 1HB GLU 51 -9.042 15.535 -3.860 422 HB3 GLU 51 2HB GLU 51 -10.421 14.792 -3.057 423 HG2 GLU 51 1HG GLU 51 -10.686 13.305 -5.032 424 HG3 GLU 51 2HG GLU 51 -9.187 13.974 -5.674 425 H LYS 52 H LYS 52 -9.639 18.159 -4.425 426 HA LYS 52 HA LYS 52 -10.864 19.079 -2.043 427 HB2 LYS 52 1HB LYS 52 -9.124 20.428 -4.085 428 HB3 LYS 52 2HB LYS 52 -9.764 21.291 -2.692 429 HG2 LYS 52 1HG LYS 52 -8.716 19.449 -1.281 430 HG3 LYS 52 2HG LYS 52 -7.841 18.996 -2.746 431 HD2 LYS 52 1HD LYS 52 -7.831 21.775 -1.609 432 HD3 LYS 52 2HD LYS 52 -6.636 20.554 -1.173 433 HE2 LYS 52 1HE LYS 52 -7.176 21.523 -3.976 434 HE3 LYS 52 2HE LYS 52 -5.862 22.091 -2.948 435 HZ1 LYS 52 3HZ LYS 52 -4.987 20.431 -4.376 436 HZ2 LYS 52 1HZ LYS 52 -6.245 19.353 -4.009 437 HZ3 LYS 52 2HZ LYS 52 -5.100 19.742 -2.829 438 H SER 53 H SER 53 -11.686 19.420 -5.379 439 HA SER 53 HA SER 53 -13.947 21.129 -4.582 440 HB2 SER 53 1HB SER 53 -12.546 21.021 -7.267 441 HB3 SER 53 2HB SER 53 -13.955 22.013 -6.886 442 HG SER 53 HG SER 53 -12.241 22.576 -5.021 443 H LEU 54 H LEU 54 -13.628 18.184 -4.598 444 HA LEU 54 HA LEU 54 -14.952 17.008 -6.774 445 HB2 LEU 54 1HB LEU 54 -13.644 15.762 -5.085 446 HB3 LEU 54 2HB LEU 54 -14.891 16.084 -3.897 447 HG LEU 54 HG LEU 54 -16.493 14.789 -5.273 448 HD11 LEU 54 1HD1 LEU 54 -15.400 15.122 -7.440 449 HD12 LEU 54 2HD1 LEU 54 -15.699 13.420 -7.094 450 HD13 LEU 54 3HD1 LEU 54 -14.072 14.083 -6.917 451 HD21 LEU 54 3HD2 LEU 54 -15.599 12.608 -4.718 452 HD22 LEU 54 1HD2 LEU 54 -15.275 13.756 -3.420 453 HD23 LEU 54 2HD2 LEU 54 -13.986 13.298 -4.533 454 H ASN 55 H ASN 55 -16.111 18.506 -3.842 455 HA ASN 55 HA ASN 55 -18.834 17.797 -4.145 456 HB2 ASN 55 1HB ASN 55 -19.291 19.580 -2.523 457 HB3 ASN 55 2HB ASN 55 -17.942 18.583 -1.996 458 HD21 ASN 55 2HD2 ASN 55 -18.659 21.277 -1.225 459 HD22 ASN 55 1HD2 ASN 55 -17.300 22.278 -1.607 460 H LYS 56 H LYS 56 -16.833 20.395 -5.390 461 HA LYS 56 HA LYS 56 -18.990 21.885 -6.514 462 HB2 LYS 56 1HB LYS 56 -16.003 21.972 -6.783 463 HB3 LYS 56 2HB LYS 56 -17.023 22.930 -7.853 464 HG2 LYS 56 1HG LYS 56 -17.132 23.045 -4.849 465 HG3 LYS 56 2HG LYS 56 -16.233 24.172 -5.868 466 HD2 LYS 56 1HD LYS 56 -18.190 25.021 -6.848 467 HD3 LYS 56 2HD LYS 56 -19.160 23.662 -6.287 468 HE2 LYS 56 1HE LYS 56 -18.864 24.436 -3.973 469 HE3 LYS 56 2HE LYS 56 -17.954 25.823 -4.571 470 HZ1 LYS 56 3HZ LYS 56 -19.824 26.767 -5.493 471 HZ2 LYS 56 1HZ LYS 56 -20.459 26.068 -4.090 472 HZ3 LYS 56 2HZ LYS 56 -20.673 25.298 -5.586 473 H LEU 57 H LEU 57 -16.629 19.572 -7.854 474 HA LEU 57 HA LEU 57 -17.571 19.649 -10.496 475 HB2 LEU 57 1HB LEU 57 -16.139 17.578 -8.881 476 HB3 LEU 57 2HB LEU 57 -16.805 17.132 -10.439 477 HG LEU 57 HG LEU 57 -14.433 17.684 -10.610 478 HD11 LEU 57 1HD1 LEU 57 -15.910 18.101 -12.512 479 HD12 LEU 57 2HD1 LEU 57 -14.568 19.245 -12.455 480 HD13 LEU 57 3HD1 LEU 57 -16.177 19.747 -11.937 481 HD21 LEU 57 3HD2 LEU 57 -15.248 20.427 -9.668 482 HD22 LEU 57 1HD2 LEU 57 -13.658 19.979 -10.289 483 HD23 LEU 57 2HD2 LEU 57 -14.249 19.271 -8.787 484 H TYR 58 H TYR 58 -18.678 17.861 -7.678 485 HA TYR 58 HA TYR 58 -20.635 16.349 -9.115 486 HB2 TYR 58 1HB TYR 58 -19.544 15.759 -6.865 487 HB3 TYR 58 2HB TYR 58 -20.689 16.894 -6.153 488 HD1 TYR 58 HD1 TYR 58 -20.526 13.881 -8.320 489 HD2 TYR 58 HD2 TYR 58 -22.831 16.165 -5.568 490 HE1 TYR 58 HE1 TYR 58 -22.234 12.115 -8.299 491 HE2 TYR 58 HE2 TYR 58 -24.542 14.403 -5.530 492 HH TYR 58 HH TYR 58 -25.326 12.584 -6.932 493 H GLU 59 H GLU 59 -20.653 19.313 -7.186 494 HA GLU 59 HA GLU 59 -23.424 19.814 -7.287 495 HB2 GLU 59 1HB GLU 59 -21.890 21.011 -5.770 496 HB3 GLU 59 2HB GLU 59 -21.129 21.792 -7.149 497 HG2 GLU 59 1HG GLU 59 -23.309 22.841 -7.688 498 HG3 GLU 59 2HG GLU 59 -23.964 22.146 -6.208 499 H TYR 60 H TYR 60 -20.813 20.380 -9.530 500 HA TYR 60 HA TYR 60 -22.140 22.103 -11.298 501 HB2 TYR 60 1HB TYR 60 -19.771 21.853 -11.493 502 HB3 TYR 60 2HB TYR 60 -19.908 20.111 -11.718 503 HD1 TYR 60 HD2 TYR 60 -20.815 23.350 -13.289 504 HD2 TYR 60 HD1 TYR 60 -20.025 19.210 -13.869 505 HE1 TYR 60 HE2 TYR 60 -20.910 23.678 -15.710 506 HE2 TYR 60 HE1 TYR 60 -20.131 19.536 -16.314 507 HH TYR 60 HH TYR 60 -20.840 21.010 -17.945 508 H ILE 61 H ILE 61 -21.719 18.563 -11.444 509 HA ILE 61 HA ILE 61 -23.179 18.295 -13.844 510 HB ILE 61 HB ILE 61 -23.230 15.856 -13.352 511 HG12 ILE 61 1HG1 ILE 61 -21.730 16.684 -10.859 512 HG13 ILE 61 2HG1 ILE 61 -23.331 15.951 -10.904 513 HG21 ILE 61 1HG2 ILE 61 -21.410 16.869 -14.585 514 HG22 ILE 61 2HG2 ILE 61 -20.805 15.565 -13.565 515 HG23 ILE 61 3HG2 ILE 61 -20.571 17.244 -13.082 516 HD11 ILE 61 3HD1 ILE 61 -20.776 14.645 -11.822 517 HD12 ILE 61 1HD1 ILE 61 -22.380 13.914 -11.834 518 HD13 ILE 61 2HD1 ILE 61 -21.615 14.333 -10.301 519 H GLU 62 H GLU 62 -24.207 18.318 -10.490 520 HA GLU 62 HA GLU 62 -26.834 17.333 -11.125 521 HB2 GLU 62 1HB GLU 62 -27.428 17.898 -8.831 522 HB3 GLU 62 2HB GLU 62 -25.912 17.016 -8.878 523 HG2 GLU 62 1HG GLU 62 -24.658 18.982 -8.448 524 HG3 GLU 62 2HG GLU 62 -26.073 20.008 -8.679 525 H GLN 63 H GLN 63 -25.331 20.501 -10.779 526 HA GLN 63 HA GLN 63 -27.876 21.879 -10.973 527 HB2 GLN 63 1HB GLN 63 -25.040 22.885 -10.805 528 HB3 GLN 63 2HB GLN 63 -26.434 23.941 -10.963 529 HG2 GLN 63 1HG GLN 63 -27.309 23.104 -8.845 530 HG3 GLN 63 2HG GLN 63 -25.906 22.045 -8.689 531 HE21 GLN 63 2HE2 GLN 63 -24.097 24.029 -9.830 532 HE22 GLN 63 1HE2 GLN 63 -23.843 25.211 -8.602 533 H SER 64 H SER 64 -28.800 22.043 -12.885 534 HA SER 64 HA SER 64 -29.194 22.513 -15.036 535 HB2 SER 64 1HB SER 64 -26.769 24.285 -14.769 536 HB3 SER 64 2HB SER 64 -28.138 24.478 -15.851 537 HG SER 64 HG SER 64 -29.435 24.604 -13.867 538 H LYS 65 H LYS 65 -28.193 20.149 -15.144 539 HA LYS 65 HA LYS 65 -25.841 19.764 -16.649 540 HB2 LYS 65 1HB LYS 65 -27.069 17.968 -15.476 541 HB3 LYS 65 2HB LYS 65 -28.398 18.137 -16.611 542 HG2 LYS 65 1HG LYS 65 -26.965 17.396 -18.426 543 HG3 LYS 65 2HG LYS 65 -25.601 17.263 -17.309 544 HD2 LYS 65 1HD LYS 65 -28.191 15.722 -17.104 545 HD3 LYS 65 2HD LYS 65 -26.667 15.085 -17.729 546 HE2 LYS 65 1HE LYS 65 -25.612 15.318 -15.605 547 HE3 LYS 65 2HE LYS 65 -26.976 16.229 -14.963 548 HZ1 LYS 65 3HZ LYS 65 -26.926 13.907 -14.212 549 HZ2 LYS 65 1HZ LYS 65 -27.101 13.386 -15.818 550 HZ3 LYS 65 2HZ LYS 65 -28.340 14.272 -15.069 551 H ASN 66 H ASN 66 -29.051 20.730 -17.402 552 HA ASN 66 HA ASN 66 -28.203 21.534 -20.083 553 HB2 ASN 66 1HB ASN 66 -30.457 20.905 -20.962 554 HB3 ASN 66 2HB ASN 66 -29.529 19.502 -20.441 555 HD21 ASN 66 2HD2 ASN 66 -31.416 18.278 -20.222 556 HD22 ASN 66 1HD2 ASN 66 -32.502 18.516 -18.895 557 H CYS 67 H CYS 67 -30.748 22.671 -20.703 558 HA CYS 67 HA CYS 67 -31.602 24.156 -18.392 559 HB2 CYS 67 1HB CYS 67 -31.122 26.316 -19.057 560 HB3 CYS 67 2HB CYS 67 -29.681 25.467 -19.584 561 H SER 68 H SER 68 -33.587 25.309 -18.804 562 HA SER 68 HA SER 68 -35.316 23.455 -20.100 563 HB2 SER 68 1HB SER 68 -35.896 24.780 -18.049 564 HB3 SER 68 2HB SER 68 -36.037 26.209 -19.070 565 HG SER 68 HG SER 68 -37.533 23.816 -19.439 566 H TYR 69 H TYR 69 -33.952 26.530 -21.010 567 HA TYR 69 HA TYR 69 -35.550 27.268 -23.135 568 HB2 TYR 69 1HB TYR 69 -33.562 28.470 -22.077 569 HB3 TYR 69 2HB TYR 69 -32.548 27.507 -23.141 570 HD1 TYR 69 HD2 TYR 69 -32.694 27.806 -25.589 571 HD2 TYR 69 HD1 TYR 69 -34.805 30.325 -22.900 572 HE1 TYR 69 HE2 TYR 69 -33.039 29.431 -27.397 573 HE2 TYR 69 HE1 TYR 69 -35.157 31.959 -24.698 574 HH TYR 69 HH TYR 69 -34.557 31.236 -27.983 575 H CYS 70 H CYS 70 -33.057 24.765 -23.031 576 HA CYS 70 HA CYS 70 -33.363 24.385 -25.935 577 HB2 CYS 70 1HB CYS 70 -31.278 23.058 -25.837 578 HB3 CYS 70 2HB CYS 70 -31.057 24.721 -25.308 579 H SER 71 H SER 71 -34.477 23.145 -23.083 580 HA SER 71 HA SER 71 -34.697 20.436 -24.191 581 HB2 SER 71 1HB SER 71 -33.723 20.787 -21.844 582 HB3 SER 71 2HB SER 71 -35.355 21.243 -21.353 583 HG SER 71 HG SER 71 -35.248 19.085 -20.990 584 H GLU 72 H GLU 72 -36.853 19.367 -23.679 585 HA GLU 72 HA GLU 72 -38.985 21.274 -24.288 586 HB2 GLU 72 1HB GLU 72 -38.603 19.112 -25.601 587 HB3 GLU 72 2HB GLU 72 -39.210 18.269 -24.183 588 HG2 GLU 72 1HG GLU 72 -40.915 18.613 -25.922 589 HG3 GLU 72 2HG GLU 72 -41.340 19.351 -24.378 590 H ASP 73 H ASP 73 -37.592 19.633 -21.738 591 HA ASP 73 HA ASP 73 -39.894 19.302 -20.070 592 HB2 ASP 73 1HB ASP 73 -36.975 19.437 -19.279 593 HB3 ASP 73 2HB ASP 73 -38.292 18.811 -18.296 594 H GLU 74 H GLU 74 -40.997 20.980 -19.315 595 HA GLU 74 HA GLU 74 -39.669 23.511 -18.774 596 HB2 GLU 74 1HB GLU 74 -41.917 23.445 -19.823 597 HB3 GLU 74 2HB GLU 74 -42.558 22.701 -18.366 598 HG2 GLU 74 1HG GLU 74 -42.005 24.688 -17.084 599 HG3 GLU 74 2HG GLU 74 -41.306 25.434 -18.519 600 H ASN 75 H ASN 75 -40.682 20.668 -17.131 601 HA ASN 75 HA ASN 75 -40.732 21.789 -14.497 602 HB2 ASN 75 1HB ASN 75 -41.983 19.715 -15.111 603 HB3 ASN 75 2HB ASN 75 -40.441 18.883 -15.297 604 HD21 ASN 75 2HD2 ASN 75 -39.229 18.387 -13.464 605 HD22 ASN 75 1HD2 ASN 75 -39.912 18.425 -11.869 606 H CYS 76 H CYS 76 -38.713 22.935 -14.765 607 HA CYS 76 HA CYS 76 -36.586 21.568 -13.430 608 HB2 CYS 76 1HB CYS 76 -36.180 20.938 -15.828 609 HB3 CYS 76 2HB CYS 76 -36.019 22.651 -16.204 610 HG CYS 76 HG CYS 76 -33.471 22.594 -15.882 611 H ASN 77 H ASN 77 -35.444 23.028 -12.243 612 HA ASN 77 HA ASN 77 -36.138 25.844 -12.708 613 HB2 ASN 77 1HB ASN 77 -35.752 24.396 -10.082 614 HB3 ASN 77 2HB ASN 77 -35.895 26.146 -10.227 615 HD21 ASN 77 2HD2 ASN 77 -37.868 27.057 -10.730 616 HD22 ASN 77 1HD2 ASN 77 -39.351 26.161 -10.660 617 H ASN 78 H ASN 78 -34.210 25.826 -14.067 618 HA ASN 78 HA ASN 78 -31.626 25.739 -12.850 619 HB2 ASN 78 1HB ASN 78 -32.701 26.823 -15.440 620 HB3 ASN 78 2HB ASN 78 -31.063 27.217 -14.936 621 HD21 ASN 78 2HD2 ASN 78 -30.156 26.134 -16.651 622 HD22 ASN 78 1HD2 ASN 78 -30.129 24.405 -16.760 623 H LEU 79 H LEU 79 -30.524 27.342 -11.812 624 HA LEU 79 HA LEU 79 -31.879 29.618 -10.856 625 HB2 LEU 79 1HB LEU 79 -29.905 28.602 -9.744 626 HB3 LEU 79 2HB LEU 79 -28.894 29.174 -11.057 627 HG LEU 79 HG LEU 79 -29.430 31.504 -10.451 628 HD11 LEU 79 1HD1 LEU 79 -30.909 30.250 -8.143 629 HD12 LEU 79 2HD1 LEU 79 -31.633 31.140 -9.481 630 HD13 LEU 79 3HD1 LEU 79 -30.574 31.970 -8.339 631 HD21 LEU 79 3HD2 LEU 79 -28.420 29.889 -8.116 632 HD22 LEU 79 1HD2 LEU 79 -28.100 31.592 -8.438 633 HD23 LEU 79 2HD2 LEU 79 -27.454 30.355 -9.516 634 H LEU 80 H LEU 80 -29.002 29.645 -12.956 635 HA LEU 80 HA LEU 80 -30.061 31.933 -14.391 636 HB2 LEU 80 1HB LEU 80 -27.482 30.396 -14.726 637 HB3 LEU 80 2HB LEU 80 -27.938 31.770 -15.711 638 HG LEU 80 HG LEU 80 -28.047 33.078 -13.497 639 HD11 LEU 80 1HD1 LEU 80 -26.391 30.720 -12.614 640 HD12 LEU 80 2HD1 LEU 80 -27.971 31.179 -11.981 641 HD13 LEU 80 3HD1 LEU 80 -26.578 32.232 -11.728 642 HD21 LEU 80 3HD2 LEU 80 -25.662 33.560 -13.600 643 HD22 LEU 80 1HD2 LEU 80 -26.343 33.402 -15.220 644 HD23 LEU 80 2HD2 LEU 80 -25.395 32.085 -14.528 645 H GLU 81 H GLU 81 -31.866 31.111 -15.465 646 HA GLU 81 HA GLU 81 -31.565 28.765 -17.134 647 HB2 GLU 81 1HB GLU 81 -33.688 29.108 -15.971 648 HB3 GLU 81 2HB GLU 81 -33.907 30.651 -16.785 649 HG2 GLU 81 1HG GLU 81 -35.256 28.772 -17.709 650 HG3 GLU 81 2HG GLU 81 -34.236 29.599 -18.880 651 H GLY 82 H GLY 82 -31.770 28.760 -19.403 652 HA2 GLY 82 1HA GLY 82 -31.388 29.701 -21.516 653 HA3 GLY 82 2HA GLY 82 -31.190 31.278 -20.759 654 H TYR 83 H TYR 83 -29.461 29.436 -18.828 655 HA TYR 83 HA TYR 83 -26.994 29.604 -20.433 656 HB2 TYR 83 1HB TYR 83 -27.207 30.176 -17.470 657 HB3 TYR 83 2HB TYR 83 -25.791 30.387 -18.491 658 HD1 TYR 83 HD1 TYR 83 -25.712 32.267 -20.117 659 HD2 TYR 83 HD2 TYR 83 -28.906 31.837 -17.341 660 HE1 TYR 83 HE1 TYR 83 -26.347 34.614 -20.491 661 HE2 TYR 83 HE2 TYR 83 -29.549 34.178 -17.709 662 HH TYR 83 HH TYR 83 -28.404 36.013 -20.287 663 H HIS 84 H HIS 84 -25.260 28.173 -19.659 664 HA HIS 84 HA HIS 84 -26.129 26.020 -17.840 665 HB2 HIS 84 1HB HIS 84 -24.319 25.687 -20.249 666 HB3 HIS 84 2HB HIS 84 -24.600 24.458 -19.031 667 HD1 HIS 84 HD1 HIS 84 -25.520 22.795 -20.784 668 HD2 HIS 84 HD2 HIS 84 -27.674 26.329 -20.509 669 HE1 HIS 84 HE1 HIS 84 -27.498 22.561 -22.349 670 HA PRO 85 HA PRO 85 -22.381 27.134 -15.756 671 HB2 PRO 85 1HB PRO 85 -21.952 24.932 -14.284 672 HB3 PRO 85 2HB PRO 85 -23.313 26.014 -13.969 673 HG2 PRO 85 1HG PRO 85 -23.266 23.377 -15.365 674 HG3 PRO 85 2HG PRO 85 -24.484 24.044 -14.262 675 HD2 PRO 85 1HD PRO 85 -24.683 24.026 -17.025 676 HD3 PRO 85 2HD PRO 85 -25.574 25.120 -15.951 677 H LYS 86 H LYS 86 -20.112 26.558 -15.527 678 HA LYS 86 HA LYS 86 -19.124 24.240 -16.952 679 HB2 LYS 86 1HB LYS 86 -19.252 26.233 -18.594 680 HB3 LYS 86 2HB LYS 86 -17.928 26.912 -17.656 681 HG2 LYS 86 1HG LYS 86 -16.613 24.875 -18.098 682 HG3 LYS 86 2HG LYS 86 -17.923 24.291 -19.120 683 HD2 LYS 86 1HD LYS 86 -16.529 25.232 -20.691 684 HD3 LYS 86 2HD LYS 86 -17.586 26.597 -20.327 685 HE2 LYS 86 1HE LYS 86 -15.293 27.342 -20.355 686 HE3 LYS 86 2HE LYS 86 -15.914 27.415 -18.707 687 HZ1 LYS 86 3HZ LYS 86 -14.792 25.331 -18.223 688 HZ2 LYS 86 1HZ LYS 86 -13.682 26.487 -18.770 689 HZ3 LYS 86 2HZ LYS 86 -14.198 25.250 -19.806 690 H LEU 87 H LEU 87 -17.055 23.596 -16.227 691 HA LEU 87 HA LEU 87 -16.307 24.693 -13.667 692 HB2 LEU 87 1HB LEU 87 -14.972 22.566 -15.343 693 HB3 LEU 87 2HB LEU 87 -14.436 23.045 -13.748 694 HG LEU 87 HG LEU 87 -15.598 21.096 -13.349 695 HD11 LEU 87 1HD1 LEU 87 -16.371 22.784 -11.831 696 HD12 LEU 87 2HD1 LEU 87 -17.704 21.702 -12.240 697 HD13 LEU 87 3HD1 LEU 87 -17.608 23.300 -12.977 698 HD21 LEU 87 3HD2 LEU 87 -16.491 20.815 -15.590 699 HD22 LEU 87 1HD2 LEU 87 -17.741 22.013 -15.254 700 HD23 LEU 87 2HD2 LEU 87 -17.719 20.486 -14.369 701 H VAL 88 H VAL 88 -14.606 25.950 -13.177 702 HA VAL 88 HA VAL 88 -12.571 26.468 -15.225 703 HB VAL 88 HB VAL 88 -12.493 28.865 -14.578 704 HG11 VAL 88 1HG1 VAL 88 -13.674 28.184 -16.604 705 HG12 VAL 88 2HG1 VAL 88 -14.452 29.578 -15.851 706 HG13 VAL 88 3HG1 VAL 88 -15.159 27.970 -15.678 707 HG21 VAL 88 3HG2 VAL 88 -15.067 28.254 -13.127 708 HG22 VAL 88 1HG2 VAL 88 -14.391 29.861 -13.393 709 HG23 VAL 88 2HG2 VAL 88 -13.532 28.700 -12.381 710 H VAL 89 H VAL 89 -10.499 26.715 -14.400 711 HA VAL 89 HA VAL 89 -10.226 25.840 -11.643 712 HB VAL 89 HB VAL 89 -8.895 24.654 -13.282 713 HG11 VAL 89 1HG1 VAL 89 -7.562 27.292 -13.877 714 HG12 VAL 89 2HG1 VAL 89 -8.663 26.424 -14.948 715 HG13 VAL 89 3HG1 VAL 89 -7.099 25.723 -14.535 716 HG21 VAL 89 3HG2 VAL 89 -6.666 24.893 -12.272 717 HG22 VAL 89 1HG2 VAL 89 -7.952 24.854 -11.065 718 HG23 VAL 89 2HG2 VAL 89 -7.194 26.387 -11.499 719 H ASN 90 H ASN 90 -9.674 27.098 -9.992 720 HA ASN 90 HA ASN 90 -8.282 29.621 -10.536 721 HB2 ASN 90 1HB ASN 90 -10.610 29.241 -8.636 722 HB3 ASN 90 2HB ASN 90 -9.594 30.671 -8.689 723 HD21 ASN 90 2HD2 ASN 90 -12.230 29.016 -10.067 724 HD22 ASN 90 1HD2 ASN 90 -12.604 30.169 -11.302 725 H GLY 91 H GLY 91 -6.315 28.896 -9.880 726 HA2 GLY 91 1HA GLY 91 -4.651 28.523 -8.327 727 HA3 GLY 91 2HA GLY 91 -5.858 28.715 -7.061 728 H ARG 92 H ARG 92 -6.262 26.985 -5.890 729 HA ARG 92 HA ARG 92 -5.739 24.339 -7.083 730 HB2 ARG 92 1HB ARG 92 -5.663 25.234 -4.198 731 HB3 ARG 92 2HB ARG 92 -5.521 23.556 -4.708 732 HG2 ARG 92 1HG ARG 92 -3.655 25.790 -5.478 733 HG3 ARG 92 2HG ARG 92 -3.340 24.549 -4.263 734 HD2 ARG 92 1HD ARG 92 -3.266 22.838 -5.881 735 HD3 ARG 92 2HD ARG 92 -4.001 23.862 -7.112 736 HE ARG 92 HE ARG 92 -1.566 25.001 -6.279 737 HH11 ARG 92 1HH1 ARG 92 -2.743 22.186 -8.025 738 HH12 ARG 92 2HH1 ARG 92 -1.389 22.140 -9.117 739 HH21 ARG 92 1HH2 ARG 92 0.207 24.955 -7.711 740 HH22 ARG 92 2HH2 ARG 92 0.285 23.728 -8.952 741 H SER 93 H SER 93 -8.175 26.223 -6.918 742 HA SER 93 HA SER 93 -10.050 24.144 -6.023 743 HB2 SER 93 1HB SER 93 -10.099 26.041 -4.466 744 HB3 SER 93 2HB SER 93 -10.373 27.150 -5.807 745 HG SER 93 HG SER 93 -12.310 25.686 -6.176 746 H ILE 94 H ILE 94 -11.887 23.842 -7.259 747 HA ILE 94 HA ILE 94 -11.818 25.084 -9.924 748 HB ILE 94 HB ILE 94 -12.940 22.412 -9.050 749 HG12 ILE 94 1HG1 ILE 94 -10.636 23.044 -10.908 750 HG13 ILE 94 2HG1 ILE 94 -10.439 22.660 -9.201 751 HG21 ILE 94 1HG2 ILE 94 -13.402 22.012 -11.418 752 HG22 ILE 94 2HG2 ILE 94 -12.869 23.649 -11.802 753 HG23 ILE 94 3HG2 ILE 94 -14.311 23.398 -10.816 754 HD11 ILE 94 3HD1 ILE 94 -11.538 20.850 -11.341 755 HD12 ILE 94 1HD1 ILE 94 -11.461 20.457 -9.622 756 HD13 ILE 94 2HD1 ILE 94 -9.972 20.722 -10.530 757 H ASP 95 H ASP 95 -13.477 26.325 -10.519 758 HA ASP 95 HA ASP 95 -15.765 26.507 -8.678 759 HB2 ASP 95 1HB ASP 95 -14.390 28.602 -10.351 760 HB3 ASP 95 2HB ASP 95 -16.001 28.849 -9.686 761 H ILE 96 H ILE 96 -17.664 27.651 -9.851 762 HA ILE 96 HA ILE 96 -18.121 26.250 -12.402 763 HB ILE 96 HB ILE 96 -20.120 26.581 -10.156 764 HG12 ILE 96 1HG1 ILE 96 -18.807 24.035 -11.121 765 HG13 ILE 96 2HG1 ILE 96 -18.214 24.959 -9.747 766 HG21 ILE 96 1HG2 ILE 96 -21.151 26.572 -12.360 767 HG22 ILE 96 2HG2 ILE 96 -21.522 25.081 -11.492 768 HG23 ILE 96 3HG2 ILE 96 -20.300 25.081 -12.764 769 HD11 ILE 96 3HD1 ILE 96 -19.563 23.101 -9.022 770 HD12 ILE 96 1HD1 ILE 96 -20.925 23.689 -9.977 771 HD13 ILE 96 2HD1 ILE 96 -20.337 24.630 -8.606 772 H GLU 97 H GLU 97 -18.149 27.849 -13.837 773 HA GLU 97 HA GLU 97 -19.528 30.357 -13.224 774 HB2 GLU 97 1HB GLU 97 -17.800 29.547 -15.573 775 HB3 GLU 97 2HB GLU 97 -18.526 31.135 -15.365 776 HG2 GLU 97 1HG GLU 97 -16.537 29.874 -13.494 777 HG3 GLU 97 2HG GLU 97 -16.164 31.081 -14.722 778 H TYR 98 H TYR 98 -20.499 31.191 -15.578 779 HA TYR 98 HA TYR 98 -22.212 29.040 -16.611 780 HB2 TYR 98 1HB TYR 98 -23.052 31.493 -15.193 781 HB3 TYR 98 2HB TYR 98 -23.940 31.126 -16.666 782 HD1 TYR 98 HD1 TYR 98 -23.083 29.880 -13.290 783 HD2 TYR 98 HD2 TYR 98 -25.514 29.325 -16.750 784 HE1 TYR 98 HE1 TYR 98 -24.504 28.305 -12.039 785 HE2 TYR 98 HE2 TYR 98 -26.931 27.753 -15.498 786 HH TYR 98 HH TYR 98 -26.829 26.318 -13.554 787 H TYR 99 H TYR 99 -22.736 29.179 -18.730 788 HA TYR 99 HA TYR 99 -22.009 31.628 -20.190 789 HB2 TYR 99 1HB TYR 99 -21.311 30.225 -22.117 790 HB3 TYR 99 2HB TYR 99 -20.286 29.986 -20.711 791 HD1 TYR 99 HD1 TYR 99 -23.071 28.480 -22.647 792 HD2 TYR 99 HD2 TYR 99 -19.994 27.850 -19.781 793 HE1 TYR 99 HE1 TYR 99 -23.430 26.055 -22.808 794 HE2 TYR 99 HE2 TYR 99 -20.347 25.424 -19.929 795 HH TYR 99 HH TYR 99 -21.826 23.816 -20.637 796 H GLU 100 H GLU 100 -23.283 31.947 -22.149 797 HA GLU 100 HA GLU 100 -26.023 31.318 -21.673 798 HB2 GLU 100 1HB GLU 100 -25.296 33.457 -22.671 799 HB3 GLU 100 2HB GLU 100 -24.742 32.593 -24.098 800 HG2 GLU 100 1HG GLU 100 -27.000 31.916 -24.613 801 HG3 GLU 100 2HG GLU 100 -27.591 32.659 -23.128 802 H CYS 101 H CYS 101 -27.319 29.865 -22.606 803 HA CYS 101 HA CYS 101 -26.353 27.502 -23.708 804 HB2 CYS 101 1HB CYS 101 -28.583 27.799 -22.666 805 HB3 CYS 101 2HB CYS 101 -29.102 28.717 -24.073 806 HA PRO 102 HA PRO 102 -25.283 28.936 -27.775 807 HB2 PRO 102 1HB PRO 102 -24.531 26.542 -28.808 808 HB3 PRO 102 2HB PRO 102 -23.537 27.458 -27.669 809 HG2 PRO 102 1HG PRO 102 -25.343 25.127 -27.162 810 HG3 PRO 102 2HG PRO 102 -23.730 25.459 -26.508 811 HD2 PRO 102 1HD PRO 102 -26.011 25.915 -25.111 812 HD3 PRO 102 2HD PRO 102 -24.539 26.882 -24.894 813 H VAL 103 H VAL 103 -27.898 26.868 -27.081 814 HA VAL 103 HA VAL 103 -28.708 26.266 -29.735 815 HB VAL 103 HB VAL 103 -29.528 25.171 -27.552 816 HG11 VAL 103 1HG1 VAL 103 -30.269 27.170 -26.401 817 HG12 VAL 103 2HG1 VAL 103 -31.627 26.075 -26.654 818 HG13 VAL 103 3HG1 VAL 103 -31.440 27.498 -27.679 819 HG21 VAL 103 3HG2 VAL 103 -30.354 24.543 -29.741 820 HG22 VAL 103 1HG2 VAL 103 -31.494 25.890 -29.721 821 HG23 VAL 103 2HG2 VAL 103 -31.675 24.564 -28.573 822 H LYS 104 H LYS 104 -28.857 29.105 -27.811 823 HA LYS 104 HA LYS 104 -31.011 30.414 -29.101 824 HB2 LYS 104 1HB LYS 104 -28.564 31.550 -27.727 825 HB3 LYS 104 2HB LYS 104 -29.939 32.509 -28.259 826 HG2 LYS 104 1HG LYS 104 -31.396 31.200 -26.754 827 HG3 LYS 104 2HG LYS 104 -29.971 30.335 -26.175 828 HD2 LYS 104 1HD LYS 104 -30.566 32.128 -24.642 829 HD3 LYS 104 2HD LYS 104 -29.009 32.460 -25.401 830 HE2 LYS 104 1HE LYS 104 -30.145 33.947 -27.007 831 HE3 LYS 104 2HE LYS 104 -31.673 33.642 -26.184 832 HZ1 LYS 104 3HZ LYS 104 -30.754 34.628 -24.178 833 HZ2 LYS 104 1HZ LYS 104 -30.674 35.723 -25.470 834 HZ3 LYS 104 2HZ LYS 104 -29.275 34.909 -24.959 835 H ARG 105 H ARG 105 -27.719 29.790 -29.929 836 HA ARG 105 HA ARG 105 -27.926 31.454 -32.321 837 HB2 ARG 105 1HB ARG 105 -25.623 29.955 -31.079 838 HB3 ARG 105 2HB ARG 105 -25.533 30.678 -32.680 839 HG2 ARG 105 1HG ARG 105 -26.241 32.223 -30.212 840 HG3 ARG 105 2HG ARG 105 -24.586 32.046 -30.804 841 HD2 ARG 105 1HD ARG 105 -26.917 33.344 -32.206 842 HD3 ARG 105 2HD ARG 105 -25.460 34.132 -31.605 843 HE ARG 105 HE ARG 105 -25.716 32.512 -34.026 844 HH11 ARG 105 1HH1 ARG 105 -23.638 34.302 -31.833 845 HH12 ARG 105 2HH1 ARG 105 -22.316 34.390 -32.965 846 HH21 ARG 105 1HH2 ARG 105 -24.010 32.673 -35.518 847 HH22 ARG 105 2HH2 ARG 105 -22.537 33.491 -35.079 848 H LYS 106 H LYS 106 -29.464 30.280 -33.376 849 HA LYS 106 HA LYS 106 -28.609 27.632 -34.330 850 HB2 LYS 106 1HB LYS 106 -31.148 27.290 -34.722 851 HB3 LYS 106 2HB LYS 106 -30.510 27.134 -33.094 852 HG2 LYS 106 1HG LYS 106 -32.526 28.345 -32.919 853 HG3 LYS 106 2HG LYS 106 -31.224 29.509 -32.691 854 HD2 LYS 106 1HD LYS 106 -32.926 30.468 -34.104 855 HD3 LYS 106 2HD LYS 106 -31.467 30.187 -35.055 856 HE2 LYS 106 1HE LYS 106 -33.420 29.527 -36.321 857 HE3 LYS 106 2HE LYS 106 -32.458 28.107 -35.919 858 HZ1 LYS 106 3HZ LYS 106 -34.918 27.881 -35.624 859 HZ2 LYS 106 1HZ LYS 106 -34.808 28.967 -34.331 860 HZ3 LYS 106 2HZ LYS 106 -33.999 27.479 -34.256 Start of MODEL 17 1 HA MET 1 HA MET 1 -14.265 -14.196 -18.049 2 HB2 MET 1 1HB MET 1 -13.170 -11.388 -18.300 3 HB3 MET 1 2HB MET 1 -13.186 -12.328 -16.816 4 HG2 MET 1 1HG MET 1 -11.698 -13.012 -19.340 5 HG3 MET 1 2HG MET 1 -10.999 -12.371 -17.855 6 HE1 MET 1 2HE MET 1 -9.856 -14.967 -19.254 7 HE2 MET 1 3HE MET 1 -9.640 -16.028 -17.863 8 HE3 MET 1 1HE MET 1 -9.227 -14.317 -17.739 9 H GLU 2 H GLU 2 -15.888 -14.059 -16.625 10 HA GLU 2 HA GLU 2 -17.820 -11.877 -17.013 11 HB2 GLU 2 1HB GLU 2 -18.315 -14.754 -16.243 12 HB3 GLU 2 2HB GLU 2 -19.542 -13.500 -16.153 13 HG2 GLU 2 1HG GLU 2 -19.966 -14.578 -18.165 14 HG3 GLU 2 2HG GLU 2 -19.090 -13.125 -18.635 15 HA PRO 3 HA PRO 3 -16.503 -11.359 -12.656 16 HB2 PRO 3 1HB PRO 3 -16.902 -8.526 -13.166 17 HB3 PRO 3 2HB PRO 3 -15.425 -9.368 -12.694 18 HG2 PRO 3 1HG PRO 3 -15.789 -8.241 -15.146 19 HG3 PRO 3 2HG PRO 3 -14.735 -9.638 -14.862 20 HD2 PRO 3 1HD PRO 3 -17.515 -9.550 -15.968 21 HD3 PRO 3 2HD PRO 3 -16.133 -10.550 -16.465 22 H ILE 4 H ILE 4 -18.654 -12.376 -12.420 23 HA ILE 4 HA ILE 4 -20.940 -10.578 -12.353 24 HB ILE 4 HB ILE 4 -20.817 -13.522 -11.679 25 HG12 ILE 4 1HG1 ILE 4 -21.706 -12.223 -14.266 26 HG13 ILE 4 2HG1 ILE 4 -20.140 -12.996 -14.036 27 HG21 ILE 4 1HG2 ILE 4 -23.249 -13.447 -12.051 28 HG22 ILE 4 2HG2 ILE 4 -23.142 -11.701 -12.278 29 HG23 ILE 4 3HG2 ILE 4 -22.738 -12.414 -10.716 30 HD11 ILE 4 3HD1 ILE 4 -21.681 -14.473 -15.182 31 HD12 ILE 4 1HD1 ILE 4 -22.829 -14.339 -13.849 32 HD13 ILE 4 2HD1 ILE 4 -21.270 -15.123 -13.594 33 H GLY 5 H GLY 5 -19.216 -12.771 -10.161 34 HA2 GLY 5 1HA GLY 5 -20.140 -11.089 -7.926 35 HA3 GLY 5 2HA GLY 5 -20.359 -12.828 -7.863 36 H ARG 6 H ARG 6 -18.008 -10.222 -7.850 37 HA ARG 6 HA ARG 6 -15.840 -11.982 -7.152 38 HB2 ARG 6 1HB ARG 6 -14.583 -9.903 -6.643 39 HB3 ARG 6 2HB ARG 6 -15.267 -9.912 -8.259 40 HG2 ARG 6 1HG ARG 6 -16.978 -8.378 -7.627 41 HG3 ARG 6 2HG ARG 6 -16.543 -8.514 -5.921 42 HD2 ARG 6 1HD ARG 6 -15.664 -6.453 -6.797 43 HD3 ARG 6 2HD ARG 6 -14.331 -7.548 -6.447 44 HE ARG 6 HE ARG 6 -15.358 -7.357 -9.188 45 HH11 ARG 6 1HH1 ARG 6 -12.779 -6.888 -6.879 46 HH12 ARG 6 2HH1 ARG 6 -11.582 -6.521 -8.088 47 HH21 ARG 6 1HH2 ARG 6 -13.781 -6.857 -10.798 48 HH22 ARG 6 2HH2 ARG 6 -12.159 -6.480 -10.302 49 H SER 7 H SER 7 -16.083 -13.098 -5.346 50 HA SER 7 HA SER 7 -17.245 -11.755 -3.004 51 HB2 SER 7 1HB SER 7 -17.696 -14.231 -2.335 52 HB3 SER 7 2HB SER 7 -18.712 -13.480 -3.566 53 HG SER 7 HG SER 7 -17.859 -14.724 -5.063 54 H LEU 8 H LEU 8 -14.402 -11.748 -3.777 55 HA LEU 8 HA LEU 8 -13.037 -13.493 -1.932 56 HB2 LEU 8 1HB LEU 8 -12.075 -11.087 -3.481 57 HB3 LEU 8 2HB LEU 8 -11.041 -12.135 -2.531 58 HG LEU 8 HG LEU 8 -12.604 -12.954 -4.981 59 HD11 LEU 8 1HD1 LEU 8 -10.724 -11.495 -5.489 60 HD12 LEU 8 2HD1 LEU 8 -10.398 -13.145 -6.022 61 HD13 LEU 8 3HD1 LEU 8 -9.649 -12.530 -4.547 62 HD21 LEU 8 3HD2 LEU 8 -12.411 -14.790 -3.408 63 HD22 LEU 8 1HD2 LEU 8 -10.678 -14.502 -3.249 64 HD23 LEU 8 2HD2 LEU 8 -11.344 -15.057 -4.787 65 H GLN 9 H GLN 9 -14.293 -10.273 -1.967 66 HA GLN 9 HA GLN 9 -13.140 -9.716 0.668 67 HB2 GLN 9 1HB GLN 9 -12.702 -8.024 -1.029 68 HB3 GLN 9 2HB GLN 9 -14.421 -7.897 -1.379 69 HG2 GLN 9 1HG GLN 9 -14.771 -7.111 0.946 70 HG3 GLN 9 2HG GLN 9 -13.021 -7.103 1.153 71 HE21 GLN 9 2HE2 GLN 9 -11.799 -5.531 0.166 72 HE22 GLN 9 1HE2 GLN 9 -12.499 -4.132 -0.568 73 H GLY 10 H GLY 10 -14.419 -10.342 2.270 74 HA2 GLY 10 1HA GLY 10 -17.307 -10.376 2.010 75 HA3 GLY 10 2HA GLY 10 -16.375 -10.849 3.425 76 H VAL 11 H VAL 11 -18.184 -9.613 4.493 77 HA VAL 11 HA VAL 11 -18.040 -6.727 4.247 78 HB VAL 11 HB VAL 11 -19.527 -8.344 6.323 79 HG11 VAL 11 1HG1 VAL 11 -19.851 -5.494 5.395 80 HG12 VAL 11 2HG1 VAL 11 -19.215 -6.018 6.954 81 HG13 VAL 11 3HG1 VAL 11 -20.904 -6.319 6.543 82 HG21 VAL 11 3HG2 VAL 11 -21.493 -8.104 4.918 83 HG22 VAL 11 1HG2 VAL 11 -20.220 -8.954 4.044 84 HG23 VAL 11 2HG2 VAL 11 -20.543 -7.254 3.699 85 H THR 12 H THR 12 -15.958 -6.211 4.818 86 HA THR 12 HA THR 12 -15.185 -6.740 7.596 87 HB THR 12 HB THR 12 -12.936 -5.834 6.852 88 HG1 THR 12 HG1 THR 12 -13.743 -4.779 4.939 89 HG21 THR 12 3HG2 THR 12 -13.336 -8.230 7.081 90 HG22 THR 12 1HG2 THR 12 -12.289 -7.907 5.698 91 HG23 THR 12 2HG2 THR 12 -13.992 -8.289 5.444 92 H GLY 13 H GLY 13 -16.489 -5.235 8.599 93 HA2 GLY 13 1HA GLY 13 -16.787 -3.161 9.585 94 HA3 GLY 13 2HA GLY 13 -15.554 -2.508 8.513 95 H ARG 14 H ARG 14 -17.166 -0.718 8.464 96 HA ARG 14 HA ARG 14 -18.909 -1.070 6.150 97 HB2 ARG 14 1HB ARG 14 -19.814 0.062 8.806 98 HB3 ARG 14 2HB ARG 14 -20.640 0.417 7.300 99 HG2 ARG 14 1HG ARG 14 -21.887 -1.291 8.276 100 HG3 ARG 14 2HG ARG 14 -20.913 -2.108 7.055 101 HD2 ARG 14 1HD ARG 14 -19.430 -2.973 8.677 102 HD3 ARG 14 2HD ARG 14 -20.076 -1.918 9.936 103 HE ARG 14 HE ARG 14 -21.998 -3.757 8.803 104 HH11 ARG 14 1HH1 ARG 14 -19.547 -3.275 11.260 105 HH12 ARG 14 2HH1 ARG 14 -20.222 -4.447 12.350 106 HH21 ARG 14 1HH2 ARG 14 -22.865 -5.333 10.213 107 HH22 ARG 14 2HH2 ARG 14 -22.095 -5.632 11.747 108 HA PRO 15 HA PRO 15 -16.413 2.808 5.930 109 HB2 PRO 15 1HB PRO 15 -15.388 2.346 3.494 110 HB3 PRO 15 2HB PRO 15 -14.653 1.692 4.960 111 HG2 PRO 15 1HG PRO 15 -16.445 0.344 2.976 112 HG3 PRO 15 2HG PRO 15 -14.976 -0.276 3.756 113 HD2 PRO 15 1HD PRO 15 -17.488 -0.910 4.598 114 HD3 PRO 15 2HD PRO 15 -16.086 -0.841 5.681 115 H ASP 16 H ASP 16 -18.951 3.132 5.782 116 HA ASP 16 HA ASP 16 -20.106 3.436 3.213 117 HB2 ASP 16 1HB ASP 16 -20.852 4.210 5.974 118 HB3 ASP 16 2HB ASP 16 -21.604 5.125 4.670 119 H PHE 17 H PHE 17 -18.126 5.499 5.198 120 HA PHE 17 HA PHE 17 -18.645 7.967 3.981 121 HB2 PHE 17 1HB PHE 17 -17.309 7.725 6.041 122 HB3 PHE 17 2HB PHE 17 -16.029 6.946 5.118 123 HD1 PHE 17 HD1 PHE 17 -17.788 10.114 5.730 124 HD2 PHE 17 HD2 PHE 17 -14.479 8.221 3.837 125 HE1 PHE 17 HE1 PHE 17 -16.776 12.317 5.310 126 HE2 PHE 17 HE2 PHE 17 -13.458 10.421 3.411 127 HZ PHE 17 HZ PHE 17 -14.614 12.472 4.145 128 H GLN 18 H GLN 18 -16.211 5.489 3.201 129 HA GLN 18 HA GLN 18 -15.229 6.909 0.937 130 HB2 GLN 18 1HB GLN 18 -13.779 5.097 0.575 131 HB3 GLN 18 2HB GLN 18 -13.975 5.156 2.312 132 HG2 GLN 18 1HG GLN 18 -14.159 2.912 1.952 133 HG3 GLN 18 2HG GLN 18 -15.851 3.392 1.877 134 HE21 GLN 18 2HE2 GLN 18 -13.494 3.939 -0.693 135 HE22 GLN 18 1HE2 GLN 18 -14.241 2.888 -1.834 136 H LYS 19 H LYS 19 -17.786 4.606 1.473 137 HA LYS 19 HA LYS 19 -18.124 3.750 -1.183 138 HB2 LYS 19 1HB LYS 19 -19.995 3.877 1.161 139 HB3 LYS 19 2HB LYS 19 -20.541 3.319 -0.415 140 HG2 LYS 19 1HG LYS 19 -18.664 1.642 -0.335 141 HG3 LYS 19 2HG LYS 19 -18.445 2.101 1.354 142 HD2 LYS 19 1HD LYS 19 -19.847 0.109 1.165 143 HD3 LYS 19 2HD LYS 19 -20.764 1.464 1.828 144 HE2 LYS 19 1HE LYS 19 -22.058 0.214 0.151 145 HE3 LYS 19 2HE LYS 19 -21.769 1.879 -0.352 146 HZ1 LYS 19 3HZ LYS 19 -20.239 -0.498 -1.284 147 HZ2 LYS 19 1HZ LYS 19 -19.974 1.105 -1.774 148 HZ3 LYS 19 2HZ LYS 19 -21.425 0.325 -2.171 149 H ARG 20 H ARG 20 -19.748 6.386 0.599 150 HA ARG 20 HA ARG 20 -21.241 7.280 -1.662 151 HB2 ARG 20 1HB ARG 20 -20.412 9.115 0.566 152 HB3 ARG 20 2HB ARG 20 -21.915 9.093 -0.345 153 HG2 ARG 20 1HG ARG 20 -22.437 6.912 0.754 154 HG3 ARG 20 2HG ARG 20 -21.014 7.179 1.767 155 HD2 ARG 20 1HD ARG 20 -23.341 9.093 1.555 156 HD3 ARG 20 2HD ARG 20 -23.177 7.874 2.818 157 HE ARG 20 HE ARG 20 -21.160 9.044 3.543 158 HH11 ARG 20 1HH1 ARG 20 -23.358 10.784 1.438 159 HH12 ARG 20 2HH1 ARG 20 -22.806 12.354 1.959 160 HH21 ARG 20 1HH2 ARG 20 -20.460 11.080 4.245 161 HH22 ARG 20 2HH2 ARG 20 -21.182 12.525 3.587 162 H LEU 21 H LEU 21 -18.218 8.177 -0.173 163 HA LEU 21 HA LEU 21 -17.465 10.349 -1.731 164 HB2 LEU 21 1HB LEU 21 -16.146 9.772 0.154 165 HB3 LEU 21 2HB LEU 21 -15.843 8.158 -0.458 166 HG LEU 21 HG LEU 21 -14.490 9.161 -2.290 167 HD11 LEU 21 1HD1 LEU 21 -14.834 11.704 -0.700 168 HD12 LEU 21 2HD1 LEU 21 -15.498 11.389 -2.303 169 HD13 LEU 21 3HD1 LEU 21 -13.751 11.480 -2.073 170 HD21 LEU 21 3HD2 LEU 21 -12.558 9.666 -0.881 171 HD22 LEU 21 1HD2 LEU 21 -13.438 8.259 -0.288 172 HD23 LEU 21 2HD2 LEU 21 -13.615 9.816 0.521 173 H GLU 22 H GLU 22 -16.759 6.911 -2.365 174 HA GLU 22 HA GLU 22 -15.693 7.427 -4.954 175 HB2 GLU 22 1HB GLU 22 -16.570 4.888 -3.583 176 HB3 GLU 22 2HB GLU 22 -15.868 4.918 -5.197 177 HG2 GLU 22 1HG GLU 22 -14.547 5.902 -2.681 178 HG3 GLU 22 2HG GLU 22 -14.208 4.384 -3.507 179 H GLN 23 H GLN 23 -18.891 6.707 -3.732 180 HA GLN 23 HA GLN 23 -20.109 5.949 -6.144 181 HB2 GLN 23 1HB GLN 23 -21.118 5.844 -3.824 182 HB3 GLN 23 2HB GLN 23 -21.411 7.569 -3.954 183 HG2 GLN 23 1HG GLN 23 -23.412 6.360 -4.492 184 HG3 GLN 23 2HG GLN 23 -22.800 7.172 -5.932 185 HE21 GLN 23 2HE2 GLN 23 -21.441 4.226 -4.594 186 HE22 GLN 23 1HE2 GLN 23 -21.895 3.199 -5.911 187 H MET 24 H MET 24 -19.923 9.140 -4.572 188 HA MET 24 HA MET 24 -20.977 10.540 -6.791 189 HB2 MET 24 1HB MET 24 -20.121 12.571 -5.708 190 HB3 MET 24 2HB MET 24 -21.022 11.554 -4.598 191 HG2 MET 24 1HG MET 24 -18.893 10.716 -3.694 192 HG3 MET 24 2HG MET 24 -18.028 11.811 -4.769 193 HE1 MET 24 3HE MET 24 -19.890 14.353 -4.737 194 HE2 MET 24 1HE MET 24 -18.139 14.500 -4.553 195 HE3 MET 24 2HE MET 24 -19.218 15.312 -3.418 196 H LYS 25 H LYS 25 -17.700 9.696 -5.837 197 HA LYS 25 HA LYS 25 -16.223 11.080 -7.738 198 HB2 LYS 25 1HB LYS 25 -15.322 9.654 -5.868 199 HB3 LYS 25 2HB LYS 25 -15.720 8.239 -6.832 200 HG2 LYS 25 1HG LYS 25 -13.495 8.504 -7.298 201 HG3 LYS 25 2HG LYS 25 -14.232 9.392 -8.633 202 HD2 LYS 25 1HD LYS 25 -12.465 10.744 -7.796 203 HD3 LYS 25 2HD LYS 25 -13.972 11.474 -7.243 204 HE2 LYS 25 1HE LYS 25 -12.276 11.420 -5.466 205 HE3 LYS 25 2HE LYS 25 -13.698 10.462 -5.055 206 HZ1 LYS 25 3HZ LYS 25 -12.547 8.465 -5.509 207 HZ2 LYS 25 1HZ LYS 25 -11.510 9.393 -4.548 208 HZ3 LYS 25 2HZ LYS 25 -11.234 9.279 -6.217 209 H GLU 26 H GLU 26 -17.667 7.856 -7.978 210 HA GLU 26 HA GLU 26 -17.005 7.236 -10.614 211 HB2 GLU 26 1HB GLU 26 -17.922 5.636 -8.975 212 HB3 GLU 26 2HB GLU 26 -19.470 6.466 -9.033 213 HG2 GLU 26 1HG GLU 26 -19.722 4.569 -10.368 214 HG3 GLU 26 2HG GLU 26 -19.514 5.905 -11.500 215 H LYS 27 H LYS 27 -19.872 8.814 -9.291 216 HA LYS 27 HA LYS 27 -21.296 9.146 -11.666 217 HB2 LYS 27 1HB LYS 27 -21.286 10.775 -9.133 218 HB3 LYS 27 2HB LYS 27 -22.435 11.028 -10.439 219 HG2 LYS 27 1HG LYS 27 -22.997 8.532 -10.139 220 HG3 LYS 27 2HG LYS 27 -22.155 8.682 -8.594 221 HD2 LYS 27 1HD LYS 27 -24.508 9.024 -8.238 222 HD3 LYS 27 2HD LYS 27 -23.668 10.561 -8.016 223 HE2 LYS 27 1HE LYS 27 -25.694 10.894 -9.303 224 HE3 LYS 27 2HE LYS 27 -24.278 11.204 -10.306 225 HZ1 LYS 27 3HZ LYS 27 -26.037 8.819 -10.340 226 HZ2 LYS 27 1HZ LYS 27 -24.533 8.860 -11.130 227 HZ3 LYS 27 2HZ LYS 27 -25.762 9.928 -11.592 228 H VAL 28 H VAL 28 -18.902 11.236 -10.129 229 HA VAL 28 HA VAL 28 -19.304 13.421 -11.886 230 HB VAL 28 HB VAL 28 -16.927 12.756 -10.137 231 HG11 VAL 28 1HG1 VAL 28 -16.320 15.104 -10.358 232 HG12 VAL 28 2HG1 VAL 28 -17.664 15.354 -11.472 233 HG13 VAL 28 3HG1 VAL 28 -16.321 14.307 -11.932 234 HG21 VAL 28 3HG2 VAL 28 -19.245 14.639 -9.693 235 HG22 VAL 28 1HG2 VAL 28 -17.899 14.361 -8.587 236 HG23 VAL 28 2HG2 VAL 28 -19.050 13.062 -8.927 237 H MET 29 H MET 29 -17.131 10.628 -11.969 238 HA MET 29 HA MET 29 -15.788 11.632 -14.338 239 HB2 MET 29 1HB MET 29 -14.519 9.562 -14.319 240 HB3 MET 29 2HB MET 29 -14.546 10.260 -12.707 241 HG2 MET 29 1HG MET 29 -16.278 8.671 -12.049 242 HG3 MET 29 2HG MET 29 -16.247 7.972 -13.667 243 HE1 MET 29 3HE MET 29 -13.193 9.276 -11.567 244 HE2 MET 29 1HE MET 29 -12.702 7.809 -10.721 245 HE3 MET 29 2HE MET 29 -14.252 8.561 -10.352 246 H LYS 30 H LYS 30 -18.739 10.366 -13.794 247 HA LYS 30 HA LYS 30 -18.929 8.823 -16.257 248 HB2 LYS 30 1HB LYS 30 -20.360 8.922 -13.799 249 HB3 LYS 30 2HB LYS 30 -21.479 9.369 -15.077 250 HG2 LYS 30 1HG LYS 30 -21.605 7.006 -14.668 251 HG3 LYS 30 2HG LYS 30 -20.915 7.292 -16.266 252 HD2 LYS 30 1HD LYS 30 -18.734 6.759 -15.522 253 HD3 LYS 30 2HD LYS 30 -19.220 6.822 -13.826 254 HE2 LYS 30 1HE LYS 30 -20.631 4.868 -14.142 255 HE3 LYS 30 2HE LYS 30 -20.200 4.815 -15.851 256 HZ1 LYS 30 3HZ LYS 30 -18.204 4.586 -13.662 257 HZ2 LYS 30 1HZ LYS 30 -17.984 4.250 -15.308 258 HZ3 LYS 30 2HZ LYS 30 -18.967 3.245 -14.373 259 H ASP 31 H ASP 31 -19.115 12.027 -15.284 260 HA ASP 31 HA ASP 31 -21.231 12.826 -17.092 261 HB2 ASP 31 1HB ASP 31 -20.955 13.947 -14.907 262 HB3 ASP 31 2HB ASP 31 -19.373 14.528 -15.423 263 H GLN 32 H GLN 32 -21.003 13.816 -19.000 264 HA GLN 32 HA GLN 32 -18.647 13.390 -20.493 265 HB2 GLN 32 1HB GLN 32 -21.036 15.127 -21.135 266 HB3 GLN 32 2HB GLN 32 -19.816 14.603 -22.287 267 HG2 GLN 32 1HG GLN 32 -21.685 12.801 -20.766 268 HG3 GLN 32 2HG GLN 32 -21.861 13.285 -22.452 269 HE21 GLN 32 2HE2 GLN 32 -20.463 12.451 -23.990 270 HE22 GLN 32 1HE2 GLN 32 -19.489 11.041 -23.696 271 H ASP 33 H ASP 33 -20.111 16.343 -19.171 272 HA ASP 33 HA ASP 33 -18.286 18.162 -20.325 273 HB2 ASP 33 1HB ASP 33 -19.968 18.433 -17.817 274 HB3 ASP 33 2HB ASP 33 -19.111 19.756 -18.595 275 H VAL 34 H VAL 34 -18.420 16.600 -17.160 276 HA VAL 34 HA VAL 34 -16.261 17.860 -15.955 277 HB VAL 34 HB VAL 34 -17.371 15.087 -15.564 278 HG11 VAL 34 1HG1 VAL 34 -16.094 14.963 -13.498 279 HG12 VAL 34 2HG1 VAL 34 -15.301 16.492 -13.881 280 HG13 VAL 34 3HG1 VAL 34 -15.023 15.074 -14.896 281 HG21 VAL 34 3HG2 VAL 34 -18.838 16.913 -14.964 282 HG22 VAL 34 1HG2 VAL 34 -17.570 17.638 -13.976 283 HG23 VAL 34 2HG2 VAL 34 -18.270 16.086 -13.514 284 H GLN 35 H GLN 35 -16.210 14.716 -17.684 285 HA GLN 35 HA GLN 35 -13.413 14.403 -17.377 286 HB2 GLN 35 1HB GLN 35 -13.643 12.633 -19.118 287 HB3 GLN 35 2HB GLN 35 -14.714 12.448 -17.737 288 HG2 GLN 35 1HG GLN 35 -16.492 13.555 -19.135 289 HG3 GLN 35 2HG GLN 35 -15.394 13.367 -20.507 290 HE21 GLN 35 2HE2 GLN 35 -17.282 11.724 -18.103 291 HE22 GLN 35 1HE2 GLN 35 -17.340 10.189 -18.901 292 H ALA 36 H ALA 36 -15.357 15.918 -19.853 293 HA ALA 36 HA ALA 36 -13.324 16.308 -21.766 294 HB1 ALA 36 1HB ALA 36 -15.699 16.701 -22.242 295 HB2 ALA 36 2HB ALA 36 -14.719 18.116 -22.626 296 HB3 ALA 36 3HB ALA 36 -15.685 18.085 -21.149 297 H PHE 37 H PHE 37 -14.335 18.167 -18.944 298 HA PHE 37 HA PHE 37 -12.461 20.273 -19.270 299 HB2 PHE 37 1HB PHE 37 -14.473 20.552 -17.933 300 HB3 PHE 37 2HB PHE 37 -13.940 19.290 -16.828 301 HD1 PHE 37 HD1 PHE 37 -13.068 22.658 -18.104 302 HD2 PHE 37 HD2 PHE 37 -12.625 19.799 -14.985 303 HE1 PHE 37 HE1 PHE 37 -11.964 24.358 -16.707 304 HE2 PHE 37 HE2 PHE 37 -11.525 21.495 -13.582 305 HZ PHE 37 HZ PHE 37 -11.191 23.779 -14.444 306 H LEU 38 H LEU 38 -12.410 17.190 -17.560 307 HA LEU 38 HA LEU 38 -10.066 17.483 -16.095 308 HB2 LEU 38 1HB LEU 38 -11.674 15.249 -17.077 309 HB3 LEU 38 2HB LEU 38 -9.974 14.854 -16.902 310 HG LEU 38 HG LEU 38 -11.072 14.236 -14.883 311 HD11 LEU 38 1HD1 LEU 38 -9.604 16.835 -14.476 312 HD12 LEU 38 2HD1 LEU 38 -8.871 15.237 -14.627 313 HD13 LEU 38 3HD1 LEU 38 -9.897 15.609 -13.241 314 HD21 LEU 38 3HD2 LEU 38 -12.145 17.052 -14.766 315 HD22 LEU 38 1HD2 LEU 38 -12.346 15.816 -13.523 316 HD23 LEU 38 2HD2 LEU 38 -13.081 15.595 -15.112 317 H LYS 39 H LYS 39 -10.459 16.286 -19.404 318 HA LYS 39 HA LYS 39 -7.617 15.958 -19.736 319 HB2 LYS 39 1HB LYS 39 -8.231 15.493 -22.140 320 HB3 LYS 39 2HB LYS 39 -8.943 14.414 -20.949 321 HG2 LYS 39 1HG LYS 39 -11.053 15.612 -21.100 322 HG3 LYS 39 2HG LYS 39 -10.343 16.745 -22.252 323 HD2 LYS 39 1HD LYS 39 -11.707 14.981 -23.333 324 HD3 LYS 39 2HD LYS 39 -10.024 14.982 -23.865 325 HE2 LYS 39 1HE LYS 39 -10.742 12.713 -23.501 326 HE3 LYS 39 2HE LYS 39 -9.559 13.150 -22.271 327 HZ1 LYS 39 3HZ LYS 39 -11.462 13.597 -20.758 328 HZ2 LYS 39 1HZ LYS 39 -11.322 11.974 -21.233 329 HZ3 LYS 39 2HZ LYS 39 -12.506 12.963 -21.939 330 H GLU 40 H GLU 40 -9.916 18.448 -20.224 331 HA GLU 40 HA GLU 40 -8.501 20.098 -22.013 332 HB2 GLU 40 1HB GLU 40 -10.856 20.412 -21.381 333 HB3 GLU 40 2HB GLU 40 -10.356 20.848 -19.759 334 HG2 GLU 40 1HG GLU 40 -10.906 22.799 -21.053 335 HG3 GLU 40 2HG GLU 40 -9.203 22.801 -20.620 336 H ASN 41 H ASN 41 -8.740 20.247 -18.475 337 HA ASN 41 HA ASN 41 -6.359 21.975 -18.474 338 HB2 ASN 41 1HB ASN 41 -8.635 21.643 -16.535 339 HB3 ASN 41 2HB ASN 41 -7.141 22.455 -16.073 340 HD21 ASN 41 2HD2 ASN 41 -9.999 22.607 -18.040 341 HD22 ASN 41 1HD2 ASN 41 -9.841 24.269 -18.490 342 H GLU 42 H GLU 42 -6.143 19.126 -18.744 343 HA GLU 42 HA GLU 42 -5.438 17.835 -16.355 344 HB2 GLU 42 1HB GLU 42 -4.092 16.329 -17.831 345 HB3 GLU 42 2HB GLU 42 -5.758 16.544 -18.352 346 HG2 GLU 42 1HG GLU 42 -5.084 18.054 -20.084 347 HG3 GLU 42 2HG GLU 42 -3.426 18.065 -19.489 348 H GLU 43 H GLU 43 -3.829 20.275 -18.128 349 HA GLU 43 HA GLU 43 -1.191 19.682 -17.097 350 HB2 GLU 43 1HB GLU 43 -1.759 20.697 -19.391 351 HB3 GLU 43 2HB GLU 43 -2.032 22.198 -18.523 352 HG2 GLU 43 1HG GLU 43 0.169 22.286 -19.377 353 HG3 GLU 43 2HG GLU 43 0.304 22.006 -17.640 354 H VAL 44 H VAL 44 -3.949 21.329 -16.012 355 HA VAL 44 HA VAL 44 -2.341 23.172 -14.363 356 HB VAL 44 HB VAL 44 -5.267 23.429 -15.079 357 HG11 VAL 44 1HG1 VAL 44 -3.367 25.349 -13.732 358 HG12 VAL 44 2HG1 VAL 44 -4.717 24.503 -12.971 359 HG13 VAL 44 3HG1 VAL 44 -5.025 25.717 -14.213 360 HG21 VAL 44 3HG2 VAL 44 -4.552 25.242 -16.577 361 HG22 VAL 44 1HG2 VAL 44 -3.879 23.684 -17.061 362 HG23 VAL 44 2HG2 VAL 44 -2.867 24.860 -16.222 363 H ILE 45 H ILE 45 -5.056 20.921 -14.305 364 HA ILE 45 HA ILE 45 -5.602 21.325 -11.504 365 HB ILE 45 HB ILE 45 -6.602 19.139 -13.329 366 HG12 ILE 45 1HG1 ILE 45 -7.919 21.774 -12.655 367 HG13 ILE 45 2HG1 ILE 45 -7.087 21.437 -14.170 368 HG21 ILE 45 1HG2 ILE 45 -7.667 20.205 -10.722 369 HG22 ILE 45 2HG2 ILE 45 -6.921 18.630 -10.983 370 HG23 ILE 45 3HG2 ILE 45 -8.469 19.009 -11.739 371 HD11 ILE 45 3HD1 ILE 45 -8.678 19.681 -14.677 372 HD12 ILE 45 1HD1 ILE 45 -9.501 21.215 -14.391 373 HD13 ILE 45 2HD1 ILE 45 -9.499 19.968 -13.142 374 H ASP 46 H ASP 46 -5.124 19.992 -9.800 375 HA ASP 46 HA ASP 46 -3.234 17.784 -10.286 376 HB2 ASP 46 1HB ASP 46 -2.518 19.645 -8.741 377 HB3 ASP 46 2HB ASP 46 -3.835 19.182 -7.671 378 H GLN 47 H GLN 47 -3.483 15.906 -8.788 379 HA GLN 47 HA GLN 47 -6.016 14.742 -8.879 380 HB2 GLN 47 1HB GLN 47 -3.647 14.169 -7.109 381 HB3 GLN 47 2HB GLN 47 -5.065 13.127 -7.204 382 HG2 GLN 47 1HG GLN 47 -4.584 12.954 -9.686 383 HG3 GLN 47 2HG GLN 47 -3.027 13.707 -9.332 384 HE21 GLN 47 2HE2 GLN 47 -1.822 11.923 -9.897 385 HE22 GLN 47 1HE2 GLN 47 -1.810 10.467 -8.958 386 H LYS 48 H LYS 48 -4.342 16.404 -6.223 387 HA LYS 48 HA LYS 48 -6.363 15.940 -4.282 388 HB2 LYS 48 1HB LYS 48 -4.276 18.119 -4.403 389 HB3 LYS 48 2HB LYS 48 -5.225 17.701 -2.991 390 HG2 LYS 48 1HG LYS 48 -3.090 16.082 -4.346 391 HG3 LYS 48 2HG LYS 48 -3.098 16.713 -2.700 392 HD2 LYS 48 1HD LYS 48 -4.947 14.572 -3.760 393 HD3 LYS 48 2HD LYS 48 -3.501 14.282 -2.797 394 HE2 LYS 48 1HE LYS 48 -5.908 15.866 -1.904 395 HE3 LYS 48 2HE LYS 48 -5.567 14.195 -1.459 396 HZ1 LYS 48 3HZ LYS 48 -3.455 15.028 -0.459 397 HZ2 LYS 48 1HZ LYS 48 -4.865 15.573 0.310 398 HZ3 LYS 48 2HZ LYS 48 -4.011 16.610 -0.722 399 H MET 49 H MET 49 -5.707 18.527 -6.527 400 HA MET 49 HA MET 49 -7.644 20.367 -5.765 401 HB2 MET 49 1HB MET 49 -5.799 20.522 -7.563 402 HB3 MET 49 2HB MET 49 -6.957 19.761 -8.635 403 HG2 MET 49 1HG MET 49 -8.491 21.634 -8.298 404 HG3 MET 49 2HG MET 49 -7.310 22.392 -7.229 405 HE1 MET 49 3HE MET 49 -7.067 24.646 -10.428 406 HE2 MET 49 1HE MET 49 -7.274 24.630 -8.676 407 HE3 MET 49 2HE MET 49 -8.512 23.929 -9.718 408 H ILE 50 H ILE 50 -7.897 17.460 -7.727 409 HA ILE 50 HA ILE 50 -10.550 17.794 -8.615 410 HB ILE 50 HB ILE 50 -8.879 15.318 -8.205 411 HG12 ILE 50 1HG1 ILE 50 -8.141 16.838 -9.968 412 HG13 ILE 50 2HG1 ILE 50 -8.759 15.339 -10.653 413 HG21 ILE 50 1HG2 ILE 50 -11.185 14.650 -7.969 414 HG22 ILE 50 2HG2 ILE 50 -10.566 14.109 -9.531 415 HG23 ILE 50 3HG2 ILE 50 -11.620 15.520 -9.442 416 HD11 ILE 50 3HD1 ILE 50 -10.841 16.434 -11.225 417 HD12 ILE 50 1HD1 ILE 50 -9.475 17.304 -11.920 418 HD13 ILE 50 2HD1 ILE 50 -10.281 17.931 -10.482 419 H GLU 51 H GLU 51 -9.276 15.867 -5.891 420 HA GLU 51 HA GLU 51 -11.805 15.050 -4.978 421 HB2 GLU 51 1HB GLU 51 -10.583 14.572 -2.835 422 HB3 GLU 51 2HB GLU 51 -9.969 13.777 -4.270 423 HG2 GLU 51 1HG GLU 51 -7.994 14.428 -3.445 424 HG3 GLU 51 2HG GLU 51 -8.406 15.960 -4.214 425 H LYS 52 H LYS 52 -9.717 17.685 -3.982 426 HA LYS 52 HA LYS 52 -11.249 18.719 -1.918 427 HB2 LYS 52 1HB LYS 52 -8.974 19.476 -2.446 428 HB3 LYS 52 2HB LYS 52 -9.569 20.251 -3.906 429 HG2 LYS 52 1HG LYS 52 -9.449 22.036 -2.488 430 HG3 LYS 52 2HG LYS 52 -11.120 21.535 -2.240 431 HD2 LYS 52 1HD LYS 52 -8.811 20.725 -0.477 432 HD3 LYS 52 2HD LYS 52 -9.891 22.076 -0.144 433 HE2 LYS 52 1HE LYS 52 -10.643 19.162 -0.324 434 HE3 LYS 52 2HE LYS 52 -10.559 20.138 1.139 435 HZ1 LYS 52 3HZ LYS 52 -12.823 19.992 0.521 436 HZ2 LYS 52 1HZ LYS 52 -12.496 20.394 -1.094 437 HZ3 LYS 52 2HZ LYS 52 -12.327 21.566 0.116 438 H SER 53 H SER 53 -11.726 19.058 -5.389 439 HA SER 53 HA SER 53 -13.974 20.879 -4.840 440 HB2 SER 53 1HB SER 53 -13.824 21.492 -7.241 441 HB3 SER 53 2HB SER 53 -12.334 21.831 -6.358 442 HG SER 53 HG SER 53 -11.395 20.038 -7.266 443 H LEU 54 H LEU 54 -13.706 17.757 -4.888 444 HA LEU 54 HA LEU 54 -15.246 16.753 -6.989 445 HB2 LEU 54 1HB LEU 54 -13.931 15.374 -5.423 446 HB3 LEU 54 2HB LEU 54 -15.076 15.740 -4.148 447 HG LEU 54 HG LEU 54 -16.845 14.582 -5.421 448 HD11 LEU 54 1HD1 LEU 54 -14.605 13.875 -7.307 449 HD12 LEU 54 2HD1 LEU 54 -15.989 14.907 -7.666 450 HD13 LEU 54 3HD1 LEU 54 -16.231 13.192 -7.337 451 HD21 LEU 54 3HD2 LEU 54 -16.010 12.315 -5.066 452 HD22 LEU 54 1HD2 LEU 54 -15.587 13.378 -3.725 453 HD23 LEU 54 2HD2 LEU 54 -14.367 12.942 -4.922 454 H ASN 55 H ASN 55 -16.184 18.211 -3.939 455 HA ASN 55 HA ASN 55 -18.953 17.661 -4.123 456 HB2 ASN 55 1HB ASN 55 -19.197 19.526 -2.473 457 HB3 ASN 55 2HB ASN 55 -18.028 18.301 -1.995 458 HD21 ASN 55 2HD2 ASN 55 -15.837 18.807 -1.986 459 HD22 ASN 55 1HD2 ASN 55 -15.276 20.445 -2.037 460 H LYS 56 H LYS 56 -16.948 20.329 -5.291 461 HA LYS 56 HA LYS 56 -19.056 21.945 -6.269 462 HB2 LYS 56 1HB LYS 56 -16.179 21.728 -7.189 463 HB3 LYS 56 2HB LYS 56 -17.291 22.998 -7.675 464 HG2 LYS 56 1HG LYS 56 -16.638 22.505 -4.791 465 HG3 LYS 56 2HG LYS 56 -15.611 23.505 -5.817 466 HD2 LYS 56 1HD LYS 56 -18.566 23.988 -5.498 467 HD3 LYS 56 2HD LYS 56 -17.357 24.729 -4.446 468 HE2 LYS 56 1HE LYS 56 -16.269 25.667 -6.489 469 HE3 LYS 56 2HE LYS 56 -17.626 25.052 -7.433 470 HZ1 LYS 56 3HZ LYS 56 -19.117 26.443 -6.122 471 HZ2 LYS 56 1HZ LYS 56 -17.921 27.385 -6.874 472 HZ3 LYS 56 2HZ LYS 56 -17.809 27.031 -5.218 473 H LEU 57 H LEU 57 -16.970 19.523 -7.805 474 HA LEU 57 HA LEU 57 -18.137 19.680 -10.366 475 HB2 LEU 57 1HB LEU 57 -16.390 17.726 -8.953 476 HB3 LEU 57 2HB LEU 57 -17.170 17.211 -10.436 477 HG LEU 57 HG LEU 57 -16.098 19.072 -11.644 478 HD11 LEU 57 1HD1 LEU 57 -14.350 20.390 -10.598 479 HD12 LEU 57 2HD1 LEU 57 -14.671 19.612 -9.049 480 HD13 LEU 57 3HD1 LEU 57 -15.894 20.646 -9.785 481 HD21 LEU 57 3HD2 LEU 57 -13.815 18.197 -11.582 482 HD22 LEU 57 1HD2 LEU 57 -15.010 16.900 -11.585 483 HD23 LEU 57 2HD2 LEU 57 -14.188 17.339 -10.088 484 H TYR 58 H TYR 58 -18.922 17.728 -7.529 485 HA TYR 58 HA TYR 58 -20.825 16.085 -8.855 486 HB2 TYR 58 1HB TYR 58 -19.757 15.555 -6.644 487 HB3 TYR 58 2HB TYR 58 -20.775 16.796 -5.916 488 HD1 TYR 58 HD2 TYR 58 -21.167 13.854 -8.175 489 HD2 TYR 58 HD1 TYR 58 -22.689 16.056 -4.877 490 HE1 TYR 58 HE2 TYR 58 -22.974 12.213 -7.931 491 HE2 TYR 58 HE1 TYR 58 -24.505 14.423 -4.611 492 HH TYR 58 HH TYR 58 -25.684 12.770 -5.850 493 H GLU 59 H GLU 59 -21.098 19.067 -6.951 494 HA GLU 59 HA GLU 59 -23.858 19.466 -7.138 495 HB2 GLU 59 1HB GLU 59 -22.295 20.804 -5.739 496 HB3 GLU 59 2HB GLU 59 -21.656 21.545 -7.197 497 HG2 GLU 59 1HG GLU 59 -23.144 23.101 -6.270 498 HG3 GLU 59 2HG GLU 59 -23.981 22.391 -7.650 499 H TYR 60 H TYR 60 -21.247 20.146 -9.328 500 HA TYR 60 HA TYR 60 -22.570 21.669 -11.262 501 HB2 TYR 60 1HB TYR 60 -20.163 21.532 -11.144 502 HB3 TYR 60 2HB TYR 60 -20.199 19.799 -11.417 503 HD1 TYR 60 HD1 TYR 60 -20.959 23.052 -13.032 504 HD2 TYR 60 HD2 TYR 60 -19.998 18.945 -13.582 505 HE1 TYR 60 HE1 TYR 60 -20.599 23.466 -15.425 506 HE2 TYR 60 HE2 TYR 60 -19.643 19.342 -15.984 507 HH TYR 60 HH TYR 60 -20.270 20.954 -17.717 508 H ILE 61 H ILE 61 -22.036 18.148 -11.083 509 HA ILE 61 HA ILE 61 -23.400 17.708 -13.560 510 HB ILE 61 HB ILE 61 -23.109 15.341 -13.162 511 HG12 ILE 61 1HG1 ILE 61 -22.034 16.131 -10.446 512 HG13 ILE 61 2HG1 ILE 61 -23.560 15.296 -10.737 513 HG21 ILE 61 1HG2 ILE 61 -20.672 16.950 -12.412 514 HG22 ILE 61 2HG2 ILE 61 -21.244 16.631 -14.049 515 HG23 ILE 61 3HG2 ILE 61 -20.667 15.303 -13.043 516 HD11 ILE 61 3HD1 ILE 61 -21.804 13.771 -10.016 517 HD12 ILE 61 1HD1 ILE 61 -20.827 14.241 -11.406 518 HD13 ILE 61 2HD1 ILE 61 -22.355 13.395 -11.649 519 H GLU 62 H GLU 62 -24.362 17.709 -10.186 520 HA GLU 62 HA GLU 62 -26.790 16.247 -10.709 521 HB2 GLU 62 1HB GLU 62 -27.350 16.593 -8.390 522 HB3 GLU 62 2HB GLU 62 -25.664 16.115 -8.511 523 HG2 GLU 62 1HG GLU 62 -24.925 18.341 -8.100 524 HG3 GLU 62 2HG GLU 62 -26.570 18.964 -8.221 525 H GLN 63 H GLN 63 -25.839 19.542 -10.875 526 HA GLN 63 HA GLN 63 -28.528 20.561 -10.608 527 HB2 GLN 63 1HB GLN 63 -27.604 22.732 -11.023 528 HB3 GLN 63 2HB GLN 63 -26.505 21.886 -9.944 529 HG2 GLN 63 1HG GLN 63 -25.021 21.408 -11.799 530 HG3 GLN 63 2HG GLN 63 -26.134 22.208 -12.908 531 HE21 GLN 63 2HE2 GLN 63 -23.883 22.661 -10.291 532 HE22 GLN 63 1HE2 GLN 63 -23.655 24.360 -10.524 533 H SER 64 H SER 64 -29.186 22.159 -12.487 534 HA SER 64 HA SER 64 -29.777 20.500 -14.697 535 HB2 SER 64 1HB SER 64 -30.147 23.491 -14.406 536 HB3 SER 64 2HB SER 64 -30.931 22.459 -15.602 537 HG SER 64 HG SER 64 -31.657 22.947 -13.061 538 H LYS 65 H LYS 65 -28.127 19.873 -15.928 539 HA LYS 65 HA LYS 65 -25.951 21.510 -16.713 540 HB2 LYS 65 1HB LYS 65 -25.899 19.020 -16.659 541 HB3 LYS 65 2HB LYS 65 -26.995 18.993 -18.034 542 HG2 LYS 65 1HG LYS 65 -24.846 18.642 -18.917 543 HG3 LYS 65 2HG LYS 65 -25.246 20.320 -19.287 544 HD2 LYS 65 1HD LYS 65 -22.986 20.271 -18.518 545 HD3 LYS 65 2HD LYS 65 -23.963 20.985 -17.232 546 HE2 LYS 65 1HE LYS 65 -22.335 19.372 -16.354 547 HE3 LYS 65 2HE LYS 65 -23.995 18.855 -16.053 548 HZ1 LYS 65 3HZ LYS 65 -22.328 17.895 -18.318 549 HZ2 LYS 65 1HZ LYS 65 -23.853 17.325 -17.866 550 HZ3 LYS 65 2HZ LYS 65 -22.524 17.049 -16.857 551 H ASN 66 H ASN 66 -29.102 20.862 -18.026 552 HA ASN 66 HA ASN 66 -28.506 22.281 -20.508 553 HB2 ASN 66 1HB ASN 66 -30.975 20.799 -19.567 554 HB3 ASN 66 2HB ASN 66 -30.869 21.650 -21.102 555 HD21 ASN 66 2HD2 ASN 66 -31.318 18.822 -20.543 556 HD22 ASN 66 1HD2 ASN 66 -30.075 17.975 -21.392 557 H CYS 67 H CYS 67 -30.996 23.430 -21.002 558 HA CYS 67 HA CYS 67 -31.762 25.058 -18.768 559 HB2 CYS 67 1HB CYS 67 -30.942 27.114 -19.395 560 HB3 CYS 67 2HB CYS 67 -29.621 26.095 -19.937 561 H SER 68 H SER 68 -33.495 26.597 -19.439 562 HA SER 68 HA SER 68 -35.435 25.106 -20.885 563 HB2 SER 68 1HB SER 68 -36.832 27.224 -20.442 564 HB3 SER 68 2HB SER 68 -36.232 26.334 -19.041 565 HG SER 68 HG SER 68 -35.834 28.543 -18.781 566 H TYR 69 H TYR 69 -33.191 27.510 -21.828 567 HA TYR 69 HA TYR 69 -34.627 28.503 -24.103 568 HB2 TYR 69 1HB TYR 69 -32.439 29.323 -22.677 569 HB3 TYR 69 2HB TYR 69 -31.706 28.738 -24.161 570 HD1 TYR 69 HD2 TYR 69 -32.662 29.642 -26.382 571 HD2 TYR 69 HD1 TYR 69 -33.373 31.474 -22.606 572 HE1 TYR 69 HE2 TYR 69 -33.254 31.742 -27.514 573 HE2 TYR 69 HE1 TYR 69 -33.967 33.576 -23.731 574 HH TYR 69 HH TYR 69 -34.648 33.772 -27.000 575 H CYS 70 H CYS 70 -33.481 25.548 -23.540 576 HA CYS 70 HA CYS 70 -33.317 25.018 -26.400 577 HB2 CYS 70 1HB CYS 70 -31.346 23.545 -26.146 578 HB3 CYS 70 2HB CYS 70 -30.975 25.233 -25.803 579 H SER 71 H SER 71 -33.358 23.642 -23.138 580 HA SER 71 HA SER 71 -34.863 21.345 -24.163 581 HB2 SER 71 1HB SER 71 -33.712 21.617 -21.385 582 HB3 SER 71 2HB SER 71 -34.131 20.142 -22.260 583 HG SER 71 HG SER 71 -32.283 20.220 -23.336 584 H GLU 72 H GLU 72 -37.001 21.265 -23.760 585 HA GLU 72 HA GLU 72 -38.178 23.375 -22.155 586 HB2 GLU 72 1HB GLU 72 -40.334 22.472 -23.046 587 HB3 GLU 72 2HB GLU 72 -39.204 23.028 -24.268 588 HG2 GLU 72 1HG GLU 72 -38.564 20.733 -24.744 589 HG3 GLU 72 2HG GLU 72 -39.653 20.157 -23.482 590 H ASP 73 H ASP 73 -36.835 20.702 -21.260 591 HA ASP 73 HA ASP 73 -38.688 19.239 -19.762 592 HB2 ASP 73 1HB ASP 73 -35.736 19.712 -19.354 593 HB3 ASP 73 2HB ASP 73 -36.675 18.619 -18.346 594 H GLU 74 H GLU 74 -39.990 19.994 -18.262 595 HA GLU 74 HA GLU 74 -39.255 22.267 -16.624 596 HB2 GLU 74 1HB GLU 74 -41.521 21.974 -15.652 597 HB3 GLU 74 2HB GLU 74 -41.537 22.160 -17.400 598 HG2 GLU 74 1HG GLU 74 -41.937 19.839 -17.723 599 HG3 GLU 74 2HG GLU 74 -41.637 19.491 -16.022 600 H ASN 75 H ASN 75 -38.646 19.051 -16.533 601 HA ASN 75 HA ASN 75 -39.183 18.270 -13.901 602 HB2 ASN 75 1HB ASN 75 -36.997 17.354 -15.784 603 HB3 ASN 75 2HB ASN 75 -37.413 16.546 -14.278 604 HD21 ASN 75 2HD2 ASN 75 -37.987 14.644 -15.264 605 HD22 ASN 75 1HD2 ASN 75 -39.425 14.472 -16.215 606 H CYS 76 H CYS 76 -36.288 19.723 -15.330 607 HA CYS 76 HA CYS 76 -35.092 19.905 -12.659 608 HB2 CYS 76 1HB CYS 76 -32.995 20.421 -13.928 609 HB3 CYS 76 2HB CYS 76 -33.675 18.836 -14.289 610 HG CYS 76 HG CYS 76 -34.572 21.388 -16.315 611 H ASN 77 H ASN 77 -34.474 21.855 -11.774 612 HA ASN 77 HA ASN 77 -35.572 24.241 -13.057 613 HB2 ASN 77 1HB ASN 77 -36.137 23.876 -10.695 614 HB3 ASN 77 2HB ASN 77 -34.425 23.861 -10.279 615 HD21 ASN 77 2HD2 ASN 77 -37.125 25.818 -11.258 616 HD22 ASN 77 1HD2 ASN 77 -36.407 27.348 -10.872 617 H ASN 78 H ASN 78 -34.173 24.985 -14.557 618 HA ASN 78 HA ASN 78 -31.352 25.145 -13.995 619 HB2 ASN 78 1HB ASN 78 -31.395 26.554 -16.176 620 HB3 ASN 78 2HB ASN 78 -31.715 24.826 -16.272 621 HD21 ASN 78 2HD2 ASN 78 -33.154 28.011 -16.377 622 HD22 ASN 78 1HD2 ASN 78 -34.617 27.532 -17.166 623 H LEU 79 H LEU 79 -30.792 26.486 -12.436 624 HA LEU 79 HA LEU 79 -32.147 28.698 -11.503 625 HB2 LEU 79 1HB LEU 79 -30.291 27.551 -10.335 626 HB3 LEU 79 2HB LEU 79 -29.159 28.256 -11.475 627 HG LEU 79 HG LEU 79 -29.768 30.510 -10.661 628 HD11 LEU 79 1HD1 LEU 79 -31.419 28.989 -8.647 629 HD12 LEU 79 2HD1 LEU 79 -32.027 30.070 -9.902 630 HD13 LEU 79 3HD1 LEU 79 -31.055 30.713 -8.578 631 HD21 LEU 79 3HD2 LEU 79 -27.846 29.339 -9.727 632 HD22 LEU 79 1HD2 LEU 79 -28.881 28.593 -8.510 633 HD23 LEU 79 2HD2 LEU 79 -28.634 30.340 -8.507 634 H LEU 80 H LEU 80 -29.178 28.855 -13.481 635 HA LEU 80 HA LEU 80 -29.892 31.519 -14.359 636 HB2 LEU 80 1HB LEU 80 -27.526 29.733 -14.780 637 HB3 LEU 80 2HB LEU 80 -27.785 31.089 -15.857 638 HG LEU 80 HG LEU 80 -26.190 31.617 -14.075 639 HD11 LEU 80 1HD1 LEU 80 -27.201 33.709 -13.336 640 HD12 LEU 80 2HD1 LEU 80 -28.786 33.127 -13.852 641 HD13 LEU 80 3HD1 LEU 80 -27.516 33.404 -15.044 642 HD21 LEU 80 3HD2 LEU 80 -28.515 31.145 -12.216 643 HD22 LEU 80 1HD2 LEU 80 -26.975 31.872 -11.758 644 HD23 LEU 80 2HD2 LEU 80 -27.031 30.198 -12.307 645 H GLU 81 H GLU 81 -31.809 31.142 -15.490 646 HA GLU 81 HA GLU 81 -31.982 29.203 -17.563 647 HB2 GLU 81 1HB GLU 81 -34.091 30.417 -18.170 648 HB3 GLU 81 2HB GLU 81 -34.010 29.857 -16.507 649 HG2 GLU 81 1HG GLU 81 -33.409 32.124 -15.791 650 HG3 GLU 81 2HG GLU 81 -33.547 32.673 -17.462 651 H GLY 82 H GLY 82 -31.469 29.298 -19.605 652 HA2 GLY 82 1HA GLY 82 -31.010 30.325 -21.693 653 HA3 GLY 82 2HA GLY 82 -30.781 31.856 -20.854 654 H TYR 83 H TYR 83 -29.230 29.951 -18.882 655 HA TYR 83 HA TYR 83 -26.683 30.042 -20.358 656 HB2 TYR 83 1HB TYR 83 -27.348 30.600 -17.476 657 HB3 TYR 83 2HB TYR 83 -25.721 30.136 -17.950 658 HD1 TYR 83 HD2 TYR 83 -28.359 32.693 -18.597 659 HD2 TYR 83 HD1 TYR 83 -24.217 31.734 -18.699 660 HE1 TYR 83 HE2 TYR 83 -27.828 35.042 -19.114 661 HE2 TYR 83 HE1 TYR 83 -23.677 34.072 -19.207 662 HH TYR 83 HH TYR 83 -25.967 36.596 -18.943 663 H HIS 84 H HIS 84 -25.059 28.473 -19.530 664 HA HIS 84 HA HIS 84 -26.220 26.073 -18.272 665 HB2 HIS 84 1HB HIS 84 -24.329 26.163 -20.627 666 HB3 HIS 84 2HB HIS 84 -24.531 24.734 -19.625 667 HD1 HIS 84 HD1 HIS 84 -25.666 23.186 -21.246 668 HD2 HIS 84 HD2 HIS 84 -27.508 26.893 -20.990 669 HE1 HIS 84 HE1 HIS 84 -27.669 23.106 -22.797 670 HA PRO 85 HA PRO 85 -22.700 26.528 -15.629 671 HB2 PRO 85 1HB PRO 85 -22.639 24.050 -14.542 672 HB3 PRO 85 2HB PRO 85 -23.859 25.252 -14.109 673 HG2 PRO 85 1HG PRO 85 -24.078 22.884 -15.898 674 HG3 PRO 85 2HG PRO 85 -25.286 23.586 -14.809 675 HD2 PRO 85 1HD PRO 85 -25.208 23.958 -17.552 676 HD3 PRO 85 2HD PRO 85 -26.045 25.023 -16.410 677 H LYS 86 H LYS 86 -20.554 26.360 -15.933 678 HA LYS 86 HA LYS 86 -19.496 24.004 -17.321 679 HB2 LYS 86 1HB LYS 86 -19.716 25.854 -18.979 680 HB3 LYS 86 2HB LYS 86 -18.674 26.847 -17.967 681 HG2 LYS 86 1HG LYS 86 -16.846 25.262 -18.272 682 HG3 LYS 86 2HG LYS 86 -17.894 24.246 -19.261 683 HD2 LYS 86 1HD LYS 86 -16.475 25.560 -20.704 684 HD3 LYS 86 2HD LYS 86 -18.140 26.124 -20.859 685 HE2 LYS 86 1HE LYS 86 -17.673 27.999 -19.396 686 HE3 LYS 86 2HE LYS 86 -16.034 27.410 -19.123 687 HZ1 LYS 86 3HZ LYS 86 -15.489 27.813 -21.403 688 HZ2 LYS 86 1HZ LYS 86 -16.190 29.225 -20.777 689 HZ3 LYS 86 2HZ LYS 86 -17.095 28.207 -21.785 690 H LEU 87 H LEU 87 -17.694 23.231 -16.500 691 HA LEU 87 HA LEU 87 -16.719 24.114 -13.998 692 HB2 LEU 87 1HB LEU 87 -16.495 21.862 -15.688 693 HB3 LEU 87 2HB LEU 87 -14.863 22.429 -15.403 694 HG LEU 87 HG LEU 87 -15.026 22.065 -13.073 695 HD11 LEU 87 1HD1 LEU 87 -17.210 23.004 -12.649 696 HD12 LEU 87 2HD1 LEU 87 -17.148 21.364 -12.001 697 HD13 LEU 87 3HD1 LEU 87 -17.985 21.683 -13.521 698 HD21 LEU 87 3HD2 LEU 87 -15.605 19.708 -12.952 699 HD22 LEU 87 1HD2 LEU 87 -14.741 20.059 -14.451 700 HD23 LEU 87 2HD2 LEU 87 -16.491 19.836 -14.474 701 H VAL 88 H VAL 88 -15.130 25.514 -13.518 702 HA VAL 88 HA VAL 88 -13.289 26.320 -15.670 703 HB VAL 88 HB VAL 88 -13.344 28.634 -14.917 704 HG11 VAL 88 1HG1 VAL 88 -14.867 28.005 -16.693 705 HG12 VAL 88 2HG1 VAL 88 -15.594 29.244 -15.667 706 HG13 VAL 88 3HG1 VAL 88 -16.092 27.559 -15.506 707 HG21 VAL 88 3HG2 VAL 88 -15.515 27.757 -13.015 708 HG22 VAL 88 1HG2 VAL 88 -15.015 29.421 -13.310 709 HG23 VAL 88 2HG2 VAL 88 -13.891 28.282 -12.567 710 H VAL 89 H VAL 89 -11.202 26.841 -15.036 711 HA VAL 89 HA VAL 89 -10.504 26.115 -12.290 712 HB VAL 89 HB VAL 89 -9.158 24.957 -13.921 713 HG11 VAL 89 1HG1 VAL 89 -9.487 26.513 -15.800 714 HG12 VAL 89 2HG1 VAL 89 -7.794 26.070 -15.585 715 HG13 VAL 89 3HG1 VAL 89 -8.369 27.647 -15.041 716 HG21 VAL 89 3HG2 VAL 89 -7.553 27.190 -12.670 717 HG22 VAL 89 1HG2 VAL 89 -6.902 25.669 -13.280 718 HG23 VAL 89 2HG2 VAL 89 -7.998 25.666 -11.901 719 H ASN 90 H ASN 90 -10.410 27.696 -10.868 720 HA ASN 90 HA ASN 90 -9.570 30.369 -11.779 721 HB2 ASN 90 1HB ASN 90 -11.663 29.562 -9.776 722 HB3 ASN 90 2HB ASN 90 -10.886 31.137 -9.674 723 HD21 ASN 90 2HD2 ASN 90 -13.657 30.501 -10.166 724 HD22 ASN 90 1HD2 ASN 90 -14.060 31.222 -11.685 725 H GLY 91 H GLY 91 -7.449 30.214 -11.326 726 HA2 GLY 91 1HA GLY 91 -5.570 30.446 -10.039 727 HA3 GLY 91 2HA GLY 91 -6.636 30.812 -8.694 728 H ARG 92 H ARG 92 -7.040 29.302 -7.181 729 HA ARG 92 HA ARG 92 -5.523 26.817 -7.407 730 HB2 ARG 92 1HB ARG 92 -5.693 26.980 -4.802 731 HB3 ARG 92 2HB ARG 92 -4.440 27.816 -5.706 732 HG2 ARG 92 1HG ARG 92 -5.410 29.263 -4.033 733 HG3 ARG 92 2HG ARG 92 -5.749 29.841 -5.664 734 HD2 ARG 92 1HD ARG 92 -7.980 29.167 -5.575 735 HD3 ARG 92 2HD ARG 92 -7.693 28.122 -4.189 736 HE ARG 92 HE ARG 92 -7.115 30.601 -3.231 737 HH11 ARG 92 1HH1 ARG 92 -9.908 29.348 -4.969 738 HH12 ARG 92 2HH1 ARG 92 -11.026 30.422 -4.181 739 HH21 ARG 92 1HH2 ARG 92 -8.597 31.986 -2.201 740 HH22 ARG 92 2HH2 ARG 92 -10.290 31.899 -2.595 741 H SER 93 H SER 93 -8.420 27.536 -7.990 742 HA SER 93 HA SER 93 -9.575 25.247 -6.599 743 HB2 SER 93 1HB SER 93 -11.651 26.784 -6.221 744 HB3 SER 93 2HB SER 93 -10.293 26.874 -5.096 745 HG SER 93 HG SER 93 -10.255 28.533 -7.354 746 H ILE 94 H ILE 94 -11.299 24.284 -7.647 747 HA ILE 94 HA ILE 94 -11.791 25.160 -10.397 748 HB ILE 94 HB ILE 94 -12.587 22.563 -9.053 749 HG12 ILE 94 1HG1 ILE 94 -10.315 23.103 -10.980 750 HG13 ILE 94 2HG1 ILE 94 -10.124 22.892 -9.244 751 HG21 ILE 94 1HG2 ILE 94 -14.025 23.134 -10.923 752 HG22 ILE 94 2HG2 ILE 94 -12.979 21.780 -11.356 753 HG23 ILE 94 3HG2 ILE 94 -12.620 23.403 -11.952 754 HD11 ILE 94 3HD1 ILE 94 -9.545 20.858 -10.350 755 HD12 ILE 94 1HD1 ILE 94 -11.082 20.842 -11.219 756 HD13 ILE 94 2HD1 ILE 94 -11.056 20.613 -9.470 757 H ASP 95 H ASP 95 -13.808 25.862 -11.032 758 HA ASP 95 HA ASP 95 -15.852 26.019 -8.929 759 HB2 ASP 95 1HB ASP 95 -14.261 28.148 -9.437 760 HB3 ASP 95 2HB ASP 95 -15.519 28.414 -10.635 761 H ILE 96 H ILE 96 -17.839 27.192 -9.967 762 HA ILE 96 HA ILE 96 -18.338 25.938 -12.593 763 HB ILE 96 HB ILE 96 -20.330 26.381 -10.359 764 HG12 ILE 96 1HG1 ILE 96 -19.302 23.732 -11.353 765 HG13 ILE 96 2HG1 ILE 96 -18.504 24.597 -10.044 766 HG21 ILE 96 1HG2 ILE 96 -21.825 25.012 -11.739 767 HG22 ILE 96 2HG2 ILE 96 -20.597 24.951 -13.004 768 HG23 ILE 96 3HG2 ILE 96 -21.343 26.490 -12.570 769 HD11 ILE 96 3HD1 ILE 96 -21.350 23.635 -10.067 770 HD12 ILE 96 1HD1 ILE 96 -20.585 24.545 -8.765 771 HD13 ILE 96 2HD1 ILE 96 -20.004 22.930 -9.171 772 H GLU 97 H GLU 97 -18.452 27.468 -14.083 773 HA GLU 97 HA GLU 97 -19.703 30.047 -13.416 774 HB2 GLU 97 1HB GLU 97 -17.611 29.208 -15.361 775 HB3 GLU 97 2HB GLU 97 -18.691 30.504 -15.850 776 HG2 GLU 97 1HG GLU 97 -17.110 30.524 -13.294 777 HG3 GLU 97 2HG GLU 97 -16.556 31.250 -14.802 778 H TYR 98 H TYR 98 -20.720 31.005 -15.552 779 HA TYR 98 HA TYR 98 -22.404 28.919 -16.754 780 HB2 TYR 98 1HB TYR 98 -23.194 31.445 -15.385 781 HB3 TYR 98 2HB TYR 98 -24.137 30.937 -16.785 782 HD1 TYR 98 HD1 TYR 98 -25.375 28.795 -16.727 783 HD2 TYR 98 HD2 TYR 98 -23.356 30.312 -13.300 784 HE1 TYR 98 HE1 TYR 98 -26.663 27.263 -15.287 785 HE2 TYR 98 HE2 TYR 98 -24.634 28.787 -11.859 786 HH TYR 98 HH TYR 98 -26.243 26.172 -12.889 787 H TYR 99 H TYR 99 -22.422 28.936 -18.888 788 HA TYR 99 HA TYR 99 -21.646 31.423 -20.259 789 HB2 TYR 99 1HB TYR 99 -20.898 30.072 -22.149 790 HB3 TYR 99 2HB TYR 99 -20.065 29.577 -20.683 791 HD1 TYR 99 HD1 TYR 99 -22.533 28.605 -23.221 792 HD2 TYR 99 HD2 TYR 99 -20.417 27.374 -19.744 793 HE1 TYR 99 HE1 TYR 99 -23.183 26.275 -23.661 794 HE2 TYR 99 HE2 TYR 99 -21.063 25.041 -20.169 795 HH TYR 99 HH TYR 99 -22.559 23.725 -21.341 796 H GLU 100 H GLU 100 -22.811 32.002 -22.138 797 HA GLU 100 HA GLU 100 -25.602 31.649 -21.870 798 HB2 GLU 100 1HB GLU 100 -24.030 32.703 -24.227 799 HB3 GLU 100 2HB GLU 100 -25.751 32.933 -23.953 800 HG2 GLU 100 1HG GLU 100 -25.317 34.275 -22.009 801 HG3 GLU 100 2HG GLU 100 -23.590 33.936 -22.119 802 H CYS 101 H CYS 101 -26.900 30.105 -22.622 803 HA CYS 101 HA CYS 101 -26.252 27.795 -23.934 804 HB2 CYS 101 1HB CYS 101 -28.518 28.430 -23.035 805 HB3 CYS 101 2HB CYS 101 -28.770 29.387 -24.489 806 HA PRO 102 HA PRO 102 -24.570 29.253 -27.809 807 HB2 PRO 102 1HB PRO 102 -24.738 26.792 -29.091 808 HB3 PRO 102 2HB PRO 102 -23.382 27.336 -28.098 809 HG2 PRO 102 1HG PRO 102 -25.663 25.553 -27.383 810 HG3 PRO 102 2HG PRO 102 -23.964 25.461 -26.887 811 HD2 PRO 102 1HD PRO 102 -25.865 26.385 -25.233 812 HD3 PRO 102 2HD PRO 102 -24.226 27.069 -25.241 813 H VAL 103 H VAL 103 -27.517 27.420 -27.520 814 HA VAL 103 HA VAL 103 -28.477 27.729 -30.151 815 HB VAL 103 HB VAL 103 -30.169 27.402 -27.677 816 HG11 VAL 103 1HG1 VAL 103 -30.596 26.542 -30.532 817 HG12 VAL 103 2HG1 VAL 103 -31.421 27.860 -29.700 818 HG13 VAL 103 3HG1 VAL 103 -31.675 26.194 -29.181 819 HG21 VAL 103 3HG2 VAL 103 -28.399 25.754 -27.588 820 HG22 VAL 103 1HG2 VAL 103 -28.723 25.276 -29.254 821 HG23 VAL 103 2HG2 VAL 103 -29.924 24.969 -27.999 822 H LYS 104 H LYS 104 -28.397 29.879 -27.431 823 HA LYS 104 HA LYS 104 -30.725 31.367 -27.941 824 HB2 LYS 104 1HB LYS 104 -29.433 31.450 -25.806 825 HB3 LYS 104 2HB LYS 104 -28.202 32.398 -26.635 826 HG2 LYS 104 1HG LYS 104 -29.880 34.132 -27.114 827 HG3 LYS 104 2HG LYS 104 -31.085 33.184 -26.245 828 HD2 LYS 104 1HD LYS 104 -30.259 34.935 -24.813 829 HD3 LYS 104 2HD LYS 104 -29.704 33.375 -24.203 830 HE2 LYS 104 1HE LYS 104 -27.515 33.773 -24.801 831 HE3 LYS 104 2HE LYS 104 -27.959 34.927 -26.059 832 HZ1 LYS 104 3HZ LYS 104 -26.918 35.913 -24.036 833 HZ2 LYS 104 1HZ LYS 104 -28.301 35.467 -23.159 834 HZ3 LYS 104 2HZ LYS 104 -28.431 36.568 -24.442 835 H ARG 105 H ARG 105 -27.474 31.619 -29.274 836 HA ARG 105 HA ARG 105 -28.587 33.529 -31.187 837 HB2 ARG 105 1HB ARG 105 -26.674 34.955 -31.168 838 HB3 ARG 105 2HB ARG 105 -27.215 34.780 -29.511 839 HG2 ARG 105 1HG ARG 105 -24.960 33.152 -30.651 840 HG3 ARG 105 2HG ARG 105 -24.715 34.739 -29.925 841 HD2 ARG 105 1HD ARG 105 -25.956 33.755 -27.890 842 HD3 ARG 105 2HD ARG 105 -25.633 32.190 -28.635 843 HE ARG 105 HE ARG 105 -23.334 33.936 -28.309 844 HH11 ARG 105 1HH1 ARG 105 -25.181 31.262 -26.997 845 HH12 ARG 105 2HH1 ARG 105 -23.896 30.720 -25.964 846 HH21 ARG 105 1HH2 ARG 105 -21.664 33.237 -26.959 847 HH22 ARG 105 2HH2 ARG 105 -21.891 31.842 -25.950 848 H LYS 106 H LYS 106 -27.694 30.643 -30.911 849 HA LYS 106 HA LYS 106 -26.698 29.007 -32.145 850 HB2 LYS 106 1HB LYS 106 -27.698 30.849 -34.320 851 HB3 LYS 106 2HB LYS 106 -27.252 29.162 -34.550 852 HG2 LYS 106 1HG LYS 106 -29.008 28.425 -33.112 853 HG3 LYS 106 2HG LYS 106 -29.389 30.079 -32.642 854 HD2 LYS 106 1HD LYS 106 -30.035 30.559 -34.978 855 HD3 LYS 106 2HD LYS 106 -29.713 28.870 -35.385 856 HE2 LYS 106 1HE LYS 106 -31.421 28.135 -33.842 857 HE3 LYS 106 2HE LYS 106 -31.701 29.793 -33.314 858 HZ1 LYS 106 3HZ LYS 106 -32.441 30.331 -35.558 859 HZ2 LYS 106 1HZ LYS 106 -33.380 29.094 -34.876 860 HZ3 LYS 106 2HZ LYS 106 -32.203 28.723 -36.040 Start of MODEL 18 1 HA MET 1 HA MET 1 -30.127 2.839 -16.831 2 HB2 MET 1 1HB MET 1 -30.587 3.509 -19.740 3 HB3 MET 1 2HB MET 1 -31.505 2.278 -18.886 4 HG2 MET 1 1HG MET 1 -32.746 4.343 -18.985 5 HG3 MET 1 2HG MET 1 -32.321 3.963 -17.320 6 HE1 MET 1 2HE MET 1 -32.259 7.895 -17.407 7 HE2 MET 1 3HE MET 1 -32.971 6.467 -16.656 8 HE3 MET 1 1HE MET 1 -33.338 6.855 -18.337 9 H GLU 2 H GLU 2 -27.311 2.455 -17.591 10 HA GLU 2 HA GLU 2 -27.462 -0.077 -19.064 11 HB2 GLU 2 1HB GLU 2 -25.027 0.241 -19.485 12 HB3 GLU 2 2HB GLU 2 -26.033 1.493 -20.188 13 HG2 GLU 2 1HG GLU 2 -24.507 1.778 -17.606 14 HG3 GLU 2 2HG GLU 2 -23.926 2.322 -19.177 15 HA PRO 3 HA PRO 3 -26.737 -1.377 -14.754 16 HB2 PRO 3 1HB PRO 3 -28.058 -3.854 -15.495 17 HB3 PRO 3 2HB PRO 3 -28.584 -2.616 -14.355 18 HG2 PRO 3 1HG PRO 3 -29.836 -3.089 -16.725 19 HG3 PRO 3 2HG PRO 3 -29.819 -1.504 -15.930 20 HD2 PRO 3 1HD PRO 3 -28.149 -2.503 -18.207 21 HD3 PRO 3 2HD PRO 3 -28.918 -0.916 -17.983 22 H ILE 4 H ILE 4 -24.515 -1.456 -16.064 23 HA ILE 4 HA ILE 4 -23.625 -4.229 -16.340 24 HB ILE 4 HB ILE 4 -22.064 -1.664 -16.724 25 HG12 ILE 4 1HG1 ILE 4 -23.309 -3.504 -18.779 26 HG13 ILE 4 2HG1 ILE 4 -23.922 -1.915 -18.335 27 HG21 ILE 4 1HG2 ILE 4 -20.451 -3.110 -17.904 28 HG22 ILE 4 2HG2 ILE 4 -21.395 -4.520 -17.427 29 HG23 ILE 4 3HG2 ILE 4 -20.612 -3.527 -16.199 30 HD11 ILE 4 3HD1 ILE 4 -21.275 -2.499 -19.638 31 HD12 ILE 4 1HD1 ILE 4 -21.852 -0.901 -19.163 32 HD13 ILE 4 2HD1 ILE 4 -22.701 -1.811 -20.413 33 H GLY 5 H GLY 5 -23.357 -5.146 -14.377 34 HA2 GLY 5 1HA GLY 5 -21.988 -3.528 -12.319 35 HA3 GLY 5 2HA GLY 5 -23.312 -4.619 -11.950 36 H ARG 6 H ARG 6 -19.942 -4.302 -12.501 37 HA ARG 6 HA ARG 6 -19.524 -7.170 -12.119 38 HB2 ARG 6 1HB ARG 6 -17.679 -4.886 -12.789 39 HB3 ARG 6 2HB ARG 6 -17.049 -6.431 -12.230 40 HG2 ARG 6 1HG ARG 6 -18.266 -7.522 -14.112 41 HG3 ARG 6 2HG ARG 6 -18.666 -5.909 -14.710 42 HD2 ARG 6 1HD ARG 6 -16.663 -6.919 -15.793 43 HD3 ARG 6 2HD ARG 6 -16.350 -5.374 -15.003 44 HE ARG 6 HE ARG 6 -15.330 -6.620 -13.170 45 HH11 ARG 6 1HH1 ARG 6 -15.779 -8.344 -16.199 46 HH12 ARG 6 2HH1 ARG 6 -14.535 -9.512 -15.851 47 HH21 ARG 6 1HH2 ARG 6 -13.707 -8.123 -12.734 48 HH22 ARG 6 2HH2 ARG 6 -13.324 -9.366 -13.889 49 H SER 7 H SER 7 -20.762 -5.657 -10.062 50 HA SER 7 HA SER 7 -18.992 -4.832 -8.041 51 HB2 SER 7 1HB SER 7 -21.072 -5.225 -6.575 52 HB3 SER 7 2HB SER 7 -21.223 -4.064 -7.896 53 HG SER 7 HG SER 7 -22.002 -6.794 -8.004 54 H LEU 8 H LEU 8 -17.485 -6.144 -7.251 55 HA LEU 8 HA LEU 8 -18.107 -8.958 -6.755 56 HB2 LEU 8 1HB LEU 8 -15.492 -7.458 -6.538 57 HB3 LEU 8 2HB LEU 8 -15.690 -9.186 -6.320 58 HG LEU 8 HG LEU 8 -16.164 -7.667 -8.884 59 HD11 LEU 8 1HD1 LEU 8 -14.207 -8.890 -9.694 60 HD12 LEU 8 2HD1 LEU 8 -13.979 -9.586 -8.089 61 HD13 LEU 8 3HD1 LEU 8 -13.806 -7.848 -8.330 62 HD21 LEU 8 3HD2 LEU 8 -16.471 -9.861 -9.899 63 HD22 LEU 8 1HD2 LEU 8 -17.679 -9.567 -8.648 64 HD23 LEU 8 2HD2 LEU 8 -16.307 -10.626 -8.319 65 H GLN 9 H GLN 9 -18.638 -6.236 -5.184 66 HA GLN 9 HA GLN 9 -18.079 -7.409 -2.554 67 HB2 GLN 9 1HB GLN 9 -18.199 -5.125 -1.635 68 HB3 GLN 9 2HB GLN 9 -16.921 -5.281 -2.829 69 HG2 GLN 9 1HG GLN 9 -18.361 -4.207 -4.499 70 HG3 GLN 9 2HG GLN 9 -19.625 -4.031 -3.282 71 HE21 GLN 9 2HE2 GLN 9 -18.266 -1.974 -4.809 72 HE22 GLN 9 1HE2 GLN 9 -17.526 -0.910 -3.650 73 H GLY 10 H GLY 10 -19.788 -8.202 -1.573 74 HA2 GLY 10 1HA GLY 10 -22.452 -7.601 -2.534 75 HA3 GLY 10 2HA GLY 10 -22.025 -8.760 -1.284 76 H VAL 11 H VAL 11 -24.215 -7.119 -0.995 77 HA VAL 11 HA VAL 11 -23.466 -4.891 0.693 78 HB VAL 11 HB VAL 11 -26.217 -6.041 0.191 79 HG11 VAL 11 1HG1 VAL 11 -25.356 -3.386 1.328 80 HG12 VAL 11 2HG1 VAL 11 -26.123 -4.708 2.211 81 HG13 VAL 11 3HG1 VAL 11 -27.016 -3.852 0.954 82 HG21 VAL 11 3HG2 VAL 11 -25.224 -5.312 -1.892 83 HG22 VAL 11 1HG2 VAL 11 -24.790 -3.762 -1.173 84 HG23 VAL 11 2HG2 VAL 11 -26.487 -4.184 -1.401 85 H THR 12 H THR 12 -22.394 -5.777 2.422 86 HA THR 12 HA THR 12 -23.682 -7.791 4.068 87 HB THR 12 HB THR 12 -21.181 -6.228 4.730 88 HG1 THR 12 HG1 THR 12 -20.287 -7.204 3.089 89 HG21 THR 12 3HG2 THR 12 -22.110 -8.995 5.514 90 HG22 THR 12 1HG2 THR 12 -22.157 -7.563 6.544 91 HG23 THR 12 2HG2 THR 12 -20.608 -8.222 6.022 92 H GLY 13 H GLY 13 -25.378 -7.049 5.226 93 HA2 GLY 13 1HA GLY 13 -26.542 -5.784 6.772 94 HA3 GLY 13 2HA GLY 13 -25.058 -4.891 7.096 95 H ARG 14 H ARG 14 -25.192 -2.800 6.606 96 HA ARG 14 HA ARG 14 -26.374 -2.041 4.056 97 HB2 ARG 14 1HB ARG 14 -27.229 -0.898 6.707 98 HB3 ARG 14 2HB ARG 14 -27.389 0.013 5.216 99 HG2 ARG 14 1HG ARG 14 -28.754 -2.551 5.969 100 HG3 ARG 14 2HG ARG 14 -29.482 -0.977 5.652 101 HD2 ARG 14 1HD ARG 14 -28.183 -2.847 3.685 102 HD3 ARG 14 2HD ARG 14 -29.870 -2.349 3.744 103 HE ARG 14 HE ARG 14 -28.288 -0.055 3.388 104 HH11 ARG 14 1HH1 ARG 14 -29.266 -2.961 1.692 105 HH12 ARG 14 2HH1 ARG 14 -29.003 -2.290 0.111 106 HH21 ARG 14 1HH2 ARG 14 -27.944 0.850 1.288 107 HH22 ARG 14 2HH2 ARG 14 -28.256 -0.138 -0.122 108 HA PRO 15 HA PRO 15 -22.474 0.293 4.790 109 HB2 PRO 15 1HB PRO 15 -21.216 -0.492 2.560 110 HB3 PRO 15 2HB PRO 15 -21.177 -1.457 4.038 111 HG2 PRO 15 1HG PRO 15 -22.851 -1.822 1.585 112 HG3 PRO 15 2HG PRO 15 -22.012 -3.046 2.557 113 HD2 PRO 15 1HD PRO 15 -24.689 -2.500 2.781 114 HD3 PRO 15 2HD PRO 15 -23.699 -3.154 4.099 115 H ASP 16 H ASP 16 -24.581 1.634 4.206 116 HA ASP 16 HA ASP 16 -24.880 2.443 1.485 117 HB2 ASP 16 1HB ASP 16 -25.946 3.540 4.085 118 HB3 ASP 16 2HB ASP 16 -26.261 4.329 2.543 119 H PHE 17 H PHE 17 -22.870 3.402 4.112 120 HA PHE 17 HA PHE 17 -22.225 6.016 3.272 121 HB2 PHE 17 1HB PHE 17 -21.705 5.113 5.523 122 HB3 PHE 17 2HB PHE 17 -20.492 4.059 4.805 123 HD1 PHE 17 HD1 PHE 17 -21.367 7.556 5.553 124 HD2 PHE 17 HD2 PHE 17 -18.344 4.882 4.197 125 HE1 PHE 17 HE1 PHE 17 -19.687 9.342 5.791 126 HE2 PHE 17 HE2 PHE 17 -16.659 6.656 4.439 127 HZ PHE 17 HZ PHE 17 -17.330 8.888 5.232 128 H GLN 18 H GLN 18 -20.647 2.887 2.626 129 HA GLN 18 HA GLN 18 -18.607 4.049 1.013 130 HB2 GLN 18 1HB GLN 18 -17.914 1.809 0.522 131 HB3 GLN 18 2HB GLN 18 -18.371 1.875 2.208 132 HG2 GLN 18 1HG GLN 18 -19.317 -0.107 1.585 133 HG3 GLN 18 2HG GLN 18 -20.668 0.995 1.351 134 HE21 GLN 18 2HE2 GLN 18 -17.932 0.752 -0.857 135 HE22 GLN 18 1HE2 GLN 18 -18.827 0.088 -2.168 136 H LYS 19 H LYS 19 -21.775 2.718 0.413 137 HA LYS 19 HA LYS 19 -21.716 2.473 -2.357 138 HB2 LYS 19 1HB LYS 19 -23.885 3.062 -0.373 139 HB3 LYS 19 2HB LYS 19 -24.237 3.106 -2.094 140 HG2 LYS 19 1HG LYS 19 -22.813 0.704 -1.240 141 HG3 LYS 19 2HG LYS 19 -24.403 0.903 -0.504 142 HD2 LYS 19 1HD LYS 19 -23.811 1.004 -3.465 143 HD3 LYS 19 2HD LYS 19 -24.506 -0.375 -2.609 144 HE2 LYS 19 1HE LYS 19 -26.447 0.946 -2.000 145 HE3 LYS 19 2HE LYS 19 -25.738 2.375 -2.747 146 HZ1 LYS 19 3HZ LYS 19 -25.889 1.313 -4.895 147 HZ2 LYS 19 1HZ LYS 19 -27.409 1.311 -4.154 148 HZ3 LYS 19 2HZ LYS 19 -26.490 -0.110 -4.202 149 H ARG 20 H ARG 20 -22.784 5.263 -0.410 150 HA ARG 20 HA ARG 20 -23.212 6.890 -2.697 151 HB2 ARG 20 1HB ARG 20 -23.472 8.745 -1.082 152 HB3 ARG 20 2HB ARG 20 -24.455 7.344 -0.696 153 HG2 ARG 20 1HG ARG 20 -22.742 6.680 0.979 154 HG3 ARG 20 2HG ARG 20 -21.907 8.200 0.650 155 HD2 ARG 20 1HD ARG 20 -24.785 8.045 1.514 156 HD3 ARG 20 2HD ARG 20 -23.448 8.194 2.650 157 HE ARG 20 HE ARG 20 -23.084 10.388 1.930 158 HH11 ARG 20 1HH1 ARG 20 -25.714 8.896 0.149 159 HH12 ARG 20 2HH1 ARG 20 -26.342 10.404 -0.445 160 HH21 ARG 20 1HH2 ARG 20 -23.926 12.363 1.188 161 HH22 ARG 20 2HH2 ARG 20 -25.317 12.385 0.143 162 H LEU 21 H LEU 21 -20.433 6.231 -0.738 163 HA LEU 21 HA LEU 21 -18.920 8.528 -1.436 164 HB2 LEU 21 1HB LEU 21 -18.250 7.296 0.472 165 HB3 LEU 21 2HB LEU 21 -18.197 5.791 -0.421 166 HG LEU 21 HG LEU 21 -16.245 6.641 -1.680 167 HD11 LEU 21 1HD1 LEU 21 -16.397 8.938 0.271 168 HD12 LEU 21 2HD1 LEU 21 -16.645 9.026 -1.473 169 HD13 LEU 21 3HD1 LEU 21 -15.056 8.614 -0.828 170 HD21 LEU 21 3HD2 LEU 21 -15.925 5.212 0.258 171 HD22 LEU 21 1HD2 LEU 21 -15.954 6.618 1.323 172 HD23 LEU 21 2HD2 LEU 21 -14.641 6.416 0.162 173 H GLU 22 H GLU 22 -18.882 5.187 -2.702 174 HA GLU 22 HA GLU 22 -17.109 5.855 -4.830 175 HB2 GLU 22 1HB GLU 22 -18.904 3.447 -4.483 176 HB3 GLU 22 2HB GLU 22 -17.669 3.609 -5.725 177 HG2 GLU 22 1HG GLU 22 -16.028 3.949 -3.796 178 HG3 GLU 22 2HG GLU 22 -17.317 3.338 -2.759 179 H GLN 23 H GLN 23 -20.566 5.793 -4.432 180 HA GLN 23 HA GLN 23 -21.392 5.908 -7.099 181 HB2 GLN 23 1HB GLN 23 -22.530 6.590 -4.473 182 HB3 GLN 23 2HB GLN 23 -23.246 7.437 -5.835 183 HG2 GLN 23 1HG GLN 23 -23.860 5.383 -6.879 184 HG3 GLN 23 2HG GLN 23 -22.918 4.451 -5.719 185 HE21 GLN 23 2HE2 GLN 23 -24.882 7.173 -4.779 186 HE22 GLN 23 1HE2 GLN 23 -26.086 6.260 -3.931 187 H MET 24 H MET 24 -20.969 8.627 -4.830 188 HA MET 24 HA MET 24 -21.372 10.646 -6.699 189 HB2 MET 24 1HB MET 24 -20.291 12.170 -5.152 190 HB3 MET 24 2HB MET 24 -21.359 11.078 -4.289 191 HG2 MET 24 1HG MET 24 -19.436 9.751 -3.602 192 HG3 MET 24 2HG MET 24 -18.367 10.857 -4.463 193 HE1 MET 24 3HE MET 24 -18.934 14.196 -2.457 194 HE2 MET 24 1HE MET 24 -19.798 13.645 -3.892 195 HE3 MET 24 2HE MET 24 -18.050 13.435 -3.782 196 H LYS 25 H LYS 25 -18.333 9.065 -5.748 197 HA LYS 25 HA LYS 25 -16.640 10.596 -7.385 198 HB2 LYS 25 1HB LYS 25 -16.003 8.988 -5.519 199 HB3 LYS 25 2HB LYS 25 -16.226 7.691 -6.683 200 HG2 LYS 25 1HG LYS 25 -13.862 8.439 -6.346 201 HG3 LYS 25 2HG LYS 25 -14.422 8.472 -8.020 202 HD2 LYS 25 1HD LYS 25 -14.485 10.774 -8.092 203 HD3 LYS 25 2HD LYS 25 -14.683 10.929 -6.348 204 HE2 LYS 25 1HE LYS 25 -12.465 11.668 -7.223 205 HE3 LYS 25 2HE LYS 25 -12.390 10.445 -5.960 206 HZ1 LYS 25 3HZ LYS 25 -10.901 10.171 -8.001 207 HZ2 LYS 25 1HZ LYS 25 -12.306 9.683 -8.814 208 HZ3 LYS 25 2HZ LYS 25 -11.761 8.812 -7.463 209 H GLU 26 H GLU 26 -18.476 7.653 -8.019 210 HA GLU 26 HA GLU 26 -17.519 7.090 -10.595 211 HB2 GLU 26 1HB GLU 26 -18.798 5.480 -9.301 212 HB3 GLU 26 2HB GLU 26 -20.199 6.536 -9.300 213 HG2 GLU 26 1HG GLU 26 -19.211 5.780 -11.961 214 HG3 GLU 26 2HG GLU 26 -19.836 4.453 -10.981 215 H LYS 27 H LYS 27 -20.395 8.896 -9.574 216 HA LYS 27 HA LYS 27 -21.335 9.693 -12.058 217 HB2 LYS 27 1HB LYS 27 -21.538 10.881 -9.320 218 HB3 LYS 27 2HB LYS 27 -22.185 11.754 -10.700 219 HG2 LYS 27 1HG LYS 27 -23.680 9.934 -11.209 220 HG3 LYS 27 2HG LYS 27 -22.957 8.944 -9.941 221 HD2 LYS 27 1HD LYS 27 -25.061 9.899 -9.184 222 HD3 LYS 27 2HD LYS 27 -23.713 10.555 -8.257 223 HE2 LYS 27 1HE LYS 27 -25.084 12.398 -8.726 224 HE3 LYS 27 2HE LYS 27 -23.753 12.515 -9.874 225 HZ1 LYS 27 3HZ LYS 27 -26.439 11.393 -10.478 226 HZ2 LYS 27 1HZ LYS 27 -25.173 11.594 -11.587 227 HZ3 LYS 27 2HZ LYS 27 -25.919 12.950 -10.896 228 H VAL 28 H VAL 28 -19.054 11.420 -9.933 229 HA VAL 28 HA VAL 28 -18.730 13.679 -11.554 230 HB VAL 28 HB VAL 28 -16.779 12.431 -9.608 231 HG11 VAL 28 1HG1 VAL 28 -15.629 13.893 -11.187 232 HG12 VAL 28 2HG1 VAL 28 -15.663 14.588 -9.567 233 HG13 VAL 28 3HG1 VAL 28 -16.761 15.195 -10.807 234 HG21 VAL 28 3HG2 VAL 28 -18.726 14.709 -9.280 235 HG22 VAL 28 1HG2 VAL 28 -17.567 14.160 -8.068 236 HG23 VAL 28 2HG2 VAL 28 -18.882 13.098 -8.578 237 H MET 29 H MET 29 -17.012 10.597 -11.467 238 HA MET 29 HA MET 29 -15.222 11.434 -13.598 239 HB2 MET 29 1HB MET 29 -15.471 8.798 -12.139 240 HB3 MET 29 2HB MET 29 -14.208 9.203 -13.296 241 HG2 MET 29 1HG MET 29 -13.409 10.970 -11.856 242 HG3 MET 29 2HG MET 29 -14.719 10.670 -10.717 243 HE1 MET 29 3HE MET 29 -12.516 8.053 -12.695 244 HE2 MET 29 1HE MET 29 -11.227 7.764 -11.525 245 HE3 MET 29 2HE MET 29 -11.397 9.349 -12.277 246 H LYS 30 H LYS 30 -18.278 10.808 -13.767 247 HA LYS 30 HA LYS 30 -18.117 9.064 -16.135 248 HB2 LYS 30 1HB LYS 30 -19.900 9.104 -13.943 249 HB3 LYS 30 2HB LYS 30 -20.808 9.687 -15.329 250 HG2 LYS 30 1HG LYS 30 -21.158 7.382 -15.279 251 HG3 LYS 30 2HG LYS 30 -19.964 7.633 -16.555 252 HD2 LYS 30 1HD LYS 30 -18.195 6.897 -15.164 253 HD3 LYS 30 2HD LYS 30 -19.215 6.943 -13.725 254 HE2 LYS 30 1HE LYS 30 -19.303 5.008 -16.018 255 HE3 LYS 30 2HE LYS 30 -19.052 4.677 -14.301 256 HZ1 LYS 30 3HZ LYS 30 -21.277 4.073 -14.893 257 HZ2 LYS 30 1HZ LYS 30 -21.573 5.593 -15.575 258 HZ3 LYS 30 2HZ LYS 30 -21.343 5.449 -13.901 259 H ASP 31 H ASP 31 -19.114 12.164 -14.905 260 HA ASP 31 HA ASP 31 -20.774 12.987 -16.990 261 HB2 ASP 31 1HB ASP 31 -20.640 14.138 -14.806 262 HB3 ASP 31 2HB ASP 31 -19.036 14.730 -15.236 263 H GLN 32 H GLN 32 -20.433 13.701 -18.962 264 HA GLN 32 HA GLN 32 -17.877 13.319 -20.132 265 HB2 GLN 32 1HB GLN 32 -20.363 14.558 -21.325 266 HB3 GLN 32 2HB GLN 32 -18.966 13.973 -22.221 267 HG2 GLN 32 1HG GLN 32 -19.396 11.711 -21.482 268 HG3 GLN 32 2HG GLN 32 -20.743 12.266 -20.491 269 HE21 GLN 32 2HE2 GLN 32 -20.725 10.329 -22.649 270 HE22 GLN 32 1HE2 GLN 32 -21.848 10.908 -23.828 271 H ASP 33 H ASP 33 -19.525 16.083 -18.852 272 HA ASP 33 HA ASP 33 -17.859 17.979 -20.273 273 HB2 ASP 33 1HB ASP 33 -19.972 18.319 -18.143 274 HB3 ASP 33 2HB ASP 33 -19.024 19.662 -18.773 275 H VAL 34 H VAL 34 -18.120 16.638 -17.012 276 HA VAL 34 HA VAL 34 -16.008 18.000 -15.803 277 HB VAL 34 HB VAL 34 -17.054 15.197 -15.445 278 HG11 VAL 34 1HG1 VAL 34 -14.664 15.156 -14.892 279 HG12 VAL 34 2HG1 VAL 34 -15.686 14.941 -13.468 280 HG13 VAL 34 3HG1 VAL 34 -14.908 16.499 -13.774 281 HG21 VAL 34 3HG2 VAL 34 -17.872 16.098 -13.339 282 HG22 VAL 34 1HG2 VAL 34 -18.451 17.050 -14.703 283 HG23 VAL 34 2HG2 VAL 34 -17.128 17.654 -13.704 284 H GLN 35 H GLN 35 -15.931 15.042 -17.777 285 HA GLN 35 HA GLN 35 -13.127 14.677 -17.657 286 HB2 GLN 35 1HB GLN 35 -14.933 13.832 -19.922 287 HB3 GLN 35 2HB GLN 35 -13.413 13.090 -19.426 288 HG2 GLN 35 1HG GLN 35 -14.518 12.598 -17.232 289 HG3 GLN 35 2HG GLN 35 -16.034 13.080 -17.975 290 HE21 GLN 35 2HE2 GLN 35 -15.284 10.516 -16.900 291 HE22 GLN 35 1HE2 GLN 35 -15.436 9.385 -18.191 292 H ALA 36 H ALA 36 -15.225 16.421 -19.834 293 HA ALA 36 HA ALA 36 -13.315 17.249 -21.718 294 HB1 ALA 36 1HB ALA 36 -14.879 19.076 -22.238 295 HB2 ALA 36 2HB ALA 36 -15.815 18.665 -20.800 296 HB3 ALA 36 3HB ALA 36 -15.688 17.512 -22.130 297 H PHE 37 H PHE 37 -14.330 18.646 -18.638 298 HA PHE 37 HA PHE 37 -12.672 20.928 -18.713 299 HB2 PHE 37 1HB PHE 37 -14.495 20.827 -17.159 300 HB3 PHE 37 2HB PHE 37 -13.854 19.365 -16.419 301 HD1 PHE 37 HD2 PHE 37 -12.813 22.877 -17.106 302 HD2 PHE 37 HD1 PHE 37 -12.743 19.574 -14.437 303 HE1 PHE 37 HE2 PHE 37 -11.637 24.256 -15.447 304 HE2 PHE 37 HE1 PHE 37 -11.570 20.947 -12.763 305 HZ PHE 37 HZ PHE 37 -11.017 23.296 -13.269 306 H LEU 38 H LEU 38 -12.183 17.655 -17.495 307 HA LEU 38 HA LEU 38 -9.713 18.051 -16.262 308 HB2 LEU 38 1HB LEU 38 -11.255 15.750 -17.209 309 HB3 LEU 38 2HB LEU 38 -9.522 15.491 -17.204 310 HG LEU 38 HG LEU 38 -10.423 14.700 -15.138 311 HD11 LEU 38 1HD1 LEU 38 -8.249 15.757 -15.015 312 HD12 LEU 38 2HD1 LEU 38 -9.161 16.061 -13.535 313 HD13 LEU 38 3HD1 LEU 38 -9.007 17.329 -14.751 314 HD21 LEU 38 3HD2 LEU 38 -12.490 15.940 -15.048 315 HD22 LEU 38 1HD2 LEU 38 -11.608 17.451 -14.813 316 HD23 LEU 38 2HD2 LEU 38 -11.576 16.208 -13.563 317 H LYS 39 H LYS 39 -10.475 17.221 -19.622 318 HA LYS 39 HA LYS 39 -7.679 17.132 -20.332 319 HB2 LYS 39 1HB LYS 39 -8.393 16.692 -22.580 320 HB3 LYS 39 2HB LYS 39 -9.376 15.730 -21.488 321 HG2 LYS 39 1HG LYS 39 -11.206 17.338 -21.726 322 HG3 LYS 39 2HG LYS 39 -10.216 18.290 -22.837 323 HD2 LYS 39 1HD LYS 39 -10.067 16.303 -24.322 324 HD3 LYS 39 2HD LYS 39 -11.167 15.454 -23.235 325 HE2 LYS 39 1HE LYS 39 -12.398 16.327 -25.117 326 HE3 LYS 39 2HE LYS 39 -12.871 17.184 -23.652 327 HZ1 LYS 39 3HZ LYS 39 -10.852 18.225 -25.564 328 HZ2 LYS 39 1HZ LYS 39 -11.605 19.059 -24.292 329 HZ3 LYS 39 2HZ LYS 39 -12.504 18.606 -25.655 330 H GLU 40 H GLU 40 -10.167 19.499 -20.217 331 HA GLU 40 HA GLU 40 -9.134 21.411 -22.001 332 HB2 GLU 40 1HB GLU 40 -11.420 21.436 -20.941 333 HB3 GLU 40 2HB GLU 40 -10.661 21.923 -19.440 334 HG2 GLU 40 1HG GLU 40 -9.809 23.951 -20.597 335 HG3 GLU 40 2HG GLU 40 -10.751 23.482 -22.011 336 H ASN 41 H ASN 41 -8.780 21.040 -18.514 337 HA ASN 41 HA ASN 41 -6.561 22.982 -18.616 338 HB2 ASN 41 1HB ASN 41 -8.496 22.350 -16.388 339 HB3 ASN 41 2HB ASN 41 -7.117 23.433 -16.226 340 HD21 ASN 41 2HD2 ASN 41 -10.284 22.985 -17.504 341 HD22 ASN 41 1HD2 ASN 41 -10.530 24.601 -18.081 342 H GLU 42 H GLU 42 -6.315 20.136 -19.083 343 HA GLU 42 HA GLU 42 -5.419 18.768 -16.785 344 HB2 GLU 42 1HB GLU 42 -4.258 17.244 -18.371 345 HB3 GLU 42 2HB GLU 42 -5.955 17.505 -18.745 346 HG2 GLU 42 1HG GLU 42 -5.360 19.038 -20.518 347 HG3 GLU 42 2HG GLU 42 -3.652 18.887 -20.102 348 H GLU 43 H GLU 43 -3.951 21.229 -18.627 349 HA GLU 43 HA GLU 43 -1.237 20.637 -17.916 350 HB2 GLU 43 1HB GLU 43 -1.956 21.952 -19.941 351 HB3 GLU 43 2HB GLU 43 -2.408 23.258 -18.857 352 HG2 GLU 43 1HG GLU 43 -0.262 23.732 -19.795 353 HG3 GLU 43 2HG GLU 43 -0.065 23.374 -18.079 354 H VAL 44 H VAL 44 -3.904 22.308 -16.469 355 HA VAL 44 HA VAL 44 -2.119 23.730 -14.607 356 HB VAL 44 HB VAL 44 -5.069 24.188 -15.075 357 HG11 VAL 44 1HG1 VAL 44 -3.007 25.846 -13.629 358 HG12 VAL 44 2HG1 VAL 44 -4.323 24.936 -12.887 359 HG13 VAL 44 3HG1 VAL 44 -4.682 26.319 -13.921 360 HG21 VAL 44 3HG2 VAL 44 -3.819 24.681 -17.101 361 HG22 VAL 44 1HG2 VAL 44 -2.709 25.702 -16.185 362 HG23 VAL 44 2HG2 VAL 44 -4.402 26.167 -16.351 363 H ILE 45 H ILE 45 -4.801 21.473 -14.763 364 HA ILE 45 HA ILE 45 -5.295 21.512 -11.926 365 HB ILE 45 HB ILE 45 -6.333 19.655 -14.069 366 HG12 ILE 45 1HG1 ILE 45 -7.674 22.044 -12.806 367 HG13 ILE 45 2HG1 ILE 45 -6.885 22.064 -14.382 368 HG21 ILE 45 1HG2 ILE 45 -7.274 20.136 -11.244 369 HG22 ILE 45 2HG2 ILE 45 -6.548 18.657 -11.872 370 HG23 ILE 45 3HG2 ILE 45 -8.134 19.176 -12.447 371 HD11 ILE 45 3HD1 ILE 45 -9.313 21.797 -14.544 372 HD12 ILE 45 1HD1 ILE 45 -9.189 20.286 -13.646 373 HD13 ILE 45 2HD1 ILE 45 -8.431 20.432 -15.232 374 H ASP 46 H ASP 46 -4.892 19.857 -10.449 375 HA ASP 46 HA ASP 46 -3.268 17.592 -11.381 376 HB2 ASP 46 1HB ASP 46 -1.774 17.720 -9.551 377 HB3 ASP 46 2HB ASP 46 -1.902 19.374 -10.136 378 H GLN 47 H GLN 47 -3.207 15.911 -9.431 379 HA GLN 47 HA GLN 47 -5.815 14.912 -9.292 380 HB2 GLN 47 1HB GLN 47 -3.450 14.197 -7.564 381 HB3 GLN 47 2HB GLN 47 -4.918 13.245 -7.727 382 HG2 GLN 47 1HG GLN 47 -4.435 12.948 -10.113 383 HG3 GLN 47 2HG GLN 47 -2.936 13.850 -9.904 384 HE21 GLN 47 2HE2 GLN 47 -2.531 12.658 -7.211 385 HE22 GLN 47 1HE2 GLN 47 -1.962 11.049 -7.515 386 H LYS 48 H LYS 48 -3.908 16.628 -6.857 387 HA LYS 48 HA LYS 48 -5.740 16.211 -4.740 388 HB2 LYS 48 1HB LYS 48 -3.520 18.210 -5.137 389 HB3 LYS 48 2HB LYS 48 -4.439 18.063 -3.645 390 HG2 LYS 48 1HG LYS 48 -3.691 15.809 -3.339 391 HG3 LYS 48 2HG LYS 48 -2.899 15.815 -4.911 392 HD2 LYS 48 1HD LYS 48 -1.387 17.585 -4.114 393 HD3 LYS 48 2HD LYS 48 -2.163 17.507 -2.529 394 HE2 LYS 48 1HE LYS 48 -1.449 15.232 -2.229 395 HE3 LYS 48 2HE LYS 48 -0.823 15.165 -3.876 396 HZ1 LYS 48 3HZ LYS 48 0.958 15.485 -2.312 397 HZ2 LYS 48 1HZ LYS 48 0.213 16.869 -1.672 398 HZ3 LYS 48 2HZ LYS 48 0.793 16.878 -3.267 399 H MET 49 H MET 49 -5.290 18.803 -7.067 400 HA MET 49 HA MET 49 -7.186 20.601 -6.109 401 HB2 MET 49 1HB MET 49 -5.567 20.919 -8.042 402 HB3 MET 49 2HB MET 49 -6.700 20.009 -9.032 403 HG2 MET 49 1HG MET 49 -8.436 21.690 -8.510 404 HG3 MET 49 2HG MET 49 -7.221 22.612 -7.628 405 HE1 MET 49 3HE MET 49 -4.755 23.677 -10.471 406 HE2 MET 49 1HE MET 49 -4.631 22.275 -9.405 407 HE3 MET 49 2HE MET 49 -5.164 23.829 -8.764 408 H ILE 50 H ILE 50 -7.541 17.702 -8.088 409 HA ILE 50 HA ILE 50 -10.337 17.923 -8.540 410 HB ILE 50 HB ILE 50 -8.554 15.484 -8.497 411 HG12 ILE 50 1HG1 ILE 50 -7.961 17.183 -10.190 412 HG13 ILE 50 2HG1 ILE 50 -8.537 15.685 -10.919 413 HG21 ILE 50 1HG2 ILE 50 -10.314 14.367 -9.780 414 HG22 ILE 50 2HG2 ILE 50 -11.357 15.772 -9.563 415 HG23 ILE 50 3HG2 ILE 50 -10.858 14.819 -8.165 416 HD11 ILE 50 3HD1 ILE 50 -10.132 18.220 -10.575 417 HD12 ILE 50 1HD1 ILE 50 -10.723 16.722 -11.294 418 HD13 ILE 50 2HD1 ILE 50 -9.423 17.624 -12.076 419 H GLU 51 H GLU 51 -8.421 16.118 -6.162 420 HA GLU 51 HA GLU 51 -10.445 14.842 -4.769 421 HB2 GLU 51 1HB GLU 51 -7.868 16.006 -3.698 422 HB3 GLU 51 2HB GLU 51 -8.887 14.866 -2.833 423 HG2 GLU 51 1HG GLU 51 -8.454 13.159 -4.463 424 HG3 GLU 51 2HG GLU 51 -7.569 14.302 -5.477 425 H LYS 52 H LYS 52 -9.072 18.065 -4.174 426 HA LYS 52 HA LYS 52 -10.687 18.633 -1.920 427 HB2 LYS 52 1HB LYS 52 -8.895 20.177 -3.702 428 HB3 LYS 52 2HB LYS 52 -10.111 21.105 -2.836 429 HG2 LYS 52 1HG LYS 52 -8.337 21.207 -1.398 430 HG3 LYS 52 2HG LYS 52 -9.227 19.831 -0.757 431 HD2 LYS 52 1HD LYS 52 -6.998 19.464 -2.731 432 HD3 LYS 52 2HD LYS 52 -6.672 19.636 -1.008 433 HE2 LYS 52 1HE LYS 52 -8.420 17.530 -2.277 434 HE3 LYS 52 2HE LYS 52 -6.775 17.289 -1.689 435 HZ1 LYS 52 3HZ LYS 52 -8.154 16.529 0.015 436 HZ2 LYS 52 1HZ LYS 52 -9.223 17.840 -0.119 437 HZ3 LYS 52 2HZ LYS 52 -7.674 18.069 0.532 438 H SER 53 H SER 53 -11.048 19.308 -5.349 439 HA SER 53 HA SER 53 -13.455 20.859 -4.882 440 HB2 SER 53 1HB SER 53 -12.163 20.180 -7.527 441 HB3 SER 53 2HB SER 53 -13.299 21.489 -7.189 442 HG SER 53 HG SER 53 -10.577 21.268 -6.561 443 H LEU 54 H LEU 54 -13.131 17.706 -4.771 444 HA LEU 54 HA LEU 54 -14.735 16.593 -6.762 445 HB2 LEU 54 1HB LEU 54 -13.401 15.276 -5.156 446 HB3 LEU 54 2HB LEU 54 -14.516 15.715 -3.877 447 HG LEU 54 HG LEU 54 -16.325 14.513 -5.066 448 HD11 LEU 54 1HD1 LEU 54 -15.800 13.060 -6.940 449 HD12 LEU 54 2HD1 LEU 54 -14.140 13.659 -6.952 450 HD13 LEU 54 3HD1 LEU 54 -15.473 14.748 -7.340 451 HD21 LEU 54 3HD2 LEU 54 -13.858 12.865 -4.536 452 HD22 LEU 54 1HD2 LEU 54 -15.509 12.245 -4.628 453 HD23 LEU 54 2HD2 LEU 54 -15.054 13.363 -3.340 454 H ASN 55 H ASN 55 -15.577 18.255 -3.811 455 HA ASN 55 HA ASN 55 -18.357 17.654 -3.881 456 HB2 ASN 55 1HB ASN 55 -18.590 19.448 -2.208 457 HB3 ASN 55 2HB ASN 55 -17.289 18.337 -1.797 458 HD21 ASN 55 2HD2 ASN 55 -17.704 21.018 -0.866 459 HD22 ASN 55 1HD2 ASN 55 -16.307 21.929 -1.335 460 H LYS 56 H LYS 56 -16.374 20.288 -5.158 461 HA LYS 56 HA LYS 56 -18.547 21.855 -6.120 462 HB2 LYS 56 1HB LYS 56 -15.633 21.761 -6.923 463 HB3 LYS 56 2HB LYS 56 -16.786 22.895 -7.614 464 HG2 LYS 56 1HG LYS 56 -16.087 22.700 -4.691 465 HG3 LYS 56 2HG LYS 56 -15.431 23.883 -5.824 466 HD2 LYS 56 1HD LYS 56 -18.359 23.562 -5.184 467 HD3 LYS 56 2HD LYS 56 -17.301 24.759 -4.447 468 HE2 LYS 56 1HE LYS 56 -16.917 25.797 -6.590 469 HE3 LYS 56 2HE LYS 56 -17.858 24.546 -7.401 470 HZ1 LYS 56 3HZ LYS 56 -18.994 26.325 -5.318 471 HZ2 LYS 56 1HZ LYS 56 -19.836 25.297 -6.371 472 HZ3 LYS 56 2HZ LYS 56 -19.063 26.689 -6.972 473 H LEU 57 H LEU 57 -16.480 19.385 -7.572 474 HA LEU 57 HA LEU 57 -17.532 19.504 -10.171 475 HB2 LEU 57 1HB LEU 57 -16.016 17.487 -8.592 476 HB3 LEU 57 2HB LEU 57 -16.790 16.949 -10.070 477 HG LEU 57 HG LEU 57 -15.508 18.554 -11.376 478 HD11 LEU 57 1HD1 LEU 57 -13.746 19.905 -10.374 479 HD12 LEU 57 2HD1 LEU 57 -14.246 19.372 -8.769 480 HD13 LEU 57 3HD1 LEU 57 -15.333 20.357 -9.749 481 HD21 LEU 57 3HD2 LEU 57 -13.792 16.948 -9.490 482 HD22 LEU 57 1HD2 LEU 57 -13.268 17.618 -11.034 483 HD23 LEU 57 2HD2 LEU 57 -14.519 16.375 -10.992 484 H TYR 58 H TYR 58 -18.542 17.636 -7.342 485 HA TYR 58 HA TYR 58 -20.572 16.175 -8.691 486 HB2 TYR 58 1HB TYR 58 -19.491 15.630 -6.443 487 HB3 TYR 58 2HB TYR 58 -20.558 16.849 -5.751 488 HD1 TYR 58 HD2 TYR 58 -20.651 13.789 -7.859 489 HD2 TYR 58 HD1 TYR 58 -22.671 16.196 -4.996 490 HE1 TYR 58 HE2 TYR 58 -22.414 12.096 -7.695 491 HE2 TYR 58 HE1 TYR 58 -24.451 14.504 -4.825 492 HH TYR 58 HH TYR 58 -24.131 11.380 -6.013 493 H GLU 59 H GLU 59 -20.595 19.103 -6.705 494 HA GLU 59 HA GLU 59 -23.282 19.778 -6.817 495 HB2 GLU 59 1HB GLU 59 -21.672 21.001 -5.466 496 HB3 GLU 59 2HB GLU 59 -20.825 21.542 -6.902 497 HG2 GLU 59 1HG GLU 59 -22.823 22.842 -7.549 498 HG3 GLU 59 2HG GLU 59 -23.594 22.346 -6.042 499 H TYR 60 H TYR 60 -20.686 20.455 -9.080 500 HA TYR 60 HA TYR 60 -22.068 22.022 -10.918 501 HB2 TYR 60 1HB TYR 60 -19.734 22.052 -11.035 502 HB3 TYR 60 2HB TYR 60 -19.612 20.299 -11.042 503 HD1 TYR 60 HD2 TYR 60 -20.768 23.161 -13.129 504 HD2 TYR 60 HD1 TYR 60 -19.307 19.170 -13.041 505 HE1 TYR 60 HE2 TYR 60 -20.535 23.196 -15.572 506 HE2 TYR 60 HE1 TYR 60 -19.060 19.198 -15.485 507 HH TYR 60 HH TYR 60 -20.033 20.437 -17.424 508 H ILE 61 H ILE 61 -21.493 18.501 -10.981 509 HA ILE 61 HA ILE 61 -22.585 18.170 -13.557 510 HB ILE 61 HB ILE 61 -22.632 15.758 -13.094 511 HG12 ILE 61 1HG1 ILE 61 -21.715 16.545 -10.319 512 HG13 ILE 61 2HG1 ILE 61 -23.266 15.816 -10.721 513 HG21 ILE 61 1HG2 ILE 61 -20.615 16.807 -13.886 514 HG22 ILE 61 2HG2 ILE 61 -20.219 15.509 -12.757 515 HG23 ILE 61 3HG2 ILE 61 -20.134 17.192 -12.234 516 HD11 ILE 61 3HD1 ILE 61 -21.694 14.190 -9.811 517 HD12 ILE 61 1HD1 ILE 61 -20.579 14.531 -11.134 518 HD13 ILE 61 2HD1 ILE 61 -22.149 13.802 -11.470 519 H GLU 62 H GLU 62 -24.087 18.204 -10.398 520 HA GLU 62 HA GLU 62 -26.563 17.107 -11.468 521 HB2 GLU 62 1HB GLU 62 -25.871 18.087 -8.700 522 HB3 GLU 62 2HB GLU 62 -27.383 17.305 -9.150 523 HG2 GLU 62 1HG GLU 62 -24.671 16.054 -9.439 524 HG3 GLU 62 2HG GLU 62 -25.743 15.801 -8.062 525 H GLN 63 H GLN 63 -25.234 20.220 -10.640 526 HA GLN 63 HA GLN 63 -27.850 21.479 -10.590 527 HB2 GLN 63 1HB GLN 63 -26.780 23.449 -9.883 528 HB3 GLN 63 2HB GLN 63 -25.862 22.156 -9.125 529 HG2 GLN 63 1HG GLN 63 -24.139 22.352 -10.817 530 HG3 GLN 63 2HG GLN 63 -25.068 23.605 -11.638 531 HE21 GLN 63 2HE2 GLN 63 -22.398 23.689 -10.530 532 HE22 GLN 63 1HE2 GLN 63 -22.389 24.977 -9.375 533 H SER 64 H SER 64 -28.849 22.431 -12.251 534 HA SER 64 HA SER 64 -29.265 23.406 -14.264 535 HB2 SER 64 1HB SER 64 -27.985 25.147 -13.008 536 HB3 SER 64 2HB SER 64 -26.525 24.608 -13.830 537 HG SER 64 HG SER 64 -27.486 26.408 -14.856 538 H LYS 65 H LYS 65 -28.238 20.806 -14.568 539 HA LYS 65 HA LYS 65 -26.124 20.690 -16.429 540 HB2 LYS 65 1HB LYS 65 -26.983 18.387 -16.934 541 HB3 LYS 65 2HB LYS 65 -26.624 18.701 -15.245 542 HG2 LYS 65 1HG LYS 65 -29.090 19.129 -14.928 543 HG3 LYS 65 2HG LYS 65 -29.318 18.477 -16.554 544 HD2 LYS 65 1HD LYS 65 -29.654 16.695 -14.977 545 HD3 LYS 65 2HD LYS 65 -28.128 16.408 -15.817 546 HE2 LYS 65 1HE LYS 65 -27.010 17.588 -13.856 547 HE3 LYS 65 2HE LYS 65 -28.558 17.445 -13.025 548 HZ1 LYS 65 3HZ LYS 65 -27.130 15.620 -12.411 549 HZ2 LYS 65 1HZ LYS 65 -26.881 15.208 -14.038 550 HZ3 LYS 65 2HZ LYS 65 -28.414 15.024 -13.338 551 H ASN 66 H ASN 66 -29.478 21.404 -16.740 552 HA ASN 66 HA ASN 66 -28.939 22.031 -19.557 553 HB2 ASN 66 1HB ASN 66 -31.264 21.509 -20.171 554 HB3 ASN 66 2HB ASN 66 -30.412 20.081 -19.591 555 HD21 ASN 66 2HD2 ASN 66 -32.324 19.025 -19.106 556 HD22 ASN 66 1HD2 ASN 66 -33.307 19.464 -17.753 557 H CYS 67 H CYS 67 -31.202 23.379 -20.179 558 HA CYS 67 HA CYS 67 -31.878 25.206 -18.062 559 HB2 CYS 67 1HB CYS 67 -31.029 27.195 -18.951 560 HB3 CYS 67 2HB CYS 67 -29.699 26.069 -19.200 561 H SER 68 H SER 68 -33.514 26.848 -18.998 562 HA SER 68 HA SER 68 -35.581 25.162 -19.957 563 HB2 SER 68 1HB SER 68 -35.978 27.068 -18.426 564 HB3 SER 68 2HB SER 68 -35.575 28.185 -19.731 565 HG SER 68 HG SER 68 -37.691 26.280 -19.800 566 H TYR 69 H TYR 69 -33.619 27.646 -21.481 567 HA TYR 69 HA TYR 69 -34.842 27.929 -23.939 568 HB2 TYR 69 1HB TYR 69 -32.663 28.964 -22.831 569 HB3 TYR 69 2HB TYR 69 -31.865 27.763 -23.834 570 HD1 TYR 69 HD2 TYR 69 -32.308 27.820 -26.345 571 HD2 TYR 69 HD1 TYR 69 -33.382 30.991 -23.725 572 HE1 TYR 69 HE2 TYR 69 -32.429 29.356 -28.262 573 HE2 TYR 69 HE1 TYR 69 -33.502 32.537 -25.631 574 HH TYR 69 HH TYR 69 -33.562 31.504 -28.836 575 H CYS 70 H CYS 70 -33.194 25.157 -22.724 576 HA CYS 70 HA CYS 70 -33.322 23.932 -25.401 577 HB2 CYS 70 1HB CYS 70 -31.336 22.607 -24.885 578 HB3 CYS 70 2HB CYS 70 -30.971 24.325 -24.772 579 H SER 71 H SER 71 -34.912 24.040 -22.723 580 HA SER 71 HA SER 71 -35.151 21.146 -22.316 581 HB2 SER 71 1HB SER 71 -34.698 22.513 -20.292 582 HB3 SER 71 2HB SER 71 -36.185 23.410 -20.584 583 HG SER 71 HG SER 71 -37.343 21.759 -19.902 584 H GLU 72 H GLU 72 -36.788 20.171 -23.250 585 HA GLU 72 HA GLU 72 -38.934 21.714 -24.429 586 HB2 GLU 72 1HB GLU 72 -39.641 19.543 -25.385 587 HB3 GLU 72 2HB GLU 72 -37.955 19.902 -25.731 588 HG2 GLU 72 1HG GLU 72 -37.395 18.459 -23.719 589 HG3 GLU 72 2HG GLU 72 -39.075 17.931 -23.769 590 H ASP 73 H ASP 73 -38.326 19.825 -21.625 591 HA ASP 73 HA ASP 73 -41.128 19.631 -20.918 592 HB2 ASP 73 1HB ASP 73 -39.499 17.868 -20.256 593 HB3 ASP 73 2HB ASP 73 -38.697 19.045 -19.218 594 H GLU 74 H GLU 74 -42.192 20.881 -19.497 595 HA GLU 74 HA GLU 74 -41.111 23.519 -19.045 596 HB2 GLU 74 1HB GLU 74 -43.816 22.306 -18.473 597 HB3 GLU 74 2HB GLU 74 -43.412 23.997 -18.202 598 HG2 GLU 74 1HG GLU 74 -43.218 22.631 -20.870 599 HG3 GLU 74 2HG GLU 74 -44.626 23.538 -20.320 600 H ASN 75 H ASN 75 -41.414 20.641 -17.214 601 HA ASN 75 HA ASN 75 -41.550 22.119 -14.678 602 HB2 ASN 75 1HB ASN 75 -41.887 19.149 -15.153 603 HB3 ASN 75 2HB ASN 75 -42.180 20.008 -13.645 604 HD21 ASN 75 2HD2 ASN 75 -44.017 21.352 -13.468 605 HD22 ASN 75 1HD2 ASN 75 -45.339 21.222 -14.584 606 H CYS 76 H CYS 76 -39.135 21.870 -16.361 607 HA CYS 76 HA CYS 76 -37.363 20.147 -14.875 608 HB2 CYS 76 1HB CYS 76 -37.063 20.673 -17.319 609 HB3 CYS 76 2HB CYS 76 -36.633 22.316 -16.855 610 HG CYS 76 HG CYS 76 -34.137 21.644 -16.981 611 H ASN 77 H ASN 77 -35.615 20.900 -13.548 612 HA ASN 77 HA ASN 77 -36.358 23.354 -12.124 613 HB2 ASN 77 1HB ASN 77 -36.361 21.336 -10.754 614 HB3 ASN 77 2HB ASN 77 -34.695 20.999 -11.208 615 HD21 ASN 77 2HD2 ASN 77 -36.805 22.992 -9.310 616 HD22 ASN 77 1HD2 ASN 77 -35.573 23.712 -8.320 617 H ASN 78 H ASN 78 -35.262 25.061 -12.762 618 HA ASN 78 HA ASN 78 -32.556 25.333 -12.108 619 HB2 ASN 78 1HB ASN 78 -32.169 24.069 -14.204 620 HB3 ASN 78 2HB ASN 78 -33.065 25.294 -15.097 621 HD21 ASN 78 2HD2 ASN 78 -31.187 25.605 -16.357 622 HD22 ASN 78 1HD2 ASN 78 -29.862 26.539 -15.769 623 H LEU 79 H LEU 79 -31.866 27.504 -12.241 624 HA LEU 79 HA LEU 79 -34.118 29.369 -12.514 625 HB2 LEU 79 1HB LEU 79 -31.457 29.678 -11.118 626 HB3 LEU 79 2HB LEU 79 -32.694 30.917 -11.195 627 HG LEU 79 HG LEU 79 -34.200 29.148 -10.056 628 HD11 LEU 79 1HD1 LEU 79 -31.475 28.089 -9.337 629 HD12 LEU 79 2HD1 LEU 79 -32.704 27.250 -10.283 630 HD13 LEU 79 3HD1 LEU 79 -32.994 27.614 -8.582 631 HD21 LEU 79 3HD2 LEU 79 -31.954 30.556 -8.637 632 HD22 LEU 79 1HD2 LEU 79 -33.380 29.888 -7.845 633 HD23 LEU 79 2HD2 LEU 79 -33.551 31.207 -9.004 634 H LEU 80 H LEU 80 -30.780 28.863 -13.441 635 HA LEU 80 HA LEU 80 -30.527 31.317 -14.869 636 HB2 LEU 80 1HB LEU 80 -28.843 28.824 -14.835 637 HB3 LEU 80 2HB LEU 80 -28.452 30.212 -15.831 638 HG LEU 80 HG LEU 80 -27.101 30.420 -13.930 639 HD11 LEU 80 1HD1 LEU 80 -28.138 32.507 -14.525 640 HD12 LEU 80 2HD1 LEU 80 -27.936 32.414 -12.776 641 HD13 LEU 80 3HD1 LEU 80 -29.523 32.146 -13.494 642 HD21 LEU 80 3HD2 LEU 80 -28.114 28.777 -12.505 643 HD22 LEU 80 1HD2 LEU 80 -29.532 29.801 -12.264 644 HD23 LEU 80 2HD2 LEU 80 -27.966 30.298 -11.624 645 H GLU 81 H GLU 81 -31.630 31.744 -16.638 646 HA GLU 81 HA GLU 81 -32.172 29.603 -18.549 647 HB2 GLU 81 1HB GLU 81 -34.080 30.982 -18.035 648 HB3 GLU 81 2HB GLU 81 -33.175 32.448 -18.385 649 HG2 GLU 81 1HG GLU 81 -34.658 31.965 -20.209 650 HG3 GLU 81 2HG GLU 81 -32.990 31.756 -20.731 651 H GLY 82 H GLY 82 -31.345 29.537 -20.554 652 HA2 GLY 82 1HA GLY 82 -30.069 30.106 -22.386 653 HA3 GLY 82 2HA GLY 82 -29.892 31.717 -21.714 654 H TYR 83 H TYR 83 -28.919 29.887 -19.239 655 HA TYR 83 HA TYR 83 -26.151 29.714 -20.233 656 HB2 TYR 83 1HB TYR 83 -27.080 30.708 -17.533 657 HB3 TYR 83 2HB TYR 83 -25.401 30.421 -17.967 658 HD1 TYR 83 HD2 TYR 83 -24.243 31.925 -19.506 659 HD2 TYR 83 HD1 TYR 83 -28.276 32.634 -18.357 660 HE1 TYR 83 HE2 TYR 83 -24.074 34.232 -20.348 661 HE2 TYR 83 HE1 TYR 83 -28.116 34.938 -19.191 662 HH TYR 83 HH TYR 83 -25.452 36.033 -21.090 663 H HIS 84 H HIS 84 -24.836 28.119 -19.343 664 HA HIS 84 HA HIS 84 -26.053 26.296 -17.370 665 HB2 HIS 84 1HB HIS 84 -24.269 25.510 -19.686 666 HB3 HIS 84 2HB HIS 84 -24.657 24.452 -18.343 667 HD1 HIS 84 HD1 HIS 84 -25.897 22.676 -19.660 668 HD2 HIS 84 HD2 HIS 84 -27.415 26.492 -20.219 669 HE1 HIS 84 HE1 HIS 84 -27.842 22.451 -21.270 670 HA PRO 85 HA PRO 85 -22.232 27.063 -15.254 671 HB2 PRO 85 1HB PRO 85 -22.078 24.908 -13.655 672 HB3 PRO 85 2HB PRO 85 -23.309 26.153 -13.424 673 HG2 PRO 85 1HG PRO 85 -23.552 23.452 -14.658 674 HG3 PRO 85 2HG PRO 85 -24.709 24.333 -13.645 675 HD2 PRO 85 1HD PRO 85 -24.813 24.156 -16.418 676 HD3 PRO 85 2HD PRO 85 -25.632 25.390 -15.446 677 H LYS 86 H LYS 86 -20.060 26.589 -15.416 678 HA LYS 86 HA LYS 86 -19.300 24.009 -16.568 679 HB2 LYS 86 1HB LYS 86 -19.343 25.829 -18.335 680 HB3 LYS 86 2HB LYS 86 -18.039 26.605 -17.448 681 HG2 LYS 86 1HG LYS 86 -16.675 24.570 -17.737 682 HG3 LYS 86 2HG LYS 86 -17.981 23.869 -18.696 683 HD2 LYS 86 1HD LYS 86 -16.691 24.729 -20.373 684 HD3 LYS 86 2HD LYS 86 -17.722 26.121 -20.051 685 HE2 LYS 86 1HE LYS 86 -15.479 26.909 -20.203 686 HE3 LYS 86 2HE LYS 86 -15.950 26.973 -18.505 687 HZ1 LYS 86 3HZ LYS 86 -14.754 24.905 -18.132 688 HZ2 LYS 86 1HZ LYS 86 -13.720 26.076 -18.780 689 HZ3 LYS 86 2HZ LYS 86 -14.305 24.833 -19.764 690 H LEU 87 H LEU 87 -17.427 23.199 -15.842 691 HA LEU 87 HA LEU 87 -16.376 24.144 -13.393 692 HB2 LEU 87 1HB LEU 87 -16.246 21.833 -15.009 693 HB3 LEU 87 2HB LEU 87 -14.596 22.371 -14.780 694 HG LEU 87 HG LEU 87 -14.676 22.033 -12.463 695 HD11 LEU 87 1HD1 LEU 87 -17.677 21.864 -12.735 696 HD12 LEU 87 2HD1 LEU 87 -16.757 23.140 -11.937 697 HD13 LEU 87 3HD1 LEU 87 -16.779 21.514 -11.257 698 HD21 LEU 87 3HD2 LEU 87 -16.398 19.882 -13.681 699 HD22 LEU 87 1HD2 LEU 87 -15.398 19.736 -12.235 700 HD23 LEU 87 2HD2 LEU 87 -14.640 19.974 -13.812 701 H VAL 88 H VAL 88 -14.797 25.588 -13.032 702 HA VAL 88 HA VAL 88 -12.993 26.264 -15.261 703 HB VAL 88 HB VAL 88 -13.003 28.593 -14.655 704 HG11 VAL 88 1HG1 VAL 88 -15.819 27.549 -14.872 705 HG12 VAL 88 2HG1 VAL 88 -14.735 27.938 -16.210 706 HG13 VAL 88 3HG1 VAL 88 -15.331 29.220 -15.152 707 HG21 VAL 88 3HG2 VAL 88 -14.462 29.510 -12.916 708 HG22 VAL 88 1HG2 VAL 88 -13.284 28.382 -12.243 709 HG23 VAL 88 2HG2 VAL 88 -14.959 27.877 -12.474 710 H VAL 89 H VAL 89 -10.848 26.658 -14.692 711 HA VAL 89 HA VAL 89 -10.214 26.091 -11.889 712 HB VAL 89 HB VAL 89 -9.117 24.584 -13.480 713 HG11 VAL 89 1HG1 VAL 89 -8.956 26.040 -15.408 714 HG12 VAL 89 2HG1 VAL 89 -7.366 25.401 -14.985 715 HG13 VAL 89 3HG1 VAL 89 -7.792 27.060 -14.564 716 HG21 VAL 89 3HG2 VAL 89 -7.208 26.476 -12.112 717 HG22 VAL 89 1HG2 VAL 89 -6.816 24.850 -12.670 718 HG23 VAL 89 2HG2 VAL 89 -7.998 25.078 -11.382 719 H ASN 90 H ASN 90 -9.853 27.748 -10.668 720 HA ASN 90 HA ASN 90 -8.668 30.161 -11.877 721 HB2 ASN 90 1HB ASN 90 -10.617 29.888 -9.576 722 HB3 ASN 90 2HB ASN 90 -9.750 31.379 -9.935 723 HD21 ASN 90 2HD2 ASN 90 -12.619 30.771 -9.960 724 HD22 ASN 90 1HD2 ASN 90 -13.181 31.167 -11.549 725 H GLY 91 H GLY 91 -6.555 29.757 -11.525 726 HA2 GLY 91 1HA GLY 91 -4.593 29.680 -10.335 727 HA3 GLY 91 2HA GLY 91 -5.519 30.069 -8.890 728 H ARG 92 H ARG 92 -5.549 28.581 -7.379 729 HA ARG 92 HA ARG 92 -4.911 25.804 -8.121 730 HB2 ARG 92 1HB ARG 92 -4.541 27.351 -5.561 731 HB3 ARG 92 2HB ARG 92 -4.362 25.605 -5.644 732 HG2 ARG 92 1HG ARG 92 -2.784 27.492 -7.374 733 HG3 ARG 92 2HG ARG 92 -2.236 26.945 -5.790 734 HD2 ARG 92 1HD ARG 92 -2.912 25.159 -8.124 735 HD3 ARG 92 2HD ARG 92 -1.283 25.600 -7.612 736 HE ARG 92 HE ARG 92 -2.219 24.541 -5.367 737 HH11 ARG 92 1HH1 ARG 92 -2.392 23.365 -8.678 738 HH12 ARG 92 2HH1 ARG 92 -2.568 21.698 -8.196 739 HH21 ARG 92 1HH2 ARG 92 -2.390 22.357 -4.765 740 HH22 ARG 92 2HH2 ARG 92 -2.517 21.130 -5.984 741 H SER 93 H SER 93 -7.589 27.286 -8.040 742 HA SER 93 HA SER 93 -8.991 25.269 -6.428 743 HB2 SER 93 1HB SER 93 -9.794 28.180 -6.668 744 HB3 SER 93 2HB SER 93 -10.616 26.938 -5.724 745 HG SER 93 HG SER 93 -8.227 26.806 -4.842 746 H ILE 94 H ILE 94 -10.843 24.420 -7.335 747 HA ILE 94 HA ILE 94 -11.426 25.254 -10.087 748 HB ILE 94 HB ILE 94 -12.216 22.715 -8.641 749 HG12 ILE 94 1HG1 ILE 94 -10.206 23.163 -10.862 750 HG13 ILE 94 2HG1 ILE 94 -9.795 22.916 -9.168 751 HG21 ILE 94 1HG2 ILE 94 -12.632 23.571 -11.503 752 HG22 ILE 94 2HG2 ILE 94 -13.882 23.315 -10.286 753 HG23 ILE 94 3HG2 ILE 94 -12.938 21.949 -10.879 754 HD11 ILE 94 3HD1 ILE 94 -9.486 20.885 -10.445 755 HD12 ILE 94 1HD1 ILE 94 -11.176 20.926 -10.954 756 HD13 ILE 94 2HD1 ILE 94 -10.771 20.688 -9.254 757 H ASP 95 H ASP 95 -13.237 26.320 -10.521 758 HA ASP 95 HA ASP 95 -15.313 26.446 -8.437 759 HB2 ASP 95 1HB ASP 95 -13.731 28.541 -8.958 760 HB3 ASP 95 2HB ASP 95 -14.892 28.772 -10.255 761 H ILE 96 H ILE 96 -17.338 27.568 -9.536 762 HA ILE 96 HA ILE 96 -17.767 26.278 -12.157 763 HB ILE 96 HB ILE 96 -19.793 26.514 -9.927 764 HG12 ILE 96 1HG1 ILE 96 -18.466 24.014 -10.977 765 HG13 ILE 96 2HG1 ILE 96 -17.864 24.893 -9.574 766 HG21 ILE 96 1HG2 ILE 96 -20.773 26.579 -12.167 767 HG22 ILE 96 2HG2 ILE 96 -21.170 25.072 -11.340 768 HG23 ILE 96 3HG2 ILE 96 -19.921 25.092 -12.585 769 HD11 ILE 96 3HD1 ILE 96 -19.218 23.003 -8.919 770 HD12 ILE 96 1HD1 ILE 96 -20.578 23.636 -9.845 771 HD13 ILE 96 2HD1 ILE 96 -19.982 24.519 -8.438 772 H GLU 97 H GLU 97 -17.997 27.826 -13.630 773 HA GLU 97 HA GLU 97 -19.675 30.159 -12.980 774 HB2 GLU 97 1HB GLU 97 -17.108 30.157 -14.587 775 HB3 GLU 97 2HB GLU 97 -18.196 31.532 -14.430 776 HG2 GLU 97 1HG GLU 97 -17.832 31.521 -11.996 777 HG3 GLU 97 2HG GLU 97 -16.692 30.191 -12.189 778 H TYR 98 H TYR 98 -20.591 31.193 -15.019 779 HA TYR 98 HA TYR 98 -21.746 28.895 -16.419 780 HB2 TYR 98 1HB TYR 98 -22.752 31.566 -15.586 781 HB3 TYR 98 2HB TYR 98 -23.527 30.765 -16.953 782 HD1 TYR 98 HD1 TYR 98 -22.397 29.991 -13.470 783 HD2 TYR 98 HD2 TYR 98 -25.339 29.387 -16.496 784 HE1 TYR 98 HE1 TYR 98 -23.715 28.629 -11.907 785 HE2 TYR 98 HE2 TYR 98 -26.660 28.026 -14.932 786 HH TYR 98 HH TYR 98 -25.949 27.859 -11.570 787 H TYR 99 H TYR 99 -22.420 29.014 -18.570 788 HA TYR 99 HA TYR 99 -21.237 31.078 -20.279 789 HB2 TYR 99 1HB TYR 99 -20.456 29.411 -21.898 790 HB3 TYR 99 2HB TYR 99 -19.679 29.152 -20.341 791 HD1 TYR 99 HD2 TYR 99 -20.210 27.201 -19.003 792 HD2 TYR 99 HD1 TYR 99 -22.037 27.787 -22.795 793 HE1 TYR 99 HE2 TYR 99 -20.944 24.858 -19.001 794 HE2 TYR 99 HE1 TYR 99 -22.771 25.439 -22.811 795 HH TYR 99 HH TYR 99 -22.516 23.416 -20.010 796 H GLU 100 H GLU 100 -22.273 31.101 -22.457 797 HA GLU 100 HA GLU 100 -25.101 30.871 -22.179 798 HB2 GLU 100 1HB GLU 100 -23.481 31.446 -24.664 799 HB3 GLU 100 2HB GLU 100 -25.214 31.686 -24.487 800 HG2 GLU 100 1HG GLU 100 -24.567 33.801 -24.080 801 HG3 GLU 100 2HG GLU 100 -24.362 33.182 -22.442 802 H CYS 101 H CYS 101 -26.379 29.265 -22.619 803 HA CYS 101 HA CYS 101 -25.841 26.719 -23.465 804 HB2 CYS 101 1HB CYS 101 -28.032 27.600 -22.619 805 HB3 CYS 101 2HB CYS 101 -28.308 28.319 -24.197 806 HA PRO 102 HA PRO 102 -24.431 27.412 -27.673 807 HB2 PRO 102 1HB PRO 102 -24.202 24.776 -28.353 808 HB3 PRO 102 2HB PRO 102 -22.997 25.648 -27.401 809 HG2 PRO 102 1HG PRO 102 -25.175 23.818 -26.475 810 HG3 PRO 102 2HG PRO 102 -23.493 23.923 -25.926 811 HD2 PRO 102 1HD PRO 102 -25.523 25.017 -24.531 812 HD3 PRO 102 2HD PRO 102 -23.909 25.759 -24.587 813 H VAL 103 H VAL 103 -27.176 25.559 -26.705 814 HA VAL 103 HA VAL 103 -28.237 24.961 -29.256 815 HB VAL 103 HB VAL 103 -29.775 25.297 -26.678 816 HG11 VAL 103 1HG1 VAL 103 -31.184 25.140 -28.663 817 HG12 VAL 103 2HG1 VAL 103 -31.342 23.701 -27.656 818 HG13 VAL 103 3HG1 VAL 103 -30.375 23.643 -29.131 819 HG21 VAL 103 3HG2 VAL 103 -27.920 23.801 -26.303 820 HG22 VAL 103 1HG2 VAL 103 -28.343 22.872 -27.741 821 HG23 VAL 103 2HG2 VAL 103 -29.427 22.888 -26.350 822 H LYS 104 H LYS 104 -28.020 27.882 -27.508 823 HA LYS 104 HA LYS 104 -30.396 29.145 -28.443 824 HB2 LYS 104 1HB LYS 104 -28.963 29.876 -26.460 825 HB3 LYS 104 2HB LYS 104 -27.854 30.564 -27.643 826 HG2 LYS 104 1HG LYS 104 -29.808 31.857 -28.550 827 HG3 LYS 104 2HG LYS 104 -30.713 31.322 -27.136 828 HD2 LYS 104 1HD LYS 104 -28.915 32.347 -25.720 829 HD3 LYS 104 2HD LYS 104 -28.235 33.034 -27.199 830 HE2 LYS 104 1HE LYS 104 -30.824 33.656 -25.838 831 HE3 LYS 104 2HE LYS 104 -29.576 34.755 -26.421 832 HZ1 LYS 104 3HZ LYS 104 -30.220 34.047 -28.723 833 HZ2 LYS 104 1HZ LYS 104 -31.412 34.926 -27.893 834 HZ3 LYS 104 2HZ LYS 104 -31.549 33.246 -28.043 835 H ARG 105 H ARG 105 -27.387 28.398 -29.843 836 HA ARG 105 HA ARG 105 -27.387 30.533 -31.791 837 HB2 ARG 105 1HB ARG 105 -25.656 28.063 -31.583 838 HB3 ARG 105 2HB ARG 105 -25.365 29.440 -32.638 839 HG2 ARG 105 1HG ARG 105 -25.072 30.876 -30.687 840 HG3 ARG 105 2HG ARG 105 -25.369 29.496 -29.628 841 HD2 ARG 105 1HD ARG 105 -23.412 28.372 -30.486 842 HD3 ARG 105 2HD ARG 105 -23.145 29.666 -31.653 843 HE ARG 105 HE ARG 105 -22.766 29.855 -28.740 844 HH11 ARG 105 1HH1 ARG 105 -22.432 31.213 -31.952 845 HH12 ARG 105 2HH1 ARG 105 -21.234 32.385 -31.478 846 HH21 ARG 105 1HH2 ARG 105 -21.195 31.399 -28.098 847 HH22 ARG 105 2HH2 ARG 105 -20.536 32.495 -29.281 848 H LYS 106 H LYS 106 -29.736 28.992 -31.893 849 HA LYS 106 HA LYS 106 -29.495 27.108 -34.056 850 HB2 LYS 106 1HB LYS 106 -31.009 26.857 -32.042 851 HB3 LYS 106 2HB LYS 106 -31.990 28.149 -32.722 852 HG2 LYS 106 1HG LYS 106 -32.956 26.049 -33.283 853 HG3 LYS 106 2HG LYS 106 -32.302 26.791 -34.742 854 HD2 LYS 106 1HD LYS 106 -30.292 25.397 -34.539 855 HD3 LYS 106 2HD LYS 106 -30.974 24.642 -33.098 856 HE2 LYS 106 1HE LYS 106 -32.829 23.778 -34.421 857 HE3 LYS 106 2HE LYS 106 -32.169 24.550 -35.864 858 HZ1 LYS 106 3HZ LYS 106 -30.911 22.375 -34.280 859 HZ2 LYS 106 1HZ LYS 106 -30.157 23.180 -35.569 860 HZ3 LYS 106 2HZ LYS 106 -31.551 22.252 -35.845 Start of MODEL 19 1 HA MET 1 HA MET 1 -15.475 -31.881 -9.498 2 HB2 MET 1 1HB MET 1 -16.818 -31.370 -11.452 3 HB3 MET 1 2HB MET 1 -18.296 -31.441 -10.499 4 HG2 MET 1 1HG MET 1 -17.631 -29.146 -10.974 5 HG3 MET 1 2HG MET 1 -17.613 -29.486 -9.245 6 HE1 MET 1 2HE MET 1 -16.243 -26.912 -10.357 7 HE2 MET 1 3HE MET 1 -14.684 -26.939 -9.534 8 HE3 MET 1 1HE MET 1 -16.150 -27.381 -8.659 9 H GLU 2 H GLU 2 -15.220 -31.000 -7.577 10 HA GLU 2 HA GLU 2 -17.528 -30.843 -5.752 11 HB2 GLU 2 1HB GLU 2 -14.624 -31.377 -5.077 12 HB3 GLU 2 2HB GLU 2 -15.877 -31.063 -3.885 13 HG2 GLU 2 1HG GLU 2 -17.058 -33.067 -4.566 14 HG3 GLU 2 2HG GLU 2 -15.858 -33.365 -5.821 15 HA PRO 3 HA PRO 3 -16.986 -26.475 -5.682 16 HB2 PRO 3 1HB PRO 3 -17.352 -25.990 -2.978 17 HB3 PRO 3 2HB PRO 3 -18.649 -26.173 -4.161 18 HG2 PRO 3 1HG PRO 3 -17.527 -28.180 -2.254 19 HG3 PRO 3 2HG PRO 3 -19.212 -27.903 -2.731 20 HD2 PRO 3 1HD PRO 3 -17.807 -29.946 -3.731 21 HD3 PRO 3 2HD PRO 3 -18.961 -29.046 -4.738 22 H ILE 4 H ILE 4 -15.417 -24.930 -5.295 23 HA ILE 4 HA ILE 4 -12.903 -25.929 -4.373 24 HB ILE 4 HB ILE 4 -12.174 -23.554 -4.990 25 HG12 ILE 4 1HG1 ILE 4 -13.604 -22.515 -6.775 26 HG13 ILE 4 2HG1 ILE 4 -14.908 -23.570 -6.263 27 HG21 ILE 4 1HG2 ILE 4 -11.649 -25.535 -6.277 28 HG22 ILE 4 2HG2 ILE 4 -11.977 -24.162 -7.334 29 HG23 ILE 4 3HG2 ILE 4 -13.200 -25.411 -7.109 30 HD11 ILE 4 3HD1 ILE 4 -15.163 -21.359 -5.321 31 HD12 ILE 4 1HD1 ILE 4 -13.561 -21.461 -4.591 32 HD13 ILE 4 2HD1 ILE 4 -14.850 -22.533 -4.042 33 H GLY 5 H GLY 5 -11.517 -24.570 -2.967 34 HA2 GLY 5 1HA GLY 5 -13.012 -23.866 -0.573 35 HA3 GLY 5 2HA GLY 5 -11.268 -24.045 -0.703 36 H ARG 6 H ARG 6 -13.305 -21.893 0.219 37 HA ARG 6 HA ARG 6 -11.651 -19.668 -0.609 38 HB2 ARG 6 1HB ARG 6 -13.281 -19.689 -2.415 39 HB3 ARG 6 2HB ARG 6 -14.605 -19.757 -1.262 40 HG2 ARG 6 1HG ARG 6 -14.106 -17.532 -0.485 41 HG3 ARG 6 2HG ARG 6 -12.668 -17.463 -1.504 42 HD2 ARG 6 1HD ARG 6 -15.472 -17.805 -2.547 43 HD3 ARG 6 2HD ARG 6 -14.638 -16.255 -2.432 44 HE ARG 6 HE ARG 6 -12.901 -17.447 -3.914 45 HH11 ARG 6 1HH1 ARG 6 -16.346 -18.022 -4.033 46 HH12 ARG 6 2HH1 ARG 6 -16.360 -18.376 -5.739 47 HH21 ARG 6 1HH2 ARG 6 -12.895 -17.890 -6.149 48 HH22 ARG 6 2HH2 ARG 6 -14.388 -18.309 -6.946 49 H SER 7 H SER 7 -11.647 -18.030 0.899 50 HA SER 7 HA SER 7 -12.803 -18.711 3.450 51 HB2 SER 7 1HB SER 7 -11.200 -16.260 2.690 52 HB3 SER 7 2HB SER 7 -11.485 -16.882 4.318 53 HG SER 7 HG SER 7 -9.405 -17.440 3.362 54 H LEU 8 H LEU 8 -15.002 -18.406 3.395 55 HA LEU 8 HA LEU 8 -16.025 -15.808 2.561 56 HB2 LEU 8 1HB LEU 8 -17.349 -18.377 3.380 57 HB3 LEU 8 2HB LEU 8 -18.256 -16.881 3.339 58 HG LEU 8 HG LEU 8 -18.675 -18.046 1.301 59 HD11 LEU 8 1HD1 LEU 8 -17.898 -16.449 -0.369 60 HD12 LEU 8 2HD1 LEU 8 -16.712 -15.822 0.775 61 HD13 LEU 8 3HD1 LEU 8 -18.435 -15.632 1.100 62 HD21 LEU 8 3HD2 LEU 8 -15.685 -18.196 0.949 63 HD22 LEU 8 1HD2 LEU 8 -16.879 -18.663 -0.263 64 HD23 LEU 8 2HD2 LEU 8 -16.780 -19.543 1.263 65 H GLN 9 H GLN 9 -14.793 -14.733 4.255 66 HA GLN 9 HA GLN 9 -16.031 -14.933 6.912 67 HB2 GLN 9 1HB GLN 9 -13.545 -13.466 5.996 68 HB3 GLN 9 2HB GLN 9 -14.153 -13.479 7.646 69 HG2 GLN 9 1HG GLN 9 -13.280 -15.920 6.120 70 HG3 GLN 9 2HG GLN 9 -12.277 -15.035 7.269 71 HE21 GLN 9 2HE2 GLN 9 -13.214 -17.807 7.310 72 HE22 GLN 9 1HE2 GLN 9 -14.072 -17.988 8.803 73 H GLY 10 H GLY 10 -15.696 -12.920 4.122 74 HA2 GLY 10 1HA GLY 10 -17.312 -11.261 3.560 75 HA3 GLY 10 2HA GLY 10 -17.626 -11.032 5.278 76 H VAL 11 H VAL 11 -16.977 -9.008 3.273 77 HA VAL 11 HA VAL 11 -14.278 -8.196 3.769 78 HB VAL 11 HB VAL 11 -15.027 -5.989 2.756 79 HG11 VAL 11 1HG1 VAL 11 -15.455 -8.510 1.160 80 HG12 VAL 11 2HG1 VAL 11 -13.903 -7.739 1.484 81 HG13 VAL 11 3HG1 VAL 11 -15.108 -6.913 0.497 82 HG21 VAL 11 3HG2 VAL 11 -17.150 -5.992 1.539 83 HG22 VAL 11 1HG2 VAL 11 -17.409 -6.148 3.277 84 HG23 VAL 11 2HG2 VAL 11 -17.550 -7.563 2.234 85 H THR 12 H THR 12 -13.925 -8.023 5.917 86 HA THR 12 HA THR 12 -15.655 -6.563 7.659 87 HB THR 12 HB THR 12 -13.673 -6.820 9.264 88 HG1 THR 12 HG1 THR 12 -11.998 -7.174 7.849 89 HG21 THR 12 3HG2 THR 12 -14.890 -9.301 8.041 90 HG22 THR 12 1HG2 THR 12 -15.624 -8.303 9.296 91 HG23 THR 12 2HG2 THR 12 -14.142 -9.196 9.635 92 H GLY 13 H GLY 13 -15.837 -4.503 6.885 93 HA2 GLY 13 1HA GLY 13 -14.717 -2.366 7.715 94 HA3 GLY 13 2HA GLY 13 -13.374 -2.909 6.718 95 H ARG 14 H ARG 14 -16.735 -1.857 6.663 96 HA ARG 14 HA ARG 14 -16.177 -0.555 4.134 97 HB2 ARG 14 1HB ARG 14 -18.202 -1.322 3.027 98 HB3 ARG 14 2HB ARG 14 -17.174 -2.683 3.426 99 HG2 ARG 14 1HG ARG 14 -19.500 -1.892 5.149 100 HG3 ARG 14 2HG ARG 14 -19.685 -2.941 3.750 101 HD2 ARG 14 1HD ARG 14 -18.113 -4.533 4.729 102 HD3 ARG 14 2HD ARG 14 -17.900 -3.473 6.123 103 HE ARG 14 HE ARG 14 -20.611 -3.931 5.951 104 HH11 ARG 14 1HH1 ARG 14 -17.791 -5.989 6.230 105 HH12 ARG 14 2HH1 ARG 14 -18.585 -7.154 7.250 106 HH21 ARG 14 1HH2 ARG 14 -21.673 -5.476 7.241 107 HH22 ARG 14 2HH2 ARG 14 -20.816 -6.905 7.765 108 HA PRO 15 HA PRO 15 -18.337 2.079 7.251 109 HB2 PRO 15 1HB PRO 15 -16.823 4.283 6.680 110 HB3 PRO 15 2HB PRO 15 -16.386 3.080 7.896 111 HG2 PRO 15 1HG PRO 15 -15.409 3.385 5.089 112 HG3 PRO 15 2HG PRO 15 -14.499 2.968 6.552 113 HD2 PRO 15 1HD PRO 15 -15.258 1.114 4.738 114 HD3 PRO 15 2HD PRO 15 -15.141 0.757 6.471 115 H ASP 16 H ASP 16 -19.935 3.517 6.858 116 HA ASP 16 HA ASP 16 -21.034 3.736 4.300 117 HB2 ASP 16 1HB ASP 16 -21.489 5.478 6.735 118 HB3 ASP 16 2HB ASP 16 -22.475 5.522 5.277 119 H PHE 17 H PHE 17 -18.905 5.871 6.080 120 HA PHE 17 HA PHE 17 -19.051 8.209 4.662 121 HB2 PHE 17 1HB PHE 17 -17.691 7.948 6.678 122 HB3 PHE 17 2HB PHE 17 -16.570 6.908 5.809 123 HD1 PHE 17 HD2 PHE 17 -17.861 10.358 6.061 124 HD2 PHE 17 HD1 PHE 17 -14.824 7.811 4.509 125 HE1 PHE 17 HE2 PHE 17 -16.541 12.331 5.423 126 HE2 PHE 17 HE1 PHE 17 -13.496 9.781 3.868 127 HZ PHE 17 HZ PHE 17 -14.354 12.044 4.323 128 H GLN 18 H GLN 18 -16.795 5.523 3.967 129 HA GLN 18 HA GLN 18 -15.741 6.801 1.672 130 HB2 GLN 18 1HB GLN 18 -14.606 4.712 1.193 131 HB3 GLN 18 2HB GLN 18 -14.451 5.128 2.892 132 HG2 GLN 18 1HG GLN 18 -15.731 3.374 3.584 133 HG3 GLN 18 2HG GLN 18 -16.664 3.321 2.088 134 HE21 GLN 18 2HE2 GLN 18 -13.225 3.537 1.970 135 HE22 GLN 18 1HE2 GLN 18 -12.933 1.917 1.450 136 H LYS 19 H LYS 19 -18.475 4.674 2.148 137 HA LYS 19 HA LYS 19 -18.675 3.861 -0.559 138 HB2 LYS 19 1HB LYS 19 -20.725 3.900 1.648 139 HB3 LYS 19 2HB LYS 19 -21.027 3.222 0.053 140 HG2 LYS 19 1HG LYS 19 -18.820 2.282 1.872 141 HG3 LYS 19 2HG LYS 19 -20.428 1.568 1.828 142 HD2 LYS 19 1HD LYS 19 -19.239 0.163 0.424 143 HD3 LYS 19 2HD LYS 19 -19.958 1.295 -0.719 144 HE2 LYS 19 1HE LYS 19 -17.900 2.475 -0.960 145 HE3 LYS 19 2HE LYS 19 -17.172 1.614 0.391 146 HZ1 LYS 19 3HZ LYS 19 -17.221 -0.409 -0.900 147 HZ2 LYS 19 1HZ LYS 19 -16.412 0.798 -1.774 148 HZ3 LYS 19 2HZ LYS 19 -18.000 0.378 -2.186 149 H ARG 20 H ARG 20 -20.080 6.555 1.240 150 HA ARG 20 HA ARG 20 -21.599 7.561 -0.965 151 HB2 ARG 20 1HB ARG 20 -20.443 9.331 1.169 152 HB3 ARG 20 2HB ARG 20 -21.994 9.458 0.347 153 HG2 ARG 20 1HG ARG 20 -22.756 7.449 1.537 154 HG3 ARG 20 2HG ARG 20 -21.208 7.414 2.389 155 HD2 ARG 20 1HD ARG 20 -21.667 9.482 3.471 156 HD3 ARG 20 2HD ARG 20 -23.075 9.775 2.451 157 HE ARG 20 HE ARG 20 -23.519 7.391 3.806 158 HH11 ARG 20 1HH1 ARG 20 -23.102 10.785 4.576 159 HH12 ARG 20 2HH1 ARG 20 -24.138 10.711 5.976 160 HH21 ARG 20 1HH2 ARG 20 -24.865 7.304 5.647 161 HH22 ARG 20 2HH2 ARG 20 -25.123 8.750 6.583 162 H LEU 21 H LEU 21 -18.426 8.132 0.360 163 HA LEU 21 HA LEU 21 -17.515 10.140 -1.350 164 HB2 LEU 21 1HB LEU 21 -16.217 9.614 0.539 165 HB3 LEU 21 2HB LEU 21 -16.133 7.917 0.119 166 HG LEU 21 HG LEU 21 -14.581 8.391 -1.681 167 HD11 LEU 21 1HD1 LEU 21 -13.695 10.659 -2.020 168 HD12 LEU 21 2HD1 LEU 21 -14.853 11.286 -0.847 169 HD13 LEU 21 3HD1 LEU 21 -15.423 10.585 -2.361 170 HD21 LEU 21 3HD2 LEU 21 -13.797 9.760 0.888 171 HD22 LEU 21 1HD2 LEU 21 -12.687 9.159 -0.344 172 HD23 LEU 21 2HD2 LEU 21 -13.696 8.031 0.561 173 H GLU 22 H GLU 22 -17.196 6.613 -1.761 174 HA GLU 22 HA GLU 22 -16.029 6.692 -4.330 175 HB2 GLU 22 1HB GLU 22 -17.721 4.541 -3.039 176 HB3 GLU 22 2HB GLU 22 -16.747 4.323 -4.483 177 HG2 GLU 22 1HG GLU 22 -15.553 5.170 -1.866 178 HG3 GLU 22 2HG GLU 22 -15.804 3.477 -2.284 179 H GLN 23 H GLN 23 -19.297 6.875 -3.192 180 HA GLN 23 HA GLN 23 -20.616 6.193 -5.607 181 HB2 GLN 23 1HB GLN 23 -21.477 6.225 -3.165 182 HB3 GLN 23 2HB GLN 23 -21.786 7.929 -3.455 183 HG2 GLN 23 1HG GLN 23 -23.346 7.440 -5.170 184 HG3 GLN 23 2HG GLN 23 -22.903 5.731 -5.169 185 HE21 GLN 23 2HE2 GLN 23 -23.541 4.429 -3.414 186 HE22 GLN 23 1HE2 GLN 23 -24.837 4.897 -2.372 187 H MET 24 H MET 24 -20.083 9.344 -3.991 188 HA MET 24 HA MET 24 -21.075 10.843 -6.185 189 HB2 MET 24 1HB MET 24 -20.079 12.795 -5.086 190 HB3 MET 24 2HB MET 24 -21.018 11.823 -3.969 191 HG2 MET 24 1HG MET 24 -18.964 10.851 -3.093 192 HG3 MET 24 2HG MET 24 -18.019 11.828 -4.215 193 HE1 MET 24 3HE MET 24 -18.857 15.468 -2.946 194 HE2 MET 24 1HE MET 24 -19.666 14.539 -4.209 195 HE3 MET 24 2HE MET 24 -17.906 14.527 -4.094 196 H LYS 25 H LYS 25 -17.860 9.763 -5.255 197 HA LYS 25 HA LYS 25 -16.333 11.097 -7.176 198 HB2 LYS 25 1HB LYS 25 -15.401 9.745 -5.314 199 HB3 LYS 25 2HB LYS 25 -15.944 8.284 -6.124 200 HG2 LYS 25 1HG LYS 25 -13.634 8.496 -6.565 201 HG3 LYS 25 2HG LYS 25 -14.476 8.928 -8.054 202 HD2 LYS 25 1HD LYS 25 -14.196 11.300 -7.521 203 HD3 LYS 25 2HD LYS 25 -13.359 10.866 -6.028 204 HE2 LYS 25 1HE LYS 25 -12.454 10.246 -8.839 205 HE3 LYS 25 2HE LYS 25 -11.758 11.450 -7.756 206 HZ1 LYS 25 3HZ LYS 25 -11.210 9.596 -6.219 207 HZ2 LYS 25 1HZ LYS 25 -10.402 9.504 -7.709 208 HZ3 LYS 25 2HZ LYS 25 -11.732 8.499 -7.400 209 H GLU 26 H GLU 26 -18.140 8.076 -7.329 210 HA GLU 26 HA GLU 26 -17.399 7.272 -9.915 211 HB2 GLU 26 1HB GLU 26 -18.729 6.061 -7.995 212 HB3 GLU 26 2HB GLU 26 -20.131 6.735 -8.812 213 HG2 GLU 26 1HG GLU 26 -19.875 4.565 -9.658 214 HG3 GLU 26 2HG GLU 26 -19.269 5.645 -10.916 215 H LYS 27 H LYS 27 -20.195 9.090 -8.740 216 HA LYS 27 HA LYS 27 -21.538 9.517 -11.126 217 HB2 LYS 27 1HB LYS 27 -21.329 11.152 -8.612 218 HB3 LYS 27 2HB LYS 27 -22.313 11.683 -9.967 219 HG2 LYS 27 1HG LYS 27 -22.646 9.057 -8.533 220 HG3 LYS 27 2HG LYS 27 -23.594 10.510 -8.216 221 HD2 LYS 27 1HD LYS 27 -23.465 8.987 -10.818 222 HD3 LYS 27 2HD LYS 27 -24.816 9.009 -9.684 223 HE2 LYS 27 1HE LYS 27 -25.035 11.449 -10.055 224 HE3 LYS 27 2HE LYS 27 -23.747 11.353 -11.253 225 HZ1 LYS 27 3HZ LYS 27 -25.153 9.778 -12.510 226 HZ2 LYS 27 1HZ LYS 27 -25.853 11.318 -12.357 227 HZ3 LYS 27 2HZ LYS 27 -26.404 10.040 -11.394 228 H VAL 28 H VAL 28 -19.048 11.528 -9.596 229 HA VAL 28 HA VAL 28 -19.060 13.577 -11.508 230 HB VAL 28 HB VAL 28 -16.788 12.672 -9.729 231 HG11 VAL 28 1HG1 VAL 28 -15.952 14.029 -11.557 232 HG12 VAL 28 2HG1 VAL 28 -15.904 14.942 -10.049 233 HG13 VAL 28 3HG1 VAL 28 -17.175 15.255 -11.230 234 HG21 VAL 28 3HG2 VAL 28 -18.813 14.872 -9.343 235 HG22 VAL 28 1HG2 VAL 28 -17.497 14.459 -8.244 236 HG23 VAL 28 2HG2 VAL 28 -18.821 13.318 -8.509 237 H MET 29 H MET 29 -17.105 10.600 -11.316 238 HA MET 29 HA MET 29 -15.652 11.347 -13.716 239 HB2 MET 29 1HB MET 29 -14.422 9.279 -13.450 240 HB3 MET 29 2HB MET 29 -14.504 10.120 -11.908 241 HG2 MET 29 1HG MET 29 -16.142 8.611 -11.075 242 HG3 MET 29 2HG MET 29 -16.369 7.883 -12.665 243 HE1 MET 29 3HE MET 29 -12.430 7.450 -10.291 244 HE2 MET 29 1HE MET 29 -13.813 8.356 -9.669 245 HE3 MET 29 2HE MET 29 -12.954 8.927 -11.099 246 H LYS 30 H LYS 30 -18.679 10.278 -13.322 247 HA LYS 30 HA LYS 30 -18.579 8.558 -15.700 248 HB2 LYS 30 1HB LYS 30 -20.282 8.630 -13.319 249 HB3 LYS 30 2HB LYS 30 -21.178 8.465 -14.820 250 HG2 LYS 30 1HG LYS 30 -20.660 6.298 -13.818 251 HG3 LYS 30 2HG LYS 30 -19.912 6.490 -15.403 252 HD2 LYS 30 1HD LYS 30 -17.774 6.971 -14.384 253 HD3 LYS 30 2HD LYS 30 -18.497 6.924 -12.773 254 HE2 LYS 30 1HE LYS 30 -19.043 4.575 -13.072 255 HE3 LYS 30 2HE LYS 30 -18.385 4.612 -14.707 256 HZ1 LYS 30 3HZ LYS 30 -16.799 3.661 -13.174 257 HZ2 LYS 30 1HZ LYS 30 -16.856 5.041 -12.192 258 HZ3 LYS 30 2HZ LYS 30 -16.203 5.135 -13.756 259 H ASP 31 H ASP 31 -19.115 11.718 -14.835 260 HA ASP 31 HA ASP 31 -21.254 12.224 -16.726 261 HB2 ASP 31 1HB ASP 31 -21.039 13.520 -14.589 262 HB3 ASP 31 2HB ASP 31 -19.569 14.243 -15.236 263 H GLN 32 H GLN 32 -21.013 12.882 -18.766 264 HA GLN 32 HA GLN 32 -18.535 12.476 -20.053 265 HB2 GLN 32 1HB GLN 32 -19.687 12.843 -22.065 266 HB3 GLN 32 2HB GLN 32 -20.913 12.200 -20.985 267 HG2 GLN 32 1HG GLN 32 -21.515 14.634 -20.513 268 HG3 GLN 32 2HG GLN 32 -20.542 15.013 -21.930 269 HE21 GLN 32 2HE2 GLN 32 -23.310 15.484 -21.551 270 HE22 GLN 32 1HE2 GLN 32 -24.167 14.597 -22.771 271 H ASP 33 H ASP 33 -20.220 15.379 -19.014 272 HA ASP 33 HA ASP 33 -18.611 17.207 -20.507 273 HB2 ASP 33 1HB ASP 33 -20.411 17.677 -18.116 274 HB3 ASP 33 2HB ASP 33 -19.677 18.947 -19.089 275 H VAL 34 H VAL 34 -18.650 16.016 -17.201 276 HA VAL 34 HA VAL 34 -16.566 17.491 -16.112 277 HB VAL 34 HB VAL 34 -17.466 14.655 -15.616 278 HG11 VAL 34 1HG1 VAL 34 -16.099 14.658 -13.580 279 HG12 VAL 34 2HG1 VAL 34 -15.365 16.185 -14.081 280 HG13 VAL 34 3HG1 VAL 34 -15.114 14.725 -15.040 281 HG21 VAL 34 3HG2 VAL 34 -17.739 17.197 -14.018 282 HG22 VAL 34 1HG2 VAL 34 -18.352 15.614 -13.544 283 HG23 VAL 34 2HG2 VAL 34 -19.007 16.422 -14.968 284 H GLN 35 H GLN 35 -16.431 14.419 -17.880 285 HA GLN 35 HA GLN 35 -13.648 14.047 -17.749 286 HB2 GLN 35 1HB GLN 35 -15.466 13.123 -19.976 287 HB3 GLN 35 2HB GLN 35 -13.955 12.386 -19.450 288 HG2 GLN 35 1HG GLN 35 -15.020 11.977 -17.251 289 HG3 GLN 35 2HG GLN 35 -16.540 12.520 -17.938 290 HE21 GLN 35 2HE2 GLN 35 -15.805 9.964 -16.826 291 HE22 GLN 35 1HE2 GLN 35 -16.078 8.790 -18.065 292 H ALA 36 H ALA 36 -15.696 15.610 -20.130 293 HA ALA 36 HA ALA 36 -13.767 16.256 -22.044 294 HB1 ALA 36 1HB ALA 36 -16.175 16.570 -22.402 295 HB2 ALA 36 2HB ALA 36 -15.266 18.039 -22.755 296 HB3 ALA 36 3HB ALA 36 -16.165 17.900 -21.245 297 H PHE 37 H PHE 37 -14.735 18.000 -19.108 298 HA PHE 37 HA PHE 37 -12.959 20.184 -19.481 299 HB2 PHE 37 1HB PHE 37 -14.828 20.474 -18.029 300 HB3 PHE 37 2HB PHE 37 -14.349 19.101 -17.036 301 HD1 PHE 37 HD1 PHE 37 -12.961 22.366 -18.211 302 HD2 PHE 37 HD2 PHE 37 -13.295 19.537 -15.050 303 HE1 PHE 37 HE1 PHE 37 -11.723 23.886 -16.719 304 HE2 PHE 37 HE2 PHE 37 -12.066 21.055 -13.558 305 HZ PHE 37 HZ PHE 37 -11.281 23.233 -14.388 306 H LEU 38 H LEU 38 -12.699 17.114 -17.759 307 HA LEU 38 HA LEU 38 -10.307 17.573 -16.413 308 HB2 LEU 38 1HB LEU 38 -11.859 15.223 -17.207 309 HB3 LEU 38 2HB LEU 38 -10.140 14.915 -17.066 310 HG LEU 38 HG LEU 38 -11.166 14.369 -14.981 311 HD11 LEU 38 1HD1 LEU 38 -10.008 15.897 -13.444 312 HD12 LEU 38 2HD1 LEU 38 -9.747 17.019 -14.781 313 HD13 LEU 38 3HD1 LEU 38 -8.995 15.424 -14.809 314 HD21 LEU 38 3HD2 LEU 38 -12.335 17.145 -15.016 315 HD22 LEU 38 1HD2 LEU 38 -12.425 16.017 -13.663 316 HD23 LEU 38 2HD2 LEU 38 -13.221 15.629 -15.189 317 H LYS 39 H LYS 39 -10.830 16.363 -19.709 318 HA LYS 39 HA LYS 39 -7.972 16.153 -20.146 319 HB2 LYS 39 1HB LYS 39 -8.599 15.477 -22.444 320 HB3 LYS 39 2HB LYS 39 -9.341 14.491 -21.198 321 HG2 LYS 39 1HG LYS 39 -11.405 15.891 -21.465 322 HG3 LYS 39 2HG LYS 39 -10.634 16.614 -22.879 323 HD2 LYS 39 1HD LYS 39 -10.423 14.403 -23.900 324 HD3 LYS 39 2HD LYS 39 -11.184 13.674 -22.486 325 HE2 LYS 39 1HE LYS 39 -13.201 15.058 -22.940 326 HE3 LYS 39 2HE LYS 39 -12.435 15.606 -24.431 327 HZ1 LYS 39 3HZ LYS 39 -12.349 13.294 -25.176 328 HZ2 LYS 39 1HZ LYS 39 -13.946 13.779 -24.857 329 HZ3 LYS 39 2HZ LYS 39 -13.121 12.796 -23.750 330 H GLU 40 H GLU 40 -10.394 18.506 -20.524 331 HA GLU 40 HA GLU 40 -9.173 20.164 -22.465 332 HB2 GLU 40 1HB GLU 40 -11.519 20.414 -21.661 333 HB3 GLU 40 2HB GLU 40 -10.906 20.971 -20.119 334 HG2 GLU 40 1HG GLU 40 -9.926 22.921 -21.175 335 HG3 GLU 40 2HG GLU 40 -10.458 22.354 -22.757 336 H ASN 41 H ASN 41 -9.111 20.208 -18.941 337 HA ASN 41 HA ASN 41 -6.765 21.997 -19.049 338 HB2 ASN 41 1HB ASN 41 -8.945 21.671 -16.993 339 HB3 ASN 41 2HB ASN 41 -7.437 22.499 -16.627 340 HD21 ASN 41 2HD2 ASN 41 -10.364 22.581 -18.531 341 HD22 ASN 41 1HD2 ASN 41 -10.286 24.256 -18.938 342 H GLU 42 H GLU 42 -6.598 19.147 -19.348 343 HA GLU 42 HA GLU 42 -6.169 17.715 -17.006 344 HB2 GLU 42 1HB GLU 42 -4.820 16.166 -18.379 345 HB3 GLU 42 2HB GLU 42 -6.342 16.603 -19.143 346 HG2 GLU 42 1HG GLU 42 -5.270 18.039 -20.675 347 HG3 GLU 42 2HG GLU 42 -3.746 17.962 -19.787 348 H GLU 43 H GLU 43 -4.008 19.906 -18.673 349 HA GLU 43 HA GLU 43 -1.697 19.067 -17.169 350 HB2 GLU 43 1HB GLU 43 -1.601 19.897 -19.522 351 HB3 GLU 43 2HB GLU 43 -2.039 21.492 -18.931 352 HG2 GLU 43 1HG GLU 43 0.007 21.558 -17.596 353 HG3 GLU 43 2HG GLU 43 0.445 19.960 -18.205 354 H VAL 44 H VAL 44 -4.234 21.336 -16.785 355 HA VAL 44 HA VAL 44 -2.687 23.049 -14.997 356 HB VAL 44 HB VAL 44 -5.602 23.318 -15.736 357 HG11 VAL 44 1HG1 VAL 44 -5.245 25.680 -15.157 358 HG12 VAL 44 2HG1 VAL 44 -3.584 25.305 -14.691 359 HG13 VAL 44 3HG1 VAL 44 -4.932 24.608 -13.793 360 HG21 VAL 44 3HG2 VAL 44 -3.227 24.574 -17.107 361 HG22 VAL 44 1HG2 VAL 44 -4.926 24.852 -17.492 362 HG23 VAL 44 2HG2 VAL 44 -4.208 23.261 -17.760 363 H ILE 45 H ILE 45 -5.443 20.870 -14.971 364 HA ILE 45 HA ILE 45 -6.086 21.264 -12.217 365 HB ILE 45 HB ILE 45 -6.868 19.017 -14.082 366 HG12 ILE 45 1HG1 ILE 45 -8.433 21.485 -13.319 367 HG13 ILE 45 2HG1 ILE 45 -7.519 21.325 -14.816 368 HG21 ILE 45 1HG2 ILE 45 -7.160 18.422 -11.726 369 HG22 ILE 45 2HG2 ILE 45 -8.717 18.623 -12.531 370 HG23 ILE 45 3HG2 ILE 45 -8.101 19.891 -11.472 371 HD11 ILE 45 3HD1 ILE 45 -9.866 20.892 -15.181 372 HD12 ILE 45 1HD1 ILE 45 -9.838 19.610 -13.970 373 HD13 ILE 45 2HD1 ILE 45 -8.914 19.436 -15.461 374 H ASP 46 H ASP 46 -5.664 19.912 -10.475 375 HA ASP 46 HA ASP 46 -3.634 17.821 -10.912 376 HB2 ASP 46 1HB ASP 46 -2.828 19.875 -9.654 377 HB3 ASP 46 2HB ASP 46 -3.974 19.445 -8.390 378 H GLN 47 H GLN 47 -3.722 16.087 -9.344 379 HA GLN 47 HA GLN 47 -6.270 14.999 -8.930 380 HB2 GLN 47 1HB GLN 47 -3.546 14.409 -7.821 381 HB3 GLN 47 2HB GLN 47 -4.952 13.458 -7.341 382 HG2 GLN 47 1HG GLN 47 -5.281 12.641 -9.513 383 HG3 GLN 47 2HG GLN 47 -4.225 13.861 -10.223 384 HE21 GLN 47 2HE2 GLN 47 -2.029 13.592 -10.137 385 HE22 GLN 47 1HE2 GLN 47 -1.280 12.092 -9.714 386 H LYS 48 H LYS 48 -4.127 16.831 -6.798 387 HA LYS 48 HA LYS 48 -5.700 16.637 -4.458 388 HB2 LYS 48 1HB LYS 48 -3.768 18.752 -5.401 389 HB3 LYS 48 2HB LYS 48 -4.546 18.804 -3.829 390 HG2 LYS 48 1HG LYS 48 -2.689 16.658 -4.836 391 HG3 LYS 48 2HG LYS 48 -2.314 17.901 -3.644 392 HD2 LYS 48 1HD LYS 48 -4.353 15.697 -3.351 393 HD3 LYS 48 2HD LYS 48 -2.780 15.766 -2.557 394 HE2 LYS 48 1HE LYS 48 -5.048 17.720 -2.168 395 HE3 LYS 48 2HE LYS 48 -4.604 16.426 -1.057 396 HZ1 LYS 48 3HZ LYS 48 -3.710 18.502 -0.295 397 HZ2 LYS 48 1HZ LYS 48 -2.937 18.781 -1.776 398 HZ3 LYS 48 2HZ LYS 48 -2.428 17.505 -0.777 399 H MET 49 H MET 49 -5.764 18.825 -7.199 400 HA MET 49 HA MET 49 -7.696 20.620 -6.225 401 HB2 MET 49 1HB MET 49 -6.208 20.885 -8.270 402 HB3 MET 49 2HB MET 49 -7.319 19.818 -9.110 403 HG2 MET 49 1HG MET 49 -9.129 21.382 -8.747 404 HG3 MET 49 2HG MET 49 -8.042 22.435 -7.844 405 HE1 MET 49 3HE MET 49 -5.350 22.263 -9.492 406 HE2 MET 49 1HE MET 49 -6.031 23.779 -8.905 407 HE3 MET 49 2HE MET 49 -5.536 23.629 -10.592 408 H ILE 50 H ILE 50 -7.905 17.481 -7.732 409 HA ILE 50 HA ILE 50 -10.617 17.503 -8.450 410 HB ILE 50 HB ILE 50 -8.801 15.206 -7.727 411 HG12 ILE 50 1HG1 ILE 50 -8.145 16.439 -9.729 412 HG13 ILE 50 2HG1 ILE 50 -8.746 14.845 -10.162 413 HG21 ILE 50 1HG2 ILE 50 -10.450 13.721 -8.740 414 HG22 ILE 50 2HG2 ILE 50 -11.548 15.083 -8.964 415 HG23 ILE 50 3HG2 ILE 50 -11.117 14.555 -7.336 416 HD11 ILE 50 3HD1 ILE 50 -9.545 16.538 -11.704 417 HD12 ILE 50 1HD1 ILE 50 -10.287 17.419 -10.371 418 HD13 ILE 50 2HD1 ILE 50 -10.885 15.819 -10.811 419 H GLU 51 H GLU 51 -9.076 16.105 -5.527 420 HA GLU 51 HA GLU 51 -11.470 15.394 -4.272 421 HB2 GLU 51 1HB GLU 51 -10.060 15.579 -2.149 422 HB3 GLU 51 2HB GLU 51 -9.565 14.425 -3.374 423 HG2 GLU 51 1HG GLU 51 -7.715 15.659 -3.967 424 HG3 GLU 51 2HG GLU 51 -8.378 17.152 -3.306 425 H LYS 52 H LYS 52 -9.526 18.320 -3.921 426 HA LYS 52 HA LYS 52 -11.036 19.635 -1.990 427 HB2 LYS 52 1HB LYS 52 -9.626 20.913 -4.344 428 HB3 LYS 52 2HB LYS 52 -10.102 21.728 -2.863 429 HG2 LYS 52 1HG LYS 52 -8.123 19.467 -2.989 430 HG3 LYS 52 2HG LYS 52 -7.691 21.176 -3.006 431 HD2 LYS 52 1HD LYS 52 -8.714 21.473 -0.816 432 HD3 LYS 52 2HD LYS 52 -9.196 19.773 -0.798 433 HE2 LYS 52 1HE LYS 52 -6.887 19.079 -0.824 434 HE3 LYS 52 2HE LYS 52 -6.351 20.746 -1.009 435 HZ1 LYS 52 3HZ LYS 52 -7.789 19.657 1.354 436 HZ2 LYS 52 1HZ LYS 52 -7.230 21.251 1.169 437 HZ3 LYS 52 2HZ LYS 52 -6.125 19.966 1.266 438 H SER 53 H SER 53 -11.383 19.647 -5.511 439 HA SER 53 HA SER 53 -13.717 21.394 -5.310 440 HB2 SER 53 1HB SER 53 -12.402 20.369 -7.824 441 HB3 SER 53 2HB SER 53 -13.451 21.776 -7.644 442 HG SER 53 HG SER 53 -10.798 21.423 -6.725 443 H LEU 54 H LEU 54 -13.461 18.301 -4.806 444 HA LEU 54 HA LEU 54 -14.995 16.886 -6.625 445 HB2 LEU 54 1HB LEU 54 -13.977 16.494 -4.034 446 HB3 LEU 54 2HB LEU 54 -15.699 16.175 -3.922 447 HG LEU 54 HG LEU 54 -13.729 14.817 -5.760 448 HD11 LEU 54 1HD1 LEU 54 -13.574 14.080 -3.450 449 HD12 LEU 54 2HD1 LEU 54 -14.277 12.818 -4.463 450 HD13 LEU 54 3HD1 LEU 54 -15.314 13.787 -3.416 451 HD21 LEU 54 3HD2 LEU 54 -16.698 14.395 -5.487 452 HD22 LEU 54 1HD2 LEU 54 -15.601 13.395 -6.438 453 HD23 LEU 54 2HD2 LEU 54 -15.866 15.081 -6.883 454 H ASN 55 H ASN 55 -16.000 18.682 -3.793 455 HA ASN 55 HA ASN 55 -18.751 18.361 -3.945 456 HB2 ASN 55 1HB ASN 55 -17.138 20.724 -2.972 457 HB3 ASN 55 2HB ASN 55 -18.862 20.514 -2.677 458 HD21 ASN 55 2HD2 ASN 55 -15.661 19.552 -1.800 459 HD22 ASN 55 1HD2 ASN 55 -16.104 18.561 -0.456 460 H LYS 56 H LYS 56 -16.653 20.688 -5.548 461 HA LYS 56 HA LYS 56 -18.742 22.229 -6.699 462 HB2 LYS 56 1HB LYS 56 -15.817 21.969 -7.397 463 HB3 LYS 56 2HB LYS 56 -16.903 23.124 -8.158 464 HG2 LYS 56 1HG LYS 56 -16.277 23.011 -5.213 465 HG3 LYS 56 2HG LYS 56 -15.555 24.129 -6.374 466 HD2 LYS 56 1HD LYS 56 -18.517 23.931 -5.851 467 HD3 LYS 56 2HD LYS 56 -17.452 25.084 -5.045 468 HE2 LYS 56 1HE LYS 56 -17.727 24.887 -8.036 469 HE3 LYS 56 2HE LYS 56 -18.697 25.974 -7.042 470 HZ1 LYS 56 3HZ LYS 56 -16.590 26.951 -6.233 471 HZ2 LYS 56 1HZ LYS 56 -16.837 27.181 -7.895 472 HZ3 LYS 56 2HZ LYS 56 -15.748 26.001 -7.353 473 H LEU 57 H LEU 57 -16.680 19.611 -7.899 474 HA LEU 57 HA LEU 57 -17.660 19.588 -10.539 475 HB2 LEU 57 1HB LEU 57 -16.599 17.262 -8.929 476 HB3 LEU 57 2HB LEU 57 -16.709 17.342 -10.677 477 HG LEU 57 HG LEU 57 -14.928 19.057 -8.941 478 HD11 LEU 57 1HD1 LEU 57 -13.106 17.821 -9.979 479 HD12 LEU 57 2HD1 LEU 57 -14.269 16.822 -10.850 480 HD13 LEU 57 3HD1 LEU 57 -14.179 16.742 -9.089 481 HD21 LEU 57 3HD2 LEU 57 -15.731 20.235 -10.934 482 HD22 LEU 57 1HD2 LEU 57 -15.146 18.912 -11.941 483 HD23 LEU 57 2HD2 LEU 57 -14.003 19.891 -11.021 484 H TYR 58 H TYR 58 -18.710 17.957 -7.599 485 HA TYR 58 HA TYR 58 -20.771 16.443 -8.830 486 HB2 TYR 58 1HB TYR 58 -19.698 16.056 -6.531 487 HB3 TYR 58 2HB TYR 58 -20.773 17.323 -5.945 488 HD1 TYR 58 HD2 TYR 58 -20.871 14.134 -7.874 489 HD2 TYR 58 HD1 TYR 58 -22.868 16.716 -5.148 490 HE1 TYR 58 HE2 TYR 58 -22.666 12.478 -7.637 491 HE2 TYR 58 HE1 TYR 58 -24.672 15.065 -4.900 492 HH TYR 58 HH TYR 58 -25.642 13.214 -6.170 493 H GLU 59 H GLU 59 -20.700 19.598 -7.195 494 HA GLU 59 HA GLU 59 -23.438 20.180 -7.355 495 HB2 GLU 59 1HB GLU 59 -21.990 21.542 -5.999 496 HB3 GLU 59 2HB GLU 59 -21.012 21.987 -7.389 497 HG2 GLU 59 1HG GLU 59 -22.815 23.291 -8.301 498 HG3 GLU 59 2HG GLU 59 -23.897 22.755 -7.016 499 H TYR 60 H TYR 60 -20.833 20.580 -9.672 500 HA TYR 60 HA TYR 60 -22.109 22.031 -11.666 501 HB2 TYR 60 1HB TYR 60 -19.730 21.566 -11.701 502 HB3 TYR 60 2HB TYR 60 -20.031 19.843 -11.862 503 HD1 TYR 60 HD1 TYR 60 -20.543 23.086 -13.625 504 HD2 TYR 60 HD2 TYR 60 -20.099 18.868 -13.977 505 HE1 TYR 60 HE1 TYR 60 -20.376 23.309 -16.063 506 HE2 TYR 60 HE2 TYR 60 -19.934 19.084 -16.422 507 HH TYR 60 HH TYR 60 -20.619 20.710 -18.190 508 H ILE 61 H ILE 61 -21.943 18.496 -11.254 509 HA ILE 61 HA ILE 61 -23.629 18.024 -13.515 510 HB ILE 61 HB ILE 61 -23.550 15.669 -12.921 511 HG12 ILE 61 1HG1 ILE 61 -22.052 16.569 -10.447 512 HG13 ILE 61 2HG1 ILE 61 -23.678 15.892 -10.466 513 HG21 ILE 61 1HG2 ILE 61 -21.702 16.587 -14.166 514 HG22 ILE 61 2HG2 ILE 61 -21.094 15.380 -13.034 515 HG23 ILE 61 3HG2 ILE 61 -20.902 17.097 -12.680 516 HD11 ILE 61 3HD1 ILE 61 -22.004 14.252 -9.800 517 HD12 ILE 61 1HD1 ILE 61 -21.185 14.459 -11.348 518 HD13 ILE 61 2HD1 ILE 61 -22.817 13.789 -11.295 519 H GLU 62 H GLU 62 -24.158 18.366 -10.083 520 HA GLU 62 HA GLU 62 -26.767 17.284 -9.955 521 HB2 GLU 62 1HB GLU 62 -25.304 19.299 -8.266 522 HB3 GLU 62 2HB GLU 62 -26.957 18.815 -7.917 523 HG2 GLU 62 1HG GLU 62 -24.689 16.872 -8.149 524 HG3 GLU 62 2HG GLU 62 -25.168 17.626 -6.631 525 H GLN 63 H GLN 63 -25.592 20.580 -10.431 526 HA GLN 63 HA GLN 63 -28.133 21.818 -10.478 527 HB2 GLN 63 1HB GLN 63 -25.424 22.667 -11.462 528 HB3 GLN 63 2HB GLN 63 -26.840 23.686 -11.679 529 HG2 GLN 63 1HG GLN 63 -27.181 23.750 -9.273 530 HG3 GLN 63 2HG GLN 63 -25.791 22.691 -9.040 531 HE21 GLN 63 2HE2 GLN 63 -24.188 23.937 -11.082 532 HE22 GLN 63 1HE2 GLN 63 -23.681 25.461 -10.449 533 H SER 64 H SER 64 -28.456 23.342 -12.601 534 HA SER 64 HA SER 64 -29.644 21.689 -14.504 535 HB2 SER 64 1HB SER 64 -29.631 23.929 -15.860 536 HB3 SER 64 2HB SER 64 -30.568 23.818 -14.370 537 HG SER 64 HG SER 64 -28.009 24.992 -14.735 538 H LYS 65 H LYS 65 -28.459 20.275 -15.619 539 HA LYS 65 HA LYS 65 -25.797 20.715 -16.490 540 HB2 LYS 65 1HB LYS 65 -26.839 18.493 -15.988 541 HB3 LYS 65 2HB LYS 65 -27.777 18.647 -17.466 542 HG2 LYS 65 1HG LYS 65 -25.761 18.636 -18.789 543 HG3 LYS 65 2HG LYS 65 -24.773 18.586 -17.325 544 HD2 LYS 65 1HD LYS 65 -25.800 16.428 -16.734 545 HD3 LYS 65 2HD LYS 65 -26.737 16.481 -18.229 546 HE2 LYS 65 1HE LYS 65 -24.759 15.074 -18.471 547 HE3 LYS 65 2HE LYS 65 -24.687 16.479 -19.533 548 HZ1 LYS 65 3HZ LYS 65 -23.116 15.917 -17.098 549 HZ2 LYS 65 1HZ LYS 65 -23.358 17.517 -17.612 550 HZ3 LYS 65 2HZ LYS 65 -22.589 16.419 -18.635 551 H ASN 66 H ASN 66 -28.933 21.048 -17.969 552 HA ASN 66 HA ASN 66 -27.672 22.488 -20.199 553 HB2 ASN 66 1HB ASN 66 -29.607 21.792 -21.619 554 HB3 ASN 66 2HB ASN 66 -28.615 20.433 -21.112 555 HD21 ASN 66 2HD2 ASN 66 -30.215 18.931 -21.387 556 HD22 ASN 66 1HD2 ASN 66 -31.606 18.829 -20.365 557 H CYS 67 H CYS 67 -30.285 23.456 -21.136 558 HA CYS 67 HA CYS 67 -31.465 24.639 -18.779 559 HB2 CYS 67 1HB CYS 67 -30.960 26.826 -19.105 560 HB3 CYS 67 2HB CYS 67 -29.518 26.130 -19.821 561 H SER 68 H SER 68 -33.478 25.690 -19.230 562 HA SER 68 HA SER 68 -34.919 23.924 -20.998 563 HB2 SER 68 1HB SER 68 -36.341 26.187 -19.692 564 HB3 SER 68 2HB SER 68 -36.803 24.490 -19.823 565 HG SER 68 HG SER 68 -35.205 25.787 -17.938 566 H TYR 69 H TYR 69 -33.800 27.170 -21.054 567 HA TYR 69 HA TYR 69 -35.358 28.322 -23.040 568 HB2 TYR 69 1HB TYR 69 -33.460 29.289 -21.585 569 HB3 TYR 69 2HB TYR 69 -32.385 28.727 -22.851 570 HD1 TYR 69 HD1 TYR 69 -35.564 30.658 -22.556 571 HD2 TYR 69 HD2 TYR 69 -31.773 30.269 -24.440 572 HE1 TYR 69 HE1 TYR 69 -35.979 32.732 -23.795 573 HE2 TYR 69 HE2 TYR 69 -32.177 32.349 -25.688 574 HH TYR 69 HH TYR 69 -33.979 33.765 -26.406 575 H CYS 70 H CYS 70 -33.052 25.762 -23.280 576 HA CYS 70 HA CYS 70 -33.301 25.903 -26.216 577 HB2 CYS 70 1HB CYS 70 -31.185 24.612 -26.373 578 HB3 CYS 70 2HB CYS 70 -30.976 26.199 -25.642 579 H SER 71 H SER 71 -32.992 23.687 -23.458 580 HA SER 71 HA SER 71 -34.213 21.553 -25.044 581 HB2 SER 71 1HB SER 71 -32.998 21.359 -22.277 582 HB3 SER 71 2HB SER 71 -33.368 20.035 -23.385 583 HG SER 71 HG SER 71 -31.630 20.501 -24.558 584 H GLU 72 H GLU 72 -36.318 21.215 -24.822 585 HA GLU 72 HA GLU 72 -37.791 22.680 -22.809 586 HB2 GLU 72 1HB GLU 72 -38.422 22.497 -25.255 587 HB3 GLU 72 2HB GLU 72 -38.858 20.828 -24.930 588 HG2 GLU 72 1HG GLU 72 -40.564 21.541 -23.375 589 HG3 GLU 72 2HG GLU 72 -40.088 23.225 -23.596 590 H ASP 73 H ASP 73 -36.414 21.057 -21.391 591 HA ASP 73 HA ASP 73 -37.737 18.512 -20.965 592 HB2 ASP 73 1HB ASP 73 -35.230 18.905 -20.716 593 HB3 ASP 73 2HB ASP 73 -35.609 19.746 -19.218 594 H GLU 74 H GLU 74 -39.380 18.218 -19.622 595 HA GLU 74 HA GLU 74 -40.547 20.487 -18.330 596 HB2 GLU 74 1HB GLU 74 -41.406 17.599 -18.162 597 HB3 GLU 74 2HB GLU 74 -42.391 19.019 -17.839 598 HG2 GLU 74 1HG GLU 74 -41.202 18.353 -20.518 599 HG3 GLU 74 2HG GLU 74 -42.836 17.923 -20.019 600 H ASN 75 H ASN 75 -38.294 18.148 -17.298 601 HA ASN 75 HA ASN 75 -39.092 18.567 -14.483 602 HB2 ASN 75 1HB ASN 75 -37.972 16.103 -15.803 603 HB3 ASN 75 2HB ASN 75 -37.903 16.344 -14.059 604 HD21 ASN 75 2HD2 ASN 75 -39.795 16.321 -12.862 605 HD22 ASN 75 1HD2 ASN 75 -41.267 15.650 -13.492 606 H CYS 76 H CYS 76 -36.787 19.364 -16.684 607 HA CYS 76 HA CYS 76 -34.436 18.954 -15.117 608 HB2 CYS 76 1HB CYS 76 -34.377 19.188 -17.586 609 HB3 CYS 76 2HB CYS 76 -34.872 20.867 -17.419 610 HG CYS 76 HG CYS 76 -32.149 20.805 -18.034 611 H ASN 77 H ASN 77 -34.035 19.960 -13.286 612 HA ASN 77 HA ASN 77 -35.325 22.434 -12.584 613 HB2 ASN 77 1HB ASN 77 -34.845 20.677 -10.899 614 HB3 ASN 77 2HB ASN 77 -33.121 20.934 -11.148 615 HD21 ASN 77 2HD2 ASN 77 -32.639 21.629 -9.120 616 HD22 ASN 77 1HD2 ASN 77 -33.230 23.112 -8.445 617 H ASN 78 H ASN 78 -34.643 24.349 -13.237 618 HA ASN 78 HA ASN 78 -31.803 24.646 -13.944 619 HB2 ASN 78 1HB ASN 78 -34.310 25.756 -15.136 620 HB3 ASN 78 2HB ASN 78 -32.811 26.671 -15.278 621 HD21 ASN 78 2HD2 ASN 78 -34.314 23.568 -15.971 622 HD22 ASN 78 1HD2 ASN 78 -33.285 23.167 -17.296 623 H LEU 79 H LEU 79 -30.612 26.113 -12.956 624 HA LEU 79 HA LEU 79 -31.854 27.792 -10.928 625 HB2 LEU 79 1HB LEU 79 -28.955 27.284 -11.613 626 HB3 LEU 79 2HB LEU 79 -29.478 28.389 -10.361 627 HG LEU 79 HG LEU 79 -28.825 26.399 -9.270 628 HD11 LEU 79 1HD1 LEU 79 -30.854 27.366 -8.373 629 HD12 LEU 79 2HD1 LEU 79 -30.894 25.608 -8.231 630 HD13 LEU 79 3HD1 LEU 79 -31.828 26.411 -9.493 631 HD21 LEU 79 3HD2 LEU 79 -30.577 24.889 -11.201 632 HD22 LEU 79 1HD2 LEU 79 -29.732 24.188 -9.821 633 HD23 LEU 79 2HD2 LEU 79 -28.814 24.882 -11.158 634 H LEU 80 H LEU 80 -29.109 28.577 -13.023 635 HA LEU 80 HA LEU 80 -30.305 31.155 -13.611 636 HB2 LEU 80 1HB LEU 80 -27.614 29.960 -14.264 637 HB3 LEU 80 2HB LEU 80 -28.138 31.507 -14.896 638 HG LEU 80 HG LEU 80 -28.418 32.251 -12.476 639 HD11 LEU 80 1HD1 LEU 80 -27.111 31.041 -10.807 640 HD12 LEU 80 2HD1 LEU 80 -26.773 29.772 -11.984 641 HD13 LEU 80 3HD1 LEU 80 -28.426 30.049 -11.437 642 HD21 LEU 80 3HD2 LEU 80 -26.581 32.975 -13.909 643 HD22 LEU 80 1HD2 LEU 80 -25.661 31.538 -13.463 644 HD23 LEU 80 2HD2 LEU 80 -26.043 32.754 -12.243 645 H GLU 81 H GLU 81 -32.049 30.591 -14.910 646 HA GLU 81 HA GLU 81 -31.892 28.871 -17.134 647 HB2 GLU 81 1HB GLU 81 -34.028 29.432 -16.091 648 HB3 GLU 81 2HB GLU 81 -33.839 31.114 -16.566 649 HG2 GLU 81 1HG GLU 81 -35.392 29.981 -18.033 650 HG3 GLU 81 2HG GLU 81 -33.949 30.468 -18.919 651 H GLY 82 H GLY 82 -31.727 29.278 -19.314 652 HA2 GLY 82 1HA GLY 82 -31.162 30.470 -21.227 653 HA3 GLY 82 2HA GLY 82 -31.068 31.933 -20.263 654 H TYR 83 H TYR 83 -29.294 29.957 -18.484 655 HA TYR 83 HA TYR 83 -26.827 30.386 -20.049 656 HB2 TYR 83 1HB TYR 83 -27.059 30.424 -17.032 657 HB3 TYR 83 2HB TYR 83 -25.622 30.772 -17.982 658 HD1 TYR 83 HD2 TYR 83 -25.634 32.857 -19.446 659 HD2 TYR 83 HD1 TYR 83 -28.555 32.110 -16.448 660 HE1 TYR 83 HE2 TYR 83 -26.209 35.249 -19.414 661 HE2 TYR 83 HE1 TYR 83 -29.134 34.495 -16.403 662 HH TYR 83 HH TYR 83 -28.083 36.636 -16.937 663 H HIS 84 H HIS 84 -25.042 28.887 -19.393 664 HA HIS 84 HA HIS 84 -25.985 26.363 -18.195 665 HB2 HIS 84 1HB HIS 84 -24.178 26.647 -20.604 666 HB3 HIS 84 2HB HIS 84 -24.373 25.156 -19.703 667 HD1 HIS 84 HD1 HIS 84 -25.284 23.891 -21.730 668 HD2 HIS 84 HD2 HIS 84 -27.564 27.208 -20.678 669 HE1 HIS 84 HE1 HIS 84 -27.324 23.878 -23.233 670 HA PRO 85 HA PRO 85 -22.281 26.969 -15.794 671 HB2 PRO 85 1HB PRO 85 -22.140 24.568 -14.597 672 HB3 PRO 85 2HB PRO 85 -23.387 25.747 -14.174 673 HG2 PRO 85 1HG PRO 85 -23.578 23.314 -15.888 674 HG3 PRO 85 2HG PRO 85 -24.752 23.972 -14.736 675 HD2 PRO 85 1HD PRO 85 -24.867 24.311 -17.478 676 HD3 PRO 85 2HD PRO 85 -25.660 25.367 -16.293 677 H LYS 86 H LYS 86 -20.187 26.831 -16.337 678 HA LYS 86 HA LYS 86 -19.272 24.381 -17.677 679 HB2 LYS 86 1HB LYS 86 -17.591 25.732 -18.899 680 HB3 LYS 86 2HB LYS 86 -19.243 26.138 -19.344 681 HG2 LYS 86 1HG LYS 86 -19.167 28.143 -18.049 682 HG3 LYS 86 2HG LYS 86 -17.599 27.702 -17.376 683 HD2 LYS 86 1HD LYS 86 -17.945 27.981 -20.335 684 HD3 LYS 86 2HD LYS 86 -17.716 29.409 -19.327 685 HE2 LYS 86 1HE LYS 86 -15.568 28.811 -20.075 686 HE3 LYS 86 2HE LYS 86 -15.658 28.265 -18.405 687 HZ1 LYS 86 3HZ LYS 86 -14.620 26.585 -19.743 688 HZ2 LYS 86 1HZ LYS 86 -15.910 26.583 -20.845 689 HZ3 LYS 86 2HZ LYS 86 -16.140 26.015 -19.267 690 H LEU 87 H LEU 87 -17.449 23.505 -16.977 691 HA LEU 87 HA LEU 87 -16.540 24.217 -14.362 692 HB2 LEU 87 1HB LEU 87 -16.643 21.942 -15.993 693 HB3 LEU 87 2HB LEU 87 -14.938 22.264 -15.768 694 HG LEU 87 HG LEU 87 -15.030 21.856 -13.474 695 HD11 LEU 87 1HD1 LEU 87 -18.014 22.220 -13.676 696 HD12 LEU 87 2HD1 LEU 87 -16.863 23.265 -12.841 697 HD13 LEU 87 3HD1 LEU 87 -17.177 21.639 -12.237 698 HD21 LEU 87 3HD2 LEU 87 -16.271 19.721 -13.258 699 HD22 LEU 87 1HD2 LEU 87 -15.293 19.811 -14.724 700 HD23 LEU 87 2HD2 LEU 87 -17.039 20.047 -14.810 701 H VAL 88 H VAL 88 -14.767 25.375 -13.838 702 HA VAL 88 HA VAL 88 -12.698 25.829 -15.880 703 HB VAL 88 HB VAL 88 -12.503 28.184 -15.280 704 HG11 VAL 88 1HG1 VAL 88 -14.587 29.034 -16.256 705 HG12 VAL 88 2HG1 VAL 88 -15.315 27.441 -16.055 706 HG13 VAL 88 3HG1 VAL 88 -13.947 27.653 -17.147 707 HG21 VAL 88 3HG2 VAL 88 -14.904 27.722 -13.513 708 HG22 VAL 88 1HG2 VAL 88 -14.192 29.293 -13.883 709 HG23 VAL 88 2HG2 VAL 88 -13.264 28.096 -12.978 710 H VAL 89 H VAL 89 -10.704 26.815 -14.828 711 HA VAL 89 HA VAL 89 -10.429 25.788 -12.092 712 HB VAL 89 HB VAL 89 -8.990 24.575 -13.595 713 HG11 VAL 89 1HG1 VAL 89 -7.209 25.668 -14.884 714 HG12 VAL 89 2HG1 VAL 89 -7.852 27.242 -14.418 715 HG13 VAL 89 3HG1 VAL 89 -8.817 26.156 -15.417 716 HG21 VAL 89 3HG2 VAL 89 -8.113 25.037 -11.372 717 HG22 VAL 89 1HG2 VAL 89 -7.395 26.541 -11.953 718 HG23 VAL 89 2HG2 VAL 89 -6.811 24.990 -12.560 719 H ASN 90 H ASN 90 -10.415 27.304 -10.608 720 HA ASN 90 HA ASN 90 -9.257 29.929 -11.288 721 HB2 ASN 90 1HB ASN 90 -11.806 29.265 -9.867 722 HB3 ASN 90 2HB ASN 90 -10.930 30.722 -9.413 723 HD21 ASN 90 2HD2 ASN 90 -13.543 30.405 -10.688 724 HD22 ASN 90 1HD2 ASN 90 -13.455 31.289 -12.172 725 H GLY 91 H GLY 91 -7.388 30.043 -10.305 726 HA2 GLY 91 1HA GLY 91 -5.892 30.216 -8.557 727 HA3 GLY 91 2HA GLY 91 -7.210 29.874 -7.442 728 H ARG 92 H ARG 92 -7.133 28.001 -6.413 729 HA ARG 92 HA ARG 92 -5.608 25.806 -7.664 730 HB2 ARG 92 1HB ARG 92 -5.946 26.433 -4.721 731 HB3 ARG 92 2HB ARG 92 -5.124 25.015 -5.360 732 HG2 ARG 92 1HG ARG 92 -4.297 27.884 -5.774 733 HG3 ARG 92 2HG ARG 92 -3.523 26.715 -4.699 734 HD2 ARG 92 1HD ARG 92 -2.814 25.378 -6.531 735 HD3 ARG 92 2HD ARG 92 -3.819 26.281 -7.662 736 HE ARG 92 HE ARG 92 -1.995 28.062 -6.476 737 HH11 ARG 92 1HH1 ARG 92 -2.025 25.326 -8.663 738 HH12 ARG 92 2HH1 ARG 92 -0.632 25.847 -9.556 739 HH21 ARG 92 1HH2 ARG 92 -0.182 28.786 -7.678 740 HH22 ARG 92 2HH2 ARG 92 0.397 27.836 -9.017 741 H SER 93 H SER 93 -8.561 26.747 -7.483 742 HA SER 93 HA SER 93 -9.646 24.109 -6.772 743 HB2 SER 93 1HB SER 93 -11.697 25.310 -5.953 744 HB3 SER 93 2HB SER 93 -10.255 25.584 -4.973 745 HG SER 93 HG SER 93 -10.319 27.432 -6.889 746 H ILE 94 H ILE 94 -11.426 23.405 -7.966 747 HA ILE 94 HA ILE 94 -11.666 24.591 -10.603 748 HB ILE 94 HB ILE 94 -12.941 22.110 -9.424 749 HG12 ILE 94 1HG1 ILE 94 -10.691 22.329 -11.423 750 HG13 ILE 94 2HG1 ILE 94 -10.418 22.182 -9.693 751 HG21 ILE 94 1HG2 ILE 94 -13.478 21.528 -11.745 752 HG22 ILE 94 2HG2 ILE 94 -12.849 23.088 -12.276 753 HG23 ILE 94 3HG2 ILE 94 -14.281 23.018 -11.248 754 HD11 ILE 94 3HD1 ILE 94 -11.732 20.168 -11.499 755 HD12 ILE 94 1HD1 ILE 94 -11.626 20.021 -9.742 756 HD13 ILE 94 2HD1 ILE 94 -10.154 20.045 -10.715 757 H ASP 95 H ASP 95 -13.427 25.683 -11.339 758 HA ASP 95 HA ASP 95 -15.406 26.385 -9.276 759 HB2 ASP 95 1HB ASP 95 -13.551 28.095 -9.931 760 HB3 ASP 95 2HB ASP 95 -14.498 28.298 -11.394 761 H ILE 96 H ILE 96 -17.341 27.495 -10.247 762 HA ILE 96 HA ILE 96 -18.043 26.304 -12.848 763 HB ILE 96 HB ILE 96 -19.898 26.600 -10.474 764 HG12 ILE 96 1HG1 ILE 96 -18.833 24.041 -11.683 765 HG13 ILE 96 2HG1 ILE 96 -18.135 24.806 -10.256 766 HG21 ILE 96 1HG2 ILE 96 -21.015 26.843 -12.630 767 HG22 ILE 96 2HG2 ILE 96 -21.488 25.341 -11.835 768 HG23 ILE 96 3HG2 ILE 96 -20.332 25.308 -13.167 769 HD11 ILE 96 3HD1 ILE 96 -20.945 23.770 -10.526 770 HD12 ILE 96 1HD1 ILE 96 -20.275 24.567 -9.103 771 HD13 ILE 96 2HD1 ILE 96 -19.625 23.015 -9.630 772 H GLU 97 H GLU 97 -18.269 27.946 -14.231 773 HA GLU 97 HA GLU 97 -19.719 30.328 -13.281 774 HB2 GLU 97 1HB GLU 97 -18.552 31.630 -15.020 775 HB3 GLU 97 2HB GLU 97 -17.445 30.948 -13.842 776 HG2 GLU 97 1HG GLU 97 -16.801 29.219 -15.385 777 HG3 GLU 97 2HG GLU 97 -17.987 29.790 -16.560 778 H TYR 98 H TYR 98 -20.989 31.415 -14.956 779 HA TYR 98 HA TYR 98 -22.271 29.366 -16.615 780 HB2 TYR 98 1HB TYR 98 -23.335 31.682 -15.063 781 HB3 TYR 98 2HB TYR 98 -24.211 31.142 -16.493 782 HD1 TYR 98 HD2 TYR 98 -22.960 30.071 -13.178 783 HD2 TYR 98 HD1 TYR 98 -25.558 29.210 -16.440 784 HE1 TYR 98 HE2 TYR 98 -24.041 28.315 -11.842 785 HE2 TYR 98 HE1 TYR 98 -26.647 27.449 -15.106 786 HH TYR 98 HH TYR 98 -26.122 27.098 -11.742 787 H TYR 99 H TYR 99 -22.250 29.568 -18.711 788 HA TYR 99 HA TYR 99 -21.749 32.225 -19.873 789 HB2 TYR 99 1HB TYR 99 -21.013 31.094 -21.909 790 HB3 TYR 99 2HB TYR 99 -20.086 30.510 -20.535 791 HD1 TYR 99 HD1 TYR 99 -22.740 29.646 -22.949 792 HD2 TYR 99 HD2 TYR 99 -20.180 28.210 -19.869 793 HE1 TYR 99 HE1 TYR 99 -23.317 27.338 -23.557 794 HE2 TYR 99 HE2 TYR 99 -20.759 25.897 -20.466 795 HH TYR 99 HH TYR 99 -22.353 25.083 -23.343 796 H GLU 100 H GLU 100 -23.069 32.798 -21.749 797 HA GLU 100 HA GLU 100 -25.793 32.131 -21.180 798 HB2 GLU 100 1HB GLU 100 -25.042 34.399 -21.892 799 HB3 GLU 100 2HB GLU 100 -24.725 33.748 -23.493 800 HG2 GLU 100 1HG GLU 100 -27.012 33.324 -23.884 801 HG3 GLU 100 2HG GLU 100 -27.424 33.584 -22.190 802 H CYS 101 H CYS 101 -27.138 30.845 -22.184 803 HA CYS 101 HA CYS 101 -26.442 28.593 -23.533 804 HB2 CYS 101 1HB CYS 101 -28.654 29.021 -22.559 805 HB3 CYS 101 2HB CYS 101 -29.011 30.148 -23.862 806 HA PRO 102 HA PRO 102 -24.911 29.945 -27.463 807 HB2 PRO 102 1HB PRO 102 -25.144 27.498 -28.724 808 HB3 PRO 102 2HB PRO 102 -23.786 27.994 -27.710 809 HG2 PRO 102 1HG PRO 102 -26.159 26.320 -27.014 810 HG3 PRO 102 2HG PRO 102 -24.464 26.116 -26.536 811 HD2 PRO 102 1HD PRO 102 -26.276 27.136 -24.851 812 HD3 PRO 102 2HD PRO 102 -24.608 27.746 -24.887 813 H VAL 103 H VAL 103 -28.092 28.670 -26.995 814 HA VAL 103 HA VAL 103 -28.983 28.776 -29.677 815 HB VAL 103 HB VAL 103 -30.195 27.632 -27.778 816 HG11 VAL 103 1HG1 VAL 103 -31.168 30.420 -27.183 817 HG12 VAL 103 2HG1 VAL 103 -30.131 29.437 -26.148 818 HG13 VAL 103 3HG1 VAL 103 -31.788 28.928 -26.474 819 HG21 VAL 103 3HG2 VAL 103 -31.206 27.927 -29.974 820 HG22 VAL 103 1HG2 VAL 103 -31.805 29.515 -29.492 821 HG23 VAL 103 2HG2 VAL 103 -32.415 28.063 -28.697 822 H LYS 104 H LYS 104 -28.404 31.205 -27.276 823 HA LYS 104 HA LYS 104 -29.891 33.327 -28.415 824 HB2 LYS 104 1HB LYS 104 -27.486 33.168 -26.623 825 HB3 LYS 104 2HB LYS 104 -28.022 34.719 -27.250 826 HG2 LYS 104 1HG LYS 104 -29.761 32.845 -25.671 827 HG3 LYS 104 2HG LYS 104 -28.849 34.187 -24.974 828 HD2 LYS 104 1HD LYS 104 -31.022 34.375 -27.062 829 HD3 LYS 104 2HD LYS 104 -31.146 34.864 -25.370 830 HE2 LYS 104 1HE LYS 104 -29.321 36.073 -27.450 831 HE3 LYS 104 2HE LYS 104 -30.799 36.801 -26.823 832 HZ1 LYS 104 3HZ LYS 104 -28.347 36.196 -25.241 833 HZ2 LYS 104 1HZ LYS 104 -29.773 36.887 -24.628 834 HZ3 LYS 104 2HZ LYS 104 -28.841 37.730 -25.765 835 H ARG 105 H ARG 105 -26.870 31.825 -29.143 836 HA ARG 105 HA ARG 105 -26.287 33.816 -31.219 837 HB2 ARG 105 1HB ARG 105 -24.514 31.595 -30.180 838 HB3 ARG 105 2HB ARG 105 -24.036 32.905 -31.246 839 HG2 ARG 105 1HG ARG 105 -25.047 33.413 -28.468 840 HG3 ARG 105 2HG ARG 105 -23.352 33.054 -28.798 841 HD2 ARG 105 1HD ARG 105 -23.569 35.418 -28.712 842 HD3 ARG 105 2HD ARG 105 -23.356 34.981 -30.403 843 HE ARG 105 HE ARG 105 -25.954 35.711 -29.193 844 HH11 ARG 105 1HH1 ARG 105 -23.696 35.701 -31.875 845 HH12 ARG 105 2HH1 ARG 105 -24.748 36.605 -32.923 846 HH21 ARG 105 1HH2 ARG 105 -27.317 36.943 -30.558 847 HH22 ARG 105 2HH2 ARG 105 -26.782 37.328 -32.167 848 H LYS 106 H LYS 106 -28.222 31.516 -31.045 849 HA LYS 106 HA LYS 106 -28.913 29.618 -32.061 850 HB2 LYS 106 1HB LYS 106 -29.334 29.885 -34.417 851 HB3 LYS 106 2HB LYS 106 -29.649 31.387 -33.568 852 HG2 LYS 106 1HG LYS 106 -27.436 32.212 -34.337 853 HG3 LYS 106 2HG LYS 106 -27.275 30.737 -35.296 854 HD2 LYS 106 1HD LYS 106 -29.402 31.298 -36.428 855 HD3 LYS 106 2HD LYS 106 -29.437 32.817 -35.531 856 HE2 LYS 106 1HE LYS 106 -27.387 33.530 -36.597 857 HE3 LYS 106 2HE LYS 106 -27.236 31.973 -37.414 858 HZ1 LYS 106 3HZ LYS 106 -29.418 33.948 -37.828 859 HZ2 LYS 106 1HZ LYS 106 -29.302 32.438 -38.592 860 HZ3 LYS 106 2HZ LYS 106 -28.142 33.633 -38.903 Start of MODEL 20 1 HA MET 1 HA MET 1 -5.200 -3.858 -12.916 2 HB2 MET 1 1HB MET 1 -4.069 -2.033 -14.146 3 HB3 MET 1 2HB MET 1 -4.146 -1.028 -12.705 4 HG2 MET 1 1HG MET 1 -2.717 -2.586 -11.514 5 HG3 MET 1 2HG MET 1 -2.679 -3.648 -12.918 6 HE1 MET 1 2HE MET 1 -0.011 -3.645 -12.748 7 HE2 MET 1 3HE MET 1 -0.095 -2.545 -11.372 8 HE3 MET 1 1HE MET 1 0.963 -2.173 -12.733 9 H GLU 2 H GLU 2 -6.818 -1.464 -11.061 10 HA GLU 2 HA GLU 2 -5.490 -2.001 -8.593 11 HB2 GLU 2 1HB GLU 2 -7.508 -0.910 -7.559 12 HB3 GLU 2 2HB GLU 2 -6.655 0.076 -8.734 13 HG2 GLU 2 1HG GLU 2 -9.081 -1.525 -9.475 14 HG3 GLU 2 2HG GLU 2 -9.202 0.090 -8.782 15 HA PRO 3 HA PRO 3 -7.147 -5.896 -7.598 16 HB2 PRO 3 1HB PRO 3 -7.360 -5.743 -4.880 17 HB3 PRO 3 2HB PRO 3 -5.825 -5.944 -5.733 18 HG2 PRO 3 1HG PRO 3 -7.058 -3.463 -4.605 19 HG3 PRO 3 2HG PRO 3 -5.368 -4.001 -4.552 20 HD2 PRO 3 1HD PRO 3 -6.234 -2.129 -6.295 21 HD3 PRO 3 2HD PRO 3 -4.942 -3.275 -6.702 22 H ILE 4 H ILE 4 -9.193 -5.900 -8.505 23 HA ILE 4 HA ILE 4 -11.434 -4.879 -6.964 24 HB ILE 4 HB ILE 4 -11.508 -6.484 -9.532 25 HG12 ILE 4 1HG1 ILE 4 -10.252 -4.402 -9.870 26 HG13 ILE 4 2HG1 ILE 4 -11.808 -4.335 -10.694 27 HG21 ILE 4 1HG2 ILE 4 -13.766 -5.551 -9.772 28 HG22 ILE 4 2HG2 ILE 4 -13.593 -4.744 -8.214 29 HG23 ILE 4 3HG2 ILE 4 -13.609 -6.505 -8.298 30 HD11 ILE 4 3HD1 ILE 4 -11.150 -3.042 -8.057 31 HD12 ILE 4 1HD1 ILE 4 -12.706 -2.969 -8.883 32 HD13 ILE 4 2HD1 ILE 4 -11.283 -2.224 -9.614 33 H GLY 5 H GLY 5 -10.952 -6.246 -5.120 34 HA2 GLY 5 1HA GLY 5 -11.990 -8.977 -5.490 35 HA3 GLY 5 2HA GLY 5 -10.492 -8.712 -4.614 36 H ARG 6 H ARG 6 -13.731 -9.181 -4.306 37 HA ARG 6 HA ARG 6 -13.622 -8.180 -1.540 38 HB2 ARG 6 1HB ARG 6 -16.116 -7.978 -1.637 39 HB3 ARG 6 2HB ARG 6 -15.263 -6.847 -2.679 40 HG2 ARG 6 1HG ARG 6 -15.722 -8.298 -4.602 41 HG3 ARG 6 2HG ARG 6 -16.607 -9.397 -3.542 42 HD2 ARG 6 1HD ARG 6 -18.223 -7.683 -3.035 43 HD3 ARG 6 2HD ARG 6 -17.298 -6.492 -3.947 44 HE ARG 6 HE ARG 6 -17.925 -8.616 -5.662 45 HH11 ARG 6 1HH1 ARG 6 -19.568 -6.059 -3.906 46 HH12 ARG 6 2HH1 ARG 6 -20.864 -5.918 -5.059 47 HH21 ARG 6 1HH2 ARG 6 -19.636 -8.448 -7.169 48 HH22 ARG 6 2HH2 ARG 6 -20.900 -7.279 -6.916 49 H SER 7 H SER 7 -13.371 -10.810 -3.342 50 HA SER 7 HA SER 7 -15.183 -12.579 -1.932 51 HB2 SER 7 1HB SER 7 -13.007 -13.369 -3.873 52 HB3 SER 7 2HB SER 7 -14.492 -14.239 -3.480 53 HG SER 7 HG SER 7 -15.661 -12.841 -4.662 54 H LEU 8 H LEU 8 -12.674 -11.131 -0.787 55 HA LEU 8 HA LEU 8 -10.828 -13.148 -0.063 56 HB2 LEU 8 1HB LEU 8 -11.412 -10.406 1.022 57 HB3 LEU 8 2HB LEU 8 -10.234 -11.452 1.790 58 HG LEU 8 HG LEU 8 -8.991 -11.537 -0.386 59 HD11 LEU 8 1HD1 LEU 8 -9.458 -9.802 -2.051 60 HD12 LEU 8 2HD1 LEU 8 -10.921 -9.360 -1.170 61 HD13 LEU 8 3HD1 LEU 8 -10.784 -10.956 -1.908 62 HD21 LEU 8 3HD2 LEU 8 -8.010 -9.313 -0.149 63 HD22 LEU 8 1HD2 LEU 8 -8.295 -10.063 1.421 64 HD23 LEU 8 2HD2 LEU 8 -9.387 -8.809 0.832 65 H GLN 9 H GLN 9 -13.686 -11.816 1.499 66 HA GLN 9 HA GLN 9 -13.601 -14.037 3.426 67 HB2 GLN 9 1HB GLN 9 -14.465 -11.200 4.041 68 HB3 GLN 9 2HB GLN 9 -14.508 -12.553 5.161 69 HG2 GLN 9 1HG GLN 9 -12.020 -11.374 3.941 70 HG3 GLN 9 2HG GLN 9 -12.614 -11.060 5.570 71 HE21 GLN 9 2HE2 GLN 9 -10.087 -12.196 4.715 72 HE22 GLN 9 1HE2 GLN 9 -9.987 -13.771 5.443 73 H GLY 10 H GLY 10 -15.724 -11.395 2.355 74 HA2 GLY 10 1HA GLY 10 -17.703 -12.426 1.003 75 HA3 GLY 10 2HA GLY 10 -18.024 -13.187 2.558 76 H VAL 11 H VAL 11 -18.924 -12.019 4.196 77 HA VAL 11 HA VAL 11 -19.739 -9.278 3.486 78 HB VAL 11 HB VAL 11 -20.885 -11.033 5.662 79 HG11 VAL 11 1HG1 VAL 11 -22.695 -9.422 5.728 80 HG12 VAL 11 2HG1 VAL 11 -21.945 -8.490 4.431 81 HG13 VAL 11 3HG1 VAL 11 -21.153 -8.610 6.001 82 HG21 VAL 11 3HG2 VAL 11 -22.800 -11.368 4.174 83 HG22 VAL 11 1HG2 VAL 11 -21.319 -12.042 3.493 84 HG23 VAL 11 2HG2 VAL 11 -21.951 -10.508 2.890 85 H THR 12 H THR 12 -17.974 -8.148 4.103 86 HA THR 12 HA THR 12 -17.768 -7.520 6.875 87 HB THR 12 HB THR 12 -16.310 -9.513 6.846 88 HG1 THR 12 HG1 THR 12 -15.368 -8.301 8.307 89 HG21 THR 12 3HG2 THR 12 -15.605 -9.444 4.511 90 HG22 THR 12 1HG2 THR 12 -14.208 -9.483 5.586 91 HG23 THR 12 2HG2 THR 12 -14.691 -7.968 4.821 92 H GLY 13 H GLY 13 -16.486 -5.629 7.206 93 HA2 GLY 13 1HA GLY 13 -15.467 -3.646 6.591 94 HA3 GLY 13 2HA GLY 13 -15.208 -4.328 4.991 95 H ARG 14 H ARG 14 -17.059 -2.200 6.870 96 HA ARG 14 HA ARG 14 -18.659 -1.497 4.534 97 HB2 ARG 14 1HB ARG 14 -19.821 -2.055 7.274 98 HB3 ARG 14 2HB ARG 14 -20.683 -1.197 6.007 99 HG2 ARG 14 1HG ARG 14 -19.738 -4.056 5.916 100 HG3 ARG 14 2HG ARG 14 -21.402 -3.496 6.090 101 HD2 ARG 14 1HD ARG 14 -21.157 -2.365 3.870 102 HD3 ARG 14 2HD ARG 14 -19.592 -3.161 3.706 103 HE ARG 14 HE ARG 14 -22.207 -4.517 3.783 104 HH11 ARG 14 1HH1 ARG 14 -18.767 -4.549 3.083 105 HH12 ARG 14 2HH1 ARG 14 -18.857 -5.988 2.116 106 HH21 ARG 14 1HH2 ARG 14 -22.318 -6.408 2.508 107 HH22 ARG 14 2HH2 ARG 14 -20.865 -7.044 1.783 108 HA PRO 15 HA PRO 15 -17.171 2.258 6.769 109 HB2 PRO 15 1HB PRO 15 -15.362 3.139 4.988 110 HB3 PRO 15 2HB PRO 15 -14.944 1.943 6.219 111 HG2 PRO 15 1HG PRO 15 -15.468 1.566 3.316 112 HG3 PRO 15 2HG PRO 15 -14.335 0.714 4.376 113 HD2 PRO 15 1HD PRO 15 -16.843 -0.216 3.577 114 HD3 PRO 15 2HD PRO 15 -15.878 -0.853 4.918 115 H ASP 16 H ASP 16 -19.059 3.384 6.428 116 HA ASP 16 HA ASP 16 -20.218 3.707 3.866 117 HB2 ASP 16 1HB ASP 16 -21.945 4.850 4.893 118 HB3 ASP 16 2HB ASP 16 -21.322 3.887 6.226 119 H PHE 17 H PHE 17 -17.781 5.455 5.556 120 HA PHE 17 HA PHE 17 -17.893 7.946 4.322 121 HB2 PHE 17 1HB PHE 17 -16.317 7.582 6.102 122 HB3 PHE 17 2HB PHE 17 -15.516 6.295 5.207 123 HD1 PHE 17 HD1 PHE 17 -16.288 9.930 4.985 124 HD2 PHE 17 HD2 PHE 17 -13.611 6.772 4.000 125 HE1 PHE 17 HE1 PHE 17 -14.701 11.566 4.059 126 HE2 PHE 17 HE2 PHE 17 -12.021 8.402 3.074 127 HZ PHE 17 HZ PHE 17 -12.564 10.802 3.103 128 H GLN 18 H GLN 18 -16.217 4.988 3.234 129 HA GLN 18 HA GLN 18 -15.298 6.160 0.809 130 HB2 GLN 18 1HB GLN 18 -14.354 4.102 0.332 131 HB3 GLN 18 2HB GLN 18 -14.450 4.036 2.080 132 HG2 GLN 18 1HG GLN 18 -15.306 1.998 1.654 133 HG3 GLN 18 2HG GLN 18 -16.802 2.922 1.522 134 HE21 GLN 18 2HE2 GLN 18 -14.214 2.874 -0.896 135 HE22 GLN 18 1HE2 GLN 18 -15.145 2.102 -2.120 136 H LYS 19 H LYS 19 -18.178 4.511 1.807 137 HA LYS 19 HA LYS 19 -19.226 3.800 -0.688 138 HB2 LYS 19 1HB LYS 19 -20.689 4.609 1.830 139 HB3 LYS 19 2HB LYS 19 -21.415 3.782 0.460 140 HG2 LYS 19 1HG LYS 19 -19.150 2.660 2.091 141 HG3 LYS 19 2HG LYS 19 -20.848 2.311 2.390 142 HD2 LYS 19 1HD LYS 19 -19.344 1.723 -0.156 143 HD3 LYS 19 2HD LYS 19 -19.790 0.542 1.078 144 HE2 LYS 19 1HE LYS 19 -22.188 1.182 0.668 145 HE3 LYS 19 2HE LYS 19 -21.626 2.132 -0.707 146 HZ1 LYS 19 3HZ LYS 19 -21.357 -0.799 -0.338 147 HZ2 LYS 19 1HZ LYS 19 -20.646 0.072 -1.612 148 HZ3 LYS 19 2HZ LYS 19 -22.337 -0.002 -1.467 149 H ARG 20 H ARG 20 -19.666 6.760 1.241 150 HA ARG 20 HA ARG 20 -21.278 8.072 -0.729 151 HB2 ARG 20 1HB ARG 20 -19.617 9.637 1.213 152 HB3 ARG 20 2HB ARG 20 -21.269 9.921 0.681 153 HG2 ARG 20 1HG ARG 20 -22.018 8.024 2.031 154 HG3 ARG 20 2HG ARG 20 -20.354 7.776 2.570 155 HD2 ARG 20 1HD ARG 20 -22.054 10.219 3.067 156 HD3 ARG 20 2HD ARG 20 -21.635 8.985 4.251 157 HE ARG 20 HE ARG 20 -19.808 10.986 3.105 158 HH11 ARG 20 1HH1 ARG 20 -20.420 8.442 5.442 159 HH12 ARG 20 2HH1 ARG 20 -19.072 8.885 6.451 160 HH21 ARG 20 1HH2 ARG 20 -18.040 11.570 4.456 161 HH22 ARG 20 2HH2 ARG 20 -17.740 10.650 5.910 162 H LEU 21 H LEU 21 -17.921 8.368 0.298 163 HA LEU 21 HA LEU 21 -17.169 10.443 -1.397 164 HB2 LEU 21 1HB LEU 21 -15.764 9.895 0.413 165 HB3 LEU 21 2HB LEU 21 -15.620 8.226 -0.098 166 HG LEU 21 HG LEU 21 -14.323 9.000 -2.081 167 HD11 LEU 21 1HD1 LEU 21 -15.168 11.305 -2.152 168 HD12 LEU 21 2HD1 LEU 21 -13.407 11.249 -2.088 169 HD13 LEU 21 3HD1 LEU 21 -14.327 11.653 -0.639 170 HD21 LEU 21 3HD2 LEU 21 -13.194 8.132 -0.117 171 HD22 LEU 21 1HD2 LEU 21 -13.227 9.729 0.633 172 HD23 LEU 21 2HD2 LEU 21 -12.262 9.457 -0.818 173 H GLU 22 H GLU 22 -16.735 6.937 -1.942 174 HA GLU 22 HA GLU 22 -15.561 7.386 -4.509 175 HB2 GLU 22 1HB GLU 22 -16.558 4.848 -3.212 176 HB3 GLU 22 2HB GLU 22 -15.673 4.914 -4.731 177 HG2 GLU 22 1HG GLU 22 -14.638 5.876 -2.075 178 HG3 GLU 22 2HG GLU 22 -14.249 4.329 -2.824 179 H GLN 23 H GLN 23 -18.816 6.754 -3.364 180 HA GLN 23 HA GLN 23 -19.942 6.030 -5.855 181 HB2 GLN 23 1HB GLN 23 -21.092 5.839 -3.633 182 HB3 GLN 23 2HB GLN 23 -21.306 7.579 -3.652 183 HG2 GLN 23 1HG GLN 23 -22.639 7.405 -5.683 184 HG3 GLN 23 2HG GLN 23 -22.421 5.656 -5.678 185 HE21 GLN 23 2HE2 GLN 23 -22.622 5.537 -2.747 186 HE22 GLN 23 1HE2 GLN 23 -24.303 5.711 -2.391 187 H MET 24 H MET 24 -19.896 9.172 -4.173 188 HA MET 24 HA MET 24 -20.926 10.649 -6.333 189 HB2 MET 24 1HB MET 24 -20.098 12.645 -5.172 190 HB3 MET 24 2HB MET 24 -20.924 11.556 -4.073 191 HG2 MET 24 1HG MET 24 -18.778 10.748 -3.259 192 HG3 MET 24 2HG MET 24 -17.945 11.833 -4.368 193 HE1 MET 24 3HE MET 24 -18.830 15.351 -2.961 194 HE2 MET 24 1HE MET 24 -19.627 14.466 -4.262 195 HE3 MET 24 2HE MET 24 -17.868 14.444 -4.130 196 H LYS 25 H LYS 25 -17.615 9.871 -5.415 197 HA LYS 25 HA LYS 25 -16.299 11.514 -7.262 198 HB2 LYS 25 1HB LYS 25 -15.254 10.456 -5.305 199 HB3 LYS 25 2HB LYS 25 -15.427 8.885 -6.067 200 HG2 LYS 25 1HG LYS 25 -13.815 9.395 -7.708 201 HG3 LYS 25 2HG LYS 25 -13.825 11.113 -7.284 202 HD2 LYS 25 1HD LYS 25 -12.833 10.667 -5.163 203 HD3 LYS 25 2HD LYS 25 -13.011 8.925 -5.381 204 HE2 LYS 25 1HE LYS 25 -11.423 8.988 -7.231 205 HE3 LYS 25 2HE LYS 25 -11.265 10.734 -7.049 206 HZ1 LYS 25 3HZ LYS 25 -10.302 10.448 -4.898 207 HZ2 LYS 25 1HZ LYS 25 -9.463 9.458 -5.985 208 HZ3 LYS 25 2HZ LYS 25 -10.588 8.772 -4.925 209 H GLU 26 H GLU 26 -17.382 8.138 -7.518 210 HA GLU 26 HA GLU 26 -16.349 7.655 -10.085 211 HB2 GLU 26 1HB GLU 26 -17.290 5.934 -8.492 212 HB3 GLU 26 2HB GLU 26 -18.895 6.476 -8.967 213 HG2 GLU 26 1HG GLU 26 -18.038 6.017 -11.376 214 HG3 GLU 26 2HG GLU 26 -16.842 5.018 -10.555 215 H LYS 27 H LYS 27 -19.492 8.840 -9.006 216 HA LYS 27 HA LYS 27 -20.780 9.059 -11.456 217 HB2 LYS 27 1HB LYS 27 -21.024 10.583 -8.882 218 HB3 LYS 27 2HB LYS 27 -22.010 11.010 -10.272 219 HG2 LYS 27 1HG LYS 27 -22.907 8.721 -10.311 220 HG3 LYS 27 2HG LYS 27 -21.935 8.332 -8.890 221 HD2 LYS 27 1HD LYS 27 -24.258 8.851 -8.293 222 HD3 LYS 27 2HD LYS 27 -23.131 10.014 -7.595 223 HE2 LYS 27 1HE LYS 27 -23.637 11.584 -9.404 224 HE3 LYS 27 2HE LYS 27 -24.769 10.423 -10.094 225 HZ1 LYS 27 3HZ LYS 27 -25.753 12.238 -8.677 226 HZ2 LYS 27 1HZ LYS 27 -25.046 11.477 -7.337 227 HZ3 LYS 27 2HZ LYS 27 -26.207 10.656 -8.262 228 H VAL 28 H VAL 28 -18.708 11.412 -9.811 229 HA VAL 28 HA VAL 28 -19.015 13.501 -11.656 230 HB VAL 28 HB VAL 28 -16.637 12.881 -9.893 231 HG11 VAL 28 1HG1 VAL 28 -17.452 15.459 -11.224 232 HG12 VAL 28 2HG1 VAL 28 -16.075 14.451 -11.673 233 HG13 VAL 28 3HG1 VAL 28 -16.105 15.252 -10.104 234 HG21 VAL 28 3HG2 VAL 28 -18.967 14.728 -9.396 235 HG22 VAL 28 1HG2 VAL 28 -17.617 14.405 -8.302 236 HG23 VAL 28 2HG2 VAL 28 -18.779 13.127 -8.680 237 H MET 29 H MET 29 -16.720 10.799 -11.518 238 HA MET 29 HA MET 29 -15.318 11.788 -13.856 239 HB2 MET 29 1HB MET 29 -13.809 9.928 -13.568 240 HB3 MET 29 2HB MET 29 -14.080 10.695 -12.010 241 HG2 MET 29 1HG MET 29 -15.632 8.928 -11.395 242 HG3 MET 29 2HG MET 29 -15.413 8.173 -12.973 243 HE1 MET 29 3HE MET 29 -12.047 8.535 -9.832 244 HE2 MET 29 1HE MET 29 -13.673 9.183 -9.607 245 HE3 MET 29 2HE MET 29 -12.599 9.892 -10.813 246 H LYS 30 H LYS 30 -18.211 10.614 -13.744 247 HA LYS 30 HA LYS 30 -17.863 8.885 -16.103 248 HB2 LYS 30 1HB LYS 30 -19.661 8.698 -13.794 249 HB3 LYS 30 2HB LYS 30 -20.479 8.527 -15.339 250 HG2 LYS 30 1HG LYS 30 -19.898 6.353 -14.583 251 HG3 LYS 30 2HG LYS 30 -18.835 6.751 -15.934 252 HD2 LYS 30 1HD LYS 30 -17.046 7.302 -14.390 253 HD3 LYS 30 2HD LYS 30 -18.110 6.991 -13.016 254 HE2 LYS 30 1HE LYS 30 -17.118 5.009 -15.055 255 HE3 LYS 30 2HE LYS 30 -16.702 5.084 -13.343 256 HZ1 LYS 30 3HZ LYS 30 -19.381 4.452 -14.464 257 HZ2 LYS 30 1HZ LYS 30 -19.028 4.586 -12.812 258 HZ3 LYS 30 2HZ LYS 30 -18.319 3.356 -13.732 259 H ASP 31 H ASP 31 -18.957 11.909 -15.022 260 HA ASP 31 HA ASP 31 -21.092 12.236 -16.895 261 HB2 ASP 31 1HB ASP 31 -20.981 13.553 -14.796 262 HB3 ASP 31 2HB ASP 31 -19.557 14.383 -15.417 263 H GLN 32 H GLN 32 -21.092 13.107 -18.856 264 HA GLN 32 HA GLN 32 -18.732 12.889 -20.389 265 HB2 GLN 32 1HB GLN 32 -21.416 14.084 -21.102 266 HB3 GLN 32 2HB GLN 32 -20.149 13.675 -22.254 267 HG2 GLN 32 1HG GLN 32 -20.379 11.364 -21.840 268 HG3 GLN 32 2HG GLN 32 -21.367 11.646 -20.408 269 HE21 GLN 32 2HE2 GLN 32 -23.008 10.345 -21.196 270 HE22 GLN 32 1HE2 GLN 32 -24.066 10.856 -22.467 271 H ASP 33 H ASP 33 -20.462 15.654 -19.059 272 HA ASP 33 HA ASP 33 -18.976 17.593 -20.564 273 HB2 ASP 33 1HB ASP 33 -20.751 17.874 -18.132 274 HB3 ASP 33 2HB ASP 33 -20.036 19.231 -18.995 275 H VAL 34 H VAL 34 -18.824 16.188 -17.345 276 HA VAL 34 HA VAL 34 -16.744 17.741 -16.303 277 HB VAL 34 HB VAL 34 -17.424 14.843 -15.781 278 HG11 VAL 34 1HG1 VAL 34 -16.101 15.032 -13.736 279 HG12 VAL 34 2HG1 VAL 34 -15.603 16.659 -14.202 280 HG13 VAL 34 3HG1 VAL 34 -15.091 15.272 -15.163 281 HG21 VAL 34 3HG2 VAL 34 -19.186 16.396 -15.192 282 HG22 VAL 34 1HG2 VAL 34 -18.045 17.378 -14.274 283 HG23 VAL 34 2HG2 VAL 34 -18.438 15.747 -13.734 284 H GLN 35 H GLN 35 -16.646 14.829 -18.334 285 HA GLN 35 HA GLN 35 -13.882 14.446 -18.437 286 HB2 GLN 35 1HB GLN 35 -15.769 14.109 -20.772 287 HB3 GLN 35 2HB GLN 35 -14.230 13.299 -20.538 288 HG2 GLN 35 1HG GLN 35 -16.692 12.928 -18.864 289 HG3 GLN 35 2HG GLN 35 -16.108 11.834 -20.111 290 HE21 GLN 35 2HE2 GLN 35 -16.577 11.406 -17.279 291 HE22 GLN 35 1HE2 GLN 35 -15.090 10.812 -16.635 292 H ALA 36 H ALA 36 -15.983 16.398 -20.493 293 HA ALA 36 HA ALA 36 -14.088 17.427 -22.249 294 HB1 ALA 36 1HB ALA 36 -16.505 17.643 -22.581 295 HB2 ALA 36 2HB ALA 36 -15.688 19.201 -22.718 296 HB3 ALA 36 3HB ALA 36 -16.582 18.799 -21.251 297 H PHE 37 H PHE 37 -15.095 18.638 -19.078 298 HA PHE 37 HA PHE 37 -13.527 20.989 -19.159 299 HB2 PHE 37 1HB PHE 37 -15.304 20.833 -17.551 300 HB3 PHE 37 2HB PHE 37 -14.593 19.393 -16.831 301 HD1 PHE 37 HD1 PHE 37 -13.716 22.945 -17.547 302 HD2 PHE 37 HD2 PHE 37 -13.373 19.627 -14.907 303 HE1 PHE 37 HE1 PHE 37 -12.488 24.353 -15.944 304 HE2 PHE 37 HE2 PHE 37 -12.148 21.027 -13.301 305 HZ PHE 37 HZ PHE 37 -11.704 23.395 -13.817 306 H LEU 38 H LEU 38 -12.891 17.732 -17.942 307 HA LEU 38 HA LEU 38 -10.417 18.290 -16.740 308 HB2 LEU 38 1HB LEU 38 -11.912 15.880 -17.525 309 HB3 LEU 38 2HB LEU 38 -10.174 15.672 -17.439 310 HG LEU 38 HG LEU 38 -11.260 15.025 -15.350 311 HD11 LEU 38 1HD1 LEU 38 -9.883 16.338 -13.823 312 HD12 LEU 38 2HD1 LEU 38 -9.611 17.531 -15.092 313 HD13 LEU 38 3HD1 LEU 38 -8.989 15.891 -15.275 314 HD21 LEU 38 3HD2 LEU 38 -12.311 16.701 -13.913 315 HD22 LEU 38 1HD2 LEU 38 -13.191 16.501 -15.429 316 HD23 LEU 38 2HD2 LEU 38 -12.144 17.901 -15.196 317 H LYS 39 H LYS 39 -11.204 17.170 -20.008 318 HA LYS 39 HA LYS 39 -8.470 16.886 -20.788 319 HB2 LYS 39 1HB LYS 39 -9.360 16.765 -23.103 320 HB3 LYS 39 2HB LYS 39 -10.155 15.656 -21.996 321 HG2 LYS 39 1HG LYS 39 -12.079 17.093 -21.859 322 HG3 LYS 39 2HG LYS 39 -11.269 18.329 -22.823 323 HD2 LYS 39 1HD LYS 39 -11.831 15.545 -23.829 324 HD3 LYS 39 2HD LYS 39 -12.938 16.901 -24.059 325 HE2 LYS 39 1HE LYS 39 -10.059 16.996 -24.921 326 HE3 LYS 39 2HE LYS 39 -11.337 16.380 -25.966 327 HZ1 LYS 39 3HZ LYS 39 -11.350 19.099 -24.761 328 HZ2 LYS 39 1HZ LYS 39 -12.416 18.490 -25.931 329 HZ3 LYS 39 2HZ LYS 39 -10.786 18.756 -26.318 330 H GLU 40 H GLU 40 -10.767 19.501 -20.821 331 HA GLU 40 HA GLU 40 -9.289 21.170 -22.596 332 HB2 GLU 40 1HB GLU 40 -11.810 21.195 -21.260 333 HB3 GLU 40 2HB GLU 40 -10.995 22.718 -20.947 334 HG2 GLU 40 1HG GLU 40 -12.434 22.816 -22.925 335 HG3 GLU 40 2HG GLU 40 -10.742 23.101 -23.329 336 H ASN 41 H ASN 41 -9.320 20.635 -19.167 337 HA ASN 41 HA ASN 41 -7.324 22.777 -18.853 338 HB2 ASN 41 1HB ASN 41 -9.416 21.784 -16.926 339 HB3 ASN 41 2HB ASN 41 -8.052 22.778 -16.418 340 HD21 ASN 41 2HD2 ASN 41 -11.000 22.680 -18.261 341 HD22 ASN 41 1HD2 ASN 41 -11.193 24.396 -18.414 342 H GLU 42 H GLU 42 -6.913 19.960 -19.595 343 HA GLU 42 HA GLU 42 -5.843 18.504 -17.429 344 HB2 GLU 42 1HB GLU 42 -4.649 17.189 -19.139 345 HB3 GLU 42 2HB GLU 42 -6.334 17.429 -19.568 346 HG2 GLU 42 1HG GLU 42 -5.760 19.096 -21.179 347 HG3 GLU 42 2HG GLU 42 -4.077 19.095 -20.651 348 H GLU 43 H GLU 43 -4.810 21.250 -19.052 349 HA GLU 43 HA GLU 43 -2.002 21.051 -18.663 350 HB2 GLU 43 1HB GLU 43 -3.066 22.462 -20.390 351 HB3 GLU 43 2HB GLU 43 -3.790 23.445 -19.129 352 HG2 GLU 43 1HG GLU 43 -1.934 24.631 -19.977 353 HG3 GLU 43 2HG GLU 43 -1.486 24.037 -18.380 354 H VAL 44 H VAL 44 -4.674 21.941 -16.650 355 HA VAL 44 HA VAL 44 -2.822 23.297 -14.788 356 HB VAL 44 HB VAL 44 -5.755 23.919 -15.114 357 HG11 VAL 44 1HG1 VAL 44 -5.206 25.931 -13.804 358 HG12 VAL 44 2HG1 VAL 44 -3.551 25.344 -13.622 359 HG13 VAL 44 3HG1 VAL 44 -4.890 24.444 -12.909 360 HG21 VAL 44 3HG2 VAL 44 -4.597 24.538 -17.151 361 HG22 VAL 44 1HG2 VAL 44 -3.364 25.390 -16.218 362 HG23 VAL 44 2HG2 VAL 44 -5.023 25.984 -16.234 363 H ILE 45 H ILE 45 -5.492 21.049 -15.114 364 HA ILE 45 HA ILE 45 -6.167 21.031 -12.339 365 HB ILE 45 HB ILE 45 -6.904 19.075 -14.515 366 HG12 ILE 45 1HG1 ILE 45 -8.446 21.368 -13.281 367 HG13 ILE 45 2HG1 ILE 45 -7.701 21.384 -14.877 368 HG21 ILE 45 1HG2 ILE 45 -7.094 18.028 -12.320 369 HG22 ILE 45 2HG2 ILE 45 -8.692 18.339 -12.998 370 HG23 ILE 45 3HG2 ILE 45 -8.048 19.391 -11.736 371 HD11 ILE 45 3HD1 ILE 45 -9.182 19.574 -15.576 372 HD12 ILE 45 1HD1 ILE 45 -10.081 20.992 -15.029 373 HD13 ILE 45 2HD1 ILE 45 -9.931 19.583 -13.980 374 H ASP 46 H ASP 46 -5.761 19.578 -10.776 375 HA ASP 46 HA ASP 46 -3.647 17.573 -11.258 376 HB2 ASP 46 1HB ASP 46 -3.033 19.606 -9.805 377 HB3 ASP 46 2HB ASP 46 -4.176 18.971 -8.628 378 H GLN 47 H GLN 47 -3.774 15.749 -9.636 379 HA GLN 47 HA GLN 47 -6.353 14.617 -9.454 380 HB2 GLN 47 1HB GLN 47 -3.849 14.030 -7.873 381 HB3 GLN 47 2HB GLN 47 -5.279 13.002 -7.901 382 HG2 GLN 47 1HG GLN 47 -4.918 12.844 -10.412 383 HG3 GLN 47 2HG GLN 47 -3.332 13.561 -10.115 384 HE21 GLN 47 2HE2 GLN 47 -5.316 10.765 -9.795 385 HE22 GLN 47 1HE2 GLN 47 -4.077 9.688 -9.238 386 H LYS 48 H LYS 48 -4.318 16.394 -7.209 387 HA LYS 48 HA LYS 48 -5.940 16.140 -4.918 388 HB2 LYS 48 1HB LYS 48 -3.933 18.244 -5.730 389 HB3 LYS 48 2HB LYS 48 -4.646 18.130 -4.130 390 HG2 LYS 48 1HG LYS 48 -3.635 15.995 -3.759 391 HG3 LYS 48 2HG LYS 48 -3.082 15.915 -5.431 392 HD2 LYS 48 1HD LYS 48 -1.633 17.855 -5.033 393 HD3 LYS 48 2HD LYS 48 -2.181 17.908 -3.354 394 HE2 LYS 48 1HE LYS 48 -1.245 15.720 -2.939 395 HE3 LYS 48 2HE LYS 48 -0.792 15.559 -4.636 396 HZ1 LYS 48 3HZ LYS 48 0.266 17.625 -2.785 397 HZ2 LYS 48 1HZ LYS 48 0.750 17.368 -4.389 398 HZ3 LYS 48 2HZ LYS 48 1.071 16.196 -3.207 399 H MET 49 H MET 49 -5.837 18.487 -7.519 400 HA MET 49 HA MET 49 -7.672 20.347 -6.582 401 HB2 MET 49 1HB MET 49 -6.237 20.590 -8.591 402 HB3 MET 49 2HB MET 49 -7.253 19.430 -9.430 403 HG2 MET 49 1HG MET 49 -9.149 20.932 -9.217 404 HG3 MET 49 2HG MET 49 -8.136 22.076 -8.339 405 HE1 MET 49 3HE MET 49 -5.569 23.176 -11.059 406 HE2 MET 49 1HE MET 49 -5.411 21.943 -9.807 407 HE3 MET 49 2HE MET 49 -6.181 23.484 -9.435 408 H ILE 50 H ILE 50 -8.137 17.297 -8.277 409 HA ILE 50 HA ILE 50 -10.939 17.519 -8.621 410 HB ILE 50 HB ILE 50 -9.211 15.047 -8.461 411 HG12 ILE 50 1HG1 ILE 50 -8.577 16.590 -10.276 412 HG13 ILE 50 2HG1 ILE 50 -9.259 15.090 -10.901 413 HG21 ILE 50 1HG2 ILE 50 -11.045 13.912 -9.630 414 HG22 ILE 50 2HG2 ILE 50 -12.026 15.370 -9.494 415 HG23 ILE 50 3HG2 ILE 50 -11.537 14.496 -8.041 416 HD11 ILE 50 3HD1 ILE 50 -10.668 17.743 -10.681 417 HD12 ILE 50 1HD1 ILE 50 -11.402 16.240 -11.243 418 HD13 ILE 50 2HD1 ILE 50 -10.084 16.974 -12.157 419 H GLU 51 H GLU 51 -8.950 15.879 -6.167 420 HA GLU 51 HA GLU 51 -11.071 14.808 -4.678 421 HB2 GLU 51 1HB GLU 51 -8.333 15.638 -3.709 422 HB3 GLU 51 2HB GLU 51 -9.436 14.562 -2.863 423 HG2 GLU 51 1HG GLU 51 -8.150 14.040 -5.533 424 HG3 GLU 51 2HG GLU 51 -7.678 13.328 -3.993 425 H LYS 52 H LYS 52 -9.443 17.931 -4.485 426 HA LYS 52 HA LYS 52 -10.793 18.782 -2.129 427 HB2 LYS 52 1HB LYS 52 -8.630 19.727 -2.955 428 HB3 LYS 52 2HB LYS 52 -9.504 20.482 -4.278 429 HG2 LYS 52 1HG LYS 52 -10.243 21.048 -1.432 430 HG3 LYS 52 2HG LYS 52 -8.902 21.889 -2.207 431 HD2 LYS 52 1HD LYS 52 -10.366 22.783 -3.893 432 HD3 LYS 52 2HD LYS 52 -11.712 21.805 -3.309 433 HE2 LYS 52 1HE LYS 52 -12.004 24.051 -2.522 434 HE3 LYS 52 2HE LYS 52 -11.590 23.024 -1.151 435 HZ1 LYS 52 3HZ LYS 52 -9.770 24.875 -2.592 436 HZ2 LYS 52 1HZ LYS 52 -9.277 23.808 -1.367 437 HZ3 LYS 52 2HZ LYS 52 -10.366 25.059 -1.015 438 H SER 53 H SER 53 -11.351 19.271 -5.594 439 HA SER 53 HA SER 53 -13.671 20.937 -5.015 440 HB2 SER 53 1HB SER 53 -12.517 20.196 -7.709 441 HB3 SER 53 2HB SER 53 -13.620 21.526 -7.345 442 HG SER 53 HG SER 53 -10.882 21.261 -6.770 443 H LEU 54 H LEU 54 -13.412 17.865 -4.778 444 HA LEU 54 HA LEU 54 -15.054 16.586 -6.608 445 HB2 LEU 54 1HB LEU 54 -13.879 16.036 -4.060 446 HB3 LEU 54 2HB LEU 54 -15.546 15.502 -4.028 447 HG LEU 54 HG LEU 54 -13.591 14.702 -6.160 448 HD11 LEU 54 1HD1 LEU 54 -14.401 13.209 -3.673 449 HD12 LEU 54 2HD1 LEU 54 -12.809 13.891 -4.005 450 HD13 LEU 54 3HD1 LEU 54 -13.422 12.560 -4.987 451 HD21 LEU 54 3HD2 LEU 54 -15.878 14.497 -6.874 452 HD22 LEU 54 1HD2 LEU 54 -16.302 13.655 -5.382 453 HD23 LEU 54 2HD2 LEU 54 -15.224 12.888 -6.550 454 H ASN 55 H ASN 55 -15.829 18.354 -3.693 455 HA ASN 55 HA ASN 55 -18.597 17.897 -3.658 456 HB2 ASN 55 1HB ASN 55 -18.632 20.099 -2.331 457 HB3 ASN 55 2HB ASN 55 -17.718 18.751 -1.672 458 HD21 ASN 55 2HD2 ASN 55 -16.387 20.004 -0.435 459 HD22 ASN 55 1HD2 ASN 55 -15.168 21.037 -1.113 460 H LYS 56 H LYS 56 -16.717 20.514 -5.133 461 HA LYS 56 HA LYS 56 -18.912 21.966 -6.150 462 HB2 LYS 56 1HB LYS 56 -16.068 21.803 -7.168 463 HB3 LYS 56 2HB LYS 56 -17.242 23.018 -7.651 464 HG2 LYS 56 1HG LYS 56 -16.267 22.618 -4.833 465 HG3 LYS 56 2HG LYS 56 -15.604 23.793 -5.967 466 HD2 LYS 56 1HD LYS 56 -18.471 23.706 -5.031 467 HD3 LYS 56 2HD LYS 56 -17.227 24.792 -4.412 468 HE2 LYS 56 1HE LYS 56 -16.963 25.741 -6.664 469 HE3 LYS 56 2HE LYS 56 -18.249 24.684 -7.247 470 HZ1 LYS 56 3HZ LYS 56 -19.116 26.870 -6.771 471 HZ2 LYS 56 1HZ LYS 56 -18.517 26.807 -5.186 472 HZ3 LYS 56 2HZ LYS 56 -19.761 25.760 -5.662 473 H LEU 57 H LEU 57 -16.779 19.564 -7.658 474 HA LEU 57 HA LEU 57 -17.938 19.622 -10.211 475 HB2 LEU 57 1HB LEU 57 -16.549 17.335 -8.814 476 HB3 LEU 57 2HB LEU 57 -16.860 17.430 -10.536 477 HG LEU 57 HG LEU 57 -15.057 19.286 -8.973 478 HD11 LEU 57 1HD1 LEU 57 -14.417 17.113 -10.959 479 HD12 LEU 57 2HD1 LEU 57 -14.121 17.050 -9.220 480 HD13 LEU 57 3HD1 LEU 57 -13.256 18.217 -10.223 481 HD21 LEU 57 3HD2 LEU 57 -15.658 19.130 -11.923 482 HD22 LEU 57 1HD2 LEU 57 -14.413 20.137 -11.183 483 HD23 LEU 57 2HD2 LEU 57 -16.115 20.436 -10.829 484 H TYR 58 H TYR 58 -18.706 17.712 -7.346 485 HA TYR 58 HA TYR 58 -20.625 16.053 -8.625 486 HB2 TYR 58 1HB TYR 58 -19.470 15.529 -6.451 487 HB3 TYR 58 2HB TYR 58 -20.495 16.739 -5.683 488 HD1 TYR 58 HD1 TYR 58 -20.834 13.780 -7.925 489 HD2 TYR 58 HD2 TYR 58 -22.413 15.972 -4.641 490 HE1 TYR 58 HE1 TYR 58 -22.587 12.085 -7.648 491 HE2 TYR 58 HE2 TYR 58 -24.173 14.283 -4.347 492 HH TYR 58 HH TYR 58 -25.296 12.575 -5.531 493 H GLU 59 H GLU 59 -20.854 19.032 -6.730 494 HA GLU 59 HA GLU 59 -23.651 19.255 -6.704 495 HB2 GLU 59 1HB GLU 59 -21.907 20.556 -5.365 496 HB3 GLU 59 2HB GLU 59 -21.702 21.560 -6.789 497 HG2 GLU 59 1HG GLU 59 -24.441 21.214 -5.701 498 HG3 GLU 59 2HG GLU 59 -23.306 22.229 -4.814 499 H TYR 60 H TYR 60 -21.246 20.051 -9.084 500 HA TYR 60 HA TYR 60 -22.834 21.583 -10.838 501 HB2 TYR 60 1HB TYR 60 -20.517 21.753 -11.131 502 HB3 TYR 60 2HB TYR 60 -20.290 20.010 -11.121 503 HD1 TYR 60 HD1 TYR 60 -21.689 22.792 -13.156 504 HD2 TYR 60 HD2 TYR 60 -20.170 18.819 -13.123 505 HE1 TYR 60 HE1 TYR 60 -21.664 22.783 -15.612 506 HE2 TYR 60 HE2 TYR 60 -20.143 18.801 -15.580 507 HH TYR 60 HH TYR 60 -21.162 19.932 -17.442 508 H ILE 61 H ILE 61 -22.130 18.085 -10.783 509 HA ILE 61 HA ILE 61 -23.607 17.649 -13.197 510 HB ILE 61 HB ILE 61 -23.285 15.258 -12.805 511 HG12 ILE 61 1HG1 ILE 61 -21.944 16.119 -10.230 512 HG13 ILE 61 2HG1 ILE 61 -23.460 15.232 -10.351 513 HG21 ILE 61 1HG2 ILE 61 -20.819 16.932 -12.381 514 HG22 ILE 61 2HG2 ILE 61 -21.563 16.534 -13.930 515 HG23 ILE 61 3HG2 ILE 61 -20.840 15.263 -12.945 516 HD11 ILE 61 3HD1 ILE 61 -21.564 13.792 -9.780 517 HD12 ILE 61 1HD1 ILE 61 -20.786 14.233 -11.300 518 HD13 ILE 61 2HD1 ILE 61 -22.306 13.335 -11.315 519 H GLU 62 H GLU 62 -24.387 17.562 -9.807 520 HA GLU 62 HA GLU 62 -26.827 16.101 -10.107 521 HB2 GLU 62 1HB GLU 62 -25.864 17.903 -7.886 522 HB3 GLU 62 2HB GLU 62 -27.300 16.891 -7.803 523 HG2 GLU 62 1HG GLU 62 -24.514 15.862 -8.245 524 HG3 GLU 62 2HG GLU 62 -25.320 15.930 -6.679 525 H GLN 63 H GLN 63 -25.961 19.499 -10.136 526 HA GLN 63 HA GLN 63 -28.663 20.455 -10.012 527 HB2 GLN 63 1HB GLN 63 -27.745 22.636 -10.329 528 HB3 GLN 63 2HB GLN 63 -26.645 21.760 -9.276 529 HG2 GLN 63 1HG GLN 63 -25.141 21.360 -11.133 530 HG3 GLN 63 2HG GLN 63 -26.255 22.172 -12.230 531 HE21 GLN 63 2HE2 GLN 63 -23.988 22.584 -9.625 532 HE22 GLN 63 1HE2 GLN 63 -23.799 24.296 -9.800 533 H SER 64 H SER 64 -29.103 22.241 -11.883 534 HA SER 64 HA SER 64 -29.654 20.742 -14.239 535 HB2 SER 64 1HB SER 64 -31.153 22.529 -13.468 536 HB3 SER 64 2HB SER 64 -29.882 23.722 -13.722 537 HG SER 64 HG SER 64 -29.950 23.221 -15.950 538 H LYS 65 H LYS 65 -27.756 20.053 -15.148 539 HA LYS 65 HA LYS 65 -25.564 21.792 -15.714 540 HB2 LYS 65 1HB LYS 65 -25.326 19.352 -15.364 541 HB3 LYS 65 2HB LYS 65 -26.222 19.066 -16.848 542 HG2 LYS 65 1HG LYS 65 -24.468 20.147 -18.136 543 HG3 LYS 65 2HG LYS 65 -23.574 20.484 -16.652 544 HD2 LYS 65 1HD LYS 65 -22.699 18.511 -17.821 545 HD3 LYS 65 2HD LYS 65 -23.335 18.105 -16.226 546 HE2 LYS 65 1HE LYS 65 -25.286 17.139 -17.146 547 HE3 LYS 65 2HE LYS 65 -24.970 17.835 -18.737 548 HZ1 LYS 65 3HZ LYS 65 -24.444 15.460 -18.626 549 HZ2 LYS 65 1HZ LYS 65 -23.287 15.761 -17.417 550 HZ3 LYS 65 2HZ LYS 65 -23.073 16.397 -18.981 551 H ASN 66 H ASN 66 -28.467 20.857 -17.343 552 HA ASN 66 HA ASN 66 -27.636 22.141 -19.838 553 HB2 ASN 66 1HB ASN 66 -29.753 21.256 -20.754 554 HB3 ASN 66 2HB ASN 66 -28.770 19.976 -20.054 555 HD21 ASN 66 2HD2 ASN 66 -31.626 20.042 -20.572 556 HD22 ASN 66 1HD2 ASN 66 -32.389 19.751 -19.046 557 H CYS 67 H CYS 67 -29.974 23.252 -20.751 558 HA CYS 67 HA CYS 67 -30.927 24.991 -18.619 559 HB2 CYS 67 1HB CYS 67 -30.262 27.002 -19.482 560 HB3 CYS 67 2HB CYS 67 -28.900 26.008 -19.959 561 H SER 68 H SER 68 -32.815 26.196 -19.178 562 HA SER 68 HA SER 68 -34.631 24.462 -20.542 563 HB2 SER 68 1HB SER 68 -35.152 27.207 -19.386 564 HB3 SER 68 2HB SER 68 -36.360 25.976 -19.764 565 HG SER 68 HG SER 68 -35.545 24.691 -18.141 566 H TYR 69 H TYR 69 -32.720 27.030 -21.614 567 HA TYR 69 HA TYR 69 -34.417 27.898 -23.758 568 HB2 TYR 69 1HB TYR 69 -32.301 29.009 -22.557 569 HB3 TYR 69 2HB TYR 69 -31.479 28.272 -23.921 570 HD1 TYR 69 HD2 TYR 69 -34.056 30.725 -22.955 571 HD2 TYR 69 HD1 TYR 69 -31.700 29.160 -26.136 572 HE1 TYR 69 HE2 TYR 69 -34.730 32.612 -24.375 573 HE2 TYR 69 HE1 TYR 69 -32.371 31.041 -27.563 574 HH TYR 69 HH TYR 69 -34.174 32.673 -27.745 575 H CYS 70 H CYS 70 -32.745 25.097 -23.208 576 HA CYS 70 HA CYS 70 -32.855 24.498 -26.078 577 HB2 CYS 70 1HB CYS 70 -30.859 23.048 -25.893 578 HB3 CYS 70 2HB CYS 70 -30.498 24.744 -25.599 579 H SER 71 H SER 71 -33.237 23.412 -22.789 580 HA SER 71 HA SER 71 -34.604 21.017 -23.805 581 HB2 SER 71 1HB SER 71 -33.496 21.487 -21.026 582 HB3 SER 71 2HB SER 71 -34.196 19.985 -21.637 583 HG SER 71 HG SER 71 -32.472 19.961 -23.203 584 H GLU 72 H GLU 72 -36.738 21.180 -23.783 585 HA GLU 72 HA GLU 72 -37.998 23.437 -22.564 586 HB2 GLU 72 1HB GLU 72 -39.279 21.069 -23.921 587 HB3 GLU 72 2HB GLU 72 -40.039 22.619 -23.588 588 HG2 GLU 72 1HG GLU 72 -39.495 23.027 -25.707 589 HG3 GLU 72 2HG GLU 72 -37.936 23.444 -25.004 590 H ASP 73 H ASP 73 -37.602 20.105 -21.617 591 HA ASP 73 HA ASP 73 -40.063 19.877 -20.311 592 HB2 ASP 73 1HB ASP 73 -39.252 17.835 -19.315 593 HB3 ASP 73 2HB ASP 73 -38.711 17.908 -20.985 594 H GLU 74 H GLU 74 -40.744 20.322 -18.350 595 HA GLU 74 HA GLU 74 -39.543 22.470 -17.009 596 HB2 GLU 74 1HB GLU 74 -41.748 20.632 -16.062 597 HB3 GLU 74 2HB GLU 74 -41.342 22.179 -15.339 598 HG2 GLU 74 1HG GLU 74 -43.243 22.525 -16.681 599 HG3 GLU 74 2HG GLU 74 -41.886 23.241 -17.543 600 H ASN 75 H ASN 75 -39.167 19.084 -16.614 601 HA ASN 75 HA ASN 75 -38.504 18.985 -13.873 602 HB2 ASN 75 1HB ASN 75 -37.535 17.154 -16.077 603 HB3 ASN 75 2HB ASN 75 -37.531 16.801 -14.352 604 HD21 ASN 75 2HD2 ASN 75 -39.383 16.944 -17.238 605 HD22 ASN 75 1HD2 ASN 75 -40.857 16.308 -16.589 606 H CYS 76 H CYS 76 -36.771 20.074 -16.626 607 HA CYS 76 HA CYS 76 -34.257 20.072 -15.093 608 HB2 CYS 76 1HB CYS 76 -34.627 20.364 -18.076 609 HB3 CYS 76 2HB CYS 76 -33.100 20.201 -17.219 610 HG CYS 76 HG CYS 76 -35.415 17.836 -17.947 611 H ASN 77 H ASN 77 -36.501 22.053 -14.930 612 HA ASN 77 HA ASN 77 -35.773 24.399 -16.317 613 HB2 ASN 77 1HB ASN 77 -37.295 25.596 -14.924 614 HB3 ASN 77 2HB ASN 77 -38.005 24.012 -15.203 615 HD21 ASN 77 2HD2 ASN 77 -38.231 22.588 -13.494 616 HD22 ASN 77 1HD2 ASN 77 -38.023 23.078 -11.847 617 H ASN 78 H ASN 78 -34.614 26.195 -15.711 618 HA ASN 78 HA ASN 78 -32.918 25.949 -13.335 619 HB2 ASN 78 1HB ASN 78 -31.089 26.962 -15.004 620 HB3 ASN 78 2HB ASN 78 -31.293 25.230 -14.772 621 HD21 ASN 78 2HD2 ASN 78 -32.288 24.013 -16.343 622 HD22 ASN 78 1HD2 ASN 78 -32.529 24.588 -17.951 623 H LEU 79 H LEU 79 -32.437 27.810 -12.331 624 HA LEU 79 HA LEU 79 -34.059 30.031 -12.726 625 HB2 LEU 79 1HB LEU 79 -32.820 31.139 -11.013 626 HB3 LEU 79 2HB LEU 79 -33.022 29.458 -10.572 627 HG LEU 79 HG LEU 79 -30.472 30.538 -11.769 628 HD11 LEU 79 1HD1 LEU 79 -30.971 31.705 -9.691 629 HD12 LEU 79 2HD1 LEU 79 -29.612 30.598 -9.483 630 HD13 LEU 79 3HD1 LEU 79 -31.209 30.162 -8.873 631 HD21 LEU 79 3HD2 LEU 79 -30.685 28.145 -11.974 632 HD22 LEU 79 1HD2 LEU 79 -31.149 28.002 -10.279 633 HD23 LEU 79 2HD2 LEU 79 -29.516 28.512 -10.707 634 H LEU 80 H LEU 80 -30.587 29.688 -13.442 635 HA LEU 80 HA LEU 80 -30.643 32.160 -14.949 636 HB2 LEU 80 1HB LEU 80 -28.720 31.629 -13.509 637 HB3 LEU 80 2HB LEU 80 -28.392 30.208 -14.479 638 HG LEU 80 HG LEU 80 -27.675 31.505 -16.331 639 HD11 LEU 80 1HD1 LEU 80 -27.858 33.915 -16.443 640 HD12 LEU 80 2HD1 LEU 80 -28.660 33.956 -14.873 641 HD13 LEU 80 3HD1 LEU 80 -29.456 33.197 -16.252 642 HD21 LEU 80 3HD2 LEU 80 -26.684 32.834 -13.812 643 HD22 LEU 80 1HD2 LEU 80 -25.890 32.879 -15.386 644 HD23 LEU 80 2HD2 LEU 80 -26.050 31.350 -14.521 645 H GLU 81 H GLU 81 -32.250 31.322 -16.426 646 HA GLU 81 HA GLU 81 -31.655 29.152 -18.171 647 HB2 GLU 81 1HB GLU 81 -33.963 29.742 -17.707 648 HB3 GLU 81 2HB GLU 81 -33.720 31.357 -18.360 649 HG2 GLU 81 1HG GLU 81 -33.314 30.394 -20.575 650 HG3 GLU 81 2HG GLU 81 -33.586 28.781 -19.918 651 H GLY 82 H GLY 82 -31.079 29.195 -20.319 652 HA2 GLY 82 1HA GLY 82 -30.358 30.163 -22.337 653 HA3 GLY 82 2HA GLY 82 -30.255 31.719 -21.522 654 H TYR 83 H TYR 83 -28.860 29.861 -19.356 655 HA TYR 83 HA TYR 83 -26.196 29.958 -20.610 656 HB2 TYR 83 1HB TYR 83 -26.981 30.652 -17.771 657 HB3 TYR 83 2HB TYR 83 -25.320 30.479 -18.319 658 HD1 TYR 83 HD1 TYR 83 -28.425 32.456 -18.929 659 HD2 TYR 83 HD2 TYR 83 -24.182 32.320 -19.195 660 HE1 TYR 83 HE1 TYR 83 -28.392 34.841 -19.528 661 HE2 TYR 83 HE2 TYR 83 -24.137 34.704 -19.799 662 HH TYR 83 HH TYR 83 -25.677 36.386 -20.816 663 H HIS 84 H HIS 84 -24.637 28.466 -19.592 664 HA HIS 84 HA HIS 84 -25.884 26.226 -18.141 665 HB2 HIS 84 1HB HIS 84 -23.804 26.060 -20.328 666 HB3 HIS 84 2HB HIS 84 -24.082 24.757 -19.185 667 HD1 HIS 84 HD1 HIS 84 -25.014 23.024 -20.805 668 HD2 HIS 84 HD2 HIS 84 -26.972 26.687 -20.957 669 HE1 HIS 84 HE1 HIS 84 -26.956 22.741 -22.417 670 HA PRO 85 HA PRO 85 -22.504 26.913 -15.345 671 HB2 PRO 85 1HB PRO 85 -22.626 24.579 -13.974 672 HB3 PRO 85 2HB PRO 85 -23.787 25.887 -13.733 673 HG2 PRO 85 1HG PRO 85 -24.079 23.347 -15.258 674 HG3 PRO 85 2HG PRO 85 -25.277 24.223 -14.286 675 HD2 PRO 85 1HD PRO 85 -25.125 24.297 -17.046 676 HD3 PRO 85 2HD PRO 85 -25.898 25.540 -16.045 677 H LYS 86 H LYS 86 -20.369 26.582 -15.529 678 HA LYS 86 HA LYS 86 -19.415 23.978 -16.422 679 HB2 LYS 86 1HB LYS 86 -18.235 24.685 -18.253 680 HB3 LYS 86 2HB LYS 86 -19.549 25.843 -18.328 681 HG2 LYS 86 1HG LYS 86 -16.985 26.467 -16.909 682 HG3 LYS 86 2HG LYS 86 -17.166 26.699 -18.647 683 HD2 LYS 86 1HD LYS 86 -18.968 28.252 -18.295 684 HD3 LYS 86 2HD LYS 86 -18.970 27.922 -16.564 685 HE2 LYS 86 1HE LYS 86 -17.854 30.033 -17.161 686 HE3 LYS 86 2HE LYS 86 -16.792 28.896 -16.334 687 HZ1 LYS 86 3HZ LYS 86 -15.714 29.989 -18.228 688 HZ2 LYS 86 1HZ LYS 86 -16.874 29.330 -19.277 689 HZ3 LYS 86 2HZ LYS 86 -15.803 28.310 -18.446 690 H LEU 87 H LEU 87 -17.204 23.596 -15.790 691 HA LEU 87 HA LEU 87 -16.705 24.805 -13.234 692 HB2 LEU 87 1HB LEU 87 -15.118 22.722 -14.731 693 HB3 LEU 87 2HB LEU 87 -14.833 23.215 -13.077 694 HG LEU 87 HG LEU 87 -15.956 21.204 -12.857 695 HD11 LEU 87 1HD1 LEU 87 -18.215 21.736 -12.027 696 HD12 LEU 87 2HD1 LEU 87 -18.053 23.353 -12.713 697 HD13 LEU 87 3HD1 LEU 87 -16.967 22.827 -11.425 698 HD21 LEU 87 3HD2 LEU 87 -17.939 20.553 -14.125 699 HD22 LEU 87 1HD2 LEU 87 -16.568 20.887 -15.181 700 HD23 LEU 87 2HD2 LEU 87 -17.865 22.071 -15.020 701 H VAL 88 H VAL 88 -14.936 26.002 -12.624 702 HA VAL 88 HA VAL 88 -13.046 26.810 -14.730 703 HB VAL 88 HB VAL 88 -12.950 29.083 -13.727 704 HG11 VAL 88 1HG1 VAL 88 -14.267 28.691 -15.730 705 HG12 VAL 88 2HG1 VAL 88 -15.027 29.911 -14.708 706 HG13 VAL 88 3HG1 VAL 88 -15.663 28.268 -14.741 707 HG21 VAL 88 3HG2 VAL 88 -15.410 28.215 -12.217 708 HG22 VAL 88 1HG2 VAL 88 -14.746 29.849 -12.270 709 HG23 VAL 88 2HG2 VAL 88 -13.827 28.547 -11.512 710 H VAL 89 H VAL 89 -10.940 26.805 -14.098 711 HA VAL 89 HA VAL 89 -10.430 25.758 -11.435 712 HB VAL 89 HB VAL 89 -9.332 24.547 -13.169 713 HG11 VAL 89 1HG1 VAL 89 -9.345 26.223 -14.927 714 HG12 VAL 89 2HG1 VAL 89 -7.725 25.557 -14.717 715 HG13 VAL 89 3HG1 VAL 89 -8.110 27.155 -14.075 716 HG21 VAL 89 3HG2 VAL 89 -8.045 24.788 -11.142 717 HG22 VAL 89 1HG2 VAL 89 -7.353 26.302 -11.724 718 HG23 VAL 89 2HG2 VAL 89 -6.962 24.785 -12.535 719 H ASN 90 H ASN 90 -10.072 27.100 -9.836 720 HA ASN 90 HA ASN 90 -8.600 29.595 -10.367 721 HB2 ASN 90 1HB ASN 90 -10.799 29.071 -8.349 722 HB3 ASN 90 2HB ASN 90 -9.805 30.521 -8.364 723 HD21 ASN 90 2HD2 ASN 90 -12.677 30.268 -8.667 724 HD22 ASN 90 1HD2 ASN 90 -13.072 30.977 -10.195 725 H GLY 91 H GLY 91 -6.565 28.923 -9.839 726 HA2 GLY 91 1HA GLY 91 -4.818 28.389 -8.420 727 HA3 GLY 91 2HA GLY 91 -5.961 28.379 -7.081 728 H ARG 92 H ARG 92 -5.907 26.438 -6.102 729 HA ARG 92 HA ARG 92 -5.835 24.045 -7.796 730 HB2 ARG 92 1HB ARG 92 -5.090 24.578 -4.955 731 HB3 ARG 92 2HB ARG 92 -5.634 22.964 -5.386 732 HG2 ARG 92 1HG ARG 92 -3.255 23.009 -5.492 733 HG3 ARG 92 2HG ARG 92 -3.877 22.903 -7.137 734 HD2 ARG 92 1HD ARG 92 -2.077 24.471 -7.129 735 HD3 ARG 92 2HD ARG 92 -3.583 25.368 -7.329 736 HE ARG 92 HE ARG 92 -2.728 25.157 -4.589 737 HH11 ARG 92 1HH1 ARG 92 -2.391 26.988 -7.568 738 HH12 ARG 92 2HH1 ARG 92 -1.854 28.427 -6.755 739 HH21 ARG 92 1HH2 ARG 92 -2.036 27.041 -3.535 740 HH22 ARG 92 2HH2 ARG 92 -1.661 28.471 -4.461 741 H SER 93 H SER 93 -8.106 26.011 -6.916 742 HA SER 93 HA SER 93 -9.970 23.906 -6.059 743 HB2 SER 93 1HB SER 93 -10.195 26.887 -5.583 744 HB3 SER 93 2HB SER 93 -11.319 25.656 -5.008 745 HG SER 93 HG SER 93 -9.221 26.557 -3.755 746 H ILE 94 H ILE 94 -11.755 23.547 -7.267 747 HA ILE 94 HA ILE 94 -11.985 25.092 -9.751 748 HB ILE 94 HB ILE 94 -13.121 22.377 -9.041 749 HG12 ILE 94 1HG1 ILE 94 -10.865 23.088 -10.921 750 HG13 ILE 94 2HG1 ILE 94 -10.625 22.517 -9.275 751 HG21 ILE 94 1HG2 ILE 94 -13.657 22.208 -11.427 752 HG22 ILE 94 2HG2 ILE 94 -13.096 23.863 -11.665 753 HG23 ILE 94 3HG2 ILE 94 -14.511 23.547 -10.661 754 HD11 ILE 94 3HD1 ILE 94 -10.309 20.717 -10.839 755 HD12 ILE 94 1HD1 ILE 94 -11.911 20.996 -11.526 756 HD13 ILE 94 2HD1 ILE 94 -11.755 20.418 -9.868 757 H ASP 95 H ASP 95 -13.775 26.231 -10.226 758 HA ASP 95 HA ASP 95 -15.968 26.242 -8.258 759 HB2 ASP 95 1HB ASP 95 -14.328 28.309 -8.534 760 HB3 ASP 95 2HB ASP 95 -15.344 28.650 -9.927 761 H ILE 96 H ILE 96 -17.914 27.541 -9.431 762 HA ILE 96 HA ILE 96 -18.274 26.245 -12.057 763 HB ILE 96 HB ILE 96 -20.378 26.411 -9.893 764 HG12 ILE 96 1HG1 ILE 96 -18.902 23.969 -10.890 765 HG13 ILE 96 2HG1 ILE 96 -18.471 24.838 -9.423 766 HG21 ILE 96 1HG2 ILE 96 -21.636 24.885 -11.381 767 HG22 ILE 96 2HG2 ILE 96 -20.375 25.076 -12.600 768 HG23 ILE 96 3HG2 ILE 96 -21.346 26.465 -12.110 769 HD11 ILE 96 3HD1 ILE 96 -20.650 24.333 -8.481 770 HD12 ILE 96 1HD1 ILE 96 -19.778 22.869 -8.933 771 HD13 ILE 96 2HD1 ILE 96 -21.087 23.467 -9.954 772 H GLU 97 H GLU 97 -18.520 27.782 -13.513 773 HA GLU 97 HA GLU 97 -20.045 30.214 -12.820 774 HB2 GLU 97 1HB GLU 97 -17.765 29.783 -14.751 775 HB3 GLU 97 2HB GLU 97 -18.782 31.216 -14.798 776 HG2 GLU 97 1HG GLU 97 -17.200 30.342 -12.395 777 HG3 GLU 97 2HG GLU 97 -16.633 31.506 -13.592 778 H TYR 98 H TYR 98 -20.641 31.205 -15.253 779 HA TYR 98 HA TYR 98 -22.118 29.040 -16.592 780 HB2 TYR 98 1HB TYR 98 -23.141 31.567 -15.404 781 HB3 TYR 98 2HB TYR 98 -23.868 31.026 -16.915 782 HD1 TYR 98 HD1 TYR 98 -23.000 29.752 -13.513 783 HD2 TYR 98 HD2 TYR 98 -25.664 29.557 -16.836 784 HE1 TYR 98 HE1 TYR 98 -24.455 28.226 -12.247 785 HE2 TYR 98 HE2 TYR 98 -27.119 28.027 -15.570 786 HH TYR 98 HH TYR 98 -26.668 27.420 -12.193 787 H TYR 99 H TYR 99 -22.532 29.275 -18.769 788 HA TYR 99 HA TYR 99 -21.509 31.665 -20.135 789 HB2 TYR 99 1HB TYR 99 -20.469 30.326 -21.882 790 HB3 TYR 99 2HB TYR 99 -19.776 29.895 -20.324 791 HD1 TYR 99 HD2 TYR 99 -20.249 27.704 -19.326 792 HD2 TYR 99 HD1 TYR 99 -21.787 28.750 -23.149 793 HE1 TYR 99 HE2 TYR 99 -20.727 25.356 -19.753 794 HE2 TYR 99 HE1 TYR 99 -22.279 26.384 -23.601 795 HH TYR 99 HH TYR 99 -22.108 23.973 -21.136 796 H GLU 100 H GLU 100 -22.460 31.906 -22.322 797 HA GLU 100 HA GLU 100 -25.261 31.399 -22.168 798 HB2 GLU 100 1HB GLU 100 -23.523 32.711 -24.232 799 HB3 GLU 100 2HB GLU 100 -25.225 32.396 -24.544 800 HG2 GLU 100 1HG GLU 100 -25.694 33.653 -22.392 801 HG3 GLU 100 2HG GLU 100 -24.011 34.178 -22.463 802 H CYS 101 H CYS 101 -26.435 29.875 -22.980 803 HA CYS 101 HA CYS 101 -25.527 27.555 -24.240 804 HB2 CYS 101 1HB CYS 101 -27.753 27.941 -23.115 805 HB3 CYS 101 2HB CYS 101 -28.257 28.826 -24.545 806 HA PRO 102 HA PRO 102 -24.648 29.236 -28.325 807 HB2 PRO 102 1HB PRO 102 -24.255 26.773 -29.511 808 HB3 PRO 102 2HB PRO 102 -23.014 27.690 -28.653 809 HG2 PRO 102 1HG PRO 102 -24.659 25.392 -27.719 810 HG3 PRO 102 2HG PRO 102 -22.969 25.783 -27.361 811 HD2 PRO 102 1HD PRO 102 -24.983 26.217 -25.603 812 HD3 PRO 102 2HD PRO 102 -23.537 27.242 -25.675 813 H VAL 103 H VAL 103 -27.037 26.832 -27.523 814 HA VAL 103 HA VAL 103 -28.366 26.668 -30.001 815 HB VAL 103 HB VAL 103 -29.564 26.332 -27.241 816 HG11 VAL 103 1HG1 VAL 103 -30.451 25.274 -29.924 817 HG12 VAL 103 2HG1 VAL 103 -31.263 26.514 -28.967 818 HG13 VAL 103 3HG1 VAL 103 -31.174 24.858 -28.369 819 HG21 VAL 103 3HG2 VAL 103 -28.262 24.287 -29.036 820 HG22 VAL 103 1HG2 VAL 103 -29.065 23.955 -27.501 821 HG23 VAL 103 2HG2 VAL 103 -27.593 24.925 -27.534 822 H LYS 104 H LYS 104 -28.230 29.139 -27.645 823 HA LYS 104 HA LYS 104 -30.701 30.439 -28.086 824 HB2 LYS 104 1HB LYS 104 -29.176 30.836 -26.153 825 HB3 LYS 104 2HB LYS 104 -28.040 31.617 -27.234 826 HG2 LYS 104 1HG LYS 104 -30.842 32.635 -26.876 827 HG3 LYS 104 2HG LYS 104 -29.530 33.101 -25.794 828 HD2 LYS 104 1HD LYS 104 -28.264 33.932 -27.740 829 HD3 LYS 104 2HD LYS 104 -29.630 33.515 -28.775 830 HE2 LYS 104 1HE LYS 104 -29.826 35.821 -28.352 831 HE3 LYS 104 2HE LYS 104 -31.025 35.040 -27.323 832 HZ1 LYS 104 3HZ LYS 104 -29.486 35.239 -25.456 833 HZ2 LYS 104 1HZ LYS 104 -29.839 36.756 -26.128 834 HZ3 LYS 104 2HZ LYS 104 -28.352 36.015 -26.454 835 H ARG 105 H ARG 105 -27.842 30.169 -29.972 836 HA ARG 105 HA ARG 105 -28.771 32.322 -31.740 837 HB2 ARG 105 1HB ARG 105 -26.381 32.973 -32.079 838 HB3 ARG 105 2HB ARG 105 -26.991 33.294 -30.463 839 HG2 ARG 105 1HG ARG 105 -25.886 31.254 -29.656 840 HG3 ARG 105 2HG ARG 105 -25.245 30.977 -31.276 841 HD2 ARG 105 1HD ARG 105 -23.574 32.027 -29.846 842 HD3 ARG 105 2HD ARG 105 -24.044 33.102 -31.161 843 HE ARG 105 HE ARG 105 -25.428 33.457 -28.620 844 HH11 ARG 105 1HH1 ARG 105 -22.836 34.506 -30.742 845 HH12 ARG 105 2HH1 ARG 105 -22.749 36.096 -30.041 846 HH21 ARG 105 1HH2 ARG 105 -25.298 35.543 -27.706 847 HH22 ARG 105 2HH2 ARG 105 -24.128 36.675 -28.313 848 H LYS 106 H LYS 106 -29.132 29.483 -31.956 849 HA LYS 106 HA LYS 106 -27.365 28.667 -34.108 850 HB2 LYS 106 1HB LYS 106 -29.802 27.355 -32.894 851 HB3 LYS 106 2HB LYS 106 -28.883 26.665 -34.225 852 HG2 LYS 106 1HG LYS 106 -26.873 26.693 -32.751 853 HG3 LYS 106 2HG LYS 106 -27.923 27.186 -31.424 854 HD2 LYS 106 1HD LYS 106 -27.766 24.870 -31.179 855 HD3 LYS 106 2HD LYS 106 -29.308 25.104 -31.999 856 HE2 LYS 106 1HE LYS 106 -26.726 24.445 -33.411 857 HE3 LYS 106 2HE LYS 106 -27.903 23.238 -32.902 858 HZ1 LYS 106 3HZ LYS 106 -29.554 24.365 -34.316 859 HZ2 LYS 106 1HZ LYS 106 -28.235 23.771 -35.203 860 HZ3 LYS 106 2HZ LYS 106 -28.346 25.425 -34.866
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