NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
651081 | 6vg7 | 30706 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 HA MET 21 HA MET 21 -8.087 -11.858 3.572 2 HB2 MET 21 1HB MET 21 -7.368 -12.203 5.890 3 HB3 MET 21 2HB MET 21 -5.717 -12.460 5.356 4 HG2 MET 21 1HG MET 21 -5.617 -10.161 4.549 5 HG3 MET 21 2HG MET 21 -7.277 -9.903 5.086 6 HE1 MET 21 1HE MET 21 -4.617 -12.079 7.041 7 HE2 MET 21 2HE MET 21 -3.799 -10.832 7.983 8 HE3 MET 21 3HE MET 21 -3.649 -10.852 6.227 9 H THR 22 H THR 22 -7.556 -11.064 1.615 10 HA THR 22 HA THR 22 -4.958 -11.574 0.463 11 HB THR 22 HB THR 22 -6.987 -9.667 -0.672 12 HG1 THR 22 HG1 THR 22 -7.023 -12.513 -0.905 13 HG21 THR 22 1HG2 THR 22 -4.823 -9.878 -1.807 14 HG22 THR 22 2HG2 THR 22 -6.120 -10.542 -2.801 15 HG23 THR 22 3HG2 THR 22 -5.045 -11.624 -1.917 16 H LEU 23 H LEU 23 -3.230 -10.328 0.813 17 HA LEU 23 HA LEU 23 -3.644 -7.655 1.919 18 HB2 LEU 23 1HB LEU 23 -1.168 -9.380 1.835 19 HB3 LEU 23 2HB LEU 23 -1.262 -7.792 2.572 20 HG LEU 23 HG LEU 23 -2.795 -10.235 3.472 21 HD11 LEU 23 1HD1 LEU 23 -0.465 -8.798 4.734 22 HD12 LEU 23 2HD1 LEU 23 -0.406 -10.378 3.956 23 HD13 LEU 23 3HD1 LEU 23 -1.348 -10.157 5.429 24 HD21 LEU 23 1HD2 LEU 23 -4.063 -8.216 3.889 25 HD22 LEU 23 2HD2 LEU 23 -2.652 -7.449 4.616 26 HD23 LEU 23 3HD2 LEU 23 -3.406 -8.833 5.405 27 H PHE 24 H PHE 24 -3.336 -5.922 0.730 28 HA PHE 24 HA PHE 24 -1.813 -6.175 -1.786 29 HB2 PHE 24 1HB PHE 24 -4.005 -4.191 -1.139 30 HB3 PHE 24 2HB PHE 24 -3.162 -4.341 -2.671 31 HD1 PHE 24 HD1 PHE 24 -5.450 -6.108 -0.363 32 HD2 PHE 24 HD2 PHE 24 -3.943 -5.787 -4.326 33 HE1 PHE 24 HE1 PHE 24 -7.182 -7.661 -1.144 34 HE2 PHE 24 HE2 PHE 24 -5.669 -7.344 -5.112 35 HZ PHE 24 HZ PHE 24 -7.295 -8.282 -3.523 36 H VAL 25 H VAL 25 -0.638 -4.242 -2.453 37 HA VAL 25 HA VAL 25 -0.367 -2.151 -0.479 38 HB VAL 25 HB VAL 25 1.402 -3.465 0.344 39 HG11 VAL 25 1HG1 VAL 25 3.163 -4.444 -1.009 40 HG12 VAL 25 2HG1 VAL 25 2.399 -3.824 -2.472 41 HG13 VAL 25 3HG1 VAL 25 1.582 -5.050 -1.505 42 HG21 VAL 25 1HG2 VAL 25 2.049 -1.182 0.179 43 HG22 VAL 25 2HG2 VAL 25 2.443 -1.350 -1.531 44 HG23 VAL 25 3HG2 VAL 25 3.443 -2.148 -0.311 45 H LEU 26 H LEU 26 -0.184 -0.254 -1.344 46 HA LEU 26 HA LEU 26 0.531 -0.038 -4.191 47 HB2 LEU 26 1HB LEU 26 -1.161 1.766 -2.460 48 HB3 LEU 26 2HB LEU 26 -0.639 2.160 -4.078 49 HG LEU 26 HG LEU 26 -2.826 1.455 -4.385 50 HD11 LEU 26 1HD1 LEU 26 -1.189 -1.037 -4.778 51 HD12 LEU 26 2HD1 LEU 26 -1.317 0.311 -5.908 52 HD13 LEU 26 3HD1 LEU 26 -2.736 -0.672 -5.541 53 HD21 LEU 26 1HD2 LEU 26 -3.820 -0.515 -3.339 54 HD22 LEU 26 2HD2 LEU 26 -3.243 0.644 -2.141 55 HD23 LEU 26 3HD2 LEU 26 -2.312 -0.815 -2.475 56 H ILE 27 H ILE 27 1.723 1.991 -4.743 57 HA ILE 27 HA ILE 27 3.157 3.199 -2.535 58 HB ILE 27 HB ILE 27 4.430 1.144 -2.973 59 HG12 ILE 27 1HG1 ILE 27 5.943 3.583 -3.928 60 HG13 ILE 27 2HG1 ILE 27 5.599 3.221 -2.239 61 HG21 ILE 27 1HG2 ILE 27 4.871 2.266 -5.731 62 HG22 ILE 27 2HG2 ILE 27 3.864 0.871 -5.335 63 HG23 ILE 27 3HG2 ILE 27 5.609 0.808 -5.067 64 HD11 ILE 27 1HD1 ILE 27 7.272 1.566 -4.118 65 HD12 ILE 27 2HD1 ILE 27 6.885 1.135 -2.452 66 HD13 ILE 27 3HD1 ILE 27 7.857 2.566 -2.788 67 H LEU 28 H LEU 28 3.311 5.321 -2.942 68 HA LEU 28 HA LEU 28 3.973 6.117 -5.715 69 HB2 LEU 28 1HB LEU 28 2.807 7.854 -3.529 70 HB3 LEU 28 2HB LEU 28 3.170 8.361 -5.164 71 HG LEU 28 HG LEU 28 0.987 6.483 -4.285 72 HD11 LEU 28 1HD1 LEU 28 0.528 8.840 -3.921 73 HD12 LEU 28 2HD1 LEU 28 -0.465 8.211 -5.235 74 HD13 LEU 28 3HD1 LEU 28 0.951 9.198 -5.596 75 HD21 LEU 28 1HD2 LEU 28 0.378 6.623 -6.759 76 HD22 LEU 28 2HD2 LEU 28 1.709 5.560 -6.305 77 HD23 LEU 28 3HD2 LEU 28 2.047 7.138 -7.008 78 H SER 29 H SER 29 6.109 5.455 -5.123 79 HA SER 29 HA SER 29 7.606 7.617 -3.905 80 HB2 SER 29 1HB SER 29 7.769 4.758 -2.938 81 HB3 SER 29 2HB SER 29 8.867 6.044 -2.458 82 HG SER 29 HG SER 29 6.333 6.847 -2.124 83 H ASN 30 H ASN 30 8.511 7.979 -6.033 84 HA ASN 30 HA ASN 30 9.710 5.617 -7.245 85 HB2 ASN 30 1HB ASN 30 9.301 8.434 -8.235 86 HB3 ASN 30 2HB ASN 30 10.269 7.259 -9.119 87 HD21 ASN 30 1HD2 ASN 30 7.066 8.126 -8.067 88 HD22 ASN 30 2HD2 ASN 30 6.221 7.040 -9.109 89 H ASP 31 H ASP 31 11.260 5.329 -5.608 90 HA ASP 31 HA ASP 31 13.724 6.705 -6.426 91 HB2 ASP 31 1HB ASP 31 13.465 7.065 -4.058 92 HB3 ASP 31 2HB ASP 31 13.094 5.374 -3.782 93 H LYS 32 H LYS 32 15.332 5.350 -7.301 94 HA LYS 32 HA LYS 32 14.379 3.043 -8.550 95 HB2 LYS 32 1HB LYS 32 17.248 3.832 -8.023 96 HB3 LYS 32 2HB LYS 32 16.743 2.566 -9.131 97 HG2 LYS 32 1HG LYS 32 16.115 5.499 -9.363 98 HG3 LYS 32 2HG LYS 32 17.255 4.582 -10.348 99 HD2 LYS 32 1HD LYS 32 15.387 3.191 -11.163 100 HD3 LYS 32 2HD LYS 32 14.266 4.177 -10.223 101 HE2 LYS 32 1HE LYS 32 16.038 5.145 -12.462 102 HE3 LYS 32 2HE LYS 32 14.301 4.869 -12.560 103 HZ1 LYS 32 1HZ LYS 32 14.784 7.200 -12.246 104 HZ2 LYS 32 2HZ LYS 32 15.651 6.871 -10.834 105 HZ3 LYS 32 3HZ LYS 32 13.987 6.594 -10.884 106 H LYS 33 H LYS 33 16.655 3.208 -5.787 107 HA LYS 33 HA LYS 33 16.738 0.355 -5.584 108 HB2 LYS 33 1HB LYS 33 17.886 2.594 -3.973 109 HB3 LYS 33 2HB LYS 33 17.865 0.972 -3.298 110 HG2 LYS 33 1HG LYS 33 19.977 1.258 -4.306 111 HG3 LYS 33 2HG LYS 33 19.055 0.206 -5.376 112 HD2 LYS 33 1HD LYS 33 20.114 1.726 -6.806 113 HD3 LYS 33 2HD LYS 33 18.465 2.333 -6.665 114 HE2 LYS 33 1HE LYS 33 19.222 3.930 -4.954 115 HE3 LYS 33 2HE LYS 33 20.870 3.337 -5.146 116 HZ1 LYS 33 1HZ LYS 33 19.238 4.671 -7.234 117 HZ2 LYS 33 2HZ LYS 33 20.794 4.052 -7.470 118 HZ3 LYS 33 3HZ LYS 33 20.548 5.346 -6.409 119 H LEU 34 H LEU 34 14.976 2.908 -3.918 120 HA LEU 34 HA LEU 34 13.878 1.416 -1.828 121 HB2 LEU 34 1HB LEU 34 13.583 3.795 -1.904 122 HB3 LEU 34 2HB LEU 34 12.746 3.684 -3.437 123 HG LEU 34 HG LEU 34 10.852 2.596 -2.351 124 HD11 LEU 34 1HD1 LEU 34 12.387 2.992 0.194 125 HD12 LEU 34 2HD1 LEU 34 11.999 1.449 -0.576 126 HD13 LEU 34 3HD1 LEU 34 10.709 2.463 0.069 127 HD21 LEU 34 1HD2 LEU 34 11.694 5.153 -1.002 128 HD22 LEU 34 2HD2 LEU 34 10.050 4.519 -1.076 129 HD23 LEU 34 3HD2 LEU 34 10.870 5.022 -2.556 130 H ILE 35 H ILE 35 12.617 1.954 -5.105 131 HA ILE 35 HA ILE 35 10.301 0.414 -4.828 132 HB ILE 35 HB ILE 35 11.932 1.131 -7.265 133 HG12 ILE 35 1HG1 ILE 35 9.265 2.110 -6.223 134 HG13 ILE 35 2HG1 ILE 35 10.793 2.977 -6.114 135 HG21 ILE 35 1HG2 ILE 35 9.247 -0.238 -7.222 136 HG22 ILE 35 2HG2 ILE 35 10.771 -0.956 -7.742 137 HG23 ILE 35 3HG2 ILE 35 10.073 0.384 -8.651 138 HD11 ILE 35 1HD1 ILE 35 9.417 2.225 -8.683 139 HD12 ILE 35 2HD1 ILE 35 10.881 3.193 -8.515 140 HD13 ILE 35 3HD1 ILE 35 9.343 3.807 -7.912 141 H GLU 36 H GLU 36 13.572 -0.475 -5.834 142 HA GLU 36 HA GLU 36 13.126 -3.145 -6.513 143 HB2 GLU 36 1HB GLU 36 15.517 -1.778 -5.280 144 HB3 GLU 36 2HB GLU 36 15.533 -3.467 -5.768 145 HG2 GLU 36 1HG GLU 36 14.861 -1.229 -7.645 146 HG3 GLU 36 2HG GLU 36 16.499 -1.833 -7.411 147 H GLU 37 H GLU 37 14.215 -1.825 -3.391 148 HA GLU 37 HA GLU 37 14.129 -4.234 -1.970 149 HB2 GLU 37 1HB GLU 37 13.836 -1.387 -1.011 150 HB3 GLU 37 2HB GLU 37 14.034 -2.767 0.056 151 HG2 GLU 37 1HG GLU 37 16.006 -1.831 -2.014 152 HG3 GLU 37 2HG GLU 37 16.135 -1.600 -0.272 153 H ALA 38 H ALA 38 11.673 -1.709 -2.358 154 HA ALA 38 HA ALA 38 9.808 -2.738 -0.529 155 HB1 ALA 38 1HB ALA 38 9.266 -1.103 -3.005 156 HB2 ALA 38 2HB ALA 38 9.711 -0.457 -1.426 157 HB3 ALA 38 3HB ALA 38 8.180 -1.310 -1.631 158 H ARG 39 H ARG 39 10.084 -3.221 -4.064 159 HA ARG 39 HA ARG 39 7.828 -4.928 -4.215 160 HB2 ARG 39 1HB ARG 39 8.808 -3.850 -6.217 161 HB3 ARG 39 2HB ARG 39 10.220 -4.890 -6.061 162 HG2 ARG 39 1HG ARG 39 8.478 -6.844 -6.169 163 HG3 ARG 39 2HG ARG 39 7.429 -5.598 -6.864 164 HD2 ARG 39 1HD ARG 39 9.044 -5.132 -8.602 165 HD3 ARG 39 2HD ARG 39 10.171 -6.289 -7.902 166 HE ARG 39 HE ARG 39 8.369 -7.996 -8.411 167 HH11 ARG 39 1HH1 ARG 39 8.805 -5.073 -10.296 168 HH12 ARG 39 2HH1 ARG 39 8.178 -5.765 -11.756 169 HH21 ARG 39 1HH2 ARG 39 7.545 -8.909 -10.337 170 HH22 ARG 39 2HH2 ARG 39 7.459 -7.949 -11.779 171 H LYS 40 H LYS 40 11.324 -5.612 -4.025 172 HA LYS 40 HA LYS 40 11.193 -8.373 -4.242 173 HB2 LYS 40 1HB LYS 40 13.115 -6.648 -2.684 174 HB3 LYS 40 2HB LYS 40 13.334 -8.375 -2.914 175 HG2 LYS 40 1HG LYS 40 13.422 -8.045 -5.332 176 HG3 LYS 40 2HG LYS 40 13.213 -6.307 -5.097 177 HD2 LYS 40 1HD LYS 40 15.293 -6.181 -3.880 178 HD3 LYS 40 2HD LYS 40 15.480 -7.933 -3.956 179 HE2 LYS 40 1HE LYS 40 15.528 -7.733 -6.448 180 HE3 LYS 40 2HE LYS 40 15.557 -5.980 -6.250 181 HZ1 LYS 40 1HZ LYS 40 17.586 -7.862 -5.172 182 HZ2 LYS 40 2HZ LYS 40 17.620 -6.179 -5.033 183 HZ3 LYS 40 3HZ LYS 40 17.776 -6.902 -6.550 184 H MET 41 H MET 41 10.801 -6.339 -1.396 185 HA MET 41 HA MET 41 10.706 -8.420 0.500 186 HB2 MET 41 1HB MET 41 11.046 -5.886 0.796 187 HB3 MET 41 2HB MET 41 9.292 -5.780 0.745 188 HG2 MET 41 1HG MET 41 10.083 -5.815 3.000 189 HG3 MET 41 2HG MET 41 9.146 -7.270 2.665 190 HE1 MET 41 1HE MET 41 11.828 -8.575 5.193 191 HE2 MET 41 2HE MET 41 10.109 -8.449 4.824 192 HE3 MET 41 3HE MET 41 11.038 -6.999 5.206 193 H ALA 42 H ALA 42 8.115 -6.524 -1.048 194 HA ALA 42 HA ALA 42 6.012 -8.030 0.175 195 HB1 ALA 42 1HB ALA 42 4.532 -6.710 -1.226 196 HB2 ALA 42 2HB ALA 42 5.909 -6.132 -2.165 197 HB3 ALA 42 3HB ALA 42 5.748 -5.685 -0.466 198 H GLU 43 H GLU 43 7.818 -8.319 -2.777 199 HA GLU 43 HA GLU 43 5.980 -9.843 -4.267 200 HB2 GLU 43 1HB GLU 43 7.936 -8.720 -5.259 201 HB3 GLU 43 2HB GLU 43 8.988 -9.876 -4.453 202 HG2 GLU 43 1HG GLU 43 8.026 -11.689 -5.716 203 HG3 GLU 43 2HG GLU 43 6.873 -10.589 -6.468 204 H LYS 44 H LYS 44 8.696 -10.733 -2.168 205 HA LYS 44 HA LYS 44 8.182 -13.553 -2.405 206 HB2 LYS 44 1HB LYS 44 10.103 -11.881 -0.831 207 HB3 LYS 44 2HB LYS 44 9.842 -13.556 -0.367 208 HG2 LYS 44 1HG LYS 44 11.764 -13.432 -1.790 209 HG3 LYS 44 2HG LYS 44 10.467 -14.250 -2.658 210 HD2 LYS 44 1HD LYS 44 9.955 -12.120 -3.816 211 HD3 LYS 44 2HD LYS 44 11.333 -11.377 -3.001 212 HE2 LYS 44 1HE LYS 44 12.808 -13.068 -4.042 213 HE3 LYS 44 2HE LYS 44 11.418 -13.711 -4.912 214 HZ1 LYS 44 1HZ LYS 44 11.158 -11.529 -5.983 215 HZ2 LYS 44 2HZ LYS 44 12.664 -12.229 -6.315 216 HZ3 LYS 44 3HZ LYS 44 12.550 -10.980 -5.185 217 H ALA 45 H ALA 45 7.017 -10.992 -0.473 218 HA ALA 45 HA ALA 45 5.912 -12.710 1.572 219 HB1 ALA 45 1HB ALA 45 6.533 -10.416 2.128 220 HB2 ALA 45 2HB ALA 45 4.808 -10.681 2.381 221 HB3 ALA 45 3HB ALA 45 5.368 -9.810 0.954 222 H ASN 46 H ASN 46 5.273 -12.174 -1.579 223 HA ASN 46 HA ASN 46 3.603 -12.666 -3.000 224 HB2 ASN 46 1HB ASN 46 3.588 -14.776 -1.619 225 HB3 ASN 46 2HB ASN 46 2.260 -14.084 -0.695 226 HD21 ASN 46 1HD2 ASN 46 0.862 -15.734 -1.327 227 HD22 ASN 46 2HD2 ASN 46 0.207 -15.818 -2.924 228 H LEU 47 H LEU 47 3.491 -10.199 -1.564 229 HA LEU 47 HA LEU 47 0.654 -9.709 -1.143 230 HB2 LEU 47 1HB LEU 47 2.844 -7.654 -1.314 231 HB3 LEU 47 2HB LEU 47 1.262 -7.474 -0.594 232 HG LEU 47 HG LEU 47 3.602 -9.019 0.489 233 HD11 LEU 47 1HD1 LEU 47 3.648 -6.625 0.852 234 HD12 LEU 47 2HD1 LEU 47 3.338 -7.473 2.368 235 HD13 LEU 47 3HD1 LEU 47 2.014 -6.679 1.513 236 HD21 LEU 47 1HD2 LEU 47 0.797 -8.901 1.580 237 HD22 LEU 47 2HD2 LEU 47 2.191 -9.647 2.360 238 HD23 LEU 47 3HD2 LEU 47 1.560 -10.315 0.856 239 H ILE 48 H ILE 48 -0.532 -8.193 -2.435 240 HA ILE 48 HA ILE 48 0.356 -8.212 -5.199 241 HB ILE 48 HB ILE 48 -2.271 -7.256 -4.048 242 HG12 ILE 48 1HG1 ILE 48 -1.492 -9.837 -5.431 243 HG13 ILE 48 2HG1 ILE 48 -1.946 -9.656 -3.740 244 HG21 ILE 48 1HG2 ILE 48 -1.748 -6.159 -6.160 245 HG22 ILE 48 2HG2 ILE 48 -3.058 -7.319 -6.378 246 HG23 ILE 48 3HG2 ILE 48 -1.425 -7.722 -6.910 247 HD11 ILE 48 1HD1 ILE 48 -3.738 -9.205 -6.114 248 HD12 ILE 48 2HD1 ILE 48 -4.198 -9.006 -4.424 249 HD13 ILE 48 3HD1 ILE 48 -3.758 -10.600 -5.034 250 H LEU 49 H LEU 49 1.976 -6.773 -5.282 251 HA LEU 49 HA LEU 49 1.584 -4.057 -4.312 252 HB2 LEU 49 1HB LEU 49 3.709 -5.065 -3.802 253 HB3 LEU 49 2HB LEU 49 3.961 -5.498 -5.481 254 HG LEU 49 HG LEU 49 4.073 -3.049 -6.022 255 HD11 LEU 49 1HD1 LEU 49 4.207 -2.757 -3.029 256 HD12 LEU 49 2HD1 LEU 49 2.878 -2.213 -4.056 257 HD13 LEU 49 3HD1 LEU 49 4.475 -1.481 -4.216 258 HD21 LEU 49 1HD2 LEU 49 6.341 -2.775 -5.204 259 HD22 LEU 49 2HD2 LEU 49 6.073 -4.429 -5.757 260 HD23 LEU 49 3HD2 LEU 49 6.086 -4.067 -4.031 261 H ILE 50 H ILE 50 0.663 -2.632 -5.599 262 HA ILE 50 HA ILE 50 1.089 -2.895 -8.506 263 HB ILE 50 HB ILE 50 -1.082 -1.309 -7.124 264 HG12 ILE 50 1HG1 ILE 50 -1.304 -3.994 -8.508 265 HG13 ILE 50 2HG1 ILE 50 -1.307 -3.768 -6.762 266 HG21 ILE 50 1HG2 ILE 50 -0.691 -2.082 -10.012 267 HG22 ILE 50 2HG2 ILE 50 -0.487 -0.471 -9.330 268 HG23 ILE 50 3HG2 ILE 50 -2.084 -1.218 -9.363 269 HD11 ILE 50 1HD1 ILE 50 -3.349 -2.671 -8.681 270 HD12 ILE 50 2HD1 ILE 50 -3.359 -2.472 -6.929 271 HD13 ILE 50 3HD1 ILE 50 -3.554 -4.076 -7.636 272 H THR 51 H THR 51 2.750 -1.688 -9.094 273 HA THR 51 HA THR 51 3.391 0.745 -7.655 274 HB THR 51 HB THR 51 5.371 0.791 -9.215 275 HG1 THR 51 HG1 THR 51 4.007 -0.808 -10.654 276 HG21 THR 51 1HG2 THR 51 5.517 -0.195 -6.974 277 HG22 THR 51 2HG2 THR 51 6.528 -1.065 -8.126 278 HG23 THR 51 3HG2 THR 51 4.981 -1.745 -7.623 279 H VAL 52 H VAL 52 2.374 2.547 -8.204 280 HA VAL 52 HA VAL 52 2.042 3.165 -11.068 281 HB VAL 52 HB VAL 52 0.019 4.466 -10.509 282 HG11 VAL 52 1HG1 VAL 52 -1.513 2.592 -10.067 283 HG12 VAL 52 2HG1 VAL 52 -0.132 1.585 -9.630 284 HG13 VAL 52 3HG1 VAL 52 -0.295 2.188 -11.280 285 HG21 VAL 52 1HG2 VAL 52 0.340 3.285 -7.754 286 HG22 VAL 52 2HG2 VAL 52 -1.052 4.204 -8.324 287 HG23 VAL 52 3HG2 VAL 52 0.522 4.984 -8.191 288 H GLY 53 H GLY 53 1.939 5.597 -11.438 289 HA2 GLY 53 1HA GLY 53 3.238 7.087 -9.256 290 HA3 GLY 53 2HA GLY 53 3.908 7.159 -10.878 291 H ASP 54 H ASP 54 1.403 8.141 -8.775 292 HA ASP 54 HA ASP 54 0.983 10.657 -9.449 293 HB2 ASP 54 1HB ASP 54 0.451 9.931 -11.803 294 HB3 ASP 54 2HB ASP 54 -0.960 9.091 -11.171 295 H GLU 55 H GLU 55 -0.901 11.545 -8.356 296 HA GLU 55 HA GLU 55 -1.750 9.905 -6.198 297 HB2 GLU 55 1HB GLU 55 -1.551 12.590 -6.597 298 HB3 GLU 55 2HB GLU 55 -3.288 12.364 -6.754 299 HG2 GLU 55 1HG GLU 55 -1.731 11.323 -4.409 300 HG3 GLU 55 2HG GLU 55 -2.408 12.948 -4.456 301 H GLU 56 H GLU 56 -3.258 11.002 -9.188 302 HA GLU 56 HA GLU 56 -5.840 9.947 -8.574 303 HB2 GLU 56 1HB GLU 56 -4.625 10.660 -11.250 304 HB3 GLU 56 2HB GLU 56 -6.332 10.365 -10.945 305 HG2 GLU 56 1HG GLU 56 -4.739 12.560 -9.642 306 HG3 GLU 56 2HG GLU 56 -5.702 12.764 -11.104 307 H GLU 57 H GLU 57 -3.031 8.808 -10.393 308 HA GLU 57 HA GLU 57 -4.135 6.406 -11.341 309 HB2 GLU 57 1HB GLU 57 -1.301 7.224 -10.747 310 HB3 GLU 57 2HB GLU 57 -1.696 5.625 -11.358 311 HG2 GLU 57 1HG GLU 57 -2.369 8.217 -12.729 312 HG3 GLU 57 2HG GLU 57 -1.008 7.170 -13.130 313 H LEU 58 H LEU 58 -2.738 7.271 -8.253 314 HA LEU 58 HA LEU 58 -2.444 4.708 -7.165 315 HB2 LEU 58 1HB LEU 58 -1.586 6.768 -6.108 316 HB3 LEU 58 2HB LEU 58 -3.231 7.253 -5.744 317 HG LEU 58 HG LEU 58 -3.451 5.178 -4.349 318 HD11 LEU 58 1HD1 LEU 58 -1.372 4.088 -3.625 319 HD12 LEU 58 2HD1 LEU 58 -0.484 5.018 -4.830 320 HD13 LEU 58 3HD1 LEU 58 -1.699 3.847 -5.339 321 HD21 LEU 58 1HD2 LEU 58 -3.025 7.348 -3.336 322 HD22 LEU 58 2HD2 LEU 58 -1.290 7.120 -3.552 323 HD23 LEU 58 3HD2 LEU 58 -2.189 6.066 -2.459 324 H LYS 59 H LYS 59 -5.213 6.856 -7.391 325 HA LYS 59 HA LYS 59 -6.918 5.342 -5.726 326 HB2 LYS 59 1HB LYS 59 -7.731 7.257 -7.904 327 HB3 LYS 59 2HB LYS 59 -8.684 6.781 -6.501 328 HG2 LYS 59 1HG LYS 59 -6.993 7.826 -5.041 329 HG3 LYS 59 2HG LYS 59 -6.131 8.374 -6.478 330 HD2 LYS 59 1HD LYS 59 -8.175 9.605 -7.161 331 HD3 LYS 59 2HD LYS 59 -8.915 9.150 -5.623 332 HE2 LYS 59 1HE LYS 59 -6.522 10.903 -6.103 333 HE3 LYS 59 2HE LYS 59 -8.044 11.326 -5.323 334 HZ1 LYS 59 1HZ LYS 59 -5.962 9.500 -4.255 335 HZ2 LYS 59 2HZ LYS 59 -7.459 9.784 -3.518 336 HZ3 LYS 59 3HZ LYS 59 -6.340 11.043 -3.679 337 H LYS 60 H LYS 60 -5.892 4.960 -8.922 338 HA LYS 60 HA LYS 60 -8.151 3.334 -9.729 339 HB2 LYS 60 1HB LYS 60 -5.568 3.597 -11.230 340 HB3 LYS 60 2HB LYS 60 -7.189 3.337 -11.863 341 HG2 LYS 60 1HG LYS 60 -6.638 5.847 -10.373 342 HG3 LYS 60 2HG LYS 60 -6.000 5.680 -12.014 343 HD2 LYS 60 1HD LYS 60 -8.111 6.779 -12.166 344 HD3 LYS 60 2HD LYS 60 -8.325 5.141 -12.771 345 HE2 LYS 60 1HE LYS 60 -9.384 4.461 -10.736 346 HE3 LYS 60 2HE LYS 60 -8.998 5.998 -9.963 347 HZ1 LYS 60 1HZ LYS 60 -10.794 5.666 -12.305 348 HZ2 LYS 60 2HZ LYS 60 -10.463 7.116 -11.502 349 HZ3 LYS 60 3HZ LYS 60 -11.306 5.885 -10.711 350 H ALA 61 H ALA 61 -4.834 2.985 -8.672 351 HA ALA 61 HA ALA 61 -4.686 0.153 -9.003 352 HB1 ALA 61 1HB ALA 61 -2.676 1.544 -8.887 353 HB2 ALA 61 2HB ALA 61 -2.670 0.319 -7.620 354 HB3 ALA 61 3HB ALA 61 -3.074 1.991 -7.229 355 H ILE 62 H ILE 62 -5.324 2.338 -6.305 356 HA ILE 62 HA ILE 62 -5.871 0.466 -4.306 357 HB ILE 62 HB ILE 62 -7.094 3.196 -4.764 358 HG12 ILE 62 1HG1 ILE 62 -4.938 2.292 -2.844 359 HG13 ILE 62 2HG1 ILE 62 -4.637 3.113 -4.371 360 HG21 ILE 62 1HG2 ILE 62 -7.768 3.126 -2.402 361 HG22 ILE 62 2HG2 ILE 62 -7.250 1.443 -2.318 362 HG23 ILE 62 3HG2 ILE 62 -8.588 1.904 -3.370 363 HD11 ILE 62 1HD1 ILE 62 -4.504 4.648 -2.499 364 HD12 ILE 62 2HD1 ILE 62 -6.155 4.242 -2.032 365 HD13 ILE 62 3HD1 ILE 62 -5.848 5.066 -3.560 366 H LYS 63 H LYS 63 -8.031 1.876 -6.746 367 HA LYS 63 HA LYS 63 -10.386 0.562 -5.967 368 HB2 LYS 63 1HB LYS 63 -10.370 2.438 -7.545 369 HB3 LYS 63 2HB LYS 63 -9.522 1.449 -8.726 370 HG2 LYS 63 1HG LYS 63 -11.442 -0.061 -8.835 371 HG3 LYS 63 2HG LYS 63 -12.292 0.951 -7.667 372 HD2 LYS 63 1HD LYS 63 -12.189 2.833 -9.222 373 HD3 LYS 63 2HD LYS 63 -11.335 1.822 -10.390 374 HE2 LYS 63 1HE LYS 63 -13.719 1.991 -10.919 375 HE3 LYS 63 2HE LYS 63 -13.253 0.335 -10.532 376 HZ1 LYS 63 1HZ LYS 63 -14.598 2.238 -8.693 377 HZ2 LYS 63 2HZ LYS 63 -14.129 0.660 -8.297 378 HZ3 LYS 63 3HZ LYS 63 -15.322 0.918 -9.465 379 H LYS 64 H LYS 64 -7.825 -0.369 -8.216 380 HA LYS 64 HA LYS 64 -8.984 -2.753 -9.142 381 HB2 LYS 64 1HB LYS 64 -7.000 -1.553 -10.127 382 HB3 LYS 64 2HB LYS 64 -6.033 -2.195 -8.808 383 HG2 LYS 64 1HG LYS 64 -6.572 -4.477 -9.554 384 HG3 LYS 64 2HG LYS 64 -7.476 -3.799 -10.908 385 HD2 LYS 64 1HD LYS 64 -4.529 -3.453 -10.366 386 HD3 LYS 64 2HD LYS 64 -5.251 -4.457 -11.624 387 HE2 LYS 64 1HE LYS 64 -6.213 -2.448 -12.658 388 HE3 LYS 64 2HE LYS 64 -5.468 -1.453 -11.408 389 HZ1 LYS 64 1HZ LYS 64 -4.052 -3.103 -13.425 390 HZ2 LYS 64 2HZ LYS 64 -3.292 -2.263 -12.171 391 HZ3 LYS 64 3HZ LYS 64 -4.123 -1.412 -13.374 392 H ALA 65 H ALA 65 -6.914 -2.042 -6.374 393 HA ALA 65 HA ALA 65 -6.573 -4.662 -5.431 394 HB1 ALA 65 1HB ALA 65 -6.050 -3.630 -3.280 395 HB2 ALA 65 2HB ALA 65 -6.728 -2.101 -3.840 396 HB3 ALA 65 3HB ALA 65 -5.277 -2.754 -4.604 397 H ASP 66 H ASP 66 -9.075 -2.244 -4.777 398 HA ASP 66 HA ASP 66 -10.619 -3.712 -2.961 399 HB2 ASP 66 1HB ASP 66 -11.020 -1.345 -3.333 400 HB3 ASP 66 2HB ASP 66 -11.463 -1.648 -5.007 401 H ASP 67 H ASP 67 -10.744 -3.550 -6.498 402 HA ASP 67 HA ASP 67 -12.940 -5.269 -6.853 403 HB2 ASP 67 1HB ASP 67 -10.658 -4.485 -8.649 404 HB3 ASP 67 2HB ASP 67 -11.862 -5.659 -9.168 405 H ILE 68 H ILE 68 -9.443 -5.976 -6.875 406 HA ILE 68 HA ILE 68 -9.710 -8.724 -7.448 407 HB ILE 68 HB ILE 68 -7.494 -7.310 -5.959 408 HG12 ILE 68 1HG1 ILE 68 -7.689 -8.138 -8.864 409 HG13 ILE 68 2HG1 ILE 68 -7.906 -6.495 -8.272 410 HG21 ILE 68 1HG2 ILE 68 -6.111 -9.251 -6.550 411 HG22 ILE 68 2HG2 ILE 68 -7.528 -10.045 -7.232 412 HG23 ILE 68 3HG2 ILE 68 -7.459 -9.701 -5.504 413 HD11 ILE 68 1HD1 ILE 68 -5.383 -8.123 -8.058 414 HD12 ILE 68 2HD1 ILE 68 -5.600 -6.469 -7.486 415 HD13 ILE 68 3HD1 ILE 68 -5.688 -6.825 -9.211 416 H ALA 69 H ALA 69 -9.478 -6.979 -4.368 417 HA ALA 69 HA ALA 69 -9.519 -9.256 -2.698 418 HB1 ALA 69 1HB ALA 69 -10.546 -6.497 -2.045 419 HB2 ALA 69 2HB ALA 69 -8.851 -6.975 -1.973 420 HB3 ALA 69 3HB ALA 69 -10.028 -7.736 -0.901 421 H LYS 70 H LYS 70 -12.047 -7.207 -4.013 422 HA LYS 70 HA LYS 70 -14.220 -7.998 -2.488 423 HB2 LYS 70 1HB LYS 70 -13.931 -6.199 -4.386 424 HB3 LYS 70 2HB LYS 70 -14.501 -7.496 -5.422 425 HG2 LYS 70 1HG LYS 70 -16.372 -6.151 -4.856 426 HG3 LYS 70 2HG LYS 70 -16.522 -7.670 -3.970 427 HD2 LYS 70 1HD LYS 70 -17.062 -5.708 -2.578 428 HD3 LYS 70 2HD LYS 70 -15.686 -6.617 -1.956 429 HE2 LYS 70 1HE LYS 70 -14.147 -5.001 -2.911 430 HE3 LYS 70 2HE LYS 70 -15.493 -4.117 -3.637 431 HZ1 LYS 70 1HZ LYS 70 -15.009 -4.503 -0.741 432 HZ2 LYS 70 2HZ LYS 70 -16.296 -3.634 -1.416 433 HZ3 LYS 70 3HZ LYS 70 -14.704 -3.083 -1.616 434 H LYS 71 H LYS 71 -12.806 -9.522 -5.294 435 HA LYS 71 HA LYS 71 -14.851 -11.252 -5.978 436 HB2 LYS 71 1HB LYS 71 -12.824 -10.917 -7.326 437 HB3 LYS 71 2HB LYS 71 -11.874 -11.750 -6.107 438 HG2 LYS 71 1HG LYS 71 -12.938 -13.820 -6.566 439 HG3 LYS 71 2HG LYS 71 -14.153 -13.040 -7.576 440 HD2 LYS 71 1HD LYS 71 -11.244 -12.858 -8.263 441 HD3 LYS 71 2HD LYS 71 -12.182 -14.283 -8.704 442 HE2 LYS 71 1HE LYS 71 -12.222 -12.845 -10.585 443 HE3 LYS 71 2HE LYS 71 -13.809 -12.728 -9.836 444 HZ1 LYS 71 1HZ LYS 71 -12.852 -10.579 -10.543 445 HZ2 LYS 71 2HZ LYS 71 -11.627 -10.764 -9.395 446 HZ3 LYS 71 3HZ LYS 71 -13.241 -10.630 -8.903 447 H GLN 72 H GLN 72 -12.345 -11.608 -3.482 448 HA GLN 72 HA GLN 72 -13.890 -13.920 -2.529 449 HB2 GLN 72 1HB GLN 72 -11.782 -14.994 -1.798 450 HB3 GLN 72 2HB GLN 72 -11.926 -14.818 -3.539 451 HG2 GLN 72 1HG GLN 72 -10.450 -12.864 -3.450 452 HG3 GLN 72 2HG GLN 72 -10.285 -13.082 -1.707 453 HE21 GLN 72 1HE2 GLN 72 -9.381 -14.229 -4.834 454 HE22 GLN 72 2HE2 GLN 72 -8.175 -15.348 -4.303 455 H ASN 73 H ASN 73 -11.524 -11.439 -1.380 456 HA ASN 73 HA ASN 73 -12.425 -12.160 1.311 457 HB2 ASN 73 1HB ASN 73 -9.657 -11.692 0.315 458 HB3 ASN 73 2HB ASN 73 -10.037 -11.427 2.013 459 HD21 ASN 73 1HD2 ASN 73 -10.699 -13.186 3.284 460 HD22 ASN 73 2HD2 ASN 73 -10.369 -14.817 2.802 461 H SER 74 H SER 74 -13.043 -9.666 -0.481 462 HA SER 74 HA SER 74 -11.921 -7.472 0.895 463 HB2 SER 74 1HB SER 74 -12.941 -7.271 -1.317 464 HB3 SER 74 2HB SER 74 -14.529 -7.585 -0.619 465 HG SER 74 HG SER 74 -13.048 -5.508 0.506 466 H SER 75 H SER 75 -14.238 -9.699 1.952 467 HA SER 75 HA SER 75 -15.853 -8.291 3.692 468 HB2 SER 75 1HB SER 75 -14.484 -10.906 4.357 469 HB3 SER 75 2HB SER 75 -16.028 -10.323 4.974 470 HG SER 75 HG SER 75 -15.820 -11.901 3.030 471 H GLU 76 H GLU 76 -12.539 -9.478 4.212 472 HA GLU 76 HA GLU 76 -11.984 -7.116 5.772 473 HB2 GLU 76 1HB GLU 76 -12.762 -8.693 7.505 474 HB3 GLU 76 2HB GLU 76 -11.545 -9.851 6.986 475 HG2 GLU 76 1HG GLU 76 -9.786 -8.236 7.574 476 HG3 GLU 76 2HG GLU 76 -11.023 -7.122 8.154 477 H ALA 77 H ALA 77 -10.507 -6.484 4.338 478 HA ALA 77 HA ALA 77 -8.150 -8.215 4.021 479 HB1 ALA 77 1HB ALA 77 -7.776 -7.197 1.824 480 HB2 ALA 77 2HB ALA 77 -9.255 -6.253 2.006 481 HB3 ALA 77 3HB ALA 77 -9.339 -8.011 1.890 482 H LYS 78 H LYS 78 -6.123 -7.006 3.811 483 HA LYS 78 HA LYS 78 -6.307 -4.305 4.936 484 HB2 LYS 78 1HB LYS 78 -4.448 -6.526 5.773 485 HB3 LYS 78 2HB LYS 78 -4.097 -4.836 6.110 486 HG2 LYS 78 1HG LYS 78 -6.228 -4.665 7.325 487 HG3 LYS 78 2HG LYS 78 -6.508 -6.379 7.040 488 HD2 LYS 78 1HD LYS 78 -4.120 -5.269 8.505 489 HD3 LYS 78 2HD LYS 78 -5.589 -5.837 9.295 490 HE2 LYS 78 1HE LYS 78 -5.217 -8.040 8.116 491 HE3 LYS 78 2HE LYS 78 -3.625 -7.429 7.668 492 HZ1 LYS 78 1HZ LYS 78 -4.639 -7.741 10.438 493 HZ2 LYS 78 2HZ LYS 78 -3.110 -7.149 10.008 494 HZ3 LYS 78 3HZ LYS 78 -3.524 -8.758 9.674 495 H ILE 79 H ILE 79 -4.986 -2.802 4.089 496 HA ILE 79 HA ILE 79 -3.234 -3.654 1.886 497 HB ILE 79 HB ILE 79 -5.165 -1.325 1.781 498 HG12 ILE 79 1HG1 ILE 79 -5.246 -3.978 0.326 499 HG13 ILE 79 2HG1 ILE 79 -6.336 -3.474 1.615 500 HG21 ILE 79 1HG2 ILE 79 -3.284 -2.426 -0.304 501 HG22 ILE 79 2HG2 ILE 79 -3.136 -0.881 0.534 502 HG23 ILE 79 3HG2 ILE 79 -4.478 -1.157 -0.575 503 HD11 ILE 79 1HD1 ILE 79 -6.095 -2.194 -1.099 504 HD12 ILE 79 2HD1 ILE 79 -7.183 -1.681 0.191 505 HD13 ILE 79 3HD1 ILE 79 -7.389 -3.264 -0.558 506 H LEU 80 H LEU 80 -1.368 -2.465 1.659 507 HA LEU 80 HA LEU 80 -0.968 -0.280 3.602 508 HB2 LEU 80 1HB LEU 80 0.449 -2.386 3.822 509 HB3 LEU 80 2HB LEU 80 1.184 -1.944 2.287 510 HG LEU 80 HG LEU 80 1.969 0.188 3.336 511 HD11 LEU 80 1HD1 LEU 80 1.945 0.354 5.775 512 HD12 LEU 80 2HD1 LEU 80 0.938 -1.091 5.861 513 HD13 LEU 80 3HD1 LEU 80 0.315 0.374 5.101 514 HD21 LEU 80 1HD2 LEU 80 3.448 -1.733 3.152 515 HD22 LEU 80 2HD2 LEU 80 2.838 -2.367 4.680 516 HD23 LEU 80 3HD2 LEU 80 3.748 -0.858 4.653 517 H ILE 81 H ILE 81 -0.385 1.701 2.801 518 HA ILE 81 HA ILE 81 0.272 1.816 -0.074 519 HB ILE 81 HB ILE 81 -1.163 3.955 1.518 520 HG12 ILE 81 1HG1 ILE 81 -2.212 2.185 -0.703 521 HG13 ILE 81 2HG1 ILE 81 -2.575 1.966 1.006 522 HG21 ILE 81 1HG2 ILE 81 0.334 4.802 -0.258 523 HG22 ILE 81 2HG2 ILE 81 -1.367 5.135 -0.584 524 HG23 ILE 81 3HG2 ILE 81 -0.546 3.825 -1.433 525 HD11 ILE 81 1HD1 ILE 81 -3.268 4.411 -0.608 526 HD12 ILE 81 2HD1 ILE 81 -3.717 4.092 1.068 527 HD13 ILE 81 3HD1 ILE 81 -4.378 3.095 -0.226 528 H LEU 82 H LEU 82 2.390 2.158 -0.215 529 HA LEU 82 HA LEU 82 3.719 3.835 1.779 530 HB2 LEU 82 1HB LEU 82 4.895 2.271 -0.523 531 HB3 LEU 82 2HB LEU 82 5.796 3.063 0.754 532 HG LEU 82 HG LEU 82 3.976 0.673 1.065 533 HD11 LEU 82 1HD1 LEU 82 6.960 0.975 1.342 534 HD12 LEU 82 2HD1 LEU 82 6.115 0.150 0.033 535 HD13 LEU 82 3HD1 LEU 82 6.037 -0.489 1.675 536 HD21 LEU 82 1HD2 LEU 82 5.541 2.221 3.125 537 HD22 LEU 82 2HD2 LEU 82 4.791 0.650 3.401 538 HD23 LEU 82 3HD2 LEU 82 3.788 2.052 3.028 539 H LEU 83 H LEU 83 3.502 5.954 1.351 540 HA LEU 83 HA LEU 83 4.031 6.832 -1.406 541 HB2 LEU 83 1HB LEU 83 2.386 8.634 -1.141 542 HB3 LEU 83 2HB LEU 83 1.645 7.046 -1.102 543 HG LEU 83 HG LEU 83 2.235 8.630 1.410 544 HD11 LEU 83 1HD1 LEU 83 0.774 9.927 -0.089 545 HD12 LEU 83 2HD1 LEU 83 -0.068 9.377 1.359 546 HD13 LEU 83 3HD1 LEU 83 -0.328 8.552 -0.177 547 HD21 LEU 83 1HD2 LEU 83 0.581 7.204 2.420 548 HD22 LEU 83 2HD2 LEU 83 1.809 6.198 1.652 549 HD23 LEU 83 3HD2 LEU 83 0.245 6.432 0.873 550 H GLU 84 H GLU 84 4.982 8.942 -1.604 551 HA GLU 84 HA GLU 84 6.166 9.886 0.908 552 HB2 GLU 84 1HB GLU 84 6.732 10.771 -1.939 553 HB3 GLU 84 2HB GLU 84 7.629 11.253 -0.505 554 HG2 GLU 84 1HG GLU 84 8.352 8.936 -0.183 555 HG3 GLU 84 2HG GLU 84 7.461 8.462 -1.627 556 H LYS 85 H LYS 85 4.559 10.928 1.869 557 HA LYS 85 HA LYS 85 3.843 13.542 1.087 558 HB2 LYS 85 1HB LYS 85 2.405 12.135 -0.474 559 HB3 LYS 85 2HB LYS 85 1.589 11.521 0.955 560 HG2 LYS 85 1HG LYS 85 0.804 13.746 1.501 561 HG3 LYS 85 2HG LYS 85 1.693 14.412 0.128 562 HD2 LYS 85 1HD LYS 85 0.330 13.058 -1.402 563 HD3 LYS 85 2HD LYS 85 -0.567 12.413 -0.025 564 HE2 LYS 85 1HE LYS 85 -1.376 14.640 0.520 565 HE3 LYS 85 2HE LYS 85 -0.427 15.328 -0.795 566 HZ1 LYS 85 1HZ LYS 85 -1.757 14.081 -2.371 567 HZ2 LYS 85 2HZ LYS 85 -2.753 15.047 -1.412 568 HZ3 LYS 85 3HZ LYS 85 -2.654 13.382 -1.117 569 HA PRO 86 HA PRO 86 3.087 13.358 5.539 570 HB2 PRO 86 1HB PRO 86 1.522 15.831 5.110 571 HB3 PRO 86 2HB PRO 86 2.913 15.554 6.162 572 HG2 PRO 86 1HG PRO 86 3.133 17.002 3.920 573 HG3 PRO 86 2HG PRO 86 4.441 15.936 4.468 574 HD2 PRO 86 1HD PRO 86 2.411 15.493 2.310 575 HD3 PRO 86 2HD PRO 86 4.142 15.093 2.330 576 H VAL 87 H VAL 87 1.570 11.998 6.300 577 HA VAL 87 HA VAL 87 -1.121 12.162 5.122 578 HB VAL 87 HB VAL 87 -1.399 9.779 5.726 579 HG11 VAL 87 1HG1 VAL 87 0.964 10.394 3.959 580 HG12 VAL 87 2HG1 VAL 87 -0.731 10.387 3.476 581 HG13 VAL 87 3HG1 VAL 87 0.053 8.883 3.959 582 HG21 VAL 87 1HG2 VAL 87 0.587 8.443 6.297 583 HG22 VAL 87 2HG2 VAL 87 0.194 9.616 7.552 584 HG23 VAL 87 3HG2 VAL 87 1.529 9.927 6.444 585 H SER 88 H SER 88 -2.780 12.614 6.371 586 HA SER 88 HA SER 88 -2.417 12.614 9.275 587 HB2 SER 88 1HB SER 88 -4.613 13.861 7.603 588 HB3 SER 88 2HB SER 88 -4.361 14.089 9.333 589 HG SER 88 HG SER 88 -2.433 15.141 8.894 590 HA PRO 89 HA PRO 89 -5.033 9.129 10.206 591 HB2 PRO 89 1HB PRO 89 -6.773 11.098 11.638 592 HB3 PRO 89 2HB PRO 89 -6.171 9.527 12.182 593 HG2 PRO 89 1HG PRO 89 -5.036 11.768 13.043 594 HG3 PRO 89 2HG PRO 89 -4.048 10.352 12.639 595 HD2 PRO 89 1HD PRO 89 -4.417 12.893 11.137 596 HD3 PRO 89 2HD PRO 89 -2.999 11.832 11.232 597 H GLU 90 H GLU 90 -7.007 12.064 9.633 598 HA GLU 90 HA GLU 90 -9.268 10.741 8.634 599 HB2 GLU 90 1HB GLU 90 -8.226 13.536 8.203 600 HB3 GLU 90 2HB GLU 90 -9.739 12.983 7.501 601 HG2 GLU 90 1HG GLU 90 -9.100 13.060 10.440 602 HG3 GLU 90 2HG GLU 90 -10.076 14.235 9.566 603 H TYR 91 H TYR 91 -6.351 11.860 7.046 604 HA TYR 91 HA TYR 91 -7.202 11.598 4.377 605 HB2 TYR 91 1HB TYR 91 -5.145 12.803 5.212 606 HB3 TYR 91 2HB TYR 91 -4.388 11.230 5.420 607 HD1 TYR 91 HD1 TYR 91 -5.897 13.475 2.883 608 HD2 TYR 91 HD2 TYR 91 -3.313 10.174 3.613 609 HE1 TYR 91 HE1 TYR 91 -5.133 13.566 0.551 610 HE2 TYR 91 HE2 TYR 91 -2.545 10.253 1.277 611 HH TYR 91 HH TYR 91 -3.329 11.074 -0.896 612 H GLU 92 H GLU 92 -5.692 9.349 6.634 613 HA GLU 92 HA GLU 92 -5.368 7.183 4.885 614 HB2 GLU 92 1HB GLU 92 -4.288 7.268 7.066 615 HB3 GLU 92 2HB GLU 92 -5.849 7.237 7.870 616 HG2 GLU 92 1HG GLU 92 -6.267 5.005 7.018 617 HG3 GLU 92 2HG GLU 92 -4.737 5.046 6.151 618 H LYS 93 H LYS 93 -8.067 8.156 6.955 619 HA LYS 93 HA LYS 93 -9.555 5.779 6.467 620 HB2 LYS 93 1HB LYS 93 -10.592 8.390 7.567 621 HB3 LYS 93 2HB LYS 93 -11.314 6.799 7.754 622 HG2 LYS 93 1HG LYS 93 -8.779 7.832 8.996 623 HG3 LYS 93 2HG LYS 93 -10.262 7.332 9.807 624 HD2 LYS 93 1HD LYS 93 -9.873 5.020 9.071 625 HD3 LYS 93 2HD LYS 93 -8.381 5.528 8.279 626 HE2 LYS 93 1HE LYS 93 -7.562 6.322 10.503 627 HE3 LYS 93 2HE LYS 93 -8.997 5.603 11.232 628 HZ1 LYS 93 1HZ LYS 93 -8.255 3.449 10.242 629 HZ2 LYS 93 2HZ LYS 93 -7.234 4.056 11.442 630 HZ3 LYS 93 3HZ LYS 93 -6.794 4.199 9.812 631 H LYS 94 H LYS 94 -9.259 8.841 4.882 632 HA LYS 94 HA LYS 94 -11.614 8.760 3.331 633 HB2 LYS 94 1HB LYS 94 -8.903 9.987 2.842 634 HB3 LYS 94 2HB LYS 94 -10.216 10.131 1.684 635 HG2 LYS 94 1HG LYS 94 -11.569 11.302 3.293 636 HG3 LYS 94 2HG LYS 94 -10.349 11.055 4.545 637 HD2 LYS 94 1HD LYS 94 -8.775 12.432 3.340 638 HD3 LYS 94 2HD LYS 94 -9.894 12.584 1.986 639 HE2 LYS 94 1HE LYS 94 -9.852 14.579 3.445 640 HE3 LYS 94 2HE LYS 94 -11.442 13.829 3.341 641 HZ1 LYS 94 1HZ LYS 94 -10.876 14.464 5.609 642 HZ2 LYS 94 2HZ LYS 94 -9.519 13.458 5.568 643 HZ3 LYS 94 3HZ LYS 94 -11.069 12.789 5.475 644 H LEU 95 H LEU 95 -8.348 7.508 2.746 645 HA LEU 95 HA LEU 95 -9.051 6.300 0.247 646 HB2 LEU 95 1HB LEU 95 -6.674 5.795 2.044 647 HB3 LEU 95 2HB LEU 95 -6.833 5.244 0.388 648 HG LEU 95 HG LEU 95 -6.672 8.126 1.279 649 HD11 LEU 95 1HD1 LEU 95 -4.681 6.405 -0.188 650 HD12 LEU 95 2HD1 LEU 95 -4.552 6.937 1.488 651 HD13 LEU 95 3HD1 LEU 95 -4.500 8.119 0.181 652 HD21 LEU 95 1HD2 LEU 95 -6.503 8.621 -1.123 653 HD22 LEU 95 2HD2 LEU 95 -8.061 7.920 -0.693 654 HD23 LEU 95 3HD2 LEU 95 -6.836 6.926 -1.483 655 H GLN 96 H GLN 96 -8.907 5.295 3.584 656 HA GLN 96 HA GLN 96 -9.179 2.520 3.193 657 HB2 GLN 96 1HB GLN 96 -8.477 3.605 5.326 658 HB3 GLN 96 2HB GLN 96 -10.118 4.184 5.538 659 HG2 GLN 96 1HG GLN 96 -9.664 1.260 5.216 660 HG3 GLN 96 2HG GLN 96 -9.271 2.027 6.750 661 HE21 GLN 96 1HE2 GLN 96 -11.347 0.065 6.058 662 HE22 GLN 96 2HE2 GLN 96 -12.842 0.783 6.552 663 H LYS 97 H LYS 97 -11.549 5.137 3.458 664 HA LYS 97 HA LYS 97 -13.761 3.292 3.274 665 HB2 LYS 97 1HB LYS 97 -13.673 6.302 3.105 666 HB3 LYS 97 2HB LYS 97 -15.152 5.358 3.026 667 HG2 LYS 97 1HG LYS 97 -13.244 5.521 5.345 668 HG3 LYS 97 2HG LYS 97 -14.850 6.235 5.245 669 HD2 LYS 97 1HD LYS 97 -14.299 3.270 5.121 670 HD3 LYS 97 2HD LYS 97 -14.722 4.133 6.594 671 HE2 LYS 97 1HE LYS 97 -16.764 3.289 5.923 672 HE3 LYS 97 2HE LYS 97 -16.796 4.913 5.242 673 HZ1 LYS 97 1HZ LYS 97 -16.276 4.048 3.100 674 HZ2 LYS 97 2HZ LYS 97 -17.551 3.127 3.715 675 HZ3 LYS 97 3HZ LYS 97 -15.986 2.501 3.715 676 H TYR 98 H TYR 98 -11.613 4.529 1.017 677 HA TYR 98 HA TYR 98 -13.467 4.745 -1.181 678 HB2 TYR 98 1HB TYR 98 -11.314 6.014 -1.096 679 HB3 TYR 98 2HB TYR 98 -10.449 4.491 -1.255 680 HD1 TYR 98 HD1 TYR 98 -10.280 3.377 -3.380 681 HD2 TYR 98 HD2 TYR 98 -12.615 6.910 -2.983 682 HE1 TYR 98 HE1 TYR 98 -10.401 3.564 -5.826 683 HE2 TYR 98 HE2 TYR 98 -12.745 7.105 -5.431 684 HH TYR 98 HH TYR 98 -11.943 4.607 -7.514 685 H ALA 99 H ALA 99 -10.915 2.458 -0.254 686 HA ALA 99 HA ALA 99 -12.231 0.385 -1.886 687 HB1 ALA 99 1HB ALA 99 -10.060 -0.839 -1.608 688 HB2 ALA 99 2HB ALA 99 -9.413 0.602 -0.818 689 HB3 ALA 99 3HB ALA 99 -9.927 0.673 -2.505 690 H ASP 100 H ASP 100 -13.148 -1.364 -0.817 691 HA ASP 100 HA ASP 100 -13.464 -0.958 2.021 692 HB2 ASP 100 1HB ASP 100 -14.488 -3.185 0.252 693 HB3 ASP 100 2HB ASP 100 -14.941 -2.940 1.933 694 H ALA 101 H ALA 101 -11.740 -1.308 3.066 695 HA ALA 101 HA ALA 101 -10.839 -3.855 3.815 696 HB1 ALA 101 1HB ALA 101 -8.546 -3.752 2.929 697 HB2 ALA 101 2HB ALA 101 -8.965 -2.302 2.015 698 HB3 ALA 101 3HB ALA 101 -9.726 -3.843 1.621 699 H GLU 102 H GLU 102 -8.707 -3.498 5.139 700 HA GLU 102 HA GLU 102 -8.918 -0.870 6.426 701 HB2 GLU 102 1HB GLU 102 -7.576 -3.400 7.369 702 HB3 GLU 102 2HB GLU 102 -7.612 -1.885 8.241 703 HG2 GLU 102 1HG GLU 102 -9.936 -3.672 7.604 704 HG3 GLU 102 2HG GLU 102 -9.231 -3.325 9.179 705 H VAL 103 H VAL 103 -7.722 0.407 5.097 706 HA VAL 103 HA VAL 103 -5.073 -0.513 4.299 707 HB VAL 103 HB VAL 103 -6.635 0.688 2.654 708 HG11 VAL 103 1HG1 VAL 103 -6.741 3.036 2.635 709 HG12 VAL 103 2HG1 VAL 103 -5.563 3.174 3.946 710 HG13 VAL 103 3HG1 VAL 103 -7.184 2.541 4.270 711 HG21 VAL 103 1HG2 VAL 103 -3.865 1.812 2.989 712 HG22 VAL 103 2HG2 VAL 103 -4.802 1.723 1.495 713 HG23 VAL 103 3HG2 VAL 103 -4.236 0.245 2.273 714 H ARG 104 H ARG 104 -3.223 0.307 5.000 715 HA ARG 104 HA ARG 104 -3.343 2.482 6.980 716 HB2 ARG 104 1HB ARG 104 -1.335 0.227 6.733 717 HB3 ARG 104 2HB ARG 104 -1.231 1.546 7.891 718 HG2 ARG 104 1HG ARG 104 -3.280 0.819 8.952 719 HG3 ARG 104 2HG ARG 104 -3.467 -0.463 7.754 720 HD2 ARG 104 1HD ARG 104 -1.357 -1.455 8.510 721 HD3 ARG 104 2HD ARG 104 -1.206 -0.188 9.726 722 HE ARG 104 HE ARG 104 -3.431 -1.110 10.564 723 HH11 ARG 104 1HH1 ARG 104 -0.955 -3.057 9.044 724 HH12 ARG 104 2HH1 ARG 104 -1.438 -4.527 9.843 725 HH21 ARG 104 1HH2 ARG 104 -4.038 -3.040 11.648 726 HH22 ARG 104 2HH2 ARG 104 -3.152 -4.505 11.347 727 H VAL 105 H VAL 105 -2.713 4.315 6.041 728 HA VAL 105 HA VAL 105 -1.048 4.210 3.696 729 HB VAL 105 HB VAL 105 -1.347 6.599 3.508 730 HG11 VAL 105 1HG1 VAL 105 -3.828 6.689 3.397 731 HG12 VAL 105 2HG1 VAL 105 -3.883 5.139 4.238 732 HG13 VAL 105 3HG1 VAL 105 -3.133 5.252 2.648 733 HG21 VAL 105 1HG2 VAL 105 -2.631 6.436 6.229 734 HG22 VAL 105 2HG2 VAL 105 -2.727 7.839 5.165 735 HG23 VAL 105 3HG2 VAL 105 -1.164 7.311 5.789 736 H ARG 106 H ARG 106 1.110 4.739 3.595 737 HA ARG 106 HA ARG 106 2.402 5.404 6.147 738 HB2 ARG 106 1HB ARG 106 2.313 2.856 5.200 739 HB3 ARG 106 2HB ARG 106 3.795 3.435 4.458 740 HG2 ARG 106 1HG ARG 106 4.354 2.386 6.505 741 HG3 ARG 106 2HG ARG 106 4.582 4.128 6.712 742 HD2 ARG 106 1HD ARG 106 2.187 4.115 7.646 743 HD3 ARG 106 2HD ARG 106 2.392 2.371 7.777 744 HE ARG 106 HE ARG 106 4.035 4.374 9.187 745 HH11 ARG 106 1HH1 ARG 106 2.775 1.116 8.919 746 HH12 ARG 106 2HH1 ARG 106 3.233 0.673 10.537 747 HH21 ARG 106 1HH2 ARG 106 4.630 3.782 11.313 748 HH22 ARG 106 2HH2 ARG 106 4.290 2.182 11.881 749 H THR 107 H THR 107 3.668 7.130 5.875 750 HA THR 107 HA THR 107 4.717 7.788 3.263 751 HB THR 107 HB THR 107 3.969 9.630 4.677 752 HG1 THR 107 HG1 THR 107 5.962 10.872 4.617 753 HG21 THR 107 1HG2 THR 107 4.405 8.684 6.877 754 HG22 THR 107 2HG2 THR 107 5.190 10.255 6.718 755 HG23 THR 107 3HG2 THR 107 6.142 8.775 6.592 756 H VAL 108 H VAL 108 6.715 7.335 2.535 757 HA VAL 108 HA VAL 108 8.540 6.000 4.425 758 HB VAL 108 HB VAL 108 9.428 4.725 2.491 759 HG11 VAL 108 1HG1 VAL 108 7.541 3.177 2.306 760 HG12 VAL 108 2HG1 VAL 108 6.470 4.406 2.983 761 HG13 VAL 108 3HG1 VAL 108 7.770 3.730 3.964 762 HG21 VAL 108 1HG2 VAL 108 8.144 4.641 0.413 763 HG22 VAL 108 2HG2 VAL 108 8.784 6.259 0.706 764 HG23 VAL 108 3HG2 VAL 108 7.080 5.913 1.014 765 H THR 109 H THR 109 10.791 6.201 4.032 766 HA THR 109 HA THR 109 11.547 8.614 2.532 767 HB THR 109 HB THR 109 13.353 8.869 4.335 768 HG1 THR 109 HG1 THR 109 12.777 7.927 6.362 769 HG21 THR 109 1HG2 THR 109 11.852 10.094 5.834 770 HG22 THR 109 2HG2 THR 109 10.463 9.282 5.113 771 HG23 THR 109 3HG2 THR 109 11.440 10.387 4.145 772 H SER 110 H SER 110 13.114 5.877 4.213 773 HA SER 110 HA SER 110 14.864 5.580 1.866 774 HB2 SER 110 1HB SER 110 15.433 4.751 4.721 775 HB3 SER 110 2HB SER 110 16.561 4.700 3.367 776 HG SER 110 HG SER 110 15.671 7.155 3.441 777 HA PRO 111 HA PRO 111 13.486 1.539 0.734 778 HB2 PRO 111 1HB PRO 111 16.281 0.676 1.393 779 HB3 PRO 111 2HB PRO 111 15.289 0.295 -0.021 780 HG2 PRO 111 1HG PRO 111 17.188 2.152 -0.165 781 HG3 PRO 111 2HG PRO 111 15.636 2.371 -0.992 782 HD2 PRO 111 1HD PRO 111 16.683 3.702 1.441 783 HD3 PRO 111 2HD PRO 111 15.522 4.294 0.238 784 H ASP 112 H ASP 112 15.789 1.328 3.477 785 HA ASP 112 HA ASP 112 14.809 -1.085 4.515 786 HB2 ASP 112 1HB ASP 112 16.345 1.161 5.808 787 HB3 ASP 112 2HB ASP 112 15.902 -0.298 6.686 788 H GLU 113 H GLU 113 13.754 2.205 5.024 789 HA GLU 113 HA GLU 113 12.187 1.743 7.333 790 HB2 GLU 113 1HB GLU 113 11.815 3.845 5.188 791 HB3 GLU 113 2HB GLU 113 11.120 3.880 6.803 792 HG2 GLU 113 1HG GLU 113 14.063 3.938 6.179 793 HG3 GLU 113 2HG GLU 113 13.077 5.344 6.573 794 H ALA 114 H ALA 114 11.460 1.735 3.876 795 HA ALA 114 HA ALA 114 8.700 1.234 4.073 796 HB1 ALA 114 1HB ALA 114 8.868 0.490 1.736 797 HB2 ALA 114 2HB ALA 114 10.626 0.497 1.870 798 HB3 ALA 114 3HB ALA 114 9.724 2.006 2.011 799 H LYS 115 H LYS 115 11.491 -0.924 3.912 800 HA LYS 115 HA LYS 115 10.056 -3.342 3.685 801 HB2 LYS 115 1HB LYS 115 12.772 -2.928 4.947 802 HB3 LYS 115 2HB LYS 115 12.129 -4.441 4.327 803 HG2 LYS 115 1HG LYS 115 12.101 -3.506 2.069 804 HG3 LYS 115 2HG LYS 115 12.748 -1.988 2.693 805 HD2 LYS 115 1HD LYS 115 14.609 -3.142 1.831 806 HD3 LYS 115 2HD LYS 115 14.696 -3.367 3.576 807 HE2 LYS 115 1HE LYS 115 13.770 -5.583 3.385 808 HE3 LYS 115 2HE LYS 115 13.502 -5.362 1.657 809 HZ1 LYS 115 1HZ LYS 115 15.923 -5.134 1.385 810 HZ2 LYS 115 2HZ LYS 115 15.481 -6.646 2.011 811 HZ3 LYS 115 3HZ LYS 115 16.128 -5.471 3.035 812 H ARG 116 H ARG 116 11.037 -1.401 6.432 813 HA ARG 116 HA ARG 116 10.416 -3.246 8.473 814 HB2 ARG 116 1HB ARG 116 11.711 -1.099 8.747 815 HB3 ARG 116 2HB ARG 116 10.182 -0.237 8.641 816 HG2 ARG 116 1HG ARG 116 9.524 -1.913 10.579 817 HG3 ARG 116 2HG ARG 116 11.271 -1.916 10.827 818 HD2 ARG 116 1HD ARG 116 9.411 0.451 10.867 819 HD3 ARG 116 2HD ARG 116 10.314 -0.223 12.220 820 HE ARG 116 HE ARG 116 12.050 0.613 10.125 821 HH11 ARG 116 1HH1 ARG 116 10.116 1.782 12.796 822 HH12 ARG 116 2HH1 ARG 116 11.055 3.225 13.016 823 HH21 ARG 116 1HH2 ARG 116 13.281 2.537 10.390 824 HH22 ARG 116 2HH2 ARG 116 12.854 3.645 11.656 825 H TRP 117 H TRP 117 8.514 -0.780 6.804 826 HA TRP 117 HA TRP 117 6.189 -1.093 8.400 827 HB2 TRP 117 1HB TRP 117 6.371 -0.017 5.582 828 HB3 TRP 117 2HB TRP 117 5.050 0.237 6.714 829 HD1 TRP 117 HD1 TRP 117 7.206 2.394 5.285 830 HE1 TRP 117 HE1 TRP 117 8.231 4.168 6.841 831 HE3 TRP 117 HE3 TRP 117 6.358 0.122 9.799 832 HZ2 TRP 117 HZ2 TRP 117 8.627 4.553 9.607 833 HZ3 TRP 117 HZ3 TRP 117 7.094 1.263 11.843 834 HH2 TRP 117 HH2 TRP 117 8.206 3.432 11.750 835 H ILE 118 H ILE 118 7.308 -2.579 5.415 836 HA ILE 118 HA ILE 118 4.956 -4.014 4.815 837 HB ILE 118 HB ILE 118 7.834 -4.751 4.230 838 HG12 ILE 118 1HG1 ILE 118 5.742 -3.377 2.523 839 HG13 ILE 118 2HG1 ILE 118 7.106 -2.579 3.296 840 HG21 ILE 118 1HG2 ILE 118 6.361 -6.697 4.083 841 HG22 ILE 118 2HG2 ILE 118 6.920 -6.204 2.484 842 HG23 ILE 118 3HG2 ILE 118 5.284 -5.807 3.008 843 HD11 ILE 118 1HD1 ILE 118 7.532 -2.952 0.941 844 HD12 ILE 118 2HD1 ILE 118 7.266 -4.684 1.151 845 HD13 ILE 118 3HD1 ILE 118 8.642 -3.901 1.931 846 H LYS 119 H LYS 119 7.750 -4.760 6.865 847 HA LYS 119 HA LYS 119 6.941 -7.341 7.666 848 HB2 LYS 119 1HB LYS 119 8.664 -5.259 9.006 849 HB3 LYS 119 2HB LYS 119 8.383 -6.845 9.707 850 HG2 LYS 119 1HG LYS 119 9.467 -6.521 6.934 851 HG3 LYS 119 2HG LYS 119 10.513 -6.499 8.353 852 HD2 LYS 119 1HD LYS 119 8.575 -8.737 8.097 853 HD3 LYS 119 2HD LYS 119 9.970 -8.736 7.020 854 HE2 LYS 119 1HE LYS 119 10.547 -10.008 8.952 855 HE3 LYS 119 2HE LYS 119 11.429 -8.488 9.030 856 HZ1 LYS 119 1HZ LYS 119 9.711 -7.671 10.578 857 HZ2 LYS 119 2HZ LYS 119 10.548 -9.008 11.174 858 HZ3 LYS 119 3HZ LYS 119 8.984 -9.204 10.565 859 H GLU 120 H GLU 120 6.257 -4.131 8.979 860 HA GLU 120 HA GLU 120 4.860 -5.062 11.276 861 HB2 GLU 120 1HB GLU 120 5.900 -2.788 11.009 862 HB3 GLU 120 2HB GLU 120 4.593 -2.380 9.908 863 HG2 GLU 120 1HG GLU 120 2.974 -2.734 11.707 864 HG3 GLU 120 2HG GLU 120 4.295 -3.120 12.809 865 H PHE 121 H PHE 121 4.045 -4.761 7.995 866 HA PHE 121 HA PHE 121 1.175 -4.632 8.445 867 HB2 PHE 121 1HB PHE 121 2.020 -3.278 6.659 868 HB3 PHE 121 2HB PHE 121 2.905 -4.630 5.968 869 HD1 PHE 121 HD1 PHE 121 -0.565 -3.537 6.757 870 HD2 PHE 121 HD2 PHE 121 1.997 -5.791 4.216 871 HE1 PHE 121 HE1 PHE 121 -2.459 -4.000 5.259 872 HE2 PHE 121 HE2 PHE 121 0.109 -6.260 2.716 873 HZ PHE 121 HZ PHE 121 -2.125 -5.367 3.238 874 H SER 122 H SER 122 3.516 -6.866 6.944 875 HA SER 122 HA SER 122 1.426 -8.816 6.478 876 HB2 SER 122 1HB SER 122 4.406 -9.087 6.038 877 HB3 SER 122 2HB SER 122 3.138 -10.098 5.346 878 HG SER 122 HG SER 122 2.624 -7.538 4.780 879 H GLU 123 H GLU 123 3.676 -8.115 8.953 880 HA GLU 123 HA GLU 123 3.273 -10.780 10.131 881 HB2 GLU 123 1HB GLU 123 5.550 -10.453 9.106 882 HB3 GLU 123 2HB GLU 123 5.827 -9.174 10.273 883 HG2 GLU 123 1HG GLU 123 5.545 -10.815 12.089 884 HG3 GLU 123 2HG GLU 123 5.373 -12.085 10.875 885 H GLU 124 H GLU 124 1.647 -8.617 10.722 886 HA GLU 124 HA GLU 124 2.622 -7.350 13.116 887 HB2 GLU 124 1HB GLU 124 0.313 -6.412 13.275 888 HB3 GLU 124 2HB GLU 124 1.142 -6.042 11.771 889 HG2 GLU 124 1HG GLU 124 -0.137 -7.696 10.599 890 HG3 GLU 124 2HG GLU 124 -0.879 -8.238 12.100 Start of MODEL 2 1 HA MET 21 HA MET 21 -8.274 -12.366 2.776 2 HB2 MET 21 1HB MET 21 -6.142 -12.273 4.916 3 HB3 MET 21 2HB MET 21 -6.959 -10.854 4.284 4 HG2 MET 21 1HG MET 21 -7.961 -11.444 6.357 5 HG3 MET 21 2HG MET 21 -9.108 -11.802 5.068 6 HE1 MET 21 1HE MET 21 -5.935 -13.896 6.218 7 HE2 MET 21 2HE MET 21 -6.688 -14.969 7.397 8 HE3 MET 21 3HE MET 21 -6.620 -13.235 7.701 9 H THR 22 H THR 22 -7.514 -10.943 1.281 10 HA THR 22 HA THR 22 -4.864 -11.506 0.173 11 HB THR 22 HB THR 22 -6.899 -9.638 -1.034 12 HG1 THR 22 HG1 THR 22 -7.076 -12.351 -0.709 13 HG21 THR 22 1HG2 THR 22 -4.636 -9.618 -1.976 14 HG22 THR 22 2HG2 THR 22 -5.792 -10.290 -3.126 15 HG23 THR 22 3HG2 THR 22 -4.720 -11.362 -2.227 16 H LEU 23 H LEU 23 -3.241 -10.013 0.179 17 HA LEU 23 HA LEU 23 -3.796 -7.469 1.549 18 HB2 LEU 23 1HB LEU 23 -1.294 -9.151 1.734 19 HB3 LEU 23 2HB LEU 23 -1.564 -7.620 2.543 20 HG LEU 23 HG LEU 23 -3.106 -10.165 3.067 21 HD11 LEU 23 1HD1 LEU 23 -0.999 -8.763 4.704 22 HD12 LEU 23 2HD1 LEU 23 -0.817 -10.307 3.869 23 HD13 LEU 23 3HD1 LEU 23 -1.946 -10.161 5.218 24 HD21 LEU 23 1HD2 LEU 23 -3.205 -7.476 4.425 25 HD22 LEU 23 2HD2 LEU 23 -4.034 -8.932 4.975 26 HD23 LEU 23 3HD2 LEU 23 -4.476 -8.193 3.436 27 H PHE 24 H PHE 24 -3.275 -5.709 0.458 28 HA PHE 24 HA PHE 24 -1.605 -6.007 -1.953 29 HB2 PHE 24 1HB PHE 24 -3.785 -3.974 -1.429 30 HB3 PHE 24 2HB PHE 24 -2.863 -4.145 -2.916 31 HD1 PHE 24 HD1 PHE 24 -3.537 -5.651 -4.588 32 HD2 PHE 24 HD2 PHE 24 -5.339 -5.820 -0.738 33 HE1 PHE 24 HE1 PHE 24 -5.236 -7.198 -5.455 34 HE2 PHE 24 HE2 PHE 24 -7.039 -7.370 -1.597 35 HZ PHE 24 HZ PHE 24 -6.991 -8.061 -3.959 36 H VAL 25 H VAL 25 -0.124 -4.345 -2.451 37 HA VAL 25 HA VAL 25 0.202 -2.271 -0.413 38 HB VAL 25 HB VAL 25 1.872 -3.864 0.202 39 HG11 VAL 25 1HG1 VAL 25 3.544 -4.752 -1.264 40 HG12 VAL 25 2HG1 VAL 25 2.939 -3.783 -2.604 41 HG13 VAL 25 3HG1 VAL 25 1.952 -5.087 -1.947 42 HG21 VAL 25 1HG2 VAL 25 2.554 -1.539 0.322 43 HG22 VAL 25 2HG2 VAL 25 3.144 -1.608 -1.338 44 HG23 VAL 25 3HG2 VAL 25 3.931 -2.566 -0.083 45 H LEU 26 H LEU 26 -0.095 -0.442 -1.337 46 HA LEU 26 HA LEU 26 0.630 0.000 -4.146 47 HB2 LEU 26 1HB LEU 26 -1.060 1.568 -2.192 48 HB3 LEU 26 2HB LEU 26 -0.607 2.187 -3.763 49 HG LEU 26 HG LEU 26 -1.859 0.367 -4.848 50 HD11 LEU 26 1HD1 LEU 26 -3.366 -1.037 -3.551 51 HD12 LEU 26 2HD1 LEU 26 -2.695 -0.381 -2.058 52 HD13 LEU 26 3HD1 LEU 26 -1.682 -1.347 -3.129 53 HD21 LEU 26 1HD2 LEU 26 -4.098 1.142 -4.231 54 HD22 LEU 26 2HD2 LEU 26 -2.959 2.472 -4.429 55 HD23 LEU 26 3HD2 LEU 26 -3.418 1.939 -2.812 56 H ILE 27 H ILE 27 1.943 1.882 -4.687 57 HA ILE 27 HA ILE 27 3.311 3.155 -2.474 58 HB ILE 27 HB ILE 27 4.532 1.081 -2.672 59 HG12 ILE 27 1HG1 ILE 27 6.191 3.303 -3.878 60 HG13 ILE 27 2HG1 ILE 27 5.778 3.191 -2.168 61 HG21 ILE 27 1HG2 ILE 27 5.727 0.455 -4.700 62 HG22 ILE 27 2HG2 ILE 27 5.036 1.843 -5.538 63 HG23 ILE 27 3HG2 ILE 27 3.985 0.540 -4.981 64 HD11 ILE 27 1HD1 ILE 27 6.944 1.020 -2.069 65 HD12 ILE 27 2HD1 ILE 27 8.004 2.349 -2.527 66 HD13 ILE 27 3HD1 ILE 27 7.418 1.228 -3.754 67 H LEU 28 H LEU 28 3.331 5.280 -3.007 68 HA LEU 28 HA LEU 28 4.203 5.945 -5.754 69 HB2 LEU 28 1HB LEU 28 2.868 7.566 -3.596 70 HB3 LEU 28 2HB LEU 28 3.751 8.353 -4.884 71 HG LEU 28 HG LEU 28 2.196 7.112 -6.487 72 HD11 LEU 28 1HD1 LEU 28 0.030 6.487 -5.607 73 HD12 LEU 28 2HD1 LEU 28 0.582 6.820 -3.966 74 HD13 LEU 28 3HD1 LEU 28 1.302 5.496 -4.887 75 HD21 LEU 28 1HD2 LEU 28 0.448 8.816 -6.205 76 HD22 LEU 28 2HD2 LEU 28 2.070 9.495 -6.086 77 HD23 LEU 28 3HD2 LEU 28 1.121 9.223 -4.626 78 H SER 29 H SER 29 6.274 5.081 -5.084 79 HA SER 29 HA SER 29 7.987 7.250 -4.209 80 HB2 SER 29 1HB SER 29 8.066 4.491 -2.963 81 HB3 SER 29 2HB SER 29 9.269 5.740 -2.704 82 HG SER 29 HG SER 29 7.993 6.655 -1.294 83 H ASN 30 H ASN 30 8.725 7.307 -6.441 84 HA ASN 30 HA ASN 30 9.628 4.719 -7.461 85 HB2 ASN 30 1HB ASN 30 8.179 6.221 -8.869 86 HB3 ASN 30 2HB ASN 30 9.532 7.340 -8.960 87 HD21 ASN 30 1HD2 ASN 30 8.153 5.870 -11.070 88 HD22 ASN 30 2HD2 ASN 30 9.367 4.940 -11.878 89 H ASP 31 H ASP 31 11.426 4.559 -6.098 90 HA ASP 31 HA ASP 31 13.731 5.777 -7.455 91 HB2 ASP 31 1HB ASP 31 13.883 6.264 -5.084 92 HB3 ASP 31 2HB ASP 31 13.566 4.583 -4.680 93 H LYS 32 H LYS 32 15.142 4.301 -8.479 94 HA LYS 32 HA LYS 32 13.928 1.971 -9.405 95 HB2 LYS 32 1HB LYS 32 16.858 2.694 -9.372 96 HB3 LYS 32 2HB LYS 32 16.179 1.341 -10.263 97 HG2 LYS 32 1HG LYS 32 15.566 4.258 -10.695 98 HG3 LYS 32 2HG LYS 32 16.540 3.220 -11.735 99 HD2 LYS 32 1HD LYS 32 13.590 2.933 -11.167 100 HD3 LYS 32 2HD LYS 32 14.318 3.498 -12.669 101 HE2 LYS 32 1HE LYS 32 14.632 0.745 -11.477 102 HE3 LYS 32 2HE LYS 32 13.599 1.167 -12.838 103 HZ1 LYS 32 1HZ LYS 32 16.559 1.393 -12.774 104 HZ2 LYS 32 2HZ LYS 32 15.573 1.814 -14.080 105 HZ3 LYS 32 3HZ LYS 32 15.674 0.202 -13.583 106 H LYS 33 H LYS 33 16.579 2.247 -7.031 107 HA LYS 33 HA LYS 33 16.650 -0.582 -6.633 108 HB2 LYS 33 1HB LYS 33 18.645 0.873 -6.388 109 HB3 LYS 33 2HB LYS 33 17.913 1.601 -4.970 110 HG2 LYS 33 1HG LYS 33 19.585 -0.070 -4.371 111 HG3 LYS 33 2HG LYS 33 17.980 -0.518 -3.802 112 HD2 LYS 33 1HD LYS 33 18.950 -2.497 -4.660 113 HD3 LYS 33 2HD LYS 33 17.782 -1.968 -5.865 114 HE2 LYS 33 1HE LYS 33 20.705 -1.285 -6.043 115 HE3 LYS 33 2HE LYS 33 20.049 -2.778 -6.702 116 HZ1 LYS 33 1HZ LYS 33 20.152 -1.193 -8.438 117 HZ2 LYS 33 2HZ LYS 33 19.381 -0.010 -7.520 118 HZ3 LYS 33 3HZ LYS 33 18.513 -1.367 -8.043 119 H LEU 34 H LEU 34 15.173 2.142 -4.977 120 HA LEU 34 HA LEU 34 14.336 0.870 -2.626 121 HB2 LEU 34 1HB LEU 34 14.105 3.324 -3.404 122 HB3 LEU 34 2HB LEU 34 12.619 2.802 -4.162 123 HG LEU 34 HG LEU 34 13.215 3.356 -1.333 124 HD11 LEU 34 1HD1 LEU 34 10.732 3.402 -3.015 125 HD12 LEU 34 2HD1 LEU 34 11.803 4.765 -2.684 126 HD13 LEU 34 3HD1 LEU 34 10.875 4.034 -1.373 127 HD21 LEU 34 1HD2 LEU 34 12.826 0.965 -1.112 128 HD22 LEU 34 2HD2 LEU 34 11.348 1.102 -2.061 129 HD23 LEU 34 3HD2 LEU 34 11.455 1.876 -0.481 130 H ILE 35 H ILE 35 12.617 1.214 -5.741 131 HA ILE 35 HA ILE 35 10.367 -0.306 -5.098 132 HB ILE 35 HB ILE 35 11.713 0.180 -7.755 133 HG12 ILE 35 1HG1 ILE 35 9.229 1.334 -6.467 134 HG13 ILE 35 2HG1 ILE 35 10.777 2.153 -6.639 135 HG21 ILE 35 1HG2 ILE 35 9.670 -0.614 -8.833 136 HG22 ILE 35 2HG2 ILE 35 9.022 -1.091 -7.264 137 HG23 ILE 35 3HG2 ILE 35 10.451 -1.899 -7.912 138 HD11 ILE 35 1HD1 ILE 35 10.535 2.134 -9.054 139 HD12 ILE 35 2HD1 ILE 35 9.146 2.906 -8.289 140 HD13 ILE 35 3HD1 ILE 35 9.010 1.260 -8.906 141 H GLU 36 H GLU 36 13.547 -1.265 -6.178 142 HA GLU 36 HA GLU 36 12.946 -4.007 -6.649 143 HB2 GLU 36 1HB GLU 36 15.578 -2.715 -5.905 144 HB3 GLU 36 2HB GLU 36 15.387 -4.354 -6.507 145 HG2 GLU 36 1HG GLU 36 14.510 -3.473 -8.616 146 HG3 GLU 36 2HG GLU 36 14.718 -1.832 -8.010 147 H GLU 37 H GLU 37 14.418 -2.309 -3.899 148 HA GLU 37 HA GLU 37 14.674 -4.516 -2.186 149 HB2 GLU 37 1HB GLU 37 14.309 -1.581 -1.572 150 HB3 GLU 37 2HB GLU 37 14.716 -2.790 -0.367 151 HG2 GLU 37 1HG GLU 37 16.390 -2.183 -2.789 152 HG3 GLU 37 2HG GLU 37 16.648 -1.481 -1.194 153 H ALA 38 H ALA 38 12.039 -2.222 -2.656 154 HA ALA 38 HA ALA 38 10.385 -3.087 -0.558 155 HB1 ALA 38 1HB ALA 38 10.051 -0.975 -1.756 156 HB2 ALA 38 2HB ALA 38 8.584 -1.952 -1.738 157 HB3 ALA 38 3HB ALA 38 9.571 -1.872 -3.197 158 H ARG 39 H ARG 39 10.545 -4.079 -3.972 159 HA ARG 39 HA ARG 39 8.407 -5.926 -3.769 160 HB2 ARG 39 1HB ARG 39 9.083 -5.097 -5.942 161 HB3 ARG 39 2HB ARG 39 10.679 -5.810 -5.753 162 HG2 ARG 39 1HG ARG 39 9.761 -8.028 -5.832 163 HG3 ARG 39 2HG ARG 39 8.108 -7.400 -5.853 164 HD2 ARG 39 1HD ARG 39 8.772 -8.034 -8.092 165 HD3 ARG 39 2HD ARG 39 8.622 -6.279 -8.004 166 HE ARG 39 HE ARG 39 11.292 -7.270 -7.543 167 HH11 ARG 39 1HH1 ARG 39 8.999 -6.198 -9.964 168 HH12 ARG 39 2HH1 ARG 39 10.221 -5.793 -11.125 169 HH21 ARG 39 1HH2 ARG 39 12.897 -6.747 -9.067 170 HH22 ARG 39 2HH2 ARG 39 12.445 -6.107 -10.614 171 H LYS 40 H LYS 40 11.909 -6.240 -3.313 172 HA LYS 40 HA LYS 40 12.091 -9.005 -3.115 173 HB2 LYS 40 1HB LYS 40 13.531 -6.902 -1.497 174 HB3 LYS 40 2HB LYS 40 13.971 -8.603 -1.520 175 HG2 LYS 40 1HG LYS 40 14.456 -8.466 -3.892 176 HG3 LYS 40 2HG LYS 40 13.965 -6.770 -3.905 177 HD2 LYS 40 1HD LYS 40 15.740 -6.274 -2.272 178 HD3 LYS 40 2HD LYS 40 16.250 -7.961 -2.342 179 HE2 LYS 40 1HE LYS 40 16.776 -7.731 -4.696 180 HE3 LYS 40 2HE LYS 40 16.192 -6.066 -4.686 181 HZ1 LYS 40 1HZ LYS 40 18.597 -6.169 -4.523 182 HZ2 LYS 40 2HZ LYS 40 18.488 -7.099 -3.117 183 HZ3 LYS 40 3HZ LYS 40 17.932 -5.496 -3.115 184 H MET 41 H MET 41 11.071 -6.648 -0.711 185 HA MET 41 HA MET 41 10.625 -8.591 1.342 186 HB2 MET 41 1HB MET 41 9.685 -5.734 1.059 187 HB3 MET 41 2HB MET 41 9.444 -6.716 2.495 188 HG2 MET 41 1HG MET 41 12.105 -5.927 1.333 189 HG3 MET 41 2HG MET 41 11.325 -5.184 2.727 190 HE1 MET 41 1HE MET 41 11.346 -8.150 5.309 191 HE2 MET 41 2HE MET 41 10.065 -7.813 4.145 192 HE3 MET 41 3HE MET 41 10.845 -6.485 5.006 193 H ALA 42 H ALA 42 8.468 -6.683 -0.763 194 HA ALA 42 HA ALA 42 6.088 -7.756 0.317 195 HB1 ALA 42 1HB ALA 42 4.965 -6.669 -1.548 196 HB2 ALA 42 2HB ALA 42 6.523 -6.389 -2.325 197 HB3 ALA 42 3HB ALA 42 6.148 -5.605 -0.791 198 H GLU 43 H GLU 43 8.006 -8.673 -2.507 199 HA GLU 43 HA GLU 43 6.149 -10.445 -3.655 200 HB2 GLU 43 1HB GLU 43 8.455 -9.507 -4.524 201 HB3 GLU 43 2HB GLU 43 9.093 -10.977 -3.808 202 HG2 GLU 43 1HG GLU 43 6.841 -11.017 -5.790 203 HG3 GLU 43 2HG GLU 43 8.531 -11.012 -6.285 204 H LYS 44 H LYS 44 8.813 -10.933 -1.368 205 HA LYS 44 HA LYS 44 8.347 -13.695 -0.897 206 HB2 LYS 44 1HB LYS 44 10.015 -11.565 0.264 207 HB3 LYS 44 2HB LYS 44 9.530 -12.804 1.406 208 HG2 LYS 44 1HG LYS 44 11.624 -13.462 0.585 209 HG3 LYS 44 2HG LYS 44 10.449 -14.497 -0.218 210 HD2 LYS 44 1HD LYS 44 11.418 -11.981 -1.525 211 HD3 LYS 44 2HD LYS 44 12.373 -13.461 -1.601 212 HE2 LYS 44 1HE LYS 44 10.390 -14.617 -2.551 213 HE3 LYS 44 2HE LYS 44 9.552 -13.066 -2.585 214 HZ1 LYS 44 1HZ LYS 44 10.453 -13.454 -4.725 215 HZ2 LYS 44 2HZ LYS 44 11.981 -13.831 -4.099 216 HZ3 LYS 44 3HZ LYS 44 11.403 -12.245 -4.010 217 H ALA 45 H ALA 45 6.987 -10.767 0.375 218 HA ALA 45 HA ALA 45 5.857 -12.030 2.705 219 HB1 ALA 45 1HB ALA 45 6.643 -9.710 2.777 220 HB2 ALA 45 2HB ALA 45 4.944 -9.855 3.223 221 HB3 ALA 45 3HB ALA 45 5.388 -9.263 1.623 222 H ASN 46 H ASN 46 5.044 -12.207 -0.425 223 HA ASN 46 HA ASN 46 3.205 -12.837 -1.582 224 HB2 ASN 46 1HB ASN 46 3.046 -14.495 0.300 225 HB3 ASN 46 2HB ASN 46 1.951 -13.391 1.119 226 HD21 ASN 46 1HD2 ASN 46 -0.161 -13.371 0.557 227 HD22 ASN 46 2HD2 ASN 46 -0.853 -14.371 -0.670 228 H LEU 47 H LEU 47 3.557 -10.135 -1.081 229 HA LEU 47 HA LEU 47 0.805 -9.164 -0.705 230 HB2 LEU 47 1HB LEU 47 3.371 -7.579 -0.719 231 HB3 LEU 47 2HB LEU 47 1.774 -6.965 -0.352 232 HG LEU 47 HG LEU 47 3.366 -8.914 1.310 233 HD11 LEU 47 1HD1 LEU 47 2.499 -6.083 1.870 234 HD12 LEU 47 2HD1 LEU 47 4.121 -6.574 1.383 235 HD13 LEU 47 3HD1 LEU 47 3.459 -7.122 2.925 236 HD21 LEU 47 1HD2 LEU 47 1.012 -9.461 1.447 237 HD22 LEU 47 2HD2 LEU 47 0.613 -7.772 1.761 238 HD23 LEU 47 3HD2 LEU 47 1.542 -8.694 2.943 239 H ILE 48 H ILE 48 -0.256 -8.200 -2.352 240 HA ILE 48 HA ILE 48 0.898 -8.341 -4.987 241 HB ILE 48 HB ILE 48 -1.758 -7.205 -4.088 242 HG12 ILE 48 1HG1 ILE 48 -1.038 -9.880 -5.311 243 HG13 ILE 48 2HG1 ILE 48 -1.528 -9.609 -3.643 244 HG21 ILE 48 1HG2 ILE 48 -2.400 -7.351 -6.449 245 HG22 ILE 48 2HG2 ILE 48 -0.764 -7.866 -6.860 246 HG23 ILE 48 3HG2 ILE 48 -1.045 -6.249 -6.215 247 HD11 ILE 48 1HD1 ILE 48 -3.728 -8.893 -4.406 248 HD12 ILE 48 2HD1 ILE 48 -3.343 -10.520 -4.968 249 HD13 ILE 48 3HD1 ILE 48 -3.234 -9.155 -6.078 250 H LEU 49 H LEU 49 2.409 -6.892 -5.456 251 HA LEU 49 HA LEU 49 2.349 -4.227 -4.341 252 HB2 LEU 49 1HB LEU 49 4.458 -5.477 -4.496 253 HB3 LEU 49 2HB LEU 49 4.297 -5.536 -6.240 254 HG LEU 49 HG LEU 49 4.449 -3.040 -6.279 255 HD11 LEU 49 1HD1 LEU 49 5.362 -1.922 -4.290 256 HD12 LEU 49 2HD1 LEU 49 5.140 -3.409 -3.368 257 HD13 LEU 49 3HD1 LEU 49 3.740 -2.557 -4.018 258 HD21 LEU 49 1HD2 LEU 49 6.866 -2.975 -5.903 259 HD22 LEU 49 2HD2 LEU 49 6.382 -4.436 -6.764 260 HD23 LEU 49 3HD2 LEU 49 6.772 -4.514 -5.045 261 H ILE 50 H ILE 50 1.390 -2.565 -5.275 262 HA ILE 50 HA ILE 50 1.037 -2.626 -8.204 263 HB ILE 50 HB ILE 50 -0.757 -1.144 -6.277 264 HG12 ILE 50 1HG1 ILE 50 -1.253 -3.829 -7.592 265 HG13 ILE 50 2HG1 ILE 50 -0.892 -3.596 -5.885 266 HG21 ILE 50 1HG2 ILE 50 -0.719 -0.278 -8.547 267 HG22 ILE 50 2HG2 ILE 50 -2.265 -1.059 -8.219 268 HG23 ILE 50 3HG2 ILE 50 -1.045 -1.887 -9.188 269 HD11 ILE 50 1HD1 ILE 50 -2.953 -2.314 -5.630 270 HD12 ILE 50 2HD1 ILE 50 -3.262 -3.938 -6.242 271 HD13 ILE 50 3HD1 ILE 50 -3.313 -2.557 -7.339 272 H THR 51 H THR 51 2.670 -1.394 -8.923 273 HA THR 51 HA THR 51 3.479 1.002 -7.525 274 HB THR 51 HB THR 51 4.988 1.141 -9.684 275 HG1 THR 51 HG1 THR 51 4.203 -0.460 -10.946 276 HG21 THR 51 1HG2 THR 51 5.817 0.706 -7.422 277 HG22 THR 51 2HG2 THR 51 6.628 -0.326 -8.600 278 HG23 THR 51 3HG2 THR 51 5.358 -0.990 -7.573 279 H VAL 52 H VAL 52 2.279 2.755 -7.746 280 HA VAL 52 HA VAL 52 1.556 3.633 -10.456 281 HB VAL 52 HB VAL 52 -0.503 4.702 -9.471 282 HG11 VAL 52 1HG1 VAL 52 -0.622 2.633 -10.789 283 HG12 VAL 52 2HG1 VAL 52 -1.866 2.701 -9.541 284 HG13 VAL 52 3HG1 VAL 52 -0.436 1.692 -9.308 285 HG21 VAL 52 1HG2 VAL 52 0.085 4.682 -7.132 286 HG22 VAL 52 2HG2 VAL 52 0.168 2.920 -7.133 287 HG23 VAL 52 3HG2 VAL 52 -1.380 3.728 -7.369 288 H GLY 53 H GLY 53 1.772 5.870 -10.804 289 HA2 GLY 53 1HA GLY 53 2.852 7.362 -8.495 290 HA3 GLY 53 2HA GLY 53 3.569 7.480 -10.094 291 H ASP 54 H ASP 54 0.992 8.389 -8.037 292 HA ASP 54 HA ASP 54 0.582 10.909 -8.586 293 HB2 ASP 54 1HB ASP 54 0.262 10.624 -10.970 294 HB3 ASP 54 2HB ASP 54 -0.959 9.389 -10.703 295 H GLU 55 H GLU 55 -1.431 11.756 -7.672 296 HA GLU 55 HA GLU 55 -2.445 10.084 -5.636 297 HB2 GLU 55 1HB GLU 55 -3.573 12.682 -6.685 298 HB3 GLU 55 2HB GLU 55 -3.976 11.930 -5.144 299 HG2 GLU 55 1HG GLU 55 -1.626 12.163 -4.441 300 HG3 GLU 55 2HG GLU 55 -1.281 12.993 -5.960 301 H GLU 56 H GLU 56 -3.811 11.174 -8.714 302 HA GLU 56 HA GLU 56 -6.318 9.891 -8.391 303 HB2 GLU 56 1HB GLU 56 -4.822 10.847 -10.826 304 HB3 GLU 56 2HB GLU 56 -6.442 10.168 -10.900 305 HG2 GLU 56 1HG GLU 56 -5.740 12.533 -9.193 306 HG3 GLU 56 2HG GLU 56 -6.284 12.678 -10.868 307 H GLU 57 H GLU 57 -3.258 8.961 -9.873 308 HA GLU 57 HA GLU 57 -4.107 6.459 -10.857 309 HB2 GLU 57 1HB GLU 57 -1.369 7.424 -10.040 310 HB3 GLU 57 2HB GLU 57 -1.669 5.881 -10.829 311 HG2 GLU 57 1HG GLU 57 -2.216 8.615 -11.948 312 HG3 GLU 57 2HG GLU 57 -0.966 7.483 -12.462 313 H LEU 58 H LEU 58 -2.923 7.497 -7.716 314 HA LEU 58 HA LEU 58 -2.678 4.983 -6.508 315 HB2 LEU 58 1HB LEU 58 -1.938 7.062 -5.431 316 HB3 LEU 58 2HB LEU 58 -3.602 7.588 -5.286 317 HG LEU 58 HG LEU 58 -4.042 5.657 -3.782 318 HD11 LEU 58 1HD1 LEU 58 -2.197 4.234 -4.635 319 HD12 LEU 58 2HD1 LEU 58 -2.237 4.367 -2.878 320 HD13 LEU 58 3HD1 LEU 58 -1.054 5.290 -3.806 321 HD21 LEU 58 1HD2 LEU 58 -3.546 7.854 -2.864 322 HD22 LEU 58 2HD2 LEU 58 -1.818 7.500 -2.921 323 HD23 LEU 58 3HD2 LEU 58 -2.872 6.581 -1.846 324 H LYS 59 H LYS 59 -5.450 7.113 -6.945 325 HA LYS 59 HA LYS 59 -7.335 5.572 -5.568 326 HB2 LYS 59 1HB LYS 59 -7.609 7.600 -7.761 327 HB3 LYS 59 2HB LYS 59 -9.001 6.846 -6.992 328 HG2 LYS 59 1HG LYS 59 -8.551 7.846 -4.928 329 HG3 LYS 59 2HG LYS 59 -6.894 8.242 -5.381 330 HD2 LYS 59 1HD LYS 59 -8.370 10.216 -5.349 331 HD3 LYS 59 2HD LYS 59 -7.682 9.913 -6.943 332 HE2 LYS 59 1HE LYS 59 -9.773 8.843 -7.632 333 HE3 LYS 59 2HE LYS 59 -10.460 9.164 -6.039 334 HZ1 LYS 59 1HZ LYS 59 -9.443 11.308 -7.820 335 HZ2 LYS 59 2HZ LYS 59 -10.398 11.476 -6.430 336 HZ3 LYS 59 3HZ LYS 59 -11.057 10.790 -7.827 337 H LYS 60 H LYS 60 -5.934 5.158 -8.647 338 HA LYS 60 HA LYS 60 -8.008 3.399 -9.616 339 HB2 LYS 60 1HB LYS 60 -5.255 3.798 -10.775 340 HB3 LYS 60 2HB LYS 60 -6.712 3.257 -11.605 341 HG2 LYS 60 1HG LYS 60 -6.818 5.904 -10.288 342 HG3 LYS 60 2HG LYS 60 -5.809 5.763 -11.740 343 HD2 LYS 60 1HD LYS 60 -7.981 6.476 -12.440 344 HD3 LYS 60 2HD LYS 60 -7.793 4.792 -12.926 345 HE2 LYS 60 1HE LYS 60 -9.112 4.072 -11.023 346 HE3 LYS 60 2HE LYS 60 -9.246 5.735 -10.457 347 HZ1 LYS 60 1HZ LYS 60 -10.461 6.276 -12.480 348 HZ2 LYS 60 2HZ LYS 60 -11.237 5.043 -11.621 349 HZ3 LYS 60 3HZ LYS 60 -10.338 4.673 -13.005 350 H ALA 61 H ALA 61 -4.780 3.156 -8.230 351 HA ALA 61 HA ALA 61 -4.588 0.319 -8.403 352 HB1 ALA 61 1HB ALA 61 -3.204 2.279 -6.565 353 HB2 ALA 61 2HB ALA 61 -2.595 1.673 -8.105 354 HB3 ALA 61 3HB ALA 61 -2.774 0.578 -6.738 355 H ILE 62 H ILE 62 -5.706 2.611 -5.989 356 HA ILE 62 HA ILE 62 -6.330 0.848 -3.910 357 HB ILE 62 HB ILE 62 -7.625 3.457 -4.718 358 HG12 ILE 62 1HG1 ILE 62 -5.712 2.805 -2.467 359 HG13 ILE 62 2HG1 ILE 62 -5.243 3.530 -4.002 360 HG21 ILE 62 1HG2 ILE 62 -8.044 1.847 -2.208 361 HG22 ILE 62 2HG2 ILE 62 -9.246 2.216 -3.444 362 HG23 ILE 62 3HG2 ILE 62 -8.583 3.508 -2.443 363 HD11 ILE 62 1HD1 ILE 62 -6.600 5.478 -3.514 364 HD12 ILE 62 2HD1 ILE 62 -5.436 5.183 -2.222 365 HD13 ILE 62 3HD1 ILE 62 -7.130 4.745 -2.000 366 H LYS 63 H LYS 63 -8.406 2.047 -6.551 367 HA LYS 63 HA LYS 63 -10.645 0.489 -5.838 368 HB2 LYS 63 1HB LYS 63 -10.872 2.433 -7.275 369 HB3 LYS 63 2HB LYS 63 -9.881 1.672 -8.511 370 HG2 LYS 63 1HG LYS 63 -11.550 0.052 -8.979 371 HG3 LYS 63 2HG LYS 63 -12.487 0.517 -7.560 372 HD2 LYS 63 1HD LYS 63 -11.943 2.332 -9.906 373 HD3 LYS 63 2HD LYS 63 -13.406 1.365 -9.716 374 HE2 LYS 63 1HE LYS 63 -12.436 3.536 -7.860 375 HE3 LYS 63 2HE LYS 63 -13.796 3.642 -8.974 376 HZ1 LYS 63 1HZ LYS 63 -14.890 1.871 -7.720 377 HZ2 LYS 63 2HZ LYS 63 -14.559 3.208 -6.742 378 HZ3 LYS 63 3HZ LYS 63 -13.597 1.825 -6.632 379 H LYS 64 H LYS 64 -7.863 -0.147 -7.890 380 HA LYS 64 HA LYS 64 -8.797 -2.569 -9.012 381 HB2 LYS 64 1HB LYS 64 -6.856 -1.293 -9.887 382 HB3 LYS 64 2HB LYS 64 -5.942 -1.736 -8.453 383 HG2 LYS 64 1HG LYS 64 -6.037 -4.068 -9.064 384 HG3 LYS 64 2HG LYS 64 -7.066 -3.692 -10.447 385 HD2 LYS 64 1HD LYS 64 -5.249 -2.337 -11.405 386 HD3 LYS 64 2HD LYS 64 -4.223 -2.768 -10.036 387 HE2 LYS 64 1HE LYS 64 -4.305 -5.099 -10.656 388 HE3 LYS 64 2HE LYS 64 -5.452 -4.748 -11.948 389 HZ1 LYS 64 1HZ LYS 64 -3.755 -3.435 -13.051 390 HZ2 LYS 64 2HZ LYS 64 -3.208 -5.012 -12.796 391 HZ3 LYS 64 3HZ LYS 64 -2.655 -3.758 -11.805 392 H ALA 65 H ALA 65 -6.821 -1.859 -6.154 393 HA ALA 65 HA ALA 65 -6.407 -4.498 -5.306 394 HB1 ALA 65 1HB ALA 65 -5.180 -2.572 -4.416 395 HB2 ALA 65 2HB ALA 65 -5.906 -3.532 -3.127 396 HB3 ALA 65 3HB ALA 65 -6.648 -2.009 -3.617 397 H ASP 66 H ASP 66 -8.915 -2.162 -4.406 398 HA ASP 66 HA ASP 66 -10.413 -3.791 -2.700 399 HB2 ASP 66 1HB ASP 66 -10.852 -1.456 -2.748 400 HB3 ASP 66 2HB ASP 66 -11.156 -1.468 -4.473 401 H ASP 67 H ASP 67 -10.474 -3.446 -6.199 402 HA ASP 67 HA ASP 67 -12.779 -5.026 -6.666 403 HB2 ASP 67 1HB ASP 67 -11.909 -3.459 -8.340 404 HB3 ASP 67 2HB ASP 67 -10.439 -4.415 -8.484 405 H ILE 68 H ILE 68 -9.300 -5.771 -6.800 406 HA ILE 68 HA ILE 68 -9.617 -8.482 -7.541 407 HB ILE 68 HB ILE 68 -7.308 -7.144 -6.114 408 HG12 ILE 68 1HG1 ILE 68 -7.714 -7.774 -9.047 409 HG13 ILE 68 2HG1 ILE 68 -7.860 -6.174 -8.325 410 HG21 ILE 68 1HG2 ILE 68 -7.402 -9.788 -7.561 411 HG22 ILE 68 2HG2 ILE 68 -7.235 -9.562 -5.821 412 HG23 ILE 68 3HG2 ILE 68 -5.954 -9.024 -6.909 413 HD11 ILE 68 1HD1 ILE 68 -5.725 -6.445 -9.440 414 HD12 ILE 68 2HD1 ILE 68 -5.356 -7.844 -8.431 415 HD13 ILE 68 3HD1 ILE 68 -5.501 -6.242 -7.702 416 H ALA 69 H ALA 69 -9.563 -6.829 -4.458 417 HA ALA 69 HA ALA 69 -9.344 -9.097 -2.791 418 HB1 ALA 69 1HB ALA 69 -10.703 -6.474 -2.182 419 HB2 ALA 69 2HB ALA 69 -8.973 -6.779 -2.028 420 HB3 ALA 69 3HB ALA 69 -10.117 -7.654 -1.010 421 H LYS 70 H LYS 70 -12.195 -7.255 -3.880 422 HA LYS 70 HA LYS 70 -14.120 -8.730 -2.477 423 HB2 LYS 70 1HB LYS 70 -14.363 -7.240 -5.073 424 HB3 LYS 70 2HB LYS 70 -15.734 -7.835 -4.152 425 HG2 LYS 70 1HG LYS 70 -15.016 -6.403 -2.259 426 HG3 LYS 70 2HG LYS 70 -13.762 -5.729 -3.303 427 HD2 LYS 70 1HD LYS 70 -15.467 -4.954 -4.863 428 HD3 LYS 70 2HD LYS 70 -16.727 -5.650 -3.846 429 HE2 LYS 70 1HE LYS 70 -14.846 -3.411 -3.110 430 HE3 LYS 70 2HE LYS 70 -16.568 -3.266 -3.460 431 HZ1 LYS 70 1HZ LYS 70 -16.199 -3.240 -1.102 432 HZ2 LYS 70 2HZ LYS 70 -15.352 -4.706 -1.169 433 HZ3 LYS 70 3HZ LYS 70 -17.007 -4.673 -1.515 434 H LYS 71 H LYS 71 -12.544 -9.402 -5.496 435 HA LYS 71 HA LYS 71 -14.286 -11.235 -6.608 436 HB2 LYS 71 1HB LYS 71 -11.264 -11.345 -6.519 437 HB3 LYS 71 2HB LYS 71 -12.273 -12.295 -7.598 438 HG2 LYS 71 1HG LYS 71 -13.080 -10.261 -8.660 439 HG3 LYS 71 2HG LYS 71 -12.101 -9.290 -7.559 440 HD2 LYS 71 1HD LYS 71 -10.073 -10.340 -8.446 441 HD3 LYS 71 2HD LYS 71 -11.054 -11.302 -9.549 442 HE2 LYS 71 1HE LYS 71 -10.865 -8.291 -9.514 443 HE3 LYS 71 2HE LYS 71 -10.081 -9.361 -10.674 444 HZ1 LYS 71 1HZ LYS 71 -13.005 -8.997 -10.312 445 HZ2 LYS 71 2HZ LYS 71 -12.301 -10.116 -11.362 446 HZ3 LYS 71 3HZ LYS 71 -12.078 -8.462 -11.619 447 H GLN 72 H GLN 72 -11.953 -11.642 -3.994 448 HA GLN 72 HA GLN 72 -13.119 -14.306 -3.522 449 HB2 GLN 72 1HB GLN 72 -10.821 -15.058 -2.785 450 HB3 GLN 72 2HB GLN 72 -11.059 -14.816 -4.510 451 HG2 GLN 72 1HG GLN 72 -9.973 -12.619 -4.330 452 HG3 GLN 72 2HG GLN 72 -9.693 -12.918 -2.615 453 HE21 GLN 72 1HE2 GLN 72 -7.466 -12.764 -2.883 454 HE22 GLN 72 2HE2 GLN 72 -6.550 -14.026 -3.636 455 H ASN 73 H ASN 73 -11.265 -11.682 -1.919 456 HA ASN 73 HA ASN 73 -11.802 -13.086 0.594 457 HB2 ASN 73 1HB ASN 73 -9.321 -11.684 -0.323 458 HB3 ASN 73 2HB ASN 73 -9.608 -12.047 1.372 459 HD21 ASN 73 1HD2 ASN 73 -10.991 -14.578 0.743 460 HD22 ASN 73 2HD2 ASN 73 -9.743 -15.683 0.284 461 H SER 74 H SER 74 -13.150 -10.593 -0.657 462 HA SER 74 HA SER 74 -12.439 -8.390 0.953 463 HB2 SER 74 1HB SER 74 -14.763 -7.556 0.234 464 HB3 SER 74 2HB SER 74 -13.550 -7.851 -1.011 465 HG SER 74 HG SER 74 -15.959 -8.911 -0.810 466 H SER 75 H SER 75 -13.503 -11.088 2.288 467 HA SER 75 HA SER 75 -15.573 -10.305 4.018 468 HB2 SER 75 1HB SER 75 -14.583 -12.049 5.555 469 HB3 SER 75 2HB SER 75 -14.921 -12.624 3.924 470 HG SER 75 HG SER 75 -12.661 -12.806 5.178 471 H GLU 76 H GLU 76 -12.081 -10.012 4.188 472 HA GLU 76 HA GLU 76 -12.190 -7.470 5.414 473 HB2 GLU 76 1HB GLU 76 -12.612 -8.969 7.414 474 HB3 GLU 76 2HB GLU 76 -11.008 -9.642 7.155 475 HG2 GLU 76 1HG GLU 76 -10.838 -7.992 8.856 476 HG3 GLU 76 2HG GLU 76 -10.077 -7.344 7.404 477 H ALA 77 H ALA 77 -10.800 -6.769 3.883 478 HA ALA 77 HA ALA 77 -8.234 -8.182 3.628 479 HB1 ALA 77 1HB ALA 77 -9.507 -8.013 1.544 480 HB2 ALA 77 2HB ALA 77 -8.008 -7.088 1.454 481 HB3 ALA 77 3HB ALA 77 -9.544 -6.258 1.706 482 H LYS 78 H LYS 78 -6.309 -6.997 3.706 483 HA LYS 78 HA LYS 78 -6.585 -4.245 4.709 484 HB2 LYS 78 1HB LYS 78 -4.443 -6.255 5.431 485 HB3 LYS 78 2HB LYS 78 -4.473 -4.578 5.946 486 HG2 LYS 78 1HG LYS 78 -6.739 -5.139 6.994 487 HG3 LYS 78 2HG LYS 78 -6.270 -6.822 6.771 488 HD2 LYS 78 1HD LYS 78 -4.640 -4.767 8.260 489 HD3 LYS 78 2HD LYS 78 -5.715 -5.935 9.022 490 HE2 LYS 78 1HE LYS 78 -3.384 -6.670 7.261 491 HE3 LYS 78 2HE LYS 78 -3.311 -6.595 9.021 492 HZ1 LYS 78 1HZ LYS 78 -4.963 -8.314 9.160 493 HZ2 LYS 78 2HZ LYS 78 -3.695 -8.850 8.178 494 HZ3 LYS 78 3HZ LYS 78 -5.149 -8.347 7.481 495 H ILE 79 H ILE 79 -5.184 -2.712 3.905 496 HA ILE 79 HA ILE 79 -3.457 -3.570 1.687 497 HB ILE 79 HB ILE 79 -5.380 -1.231 1.617 498 HG12 ILE 79 1HG1 ILE 79 -5.307 -3.761 -0.040 499 HG13 ILE 79 2HG1 ILE 79 -6.439 -3.440 1.272 500 HG21 ILE 79 1HG2 ILE 79 -4.592 -0.899 -0.691 501 HG22 ILE 79 2HG2 ILE 79 -3.377 -2.154 -0.444 502 HG23 ILE 79 3HG2 ILE 79 -3.305 -0.662 0.492 503 HD11 ILE 79 1HD1 ILE 79 -7.463 -3.068 -0.895 504 HD12 ILE 79 2HD1 ILE 79 -6.219 -1.883 -1.294 505 HD13 ILE 79 3HD1 ILE 79 -7.356 -1.562 0.016 506 H LEU 80 H LEU 80 -1.556 -2.454 1.483 507 HA LEU 80 HA LEU 80 -1.012 -0.390 3.520 508 HB2 LEU 80 1HB LEU 80 0.338 -2.615 3.333 509 HB3 LEU 80 2HB LEU 80 1.074 -1.867 1.926 510 HG LEU 80 HG LEU 80 1.188 -0.750 4.737 511 HD11 LEU 80 1HD1 LEU 80 3.275 -2.204 3.120 512 HD12 LEU 80 2HD1 LEU 80 2.431 -2.832 4.535 513 HD13 LEU 80 3HD1 LEU 80 3.524 -1.457 4.698 514 HD21 LEU 80 1HD2 LEU 80 2.647 0.082 2.230 515 HD22 LEU 80 2HD2 LEU 80 2.906 0.737 3.846 516 HD23 LEU 80 3HD2 LEU 80 1.364 0.991 3.029 517 H ILE 81 H ILE 81 -0.883 1.651 2.762 518 HA ILE 81 HA ILE 81 -0.178 2.007 -0.076 519 HB ILE 81 HB ILE 81 -1.766 3.827 1.740 520 HG12 ILE 81 1HG1 ILE 81 -2.499 2.427 -0.839 521 HG13 ILE 81 2HG1 ILE 81 -2.985 1.901 0.768 522 HG21 ILE 81 1HG2 ILE 81 -1.958 5.339 -0.179 523 HG22 ILE 81 2HG2 ILE 81 -0.855 4.312 -1.095 524 HG23 ILE 81 3HG2 ILE 81 -0.282 5.163 0.340 525 HD11 ILE 81 1HD1 ILE 81 -4.775 3.079 -0.390 526 HD12 ILE 81 2HD1 ILE 81 -3.748 4.507 -0.531 527 HD13 ILE 81 3HD1 ILE 81 -4.266 3.946 1.060 528 H LEU 82 H LEU 82 1.961 2.175 -0.064 529 HA LEU 82 HA LEU 82 3.315 3.891 1.875 530 HB2 LEU 82 1HB LEU 82 4.040 1.511 1.024 531 HB3 LEU 82 2HB LEU 82 4.635 2.386 -0.368 532 HG LEU 82 HG LEU 82 6.382 1.864 1.312 533 HD11 LEU 82 1HD1 LEU 82 7.407 4.070 1.372 534 HD12 LEU 82 2HD1 LEU 82 5.868 4.806 0.925 535 HD13 LEU 82 3HD1 LEU 82 6.697 3.736 -0.207 536 HD21 LEU 82 1HD2 LEU 82 6.441 3.011 3.424 537 HD22 LEU 82 2HD2 LEU 82 4.938 2.096 3.301 538 HD23 LEU 82 3HD2 LEU 82 4.930 3.844 3.058 539 H LEU 83 H LEU 83 4.183 5.877 1.287 540 HA LEU 83 HA LEU 83 4.530 6.598 -1.461 541 HB2 LEU 83 1HB LEU 83 2.882 8.600 -1.141 542 HB3 LEU 83 2HB LEU 83 2.294 7.042 -1.689 543 HG LEU 83 HG LEU 83 1.517 6.547 0.613 544 HD11 LEU 83 1HD1 LEU 83 2.476 9.339 1.177 545 HD12 LEU 83 2HD1 LEU 83 3.020 7.846 1.935 546 HD13 LEU 83 3HD1 LEU 83 1.383 8.434 2.221 547 HD21 LEU 83 1HD2 LEU 83 -0.015 7.511 -1.006 548 HD22 LEU 83 2HD2 LEU 83 0.499 9.134 -0.549 549 HD23 LEU 83 3HD2 LEU 83 -0.356 8.120 0.613 550 H GLU 84 H GLU 84 5.374 8.775 -1.739 551 HA GLU 84 HA GLU 84 6.548 9.908 0.690 552 HB2 GLU 84 1HB GLU 84 6.727 11.030 -2.110 553 HB3 GLU 84 2HB GLU 84 7.826 11.299 -0.766 554 HG2 GLU 84 1HG GLU 84 7.478 8.626 -2.087 555 HG3 GLU 84 2HG GLU 84 8.661 9.817 -2.617 556 H LYS 85 H LYS 85 4.943 10.933 1.801 557 HA LYS 85 HA LYS 85 3.836 13.352 0.843 558 HB2 LYS 85 1HB LYS 85 2.467 11.615 -0.415 559 HB3 LYS 85 2HB LYS 85 1.841 11.104 1.144 560 HG2 LYS 85 1HG LYS 85 0.958 13.375 1.500 561 HG3 LYS 85 2HG LYS 85 1.511 13.807 -0.119 562 HD2 LYS 85 1HD LYS 85 0.100 11.968 -1.023 563 HD3 LYS 85 2HD LYS 85 -0.531 11.711 0.605 564 HE2 LYS 85 1HE LYS 85 -2.081 13.073 -0.621 565 HE3 LYS 85 2HE LYS 85 -1.314 14.059 0.622 566 HZ1 LYS 85 1HZ LYS 85 -0.605 14.021 -2.259 567 HZ2 LYS 85 2HZ LYS 85 0.183 14.941 -1.078 568 HZ3 LYS 85 3HZ LYS 85 -1.436 15.254 -1.455 569 HA PRO 86 HA PRO 86 3.044 13.487 5.312 570 HB2 PRO 86 1HB PRO 86 1.469 15.893 4.790 571 HB3 PRO 86 2HB PRO 86 2.966 15.728 5.709 572 HG2 PRO 86 1HG PRO 86 2.850 17.007 3.326 573 HG3 PRO 86 2HG PRO 86 4.290 16.136 3.880 574 HD2 PRO 86 1HD PRO 86 2.190 15.273 1.929 575 HD3 PRO 86 2HD PRO 86 3.952 15.055 1.861 576 H VAL 87 H VAL 87 1.493 12.173 6.095 577 HA VAL 87 HA VAL 87 -1.147 12.252 4.801 578 HB VAL 87 HB VAL 87 -1.427 9.897 5.608 579 HG11 VAL 87 1HG1 VAL 87 -0.019 8.914 3.855 580 HG12 VAL 87 2HG1 VAL 87 0.878 10.428 3.737 581 HG13 VAL 87 3HG1 VAL 87 -0.830 10.378 3.301 582 HG21 VAL 87 1HG2 VAL 87 0.240 9.899 7.386 583 HG22 VAL 87 2HG2 VAL 87 1.525 10.121 6.199 584 HG23 VAL 87 3HG2 VAL 87 0.583 8.630 6.211 585 H SER 88 H SER 88 -2.873 12.717 5.958 586 HA SER 88 HA SER 88 -2.574 13.040 8.852 587 HB2 SER 88 1HB SER 88 -4.833 13.996 7.078 588 HB3 SER 88 2HB SER 88 -4.487 14.503 8.731 589 HG SER 88 HG SER 88 -2.711 15.598 8.034 590 HA PRO 89 HA PRO 89 -5.032 9.558 10.082 591 HB2 PRO 89 1HB PRO 89 -6.831 11.567 11.374 592 HB3 PRO 89 2HB PRO 89 -6.155 10.078 12.039 593 HG2 PRO 89 1HG PRO 89 -5.108 12.426 12.689 594 HG3 PRO 89 2HG PRO 89 -4.062 11.028 12.382 595 HD2 PRO 89 1HD PRO 89 -4.585 13.413 10.679 596 HD3 PRO 89 2HD PRO 89 -3.110 12.441 10.842 597 H GLU 90 H GLU 90 -7.119 12.358 9.303 598 HA GLU 90 HA GLU 90 -9.340 10.887 8.450 599 HB2 GLU 90 1HB GLU 90 -9.555 13.237 8.953 600 HB3 GLU 90 2HB GLU 90 -8.423 13.659 7.677 601 HG2 GLU 90 1HG GLU 90 -10.025 12.760 6.018 602 HG3 GLU 90 2HG GLU 90 -11.169 12.480 7.328 603 H TYR 91 H TYR 91 -6.465 11.925 6.728 604 HA TYR 91 HA TYR 91 -7.364 11.431 4.103 605 HB2 TYR 91 1HB TYR 91 -5.346 12.763 4.642 606 HB3 TYR 91 2HB TYR 91 -4.539 11.298 5.188 607 HD1 TYR 91 HD1 TYR 91 -3.418 9.898 3.657 608 HD2 TYR 91 HD2 TYR 91 -6.018 12.941 2.212 609 HE1 TYR 91 HE1 TYR 91 -2.607 9.497 1.369 610 HE2 TYR 91 HE2 TYR 91 -5.216 12.546 -0.075 611 HH TYR 91 HH TYR 91 -3.372 9.835 -0.950 612 H GLU 92 H GLU 92 -5.797 9.384 6.511 613 HA GLU 92 HA GLU 92 -5.444 7.123 4.854 614 HB2 GLU 92 1HB GLU 92 -4.230 7.345 6.941 615 HB3 GLU 92 2HB GLU 92 -5.731 7.369 7.852 616 HG2 GLU 92 1HG GLU 92 -6.167 5.100 7.368 617 HG3 GLU 92 2HG GLU 92 -4.865 5.025 6.185 618 H LYS 93 H LYS 93 -8.011 8.111 7.072 619 HA LYS 93 HA LYS 93 -9.568 5.755 6.677 620 HB2 LYS 93 1HB LYS 93 -10.541 8.409 7.731 621 HB3 LYS 93 2HB LYS 93 -11.226 6.821 8.037 622 HG2 LYS 93 1HG LYS 93 -8.586 7.866 9.035 623 HG3 LYS 93 2HG LYS 93 -10.045 7.595 9.985 624 HD2 LYS 93 1HD LYS 93 -8.482 5.447 8.552 625 HD3 LYS 93 2HD LYS 93 -8.361 5.811 10.273 626 HE2 LYS 93 1HE LYS 93 -10.804 5.328 10.465 627 HE3 LYS 93 2HE LYS 93 -10.775 4.792 8.787 628 HZ1 LYS 93 1HZ LYS 93 -10.570 2.946 10.348 629 HZ2 LYS 93 2HZ LYS 93 -9.155 3.619 10.980 630 HZ3 LYS 93 3HZ LYS 93 -9.191 3.085 9.378 631 H LYS 94 H LYS 94 -9.120 8.663 4.966 632 HA LYS 94 HA LYS 94 -11.618 8.779 3.612 633 HB2 LYS 94 1HB LYS 94 -9.991 10.676 3.824 634 HB3 LYS 94 2HB LYS 94 -8.940 9.838 2.692 635 HG2 LYS 94 1HG LYS 94 -10.648 9.986 0.969 636 HG3 LYS 94 2HG LYS 94 -11.730 10.791 2.106 637 HD2 LYS 94 1HD LYS 94 -9.989 12.578 2.355 638 HD3 LYS 94 2HD LYS 94 -9.110 11.815 1.029 639 HE2 LYS 94 1HE LYS 94 -10.449 13.643 0.185 640 HE3 LYS 94 2HE LYS 94 -11.077 12.110 -0.415 641 HZ1 LYS 94 1HZ LYS 94 -12.189 13.675 1.850 642 HZ2 LYS 94 2HZ LYS 94 -12.781 12.188 1.306 643 HZ3 LYS 94 3HZ LYS 94 -12.865 13.545 0.305 644 H LEU 95 H LEU 95 -8.432 7.478 2.792 645 HA LEU 95 HA LEU 95 -9.321 6.318 0.329 646 HB2 LEU 95 1HB LEU 95 -6.857 5.683 1.961 647 HB3 LEU 95 2HB LEU 95 -7.127 5.252 0.283 648 HG LEU 95 HG LEU 95 -6.806 8.056 1.365 649 HD11 LEU 95 1HD1 LEU 95 -4.724 6.791 1.315 650 HD12 LEU 95 2HD1 LEU 95 -4.728 8.066 0.097 651 HD13 LEU 95 3HD1 LEU 95 -5.000 6.390 -0.378 652 HD21 LEU 95 1HD2 LEU 95 -6.819 8.742 -0.991 653 HD22 LEU 95 2HD2 LEU 95 -8.356 8.034 -0.503 654 HD23 LEU 95 3HD2 LEU 95 -7.217 7.091 -1.463 655 H GLN 96 H GLN 96 -9.010 5.314 3.649 656 HA GLN 96 HA GLN 96 -9.517 2.557 3.358 657 HB2 GLN 96 1HB GLN 96 -8.747 3.948 5.411 658 HB3 GLN 96 2HB GLN 96 -10.453 4.241 5.677 659 HG2 GLN 96 1HG GLN 96 -9.369 1.452 5.484 660 HG3 GLN 96 2HG GLN 96 -9.294 2.371 6.982 661 HE21 GLN 96 1HE2 GLN 96 -11.261 0.536 4.871 662 HE22 GLN 96 2HE2 GLN 96 -12.724 0.625 5.796 663 H LYS 97 H LYS 97 -11.590 5.394 3.481 664 HA LYS 97 HA LYS 97 -14.032 3.872 3.503 665 HB2 LYS 97 1HB LYS 97 -13.766 6.189 4.454 666 HB3 LYS 97 2HB LYS 97 -13.655 6.789 2.809 667 HG2 LYS 97 1HG LYS 97 -16.026 5.164 3.580 668 HG3 LYS 97 2HG LYS 97 -15.919 6.833 4.130 669 HD2 LYS 97 1HD LYS 97 -15.661 7.578 1.810 670 HD3 LYS 97 2HD LYS 97 -15.767 5.903 1.263 671 HE2 LYS 97 1HE LYS 97 -18.023 5.749 2.209 672 HE3 LYS 97 2HE LYS 97 -17.914 7.427 2.734 673 HZ1 LYS 97 1HZ LYS 97 -19.137 7.233 0.669 674 HZ2 LYS 97 2HZ LYS 97 -17.819 6.490 -0.082 675 HZ3 LYS 97 3HZ LYS 97 -17.707 8.100 0.423 676 H TYR 98 H TYR 98 -11.888 5.147 1.088 677 HA TYR 98 HA TYR 98 -13.738 5.196 -1.072 678 HB2 TYR 98 1HB TYR 98 -11.581 6.470 -0.988 679 HB3 TYR 98 2HB TYR 98 -10.728 4.949 -1.224 680 HD1 TYR 98 HD1 TYR 98 -10.368 4.116 -3.390 681 HD2 TYR 98 HD2 TYR 98 -13.222 7.211 -2.791 682 HE1 TYR 98 HE1 TYR 98 -10.588 4.375 -5.825 683 HE2 TYR 98 HE2 TYR 98 -13.451 7.478 -5.223 684 HH TYR 98 HH TYR 98 -12.273 7.026 -7.241 685 H ALA 99 H ALA 99 -11.442 2.808 0.119 686 HA ALA 99 HA ALA 99 -12.646 0.805 -1.692 687 HB1 ALA 99 1HB ALA 99 -10.397 0.978 -2.356 688 HB2 ALA 99 2HB ALA 99 -10.426 -0.418 -1.275 689 HB3 ALA 99 3HB ALA 99 -9.831 1.135 -0.694 690 H ASP 100 H ASP 100 -13.391 -1.106 -0.696 691 HA ASP 100 HA ASP 100 -13.672 -0.904 2.174 692 HB2 ASP 100 1HB ASP 100 -14.470 -3.165 0.317 693 HB3 ASP 100 2HB ASP 100 -14.926 -3.021 2.006 694 H ALA 101 H ALA 101 -11.735 -1.087 3.051 695 HA ALA 101 HA ALA 101 -10.625 -3.622 3.563 696 HB1 ALA 101 1HB ALA 101 -9.006 -1.859 1.717 697 HB2 ALA 101 2HB ALA 101 -9.730 -3.408 1.286 698 HB3 ALA 101 3HB ALA 101 -8.440 -3.342 2.486 699 H GLU 102 H GLU 102 -9.123 -3.493 5.248 700 HA GLU 102 HA GLU 102 -9.000 -0.932 6.574 701 HB2 GLU 102 1HB GLU 102 -7.704 -3.569 7.258 702 HB3 GLU 102 2HB GLU 102 -7.693 -2.138 8.269 703 HG2 GLU 102 1HG GLU 102 -10.101 -3.737 7.461 704 HG3 GLU 102 2HG GLU 102 -9.341 -3.685 9.045 705 H VAL 103 H VAL 103 -7.845 0.360 5.204 706 HA VAL 103 HA VAL 103 -5.226 -0.536 4.312 707 HB VAL 103 HB VAL 103 -6.870 0.747 2.794 708 HG11 VAL 103 1HG1 VAL 103 -6.941 3.083 2.867 709 HG12 VAL 103 2HG1 VAL 103 -5.624 3.173 4.046 710 HG13 VAL 103 3HG1 VAL 103 -7.219 2.572 4.535 711 HG21 VAL 103 1HG2 VAL 103 -5.088 1.720 1.545 712 HG22 VAL 103 2HG2 VAL 103 -4.479 0.250 2.305 713 HG23 VAL 103 3HG2 VAL 103 -4.071 1.825 2.980 714 H ARG 104 H ARG 104 -3.338 0.359 4.875 715 HA ARG 104 HA ARG 104 -3.391 2.460 6.916 716 HB2 ARG 104 1HB ARG 104 -1.282 1.525 7.785 717 HB3 ARG 104 2HB ARG 104 -2.644 0.425 7.946 718 HG2 ARG 104 1HG ARG 104 -1.881 -0.789 5.965 719 HG3 ARG 104 2HG ARG 104 -0.497 0.301 5.845 720 HD2 ARG 104 1HD ARG 104 0.121 -1.747 6.946 721 HD3 ARG 104 2HD ARG 104 0.238 -0.400 8.066 722 HE ARG 104 HE ARG 104 -2.297 -1.675 8.234 723 HH11 ARG 104 1HH1 ARG 104 1.052 -2.049 9.177 724 HH12 ARG 104 2HH1 ARG 104 0.680 -2.996 10.583 725 HH21 ARG 104 1HH2 ARG 104 -2.791 -2.914 10.088 726 HH22 ARG 104 2HH2 ARG 104 -1.498 -3.487 11.106 727 H VAL 105 H VAL 105 -2.665 4.323 6.094 728 HA VAL 105 HA VAL 105 -1.000 4.158 3.718 729 HB VAL 105 HB VAL 105 -1.394 6.500 3.349 730 HG11 VAL 105 1HG1 VAL 105 -3.127 5.035 2.569 731 HG12 VAL 105 2HG1 VAL 105 -3.863 6.518 3.175 732 HG13 VAL 105 3HG1 VAL 105 -3.910 5.047 4.148 733 HG21 VAL 105 1HG2 VAL 105 -2.837 7.827 4.868 734 HG22 VAL 105 2HG2 VAL 105 -1.281 7.388 5.571 735 HG23 VAL 105 3HG2 VAL 105 -2.738 6.515 6.043 736 H ARG 106 H ARG 106 1.172 4.538 3.776 737 HA ARG 106 HA ARG 106 2.274 5.607 6.289 738 HB2 ARG 106 1HB ARG 106 3.273 3.183 4.780 739 HB3 ARG 106 2HB ARG 106 4.099 3.926 6.141 740 HG2 ARG 106 1HG ARG 106 1.369 2.652 6.220 741 HG3 ARG 106 2HG ARG 106 2.867 1.935 6.818 742 HD2 ARG 106 1HD ARG 106 3.086 3.729 8.452 743 HD3 ARG 106 2HD ARG 106 1.622 4.488 7.836 744 HE ARG 106 HE ARG 106 1.774 1.999 9.389 745 HH11 ARG 106 1HH1 ARG 106 -0.141 4.497 7.873 746 HH12 ARG 106 2HH1 ARG 106 -1.603 4.087 8.720 747 HH21 ARG 106 1HH2 ARG 106 -0.139 1.455 10.529 748 HH22 ARG 106 2HH2 ARG 106 -1.595 2.360 10.244 749 H THR 107 H THR 107 4.115 6.803 6.147 750 HA THR 107 HA THR 107 5.012 7.478 3.427 751 HB THR 107 HB THR 107 3.706 9.311 4.385 752 HG1 THR 107 HG1 THR 107 5.157 10.884 3.937 753 HG21 THR 107 1HG2 THR 107 4.473 10.513 6.381 754 HG22 THR 107 2HG2 THR 107 5.725 9.296 6.629 755 HG23 THR 107 3HG2 THR 107 4.024 8.850 6.755 756 H VAL 108 H VAL 108 7.208 7.632 3.094 757 HA VAL 108 HA VAL 108 8.908 6.998 5.416 758 HB VAL 108 HB VAL 108 10.322 5.597 3.994 759 HG11 VAL 108 1HG1 VAL 108 8.562 4.519 5.262 760 HG12 VAL 108 2HG1 VAL 108 8.785 3.701 3.717 761 HG13 VAL 108 3HG1 VAL 108 7.419 4.791 3.948 762 HG21 VAL 108 1HG2 VAL 108 9.914 6.647 1.845 763 HG22 VAL 108 2HG2 VAL 108 8.244 6.082 1.863 764 HG23 VAL 108 3HG2 VAL 108 9.566 4.920 1.757 765 H THR 109 H THR 109 11.239 7.458 4.997 766 HA THR 109 HA THR 109 11.573 9.772 3.201 767 HB THR 109 HB THR 109 13.251 10.650 4.814 768 HG1 THR 109 HG1 THR 109 12.620 8.256 6.094 769 HG21 THR 109 1HG2 THR 109 10.517 10.213 6.023 770 HG22 THR 109 2HG2 THR 109 10.936 11.476 4.867 771 HG23 THR 109 3HG2 THR 109 11.664 11.475 6.473 772 H SER 110 H SER 110 12.288 6.637 3.596 773 HA SER 110 HA SER 110 14.561 6.682 1.894 774 HB2 SER 110 1HB SER 110 16.092 5.500 3.517 775 HB3 SER 110 2HB SER 110 15.809 7.200 3.872 776 HG SER 110 HG SER 110 14.024 6.278 5.280 777 HA PRO 111 HA PRO 111 13.165 2.766 0.536 778 HB2 PRO 111 1HB PRO 111 15.929 1.789 1.124 779 HB3 PRO 111 2HB PRO 111 14.946 1.562 -0.328 780 HG2 PRO 111 1HG PRO 111 16.887 3.362 -0.306 781 HG3 PRO 111 2HG PRO 111 15.333 3.732 -1.079 782 HD2 PRO 111 1HD PRO 111 16.434 4.689 1.516 783 HD3 PRO 111 2HD PRO 111 15.372 5.519 0.363 784 H ASP 112 H ASP 112 15.347 2.390 3.352 785 HA ASP 112 HA ASP 112 14.548 -0.244 3.891 786 HB2 ASP 112 1HB ASP 112 16.673 0.773 4.669 787 HB3 ASP 112 2HB ASP 112 15.755 1.694 5.856 788 H GLU 113 H GLU 113 13.204 2.792 4.977 789 HA GLU 113 HA GLU 113 11.705 1.829 7.146 790 HB2 GLU 113 1HB GLU 113 11.123 4.090 5.237 791 HB3 GLU 113 2HB GLU 113 10.219 3.789 6.713 792 HG2 GLU 113 1HG GLU 113 12.166 4.200 8.052 793 HG3 GLU 113 2HG GLU 113 13.172 4.344 6.608 794 H ALA 114 H ALA 114 10.967 2.020 3.695 795 HA ALA 114 HA ALA 114 8.305 1.118 3.829 796 HB1 ALA 114 1HB ALA 114 10.288 0.778 1.579 797 HB2 ALA 114 2HB ALA 114 9.256 2.184 1.837 798 HB3 ALA 114 3HB ALA 114 8.535 0.620 1.453 799 H LYS 115 H LYS 115 11.380 -0.565 3.614 800 HA LYS 115 HA LYS 115 10.429 -3.177 3.224 801 HB2 LYS 115 1HB LYS 115 12.919 -2.155 4.601 802 HB3 LYS 115 2HB LYS 115 12.624 -3.854 4.261 803 HG2 LYS 115 1HG LYS 115 12.676 -3.480 1.915 804 HG3 LYS 115 2HG LYS 115 12.670 -1.732 2.133 805 HD2 LYS 115 1HD LYS 115 14.895 -2.602 1.529 806 HD3 LYS 115 2HD LYS 115 14.891 -1.811 3.096 807 HE2 LYS 115 1HE LYS 115 14.507 -4.764 2.932 808 HE3 LYS 115 2HE LYS 115 16.123 -4.084 2.765 809 HZ1 LYS 115 1HZ LYS 115 14.299 -3.776 5.090 810 HZ2 LYS 115 2HZ LYS 115 15.767 -2.953 4.926 811 HZ3 LYS 115 3HZ LYS 115 15.749 -4.642 5.041 812 H ARG 116 H ARG 116 10.883 -1.246 6.125 813 HA ARG 116 HA ARG 116 10.299 -3.268 8.017 814 HB2 ARG 116 1HB ARG 116 10.057 -0.265 8.135 815 HB3 ARG 116 2HB ARG 116 9.723 -1.306 9.509 816 HG2 ARG 116 1HG ARG 116 12.009 -2.098 9.505 817 HG3 ARG 116 2HG ARG 116 12.358 -1.136 8.065 818 HD2 ARG 116 1HD ARG 116 13.097 -0.096 10.217 819 HD3 ARG 116 2HD ARG 116 12.011 0.899 9.249 820 HE ARG 116 HE ARG 116 10.907 -0.734 11.421 821 HH11 ARG 116 1HH1 ARG 116 11.671 2.407 10.094 822 HH12 ARG 116 2HH1 ARG 116 10.638 3.270 11.188 823 HH21 ARG 116 1HH2 ARG 116 9.527 0.404 12.871 824 HH22 ARG 116 2HH2 ARG 116 9.421 2.135 12.763 825 H TRP 117 H TRP 117 8.285 -0.692 6.618 826 HA TRP 117 HA TRP 117 5.924 -1.311 7.959 827 HB2 TRP 117 1HB TRP 117 6.301 -0.060 5.231 828 HB3 TRP 117 2HB TRP 117 4.766 -0.111 6.093 829 HD1 TRP 117 HD1 TRP 117 7.376 2.240 5.434 830 HE1 TRP 117 HE1 TRP 117 7.550 4.061 7.251 831 HE3 TRP 117 HE3 TRP 117 4.628 -0.013 9.107 832 HZ2 TRP 117 HZ2 TRP 117 6.637 4.481 9.884 833 HZ3 TRP 117 HZ3 TRP 117 4.326 1.165 11.240 834 HH2 TRP 117 HH2 TRP 117 5.308 3.365 11.622 835 H ILE 118 H ILE 118 7.206 -2.575 4.932 836 HA ILE 118 HA ILE 118 4.974 -4.090 4.151 837 HB ILE 118 HB ILE 118 7.918 -4.472 3.618 838 HG12 ILE 118 1HG1 ILE 118 5.663 -3.502 1.847 839 HG13 ILE 118 2HG1 ILE 118 6.799 -2.453 2.688 840 HG21 ILE 118 1HG2 ILE 118 6.890 -6.645 3.430 841 HG22 ILE 118 2HG2 ILE 118 7.243 -6.027 1.816 842 HG23 ILE 118 3HG2 ILE 118 5.594 -5.984 2.438 843 HD11 ILE 118 1HD1 ILE 118 7.507 -4.471 0.571 844 HD12 ILE 118 2HD1 ILE 118 8.635 -3.398 1.403 845 HD13 ILE 118 3HD1 ILE 118 7.392 -2.725 0.349 846 H LYS 119 H LYS 119 7.760 -4.950 6.183 847 HA LYS 119 HA LYS 119 6.993 -7.658 6.525 848 HB2 LYS 119 1HB LYS 119 9.276 -7.109 6.890 849 HB3 LYS 119 2HB LYS 119 8.863 -5.859 8.055 850 HG2 LYS 119 1HG LYS 119 8.232 -7.469 9.684 851 HG3 LYS 119 2HG LYS 119 8.314 -8.782 8.508 852 HD2 LYS 119 1HD LYS 119 10.730 -7.119 9.120 853 HD3 LYS 119 2HD LYS 119 10.274 -8.461 10.167 854 HE2 LYS 119 1HE LYS 119 10.724 -8.690 7.195 855 HE3 LYS 119 2HE LYS 119 11.938 -9.063 8.417 856 HZ1 LYS 119 1HZ LYS 119 9.298 -10.407 8.170 857 HZ2 LYS 119 2HZ LYS 119 10.509 -10.784 9.287 858 HZ3 LYS 119 3HZ LYS 119 10.773 -11.046 7.637 859 H GLU 120 H GLU 120 6.538 -4.759 8.513 860 HA GLU 120 HA GLU 120 5.250 -6.051 10.662 861 HB2 GLU 120 1HB GLU 120 5.057 -3.195 9.706 862 HB3 GLU 120 2HB GLU 120 4.428 -3.777 11.240 863 HG2 GLU 120 1HG GLU 120 6.698 -4.411 11.916 864 HG3 GLU 120 2HG GLU 120 7.315 -3.778 10.391 865 H PHE 121 H PHE 121 4.119 -4.989 7.569 866 HA PHE 121 HA PHE 121 1.322 -5.057 8.250 867 HB2 PHE 121 1HB PHE 121 2.056 -3.524 6.544 868 HB3 PHE 121 2HB PHE 121 2.788 -4.828 5.620 869 HD1 PHE 121 HD1 PHE 121 -0.529 -3.806 6.982 870 HD2 PHE 121 HD2 PHE 121 1.639 -5.671 3.832 871 HE1 PHE 121 HE1 PHE 121 -2.608 -4.047 5.697 872 HE2 PHE 121 HE2 PHE 121 -0.439 -5.917 2.542 873 HZ PHE 121 HZ PHE 121 -2.567 -5.106 3.474 874 H SER 122 H SER 122 3.522 -7.095 6.339 875 HA SER 122 HA SER 122 1.569 -9.022 5.659 876 HB2 SER 122 1HB SER 122 3.645 -10.475 5.220 877 HB3 SER 122 2HB SER 122 3.483 -8.984 4.292 878 HG SER 122 HG SER 122 5.006 -8.017 5.569 879 H GLU 123 H GLU 123 3.719 -8.659 8.400 880 HA GLU 123 HA GLU 123 2.639 -11.129 9.550 881 HB2 GLU 123 1HB GLU 123 5.016 -9.441 10.328 882 HB3 GLU 123 2HB GLU 123 4.436 -10.803 11.277 883 HG2 GLU 123 1HG GLU 123 4.788 -12.270 9.327 884 HG3 GLU 123 2HG GLU 123 5.457 -10.897 8.449 885 H GLU 124 H GLU 124 0.992 -8.840 9.314 886 HA GLU 124 HA GLU 124 0.656 -7.945 12.075 887 HB2 GLU 124 1HB GLU 124 0.386 -6.308 10.210 888 HB3 GLU 124 2HB GLU 124 -0.967 -7.254 9.612 889 HG2 GLU 124 1HG GLU 124 -1.940 -5.492 10.789 890 HG3 GLU 124 2HG GLU 124 -2.041 -6.870 11.882 Start of MODEL 3 1 HA MET 21 HA MET 21 -8.034 -12.773 3.300 2 HB2 MET 21 1HB MET 21 -7.440 -10.921 4.724 3 HB3 MET 21 2HB MET 21 -7.609 -12.357 5.720 4 HG2 MET 21 1HG MET 21 -5.009 -11.151 4.795 5 HG3 MET 21 2HG MET 21 -5.713 -10.980 6.399 6 HE1 MET 21 1HE MET 21 -5.926 -12.973 8.147 7 HE2 MET 21 2HE MET 21 -5.469 -14.638 7.791 8 HE3 MET 21 3HE MET 21 -6.847 -13.906 6.968 9 H THR 22 H THR 22 -7.641 -11.355 1.654 10 HA THR 22 HA THR 22 -5.159 -11.731 0.260 11 HB THR 22 HB THR 22 -7.303 -9.748 -0.498 12 HG1 THR 22 HG1 THR 22 -7.390 -12.520 -0.427 13 HG21 THR 22 1HG2 THR 22 -5.213 -9.676 -1.775 14 HG22 THR 22 2HG2 THR 22 -6.542 -10.271 -2.772 15 HG23 THR 22 3HG2 THR 22 -5.357 -11.400 -2.116 16 H LEU 23 H LEU 23 -3.387 -10.537 0.443 17 HA LEU 23 HA LEU 23 -3.581 -7.965 1.847 18 HB2 LEU 23 1HB LEU 23 -1.148 -9.678 1.354 19 HB3 LEU 23 2HB LEU 23 -1.213 -8.229 2.335 20 HG LEU 23 HG LEU 23 -2.535 -10.873 2.942 21 HD11 LEU 23 1HD1 LEU 23 -1.015 -10.879 4.859 22 HD12 LEU 23 2HD1 LEU 23 -0.293 -9.374 4.287 23 HD13 LEU 23 3HD1 LEU 23 -0.137 -10.848 3.330 24 HD21 LEU 23 1HD2 LEU 23 -2.611 -8.277 4.472 25 HD22 LEU 23 2HD2 LEU 23 -3.201 -9.831 5.062 26 HD23 LEU 23 3HD2 LEU 23 -3.972 -9.066 3.673 27 H PHE 24 H PHE 24 -3.193 -6.136 0.799 28 HA PHE 24 HA PHE 24 -1.880 -6.281 -1.846 29 HB2 PHE 24 1HB PHE 24 -3.903 -4.232 -0.916 30 HB3 PHE 24 2HB PHE 24 -3.198 -4.351 -2.521 31 HD1 PHE 24 HD1 PHE 24 -3.979 -5.979 -4.101 32 HD2 PHE 24 HD2 PHE 24 -5.604 -5.792 -0.174 33 HE1 PHE 24 HE1 PHE 24 -5.846 -7.401 -4.812 34 HE2 PHE 24 HE2 PHE 24 -7.480 -7.216 -0.878 35 HZ PHE 24 HZ PHE 24 -7.604 -8.021 -3.202 36 H VAL 25 H VAL 25 -0.320 -4.722 -2.319 37 HA VAL 25 HA VAL 25 0.070 -2.638 -0.306 38 HB VAL 25 HB VAL 25 1.803 -4.171 0.277 39 HG11 VAL 25 1HG1 VAL 25 3.451 -5.018 -1.259 40 HG12 VAL 25 2HG1 VAL 25 2.723 -4.121 -2.588 41 HG13 VAL 25 3HG1 VAL 25 1.841 -5.450 -1.837 42 HG21 VAL 25 1HG2 VAL 25 2.497 -1.908 0.412 43 HG22 VAL 25 2HG2 VAL 25 2.779 -1.815 -1.325 44 HG23 VAL 25 3HG2 VAL 25 3.841 -2.798 -0.308 45 H LEU 26 H LEU 26 0.309 -0.727 -1.058 46 HA LEU 26 HA LEU 26 0.719 -0.333 -3.947 47 HB2 LEU 26 1HB LEU 26 -0.991 1.071 -1.922 48 HB3 LEU 26 2HB LEU 26 -0.426 1.921 -3.338 49 HG LEU 26 HG LEU 26 -1.609 0.298 -4.774 50 HD11 LEU 26 1HD1 LEU 26 -2.650 -0.818 -2.186 51 HD12 LEU 26 2HD1 LEU 26 -1.551 -1.635 -3.297 52 HD13 LEU 26 3HD1 LEU 26 -3.199 -1.259 -3.802 53 HD21 LEU 26 1HD2 LEU 26 -2.727 2.346 -4.127 54 HD22 LEU 26 2HD2 LEU 26 -3.314 1.583 -2.653 55 HD23 LEU 26 3HD2 LEU 26 -3.883 1.019 -4.223 56 H ILE 27 H ILE 27 1.904 1.624 -4.501 57 HA ILE 27 HA ILE 27 3.213 3.033 -2.337 58 HB ILE 27 HB ILE 27 4.776 1.213 -2.673 59 HG12 ILE 27 1HG1 ILE 27 5.837 3.727 -3.979 60 HG13 ILE 27 2HG1 ILE 27 5.672 3.485 -2.243 61 HG21 ILE 27 1HG2 ILE 27 4.154 0.542 -4.920 62 HG22 ILE 27 2HG2 ILE 27 5.891 0.827 -4.819 63 HG23 ILE 27 3HG2 ILE 27 4.842 2.029 -5.572 64 HD11 ILE 27 1HD1 ILE 27 7.962 3.149 -2.969 65 HD12 ILE 27 2HD1 ILE 27 7.436 1.892 -4.088 66 HD13 ILE 27 3HD1 ILE 27 7.274 1.649 -2.348 67 H LEU 28 H LEU 28 3.134 5.149 -2.806 68 HA LEU 28 HA LEU 28 3.144 5.895 -5.665 69 HB2 LEU 28 1HB LEU 28 1.361 6.617 -3.749 70 HB3 LEU 28 2HB LEU 28 2.532 7.909 -3.578 71 HG LEU 28 HG LEU 28 2.253 8.394 -6.018 72 HD11 LEU 28 1HD1 LEU 28 0.194 6.244 -5.700 73 HD12 LEU 28 2HD1 LEU 28 1.446 6.402 -6.930 74 HD13 LEU 28 3HD1 LEU 28 0.049 7.481 -6.943 75 HD21 LEU 28 1HD2 LEU 28 -0.231 8.533 -4.316 76 HD22 LEU 28 2HD2 LEU 28 0.088 9.499 -5.757 77 HD23 LEU 28 3HD2 LEU 28 1.091 9.701 -4.320 78 H SER 29 H SER 29 5.423 5.427 -5.516 79 HA SER 29 HA SER 29 6.916 7.863 -5.054 80 HB2 SER 29 1HB SER 29 7.762 5.207 -3.851 81 HB3 SER 29 2HB SER 29 8.732 6.678 -3.858 82 HG SER 29 HG SER 29 6.301 7.208 -2.862 83 H ASN 30 H ASN 30 8.618 8.045 -6.641 84 HA ASN 30 HA ASN 30 9.152 5.504 -8.032 85 HB2 ASN 30 1HB ASN 30 7.905 6.948 -9.551 86 HB3 ASN 30 2HB ASN 30 9.055 8.255 -9.287 87 HD21 ASN 30 1HD2 ASN 30 9.547 8.373 -11.470 88 HD22 ASN 30 2HD2 ASN 30 10.516 7.180 -12.263 89 H ASP 31 H ASP 31 10.829 5.255 -6.477 90 HA ASP 31 HA ASP 31 13.277 6.384 -7.647 91 HB2 ASP 31 1HB ASP 31 13.197 6.831 -5.222 92 HB3 ASP 31 2HB ASP 31 12.956 5.114 -4.912 93 H LYS 32 H LYS 32 14.545 4.943 -8.704 94 HA LYS 32 HA LYS 32 13.299 2.533 -9.492 95 HB2 LYS 32 1HB LYS 32 16.121 3.462 -9.983 96 HB3 LYS 32 2HB LYS 32 15.286 2.177 -10.853 97 HG2 LYS 32 1HG LYS 32 13.517 4.029 -11.323 98 HG3 LYS 32 2HG LYS 32 14.852 5.122 -10.955 99 HD2 LYS 32 1HD LYS 32 16.206 4.078 -12.677 100 HD3 LYS 32 2HD LYS 32 14.908 2.924 -13.003 101 HE2 LYS 32 1HE LYS 32 13.439 4.768 -13.663 102 HE3 LYS 32 2HE LYS 32 14.737 5.916 -13.345 103 HZ1 LYS 32 1HZ LYS 32 14.807 3.757 -15.377 104 HZ2 LYS 32 2HZ LYS 32 16.041 4.876 -15.084 105 HZ3 LYS 32 3HZ LYS 32 14.552 5.399 -15.691 106 H LYS 33 H LYS 33 15.677 3.251 -7.045 107 HA LYS 33 HA LYS 33 16.378 0.437 -6.757 108 HB2 LYS 33 1HB LYS 33 18.141 2.156 -6.601 109 HB3 LYS 33 2HB LYS 33 17.333 2.849 -5.204 110 HG2 LYS 33 1HG LYS 33 17.784 0.930 -3.884 111 HG3 LYS 33 2HG LYS 33 18.333 0.017 -5.288 112 HD2 LYS 33 1HD LYS 33 20.238 0.755 -3.983 113 HD3 LYS 33 2HD LYS 33 20.220 1.578 -5.542 114 HE2 LYS 33 1HE LYS 33 20.784 3.125 -3.756 115 HE3 LYS 33 2HE LYS 33 19.241 3.555 -4.488 116 HZ1 LYS 33 1HZ LYS 33 18.085 2.624 -2.641 117 HZ2 LYS 33 2HZ LYS 33 19.266 3.668 -2.031 118 HZ3 LYS 33 3HZ LYS 33 19.509 1.995 -1.978 119 H LEU 34 H LEU 34 14.614 2.971 -5.066 120 HA LEU 34 HA LEU 34 14.057 1.555 -2.694 121 HB2 LEU 34 1HB LEU 34 13.693 4.037 -3.234 122 HB3 LEU 34 2HB LEU 34 12.194 3.537 -3.988 123 HG LEU 34 HG LEU 34 12.801 2.931 -1.100 124 HD11 LEU 34 1HD1 LEU 34 11.503 4.912 -0.520 125 HD12 LEU 34 2HD1 LEU 34 11.392 5.345 -2.226 126 HD13 LEU 34 3HD1 LEU 34 12.958 5.342 -1.417 127 HD21 LEU 34 1HD2 LEU 34 10.369 2.783 -0.920 128 HD22 LEU 34 2HD2 LEU 34 10.987 1.648 -2.120 129 HD23 LEU 34 3HD2 LEU 34 10.215 3.147 -2.639 130 H ILE 35 H ILE 35 12.246 1.826 -5.744 131 HA ILE 35 HA ILE 35 10.045 0.258 -5.042 132 HB ILE 35 HB ILE 35 11.345 0.650 -7.743 133 HG12 ILE 35 1HG1 ILE 35 8.856 1.848 -6.504 134 HG13 ILE 35 2HG1 ILE 35 10.406 2.666 -6.663 135 HG21 ILE 35 1HG2 ILE 35 10.085 -1.433 -7.777 136 HG22 ILE 35 2HG2 ILE 35 9.259 -0.195 -8.723 137 HG23 ILE 35 3HG2 ILE 35 8.675 -0.608 -7.111 138 HD11 ILE 35 1HD1 ILE 35 8.819 3.370 -8.371 139 HD12 ILE 35 2HD1 ILE 35 8.692 1.707 -8.942 140 HD13 ILE 35 3HD1 ILE 35 10.222 2.573 -9.082 141 H GLU 36 H GLU 36 13.196 -0.688 -6.366 142 HA GLU 36 HA GLU 36 12.782 -3.422 -6.614 143 HB2 GLU 36 1HB GLU 36 15.194 -1.772 -5.945 144 HB3 GLU 36 2HB GLU 36 15.294 -3.528 -5.931 145 HG2 GLU 36 1HG GLU 36 14.318 -1.945 -8.276 146 HG3 GLU 36 2HG GLU 36 15.999 -2.423 -8.061 147 H GLU 37 H GLU 37 14.205 -1.761 -3.795 148 HA GLU 37 HA GLU 37 14.354 -4.021 -2.166 149 HB2 GLU 37 1HB GLU 37 14.178 -1.086 -1.495 150 HB3 GLU 37 2HB GLU 37 14.421 -2.322 -0.271 151 HG2 GLU 37 1HG GLU 37 16.237 -1.881 -2.626 152 HG3 GLU 37 2HG GLU 37 16.502 -1.213 -1.016 153 H ALA 38 H ALA 38 11.739 -1.664 -2.531 154 HA ALA 38 HA ALA 38 10.132 -2.575 -0.409 155 HB1 ALA 38 1HB ALA 38 9.723 -0.457 -1.565 156 HB2 ALA 38 2HB ALA 38 8.279 -1.471 -1.566 157 HB3 ALA 38 3HB ALA 38 9.263 -1.335 -3.024 158 H ARG 39 H ARG 39 10.297 -3.564 -3.818 159 HA ARG 39 HA ARG 39 8.210 -5.487 -3.541 160 HB2 ARG 39 1HB ARG 39 8.861 -4.474 -5.724 161 HB3 ARG 39 2HB ARG 39 10.357 -5.396 -5.664 162 HG2 ARG 39 1HG ARG 39 9.022 -7.489 -5.615 163 HG3 ARG 39 2HG ARG 39 7.562 -6.512 -5.784 164 HD2 ARG 39 1HD ARG 39 9.837 -6.440 -7.750 165 HD3 ARG 39 2HD ARG 39 8.438 -7.496 -7.919 166 HE ARG 39 HE ARG 39 7.092 -5.381 -7.911 167 HH11 ARG 39 1HH1 ARG 39 10.426 -5.408 -8.975 168 HH12 ARG 39 2HH1 ARG 39 10.235 -4.046 -10.029 169 HH21 ARG 39 1HH2 ARG 39 6.831 -3.585 -9.302 170 HH22 ARG 39 2HH2 ARG 39 8.182 -3.006 -10.219 171 H LYS 40 H LYS 40 11.663 -5.536 -2.986 172 HA LYS 40 HA LYS 40 12.134 -8.285 -3.109 173 HB2 LYS 40 1HB LYS 40 13.366 -6.370 -1.114 174 HB3 LYS 40 2HB LYS 40 14.018 -7.925 -1.604 175 HG2 LYS 40 1HG LYS 40 13.835 -5.399 -3.219 176 HG3 LYS 40 2HG LYS 40 15.279 -6.292 -2.735 177 HD2 LYS 40 1HD LYS 40 14.593 -8.144 -4.193 178 HD3 LYS 40 2HD LYS 40 13.158 -7.221 -4.643 179 HE2 LYS 40 1HE LYS 40 14.625 -5.434 -5.515 180 HE3 LYS 40 2HE LYS 40 16.019 -6.458 -5.177 181 HZ1 LYS 40 1HZ LYS 40 15.250 -8.054 -6.753 182 HZ2 LYS 40 2HZ LYS 40 15.251 -6.537 -7.510 183 HZ3 LYS 40 3HZ LYS 40 13.795 -7.222 -6.986 184 H MET 41 H MET 41 10.858 -6.286 -0.514 185 HA MET 41 HA MET 41 10.566 -8.495 1.302 186 HB2 MET 41 1HB MET 41 9.660 -5.628 1.353 187 HB3 MET 41 2HB MET 41 9.165 -6.778 2.589 188 HG2 MET 41 1HG MET 41 12.015 -6.125 1.899 189 HG3 MET 41 2HG MET 41 11.107 -5.406 3.229 190 HE1 MET 41 1HE MET 41 13.615 -7.809 5.060 191 HE2 MET 41 2HE MET 41 12.969 -6.169 4.995 192 HE3 MET 41 3HE MET 41 13.899 -6.805 3.638 193 H ALA 42 H ALA 42 8.362 -6.535 -0.676 194 HA ALA 42 HA ALA 42 6.001 -7.792 0.227 195 HB1 ALA 42 1HB ALA 42 6.462 -6.304 -2.346 196 HB2 ALA 42 2HB ALA 42 6.001 -5.585 -0.801 197 HB3 ALA 42 3HB ALA 42 4.899 -6.686 -1.626 198 H GLU 43 H GLU 43 8.182 -8.506 -2.436 199 HA GLU 43 HA GLU 43 6.572 -10.342 -3.817 200 HB2 GLU 43 1HB GLU 43 9.014 -9.296 -4.258 201 HB3 GLU 43 2HB GLU 43 9.489 -10.874 -3.651 202 HG2 GLU 43 1HG GLU 43 7.620 -10.419 -5.959 203 HG3 GLU 43 2HG GLU 43 9.341 -10.754 -6.109 204 H LYS 44 H LYS 44 9.047 -10.829 -1.311 205 HA LYS 44 HA LYS 44 8.530 -13.625 -1.052 206 HB2 LYS 44 1HB LYS 44 10.121 -11.640 0.534 207 HB3 LYS 44 2HB LYS 44 9.839 -13.253 1.172 208 HG2 LYS 44 1HG LYS 44 11.974 -13.183 0.073 209 HG3 LYS 44 2HG LYS 44 10.876 -14.207 -0.851 210 HD2 LYS 44 1HD LYS 44 10.470 -12.342 -2.398 211 HD3 LYS 44 2HD LYS 44 11.597 -11.344 -1.478 212 HE2 LYS 44 1HE LYS 44 12.267 -13.909 -2.913 213 HE3 LYS 44 2HE LYS 44 12.654 -12.284 -3.471 214 HZ1 LYS 44 1HZ LYS 44 14.039 -11.986 -1.513 215 HZ2 LYS 44 2HZ LYS 44 14.549 -13.321 -2.413 216 HZ3 LYS 44 3HZ LYS 44 13.671 -13.549 -0.988 217 H ALA 45 H ALA 45 7.138 -10.778 0.333 218 HA ALA 45 HA ALA 45 5.851 -12.165 2.505 219 HB1 ALA 45 1HB ALA 45 5.448 -9.387 1.426 220 HB2 ALA 45 2HB ALA 45 6.434 -9.848 2.812 221 HB3 ALA 45 3HB ALA 45 4.681 -10.026 2.878 222 H ASN 46 H ASN 46 5.385 -12.045 -0.743 223 HA ASN 46 HA ASN 46 3.767 -12.725 -2.159 224 HB2 ASN 46 1HB ASN 46 2.481 -13.810 0.350 225 HB3 ASN 46 2HB ASN 46 1.941 -14.170 -1.285 226 HD21 ASN 46 1HD2 ASN 46 3.251 -15.453 -2.620 227 HD22 ASN 46 2HD2 ASN 46 4.478 -16.477 -1.962 228 H LEU 47 H LEU 47 3.686 -10.097 -1.044 229 HA LEU 47 HA LEU 47 0.871 -9.469 -0.719 230 HB2 LEU 47 1HB LEU 47 3.212 -7.586 -0.975 231 HB3 LEU 47 2HB LEU 47 1.606 -7.191 -0.411 232 HG LEU 47 HG LEU 47 3.588 -8.953 1.023 233 HD11 LEU 47 1HD1 LEU 47 3.688 -7.130 2.638 234 HD12 LEU 47 2HD1 LEU 47 2.598 -6.173 1.633 235 HD13 LEU 47 3HD1 LEU 47 4.204 -6.594 1.038 236 HD21 LEU 47 1HD2 LEU 47 1.983 -8.872 2.874 237 HD22 LEU 47 2HD2 LEU 47 1.312 -9.672 1.452 238 HD23 LEU 47 3HD2 LEU 47 0.844 -8.016 1.836 239 H ILE 48 H ILE 48 -0.419 -8.588 -2.266 240 HA ILE 48 HA ILE 48 0.482 -8.585 -4.988 241 HB ILE 48 HB ILE 48 -2.094 -7.504 -3.822 242 HG12 ILE 48 1HG1 ILE 48 -1.471 -10.160 -5.139 243 HG13 ILE 48 2HG1 ILE 48 -1.798 -9.911 -3.428 244 HG21 ILE 48 1HG2 ILE 48 -1.360 -8.129 -6.683 245 HG22 ILE 48 2HG2 ILE 48 -1.590 -6.521 -5.997 246 HG23 ILE 48 3HG2 ILE 48 -2.954 -7.633 -6.114 247 HD11 ILE 48 1HD1 ILE 48 -3.733 -10.817 -4.564 248 HD12 ILE 48 2HD1 ILE 48 -3.734 -9.457 -5.685 249 HD13 ILE 48 3HD1 ILE 48 -4.067 -9.190 -3.974 250 H LEU 49 H LEU 49 2.041 -7.122 -5.358 251 HA LEU 49 HA LEU 49 1.863 -4.441 -4.283 252 HB2 LEU 49 1HB LEU 49 4.022 -5.543 -4.272 253 HB3 LEU 49 2HB LEU 49 3.939 -5.795 -6.004 254 HG LEU 49 HG LEU 49 3.994 -3.306 -6.302 255 HD11 LEU 49 1HD1 LEU 49 4.646 -3.325 -3.361 256 HD12 LEU 49 2HD1 LEU 49 3.187 -2.659 -4.096 257 HD13 LEU 49 3HD1 LEU 49 4.757 -1.935 -4.438 258 HD21 LEU 49 1HD2 LEU 49 5.994 -4.650 -6.584 259 HD22 LEU 49 2HD2 LEU 49 6.319 -4.561 -4.854 260 HD23 LEU 49 3HD2 LEU 49 6.390 -3.101 -5.840 261 H ILE 50 H ILE 50 0.970 -2.806 -5.288 262 HA ILE 50 HA ILE 50 0.835 -2.869 -8.234 263 HB ILE 50 HB ILE 50 -1.036 -1.296 -6.462 264 HG12 ILE 50 1HG1 ILE 50 -1.567 -3.992 -7.740 265 HG13 ILE 50 2HG1 ILE 50 -1.255 -3.748 -6.026 266 HG21 ILE 50 1HG2 ILE 50 -2.410 -1.227 -8.503 267 HG22 ILE 50 2HG2 ILE 50 -1.161 -2.130 -9.361 268 HG23 ILE 50 3HG2 ILE 50 -0.818 -0.510 -8.753 269 HD11 ILE 50 1HD1 ILE 50 -3.272 -2.394 -5.849 270 HD12 ILE 50 2HD1 ILE 50 -3.628 -4.003 -6.477 271 HD13 ILE 50 3HD1 ILE 50 -3.577 -2.620 -7.570 272 H THR 51 H THR 51 2.589 -1.713 -8.792 273 HA THR 51 HA THR 51 3.430 0.587 -7.246 274 HB THR 51 HB THR 51 4.623 -0.412 -9.837 275 HG1 THR 51 HG1 THR 51 4.462 -2.076 -8.160 276 HG21 THR 51 1HG2 THR 51 5.822 1.091 -7.506 277 HG22 THR 51 2HG2 THR 51 5.379 1.794 -9.060 278 HG23 THR 51 3HG2 THR 51 6.672 0.598 -8.970 279 H VAL 52 H VAL 52 2.713 2.596 -7.638 280 HA VAL 52 HA VAL 52 1.976 3.328 -10.382 281 HB VAL 52 HB VAL 52 0.061 4.687 -9.349 282 HG11 VAL 52 1HG1 VAL 52 -0.125 1.675 -9.364 283 HG12 VAL 52 2HG1 VAL 52 -0.316 2.734 -10.761 284 HG13 VAL 52 3HG1 VAL 52 -1.490 2.791 -9.444 285 HG21 VAL 52 1HG2 VAL 52 -0.890 3.743 -7.281 286 HG22 VAL 52 2HG2 VAL 52 0.693 4.471 -7.019 287 HG23 VAL 52 3HG2 VAL 52 0.534 2.719 -7.113 288 H GLY 53 H GLY 53 1.810 5.739 -10.650 289 HA2 GLY 53 1HA GLY 53 3.168 7.279 -8.566 290 HA3 GLY 53 2HA GLY 53 3.953 7.200 -10.135 291 H ASP 54 H ASP 54 1.451 8.527 -8.268 292 HA ASP 54 HA ASP 54 0.958 10.916 -9.064 293 HB2 ASP 54 1HB ASP 54 0.861 10.215 -11.481 294 HB3 ASP 54 2HB ASP 54 -0.609 9.321 -11.114 295 H GLU 55 H GLU 55 -1.172 11.751 -8.413 296 HA GLU 55 HA GLU 55 -2.357 10.193 -6.391 297 HB2 GLU 55 1HB GLU 55 -3.275 12.710 -7.768 298 HB3 GLU 55 2HB GLU 55 -4.171 11.969 -6.452 299 HG2 GLU 55 1HG GLU 55 -2.796 13.767 -5.616 300 HG3 GLU 55 2HG GLU 55 -2.239 12.217 -4.983 301 H GLU 56 H GLU 56 -3.397 10.964 -9.686 302 HA GLU 56 HA GLU 56 -5.884 9.589 -9.466 303 HB2 GLU 56 1HB GLU 56 -4.312 10.399 -11.917 304 HB3 GLU 56 2HB GLU 56 -5.977 9.833 -11.922 305 HG2 GLU 56 1HG GLU 56 -4.974 12.322 -10.557 306 HG3 GLU 56 2HG GLU 56 -5.835 12.263 -12.096 307 H GLU 57 H GLU 57 -2.637 8.701 -10.321 308 HA GLU 57 HA GLU 57 -3.276 6.159 -11.424 309 HB2 GLU 57 1HB GLU 57 -0.734 7.340 -10.332 310 HB3 GLU 57 2HB GLU 57 -0.821 5.678 -10.902 311 HG2 GLU 57 1HG GLU 57 -1.444 8.129 -12.533 312 HG3 GLU 57 2HG GLU 57 0.035 7.171 -12.624 313 H LEU 58 H LEU 58 -2.579 7.326 -8.170 314 HA LEU 58 HA LEU 58 -2.531 4.775 -6.944 315 HB2 LEU 58 1HB LEU 58 -1.768 6.892 -5.850 316 HB3 LEU 58 2HB LEU 58 -3.447 7.373 -5.708 317 HG LEU 58 HG LEU 58 -3.877 5.405 -4.273 318 HD11 LEU 58 1HD1 LEU 58 -2.021 4.101 -3.393 319 HD12 LEU 58 2HD1 LEU 58 -0.895 4.984 -4.424 320 HD13 LEU 58 3HD1 LEU 58 -2.118 3.941 -5.146 321 HD21 LEU 58 1HD2 LEU 58 -2.699 6.216 -2.299 322 HD22 LEU 58 2HD2 LEU 58 -3.328 7.556 -3.260 323 HD23 LEU 58 3HD2 LEU 58 -1.613 7.153 -3.325 324 H LYS 59 H LYS 59 -5.082 6.909 -7.983 325 HA LYS 59 HA LYS 59 -7.201 5.572 -6.689 326 HB2 LYS 59 1HB LYS 59 -7.227 7.272 -9.171 327 HB3 LYS 59 2HB LYS 59 -8.664 6.746 -8.302 328 HG2 LYS 59 1HG LYS 59 -7.918 7.973 -6.324 329 HG3 LYS 59 2HG LYS 59 -6.478 8.498 -7.197 330 HD2 LYS 59 1HD LYS 59 -7.874 9.670 -8.816 331 HD3 LYS 59 2HD LYS 59 -9.325 9.119 -7.977 332 HE2 LYS 59 1HE LYS 59 -7.177 10.884 -6.807 333 HE3 LYS 59 2HE LYS 59 -8.747 11.428 -7.396 334 HZ1 LYS 59 1HZ LYS 59 -8.786 11.192 -5.016 335 HZ2 LYS 59 2HZ LYS 59 -8.277 9.584 -5.116 336 HZ3 LYS 59 3HZ LYS 59 -9.798 10.027 -5.706 337 H LYS 60 H LYS 60 -5.312 4.796 -9.362 338 HA LYS 60 HA LYS 60 -7.213 2.972 -10.560 339 HB2 LYS 60 1HB LYS 60 -4.258 3.087 -11.097 340 HB3 LYS 60 2HB LYS 60 -5.551 2.592 -12.185 341 HG2 LYS 60 1HG LYS 60 -5.380 5.378 -11.113 342 HG3 LYS 60 2HG LYS 60 -4.476 4.876 -12.559 343 HD2 LYS 60 1HD LYS 60 -6.691 4.095 -13.500 344 HD3 LYS 60 2HD LYS 60 -7.456 4.924 -12.144 345 HE2 LYS 60 1HE LYS 60 -7.448 6.372 -14.079 346 HE3 LYS 60 2HE LYS 60 -6.365 7.021 -12.849 347 HZ1 LYS 60 1HZ LYS 60 -5.449 7.073 -15.133 348 HZ2 LYS 60 2HZ LYS 60 -5.461 5.384 -15.155 349 HZ3 LYS 60 3HZ LYS 60 -4.478 6.209 -14.046 350 H ALA 61 H ALA 61 -4.468 2.923 -8.409 351 HA ALA 61 HA ALA 61 -4.275 0.059 -8.299 352 HB1 ALA 61 1HB ALA 61 -2.597 0.457 -6.581 353 HB2 ALA 61 2HB ALA 61 -3.043 2.163 -6.522 354 HB3 ALA 61 3HB ALA 61 -2.312 1.491 -7.981 355 H ILE 62 H ILE 62 -5.502 2.632 -6.201 356 HA ILE 62 HA ILE 62 -6.322 1.044 -4.044 357 HB ILE 62 HB ILE 62 -7.355 3.685 -5.077 358 HG12 ILE 62 1HG1 ILE 62 -5.724 2.974 -2.629 359 HG13 ILE 62 2HG1 ILE 62 -5.055 3.601 -4.131 360 HG21 ILE 62 1HG2 ILE 62 -8.573 3.948 -2.976 361 HG22 ILE 62 2HG2 ILE 62 -8.133 2.305 -2.511 362 HG23 ILE 62 3HG2 ILE 62 -9.185 2.575 -3.901 363 HD11 ILE 62 1HD1 ILE 62 -6.991 5.038 -2.327 364 HD12 ILE 62 2HD1 ILE 62 -6.310 5.670 -3.826 365 HD13 ILE 62 3HD1 ILE 62 -5.258 5.341 -2.450 366 H LYS 63 H LYS 63 -8.182 2.157 -6.879 367 HA LYS 63 HA LYS 63 -10.547 0.785 -6.181 368 HB2 LYS 63 1HB LYS 63 -10.501 2.658 -7.778 369 HB3 LYS 63 2HB LYS 63 -9.586 1.673 -8.905 370 HG2 LYS 63 1HG LYS 63 -11.702 1.512 -9.767 371 HG3 LYS 63 2HG LYS 63 -11.628 0.070 -8.756 372 HD2 LYS 63 1HD LYS 63 -12.733 2.651 -7.695 373 HD3 LYS 63 2HD LYS 63 -13.734 1.564 -8.652 374 HE2 LYS 63 1HE LYS 63 -12.339 0.892 -6.064 375 HE3 LYS 63 2HE LYS 63 -14.059 1.184 -6.273 376 HZ1 LYS 63 1HZ LYS 63 -14.190 -0.756 -7.699 377 HZ2 LYS 63 2HZ LYS 63 -13.565 -1.178 -6.182 378 HZ3 LYS 63 3HZ LYS 63 -12.531 -1.039 -7.518 379 H LYS 64 H LYS 64 -7.663 -0.146 -7.895 380 HA LYS 64 HA LYS 64 -8.619 -2.574 -8.995 381 HB2 LYS 64 1HB LYS 64 -6.557 -1.440 -9.750 382 HB3 LYS 64 2HB LYS 64 -5.803 -1.803 -8.207 383 HG2 LYS 64 1HG LYS 64 -5.896 -4.168 -8.667 384 HG3 LYS 64 2HG LYS 64 -6.768 -3.868 -10.171 385 HD2 LYS 64 1HD LYS 64 -4.082 -2.628 -9.688 386 HD3 LYS 64 2HD LYS 64 -4.209 -4.295 -10.249 387 HE2 LYS 64 1HE LYS 64 -3.913 -2.831 -12.142 388 HE3 LYS 64 2HE LYS 64 -5.535 -3.513 -12.179 389 HZ1 LYS 64 1HZ LYS 64 -4.898 -0.803 -11.143 390 HZ2 LYS 64 2HZ LYS 64 -6.436 -1.459 -11.407 391 HZ3 LYS 64 3HZ LYS 64 -5.426 -1.118 -12.716 392 H ALA 65 H ALA 65 -6.737 -1.861 -6.057 393 HA ALA 65 HA ALA 65 -6.654 -4.464 -5.032 394 HB1 ALA 65 1HB ALA 65 -5.272 -2.623 -4.188 395 HB2 ALA 65 2HB ALA 65 -6.153 -3.424 -2.886 396 HB3 ALA 65 3HB ALA 65 -6.709 -1.866 -3.498 397 H ASP 66 H ASP 66 -8.993 -1.860 -4.544 398 HA ASP 66 HA ASP 66 -10.750 -3.079 -2.773 399 HB2 ASP 66 1HB ASP 66 -10.955 -0.737 -3.418 400 HB3 ASP 66 2HB ASP 66 -11.336 -1.197 -5.072 401 H ASP 67 H ASP 67 -10.660 -3.242 -6.307 402 HA ASP 67 HA ASP 67 -12.985 -4.830 -6.587 403 HB2 ASP 67 1HB ASP 67 -12.208 -3.535 -8.460 404 HB3 ASP 67 2HB ASP 67 -10.655 -4.365 -8.450 405 H ILE 68 H ILE 68 -9.523 -5.662 -6.616 406 HA ILE 68 HA ILE 68 -9.869 -8.410 -7.124 407 HB ILE 68 HB ILE 68 -7.615 -7.068 -5.622 408 HG12 ILE 68 1HG1 ILE 68 -7.796 -7.806 -8.551 409 HG13 ILE 68 2HG1 ILE 68 -8.033 -6.178 -7.922 410 HG21 ILE 68 1HG2 ILE 68 -6.294 -9.033 -6.279 411 HG22 ILE 68 2HG2 ILE 68 -7.736 -9.754 -6.994 412 HG23 ILE 68 3HG2 ILE 68 -7.660 -9.475 -5.254 413 HD11 ILE 68 1HD1 ILE 68 -5.505 -7.792 -7.681 414 HD12 ILE 68 2HD1 ILE 68 -5.746 -6.142 -7.110 415 HD13 ILE 68 3HD1 ILE 68 -5.795 -6.494 -8.838 416 H ALA 69 H ALA 69 -9.768 -6.561 -4.120 417 HA ALA 69 HA ALA 69 -9.764 -8.749 -2.347 418 HB1 ALA 69 1HB ALA 69 -10.969 -6.023 -1.892 419 HB2 ALA 69 2HB ALA 69 -9.265 -6.426 -1.679 420 HB3 ALA 69 3HB ALA 69 -10.485 -7.185 -0.656 421 H LYS 70 H LYS 70 -12.475 -6.711 -3.440 422 HA LYS 70 HA LYS 70 -14.493 -8.227 -2.164 423 HB2 LYS 70 1HB LYS 70 -14.584 -6.399 -4.542 424 HB3 LYS 70 2HB LYS 70 -16.017 -7.026 -3.742 425 HG2 LYS 70 1HG LYS 70 -15.488 -5.851 -1.724 426 HG3 LYS 70 2HG LYS 70 -13.921 -5.358 -2.369 427 HD2 LYS 70 1HD LYS 70 -14.992 -3.990 -4.040 428 HD3 LYS 70 2HD LYS 70 -16.582 -4.567 -3.540 429 HE2 LYS 70 1HE LYS 70 -16.408 -3.466 -1.440 430 HE3 LYS 70 2HE LYS 70 -14.702 -3.107 -1.701 431 HZ1 LYS 70 1HZ LYS 70 -15.302 -1.635 -3.496 432 HZ2 LYS 70 2HZ LYS 70 -16.112 -1.173 -2.084 433 HZ3 LYS 70 3HZ LYS 70 -16.943 -1.998 -3.300 434 H LYS 71 H LYS 71 -12.861 -8.580 -5.196 435 HA LYS 71 HA LYS 71 -14.537 -10.264 -6.589 436 HB2 LYS 71 1HB LYS 71 -12.376 -9.478 -7.452 437 HB3 LYS 71 2HB LYS 71 -11.532 -10.461 -6.267 438 HG2 LYS 71 1HG LYS 71 -12.507 -12.483 -7.333 439 HG3 LYS 71 2HG LYS 71 -13.192 -11.438 -8.580 440 HD2 LYS 71 1HD LYS 71 -10.925 -10.653 -9.138 441 HD3 LYS 71 2HD LYS 71 -10.262 -11.747 -7.924 442 HE2 LYS 71 1HE LYS 71 -11.828 -12.553 -10.371 443 HE3 LYS 71 2HE LYS 71 -10.083 -12.685 -10.177 444 HZ1 LYS 71 1HZ LYS 71 -12.150 -14.143 -8.624 445 HZ2 LYS 71 2HZ LYS 71 -10.492 -14.207 -8.302 446 HZ3 LYS 71 3HZ LYS 71 -11.091 -14.802 -9.766 447 H GLN 72 H GLN 72 -12.312 -11.010 -3.922 448 HA GLN 72 HA GLN 72 -13.671 -13.617 -3.732 449 HB2 GLN 72 1HB GLN 72 -11.478 -14.642 -3.106 450 HB3 GLN 72 2HB GLN 72 -11.611 -14.110 -4.774 451 HG2 GLN 72 1HG GLN 72 -10.371 -12.058 -4.181 452 HG3 GLN 72 2HG GLN 72 -10.171 -12.687 -2.546 453 HE21 GLN 72 1HE2 GLN 72 -7.949 -12.735 -2.674 454 HE22 GLN 72 2HE2 GLN 72 -7.101 -13.887 -3.649 455 H ASN 73 H ASN 73 -11.539 -11.426 -1.814 456 HA ASN 73 HA ASN 73 -12.476 -12.929 0.523 457 HB2 ASN 73 1HB ASN 73 -10.120 -13.422 -0.319 458 HB3 ASN 73 2HB ASN 73 -9.686 -11.841 0.324 459 HD21 ASN 73 1HD2 ASN 73 -10.877 -15.028 1.137 460 HD22 ASN 73 2HD2 ASN 73 -10.451 -14.971 2.813 461 H SER 74 H SER 74 -13.215 -10.117 -0.497 462 HA SER 74 HA SER 74 -11.977 -8.213 1.147 463 HB2 SER 74 1HB SER 74 -13.228 -7.680 -0.904 464 HB3 SER 74 2HB SER 74 -14.735 -8.032 -0.060 465 HG SER 74 HG SER 74 -12.895 -5.931 0.387 466 H SER 75 H SER 75 -13.794 -10.660 2.373 467 HA SER 75 HA SER 75 -15.270 -9.448 4.417 468 HB2 SER 75 1HB SER 75 -14.578 -11.563 5.730 469 HB3 SER 75 2HB SER 75 -15.480 -11.795 4.234 470 HG SER 75 HG SER 75 -13.865 -13.055 3.752 471 H GLU 76 H GLU 76 -11.825 -10.137 4.100 472 HA GLU 76 HA GLU 76 -11.342 -7.808 5.779 473 HB2 GLU 76 1HB GLU 76 -10.943 -9.679 7.311 474 HB3 GLU 76 2HB GLU 76 -9.843 -10.412 6.147 475 HG2 GLU 76 1HG GLU 76 -8.380 -8.447 6.318 476 HG3 GLU 76 2HG GLU 76 -9.457 -7.762 7.532 477 H ALA 77 H ALA 77 -10.327 -6.452 4.488 478 HA ALA 77 HA ALA 77 -8.354 -7.554 2.598 479 HB1 ALA 77 1HB ALA 77 -10.320 -6.664 1.443 480 HB2 ALA 77 2HB ALA 77 -8.878 -5.712 1.089 481 HB3 ALA 77 3HB ALA 77 -10.077 -5.105 2.231 482 H LYS 78 H LYS 78 -6.406 -7.153 3.380 483 HA LYS 78 HA LYS 78 -5.929 -4.649 4.815 484 HB2 LYS 78 1HB LYS 78 -4.495 -7.277 4.699 485 HB3 LYS 78 2HB LYS 78 -3.634 -5.833 5.205 486 HG2 LYS 78 1HG LYS 78 -5.159 -5.513 7.043 487 HG3 LYS 78 2HG LYS 78 -6.150 -6.866 6.496 488 HD2 LYS 78 1HD LYS 78 -4.468 -8.440 7.019 489 HD3 LYS 78 2HD LYS 78 -3.245 -7.181 7.205 490 HE2 LYS 78 1HE LYS 78 -4.054 -8.139 9.357 491 HE3 LYS 78 2HE LYS 78 -4.260 -6.395 9.222 492 HZ1 LYS 78 1HZ LYS 78 -6.433 -8.320 8.618 493 HZ2 LYS 78 2HZ LYS 78 -6.557 -6.640 8.859 494 HZ3 LYS 78 3HZ LYS 78 -6.189 -7.658 10.157 495 H ILE 79 H ILE 79 -5.011 -3.013 3.816 496 HA ILE 79 HA ILE 79 -3.335 -3.553 1.454 497 HB ILE 79 HB ILE 79 -5.148 -1.154 1.797 498 HG12 ILE 79 1HG1 ILE 79 -5.523 -3.566 0.005 499 HG13 ILE 79 2HG1 ILE 79 -6.445 -3.241 1.474 500 HG21 ILE 79 1HG2 ILE 79 -4.619 -0.737 -0.569 501 HG22 ILE 79 2HG2 ILE 79 -3.520 -2.115 -0.556 502 HG23 ILE 79 3HG2 ILE 79 -3.178 -0.706 0.446 503 HD11 ILE 79 1HD1 ILE 79 -7.699 -2.637 -0.517 504 HD12 ILE 79 2HD1 ILE 79 -6.414 -1.532 -1.005 505 HD13 ILE 79 3HD1 ILE 79 -7.341 -1.213 0.460 506 H LEU 80 H LEU 80 -1.368 -2.612 1.489 507 HA LEU 80 HA LEU 80 -0.862 -0.552 3.545 508 HB2 LEU 80 1HB LEU 80 0.423 -2.638 3.819 509 HB3 LEU 80 2HB LEU 80 1.066 -2.450 2.193 510 HG LEU 80 HG LEU 80 2.128 -0.295 2.969 511 HD11 LEU 80 1HD1 LEU 80 2.431 -0.009 5.381 512 HD12 LEU 80 2HD1 LEU 80 1.317 -1.345 5.672 513 HD13 LEU 80 3HD1 LEU 80 0.739 0.135 4.905 514 HD21 LEU 80 1HD2 LEU 80 2.950 -2.847 4.348 515 HD22 LEU 80 2HD2 LEU 80 3.972 -1.428 4.110 516 HD23 LEU 80 3HD2 LEU 80 3.403 -2.350 2.718 517 H ILE 81 H ILE 81 -0.857 1.448 2.636 518 HA ILE 81 HA ILE 81 0.184 1.706 -0.102 519 HB ILE 81 HB ILE 81 -1.350 3.748 1.525 520 HG12 ILE 81 1HG1 ILE 81 -2.235 2.171 -0.899 521 HG13 ILE 81 2HG1 ILE 81 -2.700 1.786 0.755 522 HG21 ILE 81 1HG2 ILE 81 -0.540 3.831 -1.380 523 HG22 ILE 81 2HG2 ILE 81 0.272 4.709 -0.085 524 HG23 ILE 81 3HG2 ILE 81 -1.405 5.083 -0.488 525 HD11 ILE 81 1HD1 ILE 81 -3.823 3.945 0.934 526 HD12 ILE 81 2HD1 ILE 81 -4.458 2.997 -0.410 527 HD13 ILE 81 3HD1 ILE 81 -3.346 4.332 -0.719 528 H LEU 82 H LEU 82 2.286 2.102 -0.180 529 HA LEU 82 HA LEU 82 3.562 3.696 1.908 530 HB2 LEU 82 1HB LEU 82 4.737 2.287 -0.495 531 HB3 LEU 82 2HB LEU 82 5.658 3.094 0.757 532 HG LEU 82 HG LEU 82 3.923 0.658 1.170 533 HD11 LEU 82 1HD1 LEU 82 6.040 -0.521 1.481 534 HD12 LEU 82 2HD1 LEU 82 6.922 0.953 1.076 535 HD13 LEU 82 3HD1 LEU 82 5.917 0.164 -0.140 536 HD21 LEU 82 1HD2 LEU 82 4.022 2.054 3.158 537 HD22 LEU 82 2HD2 LEU 82 5.780 2.118 3.046 538 HD23 LEU 82 3HD2 LEU 82 4.973 0.587 3.387 539 H LEU 83 H LEU 83 3.482 5.836 1.667 540 HA LEU 83 HA LEU 83 4.082 6.955 -0.975 541 HB2 LEU 83 1HB LEU 83 2.376 8.690 -0.706 542 HB3 LEU 83 2HB LEU 83 1.663 7.093 -0.839 543 HG LEU 83 HG LEU 83 2.033 8.526 1.805 544 HD11 LEU 83 1HD1 LEU 83 -0.289 9.181 1.640 545 HD12 LEU 83 2HD1 LEU 83 -0.412 8.433 0.047 546 HD13 LEU 83 3HD1 LEU 83 0.621 9.842 0.283 547 HD21 LEU 83 1HD2 LEU 83 0.411 6.973 2.639 548 HD22 LEU 83 2HD2 LEU 83 1.698 6.056 1.856 549 HD23 LEU 83 3HD2 LEU 83 0.160 6.298 1.032 550 H GLU 84 H GLU 84 5.455 8.715 -0.884 551 HA GLU 84 HA GLU 84 6.158 9.651 1.768 552 HB2 GLU 84 1HB GLU 84 7.708 11.198 0.478 553 HB3 GLU 84 2HB GLU 84 8.032 9.480 0.326 554 HG2 GLU 84 1HG GLU 84 6.983 9.438 -1.851 555 HG3 GLU 84 2HG GLU 84 6.542 11.138 -1.695 556 H LYS 85 H LYS 85 4.517 10.677 2.579 557 HA LYS 85 HA LYS 85 4.024 13.395 1.901 558 HB2 LYS 85 1HB LYS 85 1.894 11.331 1.333 559 HB3 LYS 85 2HB LYS 85 1.455 12.963 1.805 560 HG2 LYS 85 1HG LYS 85 2.607 13.851 -0.146 561 HG3 LYS 85 2HG LYS 85 3.094 12.220 -0.607 562 HD2 LYS 85 1HD LYS 85 0.690 11.610 -0.766 563 HD3 LYS 85 2HD LYS 85 0.282 13.300 -0.455 564 HE2 LYS 85 1HE LYS 85 1.523 13.963 -2.456 565 HE3 LYS 85 2HE LYS 85 1.932 12.278 -2.764 566 HZ1 LYS 85 1HZ LYS 85 -0.768 13.496 -2.812 567 HZ2 LYS 85 2HZ LYS 85 -0.487 11.836 -2.912 568 HZ3 LYS 85 3HZ LYS 85 0.091 12.862 -4.130 569 HA PRO 86 HA PRO 86 3.020 13.111 6.285 570 HB2 PRO 86 1HB PRO 86 1.754 15.514 6.560 571 HB3 PRO 86 2HB PRO 86 3.512 15.347 6.513 572 HG2 PRO 86 1HG PRO 86 1.623 16.154 4.343 573 HG3 PRO 86 2HG PRO 86 3.221 16.812 4.740 574 HD2 PRO 86 1HD PRO 86 2.811 15.075 2.696 575 HD3 PRO 86 2HD PRO 86 4.327 15.133 3.617 576 H VAL 87 H VAL 87 1.383 11.849 6.967 577 HA VAL 87 HA VAL 87 -1.228 12.186 5.648 578 HB VAL 87 HB VAL 87 -1.622 9.776 6.012 579 HG11 VAL 87 1HG1 VAL 87 0.894 10.409 4.473 580 HG12 VAL 87 2HG1 VAL 87 -0.760 10.547 3.873 581 HG13 VAL 87 3HG1 VAL 87 -0.097 8.963 4.276 582 HG21 VAL 87 1HG2 VAL 87 0.282 8.316 6.590 583 HG22 VAL 87 2HG2 VAL 87 -0.184 9.377 7.918 584 HG23 VAL 87 3HG2 VAL 87 1.245 9.747 6.955 585 H SER 88 H SER 88 -2.992 12.423 6.838 586 HA SER 88 HA SER 88 -2.750 12.286 9.751 587 HB2 SER 88 1HB SER 88 -5.008 13.468 8.116 588 HB3 SER 88 2HB SER 88 -4.690 13.712 9.833 589 HG SER 88 HG SER 88 -3.615 14.974 7.660 590 HA PRO 89 HA PRO 89 -5.212 8.612 10.286 591 HB2 PRO 89 1HB PRO 89 -7.126 10.321 11.820 592 HB3 PRO 89 2HB PRO 89 -6.411 8.766 12.258 593 HG2 PRO 89 1HG PRO 89 -5.499 11.018 13.332 594 HG3 PRO 89 2HG PRO 89 -4.385 9.718 12.867 595 HD2 PRO 89 1HD PRO 89 -4.914 12.329 11.534 596 HD3 PRO 89 2HD PRO 89 -3.413 11.390 11.627 597 H GLU 90 H GLU 90 -7.197 11.533 9.800 598 HA GLU 90 HA GLU 90 -9.403 10.234 8.651 599 HB2 GLU 90 1HB GLU 90 -9.540 12.508 9.526 600 HB3 GLU 90 2HB GLU 90 -8.445 13.075 8.273 601 HG2 GLU 90 1HG GLU 90 -10.081 12.520 6.567 602 HG3 GLU 90 2HG GLU 90 -11.173 11.898 7.802 603 H TYR 91 H TYR 91 -6.425 11.457 7.241 604 HA TYR 91 HA TYR 91 -7.184 11.332 4.531 605 HB2 TYR 91 1HB TYR 91 -5.159 12.504 5.302 606 HB3 TYR 91 2HB TYR 91 -4.438 10.966 5.756 607 HD1 TYR 91 HD1 TYR 91 -5.635 12.950 2.862 608 HD2 TYR 91 HD2 TYR 91 -3.284 9.654 4.168 609 HE1 TYR 91 HE1 TYR 91 -4.679 12.744 0.605 610 HE2 TYR 91 HE2 TYR 91 -2.325 9.439 1.916 611 HH TYR 91 HH TYR 91 -2.702 11.844 -0.476 612 H GLU 92 H GLU 92 -5.734 8.948 6.707 613 HA GLU 92 HA GLU 92 -5.500 6.821 4.915 614 HB2 GLU 92 1HB GLU 92 -4.532 6.785 7.158 615 HB3 GLU 92 2HB GLU 92 -6.136 6.802 7.872 616 HG2 GLU 92 1HG GLU 92 -6.610 4.609 6.912 617 HG3 GLU 92 2HG GLU 92 -5.014 4.617 6.150 618 H LYS 93 H LYS 93 -8.183 7.892 6.931 619 HA LYS 93 HA LYS 93 -9.881 5.715 6.281 620 HB2 LYS 93 1HB LYS 93 -10.378 8.375 7.602 621 HB3 LYS 93 2HB LYS 93 -11.635 7.164 7.382 622 HG2 LYS 93 1HG LYS 93 -9.059 6.637 8.844 623 HG3 LYS 93 2HG LYS 93 -10.548 7.165 9.632 624 HD2 LYS 93 1HD LYS 93 -11.700 5.181 8.877 625 HD3 LYS 93 2HD LYS 93 -10.296 4.679 7.939 626 HE2 LYS 93 1HE LYS 93 -10.248 5.045 10.927 627 HE3 LYS 93 2HE LYS 93 -10.609 3.508 10.143 628 HZ1 LYS 93 1HZ LYS 93 -8.093 5.058 9.863 629 HZ2 LYS 93 2HZ LYS 93 -8.437 3.607 9.063 630 HZ3 LYS 93 3HZ LYS 93 -8.290 3.631 10.748 631 H LYS 94 H LYS 94 -9.151 8.685 4.707 632 HA LYS 94 HA LYS 94 -11.538 8.758 3.119 633 HB2 LYS 94 1HB LYS 94 -8.847 10.076 2.732 634 HB3 LYS 94 2HB LYS 94 -10.234 10.351 1.689 635 HG2 LYS 94 1HG LYS 94 -11.494 11.178 3.651 636 HG3 LYS 94 2HG LYS 94 -10.031 10.997 4.622 637 HD2 LYS 94 1HD LYS 94 -10.179 13.283 3.961 638 HD3 LYS 94 2HD LYS 94 -8.883 12.543 3.023 639 HE2 LYS 94 1HE LYS 94 -10.233 13.964 1.600 640 HE3 LYS 94 2HE LYS 94 -10.429 12.279 1.129 641 HZ1 LYS 94 1HZ LYS 94 -12.523 12.213 2.308 642 HZ2 LYS 94 2HZ LYS 94 -12.540 13.471 1.182 643 HZ3 LYS 94 3HZ LYS 94 -12.326 13.810 2.822 644 H LEU 95 H LEU 95 -8.225 7.587 2.642 645 HA LEU 95 HA LEU 95 -8.752 6.503 0.053 646 HB2 LEU 95 1HB LEU 95 -6.587 5.753 2.024 647 HB3 LEU 95 2HB LEU 95 -6.612 5.348 0.318 648 HG LEU 95 HG LEU 95 -6.356 8.123 1.485 649 HD11 LEU 95 1HD1 LEU 95 -4.336 6.778 1.707 650 HD12 LEU 95 2HD1 LEU 95 -4.117 8.065 0.521 651 HD13 LEU 95 3HD1 LEU 95 -4.387 6.406 -0.014 652 HD21 LEU 95 1HD2 LEU 95 -6.011 8.853 -0.826 653 HD22 LEU 95 2HD2 LEU 95 -7.623 8.178 -0.591 654 HD23 LEU 95 3HD2 LEU 95 -6.375 7.224 -1.392 655 H GLN 96 H GLN 96 -8.857 5.339 3.336 656 HA GLN 96 HA GLN 96 -9.457 2.622 2.779 657 HB2 GLN 96 1HB GLN 96 -8.620 3.733 4.960 658 HB3 GLN 96 2HB GLN 96 -10.301 4.145 5.240 659 HG2 GLN 96 1HG GLN 96 -10.891 1.804 5.257 660 HG3 GLN 96 2HG GLN 96 -9.227 1.348 4.924 661 HE21 GLN 96 1HE2 GLN 96 -10.886 0.611 7.169 662 HE22 GLN 96 2HE2 GLN 96 -10.074 1.181 8.586 663 H LYS 97 H LYS 97 -11.250 5.538 2.660 664 HA LYS 97 HA LYS 97 -13.859 4.317 2.767 665 HB2 LYS 97 1HB LYS 97 -13.480 6.681 3.410 666 HB3 LYS 97 2HB LYS 97 -13.041 7.046 1.748 667 HG2 LYS 97 1HG LYS 97 -15.296 6.435 1.020 668 HG3 LYS 97 2HG LYS 97 -15.734 6.082 2.694 669 HD2 LYS 97 1HD LYS 97 -15.236 8.422 3.292 670 HD3 LYS 97 2HD LYS 97 -14.866 8.759 1.600 671 HE2 LYS 97 1HE LYS 97 -17.156 8.162 0.980 672 HE3 LYS 97 2HE LYS 97 -17.524 7.813 2.667 673 HZ1 LYS 97 1HZ LYS 97 -16.785 10.457 1.539 674 HZ2 LYS 97 2HZ LYS 97 -17.018 10.148 3.183 675 HZ3 LYS 97 3HZ LYS 97 -18.309 9.994 2.105 676 H TYR 98 H TYR 98 -11.633 5.424 0.253 677 HA TYR 98 HA TYR 98 -13.364 5.034 -1.942 678 HB2 TYR 98 1HB TYR 98 -10.340 4.952 -1.871 679 HB3 TYR 98 2HB TYR 98 -11.318 5.078 -3.327 680 HD1 TYR 98 HD1 TYR 98 -9.140 6.949 -1.877 681 HD2 TYR 98 HD2 TYR 98 -13.358 7.060 -2.405 682 HE1 TYR 98 HE1 TYR 98 -9.095 9.396 -1.667 683 HE2 TYR 98 HE2 TYR 98 -13.325 9.509 -2.198 684 HH TYR 98 HH TYR 98 -11.918 11.249 -1.232 685 H ALA 99 H ALA 99 -10.958 2.939 -0.420 686 HA ALA 99 HA ALA 99 -12.120 0.667 -1.897 687 HB1 ALA 99 1HB ALA 99 -9.377 0.931 -0.663 688 HB2 ALA 99 2HB ALA 99 -9.752 0.951 -2.387 689 HB3 ALA 99 3HB ALA 99 -10.008 -0.518 -1.446 690 H ASP 100 H ASP 100 -13.385 -0.615 -0.691 691 HA ASP 100 HA ASP 100 -13.553 -0.162 2.133 692 HB2 ASP 100 1HB ASP 100 -15.569 -0.766 0.867 693 HB3 ASP 100 2HB ASP 100 -14.849 -2.318 0.446 694 H ALA 101 H ALA 101 -11.955 -0.745 3.298 695 HA ALA 101 HA ALA 101 -11.061 -3.411 3.654 696 HB1 ALA 101 1HB ALA 101 -10.008 -2.956 1.464 697 HB2 ALA 101 2HB ALA 101 -8.810 -3.160 2.743 698 HB3 ALA 101 3HB ALA 101 -9.211 -1.545 2.159 699 H GLU 102 H GLU 102 -8.651 -3.067 4.689 700 HA GLU 102 HA GLU 102 -8.835 -0.721 6.442 701 HB2 GLU 102 1HB GLU 102 -7.672 -2.164 8.150 702 HB3 GLU 102 2HB GLU 102 -9.340 -2.576 7.815 703 HG2 GLU 102 1HG GLU 102 -8.584 -4.401 6.361 704 HG3 GLU 102 2HG GLU 102 -6.911 -3.985 6.731 705 H VAL 103 H VAL 103 -7.524 0.485 5.136 706 HA VAL 103 HA VAL 103 -4.983 -0.617 4.268 707 HB VAL 103 HB VAL 103 -6.420 0.719 2.697 708 HG11 VAL 103 1HG1 VAL 103 -5.461 3.118 4.241 709 HG12 VAL 103 2HG1 VAL 103 -7.086 2.436 4.392 710 HG13 VAL 103 3HG1 VAL 103 -6.545 3.087 2.845 711 HG21 VAL 103 1HG2 VAL 103 -3.677 1.857 3.193 712 HG22 VAL 103 2HG2 VAL 103 -4.585 1.926 1.682 713 HG23 VAL 103 3HG2 VAL 103 -4.023 0.376 2.304 714 H ARG 104 H ARG 104 -3.052 -0.050 5.027 715 HA ARG 104 HA ARG 104 -2.953 1.935 7.198 716 HB2 ARG 104 1HB ARG 104 -0.951 -0.194 6.402 717 HB3 ARG 104 2HB ARG 104 -0.738 0.948 7.717 718 HG2 ARG 104 1HG ARG 104 -2.686 -0.032 8.857 719 HG3 ARG 104 2HG ARG 104 -2.830 -1.211 7.548 720 HD2 ARG 104 1HD ARG 104 -0.570 -2.015 8.031 721 HD3 ARG 104 2HD ARG 104 -0.429 -0.841 9.336 722 HE ARG 104 HE ARG 104 -2.676 -2.615 9.626 723 HH11 ARG 104 1HH1 ARG 104 0.753 -2.185 10.206 724 HH12 ARG 104 2HH1 ARG 104 0.808 -3.329 11.509 725 HH21 ARG 104 1HH2 ARG 104 -2.596 -4.128 11.373 726 HH22 ARG 104 2HH2 ARG 104 -1.082 -4.421 12.171 727 H VAL 105 H VAL 105 -2.697 3.890 6.140 728 HA VAL 105 HA VAL 105 -0.950 4.075 3.877 729 HB VAL 105 HB VAL 105 -1.297 6.479 3.919 730 HG11 VAL 105 1HG1 VAL 105 -3.824 4.912 4.392 731 HG12 VAL 105 2HG1 VAL 105 -2.993 5.141 2.853 732 HG13 VAL 105 3HG1 VAL 105 -3.748 6.514 3.662 733 HG21 VAL 105 1HG2 VAL 105 -2.765 6.025 6.510 734 HG22 VAL 105 2HG2 VAL 105 -2.751 7.534 5.596 735 HG23 VAL 105 3HG2 VAL 105 -1.256 6.911 6.294 736 H ARG 106 H ARG 106 1.190 4.373 3.888 737 HA ARG 106 HA ARG 106 2.476 5.063 6.455 738 HB2 ARG 106 1HB ARG 106 2.770 2.705 4.735 739 HB3 ARG 106 2HB ARG 106 4.295 3.456 5.172 740 HG2 ARG 106 1HG ARG 106 3.680 1.651 6.688 741 HG3 ARG 106 2HG ARG 106 3.789 3.200 7.521 742 HD2 ARG 106 1HD ARG 106 1.391 3.399 7.551 743 HD3 ARG 106 2HD ARG 106 1.220 1.947 6.564 744 HE ARG 106 HE ARG 106 2.412 0.840 8.561 745 HH11 ARG 106 1HH1 ARG 106 0.128 3.483 8.811 746 HH12 ARG 106 2HH1 ARG 106 -0.440 3.009 10.379 747 HH21 ARG 106 1HH2 ARG 106 1.698 0.231 10.645 748 HH22 ARG 106 2HH2 ARG 106 0.459 1.181 11.427 749 H THR 107 H THR 107 4.070 6.553 6.362 750 HA THR 107 HA THR 107 4.633 7.762 3.795 751 HB THR 107 HB THR 107 4.246 9.237 5.707 752 HG1 THR 107 HG1 THR 107 5.692 10.614 4.977 753 HG21 THR 107 1HG2 THR 107 5.149 7.845 7.499 754 HG22 THR 107 2HG2 THR 107 5.894 9.442 7.510 755 HG23 THR 107 3HG2 THR 107 6.777 8.061 6.859 756 H VAL 108 H VAL 108 6.363 7.392 2.575 757 HA VAL 108 HA VAL 108 8.592 5.889 3.770 758 HB VAL 108 HB VAL 108 7.352 4.317 2.447 759 HG11 VAL 108 1HG1 VAL 108 7.589 6.281 0.171 760 HG12 VAL 108 2HG1 VAL 108 6.110 5.841 1.025 761 HG13 VAL 108 3HG1 VAL 108 6.953 4.642 0.044 762 HG21 VAL 108 1HG2 VAL 108 9.816 5.232 0.972 763 HG22 VAL 108 2HG2 VAL 108 9.044 3.657 0.792 764 HG23 VAL 108 3HG2 VAL 108 9.765 4.116 2.336 765 H THR 109 H THR 109 10.367 7.083 3.757 766 HA THR 109 HA THR 109 10.975 8.603 1.309 767 HB THR 109 HB THR 109 10.447 10.144 3.158 768 HG1 THR 109 HG1 THR 109 13.074 10.015 2.125 769 HG21 THR 109 1HG2 THR 109 11.969 10.306 5.089 770 HG22 THR 109 2HG2 THR 109 12.788 8.840 4.550 771 HG23 THR 109 3HG2 THR 109 11.099 8.775 5.053 772 H SER 110 H SER 110 11.697 5.911 2.828 773 HA SER 110 HA SER 110 14.389 5.802 1.780 774 HB2 SER 110 1HB SER 110 13.854 5.271 4.713 775 HB3 SER 110 2HB SER 110 15.381 4.990 3.883 776 HG SER 110 HG SER 110 14.741 7.469 3.356 777 HA PRO 111 HA PRO 111 12.954 1.787 0.584 778 HB2 PRO 111 1HB PRO 111 15.829 1.089 0.862 779 HB3 PRO 111 2HB PRO 111 14.741 0.847 -0.508 780 HG2 PRO 111 1HG PRO 111 16.577 2.781 -0.531 781 HG3 PRO 111 2HG PRO 111 14.975 3.022 -1.248 782 HD2 PRO 111 1HD PRO 111 16.082 4.059 1.311 783 HD3 PRO 111 2HD PRO 111 14.922 4.802 0.195 784 H ASP 112 H ASP 112 15.306 2.034 3.241 785 HA ASP 112 HA ASP 112 14.785 -0.582 4.233 786 HB2 ASP 112 1HB ASP 112 16.129 1.815 5.466 787 HB3 ASP 112 2HB ASP 112 15.925 0.299 6.337 788 H GLU 113 H GLU 113 13.578 2.621 5.080 789 HA GLU 113 HA GLU 113 11.981 1.839 7.257 790 HB2 GLU 113 1HB GLU 113 11.530 4.102 5.297 791 HB3 GLU 113 2HB GLU 113 10.740 3.932 6.859 792 HG2 GLU 113 1HG GLU 113 13.696 4.295 6.421 793 HG3 GLU 113 2HG GLU 113 12.566 5.550 6.926 794 H ALA 114 H ALA 114 11.364 2.012 3.788 795 HA ALA 114 HA ALA 114 8.660 1.325 3.754 796 HB1 ALA 114 1HB ALA 114 9.893 2.100 1.780 797 HB2 ALA 114 2HB ALA 114 9.033 0.595 1.461 798 HB3 ALA 114 3HB ALA 114 10.774 0.574 1.737 799 H LYS 115 H LYS 115 11.532 -0.747 3.623 800 HA LYS 115 HA LYS 115 10.185 -3.203 3.476 801 HB2 LYS 115 1HB LYS 115 12.926 -2.492 4.524 802 HB3 LYS 115 2HB LYS 115 12.358 -4.148 4.353 803 HG2 LYS 115 1HG LYS 115 12.059 -3.799 1.950 804 HG3 LYS 115 2HG LYS 115 12.632 -2.140 2.123 805 HD2 LYS 115 1HD LYS 115 14.256 -4.575 2.854 806 HD3 LYS 115 2HD LYS 115 14.355 -3.754 1.296 807 HE2 LYS 115 1HE LYS 115 14.974 -1.673 2.484 808 HE3 LYS 115 2HE LYS 115 14.972 -2.571 4.000 809 HZ1 LYS 115 1HZ LYS 115 17.199 -2.326 3.082 810 HZ2 LYS 115 2HZ LYS 115 16.729 -3.146 1.671 811 HZ3 LYS 115 3HZ LYS 115 16.746 -3.955 3.158 812 H ARG 116 H ARG 116 11.035 -1.168 6.195 813 HA ARG 116 HA ARG 116 10.449 -3.058 8.230 814 HB2 ARG 116 1HB ARG 116 11.797 -0.955 8.527 815 HB3 ARG 116 2HB ARG 116 10.304 -0.039 8.407 816 HG2 ARG 116 1HG ARG 116 10.605 -2.181 10.474 817 HG3 ARG 116 2HG ARG 116 11.283 -0.574 10.735 818 HD2 ARG 116 1HD ARG 116 9.122 0.439 10.533 819 HD3 ARG 116 2HD ARG 116 8.399 -1.086 10.025 820 HE ARG 116 HE ARG 116 9.631 -1.206 12.620 821 HH11 ARG 116 1HH1 ARG 116 6.732 -0.384 10.863 822 HH12 ARG 116 2HH1 ARG 116 5.666 -0.642 12.211 823 HH21 ARG 116 1HH2 ARG 116 8.254 -1.547 14.415 824 HH22 ARG 116 2HH2 ARG 116 6.543 -1.303 14.241 825 H TRP 117 H TRP 117 8.542 -0.522 6.626 826 HA TRP 117 HA TRP 117 6.168 -0.881 8.091 827 HB2 TRP 117 1HB TRP 117 6.526 0.029 5.229 828 HB3 TRP 117 2HB TRP 117 5.030 0.161 6.141 829 HD1 TRP 117 HD1 TRP 117 7.393 2.407 4.956 830 HE1 TRP 117 HE1 TRP 117 7.814 4.409 6.508 831 HE3 TRP 117 HE3 TRP 117 5.440 0.506 9.291 832 HZ2 TRP 117 HZ2 TRP 117 7.382 5.097 9.207 833 HZ3 TRP 117 HZ3 TRP 117 5.484 1.908 11.310 834 HH2 TRP 117 HH2 TRP 117 6.434 4.155 11.268 835 H ILE 118 H ILE 118 7.327 -2.370 5.110 836 HA ILE 118 HA ILE 118 5.032 -3.863 4.501 837 HB ILE 118 HB ILE 118 7.926 -4.434 3.845 838 HG12 ILE 118 1HG1 ILE 118 5.737 -3.163 2.186 839 HG13 ILE 118 2HG1 ILE 118 6.991 -2.267 3.036 840 HG21 ILE 118 1HG2 ILE 118 7.049 -5.853 2.039 841 HG22 ILE 118 2HG2 ILE 118 5.416 -5.612 2.658 842 HG23 ILE 118 3HG2 ILE 118 6.610 -6.465 3.633 843 HD11 ILE 118 1HD1 ILE 118 8.690 -3.350 1.668 844 HD12 ILE 118 2HD1 ILE 118 7.506 -2.495 0.681 845 HD13 ILE 118 3HD1 ILE 118 7.431 -4.251 0.821 846 H LYS 119 H LYS 119 7.871 -4.668 6.467 847 HA LYS 119 HA LYS 119 7.173 -7.354 6.954 848 HB2 LYS 119 1HB LYS 119 9.424 -6.351 7.376 849 HB3 LYS 119 2HB LYS 119 8.747 -5.524 8.772 850 HG2 LYS 119 1HG LYS 119 8.276 -7.632 9.848 851 HG3 LYS 119 2HG LYS 119 8.814 -8.515 8.419 852 HD2 LYS 119 1HD LYS 119 10.600 -8.574 9.985 853 HD3 LYS 119 2HD LYS 119 11.061 -7.433 8.723 854 HE2 LYS 119 1HE LYS 119 11.645 -6.442 10.798 855 HE3 LYS 119 2HE LYS 119 10.215 -5.598 10.211 856 HZ1 LYS 119 1HZ LYS 119 10.205 -7.764 12.243 857 HZ2 LYS 119 2HZ LYS 119 8.856 -6.895 11.712 858 HZ3 LYS 119 3HZ LYS 119 10.078 -6.114 12.577 859 H GLU 120 H GLU 120 6.490 -4.370 8.738 860 HA GLU 120 HA GLU 120 5.110 -5.502 10.901 861 HB2 GLU 120 1HB GLU 120 5.816 -3.169 10.903 862 HB3 GLU 120 2HB GLU 120 4.737 -2.816 9.560 863 HG2 GLU 120 1HG GLU 120 2.852 -3.572 11.093 864 HG3 GLU 120 2HG GLU 120 4.031 -3.470 12.399 865 H PHE 121 H PHE 121 4.007 -4.439 7.732 866 HA PHE 121 HA PHE 121 1.240 -4.757 8.213 867 HB2 PHE 121 1HB PHE 121 1.992 -3.317 6.448 868 HB3 PHE 121 2HB PHE 121 2.861 -4.635 5.671 869 HD1 PHE 121 HD1 PHE 121 1.854 -5.845 3.982 870 HD2 PHE 121 HD2 PHE 121 -0.563 -3.570 6.643 871 HE1 PHE 121 HE1 PHE 121 -0.120 -6.336 2.602 872 HE2 PHE 121 HE2 PHE 121 -2.541 -4.056 5.268 873 HZ PHE 121 HZ PHE 121 -2.319 -5.442 3.244 874 H SER 122 H SER 122 3.661 -6.847 6.700 875 HA SER 122 HA SER 122 1.808 -8.878 5.969 876 HB2 SER 122 1HB SER 122 4.798 -9.152 6.350 877 HB3 SER 122 2HB SER 122 3.753 -10.169 5.358 878 HG SER 122 HG SER 122 4.528 -7.482 4.930 879 H GLU 123 H GLU 123 3.936 -8.340 8.713 880 HA GLU 123 HA GLU 123 2.866 -10.753 10.010 881 HB2 GLU 123 1HB GLU 123 5.401 -9.207 10.589 882 HB3 GLU 123 2HB GLU 123 4.877 -10.658 11.430 883 HG2 GLU 123 1HG GLU 123 5.426 -10.578 8.477 884 HG3 GLU 123 2HG GLU 123 6.652 -10.973 9.680 885 H GLU 124 H GLU 124 0.950 -9.413 10.494 886 HA GLU 124 HA GLU 124 1.336 -7.272 12.403 887 HB2 GLU 124 1HB GLU 124 -1.267 -7.284 12.328 888 HB3 GLU 124 2HB GLU 124 -0.353 -6.647 10.974 889 HG2 GLU 124 1HG GLU 124 -2.112 -7.928 10.076 890 HG3 GLU 124 2HG GLU 124 -0.643 -8.867 9.850 Start of MODEL 4 1 HA MET 21 HA MET 21 -7.882 -11.677 4.037 2 HB2 MET 21 1HB MET 21 -5.434 -11.079 5.714 3 HB3 MET 21 2HB MET 21 -6.589 -9.867 5.181 4 HG2 MET 21 1HG MET 21 -7.096 -10.402 7.428 5 HG3 MET 21 2HG MET 21 -8.355 -11.113 6.421 6 HE1 MET 21 1HE MET 21 -5.009 -13.450 8.576 7 HE2 MET 21 2HE MET 21 -5.331 -11.730 8.790 8 HE3 MET 21 3HE MET 21 -4.668 -12.320 7.268 9 H THR 22 H THR 22 -7.709 -10.762 2.069 10 HA THR 22 HA THR 22 -5.402 -11.065 0.472 11 HB THR 22 HB THR 22 -6.778 -8.917 -0.609 12 HG1 THR 22 HG1 THR 22 -8.586 -8.946 0.528 13 HG21 THR 22 1HG2 THR 22 -5.997 -10.842 -1.852 14 HG22 THR 22 2HG2 THR 22 -7.720 -10.608 -2.142 15 HG23 THR 22 3HG2 THR 22 -7.173 -11.875 -1.044 16 H LEU 23 H LEU 23 -3.567 -9.971 0.476 17 HA LEU 23 HA LEU 23 -3.484 -7.424 1.936 18 HB2 LEU 23 1HB LEU 23 -1.273 -9.427 1.496 19 HB3 LEU 23 2HB LEU 23 -1.133 -7.934 2.402 20 HG LEU 23 HG LEU 23 -2.774 -10.356 3.143 21 HD11 LEU 23 1HD1 LEU 23 -1.289 -10.427 5.080 22 HD12 LEU 23 2HD1 LEU 23 -0.389 -9.051 4.443 23 HD13 LEU 23 3HD1 LEU 23 -0.394 -10.584 3.569 24 HD21 LEU 23 1HD2 LEU 23 -2.577 -7.681 4.523 25 HD22 LEU 23 2HD2 LEU 23 -3.349 -9.122 5.187 26 HD23 LEU 23 3HD2 LEU 23 -4.007 -8.357 3.740 27 H PHE 24 H PHE 24 -3.567 -5.846 0.504 28 HA PHE 24 HA PHE 24 -1.943 -6.046 -1.939 29 HB2 PHE 24 1HB PHE 24 -4.102 -4.036 -1.266 30 HB3 PHE 24 2HB PHE 24 -3.294 -4.225 -2.818 31 HD1 PHE 24 HD1 PHE 24 -5.722 -5.670 -0.499 32 HD2 PHE 24 HD2 PHE 24 -3.916 -5.966 -4.337 33 HE1 PHE 24 HE1 PHE 24 -7.454 -7.262 -1.185 34 HE2 PHE 24 HE2 PHE 24 -5.645 -7.566 -5.032 35 HZ PHE 24 HZ PHE 24 -7.421 -8.217 -3.456 36 H VAL 25 H VAL 25 -0.389 -4.523 -2.390 37 HA VAL 25 HA VAL 25 -0.056 -2.388 -0.416 38 HB VAL 25 HB VAL 25 1.583 -3.957 0.274 39 HG11 VAL 25 1HG1 VAL 25 2.579 -4.105 -2.561 40 HG12 VAL 25 2HG1 VAL 25 1.614 -5.342 -1.758 41 HG13 VAL 25 3HG1 VAL 25 3.235 -4.965 -1.170 42 HG21 VAL 25 1HG2 VAL 25 2.338 -1.646 0.216 43 HG22 VAL 25 2HG2 VAL 25 2.926 -1.866 -1.432 44 HG23 VAL 25 3HG2 VAL 25 3.676 -2.751 -0.104 45 H LEU 26 H LEU 26 -0.221 -0.551 -1.344 46 HA LEU 26 HA LEU 26 0.538 -0.219 -4.165 47 HB2 LEU 26 1HB LEU 26 -1.253 1.405 -2.351 48 HB3 LEU 26 2HB LEU 26 -0.714 1.983 -3.906 49 HG LEU 26 HG LEU 26 -1.926 0.200 -5.041 50 HD11 LEU 26 1HD1 LEU 26 -2.831 -0.668 -2.306 51 HD12 LEU 26 2HD1 LEU 26 -1.746 -1.563 -3.370 52 HD13 LEU 26 3HD1 LEU 26 -3.424 -1.294 -3.846 53 HD21 LEU 26 1HD2 LEU 26 -3.588 1.679 -3.012 54 HD22 LEU 26 2HD2 LEU 26 -4.217 0.880 -4.453 55 HD23 LEU 26 3HD2 LEU 26 -3.120 2.249 -4.614 56 H ILE 27 H ILE 27 1.717 1.767 -4.702 57 HA ILE 27 HA ILE 27 3.122 3.045 -2.510 58 HB ILE 27 HB ILE 27 4.525 1.129 -2.805 59 HG12 ILE 27 1HG1 ILE 27 5.765 3.482 -4.253 60 HG13 ILE 27 2HG1 ILE 27 5.672 3.293 -2.506 61 HG21 ILE 27 1HG2 ILE 27 4.588 1.781 -5.747 62 HG22 ILE 27 2HG2 ILE 27 3.737 0.428 -5.001 63 HG23 ILE 27 3HG2 ILE 27 5.500 0.496 -4.954 64 HD11 ILE 27 1HD1 ILE 27 7.183 1.501 -4.393 65 HD12 ILE 27 2HD1 ILE 27 7.099 1.322 -2.641 66 HD13 ILE 27 3HD1 ILE 27 7.881 2.737 -3.347 67 H LEU 28 H LEU 28 3.198 5.164 -2.961 68 HA LEU 28 HA LEU 28 3.568 5.923 -5.798 69 HB2 LEU 28 1HB LEU 28 2.641 7.811 -3.653 70 HB3 LEU 28 2HB LEU 28 2.449 7.950 -5.389 71 HG LEU 28 HG LEU 28 0.971 6.009 -3.612 72 HD11 LEU 28 1HD1 LEU 28 0.300 8.326 -3.285 73 HD12 LEU 28 2HD1 LEU 28 -0.961 7.402 -4.096 74 HD13 LEU 28 3HD1 LEU 28 0.054 8.504 -5.021 75 HD21 LEU 28 1HD2 LEU 28 0.559 6.612 -6.537 76 HD22 LEU 28 2HD2 LEU 28 -0.320 5.438 -5.553 77 HD23 LEU 28 3HD2 LEU 28 1.386 5.185 -5.917 78 H SER 29 H SER 29 5.799 5.439 -5.418 79 HA SER 29 HA SER 29 7.216 7.856 -4.690 80 HB2 SER 29 1HB SER 29 7.289 6.451 -2.630 81 HB3 SER 29 2HB SER 29 8.018 5.150 -3.570 82 HG SER 29 HG SER 29 9.116 7.751 -3.169 83 H ASN 30 H ASN 30 9.013 8.160 -6.124 84 HA ASN 30 HA ASN 30 9.764 5.697 -7.557 85 HB2 ASN 30 1HB ASN 30 8.625 7.335 -9.057 86 HB3 ASN 30 2HB ASN 30 9.905 8.491 -8.706 87 HD21 ASN 30 1HD2 ASN 30 9.094 5.507 -10.292 88 HD22 ASN 30 2HD2 ASN 30 10.510 5.412 -11.284 89 H ASP 31 H ASP 31 11.273 5.370 -5.863 90 HA ASP 31 HA ASP 31 13.793 6.663 -6.636 91 HB2 ASP 31 1HB ASP 31 13.388 6.969 -4.236 92 HB3 ASP 31 2HB ASP 31 13.167 5.235 -4.043 93 H LYS 32 H LYS 32 15.382 5.326 -7.414 94 HA LYS 32 HA LYS 32 14.507 2.953 -8.650 95 HB2 LYS 32 1HB LYS 32 17.307 3.970 -8.226 96 HB3 LYS 32 2HB LYS 32 16.846 2.687 -9.336 97 HG2 LYS 32 1HG LYS 32 15.239 4.471 -10.316 98 HG3 LYS 32 2HG LYS 32 16.305 5.614 -9.497 99 HD2 LYS 32 1HD LYS 32 17.312 3.485 -11.343 100 HD3 LYS 32 2HD LYS 32 16.833 5.080 -11.920 101 HE2 LYS 32 1HE LYS 32 19.144 5.255 -11.638 102 HE3 LYS 32 2HE LYS 32 18.482 5.998 -10.187 103 HZ1 LYS 32 1HZ LYS 32 19.550 3.235 -10.391 104 HZ2 LYS 32 2HZ LYS 32 18.910 3.934 -8.992 105 HZ3 LYS 32 3HZ LYS 32 20.330 4.548 -9.668 106 H LYS 33 H LYS 33 16.294 3.512 -5.657 107 HA LYS 33 HA LYS 33 16.816 0.679 -5.305 108 HB2 LYS 33 1HB LYS 33 18.463 2.359 -4.546 109 HB3 LYS 33 2HB LYS 33 17.280 2.990 -3.409 110 HG2 LYS 33 1HG LYS 33 17.221 0.708 -2.362 111 HG3 LYS 33 2HG LYS 33 18.600 0.291 -3.380 112 HD2 LYS 33 1HD LYS 33 19.881 2.129 -2.381 113 HD3 LYS 33 2HD LYS 33 18.501 2.526 -1.354 114 HE2 LYS 33 1HE LYS 33 18.630 0.213 -0.423 115 HE3 LYS 33 2HE LYS 33 20.116 -0.020 -1.341 116 HZ1 LYS 33 1HZ LYS 33 19.654 1.955 0.821 117 HZ2 LYS 33 2HZ LYS 33 21.046 1.905 -0.134 118 HZ3 LYS 33 3HZ LYS 33 20.668 0.605 0.876 119 H LEU 34 H LEU 34 14.812 3.199 -3.838 120 HA LEU 34 HA LEU 34 13.667 1.738 -1.765 121 HB2 LEU 34 1HB LEU 34 13.474 4.233 -2.317 122 HB3 LEU 34 2HB LEU 34 12.172 3.782 -3.396 123 HG LEU 34 HG LEU 34 12.089 3.096 -0.466 124 HD11 LEU 34 1HD1 LEU 34 11.072 5.604 -1.793 125 HD12 LEU 34 2HD1 LEU 34 12.412 5.508 -0.652 126 HD13 LEU 34 3HD1 LEU 34 10.774 5.124 -0.123 127 HD21 LEU 34 1HD2 LEU 34 9.680 3.053 -0.849 128 HD22 LEU 34 2HD2 LEU 34 10.508 1.930 -1.927 129 HD23 LEU 34 3HD2 LEU 34 9.932 3.480 -2.541 130 H ILE 35 H ILE 35 12.518 2.122 -5.111 131 HA ILE 35 HA ILE 35 10.202 0.566 -4.870 132 HB ILE 35 HB ILE 35 11.945 1.195 -7.245 133 HG12 ILE 35 1HG1 ILE 35 9.207 2.165 -6.397 134 HG13 ILE 35 2HG1 ILE 35 10.712 3.066 -6.238 135 HG21 ILE 35 1HG2 ILE 35 10.844 -0.936 -7.669 136 HG22 ILE 35 2HG2 ILE 35 10.183 0.340 -8.689 137 HG23 ILE 35 3HG2 ILE 35 9.284 -0.217 -7.277 138 HD11 ILE 35 1HD1 ILE 35 10.938 3.179 -8.638 139 HD12 ILE 35 2HD1 ILE 35 9.360 3.796 -8.149 140 HD13 ILE 35 3HD1 ILE 35 9.498 2.181 -8.845 141 H GLU 36 H GLU 36 13.514 -0.349 -5.766 142 HA GLU 36 HA GLU 36 13.028 -3.067 -6.260 143 HB2 GLU 36 1HB GLU 36 15.450 -1.506 -5.437 144 HB3 GLU 36 2HB GLU 36 15.515 -3.262 -5.495 145 HG2 GLU 36 1HG GLU 36 14.732 -1.496 -7.795 146 HG3 GLU 36 2HG GLU 36 16.335 -2.190 -7.551 147 H GLU 37 H GLU 37 14.256 -1.518 -3.298 148 HA GLU 37 HA GLU 37 14.347 -3.849 -1.749 149 HB2 GLU 37 1HB GLU 37 14.092 -0.945 -0.987 150 HB3 GLU 37 2HB GLU 37 14.281 -2.228 0.196 151 HG2 GLU 37 1HG GLU 37 16.226 -1.596 -2.010 152 HG3 GLU 37 2HG GLU 37 16.397 -1.109 -0.323 153 H ALA 38 H ALA 38 11.749 -1.509 -2.244 154 HA ALA 38 HA ALA 38 9.980 -2.508 -0.292 155 HB1 ALA 38 1HB ALA 38 9.687 -0.318 -1.345 156 HB2 ALA 38 2HB ALA 38 8.235 -1.308 -1.507 157 HB3 ALA 38 3HB ALA 38 9.322 -1.103 -2.881 158 H ARG 39 H ARG 39 10.340 -3.254 -3.757 159 HA ARG 39 HA ARG 39 8.190 -5.062 -3.898 160 HB2 ARG 39 1HB ARG 39 9.308 -4.149 -5.912 161 HB3 ARG 39 2HB ARG 39 10.724 -5.129 -5.545 162 HG2 ARG 39 1HG ARG 39 9.092 -7.136 -5.608 163 HG3 ARG 39 2HG ARG 39 8.005 -6.015 -6.434 164 HD2 ARG 39 1HD ARG 39 10.802 -6.702 -7.323 165 HD3 ARG 39 2HD ARG 39 9.322 -7.366 -8.006 166 HE ARG 39 HE ARG 39 10.088 -4.517 -8.159 167 HH11 ARG 39 1HH1 ARG 39 8.530 -7.353 -9.501 168 HH12 ARG 39 2HH1 ARG 39 8.115 -6.574 -10.992 169 HH21 ARG 39 1HH2 ARG 39 9.546 -3.493 -10.120 170 HH22 ARG 39 2HH2 ARG 39 8.691 -4.375 -11.347 171 H LYS 40 H LYS 40 11.622 -5.548 -3.189 172 HA LYS 40 HA LYS 40 11.717 -8.310 -3.294 173 HB2 LYS 40 1HB LYS 40 13.226 -6.443 -1.463 174 HB3 LYS 40 2HB LYS 40 13.645 -8.129 -1.735 175 HG2 LYS 40 1HG LYS 40 14.082 -7.686 -4.066 176 HG3 LYS 40 2HG LYS 40 13.552 -6.012 -3.878 177 HD2 LYS 40 1HD LYS 40 15.380 -5.665 -2.247 178 HD3 LYS 40 2HD LYS 40 15.936 -7.310 -2.564 179 HE2 LYS 40 1HE LYS 40 16.365 -6.768 -4.873 180 HE3 LYS 40 2HE LYS 40 15.670 -5.161 -4.660 181 HZ1 LYS 40 1HZ LYS 40 17.451 -4.695 -3.041 182 HZ2 LYS 40 2HZ LYS 40 18.043 -5.009 -4.599 183 HZ3 LYS 40 3HZ LYS 40 18.148 -6.198 -3.404 184 H MET 41 H MET 41 10.595 -6.248 -0.670 185 HA MET 41 HA MET 41 10.359 -8.343 1.240 186 HB2 MET 41 1HB MET 41 9.041 -5.633 1.093 187 HB3 MET 41 2HB MET 41 8.875 -6.731 2.457 188 HG2 MET 41 1HG MET 41 11.417 -5.472 1.460 189 HG3 MET 41 2HG MET 41 10.533 -5.065 2.927 190 HE1 MET 41 1HE MET 41 10.375 -6.589 5.049 191 HE2 MET 41 2HE MET 41 11.053 -8.214 5.155 192 HE3 MET 41 3HE MET 41 9.693 -7.894 4.078 193 H ALA 42 H ALA 42 7.940 -6.676 -0.786 194 HA ALA 42 HA ALA 42 5.796 -8.353 0.067 195 HB1 ALA 42 1HB ALA 42 4.516 -7.287 -1.707 196 HB2 ALA 42 2HB ALA 42 5.993 -6.583 -2.363 197 HB3 ALA 42 3HB ALA 42 5.417 -6.097 -0.768 198 H GLU 43 H GLU 43 8.153 -8.522 -2.476 199 HA GLU 43 HA GLU 43 6.961 -10.452 -4.132 200 HB2 GLU 43 1HB GLU 43 9.230 -9.013 -4.274 201 HB3 GLU 43 2HB GLU 43 9.905 -10.531 -3.706 202 HG2 GLU 43 1HG GLU 43 8.302 -10.107 -6.216 203 HG3 GLU 43 2HG GLU 43 10.034 -10.397 -6.108 204 H LYS 44 H LYS 44 9.335 -10.742 -1.521 205 HA LYS 44 HA LYS 44 9.309 -13.564 -1.361 206 HB2 LYS 44 1HB LYS 44 11.034 -11.854 -0.477 207 HB3 LYS 44 2HB LYS 44 9.979 -11.715 0.918 208 HG2 LYS 44 1HG LYS 44 11.126 -14.332 -0.009 209 HG3 LYS 44 2HG LYS 44 11.934 -13.279 1.148 210 HD2 LYS 44 1HD LYS 44 10.074 -13.460 2.672 211 HD3 LYS 44 2HD LYS 44 9.159 -14.401 1.496 212 HE2 LYS 44 1HE LYS 44 11.768 -15.239 2.752 213 HE3 LYS 44 2HE LYS 44 10.172 -15.806 3.241 214 HZ1 LYS 44 1HZ LYS 44 11.238 -17.389 1.779 215 HZ2 LYS 44 2HZ LYS 44 11.419 -16.215 0.576 216 HZ3 LYS 44 3HZ LYS 44 9.874 -16.735 1.023 217 H ALA 45 H ALA 45 7.459 -11.026 0.213 218 HA ALA 45 HA ALA 45 6.244 -12.750 2.134 219 HB1 ALA 45 1HB ALA 45 5.464 -9.974 1.280 220 HB2 ALA 45 2HB ALA 45 6.562 -10.386 2.594 221 HB3 ALA 45 3HB ALA 45 4.857 -10.825 2.701 222 H ASN 46 H ASN 46 5.759 -12.352 -1.127 223 HA ASN 46 HA ASN 46 4.230 -13.092 -2.614 224 HB2 ASN 46 1HB ASN 46 3.474 -14.722 -0.212 225 HB3 ASN 46 2HB ASN 46 2.518 -14.813 -1.686 226 HD21 ASN 46 1HD2 ASN 46 3.419 -15.707 -3.533 227 HD22 ASN 46 2HD2 ASN 46 4.854 -16.672 -3.483 228 H LEU 47 H LEU 47 3.738 -10.618 -1.615 229 HA LEU 47 HA LEU 47 0.876 -10.496 -1.004 230 HB2 LEU 47 1HB LEU 47 2.836 -8.215 -1.220 231 HB3 LEU 47 2HB LEU 47 1.232 -8.164 -0.524 232 HG LEU 47 HG LEU 47 3.642 -9.576 0.610 233 HD11 LEU 47 1HD1 LEU 47 3.371 -7.975 2.442 234 HD12 LEU 47 2HD1 LEU 47 2.038 -7.214 1.571 235 HD13 LEU 47 3HD1 LEU 47 3.671 -7.166 0.903 236 HD21 LEU 47 1HD2 LEU 47 0.824 -9.458 1.671 237 HD22 LEU 47 2HD2 LEU 47 2.219 -10.137 2.509 238 HD23 LEU 47 3HD2 LEU 47 1.632 -10.886 1.026 239 H ILE 48 H ILE 48 -0.140 -8.421 -2.143 240 HA ILE 48 HA ILE 48 0.413 -8.699 -5.018 241 HB ILE 48 HB ILE 48 -2.078 -7.600 -3.693 242 HG12 ILE 48 1HG1 ILE 48 -1.594 -10.279 -5.021 243 HG13 ILE 48 2HG1 ILE 48 -1.779 -10.020 -3.291 244 HG21 ILE 48 1HG2 ILE 48 -1.505 -8.287 -6.577 245 HG22 ILE 48 2HG2 ILE 48 -1.659 -6.663 -5.910 246 HG23 ILE 48 3HG2 ILE 48 -3.055 -7.740 -5.937 247 HD11 ILE 48 1HD1 ILE 48 -3.810 -10.898 -4.279 248 HD12 ILE 48 2HD1 ILE 48 -3.881 -9.528 -5.385 249 HD13 ILE 48 3HD1 ILE 48 -4.072 -9.271 -3.651 250 H LEU 49 H LEU 49 2.006 -7.246 -5.350 251 HA LEU 49 HA LEU 49 1.778 -4.553 -4.259 252 HB2 LEU 49 1HB LEU 49 3.931 -5.582 -4.007 253 HB3 LEU 49 2HB LEU 49 3.990 -5.998 -5.707 254 HG LEU 49 HG LEU 49 4.100 -3.558 -6.243 255 HD11 LEU 49 1HD1 LEU 49 4.454 -3.276 -3.265 256 HD12 LEU 49 2HD1 LEU 49 3.094 -2.675 -4.214 257 HD13 LEU 49 3HD1 LEU 49 4.706 -2.004 -4.459 258 HD21 LEU 49 1HD2 LEU 49 6.266 -4.642 -4.454 259 HD22 LEU 49 2HD2 LEU 49 6.443 -3.307 -5.594 260 HD23 LEU 49 3HD2 LEU 49 6.103 -4.933 -6.185 261 H ILE 50 H ILE 50 0.944 -2.958 -5.385 262 HA ILE 50 HA ILE 50 0.978 -3.149 -8.325 263 HB ILE 50 HB ILE 50 -0.883 -1.460 -6.633 264 HG12 ILE 50 1HG1 ILE 50 -2.602 -3.092 -7.785 265 HG13 ILE 50 2HG1 ILE 50 -1.211 -4.165 -7.894 266 HG21 ILE 50 1HG2 ILE 50 -0.830 -1.983 -9.601 267 HG22 ILE 50 2HG2 ILE 50 -0.397 -0.476 -8.798 268 HG23 ILE 50 3HG2 ILE 50 -2.061 -1.056 -8.743 269 HD11 ILE 50 1HD1 ILE 50 -2.556 -4.641 -5.929 270 HD12 ILE 50 2HD1 ILE 50 -2.330 -2.988 -5.361 271 HD13 ILE 50 3HD1 ILE 50 -0.949 -4.078 -5.474 272 H THR 51 H THR 51 2.789 -2.131 -8.926 273 HA THR 51 HA THR 51 3.797 0.174 -7.557 274 HB THR 51 HB THR 51 5.318 0.188 -9.711 275 HG1 THR 51 HG1 THR 51 4.730 -2.555 -9.749 276 HG21 THR 51 1HG2 THR 51 6.082 -0.387 -7.457 277 HG22 THR 51 2HG2 THR 51 6.781 -1.474 -8.658 278 HG23 THR 51 3HG2 THR 51 5.439 -2.017 -7.650 279 H VAL 52 H VAL 52 2.511 1.917 -7.686 280 HA VAL 52 HA VAL 52 1.620 2.787 -10.348 281 HB VAL 52 HB VAL 52 0.126 4.321 -8.722 282 HG11 VAL 52 1HG1 VAL 52 -0.561 1.487 -9.483 283 HG12 VAL 52 2HG1 VAL 52 -0.655 2.882 -10.556 284 HG13 VAL 52 3HG1 VAL 52 -1.702 2.787 -9.142 285 HG21 VAL 52 1HG2 VAL 52 -0.705 3.008 -6.845 286 HG22 VAL 52 2HG2 VAL 52 1.025 3.305 -6.675 287 HG23 VAL 52 3HG2 VAL 52 0.450 1.727 -7.213 288 H GLY 53 H GLY 53 1.030 5.375 -9.874 289 HA2 GLY 53 1HA GLY 53 3.246 6.719 -8.618 290 HA3 GLY 53 2HA GLY 53 3.282 6.767 -10.375 291 H ASP 54 H ASP 54 1.936 8.016 -7.545 292 HA ASP 54 HA ASP 54 1.253 10.225 -7.322 293 HB2 ASP 54 1HB ASP 54 1.552 10.855 -9.651 294 HB3 ASP 54 2HB ASP 54 0.113 9.953 -10.111 295 H GLU 55 H GLU 55 -0.853 11.137 -6.726 296 HA GLU 55 HA GLU 55 -2.402 9.252 -5.386 297 HB2 GLU 55 1HB GLU 55 -3.164 12.060 -6.196 298 HB3 GLU 55 2HB GLU 55 -3.971 11.096 -4.965 299 HG2 GLU 55 1HG GLU 55 -1.801 11.012 -3.726 300 HG3 GLU 55 2HG GLU 55 -1.170 12.177 -4.891 301 H GLU 56 H GLU 56 -2.831 10.691 -8.563 302 HA GLU 56 HA GLU 56 -5.507 9.805 -8.918 303 HB2 GLU 56 1HB GLU 56 -3.400 10.580 -10.934 304 HB3 GLU 56 2HB GLU 56 -5.096 10.312 -11.315 305 HG2 GLU 56 1HG GLU 56 -4.072 12.380 -9.380 306 HG3 GLU 56 2HG GLU 56 -4.525 12.696 -11.059 307 H GLU 57 H GLU 57 -2.355 8.453 -9.771 308 HA GLU 57 HA GLU 57 -3.369 6.141 -11.038 309 HB2 GLU 57 1HB GLU 57 -0.791 7.173 -10.306 310 HB3 GLU 57 2HB GLU 57 -0.903 5.467 -9.901 311 HG2 GLU 57 1HG GLU 57 0.010 5.849 -12.146 312 HG3 GLU 57 2HG GLU 57 -1.479 4.912 -12.168 313 H LEU 58 H LEU 58 -2.742 7.027 -7.747 314 HA LEU 58 HA LEU 58 -2.905 4.516 -6.516 315 HB2 LEU 58 1HB LEU 58 -2.203 6.667 -5.441 316 HB3 LEU 58 2HB LEU 58 -3.889 7.143 -5.408 317 HG LEU 58 HG LEU 58 -4.318 5.066 -4.014 318 HD11 LEU 58 1HD1 LEU 58 -2.468 4.047 -2.884 319 HD12 LEU 58 2HD1 LEU 58 -1.331 5.154 -3.653 320 HD13 LEU 58 3HD1 LEU 58 -2.181 3.953 -4.622 321 HD21 LEU 58 1HD2 LEU 58 -2.518 7.206 -2.886 322 HD22 LEU 58 2HD2 LEU 58 -3.563 6.136 -1.953 323 HD23 LEU 58 3HD2 LEU 58 -4.269 7.309 -3.065 324 H LYS 59 H LYS 59 -5.413 6.826 -7.455 325 HA LYS 59 HA LYS 59 -7.624 5.652 -6.258 326 HB2 LYS 59 1HB LYS 59 -7.639 6.935 -8.973 327 HB3 LYS 59 2HB LYS 59 -8.990 6.805 -7.859 328 HG2 LYS 59 1HG LYS 59 -7.839 8.309 -6.305 329 HG3 LYS 59 2HG LYS 59 -6.506 8.456 -7.454 330 HD2 LYS 59 1HD LYS 59 -9.348 9.397 -7.768 331 HD3 LYS 59 2HD LYS 59 -7.869 10.355 -7.780 332 HE2 LYS 59 1HE LYS 59 -7.192 9.194 -9.868 333 HE3 LYS 59 2HE LYS 59 -8.753 8.377 -9.872 334 HZ1 LYS 59 1HZ LYS 59 -8.240 11.284 -10.157 335 HZ2 LYS 59 2HZ LYS 59 -9.782 10.631 -9.905 336 HZ3 LYS 59 3HZ LYS 59 -8.917 10.233 -11.302 337 H LYS 60 H LYS 60 -5.999 4.919 -9.201 338 HA LYS 60 HA LYS 60 -7.985 3.106 -10.186 339 HB2 LYS 60 1HB LYS 60 -5.117 3.415 -11.066 340 HB3 LYS 60 2HB LYS 60 -6.474 2.807 -12.015 341 HG2 LYS 60 1HG LYS 60 -7.479 4.926 -12.140 342 HG3 LYS 60 2HG LYS 60 -6.436 5.583 -10.868 343 HD2 LYS 60 1HD LYS 60 -5.689 6.415 -13.003 344 HD3 LYS 60 2HD LYS 60 -4.499 5.256 -12.412 345 HE2 LYS 60 1HE LYS 60 -4.891 4.911 -14.773 346 HE3 LYS 60 2HE LYS 60 -5.484 3.530 -13.853 347 HZ1 LYS 60 1HZ LYS 60 -7.725 4.428 -14.041 348 HZ2 LYS 60 2HZ LYS 60 -7.045 4.180 -15.565 349 HZ3 LYS 60 3HZ LYS 60 -7.145 5.741 -14.932 350 H ALA 61 H ALA 61 -4.794 2.764 -8.673 351 HA ALA 61 HA ALA 61 -4.709 -0.054 -8.673 352 HB1 ALA 61 1HB ALA 61 -3.460 1.898 -6.735 353 HB2 ALA 61 2HB ALA 61 -2.739 1.331 -8.244 354 HB3 ALA 61 3HB ALA 61 -3.014 0.201 -6.920 355 H ILE 62 H ILE 62 -6.043 2.319 -6.480 356 HA ILE 62 HA ILE 62 -6.784 0.731 -4.332 357 HB ILE 62 HB ILE 62 -7.818 3.276 -5.501 358 HG12 ILE 62 1HG1 ILE 62 -6.716 2.592 -2.770 359 HG13 ILE 62 2HG1 ILE 62 -5.745 3.164 -4.126 360 HG21 ILE 62 1HG2 ILE 62 -9.865 2.317 -4.783 361 HG22 ILE 62 2HG2 ILE 62 -9.376 3.484 -3.552 362 HG23 ILE 62 3HG2 ILE 62 -9.145 1.756 -3.275 363 HD11 ILE 62 1HD1 ILE 62 -6.253 4.948 -2.559 364 HD12 ILE 62 2HD1 ILE 62 -7.980 4.684 -2.802 365 HD13 ILE 62 3HD1 ILE 62 -6.976 5.253 -4.137 366 H LYS 63 H LYS 63 -8.677 1.503 -7.261 367 HA LYS 63 HA LYS 63 -10.917 -0.029 -6.447 368 HB2 LYS 63 1HB LYS 63 -11.167 1.757 -8.073 369 HB3 LYS 63 2HB LYS 63 -10.100 0.928 -9.193 370 HG2 LYS 63 1HG LYS 63 -12.549 0.772 -9.708 371 HG3 LYS 63 2HG LYS 63 -11.695 -0.766 -9.616 372 HD2 LYS 63 1HD LYS 63 -13.888 -0.856 -8.510 373 HD3 LYS 63 2HD LYS 63 -12.567 -1.148 -7.381 374 HE2 LYS 63 1HE LYS 63 -12.722 1.205 -6.647 375 HE3 LYS 63 2HE LYS 63 -14.094 1.429 -7.733 376 HZ1 LYS 63 1HZ LYS 63 -14.074 -0.638 -5.606 377 HZ2 LYS 63 2HZ LYS 63 -15.401 -0.039 -6.474 378 HZ3 LYS 63 3HZ LYS 63 -14.626 0.940 -5.334 379 H LYS 64 H LYS 64 -8.079 -0.764 -8.419 380 HA LYS 64 HA LYS 64 -8.953 -3.313 -9.262 381 HB2 LYS 64 1HB LYS 64 -6.141 -2.267 -8.891 382 HB3 LYS 64 2HB LYS 64 -6.556 -3.760 -9.725 383 HG2 LYS 64 1HG LYS 64 -7.939 -2.389 -11.300 384 HG3 LYS 64 2HG LYS 64 -7.263 -0.952 -10.537 385 HD2 LYS 64 1HD LYS 64 -5.665 -3.124 -11.886 386 HD3 LYS 64 2HD LYS 64 -6.087 -1.575 -12.611 387 HE2 LYS 64 1HE LYS 64 -4.855 -0.433 -10.802 388 HE3 LYS 64 2HE LYS 64 -4.382 -2.007 -10.163 389 HZ1 LYS 64 1HZ LYS 64 -3.692 -0.940 -12.845 390 HZ2 LYS 64 2HZ LYS 64 -3.259 -2.466 -12.263 391 HZ3 LYS 64 3HZ LYS 64 -2.640 -1.076 -11.531 392 H ALA 65 H ALA 65 -7.198 -2.218 -6.405 393 HA ALA 65 HA ALA 65 -6.700 -4.782 -5.311 394 HB1 ALA 65 1HB ALA 65 -6.303 -3.595 -3.213 395 HB2 ALA 65 2HB ALA 65 -7.027 -2.138 -3.892 396 HB3 ALA 65 3HB ALA 65 -5.523 -2.769 -4.561 397 H ASP 66 H ASP 66 -9.263 -2.405 -4.747 398 HA ASP 66 HA ASP 66 -10.784 -3.896 -2.926 399 HB2 ASP 66 1HB ASP 66 -11.329 -1.648 -2.992 400 HB3 ASP 66 2HB ASP 66 -11.316 -1.577 -4.741 401 H ASP 67 H ASP 67 -10.722 -3.907 -6.444 402 HA ASP 67 HA ASP 67 -12.947 -5.611 -6.836 403 HB2 ASP 67 1HB ASP 67 -10.578 -4.838 -8.481 404 HB3 ASP 67 2HB ASP 67 -11.515 -6.239 -8.978 405 H ILE 68 H ILE 68 -9.455 -6.367 -6.882 406 HA ILE 68 HA ILE 68 -9.771 -9.128 -7.256 407 HB ILE 68 HB ILE 68 -7.458 -7.658 -5.980 408 HG12 ILE 68 1HG1 ILE 68 -7.826 -8.607 -8.831 409 HG13 ILE 68 2HG1 ILE 68 -8.053 -6.945 -8.297 410 HG21 ILE 68 1HG2 ILE 68 -7.581 -10.442 -7.137 411 HG22 ILE 68 2HG2 ILE 68 -7.385 -10.026 -5.434 412 HG23 ILE 68 3HG2 ILE 68 -6.117 -9.624 -6.592 413 HD11 ILE 68 1HD1 ILE 68 -5.708 -6.827 -7.647 414 HD12 ILE 68 2HD1 ILE 68 -5.884 -7.259 -9.349 415 HD13 ILE 68 3HD1 ILE 68 -5.479 -8.498 -8.162 416 H ALA 69 H ALA 69 -9.561 -7.204 -4.316 417 HA ALA 69 HA ALA 69 -9.177 -9.202 -2.423 418 HB1 ALA 69 1HB ALA 69 -9.149 -6.757 -1.980 419 HB2 ALA 69 2HB ALA 69 -10.097 -7.675 -0.811 420 HB3 ALA 69 3HB ALA 69 -10.909 -6.759 -2.081 421 H LYS 70 H LYS 70 -12.171 -7.984 -3.819 422 HA LYS 70 HA LYS 70 -13.757 -9.643 -2.066 423 HB2 LYS 70 1HB LYS 70 -14.457 -7.631 -4.165 424 HB3 LYS 70 2HB LYS 70 -15.655 -8.456 -3.178 425 HG2 LYS 70 1HG LYS 70 -14.827 -7.455 -1.189 426 HG3 LYS 70 2HG LYS 70 -13.411 -6.823 -2.021 427 HD2 LYS 70 1HD LYS 70 -14.775 -5.274 -3.255 428 HD3 LYS 70 2HD LYS 70 -16.250 -5.989 -2.593 429 HE2 LYS 70 1HE LYS 70 -15.676 -5.273 -0.379 430 HE3 LYS 70 2HE LYS 70 -14.087 -4.737 -0.912 431 HZ1 LYS 70 1HZ LYS 70 -15.032 -2.963 -2.109 432 HZ2 LYS 70 2HZ LYS 70 -15.780 -2.954 -0.584 433 HZ3 LYS 70 3HZ LYS 70 -16.605 -3.564 -1.930 434 H LYS 71 H LYS 71 -12.414 -9.952 -5.136 435 HA LYS 71 HA LYS 71 -14.344 -11.708 -6.245 436 HB2 LYS 71 1HB LYS 71 -11.358 -11.544 -6.714 437 HB3 LYS 71 2HB LYS 71 -12.472 -12.501 -7.680 438 HG2 LYS 71 1HG LYS 71 -13.636 -10.462 -8.355 439 HG3 LYS 71 2HG LYS 71 -12.507 -9.505 -7.395 440 HD2 LYS 71 1HD LYS 71 -10.651 -10.358 -8.771 441 HD3 LYS 71 2HD LYS 71 -11.810 -11.259 -9.751 442 HE2 LYS 71 1HE LYS 71 -11.724 -8.263 -9.414 443 HE3 LYS 71 2HE LYS 71 -11.169 -9.158 -10.826 444 HZ1 LYS 71 1HZ LYS 71 -13.958 -9.028 -9.818 445 HZ2 LYS 71 2HZ LYS 71 -13.447 -9.962 -11.131 446 HZ3 LYS 71 3HZ LYS 71 -13.358 -8.276 -11.208 447 H GLN 72 H GLN 72 -11.762 -12.048 -3.912 448 HA GLN 72 HA GLN 72 -12.419 -14.916 -3.770 449 HB2 GLN 72 1HB GLN 72 -10.028 -15.418 -3.306 450 HB3 GLN 72 2HB GLN 72 -10.358 -14.843 -4.931 451 HG2 GLN 72 1HG GLN 72 -9.568 -12.605 -4.272 452 HG3 GLN 72 2HG GLN 72 -9.176 -13.238 -2.674 453 HE21 GLN 72 1HE2 GLN 72 -6.990 -12.809 -2.871 454 HE22 GLN 72 2HE2 GLN 72 -5.954 -13.700 -3.931 455 H ASN 73 H ASN 73 -10.949 -12.255 -1.863 456 HA ASN 73 HA ASN 73 -11.172 -14.034 0.466 457 HB2 ASN 73 1HB ASN 73 -9.010 -12.071 -0.230 458 HB3 ASN 73 2HB ASN 73 -9.184 -12.760 1.379 459 HD21 ASN 73 1HD2 ASN 73 -10.089 -15.355 0.368 460 HD22 ASN 73 2HD2 ASN 73 -8.678 -16.125 -0.271 461 H SER 74 H SER 74 -13.004 -11.795 -0.501 462 HA SER 74 HA SER 74 -12.703 -9.490 0.998 463 HB2 SER 74 1HB SER 74 -15.403 -9.664 0.689 464 HB3 SER 74 2HB SER 74 -14.264 -9.067 -0.508 465 HG SER 74 HG SER 74 -15.871 -11.103 -0.768 466 H SER 75 H SER 75 -13.331 -12.473 2.400 467 HA SER 75 HA SER 75 -14.986 -11.931 4.539 468 HB2 SER 75 1HB SER 75 -13.754 -14.091 4.118 469 HB3 SER 75 2HB SER 75 -12.303 -13.324 4.753 470 HG SER 75 HG SER 75 -14.142 -12.887 6.547 471 H GLU 76 H GLU 76 -11.634 -10.984 4.010 472 HA GLU 76 HA GLU 76 -12.043 -8.458 5.182 473 HB2 GLU 76 1HB GLU 76 -11.739 -9.854 7.268 474 HB3 GLU 76 2HB GLU 76 -10.104 -10.194 6.720 475 HG2 GLU 76 1HG GLU 76 -10.186 -8.378 8.367 476 HG3 GLU 76 2HG GLU 76 -9.539 -7.845 6.814 477 H ALA 77 H ALA 77 -10.464 -7.036 4.538 478 HA ALA 77 HA ALA 77 -8.161 -8.142 3.100 479 HB1 ALA 77 1HB ALA 77 -8.601 -6.735 1.159 480 HB2 ALA 77 2HB ALA 77 -10.089 -6.152 1.903 481 HB3 ALA 77 3HB ALA 77 -9.939 -7.847 1.439 482 H LYS 78 H LYS 78 -6.371 -6.838 3.098 483 HA LYS 78 HA LYS 78 -6.654 -4.234 4.434 484 HB2 LYS 78 1HB LYS 78 -4.439 -6.245 4.866 485 HB3 LYS 78 2HB LYS 78 -4.483 -4.624 5.543 486 HG2 LYS 78 1HG LYS 78 -6.613 -5.274 6.700 487 HG3 LYS 78 2HG LYS 78 -6.306 -6.929 6.172 488 HD2 LYS 78 1HD LYS 78 -4.174 -6.920 7.352 489 HD3 LYS 78 2HD LYS 78 -4.449 -5.253 7.856 490 HE2 LYS 78 1HE LYS 78 -6.528 -6.036 9.005 491 HE3 LYS 78 2HE LYS 78 -6.038 -7.689 8.637 492 HZ1 LYS 78 1HZ LYS 78 -3.939 -7.219 9.855 493 HZ2 LYS 78 2HZ LYS 78 -5.327 -7.171 10.828 494 HZ3 LYS 78 3HZ LYS 78 -4.599 -5.730 10.332 495 H ILE 79 H ILE 79 -5.560 -2.581 3.545 496 HA ILE 79 HA ILE 79 -3.830 -3.212 1.247 497 HB ILE 79 HB ILE 79 -5.733 -0.874 1.496 498 HG12 ILE 79 1HG1 ILE 79 -5.792 -3.267 -0.361 499 HG13 ILE 79 2HG1 ILE 79 -6.862 -3.020 1.020 500 HG21 ILE 79 1HG2 ILE 79 -3.865 -1.649 -0.743 501 HG22 ILE 79 2HG2 ILE 79 -3.704 -0.248 0.316 502 HG23 ILE 79 3HG2 ILE 79 -5.056 -0.351 -0.811 503 HD11 ILE 79 1HD1 ILE 79 -7.966 -2.476 -1.071 504 HD12 ILE 79 2HD1 ILE 79 -6.717 -1.284 -1.437 505 HD13 ILE 79 3HD1 ILE 79 -7.792 -1.042 -0.061 506 H LEU 80 H LEU 80 -1.829 -2.588 1.569 507 HA LEU 80 HA LEU 80 -1.251 -0.442 3.479 508 HB2 LEU 80 1HB LEU 80 -0.012 -2.839 3.031 509 HB3 LEU 80 2HB LEU 80 0.964 -1.765 2.040 510 HG LEU 80 HG LEU 80 0.545 -1.660 5.015 511 HD11 LEU 80 1HD1 LEU 80 2.980 -1.843 5.068 512 HD12 LEU 80 2HD1 LEU 80 3.005 -1.921 3.305 513 HD13 LEU 80 3HD1 LEU 80 2.238 -3.209 4.234 514 HD21 LEU 80 1HD2 LEU 80 1.849 0.409 3.271 515 HD22 LEU 80 2HD2 LEU 80 1.970 0.340 5.026 516 HD23 LEU 80 3HD2 LEU 80 0.407 0.618 4.262 517 H ILE 81 H ILE 81 -0.857 1.572 2.746 518 HA ILE 81 HA ILE 81 -0.155 1.844 -0.104 519 HB ILE 81 HB ILE 81 -1.707 3.779 1.618 520 HG12 ILE 81 1HG1 ILE 81 -2.560 2.144 -0.783 521 HG13 ILE 81 2HG1 ILE 81 -3.005 1.809 0.887 522 HG21 ILE 81 1HG2 ILE 81 -1.956 5.103 -0.446 523 HG22 ILE 81 2HG2 ILE 81 -0.867 3.989 -1.272 524 HG23 ILE 81 3HG2 ILE 81 -0.273 4.973 0.065 525 HD11 ILE 81 1HD1 ILE 81 -4.810 2.898 -0.324 526 HD12 ILE 81 2HD1 ILE 81 -3.758 4.270 -0.674 527 HD13 ILE 81 3HD1 ILE 81 -4.222 3.915 0.990 528 H LEU 82 H LEU 82 2.017 1.971 0.012 529 HA LEU 82 HA LEU 82 3.336 3.784 1.834 530 HB2 LEU 82 1HB LEU 82 4.294 2.125 -0.491 531 HB3 LEU 82 2HB LEU 82 5.341 3.271 0.321 532 HG LEU 82 HG LEU 82 4.970 2.005 2.449 533 HD11 LEU 82 1HD1 LEU 82 2.841 0.952 1.749 534 HD12 LEU 82 2HD1 LEU 82 4.024 -0.189 2.389 535 HD13 LEU 82 3HD1 LEU 82 3.757 -0.077 0.649 536 HD21 LEU 82 1HD2 LEU 82 6.467 0.182 1.861 537 HD22 LEU 82 2HD2 LEU 82 6.961 1.682 1.073 538 HD23 LEU 82 3HD2 LEU 82 6.120 0.436 0.150 539 H LEU 83 H LEU 83 3.721 5.872 1.490 540 HA LEU 83 HA LEU 83 3.975 6.906 -1.200 541 HB2 LEU 83 1HB LEU 83 2.317 8.651 -0.955 542 HB3 LEU 83 2HB LEU 83 1.557 7.072 -0.884 543 HG LEU 83 HG LEU 83 2.061 8.947 1.443 544 HD11 LEU 83 1HD1 LEU 83 -0.346 9.186 1.482 545 HD12 LEU 83 2HD1 LEU 83 -0.503 8.066 0.128 546 HD13 LEU 83 3HD1 LEU 83 0.279 9.629 -0.107 547 HD21 LEU 83 1HD2 LEU 83 2.205 6.608 2.169 548 HD22 LEU 83 2HD2 LEU 83 0.637 6.287 1.427 549 HD23 LEU 83 3HD2 LEU 83 0.757 7.399 2.790 550 H GLU 84 H GLU 84 5.075 8.897 -1.276 551 HA GLU 84 HA GLU 84 6.063 9.747 1.342 552 HB2 GLU 84 1HB GLU 84 7.839 10.946 0.042 553 HB3 GLU 84 2HB GLU 84 7.872 9.197 -0.119 554 HG2 GLU 84 1HG GLU 84 6.751 9.387 -2.290 555 HG3 GLU 84 2HG GLU 84 6.756 11.142 -2.126 556 H LYS 85 H LYS 85 4.540 11.028 2.070 557 HA LYS 85 HA LYS 85 4.688 13.748 1.322 558 HB2 LYS 85 1HB LYS 85 2.318 14.132 0.785 559 HB3 LYS 85 2HB LYS 85 3.068 13.077 -0.402 560 HG2 LYS 85 1HG LYS 85 2.036 11.139 0.647 561 HG3 LYS 85 2HG LYS 85 1.311 12.179 1.875 562 HD2 LYS 85 1HD LYS 85 0.797 12.424 -1.088 563 HD3 LYS 85 2HD LYS 85 -0.247 11.554 0.035 564 HE2 LYS 85 1HE LYS 85 -0.660 13.596 1.277 565 HE3 LYS 85 2HE LYS 85 0.446 14.481 0.229 566 HZ1 LYS 85 1HZ LYS 85 -2.052 13.157 -0.674 567 HZ2 LYS 85 2HZ LYS 85 -1.013 14.091 -1.626 568 HZ3 LYS 85 3HZ LYS 85 -1.884 14.812 -0.372 569 HA PRO 86 HA PRO 86 3.364 14.071 5.586 570 HB2 PRO 86 1HB PRO 86 1.643 16.375 4.997 571 HB3 PRO 86 2HB PRO 86 3.112 16.305 5.972 572 HG2 PRO 86 1HG PRO 86 3.037 17.541 3.579 573 HG3 PRO 86 2HG PRO 86 4.488 16.715 4.176 574 HD2 PRO 86 1HD PRO 86 2.464 15.786 2.176 575 HD3 PRO 86 2HD PRO 86 4.230 15.605 2.159 576 H VAL 87 H VAL 87 1.973 12.849 6.579 577 HA VAL 87 HA VAL 87 -0.813 12.807 5.649 578 HB VAL 87 HB VAL 87 0.854 10.373 6.303 579 HG11 VAL 87 1HG1 VAL 87 -1.117 9.085 5.786 580 HG12 VAL 87 2HG1 VAL 87 -2.026 10.565 5.494 581 HG13 VAL 87 3HG1 VAL 87 -1.433 10.200 7.113 582 HG21 VAL 87 1HG2 VAL 87 0.411 9.720 3.976 583 HG22 VAL 87 2HG2 VAL 87 1.337 11.220 4.077 584 HG23 VAL 87 3HG2 VAL 87 -0.387 11.269 3.706 585 H SER 88 H SER 88 -2.054 13.391 7.287 586 HA SER 88 HA SER 88 -1.333 12.632 10.020 587 HB2 SER 88 1HB SER 88 -3.357 14.172 10.526 588 HB3 SER 88 2HB SER 88 -1.880 14.927 9.931 589 HG SER 88 HG SER 88 -2.800 15.272 8.005 590 HA PRO 89 HA PRO 89 -4.297 9.383 10.622 591 HB2 PRO 89 1HB PRO 89 -5.922 11.252 12.305 592 HB3 PRO 89 2HB PRO 89 -5.436 9.582 12.628 593 HG2 PRO 89 1HG PRO 89 -4.156 11.589 13.793 594 HG3 PRO 89 2HG PRO 89 -3.261 10.184 13.185 595 HD2 PRO 89 1HD PRO 89 -3.462 12.933 12.064 596 HD3 PRO 89 2HD PRO 89 -2.111 11.786 12.004 597 H GLU 90 H GLU 90 -5.888 12.546 10.202 598 HA GLU 90 HA GLU 90 -8.339 11.663 9.227 599 HB2 GLU 90 1HB GLU 90 -7.787 14.012 9.862 600 HB3 GLU 90 2HB GLU 90 -6.870 14.162 8.369 601 HG2 GLU 90 1HG GLU 90 -8.967 13.630 7.123 602 HG3 GLU 90 2HG GLU 90 -9.829 13.721 8.656 603 H TYR 91 H TYR 91 -5.265 12.074 7.568 604 HA TYR 91 HA TYR 91 -6.325 11.860 4.937 605 HB2 TYR 91 1HB TYR 91 -3.566 11.735 6.093 606 HB3 TYR 91 2HB TYR 91 -3.837 11.285 4.412 607 HD1 TYR 91 HD1 TYR 91 -3.633 12.933 2.814 608 HD2 TYR 91 HD2 TYR 91 -4.675 14.057 6.780 609 HE1 TYR 91 HE1 TYR 91 -3.556 15.301 2.157 610 HE2 TYR 91 HE2 TYR 91 -4.598 16.427 6.135 611 HH TYR 91 HH TYR 91 -3.522 17.827 4.404 612 H GLU 92 H GLU 92 -4.845 9.517 7.166 613 HA GLU 92 HA GLU 92 -4.872 7.308 5.464 614 HB2 GLU 92 1HB GLU 92 -3.759 7.244 7.627 615 HB3 GLU 92 2HB GLU 92 -5.302 7.426 8.456 616 HG2 GLU 92 1HG GLU 92 -6.023 5.279 7.464 617 HG3 GLU 92 2HG GLU 92 -4.404 5.079 6.804 618 H LYS 93 H LYS 93 -7.398 8.803 7.341 619 HA LYS 93 HA LYS 93 -9.339 6.775 7.029 620 HB2 LYS 93 1HB LYS 93 -9.399 8.519 8.804 621 HB3 LYS 93 2HB LYS 93 -9.743 9.722 7.570 622 HG2 LYS 93 1HG LYS 93 -11.826 8.581 7.027 623 HG3 LYS 93 2HG LYS 93 -11.480 7.364 8.257 624 HD2 LYS 93 1HD LYS 93 -11.473 9.144 9.967 625 HD3 LYS 93 2HD LYS 93 -11.913 10.313 8.720 626 HE2 LYS 93 1HE LYS 93 -13.883 9.605 9.951 627 HE3 LYS 93 2HE LYS 93 -13.969 9.059 8.278 628 HZ1 LYS 93 1HZ LYS 93 -13.163 7.391 10.600 629 HZ2 LYS 93 2HZ LYS 93 -13.251 6.866 8.994 630 HZ3 LYS 93 3HZ LYS 93 -14.656 7.328 9.811 631 H LYS 94 H LYS 94 -8.368 9.577 5.154 632 HA LYS 94 HA LYS 94 -10.624 9.720 3.460 633 HB2 LYS 94 1HB LYS 94 -7.760 10.483 2.849 634 HB3 LYS 94 2HB LYS 94 -9.173 10.995 1.940 635 HG2 LYS 94 1HG LYS 94 -9.976 12.275 3.806 636 HG3 LYS 94 2HG LYS 94 -8.684 11.654 4.836 637 HD2 LYS 94 1HD LYS 94 -7.052 12.689 3.218 638 HD3 LYS 94 2HD LYS 94 -8.431 13.478 2.453 639 HE2 LYS 94 1HE LYS 94 -7.693 13.756 5.361 640 HE3 LYS 94 2HE LYS 94 -7.249 14.907 4.105 641 HZ1 LYS 94 1HZ LYS 94 -9.239 15.549 5.379 642 HZ2 LYS 94 2HZ LYS 94 -10.044 14.180 4.787 643 HZ3 LYS 94 3HZ LYS 94 -9.541 15.390 3.717 644 H LEU 95 H LEU 95 -7.554 7.992 3.226 645 HA LEU 95 HA LEU 95 -8.148 6.823 0.699 646 HB2 LEU 95 1HB LEU 95 -6.087 6.241 2.800 647 HB3 LEU 95 2HB LEU 95 -6.262 5.223 1.386 648 HG LEU 95 HG LEU 95 -4.472 6.751 0.990 649 HD11 LEU 95 1HD1 LEU 95 -5.989 6.252 -0.890 650 HD12 LEU 95 2HD1 LEU 95 -5.167 7.803 -1.040 651 HD13 LEU 95 3HD1 LEU 95 -6.856 7.746 -0.542 652 HD21 LEU 95 1HD2 LEU 95 -5.038 8.478 2.599 653 HD22 LEU 95 2HD2 LEU 95 -6.402 8.977 1.599 654 HD23 LEU 95 3HD2 LEU 95 -4.755 9.173 1.004 655 H GLN 96 H GLN 96 -8.533 5.765 4.060 656 HA GLN 96 HA GLN 96 -9.558 3.196 3.482 657 HB2 GLN 96 1HB GLN 96 -9.910 5.062 5.815 658 HB3 GLN 96 2HB GLN 96 -10.825 3.568 5.724 659 HG2 GLN 96 1HG GLN 96 -8.755 2.274 5.691 660 HG3 GLN 96 2HG GLN 96 -7.821 3.777 5.720 661 HE21 GLN 96 1HE2 GLN 96 -9.648 5.080 7.583 662 HE22 GLN 96 2HE2 GLN 96 -9.339 4.369 9.125 663 H LYS 97 H LYS 97 -10.942 6.389 3.337 664 HA LYS 97 HA LYS 97 -13.651 5.521 3.045 665 HB2 LYS 97 1HB LYS 97 -12.279 8.115 2.355 666 HB3 LYS 97 2HB LYS 97 -13.999 7.845 2.107 667 HG2 LYS 97 1HG LYS 97 -14.328 7.496 4.471 668 HG3 LYS 97 2HG LYS 97 -12.593 7.630 4.760 669 HD2 LYS 97 1HD LYS 97 -13.693 9.709 5.339 670 HD3 LYS 97 2HD LYS 97 -12.657 9.949 3.933 671 HE2 LYS 97 1HE LYS 97 -14.594 9.796 2.465 672 HE3 LYS 97 2HE LYS 97 -15.639 9.509 3.856 673 HZ1 LYS 97 1HZ LYS 97 -15.036 11.703 4.693 674 HZ2 LYS 97 2HZ LYS 97 -15.747 11.804 3.163 675 HZ3 LYS 97 3HZ LYS 97 -14.072 11.976 3.330 676 H TYR 98 H TYR 98 -11.064 6.283 0.728 677 HA TYR 98 HA TYR 98 -12.745 5.996 -1.563 678 HB2 TYR 98 1HB TYR 98 -9.735 5.881 -1.305 679 HB3 TYR 98 2HB TYR 98 -10.595 5.855 -2.838 680 HD1 TYR 98 HD1 TYR 98 -12.504 7.904 -2.825 681 HD2 TYR 98 HD2 TYR 98 -8.727 7.880 -0.879 682 HE1 TYR 98 HE1 TYR 98 -12.452 10.363 -2.900 683 HE2 TYR 98 HE2 TYR 98 -8.666 10.333 -0.938 684 HH TYR 98 HH TYR 98 -11.385 12.230 -1.738 685 H ALA 99 H ALA 99 -10.310 3.872 -0.074 686 HA ALA 99 HA ALA 99 -11.168 1.671 -1.805 687 HB1 ALA 99 1HB ALA 99 -8.736 2.188 -1.457 688 HB2 ALA 99 2HB ALA 99 -9.197 0.526 -1.088 689 HB3 ALA 99 3HB ALA 99 -8.933 1.679 0.219 690 H ASP 100 H ASP 100 -12.403 -0.027 -1.050 691 HA ASP 100 HA ASP 100 -13.181 0.141 1.758 692 HB2 ASP 100 1HB ASP 100 -14.928 -0.177 0.022 693 HB3 ASP 100 2HB ASP 100 -14.186 -1.708 -0.423 694 H ALA 101 H ALA 101 -11.488 -0.509 2.812 695 HA ALA 101 HA ALA 101 -11.115 -3.211 3.445 696 HB1 ALA 101 1HB ALA 101 -8.791 -3.514 2.699 697 HB2 ALA 101 2HB ALA 101 -8.865 -1.973 1.844 698 HB3 ALA 101 3HB ALA 101 -9.876 -3.320 1.322 699 H GLU 102 H GLU 102 -8.958 -3.300 4.877 700 HA GLU 102 HA GLU 102 -8.980 -0.865 6.450 701 HB2 GLU 102 1HB GLU 102 -7.252 -3.290 6.911 702 HB3 GLU 102 2HB GLU 102 -7.627 -1.986 8.020 703 HG2 GLU 102 1HG GLU 102 -10.061 -2.745 7.803 704 HG3 GLU 102 2HG GLU 102 -9.383 -4.228 7.125 705 H VAL 103 H VAL 103 -8.068 0.643 5.171 706 HA VAL 103 HA VAL 103 -5.544 0.200 3.854 707 HB VAL 103 HB VAL 103 -7.448 2.514 4.004 708 HG11 VAL 103 1HG1 VAL 103 -5.235 3.512 4.232 709 HG12 VAL 103 2HG1 VAL 103 -5.923 3.850 2.646 710 HG13 VAL 103 3HG1 VAL 103 -4.679 2.614 2.819 711 HG21 VAL 103 1HG2 VAL 103 -6.230 1.032 1.689 712 HG22 VAL 103 2HG2 VAL 103 -7.474 2.276 1.599 713 HG23 VAL 103 3HG2 VAL 103 -7.830 0.726 2.366 714 H ARG 104 H ARG 104 -3.596 0.723 4.561 715 HA ARG 104 HA ARG 104 -3.366 2.659 6.765 716 HB2 ARG 104 1HB ARG 104 -1.661 0.199 6.330 717 HB3 ARG 104 2HB ARG 104 -1.360 1.437 7.541 718 HG2 ARG 104 1HG ARG 104 -3.527 0.900 8.581 719 HG3 ARG 104 2HG ARG 104 -3.742 -0.396 7.405 720 HD2 ARG 104 1HD ARG 104 -1.568 -0.153 9.473 721 HD3 ARG 104 2HD ARG 104 -2.881 -1.327 9.446 722 HE ARG 104 HE ARG 104 -1.716 -1.915 7.161 723 HH11 ARG 104 1HH1 ARG 104 -0.286 -1.229 10.278 724 HH12 ARG 104 2HH1 ARG 104 1.147 -2.166 9.969 725 HH21 ARG 104 1HH2 ARG 104 0.186 -3.140 6.762 726 HH22 ARG 104 2HH2 ARG 104 1.408 -3.251 8.001 727 H VAL 105 H VAL 105 -2.687 4.429 5.747 728 HA VAL 105 HA VAL 105 -0.830 4.207 3.530 729 HB VAL 105 HB VAL 105 -1.132 6.658 3.297 730 HG11 VAL 105 1HG1 VAL 105 -3.640 6.528 2.795 731 HG12 VAL 105 2HG1 VAL 105 -3.538 4.855 3.346 732 HG13 VAL 105 3HG1 VAL 105 -2.581 5.395 1.966 733 HG21 VAL 105 1HG2 VAL 105 -2.829 7.811 4.602 734 HG22 VAL 105 2HG2 VAL 105 -1.556 7.187 5.652 735 HG23 VAL 105 3HG2 VAL 105 -3.106 6.353 5.556 736 H ARG 106 H ARG 106 1.249 4.067 3.936 737 HA ARG 106 HA ARG 106 2.274 5.253 6.416 738 HB2 ARG 106 1HB ARG 106 3.455 3.059 4.713 739 HB3 ARG 106 2HB ARG 106 4.177 3.701 6.179 740 HG2 ARG 106 1HG ARG 106 1.506 2.317 6.055 741 HG3 ARG 106 2HG ARG 106 3.023 1.539 6.495 742 HD2 ARG 106 1HD ARG 106 1.949 2.048 8.529 743 HD3 ARG 106 2HD ARG 106 3.216 3.255 8.346 744 HE ARG 106 HE ARG 106 1.495 4.834 7.682 745 HH11 ARG 106 1HH1 ARG 106 0.450 1.949 9.376 746 HH12 ARG 106 2HH1 ARG 106 -1.108 2.607 9.774 747 HH21 ARG 106 1HH2 ARG 106 -0.521 5.688 8.184 748 HH22 ARG 106 2HH2 ARG 106 -1.680 4.741 9.075 749 H THR 107 H THR 107 3.364 7.042 6.258 750 HA THR 107 HA THR 107 4.247 8.002 3.703 751 HB THR 107 HB THR 107 3.323 9.606 5.245 752 HG1 THR 107 HG1 THR 107 4.689 11.030 4.542 753 HG21 THR 107 1HG2 THR 107 4.422 10.203 7.357 754 HG22 THR 107 2HG2 THR 107 5.570 8.885 7.127 755 HG23 THR 107 3HG2 THR 107 3.859 8.534 7.362 756 H VAL 108 H VAL 108 5.905 6.902 2.873 757 HA VAL 108 HA VAL 108 8.150 6.162 4.588 758 HB VAL 108 HB VAL 108 8.960 4.863 2.640 759 HG11 VAL 108 1HG1 VAL 108 6.109 4.313 3.455 760 HG12 VAL 108 2HG1 VAL 108 7.562 3.793 4.308 761 HG13 VAL 108 3HG1 VAL 108 7.202 3.149 2.707 762 HG21 VAL 108 1HG2 VAL 108 7.480 4.537 0.704 763 HG22 VAL 108 2HG2 VAL 108 8.017 6.211 0.840 764 HG23 VAL 108 3HG2 VAL 108 6.386 5.765 1.341 765 H THR 109 H THR 109 10.250 6.809 4.215 766 HA THR 109 HA THR 109 10.595 9.007 2.293 767 HB THR 109 HB THR 109 12.299 9.850 4.089 768 HG1 THR 109 HG1 THR 109 11.891 9.194 6.140 769 HG21 THR 109 1HG2 THR 109 10.306 11.090 3.390 770 HG22 THR 109 2HG2 THR 109 10.559 11.221 5.131 771 HG23 THR 109 3HG2 THR 109 9.321 10.135 4.498 772 H SER 110 H SER 110 11.648 5.979 3.297 773 HA SER 110 HA SER 110 14.002 6.136 1.636 774 HB2 SER 110 1HB SER 110 14.328 5.361 4.545 775 HB3 SER 110 2HB SER 110 15.598 5.478 3.330 776 HG SER 110 HG SER 110 14.490 7.809 3.284 777 HA PRO 111 HA PRO 111 13.173 1.900 0.581 778 HB2 PRO 111 1HB PRO 111 15.976 1.372 1.478 779 HB3 PRO 111 2HB PRO 111 15.157 0.866 -0.005 780 HG2 PRO 111 1HG PRO 111 16.867 2.907 -0.025 781 HG3 PRO 111 2HG PRO 111 15.388 2.944 -1.001 782 HD2 PRO 111 1HD PRO 111 16.048 4.420 1.487 783 HD3 PRO 111 2HD PRO 111 14.971 4.874 0.153 784 H ASP 112 H ASP 112 15.258 2.100 3.482 785 HA ASP 112 HA ASP 112 14.456 -0.341 4.599 786 HB2 ASP 112 1HB ASP 112 15.699 2.124 5.776 787 HB3 ASP 112 2HB ASP 112 15.224 0.781 6.809 788 H GLU 113 H GLU 113 12.977 2.812 4.738 789 HA GLU 113 HA GLU 113 11.235 2.268 6.920 790 HB2 GLU 113 1HB GLU 113 10.919 4.258 4.663 791 HB3 GLU 113 2HB GLU 113 9.993 4.250 6.157 792 HG2 GLU 113 1HG GLU 113 12.941 4.751 5.854 793 HG3 GLU 113 2HG GLU 113 11.700 5.921 6.300 794 H ALA 114 H ALA 114 10.973 2.011 3.419 795 HA ALA 114 HA ALA 114 8.281 1.246 3.252 796 HB1 ALA 114 1HB ALA 114 8.869 0.340 1.057 797 HB2 ALA 114 2HB ALA 114 10.582 0.454 1.463 798 HB3 ALA 114 3HB ALA 114 9.611 1.920 1.311 799 H LYS 115 H LYS 115 11.234 -0.664 3.575 800 HA LYS 115 HA LYS 115 10.010 -3.203 3.483 801 HB2 LYS 115 1HB LYS 115 12.581 -2.489 4.898 802 HB3 LYS 115 2HB LYS 115 12.121 -4.062 4.262 803 HG2 LYS 115 1HG LYS 115 12.223 -3.192 1.993 804 HG3 LYS 115 2HG LYS 115 12.640 -1.595 2.615 805 HD2 LYS 115 1HD LYS 115 14.684 -2.571 1.959 806 HD3 LYS 115 2HD LYS 115 14.638 -2.703 3.715 807 HE2 LYS 115 1HE LYS 115 13.953 -5.019 3.557 808 HE3 LYS 115 2HE LYS 115 13.868 -4.901 1.800 809 HZ1 LYS 115 1HZ LYS 115 16.260 -4.422 1.783 810 HZ2 LYS 115 2HZ LYS 115 15.912 -5.942 2.445 811 HZ3 LYS 115 3HZ LYS 115 16.312 -4.655 3.463 812 H ARG 116 H ARG 116 10.531 -0.913 6.043 813 HA ARG 116 HA ARG 116 10.223 -2.557 8.290 814 HB2 ARG 116 1HB ARG 116 11.049 -0.255 8.408 815 HB3 ARG 116 2HB ARG 116 9.484 0.350 7.895 816 HG2 ARG 116 1HG ARG 116 9.533 0.711 10.195 817 HG3 ARG 116 2HG ARG 116 8.555 -0.742 10.002 818 HD2 ARG 116 1HD ARG 116 11.504 -0.841 10.576 819 HD3 ARG 116 2HD ARG 116 10.298 -0.752 11.856 820 HE ARG 116 HE ARG 116 9.397 -2.866 10.602 821 HH11 ARG 116 1HH1 ARG 116 12.750 -2.018 11.196 822 HH12 ARG 116 2HH1 ARG 116 13.274 -3.667 11.315 823 HH21 ARG 116 1HH2 ARG 116 10.087 -5.022 10.788 824 HH22 ARG 116 2HH2 ARG 116 11.760 -5.373 11.091 825 H TRP 117 H TRP 117 7.831 -0.700 6.440 826 HA TRP 117 HA TRP 117 5.678 -1.501 8.153 827 HB2 TRP 117 1HB TRP 117 5.616 -0.092 5.480 828 HB3 TRP 117 2HB TRP 117 4.257 -0.249 6.590 829 HD1 TRP 117 HD1 TRP 117 6.796 2.164 5.656 830 HE1 TRP 117 HE1 TRP 117 7.147 3.939 7.490 831 HE3 TRP 117 HE3 TRP 117 4.410 -0.186 9.518 832 HZ2 TRP 117 HZ2 TRP 117 6.490 4.292 10.215 833 HZ3 TRP 117 HZ3 TRP 117 4.318 0.936 11.704 834 HH2 TRP 117 HH2 TRP 117 5.337 3.127 12.044 835 H ILE 118 H ILE 118 6.849 -2.465 4.961 836 HA ILE 118 HA ILE 118 4.626 -4.093 4.310 837 HB ILE 118 HB ILE 118 7.481 -4.288 3.328 838 HG12 ILE 118 1HG1 ILE 118 5.044 -2.969 2.109 839 HG13 ILE 118 2HG1 ILE 118 6.382 -2.122 2.878 840 HG21 ILE 118 1HG2 ILE 118 6.556 -5.536 1.434 841 HG22 ILE 118 2HG2 ILE 118 4.961 -5.493 2.186 842 HG23 ILE 118 3HG2 ILE 118 6.276 -6.377 2.959 843 HD11 ILE 118 1HD1 ILE 118 7.896 -2.953 1.157 844 HD12 ILE 118 2HD1 ILE 118 6.556 -2.042 0.462 845 HD13 ILE 118 3HD1 ILE 118 6.555 -3.804 0.389 846 H LYS 119 H LYS 119 7.473 -4.609 6.246 847 HA LYS 119 HA LYS 119 7.379 -7.437 6.306 848 HB2 LYS 119 1HB LYS 119 9.385 -6.159 6.931 849 HB3 LYS 119 2HB LYS 119 8.542 -5.527 8.338 850 HG2 LYS 119 1HG LYS 119 8.417 -7.702 9.325 851 HG3 LYS 119 2HG LYS 119 9.057 -8.451 7.861 852 HD2 LYS 119 1HD LYS 119 11.172 -7.287 8.172 853 HD3 LYS 119 2HD LYS 119 10.533 -6.488 9.610 854 HE2 LYS 119 1HE LYS 119 11.949 -8.393 10.196 855 HE3 LYS 119 2HE LYS 119 10.283 -8.638 10.716 856 HZ1 LYS 119 1HZ LYS 119 11.440 -9.769 8.230 857 HZ2 LYS 119 2HZ LYS 119 9.905 -10.096 8.872 858 HZ3 LYS 119 3HZ LYS 119 11.298 -10.612 9.688 859 H GLU 120 H GLU 120 6.225 -5.002 8.663 860 HA GLU 120 HA GLU 120 5.042 -6.971 10.342 861 HB2 GLU 120 1HB GLU 120 3.935 -5.001 11.448 862 HB3 GLU 120 2HB GLU 120 5.686 -4.932 11.376 863 HG2 GLU 120 1HG GLU 120 5.333 -2.835 10.685 864 HG3 GLU 120 2HG GLU 120 5.047 -3.591 9.120 865 H PHE 121 H PHE 121 4.031 -5.413 7.482 866 HA PHE 121 HA PHE 121 1.221 -5.716 7.783 867 HB2 PHE 121 1HB PHE 121 2.210 -4.165 6.169 868 HB3 PHE 121 2HB PHE 121 2.941 -5.508 5.303 869 HD1 PHE 121 HD1 PHE 121 1.963 -5.850 3.276 870 HD2 PHE 121 HD2 PHE 121 -0.501 -4.762 6.568 871 HE1 PHE 121 HE1 PHE 121 -0.021 -5.984 1.829 872 HE2 PHE 121 HE2 PHE 121 -2.487 -4.895 5.129 873 HZ PHE 121 HZ PHE 121 -2.251 -5.504 2.757 874 H SER 122 H SER 122 3.800 -7.761 6.590 875 HA SER 122 HA SER 122 1.888 -9.806 5.764 876 HB2 SER 122 1HB SER 122 4.075 -10.940 4.978 877 HB3 SER 122 2HB SER 122 3.528 -9.503 4.115 878 HG SER 122 HG SER 122 5.069 -8.294 5.126 879 H GLU 123 H GLU 123 3.634 -8.939 8.467 880 HA GLU 123 HA GLU 123 3.494 -11.682 9.520 881 HB2 GLU 123 1HB GLU 123 5.592 -9.581 10.069 882 HB3 GLU 123 2HB GLU 123 5.421 -11.062 11.000 883 HG2 GLU 123 1HG GLU 123 5.867 -12.381 9.006 884 HG3 GLU 123 2HG GLU 123 6.012 -10.903 8.055 885 H GLU 124 H GLU 124 1.330 -11.009 10.183 886 HA GLU 124 HA GLU 124 1.357 -9.279 12.548 887 HB2 GLU 124 1HB GLU 124 -0.940 -10.342 10.896 888 HB3 GLU 124 2HB GLU 124 -1.148 -9.458 12.400 889 HG2 GLU 124 1HG GLU 124 0.164 -7.582 11.315 890 HG3 GLU 124 2HG GLU 124 -0.042 -8.458 9.798 Start of MODEL 5 1 HA MET 21 HA MET 21 -8.146 -11.747 3.694 2 HB2 MET 21 1HB MET 21 -7.600 -12.301 6.002 3 HB3 MET 21 2HB MET 21 -6.034 -12.928 5.511 4 HG2 MET 21 1HG MET 21 -5.363 -10.686 4.794 5 HG3 MET 21 2HG MET 21 -6.930 -10.061 5.302 6 HE1 MET 21 1HE MET 21 -3.832 -11.839 8.232 7 HE2 MET 21 2HE MET 21 -3.584 -11.746 6.488 8 HE3 MET 21 3HE MET 21 -4.809 -12.827 7.149 9 H THR 22 H THR 22 -7.374 -10.813 1.914 10 HA THR 22 HA THR 22 -4.713 -11.615 0.970 11 HB THR 22 HB THR 22 -6.837 -10.018 -0.480 12 HG1 THR 22 HG1 THR 22 -6.925 -12.521 0.066 13 HG21 THR 22 1HG2 THR 22 -4.537 -9.578 -1.260 14 HG22 THR 22 2HG2 THR 22 -5.491 -10.434 -2.472 15 HG23 THR 22 3HG2 THR 22 -4.303 -11.309 -1.507 16 H LEU 23 H LEU 23 -3.067 -10.161 0.764 17 HA LEU 23 HA LEU 23 -3.498 -7.560 2.067 18 HB2 LEU 23 1HB LEU 23 -0.949 -9.152 1.794 19 HB3 LEU 23 2HB LEU 23 -1.130 -7.644 2.666 20 HG LEU 23 HG LEU 23 -2.407 -10.281 3.398 21 HD11 LEU 23 1HD1 LEU 23 -0.025 -10.236 3.853 22 HD12 LEU 23 2HD1 LEU 23 -0.941 -10.156 5.359 23 HD13 LEU 23 3HD1 LEU 23 -0.198 -8.699 4.700 24 HD21 LEU 23 1HD2 LEU 23 -3.147 -9.127 5.429 25 HD22 LEU 23 2HD2 LEU 23 -3.867 -8.425 3.980 26 HD23 LEU 23 3HD2 LEU 23 -2.528 -7.606 4.786 27 H PHE 24 H PHE 24 -3.243 -5.785 0.890 28 HA PHE 24 HA PHE 24 -1.893 -6.030 -1.725 29 HB2 PHE 24 1HB PHE 24 -4.116 -4.124 -0.969 30 HB3 PHE 24 2HB PHE 24 -3.373 -4.277 -2.553 31 HD1 PHE 24 HD1 PHE 24 -4.097 -5.912 -4.087 32 HD2 PHE 24 HD2 PHE 24 -5.494 -5.984 -0.071 33 HE1 PHE 24 HE1 PHE 24 -5.787 -7.582 -4.708 34 HE2 PHE 24 HE2 PHE 24 -7.183 -7.654 -0.682 35 HZ PHE 24 HZ PHE 24 -7.335 -8.456 -3.008 36 H VAL 25 H VAL 25 -0.531 -4.370 -2.383 37 HA VAL 25 HA VAL 25 -0.057 -2.204 -0.448 38 HB VAL 25 HB VAL 25 2.200 -3.497 -1.973 39 HG11 VAL 25 1HG1 VAL 25 2.164 -1.690 0.438 40 HG12 VAL 25 2HG1 VAL 25 2.546 -1.208 -1.214 41 HG13 VAL 25 3HG1 VAL 25 3.603 -2.330 -0.356 42 HG21 VAL 25 1HG2 VAL 25 1.446 -4.076 0.889 43 HG22 VAL 25 2HG2 VAL 25 2.870 -4.677 0.032 44 HG23 VAL 25 3HG2 VAL 25 1.257 -5.190 -0.467 45 H LEU 26 H LEU 26 -0.561 -0.368 -1.494 46 HA LEU 26 HA LEU 26 0.266 -0.086 -4.300 47 HB2 LEU 26 1HB LEU 26 -1.280 1.870 -2.581 48 HB3 LEU 26 2HB LEU 26 -0.905 2.069 -4.274 49 HG LEU 26 HG LEU 26 -3.156 1.439 -4.230 50 HD11 LEU 26 1HD1 LEU 26 -3.223 -0.715 -5.331 51 HD12 LEU 26 2HD1 LEU 26 -1.604 -1.085 -4.739 52 HD13 LEU 26 3HD1 LEU 26 -1.843 0.232 -5.886 53 HD21 LEU 26 1HD2 LEU 26 -4.016 -0.514 -3.018 54 HD22 LEU 26 2HD2 LEU 26 -3.328 0.696 -1.937 55 HD23 LEU 26 3HD2 LEU 26 -2.418 -0.766 -2.315 56 H ILE 27 H ILE 27 1.539 1.900 -4.833 57 HA ILE 27 HA ILE 27 2.973 3.030 -2.588 58 HB ILE 27 HB ILE 27 4.249 1.010 -2.978 59 HG12 ILE 27 1HG1 ILE 27 5.773 3.365 -4.113 60 HG13 ILE 27 2HG1 ILE 27 5.459 3.116 -2.396 61 HG21 ILE 27 1HG2 ILE 27 3.628 0.584 -5.283 62 HG22 ILE 27 2HG2 ILE 27 5.383 0.573 -5.092 63 HG23 ILE 27 3HG2 ILE 27 4.583 1.972 -5.808 64 HD11 ILE 27 1HD1 ILE 27 7.690 2.392 -2.941 65 HD12 ILE 27 2HD1 ILE 27 7.071 1.329 -4.204 66 HD13 ILE 27 3HD1 ILE 27 6.707 0.995 -2.510 67 H LEU 28 H LEU 28 3.090 5.145 -2.927 68 HA LEU 28 HA LEU 28 3.700 6.031 -5.677 69 HB2 LEU 28 1HB LEU 28 2.017 7.150 -3.578 70 HB3 LEU 28 2HB LEU 28 3.197 8.308 -4.163 71 HG LEU 28 HG LEU 28 2.385 7.827 -6.488 72 HD11 LEU 28 1HD1 LEU 28 0.126 6.477 -5.032 73 HD12 LEU 28 2HD1 LEU 28 1.355 5.652 -5.988 74 HD13 LEU 28 3HD1 LEU 28 0.236 6.774 -6.767 75 HD21 LEU 28 1HD2 LEU 28 0.385 9.198 -6.275 76 HD22 LEU 28 2HD2 LEU 28 1.699 9.817 -5.271 77 HD23 LEU 28 3HD2 LEU 28 0.373 8.915 -4.534 78 H SER 29 H SER 29 5.804 5.285 -5.286 79 HA SER 29 HA SER 29 7.477 7.430 -4.288 80 HB2 SER 29 1HB SER 29 7.740 4.553 -3.384 81 HB3 SER 29 2HB SER 29 8.951 5.797 -3.106 82 HG SER 29 HG SER 29 6.476 6.586 -2.316 83 H ASN 30 H ASN 30 9.367 7.626 -5.606 84 HA ASN 30 HA ASN 30 10.078 5.209 -7.072 85 HB2 ASN 30 1HB ASN 30 8.671 6.470 -8.626 86 HB3 ASN 30 2HB ASN 30 9.718 7.873 -8.447 87 HD21 ASN 30 1HD2 ASN 30 10.186 7.905 -10.634 88 HD22 ASN 30 2HD2 ASN 30 11.235 6.747 -11.372 89 H ASP 31 H ASP 31 11.789 5.213 -5.516 90 HA ASP 31 HA ASP 31 14.053 6.472 -6.898 91 HB2 ASP 31 1HB ASP 31 14.203 7.038 -4.545 92 HB3 ASP 31 2HB ASP 31 13.919 5.372 -4.076 93 H LYS 32 H LYS 32 15.622 4.959 -7.749 94 HA LYS 32 HA LYS 32 14.430 2.581 -8.649 95 HB2 LYS 32 1HB LYS 32 17.308 3.465 -8.622 96 HB3 LYS 32 2HB LYS 32 16.822 1.908 -9.270 97 HG2 LYS 32 1HG LYS 32 16.989 3.352 -11.114 98 HG3 LYS 32 2HG LYS 32 15.264 3.169 -10.806 99 HD2 LYS 32 1HD LYS 32 15.216 5.315 -9.669 100 HD3 LYS 32 2HD LYS 32 16.957 5.489 -9.886 101 HE2 LYS 32 1HE LYS 32 16.617 5.441 -12.335 102 HE3 LYS 32 2HE LYS 32 14.876 5.374 -12.064 103 HZ1 LYS 32 1HZ LYS 32 16.667 7.575 -11.192 104 HZ2 LYS 32 2HZ LYS 32 14.994 7.514 -10.964 105 HZ3 LYS 32 3HZ LYS 32 15.629 7.626 -12.525 106 H LYS 33 H LYS 33 16.795 3.100 -6.050 107 HA LYS 33 HA LYS 33 17.022 0.339 -5.357 108 HB2 LYS 33 1HB LYS 33 17.572 2.739 -3.606 109 HB3 LYS 33 2HB LYS 33 18.212 1.117 -3.403 110 HG2 LYS 33 1HG LYS 33 19.525 1.331 -5.409 111 HG3 LYS 33 2HG LYS 33 18.805 2.905 -5.744 112 HD2 LYS 33 1HD LYS 33 20.595 2.176 -3.431 113 HD3 LYS 33 2HD LYS 33 20.985 3.238 -4.782 114 HE2 LYS 33 1HE LYS 33 18.964 3.730 -2.598 115 HE3 LYS 33 2HE LYS 33 20.482 4.582 -2.852 116 HZ1 LYS 33 1HZ LYS 33 18.035 4.694 -4.528 117 HZ2 LYS 33 2HZ LYS 33 19.531 5.293 -5.049 118 HZ3 LYS 33 3HZ LYS 33 18.785 5.957 -3.687 119 H LEU 34 H LEU 34 15.183 3.073 -4.107 120 HA LEU 34 HA LEU 34 13.953 1.967 -1.900 121 HB2 LEU 34 1HB LEU 34 13.710 4.295 -2.457 122 HB3 LEU 34 2HB LEU 34 12.882 3.893 -3.948 123 HG LEU 34 HG LEU 34 10.960 3.083 -2.685 124 HD11 LEU 34 1HD1 LEU 34 12.073 2.274 -0.718 125 HD12 LEU 34 2HD1 LEU 34 10.805 3.425 -0.291 126 HD13 LEU 34 3HD1 LEU 34 12.497 3.925 -0.261 127 HD21 LEU 34 1HD2 LEU 34 10.246 5.249 -1.745 128 HD22 LEU 34 2HD2 LEU 34 10.975 5.399 -3.345 129 HD23 LEU 34 3HD2 LEU 34 11.902 5.832 -1.907 130 H ILE 35 H ILE 35 12.777 1.925 -5.251 131 HA ILE 35 HA ILE 35 10.449 0.454 -4.695 132 HB ILE 35 HB ILE 35 11.994 0.873 -7.248 133 HG12 ILE 35 1HG1 ILE 35 9.380 1.983 -6.209 134 HG13 ILE 35 2HG1 ILE 35 10.909 2.849 -6.320 135 HG21 ILE 35 1HG2 ILE 35 9.320 -0.485 -6.952 136 HG22 ILE 35 2HG2 ILE 35 10.829 -1.257 -7.439 137 HG23 ILE 35 3HG2 ILE 35 10.091 -0.036 -8.474 138 HD11 ILE 35 1HD1 ILE 35 10.838 2.693 -8.740 139 HD12 ILE 35 2HD1 ILE 35 9.376 3.457 -8.113 140 HD13 ILE 35 3HD1 ILE 35 9.333 1.777 -8.647 141 H GLU 36 H GLU 36 13.732 -0.541 -5.516 142 HA GLU 36 HA GLU 36 13.223 -3.271 -5.949 143 HB2 GLU 36 1HB GLU 36 15.679 -1.911 -4.833 144 HB3 GLU 36 2HB GLU 36 15.611 -3.605 -5.286 145 HG2 GLU 36 1HG GLU 36 15.051 -2.908 -7.597 146 HG3 GLU 36 2HG GLU 36 15.292 -1.231 -7.101 147 H GLU 37 H GLU 37 14.513 -1.707 -3.016 148 HA GLU 37 HA GLU 37 14.342 -3.960 -1.377 149 HB2 GLU 37 1HB GLU 37 14.311 -1.020 -0.687 150 HB3 GLU 37 2HB GLU 37 14.429 -2.299 0.514 151 HG2 GLU 37 1HG GLU 37 16.505 -3.072 -0.485 152 HG3 GLU 37 2HG GLU 37 16.382 -1.831 -1.728 153 H ALA 38 H ALA 38 11.941 -1.527 -2.162 154 HA ALA 38 HA ALA 38 10.027 -2.270 -0.218 155 HB1 ALA 38 1HB ALA 38 8.425 -1.047 -1.575 156 HB2 ALA 38 2HB ALA 38 9.563 -1.015 -2.921 157 HB3 ALA 38 3HB ALA 38 9.932 -0.143 -1.434 158 H ARG 39 H ARG 39 10.253 -3.121 -3.699 159 HA ARG 39 HA ARG 39 8.045 -4.886 -3.578 160 HB2 ARG 39 1HB ARG 39 8.775 -3.969 -5.716 161 HB3 ARG 39 2HB ARG 39 10.304 -4.830 -5.588 162 HG2 ARG 39 1HG ARG 39 9.130 -6.979 -5.705 163 HG3 ARG 39 2HG ARG 39 7.587 -6.134 -5.771 164 HD2 ARG 39 1HD ARG 39 9.793 -5.880 -7.808 165 HD3 ARG 39 2HD ARG 39 8.336 -6.855 -7.996 166 HE ARG 39 HE ARG 39 7.182 -4.562 -7.630 167 HH11 ARG 39 1HH1 ARG 39 10.131 -5.145 -9.416 168 HH12 ARG 39 2HH1 ARG 39 9.930 -3.770 -10.454 169 HH21 ARG 39 1HH2 ARG 39 6.899 -2.746 -8.989 170 HH22 ARG 39 2HH2 ARG 39 8.083 -2.408 -10.215 171 H LYS 40 H LYS 40 11.544 -5.409 -3.271 172 HA LYS 40 HA LYS 40 11.690 -8.144 -3.471 173 HB2 LYS 40 1HB LYS 40 13.188 -6.258 -1.667 174 HB3 LYS 40 2HB LYS 40 13.565 -7.972 -1.748 175 HG2 LYS 40 1HG LYS 40 14.128 -7.792 -4.077 176 HG3 LYS 40 2HG LYS 40 13.609 -6.105 -4.106 177 HD2 LYS 40 1HD LYS 40 15.368 -5.523 -2.522 178 HD3 LYS 40 2HD LYS 40 15.872 -7.211 -2.445 179 HE2 LYS 40 1HE LYS 40 15.858 -5.562 -4.964 180 HE3 LYS 40 2HE LYS 40 17.271 -5.777 -3.935 181 HZ1 LYS 40 1HZ LYS 40 15.790 -7.969 -5.276 182 HZ2 LYS 40 2HZ LYS 40 17.193 -8.139 -4.349 183 HZ3 LYS 40 3HZ LYS 40 17.247 -7.305 -5.818 184 H MET 41 H MET 41 10.665 -6.267 -0.663 185 HA MET 41 HA MET 41 10.504 -8.509 1.077 186 HB2 MET 41 1HB MET 41 9.148 -5.819 1.283 187 HB3 MET 41 2HB MET 41 9.261 -7.008 2.575 188 HG2 MET 41 1HG MET 41 11.466 -5.412 1.321 189 HG3 MET 41 2HG MET 41 10.931 -5.426 3.001 190 HE1 MET 41 1HE MET 41 13.521 -5.652 3.701 191 HE2 MET 41 2HE MET 41 13.989 -5.701 2.002 192 HE3 MET 41 3HE MET 41 14.572 -6.939 3.113 193 H ALA 42 H ALA 42 8.054 -6.708 -0.772 194 HA ALA 42 HA ALA 42 5.892 -8.382 0.050 195 HB1 ALA 42 1HB ALA 42 6.138 -6.492 -2.283 196 HB2 ALA 42 2HB ALA 42 5.466 -6.130 -0.694 197 HB3 ALA 42 3HB ALA 42 4.646 -7.267 -1.760 198 H GLU 43 H GLU 43 8.243 -8.491 -2.474 199 HA GLU 43 HA GLU 43 7.027 -10.354 -4.198 200 HB2 GLU 43 1HB GLU 43 9.015 -8.891 -4.708 201 HB3 GLU 43 2HB GLU 43 9.982 -9.954 -3.698 202 HG2 GLU 43 1HG GLU 43 10.344 -10.583 -5.949 203 HG3 GLU 43 2HG GLU 43 9.345 -11.827 -5.206 204 H LYS 44 H LYS 44 9.157 -10.576 -1.439 205 HA LYS 44 HA LYS 44 9.349 -13.437 -1.395 206 HB2 LYS 44 1HB LYS 44 11.143 -12.035 -0.573 207 HB3 LYS 44 2HB LYS 44 10.069 -11.306 0.608 208 HG2 LYS 44 1HG LYS 44 9.931 -13.340 1.843 209 HG3 LYS 44 2HG LYS 44 10.798 -14.224 0.580 210 HD2 LYS 44 1HD LYS 44 12.776 -12.936 0.966 211 HD3 LYS 44 2HD LYS 44 11.938 -11.902 2.123 212 HE2 LYS 44 1HE LYS 44 11.586 -13.877 3.570 213 HE3 LYS 44 2HE LYS 44 12.523 -14.845 2.432 214 HZ1 LYS 44 1HZ LYS 44 14.435 -13.446 2.849 215 HZ2 LYS 44 2HZ LYS 44 13.862 -14.082 4.306 216 HZ3 LYS 44 3HZ LYS 44 13.539 -12.473 3.902 217 H ALA 45 H ALA 45 7.399 -10.980 0.151 218 HA ALA 45 HA ALA 45 6.255 -12.801 2.063 219 HB1 ALA 45 1HB ALA 45 6.681 -10.492 2.687 220 HB2 ALA 45 2HB ALA 45 4.961 -10.871 2.811 221 HB3 ALA 45 3HB ALA 45 5.564 -9.940 1.440 222 H ASN 46 H ASN 46 5.729 -12.223 -1.133 223 HA ASN 46 HA ASN 46 4.134 -12.790 -2.629 224 HB2 ASN 46 1HB ASN 46 3.095 -14.403 -0.295 225 HB3 ASN 46 2HB ASN 46 2.422 -14.495 -1.918 226 HD21 ASN 46 1HD2 ASN 46 5.086 -15.302 0.126 227 HD22 ASN 46 2HD2 ASN 46 5.887 -16.355 -0.985 228 H LEU 47 H LEU 47 3.812 -10.324 -1.606 229 HA LEU 47 HA LEU 47 0.947 -10.075 -0.964 230 HB2 LEU 47 1HB LEU 47 3.000 -7.874 -0.977 231 HB3 LEU 47 2HB LEU 47 1.403 -7.837 -0.266 232 HG LEU 47 HG LEU 47 3.755 -9.438 0.727 233 HD11 LEU 47 1HD1 LEU 47 2.326 -7.041 1.853 234 HD12 LEU 47 2HD1 LEU 47 3.925 -7.042 1.111 235 HD13 LEU 47 3HD1 LEU 47 3.655 -7.911 2.622 236 HD21 LEU 47 1HD2 LEU 47 1.618 -10.602 1.094 237 HD22 LEU 47 2HD2 LEU 47 0.992 -9.162 1.899 238 HD23 LEU 47 3HD2 LEU 47 2.346 -10.044 2.601 239 H ILE 48 H ILE 48 -0.339 -8.540 -2.155 240 HA ILE 48 HA ILE 48 0.471 -8.425 -4.930 241 HB ILE 48 HB ILE 48 -2.122 -7.506 -3.675 242 HG12 ILE 48 1HG1 ILE 48 -1.408 -10.056 -5.147 243 HG13 ILE 48 2HG1 ILE 48 -1.797 -9.917 -3.436 244 HG21 ILE 48 1HG2 ILE 48 -1.667 -6.358 -5.775 245 HG22 ILE 48 2HG2 ILE 48 -2.981 -7.517 -5.984 246 HG23 ILE 48 3HG2 ILE 48 -1.362 -7.902 -6.572 247 HD11 ILE 48 1HD1 ILE 48 -3.667 -10.809 -4.689 248 HD12 ILE 48 2HD1 ILE 48 -3.674 -9.383 -5.727 249 HD13 ILE 48 3HD1 ILE 48 -4.069 -9.230 -4.015 250 H LEU 49 H LEU 49 2.100 -6.982 -4.953 251 HA LEU 49 HA LEU 49 1.644 -4.271 -3.975 252 HB2 LEU 49 1HB LEU 49 3.739 -5.232 -3.340 253 HB3 LEU 49 2HB LEU 49 4.075 -5.739 -4.979 254 HG LEU 49 HG LEU 49 4.324 -3.357 -5.637 255 HD11 LEU 49 1HD1 LEU 49 4.137 -2.833 -2.680 256 HD12 LEU 49 2HD1 LEU 49 2.914 -2.380 -3.871 257 HD13 LEU 49 3HD1 LEU 49 4.522 -1.656 -3.935 258 HD21 LEU 49 1HD2 LEU 49 6.473 -3.031 -4.560 259 HD22 LEU 49 2HD2 LEU 49 6.253 -4.723 -5.015 260 HD23 LEU 49 3HD2 LEU 49 6.048 -4.227 -3.332 261 H ILE 50 H ILE 50 0.908 -2.770 -5.295 262 HA ILE 50 HA ILE 50 1.314 -3.115 -8.195 263 HB ILE 50 HB ILE 50 -0.802 -1.420 -6.857 264 HG12 ILE 50 1HG1 ILE 50 -1.128 -4.163 -8.111 265 HG13 ILE 50 2HG1 ILE 50 -1.092 -3.860 -6.377 266 HG21 ILE 50 1HG2 ILE 50 -1.821 -1.397 -9.085 267 HG22 ILE 50 2HG2 ILE 50 -0.481 -2.358 -9.707 268 HG23 ILE 50 3HG2 ILE 50 -0.191 -0.723 -9.116 269 HD11 ILE 50 1HD1 ILE 50 -3.127 -2.762 -8.300 270 HD12 ILE 50 2HD1 ILE 50 -3.109 -2.527 -6.554 271 HD13 ILE 50 3HD1 ILE 50 -3.362 -4.137 -7.224 272 H THR 51 H THR 51 3.080 -1.978 -8.717 273 HA THR 51 HA THR 51 3.794 0.426 -7.274 274 HB THR 51 HB THR 51 5.214 -0.615 -9.719 275 HG1 THR 51 HG1 THR 51 4.796 -1.957 -7.433 276 HG21 THR 51 1HG2 THR 51 6.197 0.776 -7.224 277 HG22 THR 51 2HG2 THR 51 5.920 1.552 -8.783 278 HG23 THR 51 3HG2 THR 51 7.177 0.325 -8.620 279 H VAL 52 H VAL 52 2.731 2.249 -7.781 280 HA VAL 52 HA VAL 52 2.407 2.897 -10.637 281 HB VAL 52 HB VAL 52 0.414 4.239 -10.013 282 HG11 VAL 52 1HG1 VAL 52 0.056 2.011 -10.880 283 HG12 VAL 52 2HG1 VAL 52 -1.137 2.364 -9.628 284 HG13 VAL 52 3HG1 VAL 52 0.242 1.325 -9.266 285 HG21 VAL 52 1HG2 VAL 52 0.766 2.954 -7.309 286 HG22 VAL 52 2HG2 VAL 52 -0.649 3.872 -7.823 287 HG23 VAL 52 3HG2 VAL 52 0.917 4.669 -7.687 288 H GLY 53 H GLY 53 1.950 5.462 -10.704 289 HA2 GLY 53 1HA GLY 53 3.134 6.915 -8.518 290 HA3 GLY 53 2HA GLY 53 4.128 6.925 -9.968 291 H ASP 54 H ASP 54 1.208 7.953 -8.492 292 HA ASP 54 HA ASP 54 1.036 10.448 -9.508 293 HB2 ASP 54 1HB ASP 54 0.762 9.454 -11.773 294 HB3 ASP 54 2HB ASP 54 -0.673 8.606 -11.208 295 H GLU 55 H GLU 55 -0.910 11.504 -8.807 296 HA GLU 55 HA GLU 55 -2.042 10.349 -6.504 297 HB2 GLU 55 1HB GLU 55 -2.465 12.830 -8.094 298 HB3 GLU 55 2HB GLU 55 -3.638 12.414 -6.852 299 HG2 GLU 55 1HG GLU 55 -0.682 12.532 -6.334 300 HG3 GLU 55 2HG GLU 55 -1.732 13.944 -6.167 301 H GLU 56 H GLU 56 -3.282 10.802 -9.774 302 HA GLU 56 HA GLU 56 -5.903 9.868 -9.026 303 HB2 GLU 56 1HB GLU 56 -4.676 10.575 -11.692 304 HB3 GLU 56 2HB GLU 56 -6.361 10.119 -11.468 305 HG2 GLU 56 1HG GLU 56 -5.152 12.388 -9.928 306 HG3 GLU 56 2HG GLU 56 -5.771 12.617 -11.572 307 H GLU 57 H GLU 57 -3.107 8.652 -10.797 308 HA GLU 57 HA GLU 57 -4.133 6.177 -11.584 309 HB2 GLU 57 1HB GLU 57 -1.988 7.102 -12.376 310 HB3 GLU 57 2HB GLU 57 -1.301 6.857 -10.777 311 HG2 GLU 57 1HG GLU 57 -1.542 4.468 -10.999 312 HG3 GLU 57 2HG GLU 57 -2.332 4.667 -12.561 313 H LEU 58 H LEU 58 -2.788 7.253 -8.514 314 HA LEU 58 HA LEU 58 -2.595 4.785 -7.212 315 HB2 LEU 58 1HB LEU 58 -1.691 6.819 -6.242 316 HB3 LEU 58 2HB LEU 58 -3.298 7.503 -6.104 317 HG LEU 58 HG LEU 58 -3.890 5.764 -4.458 318 HD11 LEU 58 1HD1 LEU 58 -2.121 4.371 -3.489 319 HD12 LEU 58 2HD1 LEU 58 -1.001 4.948 -4.721 320 HD13 LEU 58 3HD1 LEU 58 -2.408 3.994 -5.185 321 HD21 LEU 58 1HD2 LEU 58 -2.531 6.623 -2.618 322 HD22 LEU 58 2HD2 LEU 58 -3.058 7.919 -3.689 323 HD23 LEU 58 3HD2 LEU 58 -1.401 7.324 -3.777 324 H LYS 59 H LYS 59 -5.318 6.972 -7.643 325 HA LYS 59 HA LYS 59 -7.112 5.620 -5.937 326 HB2 LYS 59 1HB LYS 59 -7.775 7.381 -8.294 327 HB3 LYS 59 2HB LYS 59 -8.828 7.011 -6.933 328 HG2 LYS 59 1HG LYS 59 -7.383 8.212 -5.424 329 HG3 LYS 59 2HG LYS 59 -6.211 8.487 -6.715 330 HD2 LYS 59 1HD LYS 59 -7.999 9.737 -7.947 331 HD3 LYS 59 2HD LYS 59 -9.003 9.600 -6.503 332 HE2 LYS 59 1HE LYS 59 -6.289 10.912 -6.630 333 HE3 LYS 59 2HE LYS 59 -7.829 11.762 -6.637 334 HZ1 LYS 59 1HZ LYS 59 -6.932 11.782 -4.441 335 HZ2 LYS 59 2HZ LYS 59 -6.724 10.109 -4.439 336 HZ3 LYS 59 3HZ LYS 59 -8.289 10.765 -4.439 337 H LYS 60 H LYS 60 -5.979 4.969 -9.045 338 HA LYS 60 HA LYS 60 -8.238 3.355 -9.872 339 HB2 LYS 60 1HB LYS 60 -5.533 3.557 -11.185 340 HB3 LYS 60 2HB LYS 60 -7.079 3.156 -11.932 341 HG2 LYS 60 1HG LYS 60 -6.766 5.796 -10.595 342 HG3 LYS 60 2HG LYS 60 -6.038 5.545 -12.190 343 HD2 LYS 60 1HD LYS 60 -8.923 4.928 -11.609 344 HD3 LYS 60 2HD LYS 60 -8.381 6.518 -12.150 345 HE2 LYS 60 1HE LYS 60 -7.964 3.919 -13.610 346 HE3 LYS 60 2HE LYS 60 -9.155 5.148 -14.025 347 HZ1 LYS 60 1HZ LYS 60 -7.272 6.701 -14.356 348 HZ2 LYS 60 2HZ LYS 60 -7.266 5.399 -15.433 349 HZ3 LYS 60 3HZ LYS 60 -6.200 5.410 -14.121 350 H ALA 61 H ALA 61 -4.821 2.912 -9.049 351 HA ALA 61 HA ALA 61 -4.769 0.104 -9.123 352 HB1 ALA 61 1HB ALA 61 -2.731 0.286 -7.809 353 HB2 ALA 61 2HB ALA 61 -3.121 1.959 -7.407 354 HB3 ALA 61 3HB ALA 61 -2.759 1.514 -9.074 355 H ILE 62 H ILE 62 -5.400 2.382 -6.503 356 HA ILE 62 HA ILE 62 -5.837 0.564 -4.429 357 HB ILE 62 HB ILE 62 -6.920 3.318 -4.959 358 HG12 ILE 62 1HG1 ILE 62 -5.068 2.233 -2.829 359 HG13 ILE 62 2HG1 ILE 62 -4.544 3.020 -4.311 360 HG21 ILE 62 1HG2 ILE 62 -7.880 3.355 -2.719 361 HG22 ILE 62 2HG2 ILE 62 -7.474 1.652 -2.510 362 HG23 ILE 62 3HG2 ILE 62 -8.659 2.134 -3.726 363 HD11 ILE 62 1HD1 ILE 62 -6.155 4.268 -2.106 364 HD12 ILE 62 2HD1 ILE 62 -5.692 5.066 -3.609 365 HD13 ILE 62 3HD1 ILE 62 -4.453 4.558 -2.462 366 H LYS 63 H LYS 63 -8.146 1.852 -6.827 367 HA LYS 63 HA LYS 63 -10.375 0.464 -5.756 368 HB2 LYS 63 1HB LYS 63 -10.533 2.444 -7.282 369 HB3 LYS 63 2HB LYS 63 -10.028 1.402 -8.608 370 HG2 LYS 63 1HG LYS 63 -11.990 -0.021 -8.210 371 HG3 LYS 63 2HG LYS 63 -12.507 1.078 -6.933 372 HD2 LYS 63 1HD LYS 63 -12.654 2.894 -8.581 373 HD3 LYS 63 2HD LYS 63 -12.172 1.765 -9.850 374 HE2 LYS 63 1HE LYS 63 -14.657 1.612 -8.145 375 HE3 LYS 63 2HE LYS 63 -14.578 2.029 -9.856 376 HZ1 LYS 63 1HZ LYS 63 -13.837 -0.594 -8.678 377 HZ2 LYS 63 2HZ LYS 63 -13.748 -0.197 -10.319 378 HZ3 LYS 63 3HZ LYS 63 -15.250 -0.264 -9.544 379 H LYS 64 H LYS 64 -7.925 -0.350 -8.136 380 HA LYS 64 HA LYS 64 -9.020 -2.765 -9.055 381 HB2 LYS 64 1HB LYS 64 -7.101 -1.800 -10.158 382 HB3 LYS 64 2HB LYS 64 -6.141 -1.917 -8.691 383 HG2 LYS 64 1HG LYS 64 -6.256 -4.366 -8.825 384 HG3 LYS 64 2HG LYS 64 -7.179 -4.225 -10.323 385 HD2 LYS 64 1HD LYS 64 -5.333 -3.176 -11.434 386 HD3 LYS 64 2HD LYS 64 -4.423 -3.072 -9.927 387 HE2 LYS 64 1HE LYS 64 -3.591 -4.900 -11.284 388 HE3 LYS 64 2HE LYS 64 -4.346 -5.524 -9.821 389 HZ1 LYS 64 1HZ LYS 64 -6.315 -6.065 -11.099 390 HZ2 LYS 64 2HZ LYS 64 -4.958 -6.803 -11.782 391 HZ3 LYS 64 3HZ LYS 64 -5.620 -5.423 -12.500 392 H ALA 65 H ALA 65 -6.815 -2.108 -6.343 393 HA ALA 65 HA ALA 65 -6.642 -4.727 -5.349 394 HB1 ALA 65 1HB ALA 65 -5.918 -3.696 -3.256 395 HB2 ALA 65 2HB ALA 65 -6.496 -2.128 -3.821 396 HB3 ALA 65 3HB ALA 65 -5.151 -2.920 -4.642 397 H ASP 66 H ASP 66 -8.889 -2.108 -4.643 398 HA ASP 66 HA ASP 66 -10.510 -3.274 -2.719 399 HB2 ASP 66 1HB ASP 66 -10.752 -0.954 -3.374 400 HB3 ASP 66 2HB ASP 66 -11.202 -1.418 -5.008 401 H ASP 67 H ASP 67 -10.782 -3.428 -6.244 402 HA ASP 67 HA ASP 67 -13.075 -5.053 -6.358 403 HB2 ASP 67 1HB ASP 67 -12.307 -3.730 -8.259 404 HB3 ASP 67 2HB ASP 67 -10.841 -4.697 -8.365 405 H ILE 68 H ILE 68 -9.620 -5.890 -6.538 406 HA ILE 68 HA ILE 68 -9.843 -8.571 -7.206 407 HB ILE 68 HB ILE 68 -7.763 -7.310 -5.411 408 HG12 ILE 68 1HG1 ILE 68 -7.674 -7.856 -8.385 409 HG13 ILE 68 2HG1 ILE 68 -7.987 -6.278 -7.671 410 HG21 ILE 68 1HG2 ILE 68 -7.760 -9.732 -5.189 411 HG22 ILE 68 2HG2 ILE 68 -6.332 -9.194 -6.072 412 HG23 ILE 68 3HG2 ILE 68 -7.687 -9.909 -6.942 413 HD11 ILE 68 1HD1 ILE 68 -5.679 -6.481 -8.398 414 HD12 ILE 68 2HD1 ILE 68 -5.464 -7.889 -7.357 415 HD13 ILE 68 3HD1 ILE 68 -5.774 -6.306 -6.646 416 H ALA 69 H ALA 69 -9.746 -7.135 -3.959 417 HA ALA 69 HA ALA 69 -9.945 -9.673 -2.646 418 HB1 ALA 69 1HB ALA 69 -10.395 -6.933 -1.482 419 HB2 ALA 69 2HB ALA 69 -8.821 -7.701 -1.661 420 HB3 ALA 69 3HB ALA 69 -10.033 -8.418 -0.601 421 H LYS 70 H LYS 70 -12.174 -6.999 -3.246 422 HA LYS 70 HA LYS 70 -14.206 -7.853 -1.513 423 HB2 LYS 70 1HB LYS 70 -13.924 -5.570 -2.460 424 HB3 LYS 70 2HB LYS 70 -14.449 -6.199 -4.013 425 HG2 LYS 70 1HG LYS 70 -16.638 -6.733 -3.061 426 HG3 LYS 70 2HG LYS 70 -16.112 -6.084 -1.505 427 HD2 LYS 70 1HD LYS 70 -16.171 -4.501 -4.073 428 HD3 LYS 70 2HD LYS 70 -17.463 -4.489 -2.873 429 HE2 LYS 70 1HE LYS 70 -16.077 -3.485 -1.246 430 HE3 LYS 70 2HE LYS 70 -14.618 -3.807 -2.179 431 HZ1 LYS 70 1HZ LYS 70 -16.761 -2.012 -3.151 432 HZ2 LYS 70 2HZ LYS 70 -15.175 -2.160 -3.733 433 HZ3 LYS 70 3HZ LYS 70 -15.461 -1.464 -2.221 434 H LYS 71 H LYS 71 -13.536 -8.749 -4.822 435 HA LYS 71 HA LYS 71 -16.040 -9.797 -5.478 436 HB2 LYS 71 1HB LYS 71 -13.279 -10.664 -6.344 437 HB3 LYS 71 2HB LYS 71 -14.765 -11.289 -7.050 438 HG2 LYS 71 1HG LYS 71 -15.371 -9.093 -7.831 439 HG3 LYS 71 2HG LYS 71 -13.973 -8.385 -7.022 440 HD2 LYS 71 1HD LYS 71 -13.487 -8.617 -9.365 441 HD3 LYS 71 2HD LYS 71 -12.503 -9.765 -8.460 442 HE2 LYS 71 1HE LYS 71 -14.039 -11.560 -9.028 443 HE3 LYS 71 2HE LYS 71 -15.081 -10.421 -9.878 444 HZ1 LYS 71 1HZ LYS 71 -13.656 -11.646 -11.399 445 HZ2 LYS 71 2HZ LYS 71 -12.277 -11.059 -10.615 446 HZ3 LYS 71 3HZ LYS 71 -13.301 -9.994 -11.438 447 H GLN 72 H GLN 72 -13.386 -11.168 -3.597 448 HA GLN 72 HA GLN 72 -15.181 -13.429 -3.022 449 HB2 GLN 72 1HB GLN 72 -13.225 -14.940 -2.871 450 HB3 GLN 72 2HB GLN 72 -13.525 -14.316 -4.483 451 HG2 GLN 72 1HG GLN 72 -11.641 -12.723 -2.914 452 HG3 GLN 72 2HG GLN 72 -11.111 -14.373 -3.233 453 HE21 GLN 72 1HE2 GLN 72 -9.467 -13.702 -4.580 454 HE22 GLN 72 2HE2 GLN 72 -9.762 -13.067 -6.164 455 H ASN 73 H ASN 73 -12.420 -11.564 -1.656 456 HA ASN 73 HA ASN 73 -12.874 -13.106 0.791 457 HB2 ASN 73 1HB ASN 73 -10.525 -13.111 1.262 458 HB3 ASN 73 2HB ASN 73 -10.770 -13.675 -0.384 459 HD21 ASN 73 1HD2 ASN 73 -10.004 -12.466 -2.081 460 HD22 ASN 73 2HD2 ASN 73 -8.945 -11.120 -1.868 461 H SER 74 H SER 74 -13.726 -10.229 -0.005 462 HA SER 74 HA SER 74 -12.313 -8.499 1.719 463 HB2 SER 74 1HB SER 74 -14.491 -7.099 1.460 464 HB3 SER 74 2HB SER 74 -13.449 -7.384 0.066 465 HG SER 74 HG SER 74 -15.831 -8.780 0.756 466 H SER 75 H SER 75 -13.842 -11.061 2.836 467 HA SER 75 HA SER 75 -15.404 -10.199 4.976 468 HB2 SER 75 1HB SER 75 -13.396 -12.454 5.121 469 HB3 SER 75 2HB SER 75 -14.941 -12.323 5.963 470 HG SER 75 HG SER 75 -15.212 -13.695 4.224 471 H GLU 76 H GLU 76 -11.942 -10.302 4.488 472 HA GLU 76 HA GLU 76 -11.541 -8.093 6.221 473 HB2 GLU 76 1HB GLU 76 -11.575 -9.855 7.944 474 HB3 GLU 76 2HB GLU 76 -10.312 -10.724 7.081 475 HG2 GLU 76 1HG GLU 76 -8.746 -8.941 7.475 476 HG3 GLU 76 2HG GLU 76 -10.004 -7.946 8.205 477 H ALA 77 H ALA 77 -10.533 -7.070 4.593 478 HA ALA 77 HA ALA 77 -8.043 -8.287 3.601 479 HB1 ALA 77 1HB ALA 77 -9.813 -6.295 2.181 480 HB2 ALA 77 2HB ALA 77 -9.711 -8.018 1.819 481 HB3 ALA 77 3HB ALA 77 -8.310 -6.978 1.559 482 H LYS 78 H LYS 78 -6.200 -7.038 3.660 483 HA LYS 78 HA LYS 78 -6.486 -4.387 4.901 484 HB2 LYS 78 1HB LYS 78 -4.360 -6.449 5.518 485 HB3 LYS 78 2HB LYS 78 -4.403 -4.811 6.158 486 HG2 LYS 78 1HG LYS 78 -6.609 -5.355 7.191 487 HG3 LYS 78 2HG LYS 78 -6.369 -7.026 6.683 488 HD2 LYS 78 1HD LYS 78 -4.498 -5.483 8.477 489 HD3 LYS 78 2HD LYS 78 -5.728 -6.615 9.037 490 HE2 LYS 78 1HE LYS 78 -4.614 -8.377 7.658 491 HE3 LYS 78 2HE LYS 78 -3.318 -7.226 7.336 492 HZ1 LYS 78 1HZ LYS 78 -2.840 -8.754 9.187 493 HZ2 LYS 78 2HZ LYS 78 -4.141 -8.105 10.048 494 HZ3 LYS 78 3HZ LYS 78 -2.809 -7.130 9.665 495 H ILE 79 H ILE 79 -5.209 -2.783 4.103 496 HA ILE 79 HA ILE 79 -3.513 -3.483 1.802 497 HB ILE 79 HB ILE 79 -5.590 -1.289 1.811 498 HG12 ILE 79 1HG1 ILE 79 -5.571 -3.908 0.296 499 HG13 ILE 79 2HG1 ILE 79 -6.618 -3.524 1.660 500 HG21 ILE 79 1HG2 ILE 79 -3.671 -0.687 0.489 501 HG22 ILE 79 2HG2 ILE 79 -5.019 -1.078 -0.579 502 HG23 ILE 79 3HG2 ILE 79 -3.713 -2.240 -0.343 503 HD11 ILE 79 1HD1 ILE 79 -6.618 -2.152 -1.020 504 HD12 ILE 79 2HD1 ILE 79 -7.655 -1.740 0.347 505 HD13 ILE 79 3HD1 ILE 79 -7.810 -3.314 -0.437 506 H LEU 80 H LEU 80 -1.650 -2.338 1.686 507 HA LEU 80 HA LEU 80 -1.389 0.054 3.392 508 HB2 LEU 80 1HB LEU 80 0.765 -1.559 2.020 509 HB3 LEU 80 2HB LEU 80 1.039 -0.120 2.985 510 HG LEU 80 HG LEU 80 0.150 -2.824 3.915 511 HD11 LEU 80 1HD1 LEU 80 2.539 -1.110 4.548 512 HD12 LEU 80 2HD1 LEU 80 2.526 -2.556 3.539 513 HD13 LEU 80 3HD1 LEU 80 2.186 -2.682 5.264 514 HD21 LEU 80 1HD2 LEU 80 0.067 -1.871 6.183 515 HD22 LEU 80 2HD2 LEU 80 -1.173 -1.197 5.127 516 HD23 LEU 80 3HD2 LEU 80 0.275 -0.262 5.492 517 H ILE 81 H ILE 81 -1.045 2.027 2.464 518 HA ILE 81 HA ILE 81 -0.218 1.983 -0.357 519 HB ILE 81 HB ILE 81 -1.554 4.283 1.096 520 HG12 ILE 81 1HG1 ILE 81 -3.243 3.888 -0.854 521 HG13 ILE 81 2HG1 ILE 81 -2.531 2.282 -0.926 522 HG21 ILE 81 1HG2 ILE 81 -0.641 4.056 -1.768 523 HG22 ILE 81 2HG2 ILE 81 0.124 5.031 -0.517 524 HG23 ILE 81 3HG2 ILE 81 -1.506 5.421 -1.063 525 HD11 ILE 81 1HD1 ILE 81 -3.936 3.523 1.420 526 HD12 ILE 81 2HD1 ILE 81 -3.149 1.946 1.433 527 HD13 ILE 81 3HD1 ILE 81 -4.538 2.231 0.384 528 H LEU 82 H LEU 82 1.885 1.787 -0.122 529 HA LEU 82 HA LEU 82 3.474 3.278 1.741 530 HB2 LEU 82 1HB LEU 82 3.886 0.975 0.583 531 HB3 LEU 82 2HB LEU 82 4.472 1.930 -0.759 532 HG LEU 82 HG LEU 82 6.277 1.057 0.671 533 HD11 LEU 82 1HD1 LEU 82 6.024 4.057 0.709 534 HD12 LEU 82 2HD1 LEU 82 6.669 3.079 -0.610 535 HD13 LEU 82 3HD1 LEU 82 7.515 3.143 0.935 536 HD21 LEU 82 1HD2 LEU 82 5.022 1.138 2.793 537 HD22 LEU 82 2HD2 LEU 82 5.177 2.894 2.787 538 HD23 LEU 82 3HD2 LEU 82 6.615 1.882 2.899 539 H LEU 83 H LEU 83 3.768 5.454 1.479 540 HA LEU 83 HA LEU 83 4.334 6.437 -1.206 541 HB2 LEU 83 1HB LEU 83 2.673 8.389 -0.620 542 HB3 LEU 83 2HB LEU 83 2.119 6.923 -1.398 543 HG LEU 83 HG LEU 83 1.340 6.073 0.792 544 HD11 LEU 83 1HD1 LEU 83 2.877 7.283 2.237 545 HD12 LEU 83 2HD1 LEU 83 1.200 7.569 2.702 546 HD13 LEU 83 3HD1 LEU 83 2.092 8.802 1.813 547 HD21 LEU 83 1HD2 LEU 83 -0.192 7.253 -0.696 548 HD22 LEU 83 2HD2 LEU 83 0.258 8.786 0.051 549 HD23 LEU 83 3HD2 LEU 83 -0.581 7.557 0.998 550 H GLU 84 H GLU 84 5.241 8.569 -1.277 551 HA GLU 84 HA GLU 84 6.403 9.387 1.297 552 HB2 GLU 84 1HB GLU 84 7.918 8.859 -0.670 553 HB3 GLU 84 2HB GLU 84 7.226 10.245 -1.491 554 HG2 GLU 84 1HG GLU 84 8.606 10.463 1.167 555 HG3 GLU 84 2HG GLU 84 9.465 10.571 -0.367 556 H LYS 85 H LYS 85 4.923 10.635 2.191 557 HA LYS 85 HA LYS 85 4.614 13.298 1.391 558 HB2 LYS 85 1HB LYS 85 2.170 13.352 1.003 559 HB3 LYS 85 2HB LYS 85 3.010 12.450 -0.250 560 HG2 LYS 85 1HG LYS 85 2.221 10.398 0.536 561 HG3 LYS 85 2HG LYS 85 1.768 11.070 2.101 562 HD2 LYS 85 1HD LYS 85 -0.226 10.682 0.823 563 HD3 LYS 85 2HD LYS 85 0.025 12.421 0.956 564 HE2 LYS 85 1HE LYS 85 1.042 12.396 -1.303 565 HE3 LYS 85 2HE LYS 85 0.656 10.680 -1.425 566 HZ1 LYS 85 1HZ LYS 85 -1.247 12.943 -1.213 567 HZ2 LYS 85 2HZ LYS 85 -1.715 11.327 -1.057 568 HZ3 LYS 85 3HZ LYS 85 -1.057 11.880 -2.522 569 HA PRO 86 HA PRO 86 3.507 13.300 5.761 570 HB2 PRO 86 1HB PRO 86 2.194 15.886 5.257 571 HB3 PRO 86 2HB PRO 86 3.538 15.507 6.335 572 HG2 PRO 86 1HG PRO 86 3.894 16.913 4.073 573 HG3 PRO 86 2HG PRO 86 5.120 15.782 4.677 574 HD2 PRO 86 1HD PRO 86 3.124 15.416 2.476 575 HD3 PRO 86 2HD PRO 86 4.827 14.917 2.548 576 H VAL 87 H VAL 87 1.839 12.098 6.440 577 HA VAL 87 HA VAL 87 -0.799 12.544 5.206 578 HB VAL 87 HB VAL 87 -1.298 10.159 5.621 579 HG11 VAL 87 1HG1 VAL 87 0.052 9.256 3.810 580 HG12 VAL 87 2HG1 VAL 87 1.172 10.608 3.958 581 HG13 VAL 87 3HG1 VAL 87 -0.487 10.892 3.435 582 HG21 VAL 87 1HG2 VAL 87 1.609 9.995 6.413 583 HG22 VAL 87 2HG2 VAL 87 0.557 8.610 6.122 584 HG23 VAL 87 3HG2 VAL 87 0.216 9.712 7.456 585 H SER 88 H SER 88 -2.536 12.760 6.483 586 HA SER 88 HA SER 88 -2.112 12.694 9.378 587 HB2 SER 88 1HB SER 88 -4.429 13.852 7.812 588 HB3 SER 88 2HB SER 88 -4.113 14.065 9.533 589 HG SER 88 HG SER 88 -2.250 15.221 9.014 590 HA PRO 89 HA PRO 89 -4.431 8.957 10.051 591 HB2 PRO 89 1HB PRO 89 -5.996 10.585 12.001 592 HB3 PRO 89 2HB PRO 89 -5.232 9.008 12.215 593 HG2 PRO 89 1HG PRO 89 -4.112 11.199 13.226 594 HG3 PRO 89 2HG PRO 89 -3.119 9.922 12.498 595 HD2 PRO 89 1HD PRO 89 -3.850 12.600 11.418 596 HD3 PRO 89 2HD PRO 89 -2.365 11.656 11.194 597 H GLU 90 H GLU 90 -6.391 11.935 10.088 598 HA GLU 90 HA GLU 90 -8.818 10.786 9.291 599 HB2 GLU 90 1HB GLU 90 -8.379 13.108 10.249 600 HB3 GLU 90 2HB GLU 90 -7.906 13.589 8.629 601 HG2 GLU 90 1HG GLU 90 -10.573 12.335 9.063 602 HG3 GLU 90 2HG GLU 90 -10.321 14.020 9.507 603 H TYR 91 H TYR 91 -6.137 12.105 7.410 604 HA TYR 91 HA TYR 91 -7.298 11.938 4.865 605 HB2 TYR 91 1HB TYR 91 -5.261 13.195 5.214 606 HB3 TYR 91 2HB TYR 91 -4.402 11.744 5.714 607 HD1 TYR 91 HD1 TYR 91 -6.419 12.886 2.765 608 HD2 TYR 91 HD2 TYR 91 -2.945 10.863 4.164 609 HE1 TYR 91 HE1 TYR 91 -5.698 12.527 0.443 610 HE2 TYR 91 HE2 TYR 91 -2.219 10.496 1.842 611 HH TYR 91 HH TYR 91 -3.814 12.035 -0.842 612 H GLU 92 H GLU 92 -5.634 9.533 6.831 613 HA GLU 92 HA GLU 92 -5.295 7.534 4.905 614 HB2 GLU 92 1HB GLU 92 -4.207 7.352 7.041 615 HB3 GLU 92 2HB GLU 92 -5.752 7.355 7.884 616 HG2 GLU 92 1HG GLU 92 -6.295 5.221 6.714 617 HG3 GLU 92 2HG GLU 92 -4.638 5.195 6.118 618 H LYS 93 H LYS 93 -8.110 8.527 6.707 619 HA LYS 93 HA LYS 93 -9.586 6.118 6.302 620 HB2 LYS 93 1HB LYS 93 -10.795 8.792 6.973 621 HB3 LYS 93 2HB LYS 93 -11.375 7.193 7.410 622 HG2 LYS 93 1HG LYS 93 -8.989 8.641 8.533 623 HG3 LYS 93 2HG LYS 93 -10.492 8.240 9.363 624 HD2 LYS 93 1HD LYS 93 -9.970 5.871 9.220 625 HD3 LYS 93 2HD LYS 93 -8.506 6.229 8.299 626 HE2 LYS 93 1HE LYS 93 -7.687 7.554 10.243 627 HE3 LYS 93 2HE LYS 93 -9.096 7.010 11.149 628 HZ1 LYS 93 1HZ LYS 93 -8.332 4.721 10.842 629 HZ2 LYS 93 2HZ LYS 93 -7.194 5.654 11.665 630 HZ3 LYS 93 3HZ LYS 93 -6.950 5.279 10.031 631 H LYS 94 H LYS 94 -8.999 9.025 4.551 632 HA LYS 94 HA LYS 94 -11.176 8.853 2.746 633 HB2 LYS 94 1HB LYS 94 -8.444 10.106 2.469 634 HB3 LYS 94 2HB LYS 94 -9.686 10.218 1.231 635 HG2 LYS 94 1HG LYS 94 -11.173 11.303 2.893 636 HG3 LYS 94 2HG LYS 94 -9.827 11.298 4.036 637 HD2 LYS 94 1HD LYS 94 -8.527 12.716 2.612 638 HD3 LYS 94 2HD LYS 94 -9.708 12.574 1.309 639 HE2 LYS 94 1HE LYS 94 -9.997 14.702 2.364 640 HE3 LYS 94 2HE LYS 94 -11.374 13.684 2.775 641 HZ1 LYS 94 1HZ LYS 94 -10.593 14.884 4.696 642 HZ2 LYS 94 2HZ LYS 94 -9.043 14.245 4.519 643 HZ3 LYS 94 3HZ LYS 94 -10.332 13.228 4.925 644 H LEU 95 H LEU 95 -8.002 7.357 2.887 645 HA LEU 95 HA LEU 95 -8.220 6.163 0.290 646 HB2 LEU 95 1HB LEU 95 -6.373 5.627 2.608 647 HB3 LEU 95 2HB LEU 95 -6.315 4.705 1.120 648 HG LEU 95 HG LEU 95 -4.593 6.306 0.965 649 HD11 LEU 95 1HD1 LEU 95 -5.217 7.671 -0.932 650 HD12 LEU 95 2HD1 LEU 95 -6.925 7.416 -0.579 651 HD13 LEU 95 3HD1 LEU 95 -5.915 6.058 -1.073 652 HD21 LEU 95 1HD2 LEU 95 -4.898 8.694 1.301 653 HD22 LEU 95 2HD2 LEU 95 -5.309 7.789 2.758 654 HD23 LEU 95 3HD2 LEU 95 -6.589 8.427 1.726 655 H GLN 96 H GLN 96 -8.946 5.186 3.599 656 HA GLN 96 HA GLN 96 -9.840 2.566 2.994 657 HB2 GLN 96 1HB GLN 96 -10.520 4.502 5.208 658 HB3 GLN 96 2HB GLN 96 -11.306 2.936 5.088 659 HG2 GLN 96 1HG GLN 96 -9.283 1.772 5.482 660 HG3 GLN 96 2HG GLN 96 -8.321 3.233 5.216 661 HE21 GLN 96 1HE2 GLN 96 -7.317 2.955 7.216 662 HE22 GLN 96 2HE2 GLN 96 -8.134 3.317 8.699 663 H LYS 97 H LYS 97 -11.206 5.730 2.609 664 HA LYS 97 HA LYS 97 -13.865 4.837 2.036 665 HB2 LYS 97 1HB LYS 97 -13.392 7.125 2.813 666 HB3 LYS 97 2HB LYS 97 -12.509 7.444 1.328 667 HG2 LYS 97 1HG LYS 97 -14.539 7.186 0.031 668 HG3 LYS 97 2HG LYS 97 -15.441 6.776 1.491 669 HD2 LYS 97 1HD LYS 97 -14.997 8.989 2.406 670 HD3 LYS 97 2HD LYS 97 -14.040 9.402 0.983 671 HE2 LYS 97 1HE LYS 97 -16.012 9.159 -0.428 672 HE3 LYS 97 2HE LYS 97 -16.975 8.701 0.976 673 HZ1 LYS 97 1HZ LYS 97 -17.299 11.018 0.412 674 HZ2 LYS 97 2HZ LYS 97 -15.645 11.323 0.561 675 HZ3 LYS 97 3HZ LYS 97 -16.551 10.890 1.923 676 H TYR 98 H TYR 98 -10.961 5.291 0.133 677 HA TYR 98 HA TYR 98 -12.260 5.089 -2.408 678 HB2 TYR 98 1HB TYR 98 -9.411 4.936 -1.494 679 HB3 TYR 98 2HB TYR 98 -9.828 4.419 -3.122 680 HD1 TYR 98 HD1 TYR 98 -9.058 7.206 -1.032 681 HD2 TYR 98 HD2 TYR 98 -11.060 6.091 -4.611 682 HE1 TYR 98 HE1 TYR 98 -8.960 9.535 -1.802 683 HE2 TYR 98 HE2 TYR 98 -10.970 8.419 -5.390 684 HH TYR 98 HH TYR 98 -10.787 10.696 -4.364 685 H ALA 99 H ALA 99 -10.379 2.804 -0.440 686 HA ALA 99 HA ALA 99 -11.650 0.610 -1.946 687 HB1 ALA 99 1HB ALA 99 -9.245 0.637 -2.291 688 HB2 ALA 99 2HB ALA 99 -9.707 -0.767 -1.328 689 HB3 ALA 99 3HB ALA 99 -8.977 0.638 -0.547 690 H ASP 100 H ASP 100 -12.858 -0.803 -0.816 691 HA ASP 100 HA ASP 100 -13.291 -0.150 1.982 692 HB2 ASP 100 1HB ASP 100 -15.179 -0.628 0.343 693 HB3 ASP 100 2HB ASP 100 -14.671 -2.314 0.380 694 H ALA 101 H ALA 101 -11.750 -0.862 3.183 695 HA ALA 101 HA ALA 101 -11.425 -3.560 3.895 696 HB1 ALA 101 1HB ALA 101 -9.104 -3.896 3.139 697 HB2 ALA 101 2HB ALA 101 -9.172 -2.370 2.257 698 HB3 ALA 101 3HB ALA 101 -10.195 -3.720 1.763 699 H GLU 102 H GLU 102 -9.044 -3.518 5.152 700 HA GLU 102 HA GLU 102 -9.175 -1.034 6.678 701 HB2 GLU 102 1HB GLU 102 -7.415 -3.373 7.353 702 HB3 GLU 102 2HB GLU 102 -8.000 -2.078 8.382 703 HG2 GLU 102 1HG GLU 102 -10.336 -3.024 7.942 704 HG3 GLU 102 2HG GLU 102 -9.490 -4.462 7.371 705 H VAL 103 H VAL 103 -8.275 0.342 5.260 706 HA VAL 103 HA VAL 103 -5.699 -0.185 4.073 707 HB VAL 103 HB VAL 103 -7.862 1.764 3.665 708 HG11 VAL 103 1HG1 VAL 103 -5.032 2.658 3.169 709 HG12 VAL 103 2HG1 VAL 103 -6.098 3.308 4.414 710 HG13 VAL 103 3HG1 VAL 103 -6.506 3.509 2.709 711 HG21 VAL 103 1HG2 VAL 103 -5.710 0.731 1.834 712 HG22 VAL 103 2HG2 VAL 103 -7.181 1.573 1.354 713 HG23 VAL 103 3HG2 VAL 103 -7.284 -0.031 2.086 714 H ARG 104 H ARG 104 -3.856 0.252 4.997 715 HA ARG 104 HA ARG 104 -3.716 2.472 6.927 716 HB2 ARG 104 1HB ARG 104 -2.110 -0.092 6.891 717 HB3 ARG 104 2HB ARG 104 -1.782 1.270 7.950 718 HG2 ARG 104 1HG ARG 104 -4.054 0.991 8.915 719 HG3 ARG 104 2HG ARG 104 -4.238 -0.469 7.940 720 HD2 ARG 104 1HD ARG 104 -3.530 -1.002 10.218 721 HD3 ARG 104 2HD ARG 104 -2.298 -1.458 9.041 722 HE ARG 104 HE ARG 104 -1.737 1.129 9.952 723 HH11 ARG 104 1HH1 ARG 104 -1.775 -2.152 11.162 724 HH12 ARG 104 2HH1 ARG 104 -0.536 -1.868 12.341 725 HH21 ARG 104 1HH2 ARG 104 -0.114 1.516 11.501 726 HH22 ARG 104 2HH2 ARG 104 0.402 0.229 12.546 727 H VAL 105 H VAL 105 -2.802 4.122 5.909 728 HA VAL 105 HA VAL 105 -1.049 3.657 3.666 729 HB VAL 105 HB VAL 105 -1.034 6.077 3.377 730 HG11 VAL 105 1HG1 VAL 105 -3.453 6.400 2.998 731 HG12 VAL 105 2HG1 VAL 105 -3.781 4.952 3.953 732 HG13 VAL 105 3HG1 VAL 105 -2.891 4.826 2.439 733 HG21 VAL 105 1HG2 VAL 105 -2.643 6.175 5.932 734 HG22 VAL 105 2HG2 VAL 105 -2.336 7.541 4.861 735 HG23 VAL 105 3HG2 VAL 105 -0.998 6.773 5.714 736 H ARG 106 H ARG 106 1.138 3.899 3.617 737 HA ARG 106 HA ARG 106 2.387 4.383 6.243 738 HB2 ARG 106 1HB ARG 106 3.512 2.656 4.032 739 HB3 ARG 106 2HB ARG 106 4.158 2.850 5.651 740 HG2 ARG 106 1HG ARG 106 1.744 1.317 4.762 741 HG3 ARG 106 2HG ARG 106 3.131 0.775 5.689 742 HD2 ARG 106 1HD ARG 106 1.122 2.765 6.717 743 HD3 ARG 106 2HD ARG 106 1.020 1.031 7.008 744 HE ARG 106 HE ARG 106 3.232 1.268 8.132 745 HH11 ARG 106 1HH1 ARG 106 1.131 4.066 7.831 746 HH12 ARG 106 2HH1 ARG 106 1.680 4.784 9.313 747 HH21 ARG 106 1HH2 ARG 106 3.940 2.230 10.090 748 HH22 ARG 106 2HH2 ARG 106 3.259 3.744 10.590 749 H THR 107 H THR 107 3.339 6.290 6.278 750 HA THR 107 HA THR 107 4.307 7.516 3.846 751 HB THR 107 HB THR 107 3.159 8.919 5.487 752 HG1 THR 107 HG1 THR 107 4.434 10.381 4.675 753 HG21 THR 107 1HG2 THR 107 4.213 9.472 7.637 754 HG22 THR 107 2HG2 THR 107 5.462 8.266 7.329 755 HG23 THR 107 3HG2 THR 107 3.786 7.763 7.539 756 H VAL 108 H VAL 108 6.388 7.681 3.222 757 HA VAL 108 HA VAL 108 8.460 6.716 5.070 758 HB VAL 108 HB VAL 108 9.590 5.545 3.242 759 HG11 VAL 108 1HG1 VAL 108 8.139 4.261 4.677 760 HG12 VAL 108 2HG1 VAL 108 8.016 3.662 3.023 761 HG13 VAL 108 3HG1 VAL 108 6.740 4.679 3.688 762 HG21 VAL 108 1HG2 VAL 108 8.741 6.861 1.369 763 HG22 VAL 108 2HG2 VAL 108 7.128 6.192 1.620 764 HG23 VAL 108 3HG2 VAL 108 8.451 5.140 1.116 765 H THR 109 H THR 109 10.557 7.477 4.674 766 HA THR 109 HA THR 109 10.801 9.649 2.703 767 HB THR 109 HB THR 109 12.539 10.592 4.357 768 HG1 THR 109 HG1 THR 109 10.985 8.990 6.142 769 HG21 THR 109 1HG2 THR 109 10.819 11.830 5.604 770 HG22 THR 109 2HG2 THR 109 9.604 10.673 5.061 771 HG23 THR 109 3HG2 THR 109 10.418 11.708 3.890 772 H SER 110 H SER 110 11.903 6.680 3.849 773 HA SER 110 HA SER 110 14.140 6.673 2.025 774 HB2 SER 110 1HB SER 110 14.542 6.222 4.995 775 HB3 SER 110 2HB SER 110 15.762 5.935 3.755 776 HG SER 110 HG SER 110 14.699 8.421 3.538 777 HA PRO 111 HA PRO 111 12.891 2.631 1.056 778 HB2 PRO 111 1HB PRO 111 15.757 1.851 1.342 779 HB3 PRO 111 2HB PRO 111 14.650 1.602 -0.014 780 HG2 PRO 111 1HG PRO 111 16.488 3.499 -0.145 781 HG3 PRO 111 2HG PRO 111 14.848 3.804 -0.745 782 HD2 PRO 111 1HD PRO 111 16.137 4.708 1.793 783 HD3 PRO 111 2HD PRO 111 15.014 5.571 0.726 784 H ASP 112 H ASP 112 15.010 2.917 3.843 785 HA ASP 112 HA ASP 112 14.853 0.246 4.706 786 HB2 ASP 112 1HB ASP 112 15.320 2.731 6.363 787 HB3 ASP 112 2HB ASP 112 15.663 1.081 6.873 788 H GLU 113 H GLU 113 12.907 3.082 5.515 789 HA GLU 113 HA GLU 113 11.297 1.612 7.378 790 HB2 GLU 113 1HB GLU 113 10.821 4.318 6.120 791 HB3 GLU 113 2HB GLU 113 9.915 3.642 7.469 792 HG2 GLU 113 1HG GLU 113 12.824 4.404 7.435 793 HG3 GLU 113 2HG GLU 113 11.521 5.201 8.314 794 H ALA 114 H ALA 114 11.168 2.424 3.998 795 HA ALA 114 HA ALA 114 8.476 1.804 3.491 796 HB1 ALA 114 1HB ALA 114 9.875 2.971 1.869 797 HB2 ALA 114 2HB ALA 114 9.165 1.522 1.157 798 HB3 ALA 114 3HB ALA 114 10.855 1.520 1.659 799 H LYS 115 H LYS 115 11.395 -0.205 3.159 800 HA LYS 115 HA LYS 115 9.949 -2.574 2.598 801 HB2 LYS 115 1HB LYS 115 12.047 -3.738 2.838 802 HB3 LYS 115 2HB LYS 115 12.312 -2.242 1.964 803 HG2 LYS 115 1HG LYS 115 13.182 -1.225 4.042 804 HG3 LYS 115 2HG LYS 115 13.011 -2.795 4.838 805 HD2 LYS 115 1HD LYS 115 14.504 -3.792 3.159 806 HD3 LYS 115 2HD LYS 115 14.686 -2.218 2.394 807 HE2 LYS 115 1HE LYS 115 15.716 -1.346 4.428 808 HE3 LYS 115 2HE LYS 115 15.524 -2.916 5.202 809 HZ1 LYS 115 1HZ LYS 115 17.759 -2.589 4.317 810 HZ2 LYS 115 2HZ LYS 115 17.129 -2.393 2.755 811 HZ3 LYS 115 3HZ LYS 115 16.981 -3.882 3.556 812 H ARG 116 H ARG 116 10.865 -0.960 5.506 813 HA ARG 116 HA ARG 116 10.564 -3.011 7.381 814 HB2 ARG 116 1HB ARG 116 11.511 -0.899 8.025 815 HB3 ARG 116 2HB ARG 116 10.039 -0.046 7.583 816 HG2 ARG 116 1HG ARG 116 8.855 -1.293 9.378 817 HG3 ARG 116 2HG ARG 116 10.413 -1.957 9.871 818 HD2 ARG 116 1HD ARG 116 11.252 0.276 10.313 819 HD3 ARG 116 2HD ARG 116 9.736 0.978 9.746 820 HE ARG 116 HE ARG 116 9.173 -0.845 11.804 821 HH11 ARG 116 1HH1 ARG 116 10.670 2.299 11.325 822 HH12 ARG 116 2HH1 ARG 116 10.306 2.842 12.936 823 HH21 ARG 116 1HH2 ARG 116 8.729 -0.127 13.921 824 HH22 ARG 116 2HH2 ARG 116 9.214 1.465 14.413 825 H TRP 117 H TRP 117 8.145 -0.581 6.326 826 HA TRP 117 HA TRP 117 6.073 -1.501 7.941 827 HB2 TRP 117 1HB TRP 117 5.844 -0.135 5.254 828 HB3 TRP 117 2HB TRP 117 4.572 -0.253 6.460 829 HD1 TRP 117 HD1 TRP 117 6.373 2.367 5.179 830 HE1 TRP 117 HE1 TRP 117 7.068 4.154 6.895 831 HE3 TRP 117 HE3 TRP 117 5.830 -0.369 9.474 832 HZ2 TRP 117 HZ2 TRP 117 7.359 4.371 9.687 833 HZ3 TRP 117 HZ3 TRP 117 6.343 0.708 11.620 834 HH2 TRP 117 HH2 TRP 117 7.091 3.028 11.725 835 H ILE 118 H ILE 118 7.059 -2.472 4.722 836 HA ILE 118 HA ILE 118 4.749 -3.958 4.082 837 HB ILE 118 HB ILE 118 7.562 -4.192 3.006 838 HG12 ILE 118 1HG1 ILE 118 5.112 -2.760 1.948 839 HG13 ILE 118 2HG1 ILE 118 6.500 -1.986 2.703 840 HG21 ILE 118 1HG2 ILE 118 4.983 -5.293 1.892 841 HG22 ILE 118 2HG2 ILE 118 6.305 -6.239 2.579 842 HG23 ILE 118 3HG2 ILE 118 6.552 -5.331 1.088 843 HD11 ILE 118 1HD1 ILE 118 7.920 -2.767 0.878 844 HD12 ILE 118 2HD1 ILE 118 6.584 -1.774 0.295 845 HD13 ILE 118 3HD1 ILE 118 6.521 -3.527 0.121 846 H LYS 119 H LYS 119 7.844 -4.914 5.561 847 HA LYS 119 HA LYS 119 7.209 -7.692 5.582 848 HB2 LYS 119 1HB LYS 119 9.241 -6.129 7.173 849 HB3 LYS 119 2HB LYS 119 9.101 -7.881 7.211 850 HG2 LYS 119 1HG LYS 119 9.451 -7.826 4.710 851 HG3 LYS 119 2HG LYS 119 9.896 -6.133 4.907 852 HD2 LYS 119 1HD LYS 119 11.242 -8.461 6.280 853 HD3 LYS 119 2HD LYS 119 11.853 -7.636 4.848 854 HE2 LYS 119 1HE LYS 119 13.051 -6.582 6.494 855 HE3 LYS 119 2HE LYS 119 11.659 -5.510 6.368 856 HZ1 LYS 119 1HZ LYS 119 10.670 -6.661 8.269 857 HZ2 LYS 119 2HZ LYS 119 12.166 -5.985 8.665 858 HZ3 LYS 119 3HZ LYS 119 12.039 -7.647 8.394 859 H GLU 120 H GLU 120 6.932 -5.107 7.993 860 HA GLU 120 HA GLU 120 6.104 -6.821 10.097 861 HB2 GLU 120 1HB GLU 120 5.624 -3.855 9.757 862 HB3 GLU 120 2HB GLU 120 5.395 -4.761 11.248 863 HG2 GLU 120 1HG GLU 120 7.854 -5.392 11.046 864 HG3 GLU 120 2HG GLU 120 7.953 -4.128 9.822 865 H PHE 121 H PHE 121 4.451 -5.228 7.502 866 HA PHE 121 HA PHE 121 1.799 -5.618 8.496 867 HB2 PHE 121 1HB PHE 121 2.254 -3.864 6.906 868 HB3 PHE 121 2HB PHE 121 2.892 -5.019 5.745 869 HD1 PHE 121 HD1 PHE 121 -0.244 -4.425 7.676 870 HD2 PHE 121 HD2 PHE 121 1.540 -5.580 3.992 871 HE1 PHE 121 HE1 PHE 121 -2.470 -4.585 6.654 872 HE2 PHE 121 HE2 PHE 121 -0.686 -5.745 2.963 873 HZ PHE 121 HZ PHE 121 -2.694 -5.247 4.294 874 H SER 122 H SER 122 4.041 -7.469 6.569 875 HA SER 122 HA SER 122 2.088 -9.406 5.738 876 HB2 SER 122 1HB SER 122 4.094 -8.909 4.379 877 HB3 SER 122 2HB SER 122 5.113 -9.537 5.672 878 HG SER 122 HG SER 122 3.143 -11.281 4.909 879 H GLU 123 H GLU 123 4.524 -9.121 8.260 880 HA GLU 123 HA GLU 123 3.713 -11.746 9.304 881 HB2 GLU 123 1HB GLU 123 6.204 -10.957 8.758 882 HB3 GLU 123 2HB GLU 123 6.082 -10.295 10.380 883 HG2 GLU 123 1HG GLU 123 5.701 -13.175 9.598 884 HG3 GLU 123 2HG GLU 123 7.102 -12.487 10.415 885 H GLU 124 H GLU 124 1.746 -10.591 10.075 886 HA GLU 124 HA GLU 124 2.239 -9.778 12.827 887 HB2 GLU 124 1HB GLU 124 0.406 -8.025 12.594 888 HB3 GLU 124 2HB GLU 124 1.966 -7.634 11.891 889 HG2 GLU 124 1HG GLU 124 1.168 -8.044 9.691 890 HG3 GLU 124 2HG GLU 124 -0.331 -8.741 10.302 Start of MODEL 6 1 HA MET 21 HA MET 21 -8.474 -11.609 3.973 2 HB2 MET 21 1HB MET 21 -7.301 -10.067 5.400 3 HB3 MET 21 2HB MET 21 -7.946 -11.354 6.404 4 HG2 MET 21 1HG MET 21 -5.091 -11.149 5.469 5 HG3 MET 21 2HG MET 21 -5.681 -10.652 7.052 6 HE1 MET 21 1HE MET 21 -7.785 -12.983 7.729 7 HE2 MET 21 2HE MET 21 -6.623 -12.305 8.865 8 HE3 MET 21 3HE MET 21 -6.736 -14.052 8.656 9 H THR 22 H THR 22 -7.643 -10.526 2.270 10 HA THR 22 HA THR 22 -5.104 -11.462 1.200 11 HB THR 22 HB THR 22 -6.931 -9.393 -0.030 12 HG1 THR 22 HG1 THR 22 -6.976 -12.236 -0.266 13 HG21 THR 22 1HG2 THR 22 -4.678 -9.568 -0.991 14 HG22 THR 22 2HG2 THR 22 -5.903 -10.145 -2.122 15 HG23 THR 22 3HG2 THR 22 -4.914 -11.299 -1.227 16 H LEU 23 H LEU 23 -3.272 -10.249 1.015 17 HA LEU 23 HA LEU 23 -3.298 -7.664 2.410 18 HB2 LEU 23 1HB LEU 23 -0.992 -9.548 1.926 19 HB3 LEU 23 2HB LEU 23 -0.916 -8.047 2.827 20 HG LEU 23 HG LEU 23 -2.382 -10.562 3.609 21 HD11 LEU 23 1HD1 LEU 23 -0.073 -9.084 4.858 22 HD12 LEU 23 2HD1 LEU 23 0.020 -10.612 3.980 23 HD13 LEU 23 3HD1 LEU 23 -0.851 -10.527 5.511 24 HD21 LEU 23 1HD2 LEU 23 -3.745 -8.669 4.237 25 HD22 LEU 23 2HD2 LEU 23 -2.350 -7.863 4.952 26 HD23 LEU 23 3HD2 LEU 23 -2.975 -9.347 5.673 27 H PHE 24 H PHE 24 -3.324 -6.023 1.065 28 HA PHE 24 HA PHE 24 -1.878 -6.220 -1.496 29 HB2 PHE 24 1HB PHE 24 -3.918 -4.149 -0.662 30 HB3 PHE 24 2HB PHE 24 -3.240 -4.368 -2.266 31 HD1 PHE 24 HD1 PHE 24 -5.570 -5.710 0.224 32 HD2 PHE 24 HD2 PHE 24 -4.071 -6.052 -3.744 33 HE1 PHE 24 HE1 PHE 24 -7.454 -7.178 -0.358 34 HE2 PHE 24 HE2 PHE 24 -5.946 -7.523 -4.328 35 HZ PHE 24 HZ PHE 24 -7.643 -8.086 -2.638 36 H VAL 25 H VAL 25 -0.402 -4.588 -2.062 37 HA VAL 25 HA VAL 25 0.035 -2.509 -0.062 38 HB VAL 25 HB VAL 25 1.735 -4.041 0.563 39 HG11 VAL 25 1HG1 VAL 25 2.560 -4.169 -2.332 40 HG12 VAL 25 2HG1 VAL 25 1.731 -5.442 -1.438 41 HG13 VAL 25 3HG1 VAL 25 3.369 -4.969 -0.986 42 HG21 VAL 25 1HG2 VAL 25 2.512 -1.795 0.593 43 HG22 VAL 25 2HG2 VAL 25 2.793 -1.797 -1.147 44 HG23 VAL 25 3HG2 VAL 25 3.819 -2.770 -0.086 45 H LEU 26 H LEU 26 0.353 -0.598 -0.835 46 HA LEU 26 HA LEU 26 0.871 -0.270 -3.716 47 HB2 LEU 26 1HB LEU 26 -0.799 1.332 -1.795 48 HB3 LEU 26 2HB LEU 26 -0.211 2.010 -3.292 49 HG LEU 26 HG LEU 26 -1.464 0.233 -4.526 50 HD11 LEU 26 1HD1 LEU 26 -1.603 -1.430 -2.757 51 HD12 LEU 26 2HD1 LEU 26 -3.206 -0.992 -3.352 52 HD13 LEU 26 3HD1 LEU 26 -2.629 -0.346 -1.816 53 HD21 LEU 26 1HD2 LEU 26 -3.664 1.237 -4.178 54 HD22 LEU 26 2HD2 LEU 26 -2.393 2.456 -4.250 55 HD23 LEU 26 3HD2 LEU 26 -3.082 1.991 -2.696 56 H ILE 27 H ILE 27 2.141 1.617 -4.264 57 HA ILE 27 HA ILE 27 3.475 3.005 -2.101 58 HB ILE 27 HB ILE 27 4.981 1.161 -2.313 59 HG12 ILE 27 1HG1 ILE 27 6.108 3.515 -3.848 60 HG13 ILE 27 2HG1 ILE 27 6.008 3.393 -2.094 61 HG21 ILE 27 1HG2 ILE 27 6.026 0.508 -4.435 62 HG22 ILE 27 2HG2 ILE 27 5.014 1.678 -5.281 63 HG23 ILE 27 3HG2 ILE 27 4.274 0.301 -4.466 64 HD11 ILE 27 1HD1 ILE 27 7.540 1.496 -2.139 65 HD12 ILE 27 2HD1 ILE 27 8.253 2.924 -2.894 66 HD13 ILE 27 3HD1 ILE 27 7.632 1.611 -3.897 67 H LEU 28 H LEU 28 3.095 5.080 -2.664 68 HA LEU 28 HA LEU 28 3.248 5.756 -5.524 69 HB2 LEU 28 1HB LEU 28 1.377 6.454 -3.784 70 HB3 LEU 28 2HB LEU 28 2.525 7.716 -3.386 71 HG LEU 28 HG LEU 28 2.496 8.402 -5.797 72 HD11 LEU 28 1HD1 LEU 28 1.761 6.472 -6.916 73 HD12 LEU 28 2HD1 LEU 28 0.414 7.609 -7.025 74 HD13 LEU 28 3HD1 LEU 28 0.367 6.291 -5.857 75 HD21 LEU 28 1HD2 LEU 28 0.351 9.537 -5.644 76 HD22 LEU 28 2HD2 LEU 28 1.181 9.564 -4.089 77 HD23 LEU 28 3HD2 LEU 28 -0.151 8.441 -4.359 78 H SER 29 H SER 29 5.541 5.390 -5.407 79 HA SER 29 HA SER 29 6.902 7.920 -5.059 80 HB2 SER 29 1HB SER 29 7.314 6.585 -2.924 81 HB3 SER 29 2HB SER 29 8.113 5.380 -3.931 82 HG SER 29 HG SER 29 8.852 8.111 -3.631 83 H ASN 30 H ASN 30 8.488 8.159 -6.761 84 HA ASN 30 HA ASN 30 9.137 5.587 -8.049 85 HB2 ASN 30 1HB ASN 30 8.995 8.310 -9.355 86 HB3 ASN 30 2HB ASN 30 9.589 6.852 -10.142 87 HD21 ASN 30 1HD2 ASN 30 8.131 5.235 -10.726 88 HD22 ASN 30 2HD2 ASN 30 6.427 5.523 -10.792 89 H ASP 31 H ASP 31 10.766 5.417 -6.452 90 HA ASP 31 HA ASP 31 13.222 6.644 -7.489 91 HB2 ASP 31 1HB ASP 31 12.963 7.253 -5.153 92 HB3 ASP 31 2HB ASP 31 12.696 5.574 -4.713 93 H LYS 32 H LYS 32 14.638 5.264 -8.402 94 HA LYS 32 HA LYS 32 13.776 2.690 -9.107 95 HB2 LYS 32 1HB LYS 32 16.478 3.979 -9.318 96 HB3 LYS 32 2HB LYS 32 16.084 2.409 -10.010 97 HG2 LYS 32 1HG LYS 32 14.130 3.680 -11.142 98 HG3 LYS 32 2HG LYS 32 15.093 5.114 -10.783 99 HD2 LYS 32 1HD LYS 32 16.959 4.223 -12.016 100 HD3 LYS 32 2HD LYS 32 16.096 2.702 -12.255 101 HE2 LYS 32 1HE LYS 32 16.031 4.117 -14.261 102 HE3 LYS 32 2HE LYS 32 14.424 3.826 -13.603 103 HZ1 LYS 32 1HZ LYS 32 16.030 6.287 -13.180 104 HZ2 LYS 32 2HZ LYS 32 14.465 6.012 -12.600 105 HZ3 LYS 32 3HZ LYS 32 14.740 6.133 -14.263 106 H LYS 33 H LYS 33 15.725 3.760 -6.415 107 HA LYS 33 HA LYS 33 16.740 1.097 -5.876 108 HB2 LYS 33 1HB LYS 33 18.166 3.038 -5.452 109 HB3 LYS 33 2HB LYS 33 16.984 3.680 -4.323 110 HG2 LYS 33 1HG LYS 33 17.386 1.899 -2.784 111 HG3 LYS 33 2HG LYS 33 18.407 1.059 -3.950 112 HD2 LYS 33 1HD LYS 33 19.817 2.142 -2.331 113 HD3 LYS 33 2HD LYS 33 19.988 2.971 -3.876 114 HE2 LYS 33 1HE LYS 33 18.037 3.965 -1.833 115 HE3 LYS 33 2HE LYS 33 19.748 4.351 -1.685 116 HZ1 LYS 33 1HZ LYS 33 18.022 4.998 -4.015 117 HZ2 LYS 33 2HZ LYS 33 19.667 5.359 -3.886 118 HZ3 LYS 33 3HZ LYS 33 18.559 6.091 -2.845 119 H LEU 34 H LEU 34 14.560 3.426 -4.350 120 HA LEU 34 HA LEU 34 13.737 1.921 -2.149 121 HB2 LEU 34 1HB LEU 34 13.178 4.196 -2.184 122 HB3 LEU 34 2HB LEU 34 12.468 4.084 -3.777 123 HG LEU 34 HG LEU 34 10.592 2.759 -2.771 124 HD11 LEU 34 1HD1 LEU 34 10.233 2.965 -0.365 125 HD12 LEU 34 2HD1 LEU 34 11.848 3.655 -0.194 126 HD13 LEU 34 3HD1 LEU 34 11.653 1.990 -0.749 127 HD21 LEU 34 1HD2 LEU 34 10.351 5.109 -3.299 128 HD22 LEU 34 2HD2 LEU 34 11.048 5.548 -1.738 129 HD23 LEU 34 3HD2 LEU 34 9.491 4.721 -1.809 130 H ILE 35 H ILE 35 12.267 2.137 -5.389 131 HA ILE 35 HA ILE 35 10.052 0.519 -4.841 132 HB ILE 35 HB ILE 35 11.446 1.108 -7.448 133 HG12 ILE 35 1HG1 ILE 35 8.855 2.095 -6.234 134 HG13 ILE 35 2HG1 ILE 35 10.359 3.005 -6.322 135 HG21 ILE 35 1HG2 ILE 35 8.820 -0.321 -7.034 136 HG22 ILE 35 2HG2 ILE 35 10.304 -1.036 -7.662 137 HG23 ILE 35 3HG2 ILE 35 9.469 0.213 -8.585 138 HD11 ILE 35 1HD1 ILE 35 8.807 2.033 -8.709 139 HD12 ILE 35 2HD1 ILE 35 10.225 3.084 -8.718 140 HD13 ILE 35 3HD1 ILE 35 8.706 3.655 -8.029 141 H GLU 36 H GLU 36 13.289 -0.345 -6.030 142 HA GLU 36 HA GLU 36 12.799 -3.049 -6.525 143 HB2 GLU 36 1HB GLU 36 15.302 -1.655 -5.596 144 HB3 GLU 36 2HB GLU 36 15.256 -3.362 -6.002 145 HG2 GLU 36 1HG GLU 36 14.702 -1.049 -7.830 146 HG3 GLU 36 2HG GLU 36 16.088 -2.136 -7.875 147 H GLU 37 H GLU 37 14.090 -1.568 -3.536 148 HA GLU 37 HA GLU 37 14.203 -3.985 -2.099 149 HB2 GLU 37 1HB GLU 37 13.950 -1.168 -1.034 150 HB3 GLU 37 2HB GLU 37 14.410 -2.577 -0.087 151 HG2 GLU 37 1HG GLU 37 15.941 -1.273 -2.315 152 HG3 GLU 37 2HG GLU 37 16.393 -1.399 -0.616 153 H ALA 38 H ALA 38 11.697 -1.511 -2.342 154 HA ALA 38 HA ALA 38 9.962 -2.586 -0.395 155 HB1 ALA 38 1HB ALA 38 9.268 -0.945 -2.833 156 HB2 ALA 38 2HB ALA 38 9.741 -0.304 -1.261 157 HB3 ALA 38 3HB ALA 38 8.235 -1.206 -1.429 158 H ARG 39 H ARG 39 10.193 -3.097 -3.916 159 HA ARG 39 HA ARG 39 7.959 -4.827 -4.013 160 HB2 ARG 39 1HB ARG 39 8.678 -3.828 -6.076 161 HB3 ARG 39 2HB ARG 39 10.272 -4.565 -5.931 162 HG2 ARG 39 1HG ARG 39 9.511 -6.663 -6.488 163 HG3 ARG 39 2HG ARG 39 7.852 -6.325 -5.985 164 HD2 ARG 39 1HD ARG 39 7.735 -4.722 -7.936 165 HD3 ARG 39 2HD ARG 39 9.274 -5.393 -8.473 166 HE ARG 39 HE ARG 39 8.086 -7.604 -8.498 167 HH11 ARG 39 1HH1 ARG 39 6.362 -4.580 -8.955 168 HH12 ARG 39 2HH1 ARG 39 5.014 -5.324 -9.753 169 HH21 ARG 39 1HH2 ARG 39 6.324 -8.566 -9.596 170 HH22 ARG 39 2HH2 ARG 39 5.003 -7.581 -10.137 171 H LYS 40 H LYS 40 11.458 -5.489 -3.844 172 HA LYS 40 HA LYS 40 11.417 -8.237 -3.999 173 HB2 LYS 40 1HB LYS 40 13.113 -6.504 -2.195 174 HB3 LYS 40 2HB LYS 40 13.431 -8.201 -2.522 175 HG2 LYS 40 1HG LYS 40 13.860 -7.739 -4.831 176 HG3 LYS 40 2HG LYS 40 13.346 -6.060 -4.639 177 HD2 LYS 40 1HD LYS 40 15.197 -5.715 -3.042 178 HD3 LYS 40 2HD LYS 40 15.730 -7.370 -3.335 179 HE2 LYS 40 1HE LYS 40 16.201 -6.881 -5.629 180 HE3 LYS 40 2HE LYS 40 15.466 -5.284 -5.490 181 HZ1 LYS 40 1HZ LYS 40 17.911 -6.193 -4.073 182 HZ2 LYS 40 2HZ LYS 40 17.205 -4.661 -3.925 183 HZ3 LYS 40 3HZ LYS 40 17.870 -5.152 -5.403 184 H MET 41 H MET 41 10.912 -6.242 -1.126 185 HA MET 41 HA MET 41 10.763 -8.307 0.746 186 HB2 MET 41 1HB MET 41 11.099 -5.828 1.105 187 HB3 MET 41 2HB MET 41 9.369 -5.636 0.871 188 HG2 MET 41 1HG MET 41 9.867 -5.658 3.185 189 HG3 MET 41 2HG MET 41 8.973 -7.123 2.781 190 HE1 MET 41 1HE MET 41 9.661 -8.206 5.075 191 HE2 MET 41 2HE MET 41 10.588 -6.776 5.528 192 HE3 MET 41 3HE MET 41 11.324 -8.374 5.638 193 H ALA 42 H ALA 42 8.212 -6.694 -1.126 194 HA ALA 42 HA ALA 42 6.120 -8.234 0.184 195 HB1 ALA 42 1HB ALA 42 4.598 -6.959 -1.225 196 HB2 ALA 42 2HB ALA 42 5.963 -6.275 -2.104 197 HB3 ALA 42 3HB ALA 42 5.733 -5.896 -0.398 198 H GLU 43 H GLU 43 7.932 -8.282 -2.782 199 HA GLU 43 HA GLU 43 6.224 -9.835 -4.373 200 HB2 GLU 43 1HB GLU 43 8.189 -8.554 -5.201 201 HB3 GLU 43 2HB GLU 43 9.245 -9.740 -4.450 202 HG2 GLU 43 1HG GLU 43 8.479 -11.456 -5.926 203 HG3 GLU 43 2HG GLU 43 7.224 -10.401 -6.578 204 H LYS 44 H LYS 44 8.881 -10.712 -2.196 205 HA LYS 44 HA LYS 44 8.414 -13.536 -2.592 206 HB2 LYS 44 1HB LYS 44 10.373 -11.935 -0.990 207 HB3 LYS 44 2HB LYS 44 10.117 -13.636 -0.601 208 HG2 LYS 44 1HG LYS 44 11.901 -13.711 -2.065 209 HG3 LYS 44 2HG LYS 44 10.525 -14.048 -3.113 210 HD2 LYS 44 1HD LYS 44 11.758 -12.496 -4.326 211 HD3 LYS 44 2HD LYS 44 10.519 -11.508 -3.550 212 HE2 LYS 44 1HE LYS 44 12.693 -10.438 -3.378 213 HE3 LYS 44 2HE LYS 44 12.107 -10.911 -1.785 214 HZ1 LYS 44 1HZ LYS 44 13.543 -12.832 -1.841 215 HZ2 LYS 44 2HZ LYS 44 14.457 -11.434 -2.107 216 HZ3 LYS 44 3HZ LYS 44 14.064 -12.446 -3.404 217 H ALA 45 H ALA 45 7.063 -11.135 -0.669 218 HA ALA 45 HA ALA 45 6.331 -12.930 1.494 219 HB1 ALA 45 1HB ALA 45 5.166 -10.981 2.440 220 HB2 ALA 45 2HB ALA 45 5.596 -10.051 1.004 221 HB3 ALA 45 3HB ALA 45 6.859 -10.642 2.082 222 H ASN 46 H ASN 46 5.371 -12.581 -1.548 223 HA ASN 46 HA ASN 46 3.557 -13.121 -2.777 224 HB2 ASN 46 1HB ASN 46 3.690 -15.173 -1.325 225 HB3 ASN 46 2HB ASN 46 2.487 -14.436 -0.272 226 HD21 ASN 46 1HD2 ASN 46 1.004 -16.082 -0.655 227 HD22 ASN 46 2HD2 ASN 46 0.164 -16.234 -2.160 228 H LEU 47 H LEU 47 3.573 -10.578 -1.649 229 HA LEU 47 HA LEU 47 0.788 -10.085 -0.888 230 HB2 LEU 47 1HB LEU 47 3.003 -8.069 -1.201 231 HB3 LEU 47 2HB LEU 47 1.452 -7.822 -0.438 232 HG LEU 47 HG LEU 47 3.790 -9.391 0.606 233 HD11 LEU 47 1HD1 LEU 47 3.827 -6.982 0.939 234 HD12 LEU 47 2HD1 LEU 47 3.594 -7.829 2.469 235 HD13 LEU 47 3HD1 LEU 47 2.225 -7.052 1.672 236 HD21 LEU 47 1HD2 LEU 47 2.417 -9.995 2.516 237 HD22 LEU 47 2HD2 LEU 47 1.762 -10.683 1.031 238 HD23 LEU 47 3HD2 LEU 47 1.008 -9.261 1.753 239 H ILE 48 H ILE 48 -0.469 -8.515 -2.058 240 HA ILE 48 HA ILE 48 0.148 -8.540 -4.895 241 HB ILE 48 HB ILE 48 -2.322 -7.505 -3.490 242 HG12 ILE 48 1HG1 ILE 48 -1.801 -10.105 -4.953 243 HG13 ILE 48 2HG1 ILE 48 -2.042 -9.926 -3.220 244 HG21 ILE 48 1HG2 ILE 48 -3.339 -7.513 -5.719 245 HG22 ILE 48 2HG2 ILE 48 -1.800 -8.012 -6.421 246 HG23 ILE 48 3HG2 ILE 48 -1.948 -6.431 -5.654 247 HD11 ILE 48 1HD1 ILE 48 -4.331 -9.169 -3.632 248 HD12 ILE 48 2HD1 ILE 48 -4.033 -10.780 -4.285 249 HD13 ILE 48 3HD1 ILE 48 -4.080 -9.385 -5.364 250 H LEU 49 H LEU 49 1.785 -7.132 -5.133 251 HA LEU 49 HA LEU 49 1.579 -4.442 -4.052 252 HB2 LEU 49 1HB LEU 49 3.726 -5.488 -3.832 253 HB3 LEU 49 2HB LEU 49 3.762 -5.897 -5.536 254 HG LEU 49 HG LEU 49 3.872 -3.457 -6.064 255 HD11 LEU 49 1HD1 LEU 49 4.279 -3.173 -3.091 256 HD12 LEU 49 2HD1 LEU 49 2.887 -2.596 -4.005 257 HD13 LEU 49 3HD1 LEU 49 4.480 -1.899 -4.294 258 HD21 LEU 49 1HD2 LEU 49 6.222 -3.207 -5.416 259 HD22 LEU 49 2HD2 LEU 49 5.874 -4.816 -6.049 260 HD23 LEU 49 3HD2 LEU 49 6.049 -4.569 -4.311 261 H ILE 50 H ILE 50 0.901 -2.763 -5.174 262 HA ILE 50 HA ILE 50 0.942 -2.939 -8.117 263 HB ILE 50 HB ILE 50 -1.031 -1.289 -6.532 264 HG12 ILE 50 1HG1 ILE 50 -1.558 -3.983 -7.810 265 HG13 ILE 50 2HG1 ILE 50 -1.273 -3.764 -6.087 266 HG21 ILE 50 1HG2 ILE 50 -0.618 -0.573 -8.826 267 HG22 ILE 50 2HG2 ILE 50 -2.245 -1.235 -8.665 268 HG23 ILE 50 3HG2 ILE 50 -0.970 -2.199 -9.410 269 HD11 ILE 50 1HD1 ILE 50 -3.650 -3.950 -6.630 270 HD12 ILE 50 2HD1 ILE 50 -3.522 -2.516 -7.647 271 HD13 ILE 50 3HD1 ILE 50 -3.255 -2.392 -5.909 272 H THR 51 H THR 51 2.789 -1.844 -8.532 273 HA THR 51 HA THR 51 3.548 0.490 -7.031 274 HB THR 51 HB THR 51 4.803 -0.567 -9.571 275 HG1 THR 51 HG1 THR 51 6.080 -1.849 -8.230 276 HG21 THR 51 1HG2 THR 51 5.537 1.670 -8.912 277 HG22 THR 51 2HG2 THR 51 6.832 0.495 -8.676 278 HG23 THR 51 3HG2 THR 51 5.909 1.081 -7.292 279 H VAL 52 H VAL 52 2.855 2.485 -7.448 280 HA VAL 52 HA VAL 52 2.156 3.211 -10.204 281 HB VAL 52 HB VAL 52 0.236 4.576 -9.180 282 HG11 VAL 52 1HG1 VAL 52 -0.136 2.635 -10.613 283 HG12 VAL 52 2HG1 VAL 52 -1.325 2.691 -9.310 284 HG13 VAL 52 3HG1 VAL 52 0.032 1.565 -9.220 285 HG21 VAL 52 1HG2 VAL 52 -0.748 3.607 -7.133 286 HG22 VAL 52 2HG2 VAL 52 0.826 4.351 -6.846 287 HG23 VAL 52 3HG2 VAL 52 0.685 2.595 -6.950 288 H GLY 53 H GLY 53 2.719 5.290 -10.775 289 HA2 GLY 53 1HA GLY 53 3.713 6.998 -8.585 290 HA3 GLY 53 2HA GLY 53 4.626 6.805 -10.073 291 H ASP 54 H ASP 54 1.987 8.278 -8.516 292 HA ASP 54 HA ASP 54 1.765 10.648 -9.620 293 HB2 ASP 54 1HB ASP 54 1.556 9.536 -11.896 294 HB3 ASP 54 2HB ASP 54 -0.005 8.918 -11.368 295 H GLU 55 H GLU 55 -0.146 11.747 -8.861 296 HA GLU 55 HA GLU 55 -1.344 10.647 -6.623 297 HB2 GLU 55 1HB GLU 55 -1.450 13.084 -8.040 298 HB3 GLU 55 2HB GLU 55 -3.115 12.566 -7.815 299 HG2 GLU 55 1HG GLU 55 -1.091 12.773 -5.605 300 HG3 GLU 55 2HG GLU 55 -2.239 14.045 -6.022 301 H GLU 56 H GLU 56 -2.671 10.915 -9.897 302 HA GLU 56 HA GLU 56 -5.216 9.856 -9.234 303 HB2 GLU 56 1HB GLU 56 -3.924 9.858 -11.957 304 HB3 GLU 56 2HB GLU 56 -5.642 9.863 -11.587 305 HG2 GLU 56 1HG GLU 56 -3.717 12.100 -10.997 306 HG3 GLU 56 2HG GLU 56 -4.849 12.047 -12.346 307 H GLU 57 H GLU 57 -2.208 8.457 -10.329 308 HA GLU 57 HA GLU 57 -3.175 5.930 -11.078 309 HB2 GLU 57 1HB GLU 57 -0.466 6.911 -10.234 310 HB3 GLU 57 2HB GLU 57 -0.758 5.226 -10.646 311 HG2 GLU 57 1HG GLU 57 -1.362 7.525 -12.480 312 HG3 GLU 57 2HG GLU 57 0.145 6.609 -12.504 313 H LEU 58 H LEU 58 -2.279 7.247 -7.935 314 HA LEU 58 HA LEU 58 -2.236 4.786 -6.549 315 HB2 LEU 58 1HB LEU 58 -1.452 6.965 -5.593 316 HB3 LEU 58 2HB LEU 58 -3.129 7.449 -5.441 317 HG LEU 58 HG LEU 58 -3.503 5.490 -3.930 318 HD11 LEU 58 1HD1 LEU 58 -0.498 5.274 -3.943 319 HD12 LEU 58 2HD1 LEU 58 -1.586 4.154 -4.757 320 HD13 LEU 58 3HD1 LEU 58 -1.632 4.304 -3.001 321 HD21 LEU 58 1HD2 LEU 58 -1.388 7.452 -3.059 322 HD22 LEU 58 2HD2 LEU 58 -2.390 6.473 -1.988 323 HD23 LEU 58 3HD2 LEU 58 -3.131 7.707 -3.007 324 H LYS 59 H LYS 59 -4.813 7.003 -7.424 325 HA LYS 59 HA LYS 59 -6.913 5.791 -6.030 326 HB2 LYS 59 1HB LYS 59 -7.034 7.236 -8.673 327 HB3 LYS 59 2HB LYS 59 -8.401 6.926 -7.612 328 HG2 LYS 59 1HG LYS 59 -7.485 8.370 -5.921 329 HG3 LYS 59 2HG LYS 59 -6.008 8.591 -6.859 330 HD2 LYS 59 1HD LYS 59 -7.394 10.528 -7.152 331 HD3 LYS 59 2HD LYS 59 -7.378 9.620 -8.664 332 HE2 LYS 59 1HE LYS 59 -9.623 10.378 -8.184 333 HE3 LYS 59 2HE LYS 59 -9.546 8.622 -8.059 334 HZ1 LYS 59 1HZ LYS 59 -9.431 10.493 -5.756 335 HZ2 LYS 59 2HZ LYS 59 -9.459 8.804 -5.674 336 HZ3 LYS 59 3HZ LYS 59 -10.808 9.643 -6.247 337 H LYS 60 H LYS 60 -5.320 4.982 -8.946 338 HA LYS 60 HA LYS 60 -7.311 3.190 -9.951 339 HB2 LYS 60 1HB LYS 60 -4.392 3.357 -10.690 340 HB3 LYS 60 2HB LYS 60 -5.722 2.771 -11.686 341 HG2 LYS 60 1HG LYS 60 -5.845 5.553 -10.650 342 HG3 LYS 60 2HG LYS 60 -4.738 5.193 -11.994 343 HD2 LYS 60 1HD LYS 60 -7.663 4.465 -12.003 344 HD3 LYS 60 2HD LYS 60 -7.028 5.968 -12.676 345 HE2 LYS 60 1HE LYS 60 -6.196 3.199 -13.522 346 HE3 LYS 60 2HE LYS 60 -7.348 4.215 -14.387 347 HZ1 LYS 60 1HZ LYS 60 -5.130 4.330 -15.350 348 HZ2 LYS 60 2HZ LYS 60 -4.492 4.888 -13.885 349 HZ3 LYS 60 3HZ LYS 60 -5.600 5.836 -14.743 350 H ALA 61 H ALA 61 -4.175 2.859 -8.339 351 HA ALA 61 HA ALA 61 -4.154 0.041 -8.214 352 HB1 ALA 61 1HB ALA 61 -2.823 2.050 -6.396 353 HB2 ALA 61 2HB ALA 61 -2.146 1.391 -7.885 354 HB3 ALA 61 3HB ALA 61 -2.427 0.336 -6.502 355 H ILE 62 H ILE 62 -5.303 2.541 -6.019 356 HA ILE 62 HA ILE 62 -6.127 0.951 -3.881 357 HB ILE 62 HB ILE 62 -7.165 3.575 -4.942 358 HG12 ILE 62 1HG1 ILE 62 -5.613 2.901 -2.437 359 HG13 ILE 62 2HG1 ILE 62 -4.884 3.470 -3.934 360 HG21 ILE 62 1HG2 ILE 62 -7.993 2.224 -2.379 361 HG22 ILE 62 2HG2 ILE 62 -9.014 2.455 -3.799 362 HG23 ILE 62 3HG2 ILE 62 -8.440 3.853 -2.889 363 HD11 ILE 62 1HD1 ILE 62 -6.116 5.562 -3.740 364 HD12 ILE 62 2HD1 ILE 62 -5.120 5.263 -2.316 365 HD13 ILE 62 3HD1 ILE 62 -6.861 4.987 -2.247 366 H LYS 63 H LYS 63 -7.940 1.953 -6.781 367 HA LYS 63 HA LYS 63 -10.302 0.557 -6.019 368 HB2 LYS 63 1HB LYS 63 -10.417 2.475 -7.500 369 HB3 LYS 63 2HB LYS 63 -9.426 1.655 -8.693 370 HG2 LYS 63 1HG LYS 63 -11.840 1.715 -9.247 371 HG3 LYS 63 2HG LYS 63 -11.164 0.090 -9.169 372 HD2 LYS 63 1HD LYS 63 -13.369 0.205 -8.108 373 HD3 LYS 63 2HD LYS 63 -12.112 -0.222 -6.951 374 HE2 LYS 63 1HE LYS 63 -12.067 2.081 -6.143 375 HE3 LYS 63 2HE LYS 63 -13.300 2.525 -7.321 376 HZ1 LYS 63 1HZ LYS 63 -13.700 0.470 -5.214 377 HZ2 LYS 63 2HZ LYS 63 -14.874 1.130 -6.237 378 HZ3 LYS 63 3HZ LYS 63 -14.159 2.093 -5.045 379 H LYS 64 H LYS 64 -7.482 -0.272 -7.948 380 HA LYS 64 HA LYS 64 -8.463 -2.690 -9.012 381 HB2 LYS 64 1HB LYS 64 -6.393 -1.594 -9.798 382 HB3 LYS 64 2HB LYS 64 -5.616 -1.987 -8.271 383 HG2 LYS 64 1HG LYS 64 -5.852 -4.366 -8.747 384 HG3 LYS 64 2HG LYS 64 -6.662 -3.987 -10.266 385 HD2 LYS 64 1HD LYS 64 -3.834 -3.226 -9.542 386 HD3 LYS 64 2HD LYS 64 -4.301 -4.548 -10.610 387 HE2 LYS 64 1HE LYS 64 -4.899 -1.629 -11.071 388 HE3 LYS 64 2HE LYS 64 -3.614 -2.544 -11.852 389 HZ1 LYS 64 1HZ LYS 64 -6.484 -3.258 -12.066 390 HZ2 LYS 64 2HZ LYS 64 -5.197 -3.886 -12.964 391 HZ3 LYS 64 3HZ LYS 64 -5.679 -2.284 -13.189 392 H ALA 65 H ALA 65 -6.683 -1.969 -6.026 393 HA ALA 65 HA ALA 65 -6.639 -4.589 -5.002 394 HB1 ALA 65 1HB ALA 65 -6.715 -1.981 -3.483 395 HB2 ALA 65 2HB ALA 65 -5.264 -2.770 -4.101 396 HB3 ALA 65 3HB ALA 65 -6.218 -3.546 -2.838 397 H ASP 66 H ASP 66 -8.951 -1.952 -4.657 398 HA ASP 66 HA ASP 66 -10.810 -3.079 -2.937 399 HB2 ASP 66 1HB ASP 66 -10.887 -0.749 -3.694 400 HB3 ASP 66 2HB ASP 66 -11.273 -1.275 -5.324 401 H ASP 67 H ASP 67 -10.439 -3.480 -6.423 402 HA ASP 67 HA ASP 67 -12.807 -5.036 -6.767 403 HB2 ASP 67 1HB ASP 67 -11.899 -3.788 -8.637 404 HB3 ASP 67 2HB ASP 67 -10.385 -4.683 -8.542 405 H ILE 68 H ILE 68 -9.345 -5.867 -6.627 406 HA ILE 68 HA ILE 68 -9.673 -8.630 -7.043 407 HB ILE 68 HB ILE 68 -7.466 -7.222 -5.532 408 HG12 ILE 68 1HG1 ILE 68 -7.574 -8.104 -8.423 409 HG13 ILE 68 2HG1 ILE 68 -7.795 -6.444 -7.875 410 HG21 ILE 68 1HG2 ILE 68 -7.564 -9.984 -6.739 411 HG22 ILE 68 2HG2 ILE 68 -7.487 -9.589 -5.021 412 HG23 ILE 68 3HG2 ILE 68 -6.122 -9.217 -6.075 413 HD11 ILE 68 1HD1 ILE 68 -5.546 -6.821 -8.714 414 HD12 ILE 68 2HD1 ILE 68 -5.304 -8.098 -7.522 415 HD13 ILE 68 3HD1 ILE 68 -5.525 -6.429 -6.995 416 H ALA 69 H ALA 69 -9.656 -6.689 -4.095 417 HA ALA 69 HA ALA 69 -9.624 -8.764 -2.217 418 HB1 ALA 69 1HB ALA 69 -10.970 -6.074 -1.996 419 HB2 ALA 69 2HB ALA 69 -9.281 -6.420 -1.618 420 HB3 ALA 69 3HB ALA 69 -10.569 -7.147 -0.655 421 H LYS 70 H LYS 70 -12.428 -6.960 -3.466 422 HA LYS 70 HA LYS 70 -14.367 -8.554 -2.168 423 HB2 LYS 70 1HB LYS 70 -14.600 -6.899 -4.672 424 HB3 LYS 70 2HB LYS 70 -15.957 -7.496 -3.727 425 HG2 LYS 70 1HG LYS 70 -15.394 -6.096 -1.887 426 HG3 LYS 70 2HG LYS 70 -13.859 -5.639 -2.633 427 HD2 LYS 70 1HD LYS 70 -15.059 -4.528 -4.442 428 HD3 LYS 70 2HD LYS 70 -16.600 -5.008 -3.726 429 HE2 LYS 70 1HE LYS 70 -16.191 -3.657 -1.794 430 HE3 LYS 70 2HE LYS 70 -14.547 -3.308 -2.328 431 HZ1 LYS 70 1HZ LYS 70 -16.959 -2.518 -3.855 432 HZ2 LYS 70 2HZ LYS 70 -15.360 -2.018 -4.117 433 HZ3 LYS 70 3HZ LYS 70 -16.193 -1.510 -2.735 434 H LYS 71 H LYS 71 -12.782 -8.809 -5.265 435 HA LYS 71 HA LYS 71 -14.361 -10.629 -6.570 436 HB2 LYS 71 1HB LYS 71 -12.405 -9.715 -7.628 437 HB3 LYS 71 2HB LYS 71 -11.349 -10.449 -6.430 438 HG2 LYS 71 1HG LYS 71 -11.884 -12.654 -7.261 439 HG3 LYS 71 2HG LYS 71 -13.034 -11.966 -8.407 440 HD2 LYS 71 1HD LYS 71 -11.284 -10.873 -9.615 441 HD3 LYS 71 2HD LYS 71 -10.095 -11.300 -8.383 442 HE2 LYS 71 1HE LYS 71 -10.012 -12.717 -10.439 443 HE3 LYS 71 2HE LYS 71 -10.242 -13.616 -8.941 444 HZ1 LYS 71 1HZ LYS 71 -12.377 -12.892 -10.873 445 HZ2 LYS 71 2HZ LYS 71 -12.608 -13.746 -9.431 446 HZ3 LYS 71 3HZ LYS 71 -11.695 -14.427 -10.680 447 H GLN 72 H GLN 72 -12.006 -11.238 -3.985 448 HA GLN 72 HA GLN 72 -13.093 -13.974 -3.868 449 HB2 GLN 72 1HB GLN 72 -10.814 -14.760 -3.189 450 HB3 GLN 72 2HB GLN 72 -10.954 -14.213 -4.852 451 HG2 GLN 72 1HG GLN 72 -9.879 -12.132 -4.312 452 HG3 GLN 72 2HG GLN 72 -9.861 -12.544 -2.599 453 HE21 GLN 72 1HE2 GLN 72 -8.432 -13.131 -5.704 454 HE22 GLN 72 2HE2 GLN 72 -7.060 -14.011 -5.131 455 H ASN 73 H ASN 73 -11.370 -11.524 -1.862 456 HA ASN 73 HA ASN 73 -12.025 -13.258 0.409 457 HB2 ASN 73 1HB ASN 73 -9.565 -13.032 -0.539 458 HB3 ASN 73 2HB ASN 73 -9.551 -11.633 0.529 459 HD21 ASN 73 1HD2 ASN 73 -9.760 -15.087 0.326 460 HD22 ASN 73 2HD2 ASN 73 -9.485 -15.405 2.003 461 H SER 74 H SER 74 -13.290 -10.618 -0.508 462 HA SER 74 HA SER 74 -12.470 -8.555 1.182 463 HB2 SER 74 1HB SER 74 -14.851 -7.675 0.679 464 HB3 SER 74 2HB SER 74 -13.690 -7.869 -0.635 465 HG SER 74 HG SER 74 -15.959 -9.399 -0.000 466 H SER 75 H SER 75 -13.601 -11.298 2.476 467 HA SER 75 HA SER 75 -15.353 -10.415 4.495 468 HB2 SER 75 1HB SER 75 -13.131 -12.446 4.836 469 HB3 SER 75 2HB SER 75 -14.640 -12.348 5.745 470 HG SER 75 HG SER 75 -14.135 -13.617 3.429 471 H GLU 76 H GLU 76 -11.878 -10.309 4.084 472 HA GLU 76 HA GLU 76 -11.719 -7.943 5.704 473 HB2 GLU 76 1HB GLU 76 -11.430 -9.644 7.449 474 HB3 GLU 76 2HB GLU 76 -10.149 -10.403 6.513 475 HG2 GLU 76 1HG GLU 76 -8.778 -8.401 6.739 476 HG3 GLU 76 2HG GLU 76 -10.064 -7.614 7.650 477 H ALA 77 H ALA 77 -10.697 -6.675 4.320 478 HA ALA 77 HA ALA 77 -8.404 -7.783 2.843 479 HB1 ALA 77 1HB ALA 77 -10.133 -5.418 2.119 480 HB2 ALA 77 2HB ALA 77 -10.237 -7.025 1.401 481 HB3 ALA 77 3HB ALA 77 -8.784 -6.050 1.174 482 H LYS 78 H LYS 78 -6.448 -6.984 3.303 483 HA LYS 78 HA LYS 78 -6.355 -4.493 4.869 484 HB2 LYS 78 1HB LYS 78 -4.409 -6.796 5.098 485 HB3 LYS 78 2HB LYS 78 -4.485 -5.363 6.116 486 HG2 LYS 78 1HG LYS 78 -6.758 -6.092 6.843 487 HG3 LYS 78 2HG LYS 78 -6.496 -7.594 5.958 488 HD2 LYS 78 1HD LYS 78 -5.971 -8.009 8.241 489 HD3 LYS 78 2HD LYS 78 -4.446 -7.950 7.357 490 HE2 LYS 78 1HE LYS 78 -3.957 -5.777 8.170 491 HE3 LYS 78 2HE LYS 78 -5.592 -5.568 8.796 492 HZ1 LYS 78 1HZ LYS 78 -3.549 -7.474 9.818 493 HZ2 LYS 78 2HZ LYS 78 -5.140 -7.348 10.390 494 HZ3 LYS 78 3HZ LYS 78 -4.073 -6.053 10.581 495 H ILE 79 H ILE 79 -5.306 -2.900 3.942 496 HA ILE 79 HA ILE 79 -3.434 -3.539 1.760 497 HB ILE 79 HB ILE 79 -5.201 -1.089 1.944 498 HG12 ILE 79 1HG1 ILE 79 -5.517 -3.543 0.198 499 HG13 ILE 79 2HG1 ILE 79 -6.545 -3.115 1.565 500 HG21 ILE 79 1HG2 ILE 79 -3.136 -0.707 0.719 501 HG22 ILE 79 2HG2 ILE 79 -4.512 -0.715 -0.384 502 HG23 ILE 79 3HG2 ILE 79 -3.451 -2.119 -0.288 503 HD11 ILE 79 1HD1 ILE 79 -7.257 -1.097 0.388 504 HD12 ILE 79 2HD1 ILE 79 -7.607 -2.556 -0.540 505 HD13 ILE 79 3HD1 ILE 79 -6.235 -1.538 -0.980 506 H LEU 80 H LEU 80 -1.491 -2.535 1.775 507 HA LEU 80 HA LEU 80 -1.010 -0.489 3.848 508 HB2 LEU 80 1HB LEU 80 0.283 -2.805 3.652 509 HB3 LEU 80 2HB LEU 80 1.200 -1.928 2.438 510 HG LEU 80 HG LEU 80 0.967 -1.277 5.373 511 HD11 LEU 80 1HD1 LEU 80 2.504 -3.081 4.812 512 HD12 LEU 80 2HD1 LEU 80 3.372 -1.653 5.369 513 HD13 LEU 80 3HD1 LEU 80 3.317 -2.035 3.649 514 HD21 LEU 80 1HD2 LEU 80 0.938 0.804 4.124 515 HD22 LEU 80 2HD2 LEU 80 2.353 0.288 3.204 516 HD23 LEU 80 3HD2 LEU 80 2.488 0.588 4.937 517 H ILE 81 H ILE 81 -0.979 1.532 2.979 518 HA ILE 81 HA ILE 81 -0.089 1.794 0.188 519 HB ILE 81 HB ILE 81 -1.823 3.597 1.871 520 HG12 ILE 81 1HG1 ILE 81 -2.266 2.313 -0.830 521 HG13 ILE 81 2HG1 ILE 81 -2.879 1.676 0.693 522 HG21 ILE 81 1HG2 ILE 81 -0.240 5.016 0.682 523 HG22 ILE 81 2HG2 ILE 81 -1.854 5.172 -0.011 524 HG23 ILE 81 3HG2 ILE 81 -0.630 4.204 -0.835 525 HD11 ILE 81 1HD1 ILE 81 -4.193 3.739 0.979 526 HD12 ILE 81 2HD1 ILE 81 -4.619 2.852 -0.485 527 HD13 ILE 81 3HD1 ILE 81 -3.615 4.297 -0.592 528 H LEU 82 H LEU 82 2.037 2.061 0.180 529 HA LEU 82 HA LEU 82 3.321 3.925 2.007 530 HB2 LEU 82 1HB LEU 82 4.482 2.443 -0.359 531 HB3 LEU 82 2HB LEU 82 5.385 3.288 0.880 532 HG LEU 82 HG LEU 82 3.728 0.801 1.313 533 HD11 LEU 82 1HD1 LEU 82 5.880 -0.297 1.654 534 HD12 LEU 82 2HD1 LEU 82 6.710 1.201 1.234 535 HD13 LEU 82 3HD1 LEU 82 5.743 0.359 0.022 536 HD21 LEU 82 1HD2 LEU 82 4.843 0.787 3.524 537 HD22 LEU 82 2HD2 LEU 82 3.736 2.136 3.295 538 HD23 LEU 82 3HD2 LEU 82 5.475 2.396 3.176 539 H LEU 83 H LEU 83 4.109 5.933 1.398 540 HA LEU 83 HA LEU 83 4.252 6.787 -1.319 541 HB2 LEU 83 1HB LEU 83 2.571 8.726 -0.839 542 HB3 LEU 83 2HB LEU 83 1.985 7.180 -1.422 543 HG LEU 83 HG LEU 83 1.378 6.584 0.929 544 HD11 LEU 83 1HD1 LEU 83 2.082 9.454 1.490 545 HD12 LEU 83 2HD1 LEU 83 2.931 8.036 2.099 546 HD13 LEU 83 3HD1 LEU 83 1.271 8.352 2.602 547 HD21 LEU 83 1HD2 LEU 83 0.152 9.116 -0.151 548 HD22 LEU 83 2HD2 LEU 83 -0.585 8.035 1.032 549 HD23 LEU 83 3HD2 LEU 83 -0.284 7.471 -0.612 550 H GLU 84 H GLU 84 4.954 9.103 -1.459 551 HA GLU 84 HA GLU 84 6.179 9.987 1.067 552 HB2 GLU 84 1HB GLU 84 6.587 11.090 -1.722 553 HB3 GLU 84 2HB GLU 84 7.528 11.480 -0.292 554 HG2 GLU 84 1HG GLU 84 8.481 9.300 -0.233 555 HG3 GLU 84 2HG GLU 84 7.391 8.733 -1.497 556 H LYS 85 H LYS 85 4.618 11.041 2.165 557 HA LYS 85 HA LYS 85 3.732 13.583 1.311 558 HB2 LYS 85 1HB LYS 85 2.302 12.040 -0.107 559 HB3 LYS 85 2HB LYS 85 1.570 11.471 1.384 560 HG2 LYS 85 1HG LYS 85 0.677 13.655 1.842 561 HG3 LYS 85 2HG LYS 85 1.528 14.332 0.449 562 HD2 LYS 85 1HD LYS 85 0.250 12.750 -0.999 563 HD3 LYS 85 2HD LYS 85 -0.691 12.291 0.418 564 HE2 LYS 85 1HE LYS 85 -1.540 14.521 0.646 565 HE3 LYS 85 2HE LYS 85 -0.469 15.107 -0.625 566 HZ1 LYS 85 1HZ LYS 85 -1.649 13.670 -2.196 567 HZ2 LYS 85 2HZ LYS 85 -2.686 14.796 -1.477 568 HZ3 LYS 85 3HZ LYS 85 -2.708 13.183 -0.970 569 HA PRO 86 HA PRO 86 3.067 13.573 5.799 570 HB2 PRO 86 1HB PRO 86 1.870 16.214 5.231 571 HB3 PRO 86 2HB PRO 86 3.186 15.798 6.334 572 HG2 PRO 86 1HG PRO 86 3.635 17.119 4.042 573 HG3 PRO 86 2HG PRO 86 4.794 15.940 4.683 574 HD2 PRO 86 1HD PRO 86 2.816 15.641 2.459 575 HD3 PRO 86 2HD PRO 86 4.475 15.023 2.583 576 H VAL 87 H VAL 87 1.336 12.449 6.502 577 HA VAL 87 HA VAL 87 -1.263 13.019 5.241 578 HB VAL 87 HB VAL 87 -1.803 10.580 5.632 579 HG11 VAL 87 1HG1 VAL 87 0.422 11.237 3.702 580 HG12 VAL 87 2HG1 VAL 87 -1.303 11.467 3.417 581 HG13 VAL 87 3HG1 VAL 87 -0.650 9.840 3.601 582 HG21 VAL 87 1HG2 VAL 87 0.098 9.032 5.797 583 HG22 VAL 87 2HG2 VAL 87 -0.035 10.059 7.225 584 HG23 VAL 87 3HG2 VAL 87 1.189 10.403 6.001 585 H SER 88 H SER 88 -2.850 13.564 6.542 586 HA SER 88 HA SER 88 -2.586 13.158 9.414 587 HB2 SER 88 1HB SER 88 -4.824 14.549 7.921 588 HB3 SER 88 2HB SER 88 -4.427 14.692 9.631 589 HG SER 88 HG SER 88 -2.397 15.317 7.839 590 HA PRO 89 HA PRO 89 -5.028 9.564 10.003 591 HB2 PRO 89 1HB PRO 89 -7.040 11.269 11.416 592 HB3 PRO 89 2HB PRO 89 -6.326 9.730 11.911 593 HG2 PRO 89 1HG PRO 89 -5.466 12.009 12.967 594 HG3 PRO 89 2HG PRO 89 -4.323 10.717 12.554 595 HD2 PRO 89 1HD PRO 89 -4.838 13.301 11.178 596 HD3 PRO 89 2HD PRO 89 -3.337 12.364 11.300 597 H GLU 90 H GLU 90 -7.033 12.387 9.168 598 HA GLU 90 HA GLU 90 -9.250 10.939 8.220 599 HB2 GLU 90 1HB GLU 90 -8.279 13.729 7.656 600 HB3 GLU 90 2HB GLU 90 -9.762 13.091 6.963 601 HG2 GLU 90 1HG GLU 90 -10.730 12.807 9.127 602 HG3 GLU 90 2HG GLU 90 -9.210 13.221 9.915 603 H TYR 91 H TYR 91 -6.254 11.877 6.658 604 HA TYR 91 HA TYR 91 -7.182 11.483 3.997 605 HB2 TYR 91 1HB TYR 91 -4.412 11.642 5.175 606 HB3 TYR 91 2HB TYR 91 -4.695 11.387 3.455 607 HD1 TYR 91 HD1 TYR 91 -5.254 13.743 6.248 608 HD2 TYR 91 HD2 TYR 91 -5.263 13.194 2.034 609 HE1 TYR 91 HE1 TYR 91 -5.501 16.168 5.941 610 HE2 TYR 91 HE2 TYR 91 -5.507 15.620 1.712 611 HH TYR 91 HH TYR 91 -5.022 17.863 4.186 612 H GLU 92 H GLU 92 -5.779 9.409 6.425 613 HA GLU 92 HA GLU 92 -5.401 7.148 4.762 614 HB2 GLU 92 1HB GLU 92 -4.330 7.253 6.928 615 HB3 GLU 92 2HB GLU 92 -5.882 7.410 7.735 616 HG2 GLU 92 1HG GLU 92 -6.472 5.178 7.226 617 HG3 GLU 92 2HG GLU 92 -5.098 4.987 6.141 618 H LYS 93 H LYS 93 -8.079 8.433 6.614 619 HA LYS 93 HA LYS 93 -9.798 6.204 6.207 620 HB2 LYS 93 1HB LYS 93 -10.357 9.031 7.113 621 HB3 LYS 93 2HB LYS 93 -11.559 7.749 7.083 622 HG2 LYS 93 1HG LYS 93 -10.189 6.450 8.659 623 HG3 LYS 93 2HG LYS 93 -9.033 7.783 8.720 624 HD2 LYS 93 1HD LYS 93 -10.733 9.254 9.626 625 HD3 LYS 93 2HD LYS 93 -11.946 7.981 9.480 626 HE2 LYS 93 1HE LYS 93 -11.169 8.156 11.775 627 HE3 LYS 93 2HE LYS 93 -10.693 6.611 11.078 628 HZ1 LYS 93 1HZ LYS 93 -8.929 8.983 11.345 629 HZ2 LYS 93 2HZ LYS 93 -8.474 7.475 10.730 630 HZ3 LYS 93 3HZ LYS 93 -8.905 7.631 12.357 631 H LYS 94 H LYS 94 -9.103 9.159 4.472 632 HA LYS 94 HA LYS 94 -11.280 9.141 2.691 633 HB2 LYS 94 1HB LYS 94 -8.424 10.018 2.205 634 HB3 LYS 94 2HB LYS 94 -9.773 10.365 1.135 635 HG2 LYS 94 1HG LYS 94 -10.830 11.708 2.837 636 HG3 LYS 94 2HG LYS 94 -9.568 11.283 3.995 637 HD2 LYS 94 1HD LYS 94 -9.015 13.437 3.188 638 HD3 LYS 94 2HD LYS 94 -7.919 12.319 2.379 639 HE2 LYS 94 1HE LYS 94 -8.698 13.878 0.752 640 HE3 LYS 94 2HE LYS 94 -9.471 12.327 0.425 641 HZ1 LYS 94 1HZ LYS 94 -11.026 14.179 0.267 642 HZ2 LYS 94 2HZ LYS 94 -10.725 14.594 1.877 643 HZ3 LYS 94 3HZ LYS 94 -11.466 13.121 1.509 644 H LEU 95 H LEU 95 -8.049 7.695 2.410 645 HA LEU 95 HA LEU 95 -8.591 6.400 -0.061 646 HB2 LEU 95 1HB LEU 95 -6.478 5.692 1.976 647 HB3 LEU 95 2HB LEU 95 -6.478 5.265 0.276 648 HG LEU 95 HG LEU 95 -6.180 8.046 1.419 649 HD11 LEU 95 1HD1 LEU 95 -4.234 6.276 -0.047 650 HD12 LEU 95 2HD1 LEU 95 -4.194 6.660 1.673 651 HD13 LEU 95 3HD1 LEU 95 -3.933 7.932 0.479 652 HD21 LEU 95 1HD2 LEU 95 -5.805 8.760 -0.887 653 HD22 LEU 95 2HD2 LEU 95 -7.427 8.103 -0.673 654 HD23 LEU 95 3HD2 LEU 95 -6.179 7.132 -1.455 655 H GLN 96 H GLN 96 -8.766 5.442 3.309 656 HA GLN 96 HA GLN 96 -9.389 2.715 2.918 657 HB2 GLN 96 1HB GLN 96 -8.625 3.807 5.053 658 HB3 GLN 96 2HB GLN 96 -10.219 4.517 5.204 659 HG2 GLN 96 1HG GLN 96 -9.886 1.542 5.028 660 HG3 GLN 96 2HG GLN 96 -9.640 2.405 6.544 661 HE21 GLN 96 1HE2 GLN 96 -11.696 0.449 5.724 662 HE22 GLN 96 2HE2 GLN 96 -13.211 1.232 6.024 663 H LYS 97 H LYS 97 -11.243 5.636 2.673 664 HA LYS 97 HA LYS 97 -13.808 4.326 2.688 665 HB2 LYS 97 1HB LYS 97 -13.589 6.651 3.409 666 HB3 LYS 97 2HB LYS 97 -13.006 7.109 1.817 667 HG2 LYS 97 1HG LYS 97 -15.305 7.759 2.052 668 HG3 LYS 97 2HG LYS 97 -15.182 6.465 0.863 669 HD2 LYS 97 1HD LYS 97 -17.087 6.065 2.284 670 HD3 LYS 97 2HD LYS 97 -15.854 4.850 2.615 671 HE2 LYS 97 1HE LYS 97 -15.164 6.038 4.601 672 HE3 LYS 97 2HE LYS 97 -16.287 7.349 4.245 673 HZ1 LYS 97 1HZ LYS 97 -18.116 5.782 4.512 674 HZ2 LYS 97 2HZ LYS 97 -17.180 5.873 5.918 675 HZ3 LYS 97 3HZ LYS 97 -17.025 4.546 4.884 676 H TYR 98 H TYR 98 -11.425 5.155 0.274 677 HA TYR 98 HA TYR 98 -13.204 4.976 -1.964 678 HB2 TYR 98 1HB TYR 98 -10.184 4.817 -1.878 679 HB3 TYR 98 2HB TYR 98 -11.151 4.984 -3.339 680 HD1 TYR 98 HD1 TYR 98 -13.165 6.989 -2.200 681 HD2 TYR 98 HD2 TYR 98 -8.917 6.812 -2.061 682 HE1 TYR 98 HE1 TYR 98 -13.076 9.435 -1.978 683 HE2 TYR 98 HE2 TYR 98 -8.819 9.259 -1.834 684 HH TYR 98 HH TYR 98 -11.589 11.157 -1.166 685 H ALA 99 H ALA 99 -10.786 2.806 -0.547 686 HA ALA 99 HA ALA 99 -11.930 0.604 -2.131 687 HB1 ALA 99 1HB ALA 99 -9.288 0.759 -0.677 688 HB2 ALA 99 2HB ALA 99 -9.528 0.888 -2.422 689 HB3 ALA 99 3HB ALA 99 -9.875 -0.630 -1.594 690 H ASP 100 H ASP 100 -12.956 -1.049 -1.112 691 HA ASP 100 HA ASP 100 -13.546 -0.694 1.687 692 HB2 ASP 100 1HB ASP 100 -15.308 -1.530 0.240 693 HB3 ASP 100 2HB ASP 100 -14.302 -2.884 -0.262 694 H ALA 101 H ALA 101 -11.922 -1.028 2.949 695 HA ALA 101 HA ALA 101 -10.879 -3.575 3.534 696 HB1 ALA 101 1HB ALA 101 -8.550 -3.215 2.842 697 HB2 ALA 101 2HB ALA 101 -9.017 -1.710 2.051 698 HB3 ALA 101 3HB ALA 101 -9.625 -3.251 1.444 699 H GLU 102 H GLU 102 -8.822 -3.182 4.981 700 HA GLU 102 HA GLU 102 -9.165 -0.601 6.341 701 HB2 GLU 102 1HB GLU 102 -8.188 -1.691 8.323 702 HB3 GLU 102 2HB GLU 102 -9.725 -2.375 7.851 703 HG2 GLU 102 1HG GLU 102 -8.754 -4.343 7.077 704 HG3 GLU 102 2HG GLU 102 -7.148 -3.622 6.979 705 H VAL 103 H VAL 103 -7.764 0.548 5.075 706 HA VAL 103 HA VAL 103 -5.134 -0.532 4.525 707 HB VAL 103 HB VAL 103 -6.444 0.753 2.790 708 HG11 VAL 103 1HG1 VAL 103 -6.572 3.102 2.834 709 HG12 VAL 103 2HG1 VAL 103 -5.526 3.210 4.255 710 HG13 VAL 103 3HG1 VAL 103 -7.167 2.555 4.403 711 HG21 VAL 103 1HG2 VAL 103 -4.028 0.343 2.615 712 HG22 VAL 103 2HG2 VAL 103 -3.728 1.865 3.452 713 HG23 VAL 103 3HG2 VAL 103 -4.512 1.867 1.871 714 H ARG 104 H ARG 104 -3.246 0.211 5.302 715 HA ARG 104 HA ARG 104 -3.347 2.402 7.261 716 HB2 ARG 104 1HB ARG 104 -1.132 1.428 8.084 717 HB3 ARG 104 2HB ARG 104 -2.582 0.519 8.475 718 HG2 ARG 104 1HG ARG 104 -1.140 -0.221 5.994 719 HG3 ARG 104 2HG ARG 104 -0.387 -0.630 7.537 720 HD2 ARG 104 1HD ARG 104 -3.224 -1.337 6.809 721 HD3 ARG 104 2HD ARG 104 -1.852 -2.420 6.575 722 HE ARG 104 HE ARG 104 -1.549 -1.972 9.124 723 HH11 ARG 104 1HH1 ARG 104 -4.598 -2.367 7.439 724 HH12 ARG 104 2HH1 ARG 104 -5.404 -3.082 8.806 725 HH21 ARG 104 1HH2 ARG 104 -2.596 -2.905 10.909 726 HH22 ARG 104 2HH2 ARG 104 -4.264 -3.371 10.784 727 H VAL 105 H VAL 105 -2.554 4.226 6.456 728 HA VAL 105 HA VAL 105 -0.912 4.065 4.071 729 HB VAL 105 HB VAL 105 -1.153 6.471 3.875 730 HG11 VAL 105 1HG1 VAL 105 -3.738 5.063 4.518 731 HG12 VAL 105 2HG1 VAL 105 -2.924 5.125 2.956 732 HG13 VAL 105 3HG1 VAL 105 -3.611 6.593 3.651 733 HG21 VAL 105 1HG2 VAL 105 -2.529 7.750 5.467 734 HG22 VAL 105 2HG2 VAL 105 -1.052 7.124 6.200 735 HG23 VAL 105 3HG2 VAL 105 -2.597 6.334 6.518 736 H ARG 106 H ARG 106 1.249 4.546 3.985 737 HA ARG 106 HA ARG 106 2.535 5.489 6.463 738 HB2 ARG 106 1HB ARG 106 3.558 3.244 4.725 739 HB3 ARG 106 2HB ARG 106 4.345 3.873 6.155 740 HG2 ARG 106 1HG ARG 106 1.694 2.451 6.088 741 HG3 ARG 106 2HG ARG 106 3.235 1.744 6.571 742 HD2 ARG 106 1HD ARG 106 3.356 3.506 8.363 743 HD3 ARG 106 2HD ARG 106 1.691 3.927 7.954 744 HE ARG 106 HE ARG 106 2.237 1.137 8.586 745 HH11 ARG 106 1HH1 ARG 106 0.956 4.218 9.640 746 HH12 ARG 106 2HH1 ARG 106 0.092 3.543 10.982 747 HH21 ARG 106 1HH2 ARG 106 1.109 0.241 10.341 748 HH22 ARG 106 2HH2 ARG 106 0.185 1.271 11.388 749 H THR 107 H THR 107 4.157 6.939 6.152 750 HA THR 107 HA THR 107 4.672 7.759 3.408 751 HB THR 107 HB THR 107 4.151 9.545 4.985 752 HG1 THR 107 HG1 THR 107 5.961 10.858 4.508 753 HG21 THR 107 1HG2 THR 107 5.700 10.130 6.806 754 HG22 THR 107 2HG2 THR 107 6.632 8.670 6.473 755 HG23 THR 107 3HG2 THR 107 4.970 8.544 7.050 756 H VAL 108 H VAL 108 6.486 7.315 2.345 757 HA VAL 108 HA VAL 108 8.691 6.102 3.874 758 HB VAL 108 HB VAL 108 9.258 4.852 1.751 759 HG11 VAL 108 1HG1 VAL 108 6.620 4.265 3.087 760 HG12 VAL 108 2HG1 VAL 108 8.213 3.743 3.635 761 HG13 VAL 108 3HG1 VAL 108 7.551 3.118 2.125 762 HG21 VAL 108 1HG2 VAL 108 7.445 4.501 0.129 763 HG22 VAL 108 2HG2 VAL 108 7.969 6.185 0.166 764 HG23 VAL 108 3HG2 VAL 108 6.470 5.710 0.964 765 H THR 109 H THR 109 10.212 7.581 4.051 766 HA THR 109 HA THR 109 10.848 9.253 1.731 767 HB THR 109 HB THR 109 12.256 10.498 3.516 768 HG1 THR 109 HG1 THR 109 10.736 10.054 5.573 769 HG21 THR 109 1HG2 THR 109 10.301 11.811 4.203 770 HG22 THR 109 2HG2 THR 109 9.237 10.518 3.653 771 HG23 THR 109 3HG2 THR 109 10.223 11.402 2.489 772 H SER 110 H SER 110 11.751 6.409 2.964 773 HA SER 110 HA SER 110 14.334 6.502 1.683 774 HB2 SER 110 1HB SER 110 14.135 5.673 4.593 775 HB3 SER 110 2HB SER 110 15.589 5.670 3.599 776 HG SER 110 HG SER 110 14.664 8.092 3.409 777 HA PRO 111 HA PRO 111 13.259 2.433 0.348 778 HB2 PRO 111 1HB PRO 111 15.955 1.569 1.284 779 HB3 PRO 111 2HB PRO 111 15.181 1.331 -0.286 780 HG2 PRO 111 1HG PRO 111 17.077 3.164 0.005 781 HG3 PRO 111 2HG PRO 111 15.645 3.496 -0.989 782 HD2 PRO 111 1HD PRO 111 16.316 4.465 1.755 783 HD3 PRO 111 2HD PRO 111 15.481 5.306 0.434 784 H ASP 112 H ASP 112 15.105 2.456 3.376 785 HA ASP 112 HA ASP 112 14.339 -0.074 4.285 786 HB2 ASP 112 1HB ASP 112 15.213 2.352 5.862 787 HB3 ASP 112 2HB ASP 112 15.096 0.721 6.519 788 H GLU 113 H GLU 113 12.762 3.028 4.570 789 HA GLU 113 HA GLU 113 10.980 2.505 6.649 790 HB2 GLU 113 1HB GLU 113 10.632 4.192 4.168 791 HB3 GLU 113 2HB GLU 113 9.500 4.188 5.512 792 HG2 GLU 113 1HG GLU 113 12.403 4.946 5.709 793 HG3 GLU 113 2HG GLU 113 11.065 6.085 5.557 794 H ALA 114 H ALA 114 10.753 1.807 3.205 795 HA ALA 114 HA ALA 114 8.056 1.018 3.156 796 HB1 ALA 114 1HB ALA 114 8.583 0.040 0.980 797 HB2 ALA 114 2HB ALA 114 10.305 0.213 1.316 798 HB3 ALA 114 3HB ALA 114 9.290 1.645 1.150 799 H LYS 115 H LYS 115 10.997 -0.999 3.133 800 HA LYS 115 HA LYS 115 9.582 -3.438 3.188 801 HB2 LYS 115 1HB LYS 115 11.738 -4.484 3.595 802 HB3 LYS 115 2HB LYS 115 11.894 -3.233 2.370 803 HG2 LYS 115 1HG LYS 115 12.814 -1.710 4.040 804 HG3 LYS 115 2HG LYS 115 12.659 -2.967 5.268 805 HD2 LYS 115 1HD LYS 115 14.173 -4.398 3.929 806 HD3 LYS 115 2HD LYS 115 14.385 -3.060 2.795 807 HE2 LYS 115 1HE LYS 115 15.279 -1.680 4.612 808 HE3 LYS 115 2HE LYS 115 15.076 -3.023 5.731 809 HZ1 LYS 115 1HZ LYS 115 17.344 -2.840 4.936 810 HZ2 LYS 115 2HZ LYS 115 16.830 -3.029 3.339 811 HZ3 LYS 115 3HZ LYS 115 16.653 -4.297 4.444 812 H ARG 116 H ARG 116 10.645 -1.285 5.695 813 HA ARG 116 HA ARG 116 10.655 -3.071 7.864 814 HB2 ARG 116 1HB ARG 116 11.602 -0.750 7.840 815 HB3 ARG 116 2HB ARG 116 9.958 -0.135 7.932 816 HG2 ARG 116 1HG ARG 116 9.643 -1.199 10.077 817 HG3 ARG 116 2HG ARG 116 11.254 -1.911 9.984 818 HD2 ARG 116 1HD ARG 116 10.584 1.021 10.103 819 HD3 ARG 116 2HD ARG 116 11.297 0.057 11.390 820 HE ARG 116 HE ARG 116 13.201 -0.268 9.722 821 HH11 ARG 116 1HH1 ARG 116 11.202 2.594 9.865 822 HH12 ARG 116 2HH1 ARG 116 12.434 3.653 9.248 823 HH21 ARG 116 1HH2 ARG 116 14.847 1.111 8.954 824 HH22 ARG 116 2HH2 ARG 116 14.528 2.805 8.744 825 H TRP 117 H TRP 117 8.107 -0.890 6.661 826 HA TRP 117 HA TRP 117 6.134 -1.684 8.511 827 HB2 TRP 117 1HB TRP 117 5.852 -0.541 5.727 828 HB3 TRP 117 2HB TRP 117 4.509 -0.764 6.839 829 HD1 TRP 117 HD1 TRP 117 6.679 1.852 5.678 830 HE1 TRP 117 HE1 TRP 117 6.797 3.813 7.337 831 HE3 TRP 117 HE3 TRP 117 4.717 -0.455 9.797 832 HZ2 TRP 117 HZ2 TRP 117 6.151 4.311 10.040 833 HZ3 TRP 117 HZ3 TRP 117 4.504 0.834 11.880 834 HH2 TRP 117 HH2 TRP 117 5.209 3.169 11.998 835 H ILE 118 H ILE 118 6.981 -2.837 5.288 836 HA ILE 118 HA ILE 118 4.826 -4.537 4.834 837 HB ILE 118 HB ILE 118 7.681 -4.837 3.888 838 HG12 ILE 118 1HG1 ILE 118 5.247 -3.653 2.531 839 HG13 ILE 118 2HG1 ILE 118 6.556 -2.721 3.249 840 HG21 ILE 118 1HG2 ILE 118 6.756 -6.248 2.105 841 HG22 ILE 118 2HG2 ILE 118 5.167 -6.157 2.865 842 HG23 ILE 118 3HG2 ILE 118 6.500 -6.955 3.700 843 HD11 ILE 118 1HD1 ILE 118 8.116 -3.653 1.632 844 HD12 ILE 118 2HD1 ILE 118 6.762 -2.858 0.829 845 HD13 ILE 118 3HD1 ILE 118 6.821 -4.617 0.928 846 H LYS 119 H LYS 119 7.827 -5.120 6.602 847 HA LYS 119 HA LYS 119 7.600 -7.891 6.912 848 HB2 LYS 119 1HB LYS 119 9.634 -6.613 7.467 849 HB3 LYS 119 2HB LYS 119 8.801 -5.892 8.837 850 HG2 LYS 119 1HG LYS 119 8.592 -8.065 9.888 851 HG3 LYS 119 2HG LYS 119 9.349 -8.832 8.497 852 HD2 LYS 119 1HD LYS 119 10.983 -8.615 10.243 853 HD3 LYS 119 2HD LYS 119 11.399 -7.502 8.942 854 HE2 LYS 119 1HE LYS 119 9.732 -6.508 11.206 855 HE3 LYS 119 2HE LYS 119 11.457 -6.751 11.466 856 HZ1 LYS 119 1HZ LYS 119 11.941 -5.252 9.672 857 HZ2 LYS 119 2HZ LYS 119 10.911 -4.481 10.769 858 HZ3 LYS 119 3HZ LYS 119 10.300 -5.073 9.309 859 H GLU 120 H GLU 120 6.348 -5.259 8.927 860 HA GLU 120 HA GLU 120 5.148 -7.088 10.808 861 HB2 GLU 120 1HB GLU 120 4.980 -4.086 10.534 862 HB3 GLU 120 2HB GLU 120 4.223 -5.002 11.832 863 HG2 GLU 120 1HG GLU 120 6.442 -5.833 12.503 864 HG3 GLU 120 2HG GLU 120 7.172 -4.838 11.244 865 H PHE 121 H PHE 121 4.252 -5.623 7.876 866 HA PHE 121 HA PHE 121 1.408 -5.716 8.302 867 HB2 PHE 121 1HB PHE 121 2.272 -4.033 6.820 868 HB3 PHE 121 2HB PHE 121 3.107 -5.240 5.851 869 HD1 PHE 121 HD1 PHE 121 2.089 -6.159 3.983 870 HD2 PHE 121 HD2 PHE 121 -0.286 -4.124 6.866 871 HE1 PHE 121 HE1 PHE 121 0.150 -6.296 2.477 872 HE2 PHE 121 HE2 PHE 121 -2.232 -4.261 5.368 873 HZ PHE 121 HZ PHE 121 -2.014 -5.348 3.168 874 H SER 122 H SER 122 3.820 -7.681 6.598 875 HA SER 122 HA SER 122 1.841 -9.450 5.519 876 HB2 SER 122 1HB SER 122 3.800 -10.770 4.751 877 HB3 SER 122 2HB SER 122 3.904 -9.071 4.295 878 HG SER 122 HG SER 122 5.373 -10.519 6.196 879 H GLU 123 H GLU 123 4.198 -9.636 8.173 880 HA GLU 123 HA GLU 123 2.932 -12.132 9.048 881 HB2 GLU 123 1HB GLU 123 5.559 -10.839 9.741 882 HB3 GLU 123 2HB GLU 123 4.870 -12.098 10.754 883 HG2 GLU 123 1HG GLU 123 6.366 -13.212 9.368 884 HG3 GLU 123 2HG GLU 123 4.791 -13.520 8.644 885 H GLU 124 H GLU 124 1.226 -11.786 10.300 886 HA GLU 124 HA GLU 124 1.549 -9.929 12.556 887 HB2 GLU 124 1HB GLU 124 -0.989 -10.543 11.034 888 HB3 GLU 124 2HB GLU 124 -0.917 -9.611 12.521 889 HG2 GLU 124 1HG GLU 124 0.501 -7.955 11.382 890 HG3 GLU 124 2HG GLU 124 0.334 -8.875 9.887 Start of MODEL 7 1 HA MET 21 HA MET 21 -8.804 -11.028 3.776 2 HB2 MET 21 1HB MET 21 -7.370 -9.566 5.082 3 HB3 MET 21 2HB MET 21 -8.302 -10.589 6.160 4 HG2 MET 21 1HG MET 21 -5.459 -11.158 5.379 5 HG3 MET 21 2HG MET 21 -5.914 -10.227 6.801 6 HE1 MET 21 1HE MET 21 -8.474 -11.727 7.903 7 HE2 MET 21 2HE MET 21 -7.119 -11.200 8.896 8 HE3 MET 21 3HE MET 21 -7.718 -12.853 9.027 9 H THR 22 H THR 22 -7.767 -10.183 2.029 10 HA THR 22 HA THR 22 -5.207 -11.388 1.275 11 HB THR 22 HB THR 22 -6.816 -9.404 -0.343 12 HG1 THR 22 HG1 THR 22 -6.857 -12.226 -0.646 13 HG21 THR 22 1HG2 THR 22 -4.732 -11.454 -1.112 14 HG22 THR 22 2HG2 THR 22 -4.490 -9.709 -1.041 15 HG23 THR 22 3HG2 THR 22 -5.596 -10.399 -2.230 16 H LEU 23 H LEU 23 -3.331 -10.189 1.018 17 HA LEU 23 HA LEU 23 -3.377 -7.563 2.323 18 HB2 LEU 23 1HB LEU 23 -1.037 -9.410 1.868 19 HB3 LEU 23 2HB LEU 23 -1.010 -7.914 2.778 20 HG LEU 23 HG LEU 23 -2.420 -10.471 3.531 21 HD11 LEU 23 1HD1 LEU 23 -0.008 -10.437 3.916 22 HD12 LEU 23 2HD1 LEU 23 -0.906 -10.428 5.434 23 HD13 LEU 23 3HD1 LEU 23 -0.176 -8.938 4.831 24 HD21 LEU 23 1HD2 LEU 23 -3.833 -8.611 4.152 25 HD22 LEU 23 2HD2 LEU 23 -2.465 -7.783 4.896 26 HD23 LEU 23 3HD2 LEU 23 -3.070 -9.286 5.591 27 H PHE 24 H PHE 24 -3.339 -5.906 0.994 28 HA PHE 24 HA PHE 24 -1.879 -6.160 -1.554 29 HB2 PHE 24 1HB PHE 24 -4.035 -4.167 -0.820 30 HB3 PHE 24 2HB PHE 24 -3.276 -4.346 -2.397 31 HD1 PHE 24 HD1 PHE 24 -3.901 -6.131 -3.881 32 HD2 PHE 24 HD2 PHE 24 -5.646 -5.785 -0.017 33 HE1 PHE 24 HE1 PHE 24 -5.643 -7.736 -4.528 34 HE2 PHE 24 HE2 PHE 24 -7.389 -7.389 -0.656 35 HZ PHE 24 HZ PHE 24 -7.391 -8.368 -2.916 36 H VAL 25 H VAL 25 -0.229 -4.789 -1.979 37 HA VAL 25 HA VAL 25 0.235 -2.644 -0.018 38 HB VAL 25 HB VAL 25 2.341 -4.176 -1.554 39 HG11 VAL 25 1HG1 VAL 25 3.963 -2.801 -0.438 40 HG12 VAL 25 2HG1 VAL 25 2.707 -2.013 0.517 41 HG13 VAL 25 3HG1 VAL 25 2.791 -1.732 -1.223 42 HG21 VAL 25 1HG2 VAL 25 1.417 -5.456 0.309 43 HG22 VAL 25 2HG2 VAL 25 1.709 -4.099 1.398 44 HG23 VAL 25 3HG2 VAL 25 3.069 -4.946 0.658 45 H LEU 26 H LEU 26 0.230 -0.696 -0.766 46 HA LEU 26 HA LEU 26 0.721 -0.259 -3.632 47 HB2 LEU 26 1HB LEU 26 -1.036 1.143 -1.650 48 HB3 LEU 26 2HB LEU 26 -0.399 2.013 -3.024 49 HG LEU 26 HG LEU 26 -1.512 0.378 -4.533 50 HD11 LEU 26 1HD1 LEU 26 -2.756 -0.636 -1.993 51 HD12 LEU 26 2HD1 LEU 26 -1.628 -1.521 -3.019 52 HD13 LEU 26 3HD1 LEU 26 -3.226 -1.090 -3.630 53 HD21 LEU 26 1HD2 LEU 26 -3.308 1.770 -2.563 54 HD22 LEU 26 2HD2 LEU 26 -3.778 1.204 -4.166 55 HD23 LEU 26 3HD2 LEU 26 -2.580 2.484 -3.999 56 H ILE 27 H ILE 27 2.077 1.507 -4.161 57 HA ILE 27 HA ILE 27 3.432 2.831 -1.945 58 HB ILE 27 HB ILE 27 4.911 0.987 -2.341 59 HG12 ILE 27 1HG1 ILE 27 6.009 3.428 -3.755 60 HG13 ILE 27 2HG1 ILE 27 5.967 3.194 -2.010 61 HG21 ILE 27 1HG2 ILE 27 4.121 0.291 -4.522 62 HG22 ILE 27 2HG2 ILE 27 5.874 0.491 -4.542 63 HG23 ILE 27 3HG2 ILE 27 4.837 1.723 -5.261 64 HD11 ILE 27 1HD1 ILE 27 8.174 2.750 -2.907 65 HD12 ILE 27 2HD1 ILE 27 7.508 1.519 -3.979 66 HD13 ILE 27 3HD1 ILE 27 7.467 1.284 -2.231 67 H LEU 28 H LEU 28 3.267 4.963 -2.345 68 HA LEU 28 HA LEU 28 3.321 5.773 -5.184 69 HB2 LEU 28 1HB LEU 28 1.320 6.278 -3.504 70 HB3 LEU 28 2HB LEU 28 2.364 7.608 -3.042 71 HG LEU 28 HG LEU 28 2.410 8.281 -5.473 72 HD11 LEU 28 1HD1 LEU 28 0.325 6.126 -5.567 73 HD12 LEU 28 2HD1 LEU 28 1.749 6.321 -6.588 74 HD13 LEU 28 3HD1 LEU 28 0.385 7.429 -6.748 75 HD21 LEU 28 1HD2 LEU 28 0.232 9.362 -5.375 76 HD22 LEU 28 2HD2 LEU 28 1.040 9.431 -3.809 77 HD23 LEU 28 3HD2 LEU 28 -0.260 8.273 -4.081 78 H SER 29 H SER 29 5.618 5.569 -4.970 79 HA SER 29 HA SER 29 6.722 8.200 -4.482 80 HB2 SER 29 1HB SER 29 7.215 6.717 -2.428 81 HB3 SER 29 2HB SER 29 8.210 5.749 -3.511 82 HG SER 29 HG SER 29 8.623 8.514 -3.467 83 H ASN 30 H ASN 30 8.310 8.663 -6.159 84 HA ASN 30 HA ASN 30 8.978 6.245 -7.706 85 HB2 ASN 30 1HB ASN 30 9.473 7.784 -9.625 86 HB3 ASN 30 2HB ASN 30 7.783 7.741 -9.146 87 HD21 ASN 30 1HD2 ASN 30 6.915 9.543 -8.017 88 HD22 ASN 30 2HD2 ASN 30 7.657 11.102 -8.138 89 H ASP 31 H ASP 31 10.534 5.799 -6.163 90 HA ASP 31 HA ASP 31 13.093 7.061 -6.863 91 HB2 ASP 31 1HB ASP 31 12.607 7.346 -4.476 92 HB3 ASP 31 2HB ASP 31 12.340 5.624 -4.310 93 H LYS 32 H LYS 32 14.546 5.707 -7.839 94 HA LYS 32 HA LYS 32 13.427 3.403 -9.036 95 HB2 LYS 32 1HB LYS 32 16.282 4.383 -9.026 96 HB3 LYS 32 2HB LYS 32 15.661 3.110 -10.065 97 HG2 LYS 32 1HG LYS 32 14.758 5.984 -10.062 98 HG3 LYS 32 2HG LYS 32 15.815 5.224 -11.252 99 HD2 LYS 32 1HD LYS 32 12.958 4.420 -10.690 100 HD3 LYS 32 2HD LYS 32 13.486 5.423 -12.040 101 HE2 LYS 32 1HE LYS 32 14.853 3.580 -12.880 102 HE3 LYS 32 2HE LYS 32 14.342 2.576 -11.523 103 HZ1 LYS 32 1HZ LYS 32 12.074 2.709 -12.315 104 HZ2 LYS 32 2HZ LYS 32 13.077 2.093 -13.527 105 HZ3 LYS 32 3HZ LYS 32 12.545 3.695 -13.604 106 H LYS 33 H LYS 33 15.439 3.813 -6.217 107 HA LYS 33 HA LYS 33 16.161 0.988 -6.193 108 HB2 LYS 33 1HB LYS 33 16.884 3.270 -4.349 109 HB3 LYS 33 2HB LYS 33 17.385 1.610 -4.072 110 HG2 LYS 33 1HG LYS 33 19.214 2.701 -5.080 111 HG3 LYS 33 2HG LYS 33 18.498 1.689 -6.333 112 HD2 LYS 33 1HD LYS 33 17.291 3.682 -7.183 113 HD3 LYS 33 2HD LYS 33 18.135 4.664 -5.986 114 HE2 LYS 33 1HE LYS 33 19.427 3.059 -8.188 115 HE3 LYS 33 2HE LYS 33 19.203 4.805 -8.183 116 HZ1 LYS 33 1HZ LYS 33 20.646 4.951 -6.256 117 HZ2 LYS 33 2HZ LYS 33 21.444 4.190 -7.535 118 HZ3 LYS 33 3HZ LYS 33 20.852 3.273 -6.245 119 H LEU 34 H LEU 34 14.304 3.305 -4.284 120 HA LEU 34 HA LEU 34 13.356 1.622 -2.275 121 HB2 LEU 34 1HB LEU 34 12.958 3.919 -2.042 122 HB3 LEU 34 2HB LEU 34 12.268 4.042 -3.640 123 HG LEU 34 HG LEU 34 10.283 2.770 -2.824 124 HD11 LEU 34 1HD1 LEU 34 11.539 3.220 -0.133 125 HD12 LEU 34 2HD1 LEU 34 11.285 1.660 -0.921 126 HD13 LEU 34 3HD1 LEU 34 9.902 2.639 -0.430 127 HD21 LEU 34 1HD2 LEU 34 10.266 5.195 -3.027 128 HD22 LEU 34 2HD2 LEU 34 10.920 5.342 -1.397 129 HD23 LEU 34 3HD2 LEU 34 9.311 4.666 -1.642 130 H ILE 35 H ILE 35 11.959 2.315 -5.469 131 HA ILE 35 HA ILE 35 9.649 0.771 -5.200 132 HB ILE 35 HB ILE 35 11.220 1.593 -7.636 133 HG12 ILE 35 1HG1 ILE 35 8.560 2.489 -6.508 134 HG13 ILE 35 2HG1 ILE 35 10.079 3.367 -6.377 135 HG21 ILE 35 1HG2 ILE 35 10.095 -0.469 -8.222 136 HG22 ILE 35 2HG2 ILE 35 9.298 0.897 -9.003 137 HG23 ILE 35 3HG2 ILE 35 8.577 0.151 -7.578 138 HD11 ILE 35 1HD1 ILE 35 8.658 2.731 -8.953 139 HD12 ILE 35 2HD1 ILE 35 10.131 3.685 -8.775 140 HD13 ILE 35 3HD1 ILE 35 8.611 4.278 -8.110 141 H GLU 36 H GLU 36 12.904 -0.150 -6.267 142 HA GLU 36 HA GLU 36 12.197 -2.780 -7.034 143 HB2 GLU 36 1HB GLU 36 14.837 -1.595 -6.203 144 HB3 GLU 36 2HB GLU 36 14.656 -3.256 -6.753 145 HG2 GLU 36 1HG GLU 36 14.096 -0.752 -8.302 146 HG3 GLU 36 2HG GLU 36 15.377 -1.927 -8.594 147 H GLU 37 H GLU 37 13.845 -1.639 -4.077 148 HA GLU 37 HA GLU 37 13.928 -4.160 -2.859 149 HB2 GLU 37 1HB GLU 37 14.059 -1.364 -1.744 150 HB3 GLU 37 2HB GLU 37 14.163 -2.776 -0.704 151 HG2 GLU 37 1HG GLU 37 16.012 -2.215 -3.009 152 HG3 GLU 37 2HG GLU 37 16.359 -1.834 -1.322 153 H ALA 38 H ALA 38 11.407 -1.713 -2.864 154 HA ALA 38 HA ALA 38 9.805 -2.718 -0.806 155 HB1 ALA 38 1HB ALA 38 7.944 -1.593 -1.909 156 HB2 ALA 38 2HB ALA 38 8.902 -1.427 -3.381 157 HB3 ALA 38 3HB ALA 38 9.383 -0.572 -1.915 158 H ARG 39 H ARG 39 9.820 -3.524 -4.279 159 HA ARG 39 HA ARG 39 7.826 -5.553 -3.907 160 HB2 ARG 39 1HB ARG 39 7.902 -4.381 -6.023 161 HB3 ARG 39 2HB ARG 39 9.557 -4.911 -6.296 162 HG2 ARG 39 1HG ARG 39 8.905 -7.131 -6.667 163 HG3 ARG 39 2HG ARG 39 7.303 -6.869 -5.970 164 HD2 ARG 39 1HD ARG 39 8.238 -5.450 -8.452 165 HD3 ARG 39 2HD ARG 39 7.461 -7.032 -8.508 166 HE ARG 39 HE ARG 39 5.619 -5.766 -7.183 167 HH11 ARG 39 1HH1 ARG 39 7.563 -4.476 -9.788 168 HH12 ARG 39 2HH1 ARG 39 6.328 -3.391 -10.347 169 HH21 ARG 39 1HH2 ARG 39 3.973 -4.342 -7.926 170 HH22 ARG 39 2HH2 ARG 39 4.297 -3.315 -9.291 171 H LYS 40 H LYS 40 11.329 -5.465 -3.923 172 HA LYS 40 HA LYS 40 11.923 -8.168 -4.191 173 HB2 LYS 40 1HB LYS 40 13.181 -6.270 -2.193 174 HB3 LYS 40 2HB LYS 40 13.870 -7.787 -2.743 175 HG2 LYS 40 1HG LYS 40 13.500 -5.252 -4.307 176 HG3 LYS 40 2HG LYS 40 15.008 -6.055 -3.871 177 HD2 LYS 40 1HD LYS 40 14.266 -7.989 -5.278 178 HD3 LYS 40 2HD LYS 40 12.914 -6.983 -5.798 179 HE2 LYS 40 1HE LYS 40 14.467 -5.328 -6.687 180 HE3 LYS 40 2HE LYS 40 15.829 -6.311 -6.152 181 HZ1 LYS 40 1HZ LYS 40 13.803 -7.093 -8.176 182 HZ2 LYS 40 2HZ LYS 40 15.070 -8.071 -7.639 183 HZ3 LYS 40 3HZ LYS 40 15.407 -6.650 -8.489 184 H MET 41 H MET 41 10.966 -6.356 -1.325 185 HA MET 41 HA MET 41 10.886 -8.610 0.408 186 HB2 MET 41 1HB MET 41 9.655 -5.859 0.631 187 HB3 MET 41 2HB MET 41 9.633 -7.052 1.921 188 HG2 MET 41 1HG MET 41 12.138 -5.953 0.673 189 HG3 MET 41 2HG MET 41 11.398 -5.326 2.143 190 HE1 MET 41 1HE MET 41 10.390 -7.986 3.606 191 HE2 MET 41 2HE MET 41 11.211 -6.636 4.389 192 HE3 MET 41 3HE MET 41 11.787 -8.283 4.640 193 H ALA 42 H ALA 42 8.411 -6.775 -1.349 194 HA ALA 42 HA ALA 42 6.209 -8.117 -0.209 195 HB1 ALA 42 1HB ALA 42 6.357 -6.588 -2.791 196 HB2 ALA 42 2HB ALA 42 6.012 -5.916 -1.198 197 HB3 ALA 42 3HB ALA 42 4.885 -7.048 -1.942 198 H GLU 43 H GLU 43 7.926 -8.645 -3.295 199 HA GLU 43 HA GLU 43 6.206 -10.572 -4.337 200 HB2 GLU 43 1HB GLU 43 9.118 -10.021 -4.715 201 HB3 GLU 43 2HB GLU 43 8.433 -11.495 -5.384 202 HG2 GLU 43 1HG GLU 43 7.474 -8.709 -5.963 203 HG3 GLU 43 2HG GLU 43 8.501 -9.677 -7.016 204 H LYS 44 H LYS 44 8.928 -10.882 -2.119 205 HA LYS 44 HA LYS 44 8.661 -13.740 -1.911 206 HB2 LYS 44 1HB LYS 44 10.314 -11.679 -0.494 207 HB3 LYS 44 2HB LYS 44 10.197 -13.307 0.154 208 HG2 LYS 44 1HG LYS 44 12.186 -13.095 -1.187 209 HG3 LYS 44 2HG LYS 44 11.055 -14.200 -1.968 210 HD2 LYS 44 1HD LYS 44 10.363 -12.442 -3.498 211 HD3 LYS 44 2HD LYS 44 11.425 -11.291 -2.685 212 HE2 LYS 44 1HE LYS 44 12.323 -13.793 -4.107 213 HE3 LYS 44 2HE LYS 44 12.401 -12.162 -4.770 214 HZ1 LYS 44 1HZ LYS 44 14.523 -12.861 -3.848 215 HZ2 LYS 44 2HZ LYS 44 13.816 -13.097 -2.331 216 HZ3 LYS 44 3HZ LYS 44 13.904 -11.543 -2.990 217 H ALA 45 H ALA 45 7.356 -10.980 -0.251 218 HA ALA 45 HA ALA 45 6.504 -12.498 2.050 219 HB1 ALA 45 1HB ALA 45 7.200 -10.166 2.287 220 HB2 ALA 45 2HB ALA 45 5.549 -10.422 2.847 221 HB3 ALA 45 3HB ALA 45 5.841 -9.668 1.280 222 H ASN 46 H ASN 46 5.447 -12.557 -0.960 223 HA ASN 46 HA ASN 46 3.535 -13.171 -2.014 224 HB2 ASN 46 1HB ASN 46 2.659 -13.880 0.796 225 HB3 ASN 46 2HB ASN 46 1.759 -14.297 -0.657 226 HD21 ASN 46 1HD2 ASN 46 4.532 -14.976 1.295 227 HD22 ASN 46 2HD2 ASN 46 5.000 -16.430 0.485 228 H LEU 47 H LEU 47 3.894 -10.452 -1.240 229 HA LEU 47 HA LEU 47 1.178 -9.566 -0.569 230 HB2 LEU 47 1HB LEU 47 3.772 -8.031 -0.699 231 HB3 LEU 47 2HB LEU 47 2.223 -7.344 -0.263 232 HG LEU 47 HG LEU 47 3.634 -9.508 1.300 233 HD11 LEU 47 1HD1 LEU 47 4.852 -7.376 1.322 234 HD12 LEU 47 2HD1 LEU 47 4.166 -7.770 2.898 235 HD13 LEU 47 3HD1 LEU 47 3.389 -6.561 1.876 236 HD21 LEU 47 1HD2 LEU 47 1.999 -8.956 3.036 237 HD22 LEU 47 2HD2 LEU 47 1.214 -9.545 1.571 238 HD23 LEU 47 3HD2 LEU 47 1.220 -7.819 1.938 239 H ILE 48 H ILE 48 -0.097 -8.640 -2.044 240 HA ILE 48 HA ILE 48 0.809 -8.427 -4.774 241 HB ILE 48 HB ILE 48 -1.846 -7.548 -3.621 242 HG12 ILE 48 1HG1 ILE 48 -1.058 -10.218 -4.815 243 HG13 ILE 48 2HG1 ILE 48 -1.418 -9.920 -3.117 244 HG21 ILE 48 1HG2 ILE 48 -1.361 -6.632 -5.824 245 HG22 ILE 48 2HG2 ILE 48 -2.650 -7.832 -5.920 246 HG23 ILE 48 3HG2 ILE 48 -1.016 -8.250 -6.435 247 HD11 ILE 48 1HD1 ILE 48 -3.283 -10.981 -4.252 248 HD12 ILE 48 2HD1 ILE 48 -3.355 -9.649 -5.405 249 HD13 ILE 48 3HD1 ILE 48 -3.717 -9.362 -3.703 250 H LEU 49 H LEU 49 2.308 -6.813 -4.890 251 HA LEU 49 HA LEU 49 1.622 -4.188 -3.791 252 HB2 LEU 49 1HB LEU 49 3.811 -5.246 -3.216 253 HB3 LEU 49 2HB LEU 49 4.256 -5.162 -4.907 254 HG LEU 49 HG LEU 49 3.563 -2.667 -3.371 255 HD11 LEU 49 1HD1 LEU 49 6.276 -3.954 -3.595 256 HD12 LEU 49 2HD1 LEU 49 5.316 -3.829 -2.120 257 HD13 LEU 49 3HD1 LEU 49 5.930 -2.371 -2.903 258 HD21 LEU 49 1HD2 LEU 49 5.025 -1.624 -5.031 259 HD22 LEU 49 2HD2 LEU 49 3.692 -2.487 -5.800 260 HD23 LEU 49 3HD2 LEU 49 5.306 -3.199 -5.774 261 H ILE 50 H ILE 50 0.909 -2.637 -5.061 262 HA ILE 50 HA ILE 50 1.367 -2.854 -7.961 263 HB ILE 50 HB ILE 50 -0.734 -1.194 -6.544 264 HG12 ILE 50 1HG1 ILE 50 -2.260 -2.895 -7.827 265 HG13 ILE 50 2HG1 ILE 50 -0.836 -3.926 -7.791 266 HG21 ILE 50 1HG2 ILE 50 -0.329 -1.785 -9.473 267 HG22 ILE 50 2HG2 ILE 50 -0.021 -0.247 -8.671 268 HG23 ILE 50 3HG2 ILE 50 -1.667 -0.868 -8.782 269 HD11 ILE 50 1HD1 ILE 50 -0.815 -3.809 -5.352 270 HD12 ILE 50 2HD1 ILE 50 -2.342 -4.444 -5.965 271 HD13 ILE 50 3HD1 ILE 50 -2.246 -2.778 -5.392 272 H THR 51 H THR 51 3.089 -1.705 -8.526 273 HA THR 51 HA THR 51 3.993 0.592 -7.075 274 HB THR 51 HB THR 51 5.525 0.706 -9.234 275 HG1 THR 51 HG1 THR 51 4.618 -0.804 -10.535 276 HG21 THR 51 1HG2 THR 51 5.703 -1.467 -7.147 277 HG22 THR 51 2HG2 THR 51 6.348 0.170 -7.014 278 HG23 THR 51 3HG2 THR 51 7.027 -0.954 -8.192 279 H VAL 52 H VAL 52 3.134 2.551 -7.265 280 HA VAL 52 HA VAL 52 2.361 3.512 -9.927 281 HB VAL 52 HB VAL 52 0.442 4.757 -8.743 282 HG11 VAL 52 1HG1 VAL 52 0.270 1.761 -9.061 283 HG12 VAL 52 2HG1 VAL 52 0.036 2.958 -10.334 284 HG13 VAL 52 3HG1 VAL 52 -1.106 2.864 -8.990 285 HG21 VAL 52 1HG2 VAL 52 0.882 2.556 -6.724 286 HG22 VAL 52 2HG2 VAL 52 -0.482 3.675 -6.759 287 HG23 VAL 52 3HG2 VAL 52 1.146 4.277 -6.448 288 H GLY 53 H GLY 53 2.873 5.682 -10.297 289 HA2 GLY 53 1HA GLY 53 3.746 7.215 -7.933 290 HA3 GLY 53 2HA GLY 53 4.768 7.153 -9.364 291 H ASP 54 H ASP 54 1.976 8.420 -7.908 292 HA ASP 54 HA ASP 54 1.584 10.797 -8.944 293 HB2 ASP 54 1HB ASP 54 1.659 9.719 -11.258 294 HB3 ASP 54 2HB ASP 54 0.123 8.958 -10.855 295 H GLU 55 H GLU 55 -0.354 11.644 -8.103 296 HA GLU 55 HA GLU 55 -1.632 10.052 -6.166 297 HB2 GLU 55 1HB GLU 55 -2.726 12.635 -7.265 298 HB3 GLU 55 2HB GLU 55 -2.997 11.944 -5.677 299 HG2 GLU 55 1HG GLU 55 -1.497 13.636 -5.238 300 HG3 GLU 55 2HG GLU 55 -0.454 12.221 -5.356 301 H GLU 56 H GLU 56 -2.328 10.632 -9.501 302 HA GLU 56 HA GLU 56 -5.074 9.761 -9.271 303 HB2 GLU 56 1HB GLU 56 -3.363 10.429 -11.658 304 HB3 GLU 56 2HB GLU 56 -5.052 9.945 -11.763 305 HG2 GLU 56 1HG GLU 56 -4.028 12.338 -10.251 306 HG3 GLU 56 2HG GLU 56 -4.746 12.382 -11.861 307 H GLU 57 H GLU 57 -1.973 8.408 -10.259 308 HA GLU 57 HA GLU 57 -2.996 5.952 -11.207 309 HB2 GLU 57 1HB GLU 57 -0.304 6.673 -10.062 310 HB3 GLU 57 2HB GLU 57 -0.689 5.056 -10.632 311 HG2 GLU 57 1HG GLU 57 -1.341 6.223 -12.829 312 HG3 GLU 57 2HG GLU 57 -0.425 7.589 -12.196 313 H LEU 58 H LEU 58 -2.245 7.162 -8.004 314 HA LEU 58 HA LEU 58 -2.462 4.713 -6.629 315 HB2 LEU 58 1HB LEU 58 -1.593 6.859 -5.653 316 HB3 LEU 58 2HB LEU 58 -3.249 7.427 -5.566 317 HG LEU 58 HG LEU 58 -3.768 5.459 -4.091 318 HD11 LEU 58 1HD1 LEU 58 -1.843 4.078 -4.805 319 HD12 LEU 58 2HD1 LEU 58 -1.968 4.247 -3.054 320 HD13 LEU 58 3HD1 LEU 58 -0.769 5.185 -3.948 321 HD21 LEU 58 1HD2 LEU 58 -2.772 6.434 -2.093 322 HD22 LEU 58 2HD2 LEU 58 -3.390 7.688 -3.169 323 HD23 LEU 58 3HD2 LEU 58 -1.659 7.365 -3.090 324 H LYS 59 H LYS 59 -4.852 7.045 -7.738 325 HA LYS 59 HA LYS 59 -7.104 6.064 -6.411 326 HB2 LYS 59 1HB LYS 59 -7.116 7.160 -9.214 327 HB3 LYS 59 2HB LYS 59 -8.447 7.159 -8.072 328 HG2 LYS 59 1HG LYS 59 -5.929 8.791 -7.926 329 HG3 LYS 59 2HG LYS 59 -7.562 9.373 -8.243 330 HD2 LYS 59 1HD LYS 59 -8.050 8.283 -5.900 331 HD3 LYS 59 2HD LYS 59 -6.306 8.485 -5.693 332 HE2 LYS 59 1HE LYS 59 -8.282 10.657 -6.363 333 HE3 LYS 59 2HE LYS 59 -7.501 10.404 -4.806 334 HZ1 LYS 59 1HZ LYS 59 -6.361 12.130 -5.967 335 HZ2 LYS 59 2HZ LYS 59 -6.185 11.178 -7.356 336 HZ3 LYS 59 3HZ LYS 59 -5.348 10.773 -5.938 337 H LYS 60 H LYS 60 -5.378 4.908 -9.132 338 HA LYS 60 HA LYS 60 -7.481 3.144 -10.034 339 HB2 LYS 60 1HB LYS 60 -4.613 3.221 -10.952 340 HB3 LYS 60 2HB LYS 60 -6.029 2.687 -11.854 341 HG2 LYS 60 1HG LYS 60 -5.729 5.507 -10.874 342 HG3 LYS 60 2HG LYS 60 -5.075 4.975 -12.435 343 HD2 LYS 60 1HD LYS 60 -7.965 4.689 -11.615 344 HD3 LYS 60 2HD LYS 60 -7.335 6.045 -12.552 345 HE2 LYS 60 1HE LYS 60 -6.611 4.503 -14.301 346 HE3 LYS 60 2HE LYS 60 -7.226 3.141 -13.366 347 HZ1 LYS 60 1HZ LYS 60 -8.785 3.804 -15.078 348 HZ2 LYS 60 2HZ LYS 60 -8.858 5.371 -14.448 349 HZ3 LYS 60 3HZ LYS 60 -9.450 4.069 -13.547 350 H ALA 61 H ALA 61 -4.354 2.924 -8.417 351 HA ALA 61 HA ALA 61 -4.212 0.105 -8.300 352 HB1 ALA 61 1HB ALA 61 -2.957 2.161 -6.482 353 HB2 ALA 61 2HB ALA 61 -2.263 1.540 -7.980 354 HB3 ALA 61 3HB ALA 61 -2.490 0.464 -6.602 355 H ILE 62 H ILE 62 -5.412 2.544 -6.031 356 HA ILE 62 HA ILE 62 -6.059 0.863 -3.895 357 HB ILE 62 HB ILE 62 -7.430 3.411 -4.776 358 HG12 ILE 62 1HG1 ILE 62 -5.380 2.904 -2.608 359 HG13 ILE 62 2HG1 ILE 62 -5.032 3.617 -4.181 360 HG21 ILE 62 1HG2 ILE 62 -8.319 3.523 -2.486 361 HG22 ILE 62 2HG2 ILE 62 -7.662 1.920 -2.167 362 HG23 ILE 62 3HG2 ILE 62 -8.931 2.127 -3.371 363 HD11 ILE 62 1HD1 ILE 62 -6.833 4.787 -2.074 364 HD12 ILE 62 2HD1 ILE 62 -6.478 5.502 -3.647 365 HD13 ILE 62 3HD1 ILE 62 -5.192 5.313 -2.453 366 H LYS 63 H LYS 63 -8.127 1.909 -6.607 367 HA LYS 63 HA LYS 63 -10.380 0.418 -5.736 368 HB2 LYS 63 1HB LYS 63 -10.481 2.393 -7.266 369 HB3 LYS 63 2HB LYS 63 -9.788 1.395 -8.535 370 HG2 LYS 63 1HG LYS 63 -11.710 -0.057 -8.508 371 HG3 LYS 63 2HG LYS 63 -12.387 0.812 -7.131 372 HD2 LYS 63 1HD LYS 63 -13.479 1.506 -9.184 373 HD3 LYS 63 2HD LYS 63 -12.546 2.842 -8.508 374 HE2 LYS 63 1HE LYS 63 -10.740 2.384 -10.083 375 HE3 LYS 63 2HE LYS 63 -11.652 1.030 -10.747 376 HZ1 LYS 63 1HZ LYS 63 -11.823 3.085 -12.072 377 HZ2 LYS 63 2HZ LYS 63 -12.591 3.844 -10.771 378 HZ3 LYS 63 3HZ LYS 63 -13.323 2.522 -11.532 379 H LYS 64 H LYS 64 -7.645 -0.306 -7.798 380 HA LYS 64 HA LYS 64 -8.617 -2.706 -8.923 381 HB2 LYS 64 1HB LYS 64 -6.617 -1.506 -9.759 382 HB3 LYS 64 2HB LYS 64 -5.758 -1.941 -8.288 383 HG2 LYS 64 1HG LYS 64 -5.979 -4.310 -8.870 384 HG3 LYS 64 2HG LYS 64 -6.808 -3.857 -10.360 385 HD2 LYS 64 1HD LYS 64 -4.812 -2.616 -11.077 386 HD3 LYS 64 2HD LYS 64 -3.986 -3.104 -9.595 387 HE2 LYS 64 1HE LYS 64 -3.285 -4.542 -11.388 388 HE3 LYS 64 2HE LYS 64 -4.276 -5.470 -10.266 389 HZ1 LYS 64 1HZ LYS 64 -6.158 -5.180 -11.775 390 HZ2 LYS 64 2HZ LYS 64 -4.869 -5.964 -12.535 391 HZ3 LYS 64 3HZ LYS 64 -5.171 -4.334 -12.857 392 H ALA 65 H ALA 65 -6.674 -2.041 -6.033 393 HA ALA 65 HA ALA 65 -6.423 -4.683 -5.125 394 HB1 ALA 65 1HB ALA 65 -6.525 -2.141 -3.500 395 HB2 ALA 65 2HB ALA 65 -5.085 -2.829 -4.252 396 HB3 ALA 65 3HB ALA 65 -5.900 -3.698 -2.953 397 H ASP 66 H ASP 66 -8.903 -2.244 -4.600 398 HA ASP 66 HA ASP 66 -10.518 -3.556 -2.754 399 HB2 ASP 66 1HB ASP 66 -10.914 -1.239 -3.406 400 HB3 ASP 66 2HB ASP 66 -11.306 -1.738 -5.045 401 H ASP 67 H ASP 67 -10.731 -3.610 -6.308 402 HA ASP 67 HA ASP 67 -12.856 -5.420 -6.492 403 HB2 ASP 67 1HB ASP 67 -10.703 -4.582 -8.398 404 HB3 ASP 67 2HB ASP 67 -11.782 -5.905 -8.827 405 H ILE 68 H ILE 68 -9.350 -6.034 -6.598 406 HA ILE 68 HA ILE 68 -9.499 -8.763 -7.221 407 HB ILE 68 HB ILE 68 -7.368 -7.293 -5.659 408 HG12 ILE 68 1HG1 ILE 68 -7.517 -8.056 -8.584 409 HG13 ILE 68 2HG1 ILE 68 -7.760 -6.435 -7.942 410 HG21 ILE 68 1HG2 ILE 68 -5.885 -9.147 -6.236 411 HG22 ILE 68 2HG2 ILE 68 -7.230 -9.990 -6.999 412 HG23 ILE 68 3HG2 ILE 68 -7.246 -9.703 -5.261 413 HD11 ILE 68 1HD1 ILE 68 -5.539 -6.703 -8.890 414 HD12 ILE 68 2HD1 ILE 68 -5.213 -8.029 -7.774 415 HD13 ILE 68 3HD1 ILE 68 -5.457 -6.395 -7.155 416 H ALA 69 H ALA 69 -9.661 -7.082 -4.145 417 HA ALA 69 HA ALA 69 -9.385 -9.339 -2.469 418 HB1 ALA 69 1HB ALA 69 -10.828 -6.760 -1.872 419 HB2 ALA 69 2HB ALA 69 -9.088 -6.998 -1.726 420 HB3 ALA 69 3HB ALA 69 -10.190 -7.914 -0.698 421 H LYS 70 H LYS 70 -12.212 -7.732 -3.863 422 HA LYS 70 HA LYS 70 -14.090 -9.129 -2.240 423 HB2 LYS 70 1HB LYS 70 -14.721 -7.883 -4.895 424 HB3 LYS 70 2HB LYS 70 -15.784 -8.060 -3.510 425 HG2 LYS 70 1HG LYS 70 -13.426 -6.200 -3.715 426 HG3 LYS 70 2HG LYS 70 -15.126 -5.748 -3.816 427 HD2 LYS 70 1HD LYS 70 -15.467 -6.468 -1.512 428 HD3 LYS 70 2HD LYS 70 -13.783 -6.985 -1.414 429 HE2 LYS 70 1HE LYS 70 -14.132 -4.790 -0.371 430 HE3 LYS 70 2HE LYS 70 -13.031 -4.706 -1.744 431 HZ1 LYS 70 1HZ LYS 70 -15.876 -3.871 -1.671 432 HZ2 LYS 70 2HZ LYS 70 -14.976 -3.991 -3.097 433 HZ3 LYS 70 3HZ LYS 70 -14.515 -2.886 -1.906 434 H LYS 71 H LYS 71 -12.679 -9.716 -5.359 435 HA LYS 71 HA LYS 71 -14.455 -11.522 -6.444 436 HB2 LYS 71 1HB LYS 71 -11.433 -11.607 -6.535 437 HB3 LYS 71 2HB LYS 71 -12.496 -12.507 -7.603 438 HG2 LYS 71 1HG LYS 71 -13.343 -10.466 -8.559 439 HG3 LYS 71 2HG LYS 71 -12.416 -9.504 -7.409 440 HD2 LYS 71 1HD LYS 71 -11.266 -9.518 -9.526 441 HD3 LYS 71 2HD LYS 71 -10.334 -10.456 -8.361 442 HE2 LYS 71 1HE LYS 71 -10.346 -11.642 -10.439 443 HE3 LYS 71 2HE LYS 71 -11.363 -12.521 -9.302 444 HZ1 LYS 71 1HZ LYS 71 -13.310 -11.555 -10.340 445 HZ2 LYS 71 2HZ LYS 71 -12.377 -12.363 -11.493 446 HZ3 LYS 71 3HZ LYS 71 -12.343 -10.675 -11.412 447 H GLN 72 H GLN 72 -11.982 -12.034 -3.996 448 HA GLN 72 HA GLN 72 -13.029 -14.762 -3.657 449 HB2 GLN 72 1HB GLN 72 -10.699 -15.472 -3.074 450 HB3 GLN 72 2HB GLN 72 -10.958 -15.034 -4.755 451 HG2 GLN 72 1HG GLN 72 -9.987 -12.806 -4.268 452 HG3 GLN 72 2HG GLN 72 -9.622 -13.366 -2.637 453 HE21 GLN 72 1HE2 GLN 72 -8.018 -14.927 -2.339 454 HE22 GLN 72 2HE2 GLN 72 -6.848 -15.276 -3.566 455 H ASN 73 H ASN 73 -11.367 -12.097 -1.916 456 HA ASN 73 HA ASN 73 -11.681 -13.715 0.498 457 HB2 ASN 73 1HB ASN 73 -9.336 -13.255 -0.591 458 HB3 ASN 73 2HB ASN 73 -9.463 -11.750 0.310 459 HD21 ASN 73 1HD2 ASN 73 -7.614 -13.969 0.634 460 HD22 ASN 73 2HD2 ASN 73 -7.808 -14.543 2.256 461 H SER 74 H SER 74 -13.376 -11.355 -0.511 462 HA SER 74 HA SER 74 -12.868 -9.122 1.089 463 HB2 SER 74 1HB SER 74 -15.423 -8.737 0.758 464 HB3 SER 74 2HB SER 74 -14.319 -8.656 -0.605 465 HG SER 74 HG SER 74 -16.116 -10.704 0.119 466 H SER 75 H SER 75 -13.419 -12.000 2.472 467 HA SER 75 HA SER 75 -15.103 -11.424 4.622 468 HB2 SER 75 1HB SER 75 -12.462 -12.905 4.734 469 HB3 SER 75 2HB SER 75 -13.809 -13.068 5.861 470 HG SER 75 HG SER 75 -14.897 -14.232 4.435 471 H GLU 76 H GLU 76 -11.874 -10.408 3.807 472 HA GLU 76 HA GLU 76 -12.072 -8.019 5.315 473 HB2 GLU 76 1HB GLU 76 -11.513 -9.557 7.169 474 HB3 GLU 76 2HB GLU 76 -10.076 -10.065 6.301 475 HG2 GLU 76 1HG GLU 76 -9.332 -7.646 6.378 476 HG3 GLU 76 2HG GLU 76 -10.655 -7.384 7.512 477 H ALA 77 H ALA 77 -10.468 -6.542 4.656 478 HA ALA 77 HA ALA 77 -8.409 -7.584 2.843 479 HB1 ALA 77 1HB ALA 77 -8.831 -5.781 1.250 480 HB2 ALA 77 2HB ALA 77 -10.193 -5.233 2.227 481 HB3 ALA 77 3HB ALA 77 -10.249 -6.811 1.442 482 H LYS 78 H LYS 78 -6.476 -6.872 3.366 483 HA LYS 78 HA LYS 78 -6.252 -4.382 4.923 484 HB2 LYS 78 1HB LYS 78 -4.661 -6.926 4.952 485 HB3 LYS 78 2HB LYS 78 -3.925 -5.422 5.477 486 HG2 LYS 78 1HG LYS 78 -5.497 -5.189 7.258 487 HG3 LYS 78 2HG LYS 78 -6.458 -6.543 6.654 488 HD2 LYS 78 1HD LYS 78 -4.853 -8.117 7.281 489 HD3 LYS 78 2HD LYS 78 -3.574 -6.910 7.386 490 HE2 LYS 78 1HE LYS 78 -4.316 -7.735 9.593 491 HE3 LYS 78 2HE LYS 78 -4.529 -5.998 9.395 492 HZ1 LYS 78 1HZ LYS 78 -6.826 -6.224 9.209 493 HZ2 LYS 78 2HZ LYS 78 -6.413 -7.311 10.445 494 HZ3 LYS 78 3HZ LYS 78 -6.747 -7.891 8.886 495 H ILE 79 H ILE 79 -5.348 -2.726 3.906 496 HA ILE 79 HA ILE 79 -3.561 -3.287 1.632 497 HB ILE 79 HB ILE 79 -5.518 -0.986 1.812 498 HG12 ILE 79 1HG1 ILE 79 -5.632 -3.469 0.082 499 HG13 ILE 79 2HG1 ILE 79 -6.659 -3.154 1.479 500 HG21 ILE 79 1HG2 ILE 79 -4.890 -0.584 -0.531 501 HG22 ILE 79 2HG2 ILE 79 -3.706 -1.886 -0.428 502 HG23 ILE 79 3HG2 ILE 79 -3.509 -0.435 0.555 503 HD11 ILE 79 1HD1 ILE 79 -6.586 -1.529 -1.055 504 HD12 ILE 79 2HD1 ILE 79 -7.622 -1.227 0.341 505 HD13 ILE 79 3HD1 ILE 79 -7.824 -2.702 -0.605 506 H LEU 80 H LEU 80 -1.626 -2.359 1.763 507 HA LEU 80 HA LEU 80 -1.209 -0.250 3.787 508 HB2 LEU 80 1HB LEU 80 -0.039 -2.442 4.116 509 HB3 LEU 80 2HB LEU 80 0.812 -2.162 2.605 510 HG LEU 80 HG LEU 80 1.789 -0.079 3.649 511 HD11 LEU 80 1HD1 LEU 80 0.149 0.262 5.404 512 HD12 LEU 80 2HD1 LEU 80 1.760 0.062 6.092 513 HD13 LEU 80 3HD1 LEU 80 0.604 -1.269 6.152 514 HD21 LEU 80 1HD2 LEU 80 3.404 -1.360 5.030 515 HD22 LEU 80 2HD2 LEU 80 3.103 -2.080 3.449 516 HD23 LEU 80 3HD2 LEU 80 2.352 -2.768 4.888 517 H ILE 81 H ILE 81 -0.974 1.730 2.898 518 HA ILE 81 HA ILE 81 0.062 1.899 0.149 519 HB ILE 81 HB ILE 81 -1.433 3.988 1.752 520 HG12 ILE 81 1HG1 ILE 81 -2.305 2.407 -0.676 521 HG13 ILE 81 2HG1 ILE 81 -2.813 2.064 0.974 522 HG21 ILE 81 1HG2 ILE 81 -0.465 4.051 -1.106 523 HG22 ILE 81 2HG2 ILE 81 0.156 5.021 0.229 524 HG23 ILE 81 3HG2 ILE 81 -1.492 5.267 -0.345 525 HD11 ILE 81 1HD1 ILE 81 -3.912 4.232 1.094 526 HD12 ILE 81 2HD1 ILE 81 -4.517 3.287 -0.266 527 HD13 ILE 81 3HD1 ILE 81 -3.373 4.603 -0.545 528 H LEU 82 H LEU 82 2.240 1.941 0.320 529 HA LEU 82 HA LEU 82 3.522 3.667 2.292 530 HB2 LEU 82 1HB LEU 82 4.787 1.921 0.174 531 HB3 LEU 82 2HB LEU 82 5.603 2.678 1.528 532 HG LEU 82 HG LEU 82 3.616 0.411 1.648 533 HD11 LEU 82 1HD1 LEU 82 5.848 -0.247 0.959 534 HD12 LEU 82 2HD1 LEU 82 5.502 -0.823 2.590 535 HD13 LEU 82 3HD1 LEU 82 6.537 0.585 2.353 536 HD21 LEU 82 1HD2 LEU 82 4.185 0.423 4.094 537 HD22 LEU 82 2HD2 LEU 82 3.159 1.742 3.538 538 HD23 LEU 82 3HD2 LEU 82 4.873 2.030 3.846 539 H LEU 83 H LEU 83 3.325 5.764 1.665 540 HA LEU 83 HA LEU 83 4.268 6.422 -1.050 541 HB2 LEU 83 1HB LEU 83 2.778 8.513 -0.711 542 HB3 LEU 83 2HB LEU 83 2.035 6.997 -1.182 543 HG LEU 83 HG LEU 83 1.429 6.641 1.240 544 HD11 LEU 83 1HD1 LEU 83 2.260 9.524 1.487 545 HD12 LEU 83 2HD1 LEU 83 3.073 8.148 2.228 546 HD13 LEU 83 3HD1 LEU 83 1.431 8.569 2.717 547 HD21 LEU 83 1HD2 LEU 83 0.332 9.106 -0.103 548 HD22 LEU 83 2HD2 LEU 83 -0.458 8.182 1.174 549 HD23 LEU 83 3HD2 LEU 83 -0.182 7.446 -0.404 550 H GLU 84 H GLU 84 5.228 8.653 -1.222 551 HA GLU 84 HA GLU 84 6.462 9.395 1.348 552 HB2 GLU 84 1HB GLU 84 8.030 8.940 -0.551 553 HB3 GLU 84 2HB GLU 84 7.282 10.262 -1.439 554 HG2 GLU 84 1HG GLU 84 7.963 11.811 0.352 555 HG3 GLU 84 2HG GLU 84 8.780 10.477 1.163 556 H LYS 85 H LYS 85 5.010 10.641 2.275 557 HA LYS 85 HA LYS 85 4.657 13.309 1.458 558 HB2 LYS 85 1HB LYS 85 3.077 12.162 -0.129 559 HB3 LYS 85 2HB LYS 85 2.177 11.584 1.265 560 HG2 LYS 85 1HG LYS 85 1.748 13.911 1.924 561 HG3 LYS 85 2HG LYS 85 2.596 14.451 0.473 562 HD2 LYS 85 1HD LYS 85 0.973 13.235 -0.910 563 HD3 LYS 85 2HD LYS 85 0.110 12.746 0.552 564 HE2 LYS 85 1HE LYS 85 0.507 15.560 -0.457 565 HE3 LYS 85 2HE LYS 85 -1.001 14.650 -0.433 566 HZ1 LYS 85 1HZ LYS 85 -0.933 16.182 1.399 567 HZ2 LYS 85 2HZ LYS 85 0.542 15.554 1.936 568 HZ3 LYS 85 3HZ LYS 85 -0.852 14.603 1.998 569 HA PRO 86 HA PRO 86 3.586 13.259 5.872 570 HB2 PRO 86 1HB PRO 86 2.779 16.051 5.399 571 HB3 PRO 86 2HB PRO 86 3.989 15.413 6.514 572 HG2 PRO 86 1HG PRO 86 4.676 16.787 4.306 573 HG3 PRO 86 2HG PRO 86 5.664 15.455 4.931 574 HD2 PRO 86 1HD PRO 86 3.749 15.477 2.631 575 HD3 PRO 86 2HD PRO 86 5.333 14.687 2.774 576 H VAL 87 H VAL 87 1.665 12.395 6.461 577 HA VAL 87 HA VAL 87 -0.739 13.331 5.047 578 HB VAL 87 HB VAL 87 -1.616 10.993 5.192 579 HG11 VAL 87 1HG1 VAL 87 -0.331 10.157 3.280 580 HG12 VAL 87 2HG1 VAL 87 0.903 11.381 3.579 581 HG13 VAL 87 3HG1 VAL 87 -0.725 11.866 3.106 582 HG21 VAL 87 1HG2 VAL 87 -0.010 9.164 5.503 583 HG22 VAL 87 2HG2 VAL 87 -0.161 10.153 6.955 584 HG23 VAL 87 3HG2 VAL 87 1.243 10.338 5.905 585 H SER 88 H SER 88 -2.598 13.509 6.145 586 HA SER 88 HA SER 88 -2.551 13.102 9.045 587 HB2 SER 88 1HB SER 88 -3.250 15.325 8.335 588 HB3 SER 88 2HB SER 88 -4.445 14.641 7.243 589 HG SER 88 HG SER 88 -4.802 15.334 9.734 590 HA PRO 89 HA PRO 89 -4.933 9.383 8.829 591 HB2 PRO 89 1HB PRO 89 -6.538 9.782 11.046 592 HB3 PRO 89 2HB PRO 89 -4.891 9.148 11.090 593 HG2 PRO 89 1HG PRO 89 -5.864 11.933 11.571 594 HG3 PRO 89 2HG PRO 89 -4.614 11.018 12.433 595 HD2 PRO 89 1HD PRO 89 -3.965 12.893 10.648 596 HD3 PRO 89 2HD PRO 89 -3.027 11.391 10.778 597 H GLU 90 H GLU 90 -6.442 12.498 8.834 598 HA GLU 90 HA GLU 90 -9.107 11.727 8.314 599 HB2 GLU 90 1HB GLU 90 -8.606 13.995 8.944 600 HB3 GLU 90 2HB GLU 90 -7.533 14.197 7.567 601 HG2 GLU 90 1HG GLU 90 -9.633 15.352 7.223 602 HG3 GLU 90 2HG GLU 90 -9.425 14.054 6.054 603 H TYR 91 H TYR 91 -6.351 12.383 6.173 604 HA TYR 91 HA TYR 91 -7.818 11.907 3.773 605 HB2 TYR 91 1HB TYR 91 -4.844 11.982 4.309 606 HB3 TYR 91 2HB TYR 91 -5.553 11.835 2.703 607 HD1 TYR 91 HD1 TYR 91 -6.747 13.719 1.694 608 HD2 TYR 91 HD2 TYR 91 -4.902 14.070 5.506 609 HE1 TYR 91 HE1 TYR 91 -6.942 16.166 1.556 610 HE2 TYR 91 HE2 TYR 91 -5.090 16.518 5.382 611 HH TYR 91 HH TYR 91 -7.008 18.094 3.043 612 H GLU 92 H GLU 92 -6.007 9.942 5.998 613 HA GLU 92 HA GLU 92 -5.846 7.577 4.507 614 HB2 GLU 92 1HB GLU 92 -4.663 7.776 6.599 615 HB3 GLU 92 2HB GLU 92 -6.162 8.041 7.477 616 HG2 GLU 92 1HG GLU 92 -6.871 5.773 6.975 617 HG3 GLU 92 2HG GLU 92 -5.384 5.494 6.074 618 H LYS 93 H LYS 93 -8.388 8.921 6.539 619 HA LYS 93 HA LYS 93 -10.168 6.738 6.373 620 HB2 LYS 93 1HB LYS 93 -10.300 8.455 8.130 621 HB3 LYS 93 2HB LYS 93 -10.722 9.662 6.924 622 HG2 LYS 93 1HG LYS 93 -12.779 8.403 6.425 623 HG3 LYS 93 2HG LYS 93 -12.364 7.262 7.706 624 HD2 LYS 93 1HD LYS 93 -12.447 9.049 9.351 625 HD3 LYS 93 2HD LYS 93 -12.788 10.224 8.081 626 HE2 LYS 93 1HE LYS 93 -14.883 9.083 7.578 627 HE3 LYS 93 2HE LYS 93 -14.538 7.884 8.822 628 HZ1 LYS 93 1HZ LYS 93 -14.941 10.790 9.281 629 HZ2 LYS 93 2HZ LYS 93 -14.598 9.645 10.478 630 HZ3 LYS 93 3HZ LYS 93 -16.058 9.568 9.626 631 H LYS 94 H LYS 94 -9.540 9.508 4.339 632 HA LYS 94 HA LYS 94 -11.896 9.288 2.756 633 HB2 LYS 94 1HB LYS 94 -9.233 10.508 2.001 634 HB3 LYS 94 2HB LYS 94 -10.771 10.788 1.196 635 HG2 LYS 94 1HG LYS 94 -11.625 11.771 3.319 636 HG3 LYS 94 2HG LYS 94 -9.996 11.624 3.983 637 HD2 LYS 94 1HD LYS 94 -9.197 12.992 2.029 638 HD3 LYS 94 2HD LYS 94 -10.890 13.284 1.633 639 HE2 LYS 94 1HE LYS 94 -9.418 14.096 4.131 640 HE3 LYS 94 2HE LYS 94 -10.084 15.152 2.890 641 HZ1 LYS 94 1HZ LYS 94 -11.575 15.207 4.686 642 HZ2 LYS 94 2HZ LYS 94 -11.561 13.530 4.883 643 HZ3 LYS 94 3HZ LYS 94 -12.315 14.218 3.529 644 H LEU 95 H LEU 95 -8.571 8.104 2.390 645 HA LEU 95 HA LEU 95 -9.095 6.753 -0.073 646 HB2 LEU 95 1HB LEU 95 -6.877 6.307 1.929 647 HB3 LEU 95 2HB LEU 95 -6.913 5.680 0.294 648 HG LEU 95 HG LEU 95 -6.751 8.592 1.075 649 HD11 LEU 95 1HD1 LEU 95 -4.727 6.754 -0.193 650 HD12 LEU 95 2HD1 LEU 95 -4.675 7.387 1.454 651 HD13 LEU 95 3HD1 LEU 95 -4.521 8.483 0.081 652 HD21 LEU 95 1HD2 LEU 95 -8.038 8.338 -0.964 653 HD22 LEU 95 2HD2 LEU 95 -6.786 7.301 -1.650 654 HD23 LEU 95 3HD2 LEU 95 -6.444 9.001 -1.328 655 H GLN 96 H GLN 96 -9.139 5.862 3.315 656 HA GLN 96 HA GLN 96 -9.585 3.092 2.989 657 HB2 GLN 96 1HB GLN 96 -8.861 4.228 5.099 658 HB3 GLN 96 2HB GLN 96 -10.464 4.914 5.249 659 HG2 GLN 96 1HG GLN 96 -10.082 1.939 5.148 660 HG3 GLN 96 2HG GLN 96 -9.826 2.842 6.637 661 HE21 GLN 96 1HE2 GLN 96 -11.908 4.783 6.093 662 HE22 GLN 96 2HE2 GLN 96 -13.411 3.969 6.327 663 H LYS 97 H LYS 97 -11.628 5.901 2.803 664 HA LYS 97 HA LYS 97 -14.104 4.427 2.793 665 HB2 LYS 97 1HB LYS 97 -14.027 6.744 3.570 666 HB3 LYS 97 2HB LYS 97 -13.484 7.275 1.987 667 HG2 LYS 97 1HG LYS 97 -15.847 7.749 2.338 668 HG3 LYS 97 2HG LYS 97 -15.607 6.611 1.012 669 HD2 LYS 97 1HD LYS 97 -16.179 4.755 2.481 670 HD3 LYS 97 2HD LYS 97 -16.373 5.869 3.835 671 HE2 LYS 97 1HE LYS 97 -18.207 6.974 2.678 672 HE3 LYS 97 2HE LYS 97 -17.994 5.908 1.292 673 HZ1 LYS 97 1HZ LYS 97 -19.811 5.193 2.719 674 HZ2 LYS 97 2HZ LYS 97 -18.752 5.038 4.027 675 HZ3 LYS 97 3HZ LYS 97 -18.583 4.033 2.678 676 H TYR 98 H TYR 98 -11.702 5.198 0.466 677 HA TYR 98 HA TYR 98 -13.413 5.197 -1.833 678 HB2 TYR 98 1HB TYR 98 -11.129 6.316 -1.639 679 HB3 TYR 98 2HB TYR 98 -10.432 4.709 -1.818 680 HD1 TYR 98 HD1 TYR 98 -12.892 6.948 -3.507 681 HD2 TYR 98 HD2 TYR 98 -9.840 4.026 -3.953 682 HE1 TYR 98 HE1 TYR 98 -13.013 7.210 -5.945 683 HE2 TYR 98 HE2 TYR 98 -9.953 4.273 -6.397 684 HH TYR 98 HH TYR 98 -11.695 6.836 -7.899 685 H ALA 99 H ALA 99 -11.269 2.853 -0.292 686 HA ALA 99 HA ALA 99 -12.505 0.730 -1.925 687 HB1 ALA 99 1HB ALA 99 -10.140 0.871 -2.387 688 HB2 ALA 99 2HB ALA 99 -10.455 -0.590 -1.452 689 HB3 ALA 99 3HB ALA 99 -9.767 0.831 -0.665 690 H ASP 100 H ASP 100 -13.551 -0.890 -0.845 691 HA ASP 100 HA ASP 100 -13.983 -0.480 1.973 692 HB2 ASP 100 1HB ASP 100 -15.865 -1.232 0.648 693 HB3 ASP 100 2HB ASP 100 -14.964 -2.637 0.090 694 H ALA 101 H ALA 101 -12.344 -0.893 3.180 695 HA ALA 101 HA ALA 101 -11.354 -3.475 3.723 696 HB1 ALA 101 1HB ALA 101 -9.506 -1.666 2.153 697 HB2 ALA 101 2HB ALA 101 -10.203 -3.174 1.561 698 HB3 ALA 101 3HB ALA 101 -9.058 -3.198 2.904 699 H GLU 102 H GLU 102 -9.070 -3.026 4.947 700 HA GLU 102 HA GLU 102 -9.388 -0.461 6.334 701 HB2 GLU 102 1HB GLU 102 -8.276 -1.422 8.247 702 HB3 GLU 102 2HB GLU 102 -9.697 -2.352 7.851 703 HG2 GLU 102 1HG GLU 102 -8.486 -4.187 7.169 704 HG3 GLU 102 2HG GLU 102 -7.045 -3.232 6.814 705 H VAL 103 H VAL 103 -8.195 0.713 4.844 706 HA VAL 103 HA VAL 103 -5.555 -0.209 4.140 707 HB VAL 103 HB VAL 103 -7.040 1.122 2.545 708 HG11 VAL 103 1HG1 VAL 103 -7.042 3.489 2.650 709 HG12 VAL 103 2HG1 VAL 103 -5.949 3.489 4.039 710 HG13 VAL 103 3HG1 VAL 103 -7.607 2.895 4.214 711 HG21 VAL 103 1HG2 VAL 103 -4.245 2.133 3.008 712 HG22 VAL 103 2HG2 VAL 103 -5.153 2.205 1.498 713 HG23 VAL 103 3HG2 VAL 103 -4.663 0.648 2.159 714 H ARG 104 H ARG 104 -3.695 0.452 4.927 715 HA ARG 104 HA ARG 104 -3.755 2.428 7.108 716 HB2 ARG 104 1HB ARG 104 -1.792 0.160 6.691 717 HB3 ARG 104 2HB ARG 104 -1.859 1.244 8.074 718 HG2 ARG 104 1HG ARG 104 -4.000 0.345 8.727 719 HG3 ARG 104 2HG ARG 104 -4.043 -0.671 7.285 720 HD2 ARG 104 1HD ARG 104 -1.997 -1.813 8.089 721 HD3 ARG 104 2HD ARG 104 -2.084 -0.856 9.568 722 HE ARG 104 HE ARG 104 -4.549 -2.145 9.177 723 HH11 ARG 104 1HH1 ARG 104 -1.228 -2.923 9.971 724 HH12 ARG 104 2HH1 ARG 104 -1.658 -4.324 10.896 725 HH21 ARG 104 1HH2 ARG 104 -5.104 -3.986 10.380 726 HH22 ARG 104 2HH2 ARG 104 -3.846 -4.951 11.117 727 H VAL 105 H VAL 105 -3.210 4.282 6.068 728 HA VAL 105 HA VAL 105 -1.366 4.253 3.895 729 HB VAL 105 HB VAL 105 -1.540 6.662 3.836 730 HG11 VAL 105 1HG1 VAL 105 -3.348 5.426 2.827 731 HG12 VAL 105 2HG1 VAL 105 -3.982 6.894 3.571 732 HG13 VAL 105 3HG1 VAL 105 -4.196 5.336 4.371 733 HG21 VAL 105 1HG2 VAL 105 -3.046 6.451 6.438 734 HG22 VAL 105 2HG2 VAL 105 -2.850 7.918 5.479 735 HG23 VAL 105 3HG2 VAL 105 -1.443 7.149 6.212 736 H ARG 106 H ARG 106 0.799 4.799 3.902 737 HA ARG 106 HA ARG 106 2.017 5.352 6.505 738 HB2 ARG 106 1HB ARG 106 1.928 2.869 6.052 739 HB3 ARG 106 2HB ARG 106 2.963 3.164 4.670 740 HG2 ARG 106 1HG ARG 106 4.213 2.361 6.591 741 HG3 ARG 106 2HG ARG 106 4.723 3.982 6.105 742 HD2 ARG 106 1HD ARG 106 4.546 3.804 8.535 743 HD3 ARG 106 2HD ARG 106 3.373 4.952 7.895 744 HE ARG 106 HE ARG 106 2.454 2.221 8.352 745 HH11 ARG 106 1HH1 ARG 106 2.594 5.535 9.474 746 HH12 ARG 106 2HH1 ARG 106 1.250 5.361 10.555 747 HH21 ARG 106 1HH2 ARG 106 0.704 1.979 9.791 748 HH22 ARG 106 2HH2 ARG 106 0.180 3.326 10.749 749 H THR 107 H THR 107 3.514 6.885 6.346 750 HA THR 107 HA THR 107 4.474 7.641 3.712 751 HB THR 107 HB THR 107 3.673 9.393 5.273 752 HG1 THR 107 HG1 THR 107 5.086 10.740 4.457 753 HG21 THR 107 1HG2 THR 107 4.452 8.436 7.384 754 HG22 THR 107 2HG2 THR 107 5.060 10.077 7.169 755 HG23 THR 107 3HG2 THR 107 6.124 8.699 6.894 756 H VAL 108 H VAL 108 6.389 7.080 2.929 757 HA VAL 108 HA VAL 108 8.365 5.924 4.789 758 HB VAL 108 HB VAL 108 9.237 4.633 2.846 759 HG11 VAL 108 1HG1 VAL 108 6.334 4.155 3.512 760 HG12 VAL 108 2HG1 VAL 108 7.722 3.593 4.443 761 HG13 VAL 108 3HG1 VAL 108 7.439 2.970 2.818 762 HG21 VAL 108 1HG2 VAL 108 7.837 4.387 0.848 763 HG22 VAL 108 2HG2 VAL 108 8.409 6.044 1.037 764 HG23 VAL 108 3HG2 VAL 108 6.748 5.632 1.460 765 H THR 109 H THR 109 10.498 6.518 4.594 766 HA THR 109 HA THR 109 10.960 8.934 2.996 767 HB THR 109 HB THR 109 12.992 9.082 4.646 768 HG1 THR 109 HG1 THR 109 12.819 7.898 6.441 769 HG21 THR 109 1HG2 THR 109 10.155 9.611 5.537 770 HG22 THR 109 2HG2 THR 109 11.149 10.689 4.557 771 HG23 THR 109 3HG2 THR 109 11.603 10.343 6.227 772 H SER 110 H SER 110 12.348 5.799 3.839 773 HA SER 110 HA SER 110 14.179 6.071 1.563 774 HB2 SER 110 1HB SER 110 14.991 4.887 4.226 775 HB3 SER 110 2HB SER 110 16.029 5.223 2.842 776 HG SER 110 HG SER 110 15.892 7.373 3.237 777 HA PRO 111 HA PRO 111 13.064 2.033 0.139 778 HB2 PRO 111 1HB PRO 111 15.886 1.194 0.669 779 HB3 PRO 111 2HB PRO 111 14.892 0.945 -0.771 780 HG2 PRO 111 1HG PRO 111 16.752 2.837 -0.741 781 HG3 PRO 111 2HG PRO 111 15.179 3.131 -1.507 782 HD2 PRO 111 1HD PRO 111 16.242 4.136 1.086 783 HD3 PRO 111 2HD PRO 111 15.125 4.910 -0.054 784 H ASP 112 H ASP 112 15.335 1.850 2.886 785 HA ASP 112 HA ASP 112 14.541 -0.720 3.720 786 HB2 ASP 112 1HB ASP 112 15.996 1.502 5.136 787 HB3 ASP 112 2HB ASP 112 15.656 -0.041 5.915 788 H GLU 113 H GLU 113 13.251 2.446 4.428 789 HA GLU 113 HA GLU 113 11.724 1.747 6.692 790 HB2 GLU 113 1HB GLU 113 11.372 3.899 4.612 791 HB3 GLU 113 2HB GLU 113 10.271 3.715 5.972 792 HG2 GLU 113 1HG GLU 113 13.227 4.261 6.123 793 HG3 GLU 113 2HG GLU 113 11.923 5.403 6.456 794 H ALA 114 H ALA 114 11.037 1.615 3.231 795 HA ALA 114 HA ALA 114 8.356 0.776 3.436 796 HB1 ALA 114 1HB ALA 114 9.320 1.576 1.336 797 HB2 ALA 114 2HB ALA 114 8.618 -0.029 1.138 798 HB3 ALA 114 3HB ALA 114 10.366 0.158 1.268 799 H LYS 115 H LYS 115 11.384 -1.030 3.141 800 HA LYS 115 HA LYS 115 10.362 -3.626 3.187 801 HB2 LYS 115 1HB LYS 115 12.976 -2.681 4.387 802 HB3 LYS 115 2HB LYS 115 12.599 -4.312 3.845 803 HG2 LYS 115 1HG LYS 115 12.472 -3.580 1.557 804 HG3 LYS 115 2HG LYS 115 12.676 -1.899 2.044 805 HD2 LYS 115 1HD LYS 115 14.771 -2.723 1.199 806 HD3 LYS 115 2HD LYS 115 14.918 -2.489 2.939 807 HE2 LYS 115 1HE LYS 115 14.688 -4.838 3.337 808 HE3 LYS 115 2HE LYS 115 14.308 -5.136 1.640 809 HZ1 LYS 115 1HZ LYS 115 16.897 -4.086 2.648 810 HZ2 LYS 115 2HZ LYS 115 16.526 -4.455 1.035 811 HZ3 LYS 115 3HZ LYS 115 16.608 -5.688 2.193 812 H ARG 116 H ARG 116 11.347 -1.499 5.814 813 HA ARG 116 HA ARG 116 10.952 -3.054 8.042 814 HB2 ARG 116 1HB ARG 116 11.853 -0.897 8.324 815 HB3 ARG 116 2HB ARG 116 10.510 -0.131 7.492 816 HG2 ARG 116 1HG ARG 116 9.058 -0.819 9.425 817 HG3 ARG 116 2HG ARG 116 10.538 -1.296 10.261 818 HD2 ARG 116 1HD ARG 116 11.399 0.954 10.113 819 HD3 ARG 116 2HD ARG 116 10.020 1.453 9.137 820 HE ARG 116 HE ARG 116 9.201 0.403 11.652 821 HH11 ARG 116 1HH1 ARG 116 10.501 3.279 10.111 822 HH12 ARG 116 2HH1 ARG 116 9.869 4.350 11.323 823 HH21 ARG 116 1HH2 ARG 116 8.368 1.828 13.228 824 HH22 ARG 116 2HH2 ARG 116 8.671 3.532 13.087 825 H TRP 117 H TRP 117 8.493 -0.985 6.480 826 HA TRP 117 HA TRP 117 6.426 -1.872 8.231 827 HB2 TRP 117 1HB TRP 117 6.307 -0.335 5.635 828 HB3 TRP 117 2HB TRP 117 4.914 -0.634 6.671 829 HD1 TRP 117 HD1 TRP 117 7.533 1.865 6.074 830 HE1 TRP 117 HE1 TRP 117 7.649 3.556 8.007 831 HE3 TRP 117 HE3 TRP 117 4.709 -0.644 9.513 832 HZ2 TRP 117 HZ2 TRP 117 6.670 3.798 10.641 833 HZ3 TRP 117 HZ3 TRP 117 4.346 0.388 11.717 834 HH2 TRP 117 HH2 TRP 117 5.308 2.564 12.269 835 H ILE 118 H ILE 118 7.495 -2.811 5.023 836 HA ILE 118 HA ILE 118 5.277 -4.303 4.230 837 HB ILE 118 HB ILE 118 8.196 -4.541 3.552 838 HG12 ILE 118 1HG1 ILE 118 5.784 -3.699 1.933 839 HG13 ILE 118 2HG1 ILE 118 6.890 -2.593 2.740 840 HG21 ILE 118 1HG2 ILE 118 5.943 -6.184 2.413 841 HG22 ILE 118 2HG2 ILE 118 7.306 -6.785 3.355 842 HG23 ILE 118 3HG2 ILE 118 7.574 -6.100 1.751 843 HD11 ILE 118 1HD1 ILE 118 8.709 -3.384 1.328 844 HD12 ILE 118 2HD1 ILE 118 7.368 -2.755 0.370 845 HD13 ILE 118 3HD1 ILE 118 7.601 -4.496 0.525 846 H LYS 119 H LYS 119 8.180 -5.399 6.007 847 HA LYS 119 HA LYS 119 7.310 -8.080 6.227 848 HB2 LYS 119 1HB LYS 119 9.649 -7.475 6.546 849 HB3 LYS 119 2HB LYS 119 9.232 -6.534 7.970 850 HG2 LYS 119 1HG LYS 119 8.512 -8.557 9.117 851 HG3 LYS 119 2HG LYS 119 8.882 -9.512 7.681 852 HD2 LYS 119 1HD LYS 119 11.230 -8.929 7.869 853 HD3 LYS 119 2HD LYS 119 10.882 -7.893 9.256 854 HE2 LYS 119 1HE LYS 119 10.346 -10.857 9.169 855 HE3 LYS 119 2HE LYS 119 11.795 -10.133 9.857 856 HZ1 LYS 119 1HZ LYS 119 9.013 -9.659 10.785 857 HZ2 LYS 119 2HZ LYS 119 10.393 -8.939 11.435 858 HZ3 LYS 119 3HZ LYS 119 10.172 -10.610 11.569 859 H GLU 120 H GLU 120 6.901 -5.264 8.329 860 HA GLU 120 HA GLU 120 5.702 -6.694 10.465 861 HB2 GLU 120 1HB GLU 120 5.621 -3.773 9.721 862 HB3 GLU 120 2HB GLU 120 4.878 -4.419 11.179 863 HG2 GLU 120 1HG GLU 120 7.124 -5.302 11.828 864 HG3 GLU 120 2HG GLU 120 7.794 -4.418 10.459 865 H PHE 121 H PHE 121 4.471 -5.274 7.532 866 HA PHE 121 HA PHE 121 1.706 -5.518 8.238 867 HB2 PHE 121 1HB PHE 121 2.515 -3.907 6.557 868 HB3 PHE 121 2HB PHE 121 3.028 -5.236 5.529 869 HD1 PHE 121 HD1 PHE 121 1.634 -5.906 3.839 870 HD2 PHE 121 HD2 PHE 121 -0.035 -3.980 7.247 871 HE1 PHE 121 HE1 PHE 121 -0.574 -5.917 2.758 872 HE2 PHE 121 HE2 PHE 121 -2.248 -3.990 6.173 873 HZ PHE 121 HZ PHE 121 -2.519 -4.960 3.925 874 H SER 122 H SER 122 4.098 -7.507 6.641 875 HA SER 122 HA SER 122 2.338 -9.518 5.693 876 HB2 SER 122 1HB SER 122 5.267 -9.766 6.428 877 HB3 SER 122 2HB SER 122 4.352 -10.863 5.394 878 HG SER 122 HG SER 122 4.835 -8.108 4.867 879 H GLU 123 H GLU 123 4.260 -9.155 8.647 880 HA GLU 123 HA GLU 123 2.931 -11.497 9.794 881 HB2 GLU 123 1HB GLU 123 5.237 -9.824 10.812 882 HB3 GLU 123 2HB GLU 123 4.571 -11.223 11.644 883 HG2 GLU 123 1HG GLU 123 5.867 -11.242 8.926 884 HG3 GLU 123 2HG GLU 123 6.609 -11.783 10.431 885 H GLU 124 H GLU 124 0.910 -10.281 9.784 886 HA GLU 124 HA GLU 124 0.584 -8.771 12.269 887 HB2 GLU 124 1HB GLU 124 0.750 -7.368 10.003 888 HB3 GLU 124 2HB GLU 124 -0.932 -7.850 9.863 889 HG2 GLU 124 1HG GLU 124 0.216 -6.415 12.243 890 HG3 GLU 124 2HG GLU 124 -0.557 -5.614 10.883 Start of MODEL 8 1 HA MET 21 HA MET 21 -8.511 -12.116 3.035 2 HB2 MET 21 1HB MET 21 -7.337 -10.580 4.490 3 HB3 MET 21 2HB MET 21 -8.013 -11.874 5.462 4 HG2 MET 21 1HG MET 21 -5.149 -11.786 4.558 5 HG3 MET 21 2HG MET 21 -5.715 -11.155 6.102 6 HE1 MET 21 1HE MET 21 -6.938 -14.349 7.948 7 HE2 MET 21 2HE MET 21 -7.932 -13.282 6.958 8 HE3 MET 21 3HE MET 21 -6.705 -12.604 8.026 9 H THR 22 H THR 22 -7.584 -10.820 1.453 10 HA THR 22 HA THR 22 -4.894 -11.621 0.589 11 HB THR 22 HB THR 22 -6.709 -9.677 -0.839 12 HG1 THR 22 HG1 THR 22 -6.440 -12.421 -1.485 13 HG21 THR 22 1HG2 THR 22 -4.348 -9.673 -1.514 14 HG22 THR 22 2HG2 THR 22 -5.372 -10.332 -2.790 15 HG23 THR 22 3HG2 THR 22 -4.419 -11.415 -1.777 16 H LEU 23 H LEU 23 -3.152 -10.381 0.903 17 HA LEU 23 HA LEU 23 -3.580 -7.750 2.133 18 HB2 LEU 23 1HB LEU 23 -1.132 -9.516 2.167 19 HB3 LEU 23 2HB LEU 23 -1.283 -7.973 2.980 20 HG LEU 23 HG LEU 23 -2.821 -10.487 3.627 21 HD11 LEU 23 1HD1 LEU 23 -1.575 -10.385 5.730 22 HD12 LEU 23 2HD1 LEU 23 -0.679 -8.991 5.129 23 HD13 LEU 23 3HD1 LEU 23 -0.503 -10.560 4.343 24 HD21 LEU 23 1HD2 LEU 23 -4.219 -8.537 3.988 25 HD22 LEU 23 2HD2 LEU 23 -2.929 -7.756 4.902 26 HD23 LEU 23 3HD2 LEU 23 -3.700 -9.212 5.533 27 H PHE 24 H PHE 24 -2.928 -5.957 1.130 28 HA PHE 24 HA PHE 24 -1.404 -6.278 -1.375 29 HB2 PHE 24 1HB PHE 24 -3.502 -4.203 -0.714 30 HB3 PHE 24 2HB PHE 24 -2.609 -4.313 -2.226 31 HD1 PHE 24 HD1 PHE 24 -3.314 -5.731 -3.942 32 HD2 PHE 24 HD2 PHE 24 -5.054 -6.044 -0.081 33 HE1 PHE 24 HE1 PHE 24 -5.020 -7.243 -4.843 34 HE2 PHE 24 HE2 PHE 24 -6.765 -7.554 -0.967 35 HZ PHE 24 HZ PHE 24 -6.756 -8.158 -3.357 36 H VAL 25 H VAL 25 0.109 -4.710 -1.900 37 HA VAL 25 HA VAL 25 0.498 -2.571 0.053 38 HB VAL 25 HB VAL 25 2.257 -4.072 0.626 39 HG11 VAL 25 1HG1 VAL 25 3.881 -4.931 -0.972 40 HG12 VAL 25 2HG1 VAL 25 3.010 -4.149 -2.289 41 HG13 VAL 25 3HG1 VAL 25 2.249 -5.458 -1.387 42 HG21 VAL 25 1HG2 VAL 25 4.273 -2.725 -0.043 43 HG22 VAL 25 2HG2 VAL 25 2.943 -1.794 0.646 44 HG23 VAL 25 3HG2 VAL 25 3.207 -1.790 -1.098 45 H LEU 26 H LEU 26 0.436 -0.711 -0.827 46 HA LEU 26 HA LEU 26 0.981 -0.393 -3.694 47 HB2 LEU 26 1HB LEU 26 -0.802 0.948 -1.742 48 HB3 LEU 26 2HB LEU 26 -0.053 1.965 -2.947 49 HG LEU 26 HG LEU 26 -1.069 0.578 -4.727 50 HD11 LEU 26 1HD1 LEU 26 -2.492 -0.787 -2.462 51 HD12 LEU 26 2HD1 LEU 26 -1.249 -1.516 -3.480 52 HD13 LEU 26 3HD1 LEU 26 -2.792 -1.023 -4.184 53 HD21 LEU 26 1HD2 LEU 26 -3.050 1.608 -2.711 54 HD22 LEU 26 2HD2 LEU 26 -3.338 1.363 -4.433 55 HD23 LEU 26 3HD2 LEU 26 -2.189 2.585 -3.896 56 H ILE 27 H ILE 27 2.330 1.340 -4.338 57 HA ILE 27 HA ILE 27 3.796 2.717 -2.214 58 HB ILE 27 HB ILE 27 5.238 0.860 -2.753 59 HG12 ILE 27 1HG1 ILE 27 7.229 2.066 -3.715 60 HG13 ILE 27 2HG1 ILE 27 6.170 3.434 -4.037 61 HG21 ILE 27 1HG2 ILE 27 4.275 0.280 -4.926 62 HG22 ILE 27 2HG2 ILE 27 6.036 0.386 -4.998 63 HG23 ILE 27 3HG2 ILE 27 5.047 1.697 -5.642 64 HD11 ILE 27 1HD1 ILE 27 5.713 3.640 -1.650 65 HD12 ILE 27 2HD1 ILE 27 7.439 3.755 -1.997 66 HD13 ILE 27 3HD1 ILE 27 6.770 2.265 -1.331 67 H LEU 28 H LEU 28 3.270 4.816 -2.623 68 HA LEU 28 HA LEU 28 3.131 5.632 -5.442 69 HB2 LEU 28 1HB LEU 28 1.449 6.225 -3.457 70 HB3 LEU 28 2HB LEU 28 2.601 7.521 -3.198 71 HG LEU 28 HG LEU 28 2.261 8.165 -5.618 72 HD11 LEU 28 1HD1 LEU 28 0.011 7.374 -6.513 73 HD12 LEU 28 2HD1 LEU 28 0.128 6.073 -5.331 74 HD13 LEU 28 3HD1 LEU 28 1.352 6.233 -6.590 75 HD21 LEU 28 1HD2 LEU 28 1.227 9.384 -3.780 76 HD22 LEU 28 2HD2 LEU 28 -0.129 8.258 -3.792 77 HD23 LEU 28 3HD2 LEU 28 0.156 9.309 -5.178 78 H SER 29 H SER 29 5.405 5.255 -5.517 79 HA SER 29 HA SER 29 6.846 7.751 -5.207 80 HB2 SER 29 1HB SER 29 7.840 5.088 -4.147 81 HB3 SER 29 2HB SER 29 8.876 6.487 -4.397 82 HG SER 29 HG SER 29 8.091 7.397 -2.662 83 H ASN 30 H ASN 30 8.155 8.065 -7.112 84 HA ASN 30 HA ASN 30 8.603 5.542 -8.562 85 HB2 ASN 30 1HB ASN 30 9.036 6.993 -10.585 86 HB3 ASN 30 2HB ASN 30 7.376 6.988 -10.006 87 HD21 ASN 30 1HD2 ASN 30 10.198 8.866 -10.565 88 HD22 ASN 30 2HD2 ASN 30 9.522 10.402 -10.142 89 H ASP 31 H ASP 31 10.287 5.130 -7.089 90 HA ASP 31 HA ASP 31 12.787 6.181 -8.213 91 HB2 ASP 31 1HB ASP 31 12.596 6.642 -5.769 92 HB3 ASP 31 2HB ASP 31 12.438 4.914 -5.485 93 H LYS 32 H LYS 32 13.723 4.719 -9.523 94 HA LYS 32 HA LYS 32 12.490 2.212 -9.938 95 HB2 LYS 32 1HB LYS 32 15.124 3.264 -10.945 96 HB3 LYS 32 2HB LYS 32 14.330 1.803 -11.526 97 HG2 LYS 32 1HG LYS 32 12.309 3.396 -11.927 98 HG3 LYS 32 2HG LYS 32 13.544 4.654 -11.888 99 HD2 LYS 32 1HD LYS 32 13.630 2.224 -13.648 100 HD3 LYS 32 2HD LYS 32 13.040 3.804 -14.166 101 HE2 LYS 32 1HE LYS 32 15.267 4.747 -13.573 102 HE3 LYS 32 2HE LYS 32 15.827 3.108 -13.255 103 HZ1 LYS 32 1HZ LYS 32 16.421 3.864 -15.478 104 HZ2 LYS 32 2HZ LYS 32 14.788 4.087 -15.857 105 HZ3 LYS 32 3HZ LYS 32 15.377 2.536 -15.545 106 H LYS 33 H LYS 33 15.059 3.194 -7.860 107 HA LYS 33 HA LYS 33 16.133 0.517 -7.563 108 HB2 LYS 33 1HB LYS 33 16.747 3.066 -6.051 109 HB3 LYS 33 2HB LYS 33 17.592 1.544 -5.832 110 HG2 LYS 33 1HG LYS 33 19.014 2.708 -7.215 111 HG3 LYS 33 2HG LYS 33 18.097 1.734 -8.361 112 HD2 LYS 33 1HD LYS 33 18.024 3.785 -9.392 113 HD3 LYS 33 2HD LYS 33 16.545 3.852 -8.436 114 HE2 LYS 33 1HE LYS 33 19.203 5.018 -7.611 115 HE3 LYS 33 2HE LYS 33 17.879 5.932 -8.323 116 HZ1 LYS 33 1HZ LYS 33 16.505 5.303 -6.396 117 HZ2 LYS 33 2HZ LYS 33 17.872 6.198 -5.955 118 HZ3 LYS 33 3HZ LYS 33 17.846 4.527 -5.705 119 H LEU 34 H LEU 34 14.140 2.795 -5.780 120 HA LEU 34 HA LEU 34 13.823 1.292 -3.416 121 HB2 LEU 34 1HB LEU 34 13.227 3.648 -3.550 122 HB3 LEU 34 2HB LEU 34 11.974 3.279 -4.720 123 HG LEU 34 HG LEU 34 10.984 1.787 -2.853 124 HD11 LEU 34 1HD1 LEU 34 12.896 1.900 -1.362 125 HD12 LEU 34 2HD1 LEU 34 11.446 2.557 -0.602 126 HD13 LEU 34 3HD1 LEU 34 12.689 3.646 -1.219 127 HD21 LEU 34 1HD2 LEU 34 9.929 3.774 -3.730 128 HD22 LEU 34 2HD2 LEU 34 10.927 4.788 -2.685 129 HD23 LEU 34 3HD2 LEU 34 9.738 3.693 -1.978 130 H ILE 35 H ILE 35 11.755 1.586 -6.292 131 HA ILE 35 HA ILE 35 9.663 -0.047 -5.524 132 HB ILE 35 HB ILE 35 10.836 0.389 -8.272 133 HG12 ILE 35 1HG1 ILE 35 8.368 1.511 -6.928 134 HG13 ILE 35 2HG1 ILE 35 9.894 2.366 -7.125 135 HG21 ILE 35 1HG2 ILE 35 8.219 -0.938 -7.563 136 HG22 ILE 35 2HG2 ILE 35 9.629 -1.734 -8.264 137 HG23 ILE 35 3HG2 ILE 35 8.752 -0.513 -9.189 138 HD11 ILE 35 1HD1 ILE 35 8.264 3.075 -8.776 139 HD12 ILE 35 2HD1 ILE 35 8.104 1.415 -9.350 140 HD13 ILE 35 3HD1 ILE 35 9.632 2.275 -9.548 141 H GLU 36 H GLU 36 12.793 -0.921 -6.857 142 HA GLU 36 HA GLU 36 12.278 -3.631 -7.332 143 HB2 GLU 36 1HB GLU 36 14.833 -2.214 -6.600 144 HB3 GLU 36 2HB GLU 36 14.767 -3.928 -6.997 145 HG2 GLU 36 1HG GLU 36 13.965 -1.655 -8.777 146 HG3 GLU 36 2HG GLU 36 15.416 -2.642 -8.932 147 H GLU 37 H GLU 37 13.734 -2.143 -4.410 148 HA GLU 37 HA GLU 37 13.795 -4.690 -3.092 149 HB2 GLU 37 1HB GLU 37 14.323 -1.883 -2.131 150 HB3 GLU 37 2HB GLU 37 14.352 -3.263 -1.043 151 HG2 GLU 37 1HG GLU 37 16.077 -4.284 -2.558 152 HG3 GLU 37 2HG GLU 37 16.151 -2.728 -3.387 153 H ALA 38 H ALA 38 11.592 -1.965 -3.139 154 HA ALA 38 HA ALA 38 9.950 -2.742 -0.987 155 HB1 ALA 38 1HB ALA 38 8.190 -1.437 -2.096 156 HB2 ALA 38 2HB ALA 38 9.170 -1.362 -3.561 157 HB3 ALA 38 3HB ALA 38 9.725 -0.567 -2.087 158 H ARG 39 H ARG 39 10.071 -3.683 -4.378 159 HA ARG 39 HA ARG 39 7.891 -5.502 -4.249 160 HB2 ARG 39 1HB ARG 39 8.850 -4.564 -6.370 161 HB3 ARG 39 2HB ARG 39 10.249 -5.602 -6.129 162 HG2 ARG 39 1HG ARG 39 8.395 -7.497 -5.986 163 HG3 ARG 39 2HG ARG 39 7.476 -6.305 -6.927 164 HD2 ARG 39 1HD ARG 39 10.039 -7.678 -7.642 165 HD3 ARG 39 2HD ARG 39 8.543 -7.584 -8.565 166 HE ARG 39 HE ARG 39 10.509 -5.417 -8.240 167 HH11 ARG 39 1HH1 ARG 39 7.791 -6.813 -9.952 168 HH12 ARG 39 2HH1 ARG 39 7.926 -5.728 -11.299 169 HH21 ARG 39 1HH2 ARG 39 10.708 -4.001 -10.003 170 HH22 ARG 39 2HH2 ARG 39 9.580 -4.118 -11.322 171 H LYS 40 H LYS 40 11.423 -5.874 -3.964 172 HA LYS 40 HA LYS 40 11.507 -8.653 -3.850 173 HB2 LYS 40 1HB LYS 40 13.306 -6.775 -2.305 174 HB3 LYS 40 2HB LYS 40 13.656 -8.444 -2.714 175 HG2 LYS 40 1HG LYS 40 13.643 -6.027 -4.480 176 HG3 LYS 40 2HG LYS 40 14.898 -7.249 -4.255 177 HD2 LYS 40 1HD LYS 40 13.463 -8.890 -5.402 178 HD3 LYS 40 2HD LYS 40 12.260 -7.621 -5.642 179 HE2 LYS 40 1HE LYS 40 13.590 -7.940 -7.658 180 HE3 LYS 40 2HE LYS 40 13.860 -6.338 -6.969 181 HZ1 LYS 40 1HZ LYS 40 15.927 -7.381 -7.671 182 HZ2 LYS 40 2HZ LYS 40 15.652 -8.684 -6.629 183 HZ3 LYS 40 3HZ LYS 40 15.914 -7.139 -5.997 184 H MET 41 H MET 41 11.113 -6.309 -1.232 185 HA MET 41 HA MET 41 11.059 -8.170 0.870 186 HB2 MET 41 1HB MET 41 11.505 -5.724 1.036 187 HB3 MET 41 2HB MET 41 9.804 -5.432 0.716 188 HG2 MET 41 1HG MET 41 9.856 -5.264 2.958 189 HG3 MET 41 2HG MET 41 9.450 -6.966 2.790 190 HE1 MET 41 1HE MET 41 12.611 -8.827 3.910 191 HE2 MET 41 2HE MET 41 12.286 -8.470 2.219 192 HE3 MET 41 3HE MET 41 10.960 -8.911 3.295 193 H ALA 42 H ALA 42 8.472 -6.623 -1.013 194 HA ALA 42 HA ALA 42 6.371 -7.894 0.463 195 HB1 ALA 42 1HB ALA 42 6.026 -5.743 -0.618 196 HB2 ALA 42 2HB ALA 42 4.891 -6.944 -1.231 197 HB3 ALA 42 3HB ALA 42 6.290 -6.481 -2.198 198 H GLU 43 H GLU 43 8.234 -8.660 -2.357 199 HA GLU 43 HA GLU 43 6.572 -10.591 -3.533 200 HB2 GLU 43 1HB GLU 43 8.725 -9.483 -4.434 201 HB3 GLU 43 2HB GLU 43 9.578 -10.736 -3.549 202 HG2 GLU 43 1HG GLU 43 7.461 -11.362 -5.582 203 HG3 GLU 43 2HG GLU 43 9.153 -11.136 -6.012 204 H LYS 44 H LYS 44 9.135 -10.732 -1.128 205 HA LYS 44 HA LYS 44 8.991 -13.538 -0.645 206 HB2 LYS 44 1HB LYS 44 10.136 -11.350 1.081 207 HB3 LYS 44 2HB LYS 44 10.450 -13.075 1.245 208 HG2 LYS 44 1HG LYS 44 11.419 -13.051 -1.043 209 HG3 LYS 44 2HG LYS 44 11.236 -11.296 -1.050 210 HD2 LYS 44 1HD LYS 44 12.642 -11.188 0.980 211 HD3 LYS 44 2HD LYS 44 12.873 -12.934 0.859 212 HE2 LYS 44 1HE LYS 44 13.959 -12.683 -1.285 213 HE3 LYS 44 2HE LYS 44 13.629 -10.952 -1.282 214 HZ1 LYS 44 1HZ LYS 44 15.377 -12.383 0.644 215 HZ2 LYS 44 2HZ LYS 44 15.058 -10.724 0.655 216 HZ3 LYS 44 3HZ LYS 44 15.904 -11.412 -0.636 217 H ALA 45 H ALA 45 7.243 -10.793 0.493 218 HA ALA 45 HA ALA 45 6.247 -12.152 2.854 219 HB1 ALA 45 1HB ALA 45 5.598 -9.421 1.767 220 HB2 ALA 45 2HB ALA 45 6.806 -9.786 3.000 221 HB3 ALA 45 3HB ALA 45 5.094 -10.059 3.332 222 H ASN 46 H ASN 46 5.512 -12.226 -0.334 223 HA ASN 46 HA ASN 46 3.786 -13.011 -1.562 224 HB2 ASN 46 1HB ASN 46 2.892 -13.986 1.146 225 HB3 ASN 46 2HB ASN 46 1.999 -14.341 -0.329 226 HD21 ASN 46 1HD2 ASN 46 2.888 -15.732 -1.851 227 HD22 ASN 46 2HD2 ASN 46 4.219 -16.772 -1.481 228 H LEU 47 H LEU 47 3.739 -10.317 -0.745 229 HA LEU 47 HA LEU 47 0.907 -9.729 -0.300 230 HB2 LEU 47 1HB LEU 47 3.245 -7.837 -0.530 231 HB3 LEU 47 2HB LEU 47 1.624 -7.428 -0.018 232 HG LEU 47 HG LEU 47 3.517 -9.225 1.500 233 HD11 LEU 47 1HD1 LEU 47 2.654 -6.389 2.046 234 HD12 LEU 47 2HD1 LEU 47 4.240 -6.885 1.460 235 HD13 LEU 47 3HD1 LEU 47 3.701 -7.375 3.067 236 HD21 LEU 47 1HD2 LEU 47 1.190 -9.804 1.897 237 HD22 LEU 47 2HD2 LEU 47 0.813 -8.112 2.232 238 HD23 LEU 47 3HD2 LEU 47 1.881 -9.008 3.312 239 H ILE 48 H ILE 48 -0.321 -8.534 -1.772 240 HA ILE 48 HA ILE 48 0.489 -8.675 -4.544 241 HB ILE 48 HB ILE 48 -1.920 -7.269 -3.372 242 HG12 ILE 48 1HG1 ILE 48 -1.634 -9.821 -2.907 243 HG13 ILE 48 2HG1 ILE 48 -3.177 -9.223 -3.504 244 HG21 ILE 48 1HG2 ILE 48 -2.861 -7.530 -5.621 245 HG22 ILE 48 2HG2 ILE 48 -1.356 -8.271 -6.161 246 HG23 ILE 48 3HG2 ILE 48 -1.371 -6.587 -5.642 247 HD11 ILE 48 1HD1 ILE 48 -1.035 -10.485 -5.198 248 HD12 ILE 48 2HD1 ILE 48 -2.631 -9.955 -5.739 249 HD13 ILE 48 3HD1 ILE 48 -2.484 -11.293 -4.598 250 H LEU 49 H LEU 49 1.986 -7.222 -5.215 251 HA LEU 49 HA LEU 49 2.040 -4.570 -4.012 252 HB2 LEU 49 1HB LEU 49 4.166 -5.713 -4.255 253 HB3 LEU 49 2HB LEU 49 3.899 -5.902 -5.978 254 HG LEU 49 HG LEU 49 3.897 -3.373 -6.139 255 HD11 LEU 49 1HD1 LEU 49 3.491 -2.829 -3.823 256 HD12 LEU 49 2HD1 LEU 49 5.048 -2.171 -4.327 257 HD13 LEU 49 3HD1 LEU 49 4.985 -3.634 -3.342 258 HD21 LEU 49 1HD2 LEU 49 6.405 -4.751 -5.212 259 HD22 LEU 49 2HD2 LEU 49 6.341 -3.223 -6.087 260 HD23 LEU 49 3HD2 LEU 49 5.786 -4.707 -6.861 261 H ILE 50 H ILE 50 1.211 -2.822 -4.926 262 HA ILE 50 HA ILE 50 0.801 -2.853 -7.844 263 HB ILE 50 HB ILE 50 -0.860 -1.388 -5.778 264 HG12 ILE 50 1HG1 ILE 50 -2.711 -2.728 -7.026 265 HG13 ILE 50 2HG1 ILE 50 -1.387 -3.752 -7.566 266 HG21 ILE 50 1HG2 ILE 50 -2.186 -0.579 -7.681 267 HG22 ILE 50 2HG2 ILE 50 -1.025 -1.313 -8.787 268 HG23 ILE 50 3HG2 ILE 50 -0.523 0.008 -7.731 269 HD11 ILE 50 1HD1 ILE 50 -0.824 -4.240 -5.243 270 HD12 ILE 50 2HD1 ILE 50 -2.487 -4.684 -5.621 271 HD13 ILE 50 3HD1 ILE 50 -2.154 -3.214 -4.707 272 H THR 51 H THR 51 2.410 -1.755 -8.688 273 HA THR 51 HA THR 51 3.630 0.487 -7.344 274 HB THR 51 HB THR 51 4.934 0.623 -9.551 275 HG1 THR 51 HG1 THR 51 3.899 -1.994 -9.957 276 HG21 THR 51 1HG2 THR 51 5.852 -0.404 -7.535 277 HG22 THR 51 2HG2 THR 51 6.329 -1.315 -8.967 278 HG23 THR 51 3HG2 THR 51 5.042 -1.920 -7.926 279 H VAL 52 H VAL 52 3.088 2.581 -7.603 280 HA VAL 52 HA VAL 52 1.689 3.470 -9.975 281 HB VAL 52 HB VAL 52 -0.160 2.600 -8.708 282 HG11 VAL 52 1HG1 VAL 52 0.835 2.478 -6.516 283 HG12 VAL 52 2HG1 VAL 52 -0.672 3.391 -6.425 284 HG13 VAL 52 3HG1 VAL 52 0.875 4.236 -6.398 285 HG21 VAL 52 1HG2 VAL 52 -0.050 5.597 -8.424 286 HG22 VAL 52 2HG2 VAL 52 -1.512 4.608 -8.351 287 HG23 VAL 52 3HG2 VAL 52 -0.578 4.700 -9.846 288 H GLY 53 H GLY 53 1.972 5.672 -10.338 289 HA2 GLY 53 1HA GLY 53 3.030 7.267 -8.103 290 HA3 GLY 53 2HA GLY 53 3.937 7.207 -9.607 291 H ASP 54 H ASP 54 1.246 8.456 -7.949 292 HA ASP 54 HA ASP 54 0.863 10.868 -8.923 293 HB2 ASP 54 1HB ASP 54 0.695 9.979 -11.246 294 HB3 ASP 54 2HB ASP 54 -0.703 9.029 -10.765 295 H GLU 55 H GLU 55 -1.052 11.788 -7.993 296 HA GLU 55 HA GLU 55 -2.089 10.173 -5.883 297 HB2 GLU 55 1HB GLU 55 -3.054 12.898 -6.729 298 HB3 GLU 55 2HB GLU 55 -3.233 12.147 -5.150 299 HG2 GLU 55 1HG GLU 55 -0.784 12.186 -4.879 300 HG3 GLU 55 2HG GLU 55 -0.654 13.039 -6.415 301 H GLU 56 H GLU 56 -3.254 11.159 -9.006 302 HA GLU 56 HA GLU 56 -5.976 10.363 -8.472 303 HB2 GLU 56 1HB GLU 56 -4.652 10.902 -11.136 304 HB3 GLU 56 2HB GLU 56 -6.378 10.863 -10.808 305 HG2 GLU 56 1HG GLU 56 -4.434 12.866 -9.685 306 HG3 GLU 56 2HG GLU 56 -5.517 13.142 -11.046 307 H GLU 57 H GLU 57 -3.071 9.051 -9.888 308 HA GLU 57 HA GLU 57 -4.261 6.667 -10.873 309 HB2 GLU 57 1HB GLU 57 -1.388 7.271 -10.181 310 HB3 GLU 57 2HB GLU 57 -1.935 5.815 -11.000 311 HG2 GLU 57 1HG GLU 57 -2.198 8.630 -12.022 312 HG3 GLU 57 2HG GLU 57 -1.052 7.416 -12.585 313 H LEU 58 H LEU 58 -3.088 7.685 -7.751 314 HA LEU 58 HA LEU 58 -2.979 5.126 -6.552 315 HB2 LEU 58 1HB LEU 58 -2.060 7.162 -5.477 316 HB3 LEU 58 2HB LEU 58 -3.694 7.756 -5.243 317 HG LEU 58 HG LEU 58 -4.176 5.806 -3.792 318 HD11 LEU 58 1HD1 LEU 58 -2.359 4.392 -3.011 319 HD12 LEU 58 2HD1 LEU 58 -1.238 5.212 -4.097 320 HD13 LEU 58 3HD1 LEU 58 -2.559 4.250 -4.758 321 HD21 LEU 58 1HD2 LEU 58 -1.787 7.450 -2.970 322 HD22 LEU 58 2HD2 LEU 58 -2.804 6.509 -1.880 323 HD23 LEU 58 3HD2 LEU 58 -3.484 7.882 -2.756 324 H LYS 59 H LYS 59 -5.577 7.395 -7.176 325 HA LYS 59 HA LYS 59 -7.646 6.092 -5.814 326 HB2 LYS 59 1HB LYS 59 -7.716 7.715 -8.352 327 HB3 LYS 59 2HB LYS 59 -9.148 7.210 -7.468 328 HG2 LYS 59 1HG LYS 59 -8.575 8.562 -5.600 329 HG3 LYS 59 2HG LYS 59 -6.971 8.893 -6.256 330 HD2 LYS 59 1HD LYS 59 -7.887 10.201 -8.032 331 HD3 LYS 59 2HD LYS 59 -9.532 9.711 -7.620 332 HE2 LYS 59 1HE LYS 59 -7.703 11.348 -5.870 333 HE3 LYS 59 2HE LYS 59 -8.997 11.997 -6.872 334 HZ1 LYS 59 1HZ LYS 59 -9.372 10.066 -4.648 335 HZ2 LYS 59 2HZ LYS 59 -10.597 10.767 -5.576 336 HZ3 LYS 59 3HZ LYS 59 -9.660 11.728 -4.549 337 H LYS 60 H LYS 60 -6.015 5.392 -8.732 338 HA LYS 60 HA LYS 60 -7.950 3.420 -9.607 339 HB2 LYS 60 1HB LYS 60 -5.222 4.010 -10.745 340 HB3 LYS 60 2HB LYS 60 -6.593 3.260 -11.561 341 HG2 LYS 60 1HG LYS 60 -6.763 6.036 -10.449 342 HG3 LYS 60 2HG LYS 60 -6.086 5.726 -12.061 343 HD2 LYS 60 1HD LYS 60 -8.831 4.863 -11.145 344 HD3 LYS 60 2HD LYS 60 -8.502 6.322 -12.078 345 HE2 LYS 60 1HE LYS 60 -7.560 4.938 -13.879 346 HE3 LYS 60 2HE LYS 60 -7.938 3.488 -12.949 347 HZ1 LYS 60 1HZ LYS 60 -9.908 5.458 -13.973 348 HZ2 LYS 60 2HZ LYS 60 -10.281 4.088 -13.053 349 HZ3 LYS 60 3HZ LYS 60 -9.628 3.913 -14.601 350 H ALA 61 H ALA 61 -4.718 3.556 -8.192 351 HA ALA 61 HA ALA 61 -4.119 0.802 -8.368 352 HB1 ALA 61 1HB ALA 61 -2.399 2.488 -7.999 353 HB2 ALA 61 2HB ALA 61 -2.374 1.285 -6.708 354 HB3 ALA 61 3HB ALA 61 -3.094 2.870 -6.425 355 H ILE 62 H ILE 62 -5.591 2.777 -5.828 356 HA ILE 62 HA ILE 62 -5.908 0.751 -3.910 357 HB ILE 62 HB ILE 62 -7.558 3.234 -4.415 358 HG12 ILE 62 1HG1 ILE 62 -5.551 2.615 -2.240 359 HG13 ILE 62 2HG1 ILE 62 -5.170 3.514 -3.699 360 HG21 ILE 62 1HG2 ILE 62 -7.658 1.363 -2.056 361 HG22 ILE 62 2HG2 ILE 62 -8.920 1.575 -3.270 362 HG23 ILE 62 3HG2 ILE 62 -8.503 2.905 -2.190 363 HD11 ILE 62 1HD1 ILE 62 -5.555 4.995 -1.817 364 HD12 ILE 62 2HD1 ILE 62 -7.174 4.326 -1.612 365 HD13 ILE 62 3HD1 ILE 62 -6.773 5.233 -3.070 366 H LYS 63 H LYS 63 -8.101 1.848 -6.489 367 HA LYS 63 HA LYS 63 -10.157 -0.006 -5.905 368 HB2 LYS 63 1HB LYS 63 -10.571 2.019 -7.210 369 HB3 LYS 63 2HB LYS 63 -9.507 1.439 -8.481 370 HG2 LYS 63 1HG LYS 63 -11.837 1.152 -9.092 371 HG3 LYS 63 2HG LYS 63 -11.030 -0.407 -8.934 372 HD2 LYS 63 1HD LYS 63 -13.227 -0.523 -7.932 373 HD3 LYS 63 2HD LYS 63 -12.000 -0.644 -6.673 374 HE2 LYS 63 1HE LYS 63 -12.338 1.661 -6.059 375 HE3 LYS 63 2HE LYS 63 -13.451 1.894 -7.407 376 HZ1 LYS 63 1HZ LYS 63 -14.624 1.578 -5.316 377 HZ2 LYS 63 2HZ LYS 63 -13.896 0.071 -5.106 378 HZ3 LYS 63 3HZ LYS 63 -14.967 0.320 -6.389 379 H LYS 64 H LYS 64 -7.330 -0.109 -7.987 380 HA LYS 64 HA LYS 64 -7.772 -2.509 -9.323 381 HB2 LYS 64 1HB LYS 64 -5.929 -1.039 -9.885 382 HB3 LYS 64 2HB LYS 64 -5.206 -1.276 -8.302 383 HG2 LYS 64 1HG LYS 64 -4.768 -3.613 -8.843 384 HG3 LYS 64 2HG LYS 64 -5.516 -3.389 -10.427 385 HD2 LYS 64 1HD LYS 64 -3.823 -1.784 -11.049 386 HD3 LYS 64 2HD LYS 64 -3.119 -1.848 -9.432 387 HE2 LYS 64 1HE LYS 64 -2.518 -4.179 -9.767 388 HE3 LYS 64 2HE LYS 64 -3.280 -4.164 -11.355 389 HZ1 LYS 64 1HZ LYS 64 -0.863 -3.910 -11.470 390 HZ2 LYS 64 2HZ LYS 64 -0.962 -2.479 -10.575 391 HZ3 LYS 64 3HZ LYS 64 -1.667 -2.566 -12.107 392 H ALA 65 H ALA 65 -6.348 -1.902 -6.140 393 HA ALA 65 HA ALA 65 -5.843 -4.635 -5.528 394 HB1 ALA 65 1HB ALA 65 -4.634 -2.815 -4.443 395 HB2 ALA 65 2HB ALA 65 -5.450 -3.829 -3.252 396 HB3 ALA 65 3HB ALA 65 -6.129 -2.261 -3.688 397 H ASP 66 H ASP 66 -8.466 -2.390 -4.784 398 HA ASP 66 HA ASP 66 -10.006 -3.902 -3.055 399 HB2 ASP 66 1HB ASP 66 -10.563 -1.604 -3.536 400 HB3 ASP 66 2HB ASP 66 -10.857 -1.976 -5.228 401 H ASP 67 H ASP 67 -10.030 -3.924 -6.601 402 HA ASP 67 HA ASP 67 -12.170 -5.752 -6.857 403 HB2 ASP 67 1HB ASP 67 -11.441 -4.238 -8.672 404 HB3 ASP 67 2HB ASP 67 -9.962 -5.180 -8.841 405 H ILE 68 H ILE 68 -8.652 -6.218 -6.754 406 HA ILE 68 HA ILE 68 -8.634 -8.929 -7.488 407 HB ILE 68 HB ILE 68 -6.710 -7.432 -5.704 408 HG12 ILE 68 1HG1 ILE 68 -6.537 -8.081 -8.653 409 HG13 ILE 68 2HG1 ILE 68 -6.966 -6.507 -7.994 410 HG21 ILE 68 1HG2 ILE 68 -6.517 -9.842 -5.388 411 HG22 ILE 68 2HG2 ILE 68 -5.105 -9.206 -6.232 412 HG23 ILE 68 3HG2 ILE 68 -6.356 -10.066 -7.129 413 HD11 ILE 68 1HD1 ILE 68 -4.335 -7.919 -7.614 414 HD12 ILE 68 2HD1 ILE 68 -4.762 -6.336 -6.964 415 HD13 ILE 68 3HD1 ILE 68 -4.646 -6.570 -8.708 416 H ALA 69 H ALA 69 -8.910 -7.321 -4.368 417 HA ALA 69 HA ALA 69 -8.788 -9.718 -2.822 418 HB1 ALA 69 1HB ALA 69 -9.141 -8.356 -0.949 419 HB2 ALA 69 2HB ALA 69 -9.973 -7.124 -1.895 420 HB3 ALA 69 3HB ALA 69 -8.234 -7.345 -2.074 421 H LYS 70 H LYS 70 -11.430 -7.495 -3.659 422 HA LYS 70 HA LYS 70 -13.181 -8.767 -1.850 423 HB2 LYS 70 1HB LYS 70 -13.204 -6.347 -2.605 424 HB3 LYS 70 2HB LYS 70 -13.966 -6.916 -4.083 425 HG2 LYS 70 1HG LYS 70 -15.853 -7.760 -2.823 426 HG3 LYS 70 2HG LYS 70 -15.080 -7.282 -1.312 427 HD2 LYS 70 1HD LYS 70 -16.008 -5.452 -3.524 428 HD3 LYS 70 2HD LYS 70 -16.747 -5.644 -1.934 429 HE2 LYS 70 1HE LYS 70 -13.999 -4.541 -2.517 430 HE3 LYS 70 2HE LYS 70 -15.409 -3.620 -2.006 431 HZ1 LYS 70 1HZ LYS 70 -14.182 -5.772 -0.378 432 HZ2 LYS 70 2HZ LYS 70 -15.373 -4.671 0.113 433 HZ3 LYS 70 3HZ LYS 70 -13.799 -4.133 -0.207 434 H LYS 71 H LYS 71 -12.611 -9.177 -5.261 435 HA LYS 71 HA LYS 71 -15.045 -10.431 -5.918 436 HB2 LYS 71 1HB LYS 71 -13.462 -9.563 -7.597 437 HB3 LYS 71 2HB LYS 71 -12.316 -10.819 -7.161 438 HG2 LYS 71 1HG LYS 71 -13.471 -11.393 -9.207 439 HG3 LYS 71 2HG LYS 71 -13.898 -12.525 -7.924 440 HD2 LYS 71 1HD LYS 71 -15.992 -11.325 -7.554 441 HD3 LYS 71 2HD LYS 71 -15.561 -10.165 -8.811 442 HE2 LYS 71 1HE LYS 71 -17.115 -11.803 -9.686 443 HE3 LYS 71 2HE LYS 71 -15.543 -11.986 -10.458 444 HZ1 LYS 71 1HZ LYS 71 -15.074 -13.850 -9.001 445 HZ2 LYS 71 2HZ LYS 71 -16.506 -14.120 -9.858 446 HZ3 LYS 71 3HZ LYS 71 -16.570 -13.662 -8.234 447 H GLN 72 H GLN 72 -12.165 -11.592 -4.346 448 HA GLN 72 HA GLN 72 -13.258 -14.330 -4.464 449 HB2 GLN 72 1HB GLN 72 -10.862 -15.118 -4.419 450 HB3 GLN 72 2HB GLN 72 -11.388 -14.336 -5.902 451 HG2 GLN 72 1HG GLN 72 -10.335 -12.236 -5.092 452 HG3 GLN 72 2HG GLN 72 -9.700 -13.140 -3.720 453 HE21 GLN 72 1HE2 GLN 72 -7.582 -12.701 -4.326 454 HE22 GLN 72 2HE2 GLN 72 -6.832 -13.480 -5.674 455 H ASN 73 H ASN 73 -11.200 -12.172 -2.511 456 HA ASN 73 HA ASN 73 -11.354 -14.137 -0.342 457 HB2 ASN 73 1HB ASN 73 -9.107 -13.418 -1.561 458 HB3 ASN 73 2HB ASN 73 -9.187 -12.106 -0.392 459 HD21 ASN 73 1HD2 ASN 73 -7.276 -14.282 -0.645 460 HD22 ASN 73 2HD2 ASN 73 -7.300 -15.130 0.864 461 H SER 74 H SER 74 -13.105 -11.829 -0.996 462 HA SER 74 HA SER 74 -12.684 -9.555 0.481 463 HB2 SER 74 1HB SER 74 -15.068 -9.153 0.222 464 HB3 SER 74 2HB SER 74 -14.367 -9.837 -1.239 465 HG SER 74 HG SER 74 -16.422 -10.765 -0.484 466 H SER 75 H SER 75 -13.182 -12.576 1.923 467 HA SER 75 HA SER 75 -14.698 -12.044 4.172 468 HB2 SER 75 1HB SER 75 -13.673 -14.249 3.637 469 HB3 SER 75 2HB SER 75 -12.100 -13.604 4.092 470 HG SER 75 HG SER 75 -14.056 -13.257 5.997 471 H GLU 76 H GLU 76 -11.354 -11.180 3.459 472 HA GLU 76 HA GLU 76 -11.666 -8.791 5.011 473 HB2 GLU 76 1HB GLU 76 -10.883 -10.330 6.774 474 HB3 GLU 76 2HB GLU 76 -9.482 -10.733 5.793 475 HG2 GLU 76 1HG GLU 76 -8.868 -8.296 5.859 476 HG3 GLU 76 2HG GLU 76 -10.136 -8.091 7.066 477 H ALA 77 H ALA 77 -10.666 -7.199 3.971 478 HA ALA 77 HA ALA 77 -8.398 -7.877 2.219 479 HB1 ALA 77 1HB ALA 77 -10.528 -5.797 1.716 480 HB2 ALA 77 2HB ALA 77 -10.391 -7.352 0.896 481 HB3 ALA 77 3HB ALA 77 -9.138 -6.130 0.681 482 H LYS 78 H LYS 78 -6.573 -6.900 2.809 483 HA LYS 78 HA LYS 78 -6.783 -4.292 4.149 484 HB2 LYS 78 1HB LYS 78 -4.882 -6.531 4.862 485 HB3 LYS 78 2HB LYS 78 -4.757 -4.891 5.480 486 HG2 LYS 78 1HG LYS 78 -7.232 -5.329 6.242 487 HG3 LYS 78 2HG LYS 78 -6.734 -7.018 6.129 488 HD2 LYS 78 1HD LYS 78 -5.279 -4.897 7.707 489 HD3 LYS 78 2HD LYS 78 -6.428 -6.045 8.393 490 HE2 LYS 78 1HE LYS 78 -4.110 -7.064 6.816 491 HE3 LYS 78 2HE LYS 78 -3.847 -6.508 8.465 492 HZ1 LYS 78 1HZ LYS 78 -5.514 -8.081 9.222 493 HZ2 LYS 78 2HZ LYS 78 -4.270 -8.878 8.401 494 HZ3 LYS 78 3HZ LYS 78 -5.771 -8.628 7.640 495 H ILE 79 H ILE 79 -5.478 -2.728 3.410 496 HA ILE 79 HA ILE 79 -3.530 -3.465 1.323 497 HB ILE 79 HB ILE 79 -5.323 -1.029 1.279 498 HG12 ILE 79 1HG1 ILE 79 -5.466 -3.493 -0.475 499 HG13 ILE 79 2HG1 ILE 79 -6.548 -3.175 0.882 500 HG21 ILE 79 1HG2 ILE 79 -4.465 -0.725 -1.001 501 HG22 ILE 79 2HG2 ILE 79 -3.398 -2.111 -0.778 502 HG23 ILE 79 3HG2 ILE 79 -3.174 -0.660 0.199 503 HD11 ILE 79 1HD1 ILE 79 -7.577 -2.609 -1.247 504 HD12 ILE 79 2HD1 ILE 79 -6.272 -1.474 -1.587 505 HD13 ILE 79 3HD1 ILE 79 -7.370 -1.177 -0.239 506 H LEU 80 H LEU 80 -1.550 -2.625 1.614 507 HA LEU 80 HA LEU 80 -1.202 -0.515 3.639 508 HB2 LEU 80 1HB LEU 80 0.051 -2.846 3.555 509 HB3 LEU 80 2HB LEU 80 1.057 -2.024 2.373 510 HG LEU 80 HG LEU 80 0.802 -1.524 5.314 511 HD11 LEU 80 1HD1 LEU 80 3.224 -1.608 5.207 512 HD12 LEU 80 2HD1 LEU 80 3.154 -1.762 3.451 513 HD13 LEU 80 3HD1 LEU 80 2.512 -3.047 4.475 514 HD21 LEU 80 1HD2 LEU 80 0.467 0.674 4.335 515 HD22 LEU 80 2HD2 LEU 80 1.894 0.457 3.323 516 HD23 LEU 80 3HD2 LEU 80 2.063 0.558 5.076 517 H ILE 81 H ILE 81 -1.283 1.470 2.633 518 HA ILE 81 HA ILE 81 0.022 1.733 0.024 519 HB ILE 81 HB ILE 81 -1.513 3.835 1.565 520 HG12 ILE 81 1HG1 ILE 81 -2.367 2.287 -0.887 521 HG13 ILE 81 2HG1 ILE 81 -2.901 1.902 0.748 522 HG21 ILE 81 1HG2 ILE 81 -0.603 3.843 -1.308 523 HG22 ILE 81 2HG2 ILE 81 0.226 4.679 0.003 524 HG23 ILE 81 3HG2 ILE 81 -1.414 5.152 -0.447 525 HD11 ILE 81 1HD1 ILE 81 -3.964 4.088 0.913 526 HD12 ILE 81 2HD1 ILE 81 -4.571 3.183 -0.473 527 HD13 ILE 81 3HD1 ILE 81 -3.407 4.486 -0.712 528 H LEU 82 H LEU 82 2.171 1.894 0.227 529 HA LEU 82 HA LEU 82 3.304 3.663 2.249 530 HB2 LEU 82 1HB LEU 82 4.625 1.983 0.113 531 HB3 LEU 82 2HB LEU 82 5.480 2.936 1.309 532 HG LEU 82 HG LEU 82 3.708 0.558 1.876 533 HD11 LEU 82 1HD1 LEU 82 6.689 0.920 2.092 534 HD12 LEU 82 2HD1 LEU 82 5.846 -0.047 0.881 535 HD13 LEU 82 3HD1 LEU 82 5.784 -0.512 2.581 536 HD21 LEU 82 1HD2 LEU 82 4.537 0.804 4.187 537 HD22 LEU 82 2HD2 LEU 82 3.533 2.154 3.664 538 HD23 LEU 82 3HD2 LEU 82 5.286 2.334 3.728 539 H LEU 83 H LEU 83 3.587 5.755 1.840 540 HA LEU 83 HA LEU 83 4.129 6.602 -0.905 541 HB2 LEU 83 1HB LEU 83 2.532 8.471 -0.713 542 HB3 LEU 83 2HB LEU 83 1.752 6.903 -0.784 543 HG LEU 83 HG LEU 83 2.158 8.470 1.774 544 HD11 LEU 83 1HD1 LEU 83 0.756 9.724 0.229 545 HD12 LEU 83 2HD1 LEU 83 -0.206 9.072 1.556 546 HD13 LEU 83 3HD1 LEU 83 -0.251 8.299 -0.030 547 HD21 LEU 83 1HD2 LEU 83 0.529 6.999 2.723 548 HD22 LEU 83 2HD2 LEU 83 1.800 6.014 1.998 549 HD23 LEU 83 3HD2 LEU 83 0.258 6.218 1.169 550 H GLU 84 H GLU 84 5.104 8.705 -1.056 551 HA GLU 84 HA GLU 84 6.276 9.531 1.509 552 HB2 GLU 84 1HB GLU 84 7.934 10.740 -0.038 553 HB3 GLU 84 2HB GLU 84 8.035 8.987 0.055 554 HG2 GLU 84 1HG GLU 84 6.783 8.797 -2.028 555 HG3 GLU 84 2HG GLU 84 6.668 10.552 -2.122 556 H LYS 85 H LYS 85 4.767 10.832 2.259 557 HA LYS 85 HA LYS 85 4.994 13.555 1.573 558 HB2 LYS 85 1HB LYS 85 2.593 13.999 1.084 559 HB3 LYS 85 2HB LYS 85 3.375 13.061 -0.180 560 HG2 LYS 85 1HG LYS 85 2.250 11.119 0.391 561 HG3 LYS 85 2HG LYS 85 1.857 11.706 2.006 562 HD2 LYS 85 1HD LYS 85 -0.116 11.692 0.592 563 HD3 LYS 85 2HD LYS 85 0.318 13.342 1.036 564 HE2 LYS 85 1HE LYS 85 1.405 13.615 -1.159 565 HE3 LYS 85 2HE LYS 85 0.905 11.980 -1.591 566 HZ1 LYS 85 1HZ LYS 85 -1.420 12.699 -1.248 567 HZ2 LYS 85 2HZ LYS 85 -0.651 13.540 -2.503 568 HZ3 LYS 85 3HZ LYS 85 -0.872 14.282 -1.002 569 HA PRO 86 HA PRO 86 3.516 13.734 5.839 570 HB2 PRO 86 1HB PRO 86 2.045 16.042 5.834 571 HB3 PRO 86 2HB PRO 86 3.810 16.010 5.923 572 HG2 PRO 86 1HG PRO 86 2.038 16.475 3.555 573 HG3 PRO 86 2HG PRO 86 3.531 17.312 4.018 574 HD2 PRO 86 1HD PRO 86 3.497 15.419 2.106 575 HD3 PRO 86 2HD PRO 86 4.883 15.626 3.194 576 H VAL 87 H VAL 87 1.955 12.379 6.527 577 HA VAL 87 HA VAL 87 -0.726 12.654 5.341 578 HB VAL 87 HB VAL 87 -1.062 10.230 5.530 579 HG11 VAL 87 1HG1 VAL 87 -0.320 11.150 3.409 580 HG12 VAL 87 2HG1 VAL 87 0.365 9.545 3.663 581 HG13 VAL 87 3HG1 VAL 87 1.364 10.978 3.907 582 HG21 VAL 87 1HG2 VAL 87 1.854 10.132 6.296 583 HG22 VAL 87 2HG2 VAL 87 0.853 8.733 5.908 584 HG23 VAL 87 3HG2 VAL 87 0.485 9.714 7.325 585 H SER 88 H SER 88 -2.329 12.920 6.719 586 HA SER 88 HA SER 88 -1.842 12.488 9.572 587 HB2 SER 88 1HB SER 88 -3.845 13.889 9.900 588 HB3 SER 88 2HB SER 88 -2.670 14.712 8.874 589 HG SER 88 HG SER 88 -4.042 14.668 7.280 590 HA PRO 89 HA PRO 89 -4.765 9.068 9.898 591 HB2 PRO 89 1HB PRO 89 -6.384 10.746 11.750 592 HB3 PRO 89 2HB PRO 89 -5.761 9.107 11.972 593 HG2 PRO 89 1HG PRO 89 -4.620 11.151 13.222 594 HG3 PRO 89 2HG PRO 89 -3.630 9.854 12.530 595 HD2 PRO 89 1HD PRO 89 -4.145 12.608 11.483 596 HD3 PRO 89 2HD PRO 89 -2.644 11.659 11.467 597 H GLU 90 H GLU 90 -5.987 12.343 9.489 598 HA GLU 90 HA GLU 90 -8.546 11.576 8.491 599 HB2 GLU 90 1HB GLU 90 -7.021 14.177 8.316 600 HB3 GLU 90 2HB GLU 90 -8.659 13.964 7.714 601 HG2 GLU 90 1HG GLU 90 -9.370 13.332 9.999 602 HG3 GLU 90 2HG GLU 90 -7.741 13.693 10.566 603 H TYR 91 H TYR 91 -5.411 12.239 7.050 604 HA TYR 91 HA TYR 91 -6.253 12.212 4.348 605 HB2 TYR 91 1HB TYR 91 -4.011 13.012 5.126 606 HB3 TYR 91 2HB TYR 91 -3.568 11.339 5.451 607 HD1 TYR 91 HD1 TYR 91 -4.052 13.873 2.891 608 HD2 TYR 91 HD2 TYR 91 -3.233 9.758 3.578 609 HE1 TYR 91 HE1 TYR 91 -3.297 13.644 0.566 610 HE2 TYR 91 HE2 TYR 91 -2.475 9.516 1.252 611 HH TYR 91 HH TYR 91 -2.867 10.682 -0.944 612 H GLU 92 H GLU 92 -5.031 9.681 6.512 613 HA GLU 92 HA GLU 92 -5.246 7.535 4.730 614 HB2 GLU 92 1HB GLU 92 -4.032 7.440 6.876 615 HB3 GLU 92 2HB GLU 92 -5.559 7.530 7.738 616 HG2 GLU 92 1HG GLU 92 -6.242 5.395 6.869 617 HG3 GLU 92 2HG GLU 92 -4.818 5.337 5.828 618 H LYS 93 H LYS 93 -7.545 8.920 7.020 619 HA LYS 93 HA LYS 93 -9.625 7.093 6.753 620 HB2 LYS 93 1HB LYS 93 -9.471 8.891 8.459 621 HB3 LYS 93 2HB LYS 93 -9.833 10.074 7.213 622 HG2 LYS 93 1HG LYS 93 -12.020 9.030 6.865 623 HG3 LYS 93 2HG LYS 93 -11.656 7.862 8.135 624 HD2 LYS 93 1HD LYS 93 -11.807 10.857 8.489 625 HD3 LYS 93 2HD LYS 93 -13.058 9.706 8.959 626 HE2 LYS 93 1HE LYS 93 -10.241 9.762 10.044 627 HE3 LYS 93 2HE LYS 93 -11.656 10.421 10.859 628 HZ1 LYS 93 1HZ LYS 93 -12.609 8.214 10.934 629 HZ2 LYS 93 2HZ LYS 93 -11.091 8.215 11.675 630 HZ3 LYS 93 3HZ LYS 93 -11.275 7.571 10.123 631 H LYS 94 H LYS 94 -8.706 9.824 4.751 632 HA LYS 94 HA LYS 94 -11.037 9.944 3.166 633 HB2 LYS 94 1HB LYS 94 -9.414 11.769 3.266 634 HB3 LYS 94 2HB LYS 94 -8.196 10.753 2.511 635 HG2 LYS 94 1HG LYS 94 -9.528 10.651 0.474 636 HG3 LYS 94 2HG LYS 94 -10.769 11.651 1.231 637 HD2 LYS 94 1HD LYS 94 -7.906 12.505 0.806 638 HD3 LYS 94 2HD LYS 94 -9.240 12.909 -0.274 639 HE2 LYS 94 1HE LYS 94 -10.378 14.036 1.606 640 HE3 LYS 94 2HE LYS 94 -8.985 13.686 2.627 641 HZ1 LYS 94 1HZ LYS 94 -7.612 15.035 1.200 642 HZ2 LYS 94 2HZ LYS 94 -8.940 15.942 1.717 643 HZ3 LYS 94 3HZ LYS 94 -8.907 15.317 0.148 644 H LEU 95 H LEU 95 -8.078 8.056 2.916 645 HA LEU 95 HA LEU 95 -8.856 6.933 0.354 646 HB2 LEU 95 1HB LEU 95 -6.531 6.279 2.172 647 HB3 LEU 95 2HB LEU 95 -6.757 5.655 0.550 648 HG LEU 95 HG LEU 95 -6.356 8.568 1.240 649 HD11 LEU 95 1HD1 LEU 95 -4.332 7.343 1.662 650 HD12 LEU 95 2HD1 LEU 95 -4.152 8.257 0.165 651 HD13 LEU 95 3HD1 LEU 95 -4.458 6.521 0.107 652 HD21 LEU 95 1HD2 LEU 95 -6.490 7.145 -1.416 653 HD22 LEU 95 2HD2 LEU 95 -6.059 8.839 -1.185 654 HD23 LEU 95 3HD2 LEU 95 -7.679 8.278 -0.772 655 H GLN 96 H GLN 96 -8.730 6.017 3.722 656 HA GLN 96 HA GLN 96 -9.330 3.279 3.382 657 HB2 GLN 96 1HB GLN 96 -8.251 4.177 5.390 658 HB3 GLN 96 2HB GLN 96 -9.695 5.097 5.770 659 HG2 GLN 96 1HG GLN 96 -10.927 3.081 6.193 660 HG3 GLN 96 2HG GLN 96 -9.567 2.087 5.666 661 HE21 GLN 96 1HE2 GLN 96 -9.545 1.049 7.676 662 HE22 GLN 96 2HE2 GLN 96 -8.886 1.808 9.081 663 H LYS 97 H LYS 97 -11.290 6.172 3.630 664 HA LYS 97 HA LYS 97 -13.759 4.684 3.721 665 HB2 LYS 97 1HB LYS 97 -13.666 6.937 4.669 666 HB3 LYS 97 2HB LYS 97 -13.257 7.600 3.090 667 HG2 LYS 97 1HG LYS 97 -15.419 6.866 2.225 668 HG3 LYS 97 2HG LYS 97 -15.826 6.208 3.806 669 HD2 LYS 97 1HD LYS 97 -15.792 8.401 4.786 670 HD3 LYS 97 2HD LYS 97 -15.199 9.108 3.279 671 HE2 LYS 97 1HE LYS 97 -17.644 9.431 3.660 672 HE3 LYS 97 2HE LYS 97 -17.251 8.601 2.155 673 HZ1 LYS 97 1HZ LYS 97 -18.122 7.275 4.668 674 HZ2 LYS 97 2HZ LYS 97 -17.789 6.500 3.203 675 HZ3 LYS 97 3HZ LYS 97 -19.102 7.555 3.321 676 H TYR 98 H TYR 98 -11.616 5.836 1.258 677 HA TYR 98 HA TYR 98 -13.426 6.075 -0.887 678 HB2 TYR 98 1HB TYR 98 -11.145 7.010 -0.939 679 HB3 TYR 98 2HB TYR 98 -10.479 5.383 -0.971 680 HD1 TYR 98 HD1 TYR 98 -10.082 4.325 -3.021 681 HD2 TYR 98 HD2 TYR 98 -12.699 7.677 -2.889 682 HE1 TYR 98 HE1 TYR 98 -10.191 4.331 -5.476 683 HE2 TYR 98 HE2 TYR 98 -12.813 7.693 -5.344 684 HH TYR 98 HH TYR 98 -11.508 6.924 -7.259 685 H ALA 99 H ALA 99 -11.423 3.358 0.189 686 HA ALA 99 HA ALA 99 -12.922 1.616 -1.656 687 HB1 ALA 99 1HB ALA 99 -10.534 1.675 -2.121 688 HB2 ALA 99 2HB ALA 99 -11.019 0.085 -1.533 689 HB3 ALA 99 3HB ALA 99 -10.189 1.209 -0.456 690 H ASP 100 H ASP 100 -13.517 -0.490 -0.862 691 HA ASP 100 HA ASP 100 -14.097 -0.406 2.003 692 HB2 ASP 100 1HB ASP 100 -15.996 -0.925 0.549 693 HB3 ASP 100 2HB ASP 100 -15.110 -2.274 -0.157 694 H ALA 101 H ALA 101 -12.352 -0.956 3.003 695 HA ALA 101 HA ALA 101 -11.482 -3.608 3.245 696 HB1 ALA 101 1HB ALA 101 -9.618 -1.786 1.702 697 HB2 ALA 101 2HB ALA 101 -10.399 -3.235 1.072 698 HB3 ALA 101 3HB ALA 101 -9.191 -3.369 2.349 699 H GLU 102 H GLU 102 -9.215 -3.455 4.511 700 HA GLU 102 HA GLU 102 -9.330 -0.981 6.093 701 HB2 GLU 102 1HB GLU 102 -7.732 -3.371 6.942 702 HB3 GLU 102 2HB GLU 102 -8.439 -2.089 7.911 703 HG2 GLU 102 1HG GLU 102 -10.699 -3.082 7.099 704 HG3 GLU 102 2HG GLU 102 -9.731 -4.519 6.782 705 H VAL 103 H VAL 103 -8.236 0.274 4.638 706 HA VAL 103 HA VAL 103 -5.571 -0.606 3.835 707 HB VAL 103 HB VAL 103 -6.865 0.090 1.962 708 HG11 VAL 103 1HG1 VAL 103 -8.562 1.412 3.011 709 HG12 VAL 103 2HG1 VAL 103 -7.794 2.338 1.716 710 HG13 VAL 103 3HG1 VAL 103 -7.380 2.664 3.402 711 HG21 VAL 103 1HG2 VAL 103 -5.566 1.889 1.028 712 HG22 VAL 103 2HG2 VAL 103 -4.540 0.748 1.899 713 HG23 VAL 103 3HG2 VAL 103 -4.957 2.297 2.632 714 H ARG 104 H ARG 104 -3.865 0.111 4.777 715 HA ARG 104 HA ARG 104 -4.063 2.483 6.512 716 HB2 ARG 104 1HB ARG 104 -3.688 0.192 7.567 717 HB3 ARG 104 2HB ARG 104 -2.114 0.194 6.786 718 HG2 ARG 104 1HG ARG 104 -1.415 2.095 8.056 719 HG3 ARG 104 2HG ARG 104 -3.039 2.304 8.719 720 HD2 ARG 104 1HD ARG 104 -1.182 -0.025 9.185 721 HD3 ARG 104 2HD ARG 104 -1.629 1.218 10.355 722 HE ARG 104 HE ARG 104 -4.017 0.245 9.788 723 HH11 ARG 104 1HH1 ARG 104 -1.024 -1.465 10.395 724 HH12 ARG 104 2HH1 ARG 104 -1.814 -2.890 11.013 725 HH21 ARG 104 1HH2 ARG 104 -5.061 -1.612 10.587 726 HH22 ARG 104 2HH2 ARG 104 -4.114 -2.969 11.112 727 H VAL 105 H VAL 105 -2.630 4.111 6.161 728 HA VAL 105 HA VAL 105 -0.793 3.668 3.900 729 HB VAL 105 HB VAL 105 -1.228 5.833 3.075 730 HG11 VAL 105 1HG1 VAL 105 -3.570 5.764 2.575 731 HG12 VAL 105 2HG1 VAL 105 -3.910 4.834 4.030 732 HG13 VAL 105 3HG1 VAL 105 -3.006 4.098 2.711 733 HG21 VAL 105 1HG2 VAL 105 -1.209 7.096 5.153 734 HG22 VAL 105 2HG2 VAL 105 -2.767 6.405 5.608 735 HG23 VAL 105 3HG2 VAL 105 -2.653 7.482 4.216 736 H ARG 106 H ARG 106 1.287 4.149 4.153 737 HA ARG 106 HA ARG 106 2.088 5.450 6.679 738 HB2 ARG 106 1HB ARG 106 3.454 3.163 5.252 739 HB3 ARG 106 2HB ARG 106 4.104 3.993 6.649 740 HG2 ARG 106 1HG ARG 106 1.525 2.441 6.622 741 HG3 ARG 106 2HG ARG 106 3.076 1.810 7.170 742 HD2 ARG 106 1HD ARG 106 2.209 2.466 9.174 743 HD3 ARG 106 2HD ARG 106 3.001 3.968 8.702 744 HE ARG 106 HE ARG 106 0.609 4.431 7.720 745 HH11 ARG 106 1HH1 ARG 106 1.477 3.005 10.796 746 HH12 ARG 106 2HH1 ARG 106 -0.006 3.461 11.572 747 HH21 ARG 106 1HH2 ARG 106 -1.361 5.011 8.730 748 HH22 ARG 106 2HH2 ARG 106 -1.617 4.604 10.400 749 H THR 107 H THR 107 3.599 7.030 6.538 750 HA THR 107 HA THR 107 4.413 7.839 3.875 751 HB THR 107 HB THR 107 3.599 9.609 5.270 752 HG1 THR 107 HG1 THR 107 5.100 10.932 4.609 753 HG21 THR 107 1HG2 THR 107 3.988 8.709 7.472 754 HG22 THR 107 2HG2 THR 107 4.766 10.285 7.351 755 HG23 THR 107 3HG2 THR 107 5.732 8.814 7.249 756 H VAL 108 H VAL 108 6.215 7.132 3.004 757 HA VAL 108 HA VAL 108 8.432 6.359 4.786 758 HB VAL 108 HB VAL 108 9.106 4.714 3.025 759 HG11 VAL 108 1HG1 VAL 108 7.916 4.001 5.024 760 HG12 VAL 108 2HG1 VAL 108 7.420 3.042 3.631 761 HG13 VAL 108 3HG1 VAL 108 6.371 4.323 4.237 762 HG21 VAL 108 1HG2 VAL 108 7.922 5.688 1.122 763 HG22 VAL 108 2HG2 VAL 108 6.375 5.316 1.884 764 HG23 VAL 108 3HG2 VAL 108 7.443 4.009 1.370 765 H THR 109 H THR 109 10.206 7.524 4.564 766 HA THR 109 HA THR 109 10.551 9.070 2.091 767 HB THR 109 HB THR 109 12.204 10.399 3.484 768 HG1 THR 109 HG1 THR 109 10.880 9.316 5.737 769 HG21 THR 109 1HG2 THR 109 9.985 11.255 3.004 770 HG22 THR 109 2HG2 THR 109 10.427 11.648 4.665 771 HG23 THR 109 3HG2 THR 109 9.309 10.323 4.338 772 H SER 110 H SER 110 11.575 6.202 3.233 773 HA SER 110 HA SER 110 14.011 6.278 1.674 774 HB2 SER 110 1HB SER 110 14.286 5.259 4.487 775 HB3 SER 110 2HB SER 110 15.547 5.719 3.352 776 HG SER 110 HG SER 110 14.429 7.920 3.580 777 HA PRO 111 HA PRO 111 13.117 2.094 0.620 778 HB2 PRO 111 1HB PRO 111 15.898 1.509 1.531 779 HB3 PRO 111 2HB PRO 111 15.083 1.077 0.034 780 HG2 PRO 111 1HG PRO 111 16.837 3.054 0.060 781 HG3 PRO 111 2HG PRO 111 15.345 3.180 -0.894 782 HD2 PRO 111 1HD PRO 111 16.050 4.462 1.700 783 HD3 PRO 111 2HD PRO 111 15.071 5.087 0.360 784 H ASP 112 H ASP 112 15.193 2.245 3.527 785 HA ASP 112 HA ASP 112 14.374 -0.245 4.538 786 HB2 ASP 112 1HB ASP 112 15.711 2.118 5.828 787 HB3 ASP 112 2HB ASP 112 15.334 0.654 6.731 788 H GLU 113 H GLU 113 13.014 2.941 4.900 789 HA GLU 113 HA GLU 113 11.265 2.456 7.040 790 HB2 GLU 113 1HB GLU 113 10.957 4.246 4.620 791 HB3 GLU 113 2HB GLU 113 9.870 4.266 6.000 792 HG2 GLU 113 1HG GLU 113 12.821 4.787 6.197 793 HG3 GLU 113 2HG GLU 113 11.610 6.052 5.993 794 H ALA 114 H ALA 114 10.868 2.038 3.549 795 HA ALA 114 HA ALA 114 8.224 1.054 3.632 796 HB1 ALA 114 1HB ALA 114 8.638 0.309 1.338 797 HB2 ALA 114 2HB ALA 114 10.364 0.599 1.552 798 HB3 ALA 114 3HB ALA 114 9.232 1.951 1.592 799 H LYS 115 H LYS 115 11.367 -0.577 3.482 800 HA LYS 115 HA LYS 115 10.489 -3.216 3.327 801 HB2 LYS 115 1HB LYS 115 12.951 -2.185 4.752 802 HB3 LYS 115 2HB LYS 115 12.696 -3.831 4.191 803 HG2 LYS 115 1HG LYS 115 12.792 -3.159 1.912 804 HG3 LYS 115 2HG LYS 115 12.737 -1.450 2.351 805 HD2 LYS 115 1HD LYS 115 14.991 -1.897 1.830 806 HD3 LYS 115 2HD LYS 115 14.916 -1.848 3.590 807 HE2 LYS 115 1HE LYS 115 16.239 -3.717 3.108 808 HE3 LYS 115 2HE LYS 115 14.651 -4.384 3.476 809 HZ1 LYS 115 1HZ LYS 115 14.222 -4.519 1.086 810 HZ2 LYS 115 2HZ LYS 115 15.572 -5.429 1.527 811 HZ3 LYS 115 3HZ LYS 115 15.779 -3.932 0.762 812 H ARG 116 H ARG 116 10.929 -1.117 6.106 813 HA ARG 116 HA ARG 116 10.535 -3.003 8.145 814 HB2 ARG 116 1HB ARG 116 11.429 -0.835 8.659 815 HB3 ARG 116 2HB ARG 116 10.002 -0.034 8.021 816 HG2 ARG 116 1HG ARG 116 8.662 -0.958 9.842 817 HG3 ARG 116 2HG ARG 116 10.093 -1.771 10.480 818 HD2 ARG 116 1HD ARG 116 9.852 1.212 10.108 819 HD3 ARG 116 2HD ARG 116 9.539 0.373 11.627 820 HE ARG 116 HE ARG 116 12.014 -0.460 11.056 821 HH11 ARG 116 1HH1 ARG 116 10.631 2.754 10.967 822 HH12 ARG 116 2HH1 ARG 116 12.101 3.536 11.445 823 HH21 ARG 116 1HH2 ARG 116 13.954 0.571 11.705 824 HH22 ARG 116 2HH2 ARG 116 13.979 2.297 11.889 825 H TRP 117 H TRP 117 8.189 -0.723 6.694 826 HA TRP 117 HA TRP 117 6.042 -1.665 8.275 827 HB2 TRP 117 1HB TRP 117 5.964 -0.086 5.703 828 HB3 TRP 117 2HB TRP 117 4.602 -0.321 6.795 829 HD1 TRP 117 HD1 TRP 117 6.747 2.325 5.970 830 HE1 TRP 117 HE1 TRP 117 7.267 3.892 7.941 831 HE3 TRP 117 HE3 TRP 117 5.292 -0.703 9.828 832 HZ2 TRP 117 HZ2 TRP 117 7.084 3.850 10.758 833 HZ3 TRP 117 HZ3 TRP 117 5.501 0.136 12.127 834 HH2 TRP 117 HH2 TRP 117 6.379 2.367 12.581 835 H ILE 118 H ILE 118 7.221 -2.600 5.110 836 HA ILE 118 HA ILE 118 5.017 -4.105 4.264 837 HB ILE 118 HB ILE 118 7.961 -4.521 3.736 838 HG12 ILE 118 1HG1 ILE 118 5.761 -3.349 2.020 839 HG13 ILE 118 2HG1 ILE 118 6.961 -2.413 2.901 840 HG21 ILE 118 1HG2 ILE 118 5.610 -5.848 2.400 841 HG22 ILE 118 2HG2 ILE 118 6.809 -6.637 3.423 842 HG23 ILE 118 3HG2 ILE 118 7.285 -5.960 1.865 843 HD11 ILE 118 1HD1 ILE 118 8.730 -3.393 1.546 844 HD12 ILE 118 2HD1 ILE 118 7.518 -2.596 0.542 845 HD13 ILE 118 3HD1 ILE 118 7.537 -4.355 0.675 846 H LYS 119 H LYS 119 7.795 -5.030 6.275 847 HA LYS 119 HA LYS 119 6.923 -7.733 6.567 848 HB2 LYS 119 1HB LYS 119 8.972 -6.112 8.071 849 HB3 LYS 119 2HB LYS 119 8.677 -7.821 8.367 850 HG2 LYS 119 1HG LYS 119 9.228 -8.266 5.987 851 HG3 LYS 119 2HG LYS 119 9.657 -6.566 5.813 852 HD2 LYS 119 1HD LYS 119 10.942 -8.397 7.831 853 HD3 LYS 119 2HD LYS 119 11.575 -8.158 6.204 854 HE2 LYS 119 1HE LYS 119 12.811 -6.648 7.440 855 HE3 LYS 119 2HE LYS 119 11.510 -5.640 6.815 856 HZ1 LYS 119 1HZ LYS 119 10.380 -5.814 8.922 857 HZ2 LYS 119 2HZ LYS 119 11.951 -5.257 9.174 858 HZ3 LYS 119 3HZ LYS 119 11.562 -6.862 9.518 859 H GLU 120 H GLU 120 6.351 -4.768 8.312 860 HA GLU 120 HA GLU 120 5.242 -5.993 10.637 861 HB2 GLU 120 1HB GLU 120 4.865 -3.223 9.489 862 HB3 GLU 120 2HB GLU 120 4.257 -3.737 11.057 863 HG2 GLU 120 1HG GLU 120 7.139 -3.586 10.211 864 HG3 GLU 120 2HG GLU 120 6.307 -2.507 11.330 865 H PHE 121 H PHE 121 3.878 -4.660 7.662 866 HA PHE 121 HA PHE 121 1.168 -5.058 8.303 867 HB2 PHE 121 1HB PHE 121 1.992 -3.593 6.484 868 HB3 PHE 121 2HB PHE 121 2.470 -5.021 5.575 869 HD1 PHE 121 HD1 PHE 121 -0.516 -3.485 7.184 870 HD2 PHE 121 HD2 PHE 121 1.006 -5.918 4.040 871 HE1 PHE 121 HE1 PHE 121 -2.755 -3.571 6.170 872 HE2 PHE 121 HE2 PHE 121 -1.230 -6.006 3.022 873 HZ PHE 121 HZ PHE 121 -3.112 -4.834 4.086 874 H SER 122 H SER 122 3.615 -7.197 7.059 875 HA SER 122 HA SER 122 1.939 -9.238 6.071 876 HB2 SER 122 1HB SER 122 4.707 -9.497 7.275 877 HB3 SER 122 2HB SER 122 3.912 -10.677 6.235 878 HG SER 122 HG SER 122 4.432 -8.005 5.423 879 H GLU 123 H GLU 123 2.937 -8.340 9.279 880 HA GLU 123 HA GLU 123 2.110 -10.892 10.414 881 HB2 GLU 123 1HB GLU 123 3.316 -8.441 11.705 882 HB3 GLU 123 2HB GLU 123 2.964 -9.949 12.538 883 HG2 GLU 123 1HG GLU 123 4.913 -9.581 10.275 884 HG3 GLU 123 2HG GLU 123 5.314 -9.800 11.977 885 H GLU 124 H GLU 124 0.453 -8.369 9.375 886 HA GLU 124 HA GLU 124 -1.233 -7.887 11.664 887 HB2 GLU 124 1HB GLU 124 -1.537 -7.104 8.758 888 HB3 GLU 124 2HB GLU 124 -2.605 -6.583 10.052 889 HG2 GLU 124 1HG GLU 124 0.344 -6.007 9.972 890 HG3 GLU 124 2HG GLU 124 -0.902 -4.907 9.380 Start of MODEL 9 1 HA MET 21 HA MET 21 -8.442 -11.776 2.827 2 HB2 MET 21 1HB MET 21 -8.213 -11.846 5.277 3 HB3 MET 21 2HB MET 21 -6.492 -12.142 5.112 4 HG2 MET 21 1HG MET 21 -6.297 -9.941 3.961 5 HG3 MET 21 2HG MET 21 -7.990 -9.650 4.361 6 HE1 MET 21 1HE MET 21 -8.060 -11.191 7.199 7 HE2 MET 21 2HE MET 21 -8.885 -9.653 6.941 8 HE3 MET 21 3HE MET 21 -7.803 -9.856 8.319 9 H THR 22 H THR 22 -7.341 -10.613 1.363 10 HA THR 22 HA THR 22 -4.661 -11.562 0.624 11 HB THR 22 HB THR 22 -6.536 -9.822 -0.996 12 HG1 THR 22 HG1 THR 22 -6.140 -12.654 -1.057 13 HG21 THR 22 1HG2 THR 22 -4.184 -9.689 -1.663 14 HG22 THR 22 2HG2 THR 22 -5.128 -10.545 -2.883 15 HG23 THR 22 3HG2 THR 22 -4.103 -11.447 -1.768 16 H LEU 23 H LEU 23 -2.930 -10.229 0.829 17 HA LEU 23 HA LEU 23 -3.437 -7.555 1.905 18 HB2 LEU 23 1HB LEU 23 -0.899 -9.186 1.862 19 HB3 LEU 23 2HB LEU 23 -1.080 -7.613 2.615 20 HG LEU 23 HG LEU 23 -2.461 -10.163 3.456 21 HD11 LEU 23 1HD1 LEU 23 -0.323 -8.512 4.790 22 HD12 LEU 23 2HD1 LEU 23 -0.100 -10.094 4.043 23 HD13 LEU 23 3HD1 LEU 23 -1.112 -9.929 5.478 24 HD21 LEU 23 1HD2 LEU 23 -2.627 -7.386 4.617 25 HD22 LEU 23 2HD2 LEU 23 -3.297 -8.843 5.351 26 HD23 LEU 23 3HD2 LEU 23 -3.928 -8.263 3.811 27 H PHE 24 H PHE 24 -3.174 -5.832 0.702 28 HA PHE 24 HA PHE 24 -1.599 -6.048 -1.779 29 HB2 PHE 24 1HB PHE 24 -3.874 -4.159 -1.119 30 HB3 PHE 24 2HB PHE 24 -2.964 -4.162 -2.622 31 HD1 PHE 24 HD1 PHE 24 -5.235 -6.201 -0.529 32 HD2 PHE 24 HD2 PHE 24 -3.589 -5.557 -4.399 33 HE1 PHE 24 HE1 PHE 24 -6.825 -7.816 -1.472 34 HE2 PHE 24 HE2 PHE 24 -5.174 -7.174 -5.348 35 HZ PHE 24 HZ PHE 24 -6.799 -8.306 -3.885 36 H VAL 25 H VAL 25 -0.037 -4.532 -2.201 37 HA VAL 25 HA VAL 25 0.398 -2.499 -0.111 38 HB VAL 25 HB VAL 25 2.553 -3.929 -1.678 39 HG11 VAL 25 1HG1 VAL 25 3.102 -1.598 -1.165 40 HG12 VAL 25 2HG1 VAL 25 4.110 -2.713 -0.239 41 HG13 VAL 25 3HG1 VAL 25 2.756 -1.890 0.540 42 HG21 VAL 25 1HG2 VAL 25 1.801 -4.136 1.237 43 HG22 VAL 25 2HG2 VAL 25 3.188 -4.911 0.474 44 HG23 VAL 25 3HG2 VAL 25 1.552 -5.378 0.010 45 H LEU 26 H LEU 26 -0.231 -0.670 -0.968 46 HA LEU 26 HA LEU 26 0.347 -0.044 -3.771 47 HB2 LEU 26 1HB LEU 26 -1.453 1.079 -1.661 48 HB3 LEU 26 2HB LEU 26 -0.987 2.096 -3.008 49 HG LEU 26 HG LEU 26 -2.077 0.634 -4.579 50 HD11 LEU 26 1HD1 LEU 26 -3.275 -1.373 -3.894 51 HD12 LEU 26 2HD1 LEU 26 -2.681 -1.173 -2.247 52 HD13 LEU 26 3HD1 LEU 26 -1.550 -1.516 -3.556 53 HD21 LEU 26 1HD2 LEU 26 -3.821 1.089 -2.165 54 HD22 LEU 26 2HD2 LEU 26 -4.389 0.786 -3.806 55 HD23 LEU 26 3HD2 LEU 26 -3.487 2.255 -3.443 56 H ILE 27 H ILE 27 1.713 1.708 -4.322 57 HA ILE 27 HA ILE 27 3.048 3.081 -2.135 58 HB ILE 27 HB ILE 27 4.341 1.077 -2.240 59 HG12 ILE 27 1HG1 ILE 27 5.863 3.221 -3.736 60 HG13 ILE 27 2HG1 ILE 27 5.566 3.238 -2.000 61 HG21 ILE 27 1HG2 ILE 27 5.437 0.304 -4.288 62 HG22 ILE 27 2HG2 ILE 27 4.630 1.583 -5.196 63 HG23 ILE 27 3HG2 ILE 27 3.679 0.301 -4.442 64 HD11 ILE 27 1HD1 ILE 27 7.138 1.170 -3.515 65 HD12 ILE 27 2HD1 ILE 27 6.823 1.150 -1.780 66 HD13 ILE 27 3HD1 ILE 27 7.792 2.441 -2.485 67 H LEU 28 H LEU 28 3.399 5.132 -2.640 68 HA LEU 28 HA LEU 28 3.948 5.794 -5.472 69 HB2 LEU 28 1HB LEU 28 2.804 7.537 -3.282 70 HB3 LEU 28 2HB LEU 28 3.317 8.138 -4.838 71 HG LEU 28 HG LEU 28 1.558 6.710 -5.899 72 HD11 LEU 28 1HD1 LEU 28 1.322 5.093 -4.045 73 HD12 LEU 28 2HD1 LEU 28 -0.207 5.808 -4.542 74 HD13 LEU 28 3HD1 LEU 28 0.584 6.364 -3.069 75 HD21 LEU 28 1HD2 LEU 28 0.623 8.715 -3.854 76 HD22 LEU 28 2HD2 LEU 28 -0.268 8.196 -5.287 77 HD23 LEU 28 3HD2 LEU 28 1.241 9.091 -5.463 78 H SER 29 H SER 29 6.140 5.128 -4.960 79 HA SER 29 HA SER 29 7.640 7.519 -4.310 80 HB2 SER 29 1HB SER 29 7.602 6.183 -2.192 81 HB3 SER 29 2HB SER 29 8.335 4.840 -3.065 82 HG SER 29 HG SER 29 10.165 6.081 -3.392 83 H ASN 30 H ASN 30 8.105 7.612 -6.614 84 HA ASN 30 HA ASN 30 9.131 5.143 -7.755 85 HB2 ASN 30 1HB ASN 30 8.416 7.824 -8.902 86 HB3 ASN 30 2HB ASN 30 9.385 6.690 -9.836 87 HD21 ASN 30 1HD2 ASN 30 6.271 7.276 -8.375 88 HD22 ASN 30 2HD2 ASN 30 5.417 6.044 -9.240 89 H ASP 31 H ASP 31 10.941 5.038 -6.381 90 HA ASP 31 HA ASP 31 13.223 6.277 -7.757 91 HB2 ASP 31 1HB ASP 31 13.309 6.943 -5.435 92 HB3 ASP 31 2HB ASP 31 13.027 5.296 -4.899 93 H LYS 32 H LYS 32 14.757 4.756 -8.614 94 HA LYS 32 HA LYS 32 13.468 2.379 -9.421 95 HB2 LYS 32 1HB LYS 32 16.281 3.372 -9.757 96 HB3 LYS 32 2HB LYS 32 15.822 1.763 -10.292 97 HG2 LYS 32 1HG LYS 32 15.615 3.081 -12.197 98 HG3 LYS 32 2HG LYS 32 13.965 2.914 -11.609 99 HD2 LYS 32 1HD LYS 32 14.241 5.185 -12.229 100 HD3 LYS 32 2HD LYS 32 14.268 5.142 -10.468 101 HE2 LYS 32 1HE LYS 32 16.000 6.623 -11.378 102 HE3 LYS 32 2HE LYS 32 16.692 5.277 -10.478 103 HZ1 LYS 32 1HZ LYS 32 17.857 5.719 -12.568 104 HZ2 LYS 32 2HZ LYS 32 16.445 5.378 -13.433 105 HZ3 LYS 32 3HZ LYS 32 17.197 4.164 -12.528 106 H LYS 33 H LYS 33 16.323 2.784 -7.328 107 HA LYS 33 HA LYS 33 16.487 0.064 -6.594 108 HB2 LYS 33 1HB LYS 33 17.790 1.133 -4.570 109 HB3 LYS 33 2HB LYS 33 18.467 1.155 -6.193 110 HG2 LYS 33 1HG LYS 33 17.749 3.426 -6.513 111 HG3 LYS 33 2HG LYS 33 16.918 3.419 -4.961 112 HD2 LYS 33 1HD LYS 33 18.997 3.253 -3.783 113 HD3 LYS 33 2HD LYS 33 19.885 3.013 -5.291 114 HE2 LYS 33 1HE LYS 33 20.088 5.314 -4.426 115 HE3 LYS 33 2HE LYS 33 19.334 5.248 -6.018 116 HZ1 LYS 33 1HZ LYS 33 17.156 5.434 -4.911 117 HZ2 LYS 33 2HZ LYS 33 18.147 6.777 -4.627 118 HZ3 LYS 33 3HZ LYS 33 17.942 5.611 -3.421 119 H LEU 34 H LEU 34 14.806 2.804 -5.117 120 HA LEU 34 HA LEU 34 13.935 1.630 -2.749 121 HB2 LEU 34 1HB LEU 34 13.630 4.000 -3.344 122 HB3 LEU 34 2HB LEU 34 12.469 3.547 -4.569 123 HG LEU 34 HG LEU 34 11.607 4.517 -2.348 124 HD11 LEU 34 1HD1 LEU 34 9.619 3.096 -2.384 125 HD12 LEU 34 2HD1 LEU 34 10.471 1.936 -3.403 126 HD13 LEU 34 3HD1 LEU 34 10.129 3.557 -4.007 127 HD21 LEU 34 1HD2 LEU 34 11.228 2.926 -0.570 128 HD22 LEU 34 2HD2 LEU 34 12.955 3.123 -0.879 129 HD23 LEU 34 3HD2 LEU 34 12.112 1.689 -1.467 130 H ILE 35 H ILE 35 12.299 1.676 -5.918 131 HA ILE 35 HA ILE 35 10.101 0.109 -5.142 132 HB ILE 35 HB ILE 35 11.316 0.611 -7.858 133 HG12 ILE 35 1HG1 ILE 35 8.841 1.687 -6.484 134 HG13 ILE 35 2HG1 ILE 35 10.351 2.561 -6.718 135 HG21 ILE 35 1HG2 ILE 35 10.154 -1.494 -7.997 136 HG22 ILE 35 2HG2 ILE 35 9.196 -0.249 -8.799 137 HG23 ILE 35 3HG2 ILE 35 8.744 -0.810 -7.190 138 HD11 ILE 35 1HD1 ILE 35 8.621 3.227 -8.313 139 HD12 ILE 35 2HD1 ILE 35 8.560 1.574 -8.924 140 HD13 ILE 35 3HD1 ILE 35 10.029 2.532 -9.114 141 H GLU 36 H GLU 36 13.250 -0.750 -6.465 142 HA GLU 36 HA GLU 36 12.827 -3.488 -6.818 143 HB2 GLU 36 1HB GLU 36 15.187 -1.745 -6.396 144 HB3 GLU 36 2HB GLU 36 15.412 -3.465 -6.109 145 HG2 GLU 36 1HG GLU 36 14.288 -2.309 -8.647 146 HG3 GLU 36 2HG GLU 36 15.985 -2.727 -8.406 147 H GLU 37 H GLU 37 14.348 -1.881 -4.018 148 HA GLU 37 HA GLU 37 14.530 -4.174 -2.437 149 HB2 GLU 37 1HB GLU 37 14.464 -1.246 -1.776 150 HB3 GLU 37 2HB GLU 37 14.596 -2.464 -0.521 151 HG2 GLU 37 1HG GLU 37 16.510 -2.091 -2.809 152 HG3 GLU 37 2HG GLU 37 16.773 -1.577 -1.142 153 H ALA 38 H ALA 38 11.941 -1.763 -2.640 154 HA ALA 38 HA ALA 38 10.413 -2.730 -0.474 155 HB1 ALA 38 1HB ALA 38 9.457 -1.276 -2.941 156 HB2 ALA 38 2HB ALA 38 10.075 -0.517 -1.473 157 HB3 ALA 38 3HB ALA 38 8.575 -1.445 -1.422 158 H ARG 39 H ARG 39 10.298 -3.481 -3.957 159 HA ARG 39 HA ARG 39 8.081 -5.238 -3.689 160 HB2 ARG 39 1HB ARG 39 8.530 -4.254 -5.845 161 HB3 ARG 39 2HB ARG 39 10.125 -4.992 -5.896 162 HG2 ARG 39 1HG ARG 39 9.235 -7.150 -6.202 163 HG3 ARG 39 2HG ARG 39 7.603 -6.636 -5.760 164 HD2 ARG 39 1HD ARG 39 7.490 -5.266 -7.777 165 HD3 ARG 39 2HD ARG 39 9.137 -5.725 -8.200 166 HE ARG 39 HE ARG 39 7.983 -8.117 -8.077 167 HH11 ARG 39 1HH1 ARG 39 6.826 -5.144 -9.539 168 HH12 ARG 39 2HH1 ARG 39 5.962 -5.954 -10.805 169 HH21 ARG 39 1HH2 ARG 39 6.842 -9.178 -9.738 170 HH22 ARG 39 2HH2 ARG 39 5.966 -8.253 -10.915 171 H LYS 40 H LYS 40 11.592 -5.739 -3.664 172 HA LYS 40 HA LYS 40 11.595 -8.524 -3.784 173 HB2 LYS 40 1HB LYS 40 13.459 -6.712 -2.242 174 HB3 LYS 40 2HB LYS 40 13.754 -8.416 -2.556 175 HG2 LYS 40 1HG LYS 40 13.743 -7.958 -4.967 176 HG3 LYS 40 2HG LYS 40 13.501 -6.245 -4.624 177 HD2 LYS 40 1HD LYS 40 15.635 -6.348 -3.270 178 HD3 LYS 40 2HD LYS 40 15.892 -7.950 -3.964 179 HE2 LYS 40 1HE LYS 40 15.636 -5.351 -5.466 180 HE3 LYS 40 2HE LYS 40 17.106 -6.295 -5.241 181 HZ1 LYS 40 1HZ LYS 40 14.704 -7.305 -6.661 182 HZ2 LYS 40 2HZ LYS 40 16.232 -8.027 -6.595 183 HZ3 LYS 40 3HZ LYS 40 16.016 -6.572 -7.439 184 H MET 41 H MET 41 10.857 -6.388 -1.116 185 HA MET 41 HA MET 41 10.822 -8.423 0.878 186 HB2 MET 41 1HB MET 41 11.233 -6.133 1.482 187 HB3 MET 41 2HB MET 41 9.717 -5.619 0.759 188 HG2 MET 41 1HG MET 41 9.521 -5.636 3.122 189 HG3 MET 41 2HG MET 41 8.495 -6.897 2.450 190 HE1 MET 41 1HE MET 41 11.699 -6.055 4.511 191 HE2 MET 41 2HE MET 41 12.408 -6.851 3.107 192 HE3 MET 41 3HE MET 41 12.468 -7.631 4.687 193 H ALA 42 H ALA 42 8.236 -6.598 -0.793 194 HA ALA 42 HA ALA 42 6.127 -8.070 0.459 195 HB1 ALA 42 1HB ALA 42 4.652 -6.841 -1.016 196 HB2 ALA 42 2HB ALA 42 6.029 -6.298 -1.974 197 HB3 ALA 42 3HB ALA 42 5.851 -5.766 -0.303 198 H GLU 43 H GLU 43 7.684 -8.252 -2.710 199 HA GLU 43 HA GLU 43 5.921 -10.020 -3.965 200 HB2 GLU 43 1HB GLU 43 7.761 -8.797 -5.093 201 HB3 GLU 43 2HB GLU 43 8.922 -9.851 -4.301 202 HG2 GLU 43 1HG GLU 43 7.961 -11.773 -5.474 203 HG3 GLU 43 2HG GLU 43 6.828 -10.694 -6.291 204 H LYS 44 H LYS 44 8.896 -10.645 -2.161 205 HA LYS 44 HA LYS 44 8.706 -13.460 -2.144 206 HB2 LYS 44 1HB LYS 44 10.819 -12.364 -1.783 207 HB3 LYS 44 2HB LYS 44 10.194 -11.506 -0.388 208 HG2 LYS 44 1HG LYS 44 10.143 -14.458 -0.261 209 HG3 LYS 44 2HG LYS 44 11.724 -13.682 -0.208 210 HD2 LYS 44 1HD LYS 44 9.412 -12.993 1.609 211 HD3 LYS 44 2HD LYS 44 10.726 -14.088 2.037 212 HE2 LYS 44 1HE LYS 44 11.028 -11.172 1.314 213 HE3 LYS 44 2HE LYS 44 11.075 -11.834 2.944 214 HZ1 LYS 44 1HZ LYS 44 12.998 -12.432 0.763 215 HZ2 LYS 44 2HZ LYS 44 13.029 -13.127 2.303 216 HZ3 LYS 44 3HZ LYS 44 13.291 -11.468 2.121 217 H ALA 45 H ALA 45 7.380 -10.964 -0.091 218 HA ALA 45 HA ALA 45 6.581 -12.729 2.014 219 HB1 ALA 45 1HB ALA 45 7.009 -10.390 2.476 220 HB2 ALA 45 2HB ALA 45 5.343 -10.805 2.884 221 HB3 ALA 45 3HB ALA 45 5.695 -9.922 1.399 222 H ASN 46 H ASN 46 5.507 -12.373 -1.060 223 HA ASN 46 HA ASN 46 3.730 -13.142 -2.225 224 HB2 ASN 46 1HB ASN 46 3.899 -15.094 -0.651 225 HB3 ASN 46 2HB ASN 46 2.706 -14.304 0.375 226 HD21 ASN 46 1HD2 ASN 46 1.217 -15.943 0.147 227 HD22 ASN 46 2HD2 ASN 46 0.352 -16.220 -1.323 228 H LEU 47 H LEU 47 3.715 -10.544 -1.344 229 HA LEU 47 HA LEU 47 0.869 -10.032 -0.772 230 HB2 LEU 47 1HB LEU 47 3.030 -7.949 -0.861 231 HB3 LEU 47 2HB LEU 47 1.464 -7.857 -0.086 232 HG LEU 47 HG LEU 47 3.826 -9.482 0.854 233 HD11 LEU 47 1HD1 LEU 47 3.823 -7.928 2.728 234 HD12 LEU 47 2HD1 LEU 47 2.483 -7.043 1.994 235 HD13 LEU 47 3HD1 LEU 47 4.056 -7.084 1.197 236 HD21 LEU 47 1HD2 LEU 47 1.109 -9.144 2.102 237 HD22 LEU 47 2HD2 LEU 47 2.485 -9.990 2.807 238 HD23 LEU 47 3HD2 LEU 47 1.721 -10.614 1.345 239 H ILE 48 H ILE 48 -0.228 -8.459 -2.116 240 HA ILE 48 HA ILE 48 0.836 -8.431 -4.837 241 HB ILE 48 HB ILE 48 -1.896 -7.562 -3.869 242 HG12 ILE 48 1HG1 ILE 48 -0.989 -10.128 -5.198 243 HG13 ILE 48 2HG1 ILE 48 -1.560 -9.960 -3.541 244 HG21 ILE 48 1HG2 ILE 48 -0.841 -8.014 -6.661 245 HG22 ILE 48 2HG2 ILE 48 -1.230 -6.455 -5.935 246 HG23 ILE 48 3HG2 ILE 48 -2.510 -7.629 -6.244 247 HD11 ILE 48 1HD1 ILE 48 -3.185 -9.513 -6.033 248 HD12 ILE 48 2HD1 ILE 48 -3.765 -9.314 -4.379 249 HD13 ILE 48 3HD1 ILE 48 -3.276 -10.907 -4.958 250 H LEU 49 H LEU 49 2.351 -6.864 -4.898 251 HA LEU 49 HA LEU 49 1.794 -4.261 -3.724 252 HB2 LEU 49 1HB LEU 49 4.007 -5.409 -3.455 253 HB3 LEU 49 2HB LEU 49 4.268 -5.217 -5.176 254 HG LEU 49 HG LEU 49 3.767 -2.799 -3.470 255 HD11 LEU 49 1HD1 LEU 49 6.422 -4.171 -3.853 256 HD12 LEU 49 2HD1 LEU 49 5.532 -4.049 -2.336 257 HD13 LEU 49 3HD1 LEU 49 6.170 -2.595 -3.103 258 HD21 LEU 49 1HD2 LEU 49 5.378 -3.286 -5.975 259 HD22 LEU 49 2HD2 LEU 49 5.184 -1.735 -5.159 260 HD23 LEU 49 3HD2 LEU 49 3.789 -2.525 -5.893 261 H ILE 50 H ILE 50 1.286 -2.485 -4.842 262 HA ILE 50 HA ILE 50 1.165 -2.695 -7.787 263 HB ILE 50 HB ILE 50 -0.670 -1.019 -6.064 264 HG12 ILE 50 1HG1 ILE 50 -1.042 -3.425 -5.604 265 HG13 ILE 50 2HG1 ILE 50 -2.413 -2.688 -6.427 266 HG21 ILE 50 1HG2 ILE 50 -0.864 -1.849 -8.955 267 HG22 ILE 50 2HG2 ILE 50 -0.358 -0.265 -8.373 268 HG23 ILE 50 3HG2 ILE 50 -2.005 -0.823 -8.084 269 HD11 ILE 50 1HD1 ILE 50 -1.958 -4.884 -7.314 270 HD12 ILE 50 2HD1 ILE 50 -0.300 -4.415 -7.686 271 HD13 ILE 50 3HD1 ILE 50 -1.644 -3.655 -8.537 272 H THR 51 H THR 51 2.990 -1.587 -8.374 273 HA THR 51 HA THR 51 3.697 0.914 -7.140 274 HB THR 51 HB THR 51 5.210 0.989 -9.307 275 HG1 THR 51 HG1 THR 51 4.818 -0.704 -10.517 276 HG21 THR 51 1HG2 THR 51 5.657 -0.991 -7.074 277 HG22 THR 51 2HG2 THR 51 6.033 0.731 -7.016 278 HG23 THR 51 3HG2 THR 51 6.901 -0.325 -8.130 279 H VAL 52 H VAL 52 2.811 2.802 -7.586 280 HA VAL 52 HA VAL 52 1.561 3.195 -10.220 281 HB VAL 52 HB VAL 52 -0.114 4.682 -9.001 282 HG11 VAL 52 1HG1 VAL 52 -0.630 2.467 -9.977 283 HG12 VAL 52 2HG1 VAL 52 -1.606 2.856 -8.561 284 HG13 VAL 52 3HG1 VAL 52 -0.254 1.732 -8.416 285 HG21 VAL 52 1HG2 VAL 52 0.871 3.085 -6.641 286 HG22 VAL 52 2HG2 VAL 52 -0.556 4.120 -6.658 287 HG23 VAL 52 3HG2 VAL 52 1.047 4.825 -6.866 288 H GLY 53 H GLY 53 0.891 5.686 -10.287 289 HA2 GLY 53 1HA GLY 53 3.160 7.277 -9.318 290 HA3 GLY 53 2HA GLY 53 2.713 7.323 -11.015 291 H ASP 54 H ASP 54 1.918 8.311 -7.832 292 HA ASP 54 HA ASP 54 1.177 10.388 -7.216 293 HB2 ASP 54 1HB ASP 54 0.270 10.584 -10.084 294 HB3 ASP 54 2HB ASP 54 -0.178 11.784 -8.880 295 H GLU 55 H GLU 55 -0.953 11.388 -6.674 296 HA GLU 55 HA GLU 55 -2.541 9.559 -5.403 297 HB2 GLU 55 1HB GLU 55 -3.506 12.219 -6.466 298 HB3 GLU 55 2HB GLU 55 -4.207 11.313 -5.132 299 HG2 GLU 55 1HG GLU 55 -2.984 12.815 -3.955 300 HG3 GLU 55 2HG GLU 55 -1.767 11.553 -4.153 301 H GLU 56 H GLU 56 -3.013 10.910 -8.604 302 HA GLU 56 HA GLU 56 -5.553 9.941 -9.167 303 HB2 GLU 56 1HB GLU 56 -3.270 10.260 -11.114 304 HB3 GLU 56 2HB GLU 56 -4.989 10.303 -11.489 305 HG2 GLU 56 1HG GLU 56 -5.234 12.322 -10.141 306 HG3 GLU 56 2HG GLU 56 -3.511 12.284 -9.769 307 H GLU 57 H GLU 57 -2.394 8.442 -9.877 308 HA GLU 57 HA GLU 57 -3.560 6.074 -10.907 309 HB2 GLU 57 1HB GLU 57 -0.779 6.801 -10.088 310 HB3 GLU 57 2HB GLU 57 -1.190 5.145 -10.515 311 HG2 GLU 57 1HG GLU 57 -1.567 7.544 -12.291 312 HG3 GLU 57 2HG GLU 57 -0.248 6.378 -12.404 313 H LEU 58 H LEU 58 -2.612 7.120 -7.735 314 HA LEU 58 HA LEU 58 -2.725 4.620 -6.435 315 HB2 LEU 58 1HB LEU 58 -1.782 6.582 -5.352 316 HB3 LEU 58 2HB LEU 58 -3.334 7.389 -5.399 317 HG LEU 58 HG LEU 58 -4.256 5.737 -3.835 318 HD11 LEU 58 1HD1 LEU 58 -2.831 4.122 -2.725 319 HD12 LEU 58 2HD1 LEU 58 -1.455 4.628 -3.702 320 HD13 LEU 58 3HD1 LEU 58 -2.832 3.836 -4.466 321 HD21 LEU 58 1HD2 LEU 58 -3.285 7.791 -2.964 322 HD22 LEU 58 2HD2 LEU 58 -1.699 7.023 -2.887 323 HD23 LEU 58 3HD2 LEU 58 -3.009 6.449 -1.855 324 H LYS 59 H LYS 59 -5.188 7.039 -7.182 325 HA LYS 59 HA LYS 59 -7.360 5.937 -5.851 326 HB2 LYS 59 1HB LYS 59 -7.332 7.388 -8.493 327 HB3 LYS 59 2HB LYS 59 -8.768 7.097 -7.523 328 HG2 LYS 59 1HG LYS 59 -7.829 8.445 -5.720 329 HG3 LYS 59 2HG LYS 59 -6.380 8.728 -6.686 330 HD2 LYS 59 1HD LYS 59 -7.759 9.833 -8.398 331 HD3 LYS 59 2HD LYS 59 -9.189 9.577 -7.396 332 HE2 LYS 59 1HE LYS 59 -6.763 11.214 -6.661 333 HE3 LYS 59 2HE LYS 59 -8.343 11.844 -7.124 334 HZ1 LYS 59 1HZ LYS 59 -7.797 10.172 -4.733 335 HZ2 LYS 59 2HZ LYS 59 -9.297 10.818 -5.167 336 HZ3 LYS 59 3HZ LYS 59 -8.029 11.846 -4.724 337 H LYS 60 H LYS 60 -5.851 5.011 -8.812 338 HA LYS 60 HA LYS 60 -8.007 3.269 -9.612 339 HB2 LYS 60 1HB LYS 60 -5.261 3.392 -10.818 340 HB3 LYS 60 2HB LYS 60 -6.777 2.951 -11.596 341 HG2 LYS 60 1HG LYS 60 -6.497 5.680 -10.443 342 HG3 LYS 60 2HG LYS 60 -5.684 5.311 -11.972 343 HD2 LYS 60 1HD LYS 60 -7.824 6.264 -12.474 344 HD3 LYS 60 2HD LYS 60 -7.888 4.549 -12.874 345 HE2 LYS 60 1HE LYS 60 -9.116 4.062 -10.882 346 HE3 LYS 60 2HE LYS 60 -8.878 5.699 -10.272 347 HZ1 LYS 60 1HZ LYS 60 -10.256 6.539 -12.040 348 HZ2 LYS 60 2HZ LYS 60 -11.101 5.341 -11.197 349 HZ3 LYS 60 3HZ LYS 60 -10.422 4.993 -12.708 350 H ALA 61 H ALA 61 -4.876 3.040 -8.079 351 HA ALA 61 HA ALA 61 -4.711 0.193 -8.103 352 HB1 ALA 61 1HB ALA 61 -2.723 1.552 -7.784 353 HB2 ALA 61 2HB ALA 61 -2.966 0.499 -6.393 354 HB3 ALA 61 3HB ALA 61 -3.386 2.209 -6.288 355 H ILE 62 H ILE 62 -5.985 2.606 -5.896 356 HA ILE 62 HA ILE 62 -6.643 0.970 -3.730 357 HB ILE 62 HB ILE 62 -7.973 3.477 -4.766 358 HG12 ILE 62 1HG1 ILE 62 -6.136 3.045 -2.404 359 HG13 ILE 62 2HG1 ILE 62 -5.606 3.630 -3.979 360 HG21 ILE 62 1HG2 ILE 62 -8.433 2.048 -2.151 361 HG22 ILE 62 2HG2 ILE 62 -9.603 2.262 -3.455 362 HG23 ILE 62 3HG2 ILE 62 -9.028 3.661 -2.547 363 HD11 ILE 62 1HD1 ILE 62 -5.881 5.444 -2.389 364 HD12 ILE 62 2HD1 ILE 62 -7.574 5.003 -2.166 365 HD13 ILE 62 3HD1 ILE 62 -7.015 5.594 -3.730 366 H LYS 63 H LYS 63 -8.647 1.922 -6.529 367 HA LYS 63 HA LYS 63 -10.816 0.265 -5.730 368 HB2 LYS 63 1HB LYS 63 -11.091 2.270 -7.166 369 HB3 LYS 63 2HB LYS 63 -10.256 1.428 -8.463 370 HG2 LYS 63 1HG LYS 63 -12.698 1.402 -8.732 371 HG3 LYS 63 2HG LYS 63 -12.018 -0.220 -8.584 372 HD2 LYS 63 1HD LYS 63 -12.639 -0.221 -6.188 373 HD3 LYS 63 2HD LYS 63 -13.390 1.360 -6.406 374 HE2 LYS 63 1HE LYS 63 -14.994 0.438 -7.945 375 HE3 LYS 63 2HE LYS 63 -14.178 -1.125 -7.916 376 HZ1 LYS 63 1HZ LYS 63 -16.129 -1.144 -6.507 377 HZ2 LYS 63 2HZ LYS 63 -15.541 0.164 -5.613 378 HZ3 LYS 63 3HZ LYS 63 -14.733 -1.322 -5.562 379 H LYS 64 H LYS 64 -7.978 -0.204 -7.704 380 HA LYS 64 HA LYS 64 -8.745 -2.624 -8.937 381 HB2 LYS 64 1HB LYS 64 -6.791 -1.253 -9.630 382 HB3 LYS 64 2HB LYS 64 -5.966 -1.727 -8.153 383 HG2 LYS 64 1HG LYS 64 -5.914 -4.022 -8.853 384 HG3 LYS 64 2HG LYS 64 -6.896 -3.650 -10.271 385 HD2 LYS 64 1HD LYS 64 -5.099 -2.152 -11.072 386 HD3 LYS 64 2HD LYS 64 -4.113 -2.640 -9.693 387 HE2 LYS 64 1HE LYS 64 -4.038 -4.902 -10.462 388 HE3 LYS 64 2HE LYS 64 -5.217 -4.565 -11.728 389 HZ1 LYS 64 1HZ LYS 64 -3.627 -3.120 -12.801 390 HZ2 LYS 64 2HZ LYS 64 -2.948 -4.653 -12.583 391 HZ3 LYS 64 3HZ LYS 64 -2.500 -3.380 -11.568 392 H ALA 65 H ALA 65 -6.913 -1.961 -5.961 393 HA ALA 65 HA ALA 65 -6.632 -4.637 -5.134 394 HB1 ALA 65 1HB ALA 65 -5.332 -2.794 -4.181 395 HB2 ALA 65 2HB ALA 65 -6.161 -3.715 -2.925 396 HB3 ALA 65 3HB ALA 65 -6.794 -2.150 -3.434 397 H ASP 66 H ASP 66 -9.085 -2.199 -4.456 398 HA ASP 66 HA ASP 66 -10.771 -3.622 -2.755 399 HB2 ASP 66 1HB ASP 66 -11.100 -1.266 -3.144 400 HB3 ASP 66 2HB ASP 66 -11.367 -1.532 -4.859 401 H ASP 67 H ASP 67 -10.396 -3.761 -6.226 402 HA ASP 67 HA ASP 67 -12.800 -5.305 -6.614 403 HB2 ASP 67 1HB ASP 67 -12.027 -3.624 -8.266 404 HB3 ASP 67 2HB ASP 67 -10.624 -4.634 -8.597 405 H ILE 68 H ILE 68 -9.291 -5.912 -6.728 406 HA ILE 68 HA ILE 68 -9.526 -8.606 -7.606 407 HB ILE 68 HB ILE 68 -7.273 -7.315 -6.055 408 HG12 ILE 68 1HG1 ILE 68 -7.562 -7.785 -9.031 409 HG13 ILE 68 2HG1 ILE 68 -7.793 -6.232 -8.236 410 HG21 ILE 68 1HG2 ILE 68 -5.893 -9.149 -6.872 411 HG22 ILE 68 2HG2 ILE 68 -7.290 -9.854 -7.686 412 HG23 ILE 68 3HG2 ILE 68 -7.248 -9.768 -5.925 413 HD11 ILE 68 1HD1 ILE 68 -5.461 -6.239 -7.532 414 HD12 ILE 68 2HD1 ILE 68 -5.603 -6.395 -9.283 415 HD13 ILE 68 3HD1 ILE 68 -5.230 -7.810 -8.299 416 H ALA 69 H ALA 69 -9.338 -7.095 -4.436 417 HA ALA 69 HA ALA 69 -9.066 -9.455 -2.912 418 HB1 ALA 69 1HB ALA 69 -9.645 -8.061 -1.012 419 HB2 ALA 69 2HB ALA 69 -10.276 -6.818 -2.088 420 HB3 ALA 69 3HB ALA 69 -8.554 -7.186 -2.086 421 H LYS 70 H LYS 70 -11.872 -7.375 -3.406 422 HA LYS 70 HA LYS 70 -13.726 -8.955 -1.993 423 HB2 LYS 70 1HB LYS 70 -13.678 -6.465 -2.912 424 HB3 LYS 70 2HB LYS 70 -14.551 -7.215 -4.237 425 HG2 LYS 70 1HG LYS 70 -16.321 -7.891 -2.781 426 HG3 LYS 70 2HG LYS 70 -15.417 -7.363 -1.360 427 HD2 LYS 70 1HD LYS 70 -16.499 -5.614 -3.569 428 HD3 LYS 70 2HD LYS 70 -17.081 -5.698 -1.906 429 HE2 LYS 70 1HE LYS 70 -14.967 -4.821 -1.097 430 HE3 LYS 70 2HE LYS 70 -14.317 -4.812 -2.731 431 HZ1 LYS 70 1HZ LYS 70 -16.397 -3.067 -1.580 432 HZ2 LYS 70 2HZ LYS 70 -16.239 -3.267 -3.254 433 HZ3 LYS 70 3HZ LYS 70 -14.950 -2.638 -2.358 434 H LYS 71 H LYS 71 -12.527 -9.073 -5.205 435 HA LYS 71 HA LYS 71 -14.478 -10.055 -6.788 436 HB2 LYS 71 1HB LYS 71 -12.149 -9.649 -7.486 437 HB3 LYS 71 2HB LYS 71 -11.644 -11.095 -6.626 438 HG2 LYS 71 1HG LYS 71 -13.002 -12.461 -8.131 439 HG3 LYS 71 2HG LYS 71 -13.493 -11.003 -8.999 440 HD2 LYS 71 1HD LYS 71 -11.128 -10.551 -9.519 441 HD3 LYS 71 2HD LYS 71 -10.681 -12.053 -8.711 442 HE2 LYS 71 1HE LYS 71 -12.054 -13.303 -10.322 443 HE3 LYS 71 2HE LYS 71 -12.444 -11.793 -11.143 444 HZ1 LYS 71 1HZ LYS 71 -10.081 -11.489 -11.600 445 HZ2 LYS 71 2HZ LYS 71 -10.651 -12.934 -12.262 446 HZ3 LYS 71 3HZ LYS 71 -9.730 -12.962 -10.846 447 H GLN 72 H GLN 72 -12.521 -11.982 -4.527 448 HA GLN 72 HA GLN 72 -14.545 -14.093 -4.848 449 HB2 GLN 72 1HB GLN 72 -12.511 -15.689 -4.407 450 HB3 GLN 72 2HB GLN 72 -12.875 -15.101 -6.022 451 HG2 GLN 72 1HG GLN 72 -11.145 -13.451 -5.878 452 HG3 GLN 72 2HG GLN 72 -10.849 -13.835 -4.185 453 HE21 GLN 72 1HE2 GLN 72 -8.696 -14.323 -4.571 454 HE22 GLN 72 2HE2 GLN 72 -8.202 -15.761 -5.394 455 H ASN 73 H ASN 73 -11.781 -13.300 -2.662 456 HA ASN 73 HA ASN 73 -13.424 -14.479 -0.510 457 HB2 ASN 73 1HB ASN 73 -10.415 -14.555 -0.759 458 HB3 ASN 73 2HB ASN 73 -11.348 -15.232 0.566 459 HD21 ASN 73 1HD2 ASN 73 -13.457 -16.286 -1.116 460 HD22 ASN 73 2HD2 ASN 73 -12.784 -17.643 -1.949 461 H SER 74 H SER 74 -11.196 -11.942 -1.336 462 HA SER 74 HA SER 74 -10.691 -11.303 1.423 463 HB2 SER 74 1HB SER 74 -8.879 -11.414 -0.263 464 HB3 SER 74 2HB SER 74 -9.561 -9.987 -1.040 465 HG SER 74 HG SER 74 -9.321 -8.955 1.078 466 H SER 75 H SER 75 -13.368 -10.680 0.219 467 HA SER 75 HA SER 75 -13.874 -8.044 -0.263 468 HB2 SER 75 1HB SER 75 -15.524 -9.818 1.547 469 HB3 SER 75 2HB SER 75 -16.099 -8.425 0.629 470 HG SER 75 HG SER 75 -16.116 -10.862 -0.195 471 H GLU 76 H GLU 76 -12.947 -9.435 2.832 472 HA GLU 76 HA GLU 76 -12.702 -6.674 3.819 473 HB2 GLU 76 1HB GLU 76 -14.027 -8.129 5.312 474 HB3 GLU 76 2HB GLU 76 -12.688 -9.259 5.400 475 HG2 GLU 76 1HG GLU 76 -12.165 -6.452 6.210 476 HG3 GLU 76 2HG GLU 76 -13.157 -7.445 7.276 477 H ALA 77 H ALA 77 -10.809 -6.056 2.984 478 HA ALA 77 HA ALA 77 -8.507 -7.864 3.233 479 HB1 ALA 77 1HB ALA 77 -9.145 -7.281 0.918 480 HB2 ALA 77 2HB ALA 77 -7.532 -6.712 1.342 481 HB3 ALA 77 3HB ALA 77 -8.883 -5.580 1.298 482 H LYS 78 H LYS 78 -6.404 -6.720 3.438 483 HA LYS 78 HA LYS 78 -6.643 -4.121 4.766 484 HB2 LYS 78 1HB LYS 78 -4.715 -6.293 5.617 485 HB3 LYS 78 2HB LYS 78 -4.923 -4.716 6.367 486 HG2 LYS 78 1HG LYS 78 -7.333 -5.437 6.806 487 HG3 LYS 78 2HG LYS 78 -6.786 -7.065 6.405 488 HD2 LYS 78 1HD LYS 78 -4.968 -6.703 8.152 489 HD3 LYS 78 2HD LYS 78 -5.902 -5.296 8.666 490 HE2 LYS 78 1HE LYS 78 -6.780 -8.175 8.641 491 HE3 LYS 78 2HE LYS 78 -6.510 -7.153 10.046 492 HZ1 LYS 78 1HZ LYS 78 -8.835 -7.304 9.680 493 HZ2 LYS 78 2HZ LYS 78 -8.697 -6.912 8.041 494 HZ3 LYS 78 3HZ LYS 78 -8.379 -5.736 9.228 495 H ILE 79 H ILE 79 -5.356 -2.630 3.921 496 HA ILE 79 HA ILE 79 -3.402 -3.533 1.908 497 HB ILE 79 HB ILE 79 -5.231 -1.129 1.714 498 HG12 ILE 79 1HG1 ILE 79 -5.331 -3.722 0.161 499 HG13 ILE 79 2HG1 ILE 79 -6.416 -3.302 1.485 500 HG21 ILE 79 1HG2 ILE 79 -3.119 -0.761 0.582 501 HG22 ILE 79 2HG2 ILE 79 -4.412 -0.970 -0.599 502 HG23 ILE 79 3HG2 ILE 79 -3.289 -2.291 -0.278 503 HD11 ILE 79 1HD1 ILE 79 -6.167 -1.825 -1.127 504 HD12 ILE 79 2HD1 ILE 79 -7.263 -1.418 0.194 505 HD13 ILE 79 3HD1 ILE 79 -7.460 -2.938 -0.678 506 H LEU 80 H LEU 80 -1.474 -2.396 1.814 507 HA LEU 80 HA LEU 80 -1.138 -0.282 3.847 508 HB2 LEU 80 1HB LEU 80 0.258 -2.580 3.717 509 HB3 LEU 80 2HB LEU 80 1.227 -1.605 2.621 510 HG LEU 80 HG LEU 80 0.684 -1.070 5.544 511 HD11 LEU 80 1HD1 LEU 80 2.381 -2.762 5.034 512 HD12 LEU 80 2HD1 LEU 80 3.074 -1.323 5.779 513 HD13 LEU 80 3HD1 LEU 80 3.241 -1.585 4.043 514 HD21 LEU 80 1HD2 LEU 80 2.130 0.893 5.302 515 HD22 LEU 80 2HD2 LEU 80 0.634 1.049 4.379 516 HD23 LEU 80 3HD2 LEU 80 2.142 0.654 3.556 517 H ILE 81 H ILE 81 -0.867 1.720 3.058 518 HA ILE 81 HA ILE 81 0.070 1.987 0.279 519 HB ILE 81 HB ILE 81 -1.555 3.935 1.930 520 HG12 ILE 81 1HG1 ILE 81 -2.245 2.397 -0.583 521 HG13 ILE 81 2HG1 ILE 81 -2.810 1.996 1.033 522 HG21 ILE 81 1HG2 ILE 81 -0.513 4.208 -0.890 523 HG22 ILE 81 2HG2 ILE 81 0.030 5.126 0.514 524 HG23 ILE 81 3HG2 ILE 81 -1.615 5.330 -0.089 525 HD11 ILE 81 1HD1 ILE 81 -3.427 4.531 -0.465 526 HD12 ILE 81 2HD1 ILE 81 -4.028 4.098 1.135 527 HD13 ILE 81 3HD1 ILE 81 -4.510 3.152 -0.273 528 H LEU 82 H LEU 82 2.206 2.176 0.384 529 HA LEU 82 HA LEU 82 3.401 4.016 2.331 530 HB2 LEU 82 1HB LEU 82 4.668 2.024 0.448 531 HB3 LEU 82 2HB LEU 82 5.562 3.078 1.526 532 HG LEU 82 HG LEU 82 3.647 0.907 2.375 533 HD11 LEU 82 1HD1 LEU 82 5.655 -0.198 3.221 534 HD12 LEU 82 2HD1 LEU 82 6.648 1.086 2.530 535 HD13 LEU 82 3HD1 LEU 82 5.719 0.023 1.471 536 HD21 LEU 82 1HD2 LEU 82 5.399 2.725 4.022 537 HD22 LEU 82 2HD2 LEU 82 4.428 1.387 4.637 538 HD23 LEU 82 3HD2 LEU 82 3.640 2.794 3.922 539 H LEU 83 H LEU 83 4.476 5.846 1.707 540 HA LEU 83 HA LEU 83 5.095 6.395 -1.030 541 HB2 LEU 83 1HB LEU 83 3.565 8.522 -0.930 542 HB3 LEU 83 2HB LEU 83 2.926 6.984 -1.471 543 HG LEU 83 HG LEU 83 2.007 6.634 0.841 544 HD11 LEU 83 1HD1 LEU 83 2.690 9.544 1.201 545 HD12 LEU 83 2HD1 LEU 83 3.482 8.202 2.024 546 HD13 LEU 83 3HD1 LEU 83 1.773 8.531 2.316 547 HD21 LEU 83 1HD2 LEU 83 1.051 9.060 -0.668 548 HD22 LEU 83 2HD2 LEU 83 0.115 8.143 0.512 549 HD23 LEU 83 3HD2 LEU 83 0.611 7.384 -1.001 550 H GLU 84 H GLU 84 6.283 8.378 -1.292 551 HA GLU 84 HA GLU 84 7.196 9.516 1.265 552 HB2 GLU 84 1HB GLU 84 8.809 8.692 -0.599 553 HB3 GLU 84 2HB GLU 84 8.310 10.123 -1.481 554 HG2 GLU 84 1HG GLU 84 9.566 10.177 1.252 555 HG3 GLU 84 2HG GLU 84 10.460 10.346 -0.254 556 H LYS 85 H LYS 85 5.701 10.951 1.842 557 HA LYS 85 HA LYS 85 5.152 13.317 0.434 558 HB2 LYS 85 1HB LYS 85 3.950 11.826 -1.095 559 HB3 LYS 85 2HB LYS 85 3.046 11.147 0.246 560 HG2 LYS 85 1HG LYS 85 1.943 13.275 0.610 561 HG3 LYS 85 2HG LYS 85 2.890 13.999 -0.686 562 HD2 LYS 85 1HD LYS 85 1.000 11.678 -1.034 563 HD3 LYS 85 2HD LYS 85 0.593 13.359 -1.380 564 HE2 LYS 85 1HE LYS 85 2.746 11.721 -2.716 565 HE3 LYS 85 2HE LYS 85 1.199 12.183 -3.419 566 HZ1 LYS 85 1HZ LYS 85 1.889 14.522 -3.196 567 HZ2 LYS 85 2HZ LYS 85 2.899 13.637 -4.222 568 HZ3 LYS 85 3HZ LYS 85 3.410 14.012 -2.655 569 HA PRO 86 HA PRO 86 3.430 13.958 4.554 570 HB2 PRO 86 1HB PRO 86 2.407 16.439 4.184 571 HB3 PRO 86 2HB PRO 86 4.134 16.153 4.426 572 HG2 PRO 86 1HG PRO 86 2.630 16.653 1.893 573 HG3 PRO 86 2HG PRO 86 4.216 17.265 2.393 574 HD2 PRO 86 1HD PRO 86 3.877 15.172 0.672 575 HD3 PRO 86 2HD PRO 86 5.296 15.360 1.714 576 H VAL 87 H VAL 87 1.611 12.891 5.051 577 HA VAL 87 HA VAL 87 -0.847 13.550 3.584 578 HB VAL 87 HB VAL 87 -1.561 11.170 3.756 579 HG11 VAL 87 1HG1 VAL 87 -0.704 12.037 1.660 580 HG12 VAL 87 2HG1 VAL 87 -0.214 10.358 1.880 581 HG13 VAL 87 3HG1 VAL 87 0.946 11.658 2.156 582 HG21 VAL 87 1HG2 VAL 87 -0.114 10.417 5.541 583 HG22 VAL 87 2HG2 VAL 87 1.313 10.708 4.543 584 HG23 VAL 87 3HG2 VAL 87 0.166 9.445 4.094 585 H SER 88 H SER 88 -2.708 13.559 4.743 586 HA SER 88 HA SER 88 -2.411 13.736 7.619 587 HB2 SER 88 1HB SER 88 -3.659 15.498 6.508 588 HB3 SER 88 2HB SER 88 -4.730 14.316 5.758 589 HG SER 88 HG SER 88 -5.043 15.518 8.072 590 HA PRO 89 HA PRO 89 -4.019 9.635 8.479 591 HB2 PRO 89 1HB PRO 89 -5.023 11.014 10.915 592 HB3 PRO 89 2HB PRO 89 -4.052 9.543 10.774 593 HG2 PRO 89 1HG PRO 89 -2.940 11.828 11.564 594 HG3 PRO 89 2HG PRO 89 -2.073 10.721 10.484 595 HD2 PRO 89 1HD PRO 89 -3.479 13.281 9.842 596 HD3 PRO 89 2HD PRO 89 -1.961 12.633 9.192 597 H GLU 90 H GLU 90 -5.825 12.610 8.482 598 HA GLU 90 HA GLU 90 -8.428 11.445 8.625 599 HB2 GLU 90 1HB GLU 90 -7.844 13.871 9.066 600 HB3 GLU 90 2HB GLU 90 -7.653 14.065 7.330 601 HG2 GLU 90 1HG GLU 90 -9.816 14.855 7.965 602 HG3 GLU 90 2HG GLU 90 -10.008 13.365 7.039 603 H TYR 91 H TYR 91 -6.247 12.425 6.043 604 HA TYR 91 HA TYR 91 -7.961 11.813 3.873 605 HB2 TYR 91 1HB TYR 91 -5.955 13.301 3.759 606 HB3 TYR 91 2HB TYR 91 -4.934 11.880 3.922 607 HD1 TYR 91 HD1 TYR 91 -3.981 11.129 1.970 608 HD2 TYR 91 HD2 TYR 91 -7.814 12.965 1.787 609 HE1 TYR 91 HE1 TYR 91 -3.989 10.857 -0.475 610 HE2 TYR 91 HE2 TYR 91 -7.834 12.697 -0.656 611 HH TYR 91 HH TYR 91 -6.200 12.440 -2.490 612 H GLU 92 H GLU 92 -5.690 9.972 5.784 613 HA GLU 92 HA GLU 92 -5.522 7.620 4.307 614 HB2 GLU 92 1HB GLU 92 -4.126 7.759 6.181 615 HB3 GLU 92 2HB GLU 92 -5.439 8.227 7.248 616 HG2 GLU 92 1HG GLU 92 -6.363 5.927 7.019 617 HG3 GLU 92 2HG GLU 92 -4.929 5.492 6.094 618 H LYS 93 H LYS 93 -8.054 8.741 6.495 619 HA LYS 93 HA LYS 93 -9.491 6.255 6.318 620 HB2 LYS 93 1HB LYS 93 -10.178 8.881 7.636 621 HB3 LYS 93 2HB LYS 93 -11.196 7.449 7.705 622 HG2 LYS 93 1HG LYS 93 -8.358 7.573 8.701 623 HG3 LYS 93 2HG LYS 93 -9.790 7.756 9.715 624 HD2 LYS 93 1HD LYS 93 -10.498 5.520 9.239 625 HD3 LYS 93 2HD LYS 93 -9.249 5.329 8.009 626 HE2 LYS 93 1HE LYS 93 -8.684 4.181 10.113 627 HE3 LYS 93 2HE LYS 93 -7.519 5.434 9.693 628 HZ1 LYS 93 1HZ LYS 93 -8.156 5.414 12.062 629 HZ2 LYS 93 2HZ LYS 93 -9.740 5.809 11.624 630 HZ3 LYS 93 3HZ LYS 93 -8.479 6.887 11.303 631 H LYS 94 H LYS 94 -9.287 9.094 4.485 632 HA LYS 94 HA LYS 94 -11.878 8.916 3.268 633 HB2 LYS 94 1HB LYS 94 -9.316 10.115 2.178 634 HB3 LYS 94 2HB LYS 94 -10.925 10.355 1.512 635 HG2 LYS 94 1HG LYS 94 -9.999 11.250 4.232 636 HG3 LYS 94 2HG LYS 94 -10.180 12.278 2.810 637 HD2 LYS 94 1HD LYS 94 -12.583 11.730 2.756 638 HD3 LYS 94 2HD LYS 94 -12.378 10.768 4.222 639 HE2 LYS 94 1HE LYS 94 -11.580 12.787 5.396 640 HE3 LYS 94 2HE LYS 94 -11.886 13.730 3.937 641 HZ1 LYS 94 1HZ LYS 94 -13.916 12.255 5.522 642 HZ2 LYS 94 2HZ LYS 94 -14.227 13.112 4.096 643 HZ3 LYS 94 3HZ LYS 94 -13.709 13.931 5.479 644 H LEU 95 H LEU 95 -8.613 7.869 2.475 645 HA LEU 95 HA LEU 95 -9.263 6.411 0.145 646 HB2 LEU 95 1HB LEU 95 -6.939 6.475 2.028 647 HB3 LEU 95 2HB LEU 95 -7.035 5.197 0.833 648 HG LEU 95 HG LEU 95 -6.980 6.808 -0.968 649 HD11 LEU 95 1HD1 LEU 95 -8.228 8.615 0.083 650 HD12 LEU 95 2HD1 LEU 95 -6.701 9.183 -0.591 651 HD13 LEU 95 3HD1 LEU 95 -6.860 8.939 1.148 652 HD21 LEU 95 1HD2 LEU 95 -4.854 6.048 -0.089 653 HD22 LEU 95 2HD2 LEU 95 -4.856 7.356 1.092 654 HD23 LEU 95 3HD2 LEU 95 -4.737 7.723 -0.629 655 H GLN 96 H GLN 96 -9.032 5.547 3.547 656 HA GLN 96 HA GLN 96 -9.453 2.768 3.220 657 HB2 GLN 96 1HB GLN 96 -8.534 3.964 5.265 658 HB3 GLN 96 2HB GLN 96 -10.184 4.431 5.635 659 HG2 GLN 96 1HG GLN 96 -9.692 1.549 5.210 660 HG3 GLN 96 2HG GLN 96 -9.002 2.275 6.656 661 HE21 GLN 96 1HE2 GLN 96 -11.155 0.307 6.348 662 HE22 GLN 96 2HE2 GLN 96 -12.529 0.988 7.154 663 H LYS 97 H LYS 97 -11.543 5.513 3.205 664 HA LYS 97 HA LYS 97 -13.973 4.017 3.566 665 HB2 LYS 97 1HB LYS 97 -13.893 6.358 4.217 666 HB3 LYS 97 2HB LYS 97 -13.496 6.830 2.571 667 HG2 LYS 97 1HG LYS 97 -15.692 5.961 1.836 668 HG3 LYS 97 2HG LYS 97 -16.087 5.623 3.522 669 HD2 LYS 97 1HD LYS 97 -15.860 7.984 4.065 670 HD3 LYS 97 2HD LYS 97 -15.398 8.338 2.398 671 HE2 LYS 97 1HE LYS 97 -17.594 7.513 1.647 672 HE3 LYS 97 2HE LYS 97 -18.049 7.238 3.327 673 HZ1 LYS 97 1HZ LYS 97 -17.818 9.598 3.748 674 HZ2 LYS 97 2HZ LYS 97 -18.912 9.337 2.485 675 HZ3 LYS 97 3HZ LYS 97 -17.344 9.870 2.147 676 H TYR 98 H TYR 98 -12.114 5.230 0.817 677 HA TYR 98 HA TYR 98 -14.093 4.914 -1.154 678 HB2 TYR 98 1HB TYR 98 -11.091 4.741 -1.488 679 HB3 TYR 98 2HB TYR 98 -12.253 4.966 -2.789 680 HD1 TYR 98 HD1 TYR 98 -9.851 6.748 -1.863 681 HD2 TYR 98 HD2 TYR 98 -14.053 6.931 -1.219 682 HE1 TYR 98 HE1 TYR 98 -9.692 9.181 -1.544 683 HE2 TYR 98 HE2 TYR 98 -13.903 9.362 -0.901 684 HH TYR 98 HH TYR 98 -12.254 11.035 -0.271 685 H ALA 99 H ALA 99 -11.466 2.720 -0.195 686 HA ALA 99 HA ALA 99 -12.732 0.574 -1.747 687 HB1 ALA 99 1HB ALA 99 -10.657 -0.687 -1.240 688 HB2 ALA 99 2HB ALA 99 -10.054 0.715 -0.357 689 HB3 ALA 99 3HB ALA 99 -10.347 0.824 -2.092 690 H ASP 100 H ASP 100 -13.358 -1.399 -0.721 691 HA ASP 100 HA ASP 100 -13.961 -1.036 2.111 692 HB2 ASP 100 1HB ASP 100 -14.681 -3.264 0.188 693 HB3 ASP 100 2HB ASP 100 -15.122 -3.258 1.889 694 H ALA 101 H ALA 101 -12.209 -1.249 3.244 695 HA ALA 101 HA ALA 101 -10.956 -3.715 3.730 696 HB1 ALA 101 1HB ALA 101 -8.726 -3.245 2.817 697 HB2 ALA 101 2HB ALA 101 -9.339 -1.770 2.070 698 HB3 ALA 101 3HB ALA 101 -9.926 -3.341 1.527 699 H GLU 102 H GLU 102 -8.883 -3.282 5.043 700 HA GLU 102 HA GLU 102 -9.165 -0.716 6.452 701 HB2 GLU 102 1HB GLU 102 -7.808 -3.236 7.420 702 HB3 GLU 102 2HB GLU 102 -8.051 -1.756 8.329 703 HG2 GLU 102 1HG GLU 102 -10.540 -2.138 7.984 704 HG3 GLU 102 2HG GLU 102 -10.091 -3.770 7.482 705 H VAL 103 H VAL 103 -7.935 0.496 5.018 706 HA VAL 103 HA VAL 103 -5.294 -0.462 4.315 707 HB VAL 103 HB VAL 103 -6.779 0.762 2.657 708 HG11 VAL 103 1HG1 VAL 103 -5.792 3.236 4.058 709 HG12 VAL 103 2HG1 VAL 103 -7.421 2.575 4.272 710 HG13 VAL 103 3HG1 VAL 103 -6.897 3.127 2.680 711 HG21 VAL 103 1HG2 VAL 103 -4.342 0.375 2.377 712 HG22 VAL 103 2HG2 VAL 103 -4.055 1.963 3.083 713 HG23 VAL 103 3HG2 VAL 103 -4.936 1.819 1.563 714 H ARG 104 H ARG 104 -3.434 0.292 5.029 715 HA ARG 104 HA ARG 104 -3.505 2.227 7.245 716 HB2 ARG 104 1HB ARG 104 -2.782 -0.170 7.696 717 HB3 ARG 104 2HB ARG 104 -1.391 0.142 6.672 718 HG2 ARG 104 1HG ARG 104 -0.637 1.878 8.191 719 HG3 ARG 104 2HG ARG 104 -2.060 1.621 9.205 720 HD2 ARG 104 1HD ARG 104 -1.344 -0.710 9.565 721 HD3 ARG 104 2HD ARG 104 0.105 -0.394 8.613 722 HE ARG 104 HE ARG 104 -0.236 1.410 10.825 723 HH11 ARG 104 1HH1 ARG 104 1.000 -1.729 9.865 724 HH12 ARG 104 2HH1 ARG 104 2.147 -1.818 11.172 725 HH21 ARG 104 1HH2 ARG 104 1.244 1.278 12.546 726 HH22 ARG 104 2HH2 ARG 104 2.275 -0.112 12.692 727 H VAL 105 H VAL 105 -3.038 4.164 6.317 728 HA VAL 105 HA VAL 105 -1.238 4.248 4.047 729 HB VAL 105 HB VAL 105 -2.803 6.465 5.376 730 HG11 VAL 105 1HG1 VAL 105 -0.784 7.335 4.311 731 HG12 VAL 105 2HG1 VAL 105 -2.226 7.810 3.412 732 HG13 VAL 105 3HG1 VAL 105 -1.206 6.502 2.815 733 HG21 VAL 105 1HG2 VAL 105 -3.249 4.964 2.799 734 HG22 VAL 105 2HG2 VAL 105 -4.194 6.344 3.351 735 HG23 VAL 105 3HG2 VAL 105 -4.221 4.835 4.264 736 H ARG 106 H ARG 106 0.910 4.375 4.414 737 HA ARG 106 HA ARG 106 1.809 5.840 6.811 738 HB2 ARG 106 1HB ARG 106 2.997 3.308 5.669 739 HB3 ARG 106 2HB ARG 106 3.658 4.211 7.018 740 HG2 ARG 106 1HG ARG 106 1.054 2.712 6.916 741 HG3 ARG 106 2HG ARG 106 2.482 2.319 7.873 742 HD2 ARG 106 1HD ARG 106 0.649 4.692 8.205 743 HD3 ARG 106 2HD ARG 106 0.824 3.324 9.299 744 HE ARG 106 HE ARG 106 3.288 4.731 8.919 745 HH11 ARG 106 1HH1 ARG 106 0.238 4.799 10.641 746 HH12 ARG 106 2HH1 ARG 106 0.868 5.717 11.974 747 HH21 ARG 106 1HH2 ARG 106 4.115 5.959 10.669 748 HH22 ARG 106 2HH2 ARG 106 3.074 6.371 11.993 749 H THR 107 H THR 107 3.346 7.323 6.517 750 HA THR 107 HA THR 107 4.367 7.736 3.833 751 HB THR 107 HB THR 107 3.516 9.640 5.239 752 HG1 THR 107 HG1 THR 107 4.744 10.721 3.919 753 HG21 THR 107 1HG2 THR 107 6.093 9.244 6.764 754 HG22 THR 107 2HG2 THR 107 4.479 8.917 7.390 755 HG23 THR 107 3HG2 THR 107 4.944 10.566 6.976 756 H VAL 108 H VAL 108 6.481 7.513 3.214 757 HA VAL 108 HA VAL 108 8.329 6.400 5.224 758 HB VAL 108 HB VAL 108 9.329 4.988 3.465 759 HG11 VAL 108 1HG1 VAL 108 7.503 3.337 3.327 760 HG12 VAL 108 2HG1 VAL 108 6.381 4.564 3.916 761 HG13 VAL 108 3HG1 VAL 108 7.698 4.007 4.947 762 HG21 VAL 108 1HG2 VAL 108 8.691 6.291 1.505 763 HG22 VAL 108 2HG2 VAL 108 6.995 5.893 1.779 764 HG23 VAL 108 3HG2 VAL 108 8.141 4.622 1.354 765 H THR 109 H THR 109 10.513 6.879 4.974 766 HA THR 109 HA THR 109 11.036 9.183 3.212 767 HB THR 109 HB THR 109 12.780 9.821 4.925 768 HG1 THR 109 HG1 THR 109 11.504 7.670 6.279 769 HG21 THR 109 1HG2 THR 109 11.150 10.817 6.480 770 HG22 THR 109 2HG2 THR 109 9.893 9.772 5.816 771 HG23 THR 109 3HG2 THR 109 10.652 10.997 4.798 772 H SER 110 H SER 110 12.150 6.055 4.276 773 HA SER 110 HA SER 110 14.304 6.219 2.305 774 HB2 SER 110 1HB SER 110 14.701 5.181 5.120 775 HB3 SER 110 2HB SER 110 15.920 5.244 3.848 776 HG SER 110 HG SER 110 15.048 7.670 3.975 777 HA PRO 111 HA PRO 111 12.979 2.321 0.832 778 HB2 PRO 111 1HB PRO 111 15.782 1.338 1.019 779 HB3 PRO 111 2HB PRO 111 14.684 1.359 -0.359 780 HG2 PRO 111 1HG PRO 111 16.678 3.116 -0.178 781 HG3 PRO 111 2HG PRO 111 15.098 3.584 -0.832 782 HD2 PRO 111 1HD PRO 111 16.293 4.169 1.837 783 HD3 PRO 111 2HD PRO 111 15.246 5.179 0.824 784 H ASP 112 H ASP 112 15.463 1.849 3.374 785 HA ASP 112 HA ASP 112 14.683 -0.709 4.179 786 HB2 ASP 112 1HB ASP 112 15.968 1.540 5.723 787 HB3 ASP 112 2HB ASP 112 15.646 -0.030 6.447 788 H GLU 113 H GLU 113 13.515 2.440 5.152 789 HA GLU 113 HA GLU 113 11.900 1.623 7.298 790 HB2 GLU 113 1HB GLU 113 12.638 3.966 6.752 791 HB3 GLU 113 2HB GLU 113 11.437 3.980 5.469 792 HG2 GLU 113 1HG GLU 113 9.686 3.573 7.154 793 HG3 GLU 113 2HG GLU 113 10.927 3.671 8.406 794 H ALA 114 H ALA 114 11.230 2.071 3.851 795 HA ALA 114 HA ALA 114 8.479 1.501 3.919 796 HB1 ALA 114 1HB ALA 114 9.580 2.528 1.989 797 HB2 ALA 114 2HB ALA 114 8.682 1.082 1.522 798 HB3 ALA 114 3HB ALA 114 10.439 1.020 1.675 799 H LYS 115 H LYS 115 11.292 -0.586 3.402 800 HA LYS 115 HA LYS 115 9.937 -3.011 3.010 801 HB2 LYS 115 1HB LYS 115 12.619 -2.599 4.349 802 HB3 LYS 115 2HB LYS 115 12.036 -4.093 3.631 803 HG2 LYS 115 1HG LYS 115 12.117 -3.148 1.437 804 HG3 LYS 115 2HG LYS 115 12.490 -1.550 2.090 805 HD2 LYS 115 1HD LYS 115 14.531 -2.504 1.296 806 HD3 LYS 115 2HD LYS 115 14.580 -2.522 3.053 807 HE2 LYS 115 1HE LYS 115 13.939 -4.875 3.057 808 HE3 LYS 115 2HE LYS 115 13.861 -4.864 1.296 809 HZ1 LYS 115 1HZ LYS 115 16.211 -4.395 1.202 810 HZ2 LYS 115 2HZ LYS 115 15.948 -5.785 2.140 811 HZ3 LYS 115 3HZ LYS 115 16.301 -4.311 2.894 812 H ARG 116 H ARG 116 10.908 -1.299 5.892 813 HA ARG 116 HA ARG 116 10.489 -3.323 7.789 814 HB2 ARG 116 1HB ARG 116 11.758 -1.236 8.170 815 HB3 ARG 116 2HB ARG 116 10.254 -0.329 8.115 816 HG2 ARG 116 1HG ARG 116 9.471 -1.440 10.111 817 HG3 ARG 116 2HG ARG 116 10.921 -2.448 10.142 818 HD2 ARG 116 1HD ARG 116 10.803 0.548 10.423 819 HD3 ARG 116 2HD ARG 116 11.171 -0.611 11.698 820 HE ARG 116 HE ARG 116 13.167 -1.208 10.270 821 HH11 ARG 116 1HH1 ARG 116 11.735 1.996 10.243 822 HH12 ARG 116 2HH1 ARG 116 13.199 2.778 9.733 823 HH21 ARG 116 1HH2 ARG 116 15.081 -0.174 9.590 824 HH22 ARG 116 2HH2 ARG 116 15.091 1.546 9.345 825 H TRP 117 H TRP 117 8.339 -0.758 6.590 826 HA TRP 117 HA TRP 117 6.137 -1.434 8.223 827 HB2 TRP 117 1HB TRP 117 6.329 0.040 5.598 828 HB3 TRP 117 2HB TRP 117 4.803 -0.191 6.446 829 HD1 TRP 117 HD1 TRP 117 7.733 2.091 6.290 830 HE1 TRP 117 HE1 TRP 117 7.612 3.823 8.190 831 HE3 TRP 117 HE3 TRP 117 4.022 -0.037 9.087 832 HZ2 TRP 117 HZ2 TRP 117 6.134 4.230 10.562 833 HZ3 TRP 117 HZ3 TRP 117 3.312 1.089 11.154 834 HH2 TRP 117 HH2 TRP 117 4.346 3.176 11.874 835 H ILE 118 H ILE 118 7.035 -2.376 4.928 836 HA ILE 118 HA ILE 118 4.800 -3.985 4.377 837 HB ILE 118 HB ILE 118 7.638 -4.304 3.377 838 HG12 ILE 118 1HG1 ILE 118 5.255 -2.916 2.131 839 HG13 ILE 118 2HG1 ILE 118 6.620 -2.104 2.890 840 HG21 ILE 118 1HG2 ILE 118 6.313 -6.342 3.082 841 HG22 ILE 118 2HG2 ILE 118 6.674 -5.571 1.538 842 HG23 ILE 118 3HG2 ILE 118 5.069 -5.410 2.250 843 HD11 ILE 118 1HD1 ILE 118 6.753 -3.848 0.444 844 HD12 ILE 118 2HD1 ILE 118 8.111 -3.014 1.197 845 HD13 ILE 118 3HD1 ILE 118 6.801 -2.087 0.468 846 H LYS 119 H LYS 119 7.926 -4.748 5.841 847 HA LYS 119 HA LYS 119 7.624 -7.495 6.171 848 HB2 LYS 119 1HB LYS 119 9.731 -6.284 6.542 849 HB3 LYS 119 2HB LYS 119 9.047 -5.522 7.969 850 HG2 LYS 119 1HG LYS 119 8.857 -7.709 9.045 851 HG3 LYS 119 2HG LYS 119 9.560 -8.466 7.614 852 HD2 LYS 119 1HD LYS 119 11.600 -7.123 7.931 853 HD3 LYS 119 2HD LYS 119 10.894 -6.421 9.387 854 HE2 LYS 119 1HE LYS 119 12.405 -8.195 10.002 855 HE3 LYS 119 2HE LYS 119 10.750 -8.681 10.366 856 HZ1 LYS 119 1HZ LYS 119 11.989 -10.472 9.331 857 HZ2 LYS 119 2HZ LYS 119 12.307 -9.511 7.979 858 HZ3 LYS 119 3HZ LYS 119 10.722 -9.978 8.327 859 H GLU 120 H GLU 120 6.814 -4.870 8.433 860 HA GLU 120 HA GLU 120 5.798 -6.485 10.492 861 HB2 GLU 120 1HB GLU 120 6.401 -4.098 10.752 862 HB3 GLU 120 2HB GLU 120 5.016 -3.653 9.766 863 HG2 GLU 120 1HG GLU 120 3.530 -4.672 11.448 864 HG3 GLU 120 2HG GLU 120 4.940 -5.014 12.449 865 H PHE 121 H PHE 121 4.245 -4.994 7.704 866 HA PHE 121 HA PHE 121 1.584 -5.628 8.421 867 HB2 PHE 121 1HB PHE 121 2.388 -3.885 6.760 868 HB3 PHE 121 2HB PHE 121 2.634 -5.206 5.625 869 HD1 PHE 121 HD1 PHE 121 0.034 -3.663 7.779 870 HD2 PHE 121 HD2 PHE 121 0.903 -5.861 4.241 871 HE1 PHE 121 HE1 PHE 121 -2.319 -3.470 7.087 872 HE2 PHE 121 HE2 PHE 121 -1.448 -5.676 3.546 873 HZ PHE 121 HZ PHE 121 -3.060 -4.479 4.969 874 H SER 122 H SER 122 4.088 -7.366 6.716 875 HA SER 122 HA SER 122 2.363 -9.414 5.712 876 HB2 SER 122 1HB SER 122 4.509 -8.876 4.627 877 HB3 SER 122 2HB SER 122 5.372 -9.396 6.073 878 HG SER 122 HG SER 122 3.582 -11.200 4.908 879 H GLU 123 H GLU 123 4.270 -8.936 8.621 880 HA GLU 123 HA GLU 123 4.090 -11.655 9.494 881 HB2 GLU 123 1HB GLU 123 4.779 -9.169 11.072 882 HB3 GLU 123 2HB GLU 123 5.018 -10.826 11.612 883 HG2 GLU 123 1HG GLU 123 6.547 -11.162 9.681 884 HG3 GLU 123 2HG GLU 123 6.396 -9.441 9.330 885 H GLU 124 H GLU 124 2.420 -8.646 10.374 886 HA GLU 124 HA GLU 124 0.362 -10.294 11.660 887 HB2 GLU 124 1HB GLU 124 0.125 -8.452 13.368 888 HB3 GLU 124 2HB GLU 124 1.584 -9.422 13.488 889 HG2 GLU 124 1HG GLU 124 2.803 -7.631 12.276 890 HG3 GLU 124 2HG GLU 124 1.336 -6.655 12.342 Start of MODEL 10 1 HA MET 21 HA MET 21 -8.546 -12.235 2.823 2 HB2 MET 21 1HB MET 21 -7.724 -10.428 4.180 3 HB3 MET 21 2HB MET 21 -8.441 -11.626 5.245 4 HG2 MET 21 1HG MET 21 -5.493 -11.292 4.735 5 HG3 MET 21 2HG MET 21 -6.364 -10.651 6.123 6 HE1 MET 21 1HE MET 21 -4.709 -11.823 7.830 7 HE2 MET 21 2HE MET 21 -3.780 -12.364 6.433 8 HE3 MET 21 3HE MET 21 -4.224 -13.513 7.695 9 H THR 22 H THR 22 -7.462 -11.071 1.294 10 HA THR 22 HA THR 22 -4.716 -11.885 0.712 11 HB THR 22 HB THR 22 -6.623 -10.219 -0.945 12 HG1 THR 22 HG1 THR 22 -7.468 -12.268 -0.845 13 HG21 THR 22 1HG2 THR 22 -5.108 -10.740 -2.803 14 HG22 THR 22 2HG2 THR 22 -4.047 -11.618 -1.700 15 HG23 THR 22 3HG2 THR 22 -4.258 -9.875 -1.522 16 H LEU 23 H LEU 23 -3.042 -10.349 0.441 17 HA LEU 23 HA LEU 23 -3.587 -7.788 1.786 18 HB2 LEU 23 1HB LEU 23 -0.965 -9.278 1.666 19 HB3 LEU 23 2HB LEU 23 -1.315 -7.841 2.608 20 HG LEU 23 HG LEU 23 -2.518 -10.575 3.052 21 HD11 LEU 23 1HD1 LEU 23 -0.526 -9.012 4.683 22 HD12 LEU 23 2HD1 LEU 23 -0.174 -10.440 3.711 23 HD13 LEU 23 3HD1 LEU 23 -1.233 -10.569 5.114 24 HD21 LEU 23 1HD2 LEU 23 -3.508 -9.616 5.049 25 HD22 LEU 23 2HD2 LEU 23 -4.074 -8.768 3.610 26 HD23 LEU 23 3HD2 LEU 23 -2.841 -8.036 4.639 27 H PHE 24 H PHE 24 -3.414 -6.047 0.571 28 HA PHE 24 HA PHE 24 -1.842 -6.200 -1.919 29 HB2 PHE 24 1HB PHE 24 -4.201 -4.426 -1.247 30 HB3 PHE 24 2HB PHE 24 -3.299 -4.380 -2.755 31 HD1 PHE 24 HD1 PHE 24 -5.498 -6.498 -0.664 32 HD2 PHE 24 HD2 PHE 24 -3.825 -5.830 -4.518 33 HE1 PHE 24 HE1 PHE 24 -7.029 -8.170 -1.614 34 HE2 PHE 24 HE2 PHE 24 -5.350 -7.505 -5.473 35 HZ PHE 24 HZ PHE 24 -6.956 -8.676 -4.021 36 H VAL 25 H VAL 25 -0.509 -4.442 -2.473 37 HA VAL 25 HA VAL 25 -0.307 -2.283 -0.530 38 HB VAL 25 HB VAL 25 1.347 -3.723 0.353 39 HG11 VAL 25 1HG1 VAL 25 2.519 -4.033 -2.401 40 HG12 VAL 25 2HG1 VAL 25 1.529 -5.236 -1.580 41 HG13 VAL 25 3HG1 VAL 25 3.100 -4.783 -0.916 42 HG21 VAL 25 1HG2 VAL 25 3.437 -2.487 -0.013 43 HG22 VAL 25 2HG2 VAL 25 2.056 -1.410 0.198 44 HG23 VAL 25 3HG2 VAL 25 2.713 -1.698 -1.413 45 H LEU 26 H LEU 26 -0.322 -0.443 -1.498 46 HA LEU 26 HA LEU 26 0.569 -0.216 -4.292 47 HB2 LEU 26 1HB LEU 26 -1.165 1.621 -2.626 48 HB3 LEU 26 2HB LEU 26 -0.648 1.965 -4.261 49 HG LEU 26 HG LEU 26 -2.846 1.228 -4.496 50 HD11 LEU 26 1HD1 LEU 26 -2.721 -0.873 -5.681 51 HD12 LEU 26 2HD1 LEU 26 -1.169 -1.229 -4.927 52 HD13 LEU 26 3HD1 LEU 26 -1.314 0.126 -6.046 53 HD21 LEU 26 1HD2 LEU 26 -2.237 -1.046 -2.617 54 HD22 LEU 26 2HD2 LEU 26 -3.773 -0.762 -3.435 55 HD23 LEU 26 3HD2 LEU 26 -3.185 0.392 -2.240 56 H ILE 27 H ILE 27 1.713 1.900 -4.792 57 HA ILE 27 HA ILE 27 3.219 2.962 -2.549 58 HB ILE 27 HB ILE 27 4.536 1.029 -3.013 59 HG12 ILE 27 1HG1 ILE 27 5.845 3.407 -4.355 60 HG13 ILE 27 2HG1 ILE 27 5.787 3.125 -2.619 61 HG21 ILE 27 1HG2 ILE 27 3.647 0.517 -5.228 62 HG22 ILE 27 2HG2 ILE 27 5.412 0.487 -5.224 63 HG23 ILE 27 3HG2 ILE 27 4.555 1.868 -5.908 64 HD11 ILE 27 1HD1 ILE 27 7.945 2.514 -3.548 65 HD12 ILE 27 2HD1 ILE 27 7.163 1.374 -4.644 66 HD13 ILE 27 3HD1 ILE 27 7.113 1.099 -2.903 67 H LEU 28 H LEU 28 3.179 5.124 -2.846 68 HA LEU 28 HA LEU 28 3.645 6.109 -5.588 69 HB2 LEU 28 1HB LEU 28 2.183 7.219 -3.261 70 HB3 LEU 28 2HB LEU 28 3.099 8.367 -4.212 71 HG LEU 28 HG LEU 28 1.846 7.454 -6.230 72 HD11 LEU 28 1HD1 LEU 28 -0.298 6.423 -5.813 73 HD12 LEU 28 2HD1 LEU 28 0.030 6.400 -4.080 74 HD13 LEU 28 3HD1 LEU 28 1.004 5.416 -5.174 75 HD21 LEU 28 1HD2 LEU 28 -0.099 8.874 -5.788 76 HD22 LEU 28 2HD2 LEU 28 1.404 9.641 -5.279 77 HD23 LEU 28 3HD2 LEU 28 0.332 8.920 -4.079 78 H SER 29 H SER 29 5.863 5.441 -5.253 79 HA SER 29 HA SER 29 7.360 7.826 -4.576 80 HB2 SER 29 1HB SER 29 7.530 6.252 -2.570 81 HB3 SER 29 2HB SER 29 8.330 5.113 -3.646 82 HG SER 29 HG SER 29 9.226 7.642 -2.758 83 H ASN 30 H ASN 30 9.070 8.116 -6.133 84 HA ASN 30 HA ASN 30 9.658 5.649 -7.627 85 HB2 ASN 30 1HB ASN 30 10.287 7.048 -9.581 86 HB3 ASN 30 2HB ASN 30 8.586 7.173 -9.161 87 HD21 ASN 30 1HD2 ASN 30 10.332 8.967 -10.671 88 HD22 ASN 30 2HD2 ASN 30 10.241 10.499 -9.880 89 H ASP 31 H ASP 31 11.162 5.176 -6.036 90 HA ASP 31 HA ASP 31 13.757 6.424 -6.622 91 HB2 ASP 31 1HB ASP 31 13.219 6.668 -4.255 92 HB3 ASP 31 2HB ASP 31 12.904 4.949 -4.126 93 H LYS 32 H LYS 32 15.463 4.970 -7.104 94 HA LYS 32 HA LYS 32 14.483 2.708 -8.557 95 HB2 LYS 32 1HB LYS 32 17.248 3.847 -8.190 96 HB3 LYS 32 2HB LYS 32 16.936 2.399 -9.132 97 HG2 LYS 32 1HG LYS 32 17.066 4.196 -10.662 98 HG3 LYS 32 2HG LYS 32 15.362 3.764 -10.535 99 HD2 LYS 32 1HD LYS 32 15.051 5.626 -8.935 100 HD3 LYS 32 2HD LYS 32 16.739 6.078 -9.172 101 HE2 LYS 32 1HE LYS 32 14.624 5.989 -11.320 102 HE3 LYS 32 2HE LYS 32 15.209 7.448 -10.522 103 HZ1 LYS 32 1HZ LYS 32 17.433 6.940 -11.394 104 HZ2 LYS 32 2HZ LYS 32 16.299 7.179 -12.625 105 HZ3 LYS 32 3HZ LYS 32 16.797 5.614 -12.230 106 H LYS 33 H LYS 33 16.207 3.153 -5.529 107 HA LYS 33 HA LYS 33 16.748 0.320 -5.264 108 HB2 LYS 33 1HB LYS 33 17.229 2.722 -3.551 109 HB3 LYS 33 2HB LYS 33 17.283 1.122 -2.828 110 HG2 LYS 33 1HG LYS 33 19.023 0.472 -4.430 111 HG3 LYS 33 2HG LYS 33 18.979 2.095 -5.118 112 HD2 LYS 33 1HD LYS 33 20.830 1.717 -3.480 113 HD3 LYS 33 2HD LYS 33 19.763 3.062 -3.075 114 HE2 LYS 33 1HE LYS 33 20.321 1.702 -1.108 115 HE3 LYS 33 2HE LYS 33 18.596 1.683 -1.451 116 HZ1 LYS 33 1HZ LYS 33 18.923 -0.481 -2.548 117 HZ2 LYS 33 2HZ LYS 33 19.329 -0.517 -0.911 118 HZ3 LYS 33 3HZ LYS 33 20.546 -0.464 -2.081 119 H LEU 34 H LEU 34 14.616 2.715 -3.765 120 HA LEU 34 HA LEU 34 13.331 1.083 -1.926 121 HB2 LEU 34 1HB LEU 34 12.981 3.439 -1.867 122 HB3 LEU 34 2HB LEU 34 12.351 3.440 -3.497 123 HG LEU 34 HG LEU 34 10.349 2.262 -2.740 124 HD11 LEU 34 1HD1 LEU 34 11.264 2.677 0.070 125 HD12 LEU 34 2HD1 LEU 34 11.499 1.153 -0.787 126 HD13 LEU 34 3HD1 LEU 34 9.870 1.774 -0.516 127 HD21 LEU 34 1HD2 LEU 34 10.360 4.687 -2.816 128 HD22 LEU 34 2HD2 LEU 34 10.973 4.741 -1.164 129 HD23 LEU 34 3HD2 LEU 34 9.362 4.102 -1.486 130 H ILE 35 H ILE 35 12.361 1.744 -5.299 131 HA ILE 35 HA ILE 35 10.027 0.211 -5.258 132 HB ILE 35 HB ILE 35 11.851 0.986 -7.530 133 HG12 ILE 35 1HG1 ILE 35 9.090 1.916 -6.711 134 HG13 ILE 35 2HG1 ILE 35 10.591 2.781 -6.403 135 HG21 ILE 35 1HG2 ILE 35 9.186 -0.408 -7.736 136 HG22 ILE 35 2HG2 ILE 35 10.754 -1.089 -8.169 137 HG23 ILE 35 3HG2 ILE 35 10.100 0.270 -9.083 138 HD11 ILE 35 1HD1 ILE 35 10.936 3.061 -8.791 139 HD12 ILE 35 2HD1 ILE 35 9.374 3.712 -8.295 140 HD13 ILE 35 3HD1 ILE 35 9.459 2.156 -9.119 141 H GLU 36 H GLU 36 13.368 -0.723 -5.997 142 HA GLU 36 HA GLU 36 12.721 -3.388 -6.739 143 HB2 GLU 36 1HB GLU 36 15.296 -2.114 -5.839 144 HB3 GLU 36 2HB GLU 36 15.175 -3.802 -6.320 145 HG2 GLU 36 1HG GLU 36 14.464 -1.453 -8.046 146 HG3 GLU 36 2HG GLU 36 15.972 -2.358 -8.132 147 H GLU 37 H GLU 37 14.127 -2.063 -3.737 148 HA GLU 37 HA GLU 37 14.166 -4.537 -2.391 149 HB2 GLU 37 1HB GLU 37 14.146 -1.723 -1.305 150 HB3 GLU 37 2HB GLU 37 14.407 -3.155 -0.318 151 HG2 GLU 37 1HG GLU 37 16.366 -3.701 -1.759 152 HG3 GLU 37 2HG GLU 37 16.143 -2.145 -2.557 153 H ALA 38 H ALA 38 11.683 -2.069 -2.676 154 HA ALA 38 HA ALA 38 9.964 -2.939 -0.647 155 HB1 ALA 38 1HB ALA 38 9.206 -1.726 -3.303 156 HB2 ALA 38 2HB ALA 38 9.643 -0.829 -1.850 157 HB3 ALA 38 3HB ALA 38 8.182 -1.816 -1.871 158 H ARG 39 H ARG 39 10.062 -3.885 -4.097 159 HA ARG 39 HA ARG 39 7.986 -5.805 -3.722 160 HB2 ARG 39 1HB ARG 39 8.304 -4.861 -5.926 161 HB3 ARG 39 2HB ARG 39 9.945 -5.487 -5.994 162 HG2 ARG 39 1HG ARG 39 9.219 -7.702 -6.206 163 HG3 ARG 39 2HG ARG 39 7.579 -7.319 -5.673 164 HD2 ARG 39 1HD ARG 39 8.820 -6.259 -8.210 165 HD3 ARG 39 2HD ARG 39 7.854 -7.730 -8.142 166 HE ARG 39 HE ARG 39 6.137 -6.036 -7.102 167 HH11 ARG 39 1HH1 ARG 39 8.290 -5.537 -9.810 168 HH12 ARG 39 2HH1 ARG 39 7.218 -4.446 -10.628 169 HH21 ARG 39 1HH2 ARG 39 4.701 -4.610 -8.185 170 HH22 ARG 39 2HH2 ARG 39 5.168 -3.933 -9.711 171 H LYS 40 H LYS 40 11.517 -5.943 -3.650 172 HA LYS 40 HA LYS 40 11.740 -8.743 -3.638 173 HB2 LYS 40 1HB LYS 40 13.502 -6.659 -2.344 174 HB3 LYS 40 2HB LYS 40 13.913 -8.365 -2.453 175 HG2 LYS 40 1HG LYS 40 13.787 -8.200 -4.916 176 HG3 LYS 40 2HG LYS 40 13.489 -6.467 -4.752 177 HD2 LYS 40 1HD LYS 40 15.647 -6.245 -3.574 178 HD3 LYS 40 2HD LYS 40 15.945 -7.964 -3.839 179 HE2 LYS 40 1HE LYS 40 15.560 -5.877 -5.982 180 HE3 LYS 40 2HE LYS 40 17.099 -6.587 -5.496 181 HZ1 LYS 40 1HZ LYS 40 16.319 -8.737 -6.242 182 HZ2 LYS 40 2HZ LYS 40 16.205 -7.614 -7.500 183 HZ3 LYS 40 3HZ LYS 40 14.815 -8.087 -6.666 184 H MET 41 H MET 41 11.153 -6.429 -1.037 185 HA MET 41 HA MET 41 11.116 -8.393 1.022 186 HB2 MET 41 1HB MET 41 11.579 -5.994 1.375 187 HB3 MET 41 2HB MET 41 9.930 -5.619 0.910 188 HG2 MET 41 1HG MET 41 10.070 -5.513 3.247 189 HG3 MET 41 2HG MET 41 9.147 -6.954 2.849 190 HE1 MET 41 1HE MET 41 11.175 -9.849 4.162 191 HE2 MET 41 2HE MET 41 10.561 -9.394 2.574 192 HE3 MET 41 3HE MET 41 9.561 -9.162 4.007 193 H ALA 42 H ALA 42 8.628 -6.690 -0.859 194 HA ALA 42 HA ALA 42 6.426 -7.851 0.506 195 HB1 ALA 42 1HB ALA 42 6.277 -5.712 -0.655 196 HB2 ALA 42 2HB ALA 42 5.063 -6.848 -1.235 197 HB3 ALA 42 3HB ALA 42 6.503 -6.533 -2.199 198 H GLU 43 H GLU 43 8.259 -8.821 -2.316 199 HA GLU 43 HA GLU 43 6.379 -10.632 -3.383 200 HB2 GLU 43 1HB GLU 43 8.384 -9.715 -4.581 201 HB3 GLU 43 2HB GLU 43 9.391 -10.775 -3.610 202 HG2 GLU 43 1HG GLU 43 7.176 -11.981 -5.172 203 HG3 GLU 43 2HG GLU 43 8.610 -11.429 -6.033 204 H LYS 44 H LYS 44 9.168 -11.062 -1.218 205 HA LYS 44 HA LYS 44 8.618 -13.834 -0.736 206 HB2 LYS 44 1HB LYS 44 10.420 -11.835 0.620 207 HB3 LYS 44 2HB LYS 44 10.217 -13.463 1.245 208 HG2 LYS 44 1HG LYS 44 12.194 -13.444 -0.059 209 HG3 LYS 44 2HG LYS 44 10.974 -14.323 -0.981 210 HD2 LYS 44 1HD LYS 44 10.556 -12.350 -2.339 211 HD3 LYS 44 2HD LYS 44 11.724 -11.430 -1.390 212 HE2 LYS 44 1HE LYS 44 12.778 -12.115 -3.425 213 HE3 LYS 44 2HE LYS 44 13.477 -13.043 -2.100 214 HZ1 LYS 44 1HZ LYS 44 13.002 -14.425 -4.028 215 HZ2 LYS 44 2HZ LYS 44 11.360 -14.008 -3.944 216 HZ3 LYS 44 3HZ LYS 44 12.074 -14.903 -2.695 217 H ALA 45 H ALA 45 7.221 -10.976 0.333 218 HA ALA 45 HA ALA 45 6.160 -12.187 2.769 219 HB1 ALA 45 1HB ALA 45 5.276 -9.997 3.286 220 HB2 ALA 45 2HB ALA 45 5.767 -9.397 1.705 221 HB3 ALA 45 3HB ALA 45 6.987 -9.872 2.885 222 H ASN 46 H ASN 46 5.519 -12.265 -0.387 223 HA ASN 46 HA ASN 46 3.778 -12.805 -1.704 224 HB2 ASN 46 1HB ASN 46 2.699 -13.814 0.927 225 HB3 ASN 46 2HB ASN 46 1.907 -14.103 -0.620 226 HD21 ASN 46 1HD2 ASN 46 4.540 -14.923 1.442 227 HD22 ASN 46 2HD2 ASN 46 5.152 -16.230 0.493 228 H LEU 47 H LEU 47 3.844 -10.156 -1.045 229 HA LEU 47 HA LEU 47 1.021 -9.437 -0.647 230 HB2 LEU 47 1HB LEU 47 3.409 -7.602 -0.730 231 HB3 LEU 47 2HB LEU 47 1.783 -7.191 -0.234 232 HG LEU 47 HG LEU 47 3.662 -9.033 1.244 233 HD11 LEU 47 1HD1 LEU 47 4.317 -6.686 1.337 234 HD12 LEU 47 2HD1 LEU 47 3.734 -7.251 2.902 235 HD13 LEU 47 3HD1 LEU 47 2.700 -6.249 1.883 236 HD21 LEU 47 1HD2 LEU 47 0.901 -8.054 1.953 237 HD22 LEU 47 2HD2 LEU 47 1.971 -8.965 3.017 238 HD23 LEU 47 3HD2 LEU 47 1.350 -9.709 1.544 239 H ILE 48 H ILE 48 -0.112 -8.358 -2.218 240 HA ILE 48 HA ILE 48 0.976 -8.463 -4.895 241 HB ILE 48 HB ILE 48 -1.699 -7.367 -4.005 242 HG12 ILE 48 1HG1 ILE 48 -0.953 -10.149 -4.945 243 HG13 ILE 48 2HG1 ILE 48 -1.441 -9.709 -3.312 244 HG21 ILE 48 1HG2 ILE 48 -2.372 -7.717 -6.312 245 HG22 ILE 48 2HG2 ILE 48 -0.775 -8.356 -6.701 246 HG23 ILE 48 3HG2 ILE 48 -0.959 -6.663 -6.245 247 HD11 ILE 48 1HD1 ILE 48 -3.645 -9.062 -4.161 248 HD12 ILE 48 2HD1 ILE 48 -3.268 -10.752 -4.493 249 HD13 ILE 48 3HD1 ILE 48 -3.151 -9.552 -5.781 250 H LEU 49 H LEU 49 2.536 -6.947 -5.137 251 HA LEU 49 HA LEU 49 2.070 -4.215 -4.233 252 HB2 LEU 49 1HB LEU 49 4.243 -5.238 -3.763 253 HB3 LEU 49 2HB LEU 49 4.501 -5.500 -5.478 254 HG LEU 49 HG LEU 49 4.308 -2.939 -5.701 255 HD11 LEU 49 1HD1 LEU 49 4.976 -1.689 -3.708 256 HD12 LEU 49 2HD1 LEU 49 4.859 -3.165 -2.750 257 HD13 LEU 49 3HD1 LEU 49 3.414 -2.479 -3.497 258 HD21 LEU 49 1HD2 LEU 49 6.670 -2.649 -5.201 259 HD22 LEU 49 2HD2 LEU 49 6.377 -4.190 -6.008 260 HD23 LEU 49 3HD2 LEU 49 6.666 -4.147 -4.269 261 H ILE 50 H ILE 50 0.967 -2.943 -5.552 262 HA ILE 50 HA ILE 50 1.478 -3.130 -8.445 263 HB ILE 50 HB ILE 50 -0.775 -1.694 -7.024 264 HG12 ILE 50 1HG1 ILE 50 -2.093 -3.495 -8.435 265 HG13 ILE 50 2HG1 ILE 50 -0.580 -4.386 -8.313 266 HG21 ILE 50 1HG2 ILE 50 -0.279 -2.106 -9.966 267 HG22 ILE 50 2HG2 ILE 50 -0.166 -0.581 -9.086 268 HG23 ILE 50 3HG2 ILE 50 -1.725 -1.385 -9.260 269 HD11 ILE 50 1HD1 ILE 50 -2.157 -5.030 -6.577 270 HD12 ILE 50 2HD1 ILE 50 -2.207 -3.366 -5.997 271 HD13 ILE 50 3HD1 ILE 50 -0.711 -4.292 -5.888 272 H THR 51 H THR 51 2.953 -1.761 -9.170 273 HA THR 51 HA THR 51 3.717 0.591 -7.723 274 HB THR 51 HB THR 51 5.086 1.021 -9.847 275 HG1 THR 51 HG1 THR 51 3.740 -0.352 -11.185 276 HG21 THR 51 1HG2 THR 51 6.042 0.015 -7.833 277 HG22 THR 51 2HG2 THR 51 6.716 -0.725 -9.284 278 HG23 THR 51 3HG2 THR 51 5.481 -1.575 -8.355 279 H VAL 52 H VAL 52 2.824 2.556 -7.870 280 HA VAL 52 HA VAL 52 1.412 3.368 -10.270 281 HB VAL 52 HB VAL 52 -0.354 2.180 -9.167 282 HG11 VAL 52 1HG1 VAL 52 0.566 2.035 -6.932 283 HG12 VAL 52 2HG1 VAL 52 -1.073 2.681 -6.871 284 HG13 VAL 52 3HG1 VAL 52 0.308 3.762 -6.688 285 HG21 VAL 52 1HG2 VAL 52 -1.072 4.241 -10.167 286 HG22 VAL 52 2HG2 VAL 52 -0.635 5.145 -8.719 287 HG23 VAL 52 3HG2 VAL 52 -1.971 3.993 -8.669 288 H GLY 53 H GLY 53 2.137 5.390 -10.634 289 HA2 GLY 53 1HA GLY 53 2.672 7.054 -8.249 290 HA3 GLY 53 2HA GLY 53 3.614 7.148 -9.727 291 H ASP 54 H ASP 54 0.691 8.014 -8.129 292 HA ASP 54 HA ASP 54 0.456 10.546 -8.983 293 HB2 ASP 54 1HB ASP 54 0.207 9.808 -11.310 294 HB3 ASP 54 2HB ASP 54 -1.146 8.783 -10.855 295 H GLU 55 H GLU 55 -1.440 11.551 -8.066 296 HA GLU 55 HA GLU 55 -2.583 10.071 -5.950 297 HB2 GLU 55 1HB GLU 55 -3.381 12.733 -7.127 298 HB3 GLU 55 2HB GLU 55 -4.115 12.043 -5.690 299 HG2 GLU 55 1HG GLU 55 -2.504 13.605 -4.960 300 HG3 GLU 55 2HG GLU 55 -1.846 11.998 -4.649 301 H GLU 56 H GLU 56 -3.923 11.176 -9.045 302 HA GLU 56 HA GLU 56 -6.509 10.123 -8.553 303 HB2 GLU 56 1HB GLU 56 -5.183 10.778 -11.189 304 HB3 GLU 56 2HB GLU 56 -6.901 10.493 -10.951 305 HG2 GLU 56 1HG GLU 56 -5.276 12.750 -9.806 306 HG3 GLU 56 2HG GLU 56 -6.467 12.858 -11.102 307 H GLU 57 H GLU 57 -3.614 8.889 -10.152 308 HA GLU 57 HA GLU 57 -4.748 6.459 -11.054 309 HB2 GLU 57 1HB GLU 57 -1.893 7.117 -10.310 310 HB3 GLU 57 2HB GLU 57 -2.391 5.619 -11.076 311 HG2 GLU 57 1HG GLU 57 -2.653 8.379 -12.234 312 HG3 GLU 57 2HG GLU 57 -1.486 7.147 -12.708 313 H LEU 58 H LEU 58 -3.383 7.445 -7.955 314 HA LEU 58 HA LEU 58 -3.277 4.914 -6.733 315 HB2 LEU 58 1HB LEU 58 -2.294 6.914 -5.711 316 HB3 LEU 58 2HB LEU 58 -3.892 7.596 -5.484 317 HG LEU 58 HG LEU 58 -4.451 5.780 -3.921 318 HD11 LEU 58 1HD1 LEU 58 -2.679 4.289 -3.105 319 HD12 LEU 58 2HD1 LEU 58 -1.595 4.916 -4.345 320 HD13 LEU 58 3HD1 LEU 58 -3.042 4.021 -4.809 321 HD21 LEU 58 1HD2 LEU 58 -3.541 7.855 -3.042 322 HD22 LEU 58 2HD2 LEU 58 -1.900 7.241 -3.253 323 HD23 LEU 58 3HD2 LEU 58 -2.985 6.478 -2.088 324 H LYS 59 H LYS 59 -5.892 7.281 -6.988 325 HA LYS 59 HA LYS 59 -7.827 5.952 -5.503 326 HB2 LYS 59 1HB LYS 59 -8.174 7.683 -7.948 327 HB3 LYS 59 2HB LYS 59 -9.474 7.225 -6.855 328 HG2 LYS 59 1HG LYS 59 -8.472 8.442 -5.051 329 HG3 LYS 59 2HG LYS 59 -7.030 8.766 -6.013 330 HD2 LYS 59 1HD LYS 59 -8.333 10.125 -7.552 331 HD3 LYS 59 2HD LYS 59 -9.809 9.755 -6.656 332 HE2 LYS 59 1HE LYS 59 -8.954 10.893 -4.706 333 HE3 LYS 59 2HE LYS 59 -7.406 11.166 -5.503 334 HZ1 LYS 59 1HZ LYS 59 -8.833 13.130 -5.531 335 HZ2 LYS 59 2HZ LYS 59 -10.006 12.282 -6.406 336 HZ3 LYS 59 3HZ LYS 59 -8.487 12.588 -7.097 337 H LYS 60 H LYS 60 -6.544 5.250 -8.575 338 HA LYS 60 HA LYS 60 -8.696 3.454 -9.342 339 HB2 LYS 60 1HB LYS 60 -6.073 3.778 -10.761 340 HB3 LYS 60 2HB LYS 60 -7.648 3.369 -11.434 341 HG2 LYS 60 1HG LYS 60 -7.201 6.018 -10.130 342 HG3 LYS 60 2HG LYS 60 -6.684 5.736 -11.800 343 HD2 LYS 60 1HD LYS 60 -8.945 5.171 -12.433 344 HD3 LYS 60 2HD LYS 60 -9.485 5.328 -10.759 345 HE2 LYS 60 1HE LYS 60 -8.939 7.689 -10.779 346 HE3 LYS 60 2HE LYS 60 -8.289 7.552 -12.410 347 HZ1 LYS 60 1HZ LYS 60 -10.497 8.458 -12.484 348 HZ2 LYS 60 2HZ LYS 60 -11.118 7.157 -11.605 349 HZ3 LYS 60 3HZ LYS 60 -10.518 6.912 -13.165 350 H ALA 61 H ALA 61 -5.423 3.410 -8.114 351 HA ALA 61 HA ALA 61 -4.901 0.653 -8.542 352 HB1 ALA 61 1HB ALA 61 -3.599 2.555 -6.597 353 HB2 ALA 61 2HB ALA 61 -3.115 2.304 -8.274 354 HB3 ALA 61 3HB ALA 61 -2.964 0.992 -7.107 355 H ILE 62 H ILE 62 -5.868 2.497 -5.631 356 HA ILE 62 HA ILE 62 -6.126 0.184 -4.003 357 HB ILE 62 HB ILE 62 -8.051 2.146 -3.161 358 HG12 ILE 62 1HG1 ILE 62 -5.265 3.227 -3.664 359 HG13 ILE 62 2HG1 ILE 62 -6.752 3.774 -4.430 360 HG21 ILE 62 1HG2 ILE 62 -6.648 2.154 -1.147 361 HG22 ILE 62 2HG2 ILE 62 -5.414 1.243 -2.019 362 HG23 ILE 62 3HG2 ILE 62 -6.995 0.521 -1.717 363 HD11 ILE 62 1HD1 ILE 62 -6.047 5.299 -2.678 364 HD12 ILE 62 2HD1 ILE 62 -6.120 3.989 -1.501 365 HD13 ILE 62 3HD1 ILE 62 -7.594 4.549 -2.288 366 H LYS 63 H LYS 63 -8.316 1.841 -6.187 367 HA LYS 63 HA LYS 63 -10.656 0.402 -5.530 368 HB2 LYS 63 1HB LYS 63 -10.648 2.481 -6.861 369 HB3 LYS 63 2HB LYS 63 -9.856 1.628 -8.177 370 HG2 LYS 63 1HG LYS 63 -11.812 0.145 -8.359 371 HG3 LYS 63 2HG LYS 63 -12.608 1.079 -7.091 372 HD2 LYS 63 1HD LYS 63 -11.664 2.178 -9.737 373 HD3 LYS 63 2HD LYS 63 -13.330 1.748 -9.348 374 HE2 LYS 63 1HE LYS 63 -13.311 3.417 -7.537 375 HE3 LYS 63 2HE LYS 63 -11.667 3.867 -7.988 376 HZ1 LYS 63 1HZ LYS 63 -14.060 4.099 -9.726 377 HZ2 LYS 63 2HZ LYS 63 -12.487 4.533 -10.154 378 HZ3 LYS 63 3HZ LYS 63 -13.289 5.376 -8.933 379 H LYS 64 H LYS 64 -8.022 -0.200 -7.795 380 HA LYS 64 HA LYS 64 -9.068 -2.549 -8.961 381 HB2 LYS 64 1HB LYS 64 -7.204 -1.279 -9.934 382 HB3 LYS 64 2HB LYS 64 -6.190 -1.702 -8.562 383 HG2 LYS 64 1HG LYS 64 -6.328 -4.062 -9.188 384 HG3 LYS 64 2HG LYS 64 -7.341 -3.633 -10.567 385 HD2 LYS 64 1HD LYS 64 -4.517 -2.666 -10.114 386 HD3 LYS 64 2HD LYS 64 -4.979 -3.980 -11.194 387 HE2 LYS 64 1HE LYS 64 -5.859 -1.103 -11.430 388 HE3 LYS 64 2HE LYS 64 -4.634 -1.892 -12.419 389 HZ1 LYS 64 1HZ LYS 64 -6.326 -3.401 -13.250 390 HZ2 LYS 64 2HZ LYS 64 -6.758 -1.797 -13.556 391 HZ3 LYS 64 3HZ LYS 64 -7.503 -2.647 -12.301 392 H ALA 65 H ALA 65 -6.991 -1.978 -6.156 393 HA ALA 65 HA ALA 65 -6.579 -4.658 -5.418 394 HB1 ALA 65 1HB ALA 65 -6.748 -2.223 -3.641 395 HB2 ALA 65 2HB ALA 65 -5.301 -2.793 -4.471 396 HB3 ALA 65 3HB ALA 65 -6.038 -3.776 -3.206 397 H ASP 66 H ASP 66 -9.069 -2.324 -4.497 398 HA ASP 66 HA ASP 66 -10.615 -3.884 -2.790 399 HB2 ASP 66 1HB ASP 66 -11.075 -1.547 -3.001 400 HB3 ASP 66 2HB ASP 66 -11.353 -1.691 -4.730 401 H ASP 67 H ASP 67 -10.643 -3.663 -6.305 402 HA ASP 67 HA ASP 67 -12.921 -5.245 -6.775 403 HB2 ASP 67 1HB ASP 67 -12.039 -3.822 -8.517 404 HB3 ASP 67 2HB ASP 67 -10.510 -4.697 -8.513 405 H ILE 68 H ILE 68 -9.468 -6.093 -6.794 406 HA ILE 68 HA ILE 68 -9.907 -8.837 -7.370 407 HB ILE 68 HB ILE 68 -7.497 -7.563 -6.060 408 HG12 ILE 68 1HG1 ILE 68 -8.016 -8.141 -8.988 409 HG13 ILE 68 2HG1 ILE 68 -8.112 -6.546 -8.249 410 HG21 ILE 68 1HG2 ILE 68 -6.279 -9.508 -6.931 411 HG22 ILE 68 2HG2 ILE 68 -7.793 -10.177 -7.539 412 HG23 ILE 68 3HG2 ILE 68 -7.549 -9.987 -5.803 413 HD11 ILE 68 1HD1 ILE 68 -5.741 -6.654 -7.696 414 HD12 ILE 68 2HD1 ILE 68 -6.011 -6.859 -9.428 415 HD13 ILE 68 3HD1 ILE 68 -5.643 -8.260 -8.421 416 H ALA 69 H ALA 69 -9.624 -6.998 -4.388 417 HA ALA 69 HA ALA 69 -9.288 -9.188 -2.638 418 HB1 ALA 69 1HB ALA 69 -10.468 -6.481 -2.028 419 HB2 ALA 69 2HB ALA 69 -8.748 -6.869 -2.026 420 HB3 ALA 69 3HB ALA 69 -9.826 -7.633 -0.857 421 H LYS 70 H LYS 70 -12.198 -7.153 -3.053 422 HA LYS 70 HA LYS 70 -13.823 -8.891 -1.514 423 HB2 LYS 70 1HB LYS 70 -14.559 -6.731 -3.474 424 HB3 LYS 70 2HB LYS 70 -15.710 -7.624 -2.495 425 HG2 LYS 70 1HG LYS 70 -14.755 -6.719 -0.473 426 HG3 LYS 70 2HG LYS 70 -13.469 -5.936 -1.392 427 HD2 LYS 70 1HD LYS 70 -15.149 -4.556 -2.526 428 HD3 LYS 70 2HD LYS 70 -16.420 -5.342 -1.589 429 HE2 LYS 70 1HE LYS 70 -14.144 -3.714 -0.460 430 HE3 LYS 70 2HE LYS 70 -15.807 -3.162 -0.651 431 HZ1 LYS 70 1HZ LYS 70 -16.496 -4.946 0.871 432 HZ2 LYS 70 2HZ LYS 70 -15.437 -3.848 1.606 433 HZ3 LYS 70 3HZ LYS 70 -14.873 -5.366 1.108 434 H LYS 71 H LYS 71 -12.711 -9.161 -4.648 435 HA LYS 71 HA LYS 71 -14.643 -10.081 -6.262 436 HB2 LYS 71 1HB LYS 71 -12.300 -10.004 -6.896 437 HB3 LYS 71 2HB LYS 71 -11.932 -11.325 -5.800 438 HG2 LYS 71 1HG LYS 71 -13.242 -12.849 -7.156 439 HG3 LYS 71 2HG LYS 71 -13.697 -11.525 -8.231 440 HD2 LYS 71 1HD LYS 71 -11.869 -12.865 -9.171 441 HD3 LYS 71 2HD LYS 71 -11.363 -11.207 -8.854 442 HE2 LYS 71 1HE LYS 71 -10.285 -11.914 -6.787 443 HE3 LYS 71 2HE LYS 71 -10.831 -13.570 -7.054 444 HZ1 LYS 71 1HZ LYS 71 -8.510 -13.202 -7.709 445 HZ2 LYS 71 2HZ LYS 71 -9.014 -12.080 -8.867 446 HZ3 LYS 71 3HZ LYS 71 -9.469 -13.701 -9.006 447 H GLN 72 H GLN 72 -13.073 -12.074 -3.745 448 HA GLN 72 HA GLN 72 -15.332 -13.920 -4.055 449 HB2 GLN 72 1HB GLN 72 -13.731 -15.853 -3.836 450 HB3 GLN 72 2HB GLN 72 -13.675 -14.969 -5.353 451 HG2 GLN 72 1HG GLN 72 -11.715 -13.706 -4.456 452 HG3 GLN 72 2HG GLN 72 -11.725 -14.796 -3.070 453 HE21 GLN 72 1HE2 GLN 72 -9.660 -14.380 -5.047 454 HE22 GLN 72 2HE2 GLN 72 -9.380 -15.912 -5.803 455 H ASN 73 H ASN 73 -12.408 -13.597 -1.988 456 HA ASN 73 HA ASN 73 -14.134 -14.271 0.305 457 HB2 ASN 73 1HB ASN 73 -12.243 -15.397 1.347 458 HB3 ASN 73 2HB ASN 73 -12.550 -16.078 -0.245 459 HD21 ASN 73 1HD2 ASN 73 -10.125 -16.105 1.383 460 HD22 ASN 73 2HD2 ASN 73 -8.889 -15.400 0.402 461 H SER 74 H SER 74 -11.623 -12.227 -0.879 462 HA SER 74 HA SER 74 -10.706 -11.359 1.674 463 HB2 SER 74 1HB SER 74 -10.027 -10.366 -1.091 464 HB3 SER 74 2HB SER 74 -9.162 -9.952 0.391 465 HG SER 74 HG SER 74 -9.537 -12.620 -0.520 466 H SER 75 H SER 75 -13.523 -10.759 0.908 467 HA SER 75 HA SER 75 -14.072 -8.172 0.271 468 HB2 SER 75 1HB SER 75 -15.456 -9.753 2.444 469 HB3 SER 75 2HB SER 75 -16.147 -8.428 1.507 470 HG SER 75 HG SER 75 -16.347 -10.909 0.913 471 H GLU 76 H GLU 76 -12.764 -9.358 3.300 472 HA GLU 76 HA GLU 76 -12.359 -6.549 4.093 473 HB2 GLU 76 1HB GLU 76 -13.728 -7.936 5.700 474 HB3 GLU 76 2HB GLU 76 -12.312 -8.957 5.924 475 HG2 GLU 76 1HG GLU 76 -11.064 -6.959 6.702 476 HG3 GLU 76 2HG GLU 76 -12.561 -6.037 6.601 477 H ALA 77 H ALA 77 -10.427 -6.148 3.158 478 HA ALA 77 HA ALA 77 -8.237 -8.078 3.591 479 HB1 ALA 77 1HB ALA 77 -7.249 -7.230 1.532 480 HB2 ALA 77 2HB ALA 77 -8.587 -6.096 1.343 481 HB3 ALA 77 3HB ALA 77 -8.881 -7.831 1.242 482 H LYS 78 H LYS 78 -6.038 -6.980 3.534 483 HA LYS 78 HA LYS 78 -6.149 -4.353 4.852 484 HB2 LYS 78 1HB LYS 78 -3.960 -6.439 4.871 485 HB3 LYS 78 2HB LYS 78 -3.777 -4.825 5.527 486 HG2 LYS 78 1HG LYS 78 -4.275 -5.923 7.437 487 HG3 LYS 78 2HG LYS 78 -5.918 -5.556 6.912 488 HD2 LYS 78 1HD LYS 78 -6.195 -7.754 6.016 489 HD3 LYS 78 2HD LYS 78 -4.490 -8.127 6.264 490 HE2 LYS 78 1HE LYS 78 -6.465 -7.535 8.461 491 HE3 LYS 78 2HE LYS 78 -5.965 -9.150 7.965 492 HZ1 LYS 78 1HZ LYS 78 -4.140 -7.046 9.020 493 HZ2 LYS 78 2HZ LYS 78 -3.711 -8.639 8.622 494 HZ3 LYS 78 3HZ LYS 78 -4.756 -8.347 9.916 495 H ILE 79 H ILE 79 -5.276 -2.636 3.836 496 HA ILE 79 HA ILE 79 -3.875 -3.150 1.285 497 HB ILE 79 HB ILE 79 -5.624 -0.763 1.892 498 HG12 ILE 79 1HG1 ILE 79 -6.992 -2.817 1.796 499 HG13 ILE 79 2HG1 ILE 79 -7.321 -1.742 0.437 500 HG21 ILE 79 1HG2 ILE 79 -3.871 -0.367 0.247 501 HG22 ILE 79 2HG2 ILE 79 -5.469 -0.325 -0.498 502 HG23 ILE 79 3HG2 ILE 79 -4.440 -1.744 -0.698 503 HD11 ILE 79 1HD1 ILE 79 -5.627 -4.229 0.370 504 HD12 ILE 79 2HD1 ILE 79 -5.914 -3.146 -0.992 505 HD13 ILE 79 3HD1 ILE 79 -7.254 -4.046 -0.284 506 H LEU 80 H LEU 80 -1.779 -2.587 1.527 507 HA LEU 80 HA LEU 80 -1.095 -0.422 3.380 508 HB2 LEU 80 1HB LEU 80 0.161 -2.595 3.403 509 HB3 LEU 80 2HB LEU 80 0.743 -2.220 1.789 510 HG LEU 80 HG LEU 80 1.799 -0.133 2.774 511 HD11 LEU 80 1HD1 LEU 80 2.213 -0.155 5.190 512 HD12 LEU 80 2HD1 LEU 80 1.128 -1.536 5.355 513 HD13 LEU 80 3HD1 LEU 80 0.500 0.020 4.810 514 HD21 LEU 80 1HD2 LEU 80 2.735 -2.812 3.798 515 HD22 LEU 80 2HD2 LEU 80 3.715 -1.350 3.678 516 HD23 LEU 80 3HD2 LEU 80 3.096 -2.121 2.217 517 H ILE 81 H ILE 81 -0.738 1.596 2.653 518 HA ILE 81 HA ILE 81 -0.023 1.895 -0.192 519 HB ILE 81 HB ILE 81 -1.360 3.936 1.600 520 HG12 ILE 81 1HG1 ILE 81 -2.400 2.412 -0.802 521 HG13 ILE 81 2HG1 ILE 81 -2.861 2.117 0.870 522 HG21 ILE 81 1HG2 ILE 81 -0.584 4.107 -1.312 523 HG22 ILE 81 2HG2 ILE 81 0.161 4.994 0.019 524 HG23 ILE 81 3HG2 ILE 81 -1.516 5.314 -0.424 525 HD11 ILE 81 1HD1 ILE 81 -4.575 3.367 -0.280 526 HD12 ILE 81 2HD1 ILE 81 -3.409 4.616 -0.718 527 HD13 ILE 81 3HD1 ILE 81 -3.841 4.366 0.973 528 H LEU 82 H LEU 82 2.104 1.896 -0.217 529 HA LEU 82 HA LEU 82 3.628 3.233 1.884 530 HB2 LEU 82 1HB LEU 82 4.021 0.855 0.876 531 HB3 LEU 82 2HB LEU 82 4.767 1.719 -0.450 532 HG LEU 82 HG LEU 82 6.403 0.855 1.170 533 HD11 LEU 82 1HD1 LEU 82 7.005 2.791 -0.136 534 HD12 LEU 82 2HD1 LEU 82 7.672 2.928 1.491 535 HD13 LEU 82 3HD1 LEU 82 6.244 3.858 1.044 536 HD21 LEU 82 1HD2 LEU 82 4.994 1.042 3.174 537 HD22 LEU 82 2HD2 LEU 82 5.158 2.797 3.109 538 HD23 LEU 82 3HD2 LEU 82 6.576 1.789 3.390 539 H LEU 83 H LEU 83 3.995 5.363 1.554 540 HA LEU 83 HA LEU 83 4.966 6.208 -1.063 541 HB2 LEU 83 1HB LEU 83 3.406 8.245 -0.863 542 HB3 LEU 83 2HB LEU 83 2.751 6.738 -1.469 543 HG LEU 83 HG LEU 83 1.828 6.308 0.832 544 HD11 LEU 83 1HD1 LEU 83 1.577 8.253 2.321 545 HD12 LEU 83 2HD1 LEU 83 2.676 9.161 1.283 546 HD13 LEU 83 3HD1 LEU 83 3.253 7.739 2.148 547 HD21 LEU 83 1HD2 LEU 83 0.437 7.150 -0.971 548 HD22 LEU 83 2HD2 LEU 83 0.911 8.803 -0.583 549 HD23 LEU 83 3HD2 LEU 83 -0.038 7.867 0.569 550 H GLU 84 H GLU 84 5.547 8.646 -0.948 551 HA GLU 84 HA GLU 84 6.379 9.322 1.792 552 HB2 GLU 84 1HB GLU 84 8.122 10.779 0.711 553 HB3 GLU 84 2HB GLU 84 8.371 9.056 0.483 554 HG2 GLU 84 1HG GLU 84 7.403 9.236 -1.771 555 HG3 GLU 84 2HG GLU 84 7.228 10.974 -1.535 556 H LYS 85 H LYS 85 4.801 10.531 2.492 557 HA LYS 85 HA LYS 85 4.256 13.102 1.465 558 HB2 LYS 85 1HB LYS 85 3.066 11.688 -0.229 559 HB3 LYS 85 2HB LYS 85 2.074 11.041 1.065 560 HG2 LYS 85 1HG LYS 85 1.144 13.239 1.488 561 HG3 LYS 85 2HG LYS 85 2.185 13.932 0.241 562 HD2 LYS 85 1HD LYS 85 0.158 11.760 -0.269 563 HD3 LYS 85 2HD LYS 85 -0.164 13.482 -0.503 564 HE2 LYS 85 1HE LYS 85 1.712 13.563 -2.119 565 HE3 LYS 85 2HE LYS 85 1.923 11.824 -1.921 566 HZ1 LYS 85 1HZ LYS 85 -0.254 11.451 -2.809 567 HZ2 LYS 85 2HZ LYS 85 0.595 12.436 -3.895 568 HZ3 LYS 85 3HZ LYS 85 -0.575 13.109 -2.874 569 HA PRO 86 HA PRO 86 3.101 13.195 5.809 570 HB2 PRO 86 1HB PRO 86 1.795 15.738 5.019 571 HB3 PRO 86 2HB PRO 86 2.987 15.435 6.286 572 HG2 PRO 86 1HG PRO 86 3.666 16.687 4.027 573 HG3 PRO 86 2HG PRO 86 4.772 15.554 4.822 574 HD2 PRO 86 1HD PRO 86 3.073 15.161 2.396 575 HD3 PRO 86 2HD PRO 86 4.715 14.574 2.734 576 H VAL 87 H VAL 87 1.419 12.003 6.486 577 HA VAL 87 HA VAL 87 -1.155 12.365 5.110 578 HB VAL 87 HB VAL 87 -1.628 9.964 5.721 579 HG11 VAL 87 1HG1 VAL 87 -1.018 10.636 3.455 580 HG12 VAL 87 2HG1 VAL 87 -0.350 9.051 3.847 581 HG13 VAL 87 3HG1 VAL 87 0.692 10.475 3.859 582 HG21 VAL 87 1HG2 VAL 87 0.064 9.685 7.455 583 HG22 VAL 87 2HG2 VAL 87 1.342 9.926 6.265 584 HG23 VAL 87 3HG2 VAL 87 0.297 8.509 6.162 585 H SER 88 H SER 88 -2.780 13.021 6.288 586 HA SER 88 HA SER 88 -2.620 12.825 9.201 587 HB2 SER 88 1HB SER 88 -4.504 14.411 7.433 588 HB3 SER 88 2HB SER 88 -4.458 14.475 9.194 589 HG SER 88 HG SER 88 -2.285 15.227 9.016 590 HA PRO 89 HA PRO 89 -5.376 9.429 9.729 591 HB2 PRO 89 1HB PRO 89 -7.025 11.344 11.333 592 HB3 PRO 89 2HB PRO 89 -6.525 9.693 11.723 593 HG2 PRO 89 1HG PRO 89 -5.268 11.775 12.801 594 HG3 PRO 89 2HG PRO 89 -4.371 10.336 12.284 595 HD2 PRO 89 1HD PRO 89 -4.508 13.023 11.036 596 HD3 PRO 89 2HD PRO 89 -3.199 11.829 11.005 597 H GLU 90 H GLU 90 -7.084 12.528 9.282 598 HA GLU 90 HA GLU 90 -9.491 11.483 8.322 599 HB2 GLU 90 1HB GLU 90 -9.148 13.814 9.090 600 HB3 GLU 90 2HB GLU 90 -8.225 14.138 7.631 601 HG2 GLU 90 1HG GLU 90 -10.202 13.673 6.276 602 HG3 GLU 90 2HG GLU 90 -11.127 13.350 7.742 603 H TYR 91 H TYR 91 -6.560 12.447 6.581 604 HA TYR 91 HA TYR 91 -7.623 12.028 3.986 605 HB2 TYR 91 1HB TYR 91 -5.684 13.426 4.214 606 HB3 TYR 91 2HB TYR 91 -4.779 12.139 5.004 607 HD1 TYR 91 HD1 TYR 91 -6.668 12.591 1.797 608 HD2 TYR 91 HD2 TYR 91 -3.150 11.160 3.714 609 HE1 TYR 91 HE1 TYR 91 -5.780 11.871 -0.381 610 HE2 TYR 91 HE2 TYR 91 -2.252 10.440 1.542 611 HH TYR 91 HH TYR 91 -3.617 11.391 -1.422 612 H GLU 92 H GLU 92 -5.824 9.989 6.243 613 HA GLU 92 HA GLU 92 -5.527 7.756 4.557 614 HB2 GLU 92 1HB GLU 92 -4.267 7.910 6.613 615 HB3 GLU 92 2HB GLU 92 -5.744 7.951 7.566 616 HG2 GLU 92 1HG GLU 92 -6.265 5.675 6.809 617 HG3 GLU 92 2HG GLU 92 -4.736 5.635 5.935 618 H LYS 93 H LYS 93 -8.126 8.874 6.596 619 HA LYS 93 HA LYS 93 -9.737 6.560 6.472 620 HB2 LYS 93 1HB LYS 93 -9.960 8.369 8.170 621 HB3 LYS 93 2HB LYS 93 -10.585 9.428 6.914 622 HG2 LYS 93 1HG LYS 93 -12.493 7.970 6.597 623 HG3 LYS 93 2HG LYS 93 -11.855 6.850 7.801 624 HD2 LYS 93 1HD LYS 93 -11.957 8.695 9.471 625 HD3 LYS 93 2HD LYS 93 -12.758 9.688 8.253 626 HE2 LYS 93 1HE LYS 93 -14.396 8.682 9.733 627 HE3 LYS 93 2HE LYS 93 -14.559 8.035 8.101 628 HZ1 LYS 93 1HZ LYS 93 -13.327 6.072 8.800 629 HZ2 LYS 93 2HZ LYS 93 -14.707 6.287 9.753 630 HZ3 LYS 93 3HZ LYS 93 -13.184 6.693 10.367 631 H LYS 94 H LYS 94 -9.409 9.430 4.466 632 HA LYS 94 HA LYS 94 -11.606 8.881 2.755 633 HB2 LYS 94 1HB LYS 94 -9.073 10.456 2.261 634 HB3 LYS 94 2HB LYS 94 -10.442 10.410 1.160 635 HG2 LYS 94 1HG LYS 94 -11.864 11.400 2.881 636 HG3 LYS 94 2HG LYS 94 -10.493 11.439 3.991 637 HD2 LYS 94 1HD LYS 94 -10.790 13.624 3.010 638 HD3 LYS 94 2HD LYS 94 -9.297 12.909 2.400 639 HE2 LYS 94 1HE LYS 94 -10.448 12.263 0.340 640 HE3 LYS 94 2HE LYS 94 -11.944 12.962 0.954 641 HZ1 LYS 94 1HZ LYS 94 -9.437 14.435 0.363 642 HZ2 LYS 94 2HZ LYS 94 -10.834 15.124 1.019 643 HZ3 LYS 94 3HZ LYS 94 -10.864 14.482 -0.545 644 H LEU 95 H LEU 95 -8.263 7.851 2.840 645 HA LEU 95 HA LEU 95 -8.318 6.537 0.305 646 HB2 LEU 95 1HB LEU 95 -6.475 6.179 2.672 647 HB3 LEU 95 2HB LEU 95 -6.217 5.476 1.085 648 HG LEU 95 HG LEU 95 -6.347 8.444 1.629 649 HD11 LEU 95 1HD1 LEU 95 -4.389 7.558 2.690 650 HD12 LEU 95 2HD1 LEU 95 -3.909 8.389 1.211 651 HD13 LEU 95 3HD1 LEU 95 -3.979 6.627 1.249 652 HD21 LEU 95 1HD2 LEU 95 -5.420 8.638 -0.631 653 HD22 LEU 95 2HD2 LEU 95 -7.002 7.859 -0.632 654 HD23 LEU 95 3HD2 LEU 95 -5.542 6.888 -0.824 655 H GLN 96 H GLN 96 -8.824 5.529 3.659 656 HA GLN 96 HA GLN 96 -9.426 2.817 3.080 657 HB2 GLN 96 1HB GLN 96 -10.295 4.586 5.381 658 HB3 GLN 96 2HB GLN 96 -10.600 2.859 5.305 659 HG2 GLN 96 1HG GLN 96 -8.307 2.335 5.508 660 HG3 GLN 96 2HG GLN 96 -7.826 4.009 5.184 661 HE21 GLN 96 1HE2 GLN 96 -7.096 2.352 7.412 662 HE22 GLN 96 2HE2 GLN 96 -7.676 3.134 8.843 663 H LYS 97 H LYS 97 -11.119 5.770 2.692 664 HA LYS 97 HA LYS 97 -13.752 4.634 2.486 665 HB2 LYS 97 1HB LYS 97 -13.384 6.982 3.141 666 HB3 LYS 97 2HB LYS 97 -12.706 7.313 1.553 667 HG2 LYS 97 1HG LYS 97 -14.897 6.678 0.557 668 HG3 LYS 97 2HG LYS 97 -15.543 6.554 2.195 669 HD2 LYS 97 1HD LYS 97 -14.891 8.915 2.579 670 HD3 LYS 97 2HD LYS 97 -14.386 9.014 0.891 671 HE2 LYS 97 1HE LYS 97 -16.619 9.936 1.179 672 HE3 LYS 97 2HE LYS 97 -16.666 8.482 0.181 673 HZ1 LYS 97 1HZ LYS 97 -18.446 8.570 1.854 674 HZ2 LYS 97 2HZ LYS 97 -17.289 8.544 3.084 675 HZ3 LYS 97 3HZ LYS 97 -17.448 7.221 2.047 676 H TYR 98 H TYR 98 -11.191 5.532 0.208 677 HA TYR 98 HA TYR 98 -12.704 5.218 -2.153 678 HB2 TYR 98 1HB TYR 98 -9.728 4.872 -1.740 679 HB3 TYR 98 2HB TYR 98 -10.519 4.970 -3.307 680 HD1 TYR 98 HD1 TYR 98 -8.335 6.755 -1.841 681 HD2 TYR 98 HD2 TYR 98 -12.490 7.189 -2.647 682 HE1 TYR 98 HE1 TYR 98 -8.085 9.200 -1.784 683 HE2 TYR 98 HE2 TYR 98 -12.250 9.636 -2.589 684 HH TYR 98 HH TYR 98 -9.157 11.175 -2.546 685 H ALA 99 H ALA 99 -10.549 2.964 -0.459 686 HA ALA 99 HA ALA 99 -11.919 0.759 -1.859 687 HB1 ALA 99 1HB ALA 99 -9.110 0.840 -0.759 688 HB2 ALA 99 2HB ALA 99 -9.570 0.844 -2.462 689 HB3 ALA 99 3HB ALA 99 -9.888 -0.575 -1.468 690 H ASP 100 H ASP 100 -13.184 -0.435 -0.569 691 HA ASP 100 HA ASP 100 -13.221 0.170 2.239 692 HB2 ASP 100 1HB ASP 100 -15.342 -0.189 1.086 693 HB3 ASP 100 2HB ASP 100 -14.852 -1.825 0.655 694 H ALA 101 H ALA 101 -11.628 -0.545 3.302 695 HA ALA 101 HA ALA 101 -11.342 -3.226 4.096 696 HB1 ALA 101 1HB ALA 101 -10.261 -3.507 1.906 697 HB2 ALA 101 2HB ALA 101 -9.079 -3.640 3.209 698 HB3 ALA 101 3HB ALA 101 -9.184 -2.156 2.262 699 H GLU 102 H GLU 102 -8.924 -3.216 5.235 700 HA GLU 102 HA GLU 102 -8.901 -0.660 6.645 701 HB2 GLU 102 1HB GLU 102 -7.401 -3.163 7.389 702 HB3 GLU 102 2HB GLU 102 -7.641 -1.710 8.347 703 HG2 GLU 102 1HG GLU 102 -10.102 -2.181 8.281 704 HG3 GLU 102 2HG GLU 102 -9.701 -3.748 7.578 705 H VAL 103 H VAL 103 -7.897 0.629 5.247 706 HA VAL 103 HA VAL 103 -5.457 -0.156 3.938 707 HB VAL 103 HB VAL 103 -6.666 2.609 4.008 708 HG11 VAL 103 1HG1 VAL 103 -4.864 1.240 2.031 709 HG12 VAL 103 2HG1 VAL 103 -4.405 2.520 3.156 710 HG13 VAL 103 3HG1 VAL 103 -5.544 2.855 1.849 711 HG21 VAL 103 1HG2 VAL 103 -8.379 1.068 3.251 712 HG22 VAL 103 2HG2 VAL 103 -7.259 0.383 2.075 713 HG23 VAL 103 3HG2 VAL 103 -7.787 2.055 1.915 714 H ARG 104 H ARG 104 -3.589 -0.097 4.921 715 HA ARG 104 HA ARG 104 -3.092 1.895 7.016 716 HB2 ARG 104 1HB ARG 104 -1.601 -0.615 6.238 717 HB3 ARG 104 2HB ARG 104 -1.003 0.543 7.416 718 HG2 ARG 104 1HG ARG 104 -3.047 0.143 8.764 719 HG3 ARG 104 2HG ARG 104 -3.497 -1.124 7.618 720 HD2 ARG 104 1HD ARG 104 -2.358 -2.022 9.609 721 HD3 ARG 104 2HD ARG 104 -1.468 -2.345 8.120 722 HE ARG 104 HE ARG 104 -0.555 0.056 9.296 723 HH11 ARG 104 1HH1 ARG 104 -0.460 -3.406 9.780 724 HH12 ARG 104 2HH1 ARG 104 1.079 -3.373 10.592 725 HH21 ARG 104 1HH2 ARG 104 1.458 0.111 10.357 726 HH22 ARG 104 2HH2 ARG 104 2.168 -1.368 10.928 727 H VAL 105 H VAL 105 -2.518 3.733 6.012 728 HA VAL 105 HA VAL 105 -0.735 3.583 3.717 729 HB VAL 105 HB VAL 105 -1.252 5.850 3.277 730 HG11 VAL 105 1HG1 VAL 105 -3.747 4.522 4.353 731 HG12 VAL 105 2HG1 VAL 105 -3.037 4.248 2.766 732 HG13 VAL 105 3HG1 VAL 105 -3.697 5.829 3.172 733 HG21 VAL 105 1HG2 VAL 105 -2.503 7.298 4.804 734 HG22 VAL 105 2HG2 VAL 105 -0.990 6.757 5.534 735 HG23 VAL 105 3HG2 VAL 105 -2.516 6.016 6.016 736 H ARG 106 H ARG 106 1.344 4.418 3.695 737 HA ARG 106 HA ARG 106 2.443 5.186 6.315 738 HB2 ARG 106 1HB ARG 106 3.412 2.986 4.499 739 HB3 ARG 106 2HB ARG 106 4.446 3.721 5.712 740 HG2 ARG 106 1HG ARG 106 1.865 2.263 6.234 741 HG3 ARG 106 2HG ARG 106 3.492 1.642 6.517 742 HD2 ARG 106 1HD ARG 106 2.050 3.859 7.944 743 HD3 ARG 106 2HD ARG 106 2.738 2.384 8.620 744 HE ARG 106 HE ARG 106 4.930 3.566 7.702 745 HH11 ARG 106 1HH1 ARG 106 2.266 4.840 9.584 746 HH12 ARG 106 2HH1 ARG 106 3.212 6.107 10.300 747 HH21 ARG 106 1HH2 ARG 106 6.184 5.253 8.650 748 HH22 ARG 106 2HH2 ARG 106 5.430 6.336 9.775 749 H THR 107 H THR 107 3.800 6.845 6.237 750 HA THR 107 HA THR 107 4.818 7.702 3.631 751 HB THR 107 HB THR 107 3.638 9.448 4.814 752 HG1 THR 107 HG1 THR 107 5.429 10.979 5.032 753 HG21 THR 107 1HG2 THR 107 5.581 9.005 7.081 754 HG22 THR 107 2HG2 THR 107 3.857 8.632 7.099 755 HG23 THR 107 3HG2 THR 107 4.395 10.308 6.985 756 H VAL 108 H VAL 108 6.858 7.308 3.112 757 HA VAL 108 HA VAL 108 8.744 6.646 5.282 758 HB VAL 108 HB VAL 108 9.929 5.190 3.707 759 HG11 VAL 108 1HG1 VAL 108 8.275 3.390 3.596 760 HG12 VAL 108 2HG1 VAL 108 6.992 4.551 3.937 761 HG13 VAL 108 3HG1 VAL 108 8.229 4.221 5.150 762 HG21 VAL 108 1HG2 VAL 108 9.328 6.335 1.627 763 HG22 VAL 108 2HG2 VAL 108 7.663 5.778 1.801 764 HG23 VAL 108 3HG2 VAL 108 8.963 4.613 1.545 765 H THR 109 H THR 109 10.807 7.430 5.183 766 HA THR 109 HA THR 109 11.166 9.748 3.468 767 HB THR 109 HB THR 109 13.235 10.043 4.967 768 HG1 THR 109 HG1 THR 109 12.927 8.883 7.017 769 HG21 THR 109 1HG2 THR 109 11.874 10.960 6.801 770 HG22 THR 109 2HG2 THR 109 10.469 10.089 6.188 771 HG23 THR 109 3HG2 THR 109 11.200 11.373 5.226 772 H SER 110 H SER 110 12.448 6.541 3.957 773 HA SER 110 HA SER 110 14.060 6.806 1.554 774 HB2 SER 110 1HB SER 110 15.282 5.905 4.178 775 HB3 SER 110 2HB SER 110 16.102 5.985 2.624 776 HG SER 110 HG SER 110 16.117 7.842 4.369 777 HA PRO 111 HA PRO 111 13.016 2.580 0.523 778 HB2 PRO 111 1HB PRO 111 15.930 1.987 0.881 779 HB3 PRO 111 2HB PRO 111 14.841 1.516 -0.427 780 HG2 PRO 111 1HG PRO 111 16.564 3.539 -0.715 781 HG3 PRO 111 2HG PRO 111 14.951 3.585 -1.446 782 HD2 PRO 111 1HD PRO 111 16.019 5.102 0.851 783 HD3 PRO 111 2HD PRO 111 14.675 5.496 -0.234 784 H ASP 112 H ASP 112 15.482 2.880 3.052 785 HA ASP 112 HA ASP 112 15.353 0.413 4.259 786 HB2 ASP 112 1HB ASP 112 16.998 2.214 4.746 787 HB3 ASP 112 2HB ASP 112 15.759 3.060 5.665 788 H GLU 113 H GLU 113 13.303 3.228 4.913 789 HA GLU 113 HA GLU 113 11.989 2.243 7.181 790 HB2 GLU 113 1HB GLU 113 11.091 4.186 5.055 791 HB3 GLU 113 2HB GLU 113 10.155 3.848 6.502 792 HG2 GLU 113 1HG GLU 113 12.964 4.921 6.491 793 HG3 GLU 113 2HG GLU 113 11.509 5.902 6.655 794 H ALA 114 H ALA 114 11.095 2.058 3.753 795 HA ALA 114 HA ALA 114 8.604 0.824 4.086 796 HB1 ALA 114 1HB ALA 114 8.736 0.259 1.743 797 HB2 ALA 114 2HB ALA 114 10.477 0.542 1.744 798 HB3 ALA 114 3HB ALA 114 9.366 1.887 1.998 799 H LYS 115 H LYS 115 11.839 -0.509 3.819 800 HA LYS 115 HA LYS 115 11.315 -3.193 3.430 801 HB2 LYS 115 1HB LYS 115 13.451 -1.931 5.160 802 HB3 LYS 115 2HB LYS 115 13.455 -3.606 4.637 803 HG2 LYS 115 1HG LYS 115 13.675 -2.935 2.331 804 HG3 LYS 115 2HG LYS 115 13.523 -1.235 2.784 805 HD2 LYS 115 1HD LYS 115 15.840 -1.667 2.455 806 HD3 LYS 115 2HD LYS 115 15.580 -1.524 4.191 807 HE2 LYS 115 1HE LYS 115 17.037 -3.370 3.839 808 HE3 LYS 115 2HE LYS 115 15.466 -4.021 4.295 809 HZ1 LYS 115 1HZ LYS 115 16.454 -3.794 1.501 810 HZ2 LYS 115 2HZ LYS 115 15.016 -4.538 2.013 811 HZ3 LYS 115 3HZ LYS 115 16.508 -5.210 2.434 812 H ARG 116 H ARG 116 11.231 -1.324 6.427 813 HA ARG 116 HA ARG 116 10.717 -3.672 8.025 814 HB2 ARG 116 1HB ARG 116 11.125 -0.779 8.580 815 HB3 ARG 116 2HB ARG 116 10.272 -1.738 9.781 816 HG2 ARG 116 1HG ARG 116 12.617 -1.632 10.322 817 HG3 ARG 116 2HG ARG 116 12.177 -3.282 9.881 818 HD2 ARG 116 1HD ARG 116 13.044 -2.827 7.592 819 HD3 ARG 116 2HD ARG 116 13.612 -1.260 8.169 820 HE ARG 116 HE ARG 116 14.532 -3.629 9.599 821 HH11 ARG 116 1HH1 ARG 116 15.210 -1.089 7.300 822 HH12 ARG 116 2HH1 ARG 116 16.928 -1.301 7.375 823 HH21 ARG 116 1HH2 ARG 116 16.795 -3.921 9.702 824 HH22 ARG 116 2HH2 ARG 116 17.835 -2.905 8.752 825 H TRP 117 H TRP 117 8.822 -1.091 6.595 826 HA TRP 117 HA TRP 117 6.494 -1.565 8.170 827 HB2 TRP 117 1HB TRP 117 6.873 -0.139 5.537 828 HB3 TRP 117 2HB TRP 117 5.321 -0.240 6.368 829 HD1 TRP 117 HD1 TRP 117 7.978 2.116 5.977 830 HE1 TRP 117 HE1 TRP 117 8.165 3.731 7.971 831 HE3 TRP 117 HE3 TRP 117 5.142 -0.457 9.363 832 HZ2 TRP 117 HZ2 TRP 117 7.228 3.886 10.635 833 HZ3 TRP 117 HZ3 TRP 117 4.837 0.492 11.611 834 HH2 TRP 117 HH2 TRP 117 5.859 2.618 12.231 835 H ILE 118 H ILE 118 7.587 -2.696 5.020 836 HA ILE 118 HA ILE 118 5.264 -4.102 4.303 837 HB ILE 118 HB ILE 118 8.151 -4.671 3.607 838 HG12 ILE 118 1HG1 ILE 118 5.990 -3.244 2.042 839 HG13 ILE 118 2HG1 ILE 118 7.264 -2.435 2.950 840 HG21 ILE 118 1HG2 ILE 118 5.630 -5.695 2.313 841 HG22 ILE 118 2HG2 ILE 118 6.773 -6.652 3.256 842 HG23 ILE 118 3HG2 ILE 118 7.269 -5.949 1.715 843 HD11 ILE 118 1HD1 ILE 118 7.777 -2.506 0.585 844 HD12 ILE 118 2HD1 ILE 118 7.661 -4.264 0.598 845 HD13 ILE 118 3HD1 ILE 118 8.939 -3.459 1.507 846 H LYS 119 H LYS 119 8.031 -4.972 6.298 847 HA LYS 119 HA LYS 119 7.425 -7.673 6.731 848 HB2 LYS 119 1HB LYS 119 8.794 -5.652 8.503 849 HB3 LYS 119 2HB LYS 119 8.701 -7.363 8.882 850 HG2 LYS 119 1HG LYS 119 9.978 -7.917 6.922 851 HG3 LYS 119 2HG LYS 119 9.970 -6.231 6.400 852 HD2 LYS 119 1HD LYS 119 12.099 -6.763 7.426 853 HD3 LYS 119 2HD LYS 119 11.217 -5.621 8.437 854 HE2 LYS 119 1HE LYS 119 12.248 -7.324 9.814 855 HE3 LYS 119 2HE LYS 119 10.493 -7.479 9.877 856 HZ1 LYS 119 1HZ LYS 119 11.599 -9.625 9.638 857 HZ2 LYS 119 2HZ LYS 119 12.294 -9.124 8.182 858 HZ3 LYS 119 3HZ LYS 119 10.616 -9.291 8.306 859 H GLU 120 H GLU 120 6.523 -4.803 8.627 860 HA GLU 120 HA GLU 120 5.078 -6.196 10.601 861 HB2 GLU 120 1HB GLU 120 4.803 -3.332 9.678 862 HB3 GLU 120 2HB GLU 120 4.099 -3.989 11.149 863 HG2 GLU 120 1HG GLU 120 7.026 -3.741 10.506 864 HG3 GLU 120 2HG GLU 120 6.110 -2.793 11.678 865 H PHE 121 H PHE 121 4.119 -4.776 7.538 866 HA PHE 121 HA PHE 121 1.327 -5.034 7.901 867 HB2 PHE 121 1HB PHE 121 2.283 -3.504 6.260 868 HB3 PHE 121 2HB PHE 121 2.970 -4.856 5.368 869 HD1 PHE 121 HD1 PHE 121 1.754 -5.899 3.688 870 HD2 PHE 121 HD2 PHE 121 -0.249 -3.382 6.470 871 HE1 PHE 121 HE1 PHE 121 -0.297 -6.050 2.339 872 HE2 PHE 121 HE2 PHE 121 -2.303 -3.528 5.130 873 HZ PHE 121 HZ PHE 121 -2.331 -4.867 3.061 874 H SER 122 H SER 122 3.739 -7.121 6.340 875 HA SER 122 HA SER 122 1.821 -8.973 5.365 876 HB2 SER 122 1HB SER 122 3.878 -10.464 5.091 877 HB3 SER 122 2HB SER 122 3.882 -8.930 4.221 878 HG SER 122 HG SER 122 5.343 -8.120 5.607 879 H GLU 123 H GLU 123 3.793 -8.833 8.293 880 HA GLU 123 HA GLU 123 2.764 -11.394 9.190 881 HB2 GLU 123 1HB GLU 123 4.536 -9.412 10.632 882 HB3 GLU 123 2HB GLU 123 4.173 -11.046 11.166 883 HG2 GLU 123 1HG GLU 123 5.733 -10.233 8.729 884 HG3 GLU 123 2HG GLU 123 6.348 -11.018 10.182 885 H GLU 124 H GLU 124 1.062 -8.891 8.824 886 HA GLU 124 HA GLU 124 0.049 -8.512 11.524 887 HB2 GLU 124 1HB GLU 124 0.163 -6.595 9.944 888 HB3 GLU 124 2HB GLU 124 -0.996 -7.414 8.906 889 HG2 GLU 124 1HG GLU 124 -2.582 -7.402 10.857 890 HG3 GLU 124 2HG GLU 124 -1.441 -6.334 11.674 Start of MODEL 11 1 HA MET 21 HA MET 21 -8.524 -11.235 3.260 2 HB2 MET 21 1HB MET 21 -7.213 -9.594 4.583 3 HB3 MET 21 2HB MET 21 -8.319 -10.533 5.576 4 HG2 MET 21 1HG MET 21 -6.479 -11.946 6.306 5 HG3 MET 21 2HG MET 21 -5.366 -11.038 5.287 6 HE1 MET 21 1HE MET 21 -3.744 -10.623 7.301 7 HE2 MET 21 2HE MET 21 -4.812 -11.572 8.336 8 HE3 MET 21 3HE MET 21 -4.258 -9.984 8.861 9 H THR 22 H THR 22 -7.520 -10.645 1.434 10 HA THR 22 HA THR 22 -4.823 -11.495 0.864 11 HB THR 22 HB THR 22 -6.664 -9.676 -0.714 12 HG1 THR 22 HG1 THR 22 -6.067 -12.268 -1.560 13 HG21 THR 22 1HG2 THR 22 -4.123 -11.081 -1.553 14 HG22 THR 22 2HG2 THR 22 -4.312 -9.346 -1.310 15 HG23 THR 22 3HG2 THR 22 -5.185 -10.154 -2.613 16 H LEU 23 H LEU 23 -2.997 -10.221 0.906 17 HA LEU 23 HA LEU 23 -3.343 -7.588 2.134 18 HB2 LEU 23 1HB LEU 23 -0.891 -9.338 1.966 19 HB3 LEU 23 2HB LEU 23 -0.981 -7.794 2.790 20 HG LEU 23 HG LEU 23 -2.492 -10.298 3.550 21 HD11 LEU 23 1HD1 LEU 23 -0.118 -10.440 4.054 22 HD12 LEU 23 2HD1 LEU 23 -1.064 -10.273 5.534 23 HD13 LEU 23 3HD1 LEU 23 -0.188 -8.886 4.885 24 HD21 LEU 23 1HD2 LEU 23 -3.807 -8.335 4.062 25 HD22 LEU 23 2HD2 LEU 23 -2.420 -7.573 4.840 26 HD23 LEU 23 3HD2 LEU 23 -3.148 -9.015 5.550 27 H PHE 24 H PHE 24 -3.309 -5.955 0.793 28 HA PHE 24 HA PHE 24 -1.764 -6.145 -1.701 29 HB2 PHE 24 1HB PHE 24 -3.849 -4.101 -0.897 30 HB3 PHE 24 2HB PHE 24 -3.095 -4.245 -2.476 31 HD1 PHE 24 HD1 PHE 24 -3.925 -5.745 -4.093 32 HD2 PHE 24 HD2 PHE 24 -5.394 -5.886 -0.103 33 HE1 PHE 24 HE1 PHE 24 -5.729 -7.245 -4.813 34 HE2 PHE 24 HE2 PHE 24 -7.203 -7.386 -0.819 35 HZ PHE 24 HZ PHE 24 -7.374 -8.067 -3.179 36 H VAL 25 H VAL 25 -0.332 -4.444 -2.292 37 HA VAL 25 HA VAL 25 0.177 -2.430 -0.254 38 HB VAL 25 HB VAL 25 1.773 -4.065 0.401 39 HG11 VAL 25 1HG1 VAL 25 1.760 -5.398 -1.667 40 HG12 VAL 25 2HG1 VAL 25 3.386 -5.088 -1.060 41 HG13 VAL 25 3HG1 VAL 25 2.769 -4.174 -2.435 42 HG21 VAL 25 1HG2 VAL 25 3.161 -1.969 -1.261 43 HG22 VAL 25 2HG2 VAL 25 3.896 -2.904 0.041 44 HG23 VAL 25 3HG2 VAL 25 2.589 -1.774 0.396 45 H LEU 26 H LEU 26 0.080 -0.581 -1.149 46 HA LEU 26 HA LEU 26 0.824 -0.221 -3.971 47 HB2 LEU 26 1HB LEU 26 -0.924 1.388 -2.105 48 HB3 LEU 26 2HB LEU 26 -0.385 2.003 -3.651 49 HG LEU 26 HG LEU 26 -1.588 0.153 -4.782 50 HD11 LEU 26 1HD1 LEU 26 -2.660 -0.462 -2.042 51 HD12 LEU 26 2HD1 LEU 26 -1.578 -1.490 -2.982 52 HD13 LEU 26 3HD1 LEU 26 -3.214 -1.166 -3.561 53 HD21 LEU 26 1HD2 LEU 26 -3.224 1.870 -2.934 54 HD22 LEU 26 2HD2 LEU 26 -3.851 1.008 -4.338 55 HD23 LEU 26 3HD2 LEU 26 -2.661 2.288 -4.551 56 H ILE 27 H ILE 27 2.070 1.744 -4.477 57 HA ILE 27 HA ILE 27 3.579 2.836 -2.241 58 HB ILE 27 HB ILE 27 4.886 0.908 -2.680 59 HG12 ILE 27 1HG1 ILE 27 6.164 3.255 -4.105 60 HG13 ILE 27 2HG1 ILE 27 6.181 2.970 -2.367 61 HG21 ILE 27 1HG2 ILE 27 3.953 0.310 -4.847 62 HG22 ILE 27 2HG2 ILE 27 5.718 0.290 -4.893 63 HG23 ILE 27 3HG2 ILE 27 4.832 1.639 -5.604 64 HD11 ILE 27 1HD1 ILE 27 8.292 2.344 -3.396 65 HD12 ILE 27 2HD1 ILE 27 7.451 1.208 -4.450 66 HD13 ILE 27 3HD1 ILE 27 7.482 0.938 -2.708 67 H LEU 28 H LEU 28 3.309 4.958 -2.572 68 HA LEU 28 HA LEU 28 3.618 6.021 -5.288 69 HB2 LEU 28 1HB LEU 28 2.255 6.880 -2.856 70 HB3 LEU 28 2HB LEU 28 3.217 8.160 -3.568 71 HG LEU 28 HG LEU 28 2.011 7.958 -5.657 72 HD11 LEU 28 1HD1 LEU 28 0.499 5.749 -4.287 73 HD12 LEU 28 2HD1 LEU 28 1.575 5.587 -5.671 74 HD13 LEU 28 3HD1 LEU 28 0.059 6.470 -5.834 75 HD21 LEU 28 1HD2 LEU 28 0.172 8.112 -3.279 76 HD22 LEU 28 2HD2 LEU 28 -0.196 8.699 -4.901 77 HD23 LEU 28 3HD2 LEU 28 1.102 9.443 -3.966 78 H SER 29 H SER 29 5.819 5.474 -5.347 79 HA SER 29 HA SER 29 7.464 7.672 -4.413 80 HB2 SER 29 1HB SER 29 7.822 5.949 -2.701 81 HB3 SER 29 2HB SER 29 8.175 4.758 -3.950 82 HG SER 29 HG SER 29 9.725 6.899 -3.011 83 H ASN 30 H ASN 30 8.994 8.248 -6.019 84 HA ASN 30 HA ASN 30 9.480 6.118 -7.998 85 HB2 ASN 30 1HB ASN 30 10.127 7.905 -9.607 86 HB3 ASN 30 2HB ASN 30 8.442 8.007 -9.119 87 HD21 ASN 30 1HD2 ASN 30 10.222 10.035 -10.230 88 HD22 ASN 30 2HD2 ASN 30 10.223 11.342 -9.097 89 H ASP 31 H ASP 31 10.959 5.295 -6.522 90 HA ASP 31 HA ASP 31 13.609 6.525 -6.829 91 HB2 ASP 31 1HB ASP 31 12.770 6.314 -4.439 92 HB3 ASP 31 2HB ASP 31 12.807 4.572 -4.668 93 H LYS 32 H LYS 32 15.349 4.816 -7.159 94 HA LYS 32 HA LYS 32 14.247 2.625 -8.734 95 HB2 LYS 32 1HB LYS 32 17.107 3.504 -8.297 96 HB3 LYS 32 2HB LYS 32 16.624 2.161 -9.323 97 HG2 LYS 32 1HG LYS 32 15.893 5.054 -9.712 98 HG3 LYS 32 2HG LYS 32 17.055 4.125 -10.659 99 HD2 LYS 32 1HD LYS 32 15.253 2.639 -11.403 100 HD3 LYS 32 2HD LYS 32 14.092 3.575 -10.461 101 HE2 LYS 32 1HE LYS 32 15.750 4.605 -12.759 102 HE3 LYS 32 2HE LYS 32 14.037 4.193 -12.825 103 HZ1 LYS 32 1HZ LYS 32 15.272 6.360 -11.214 104 HZ2 LYS 32 2HZ LYS 32 13.643 5.925 -11.141 105 HZ3 LYS 32 3HZ LYS 32 14.283 6.549 -12.574 106 H LYS 33 H LYS 33 15.893 3.162 -5.694 107 HA LYS 33 HA LYS 33 16.324 0.301 -5.321 108 HB2 LYS 33 1HB LYS 33 17.025 2.647 -3.549 109 HB3 LYS 33 2HB LYS 33 17.445 0.973 -3.217 110 HG2 LYS 33 1HG LYS 33 18.411 2.649 -5.524 111 HG3 LYS 33 2HG LYS 33 19.350 2.124 -4.125 112 HD2 LYS 33 1HD LYS 33 18.935 -0.232 -4.817 113 HD3 LYS 33 2HD LYS 33 18.171 0.381 -6.284 114 HE2 LYS 33 1HE LYS 33 20.287 1.561 -6.823 115 HE3 LYS 33 2HE LYS 33 21.029 0.791 -5.423 116 HZ1 LYS 33 1HZ LYS 33 21.544 -0.424 -7.428 117 HZ2 LYS 33 2HZ LYS 33 19.904 -0.604 -7.791 118 HZ3 LYS 33 3HZ LYS 33 20.556 -1.372 -6.435 119 H LEU 34 H LEU 34 14.481 2.958 -3.891 120 HA LEU 34 HA LEU 34 13.354 1.602 -1.727 121 HB2 LEU 34 1HB LEU 34 13.271 4.097 -2.360 122 HB3 LEU 34 2HB LEU 34 11.884 3.676 -3.339 123 HG LEU 34 HG LEU 34 11.913 3.045 -0.405 124 HD11 LEU 34 1HD1 LEU 34 12.460 5.413 -0.602 125 HD12 LEU 34 2HD1 LEU 34 10.820 5.189 0.002 126 HD13 LEU 34 3HD1 LEU 34 11.086 5.646 -1.680 127 HD21 LEU 34 1HD2 LEU 34 10.159 2.046 -1.770 128 HD22 LEU 34 2HD2 LEU 34 9.714 3.643 -2.375 129 HD23 LEU 34 3HD2 LEU 34 9.497 3.253 -0.669 130 H ILE 35 H ILE 35 12.204 1.890 -5.063 131 HA ILE 35 HA ILE 35 9.831 0.428 -4.812 132 HB ILE 35 HB ILE 35 11.677 0.894 -7.144 133 HG12 ILE 35 1HG1 ILE 35 8.914 1.910 -6.450 134 HG13 ILE 35 2HG1 ILE 35 10.417 2.823 -6.355 135 HG21 ILE 35 1HG2 ILE 35 10.614 -1.268 -7.510 136 HG22 ILE 35 2HG2 ILE 35 9.999 -0.052 -8.629 137 HG23 ILE 35 3HG2 ILE 35 9.028 -0.542 -7.238 138 HD11 ILE 35 1HD1 ILE 35 10.670 2.626 -8.784 139 HD12 ILE 35 2HD1 ILE 35 9.170 3.437 -8.329 140 HD13 ILE 35 3HD1 ILE 35 9.139 1.755 -8.860 141 H GLU 36 H GLU 36 13.109 -0.646 -5.693 142 HA GLU 36 HA GLU 36 12.390 -3.341 -6.112 143 HB2 GLU 36 1HB GLU 36 15.069 -2.119 -5.455 144 HB3 GLU 36 2HB GLU 36 14.830 -3.780 -5.984 145 HG2 GLU 36 1HG GLU 36 14.141 -1.308 -7.552 146 HG3 GLU 36 2HG GLU 36 15.525 -2.358 -7.821 147 H GLU 37 H GLU 37 13.781 -1.699 -3.270 148 HA GLU 37 HA GLU 37 14.102 -3.969 -1.663 149 HB2 GLU 37 1HB GLU 37 13.502 -1.111 -0.891 150 HB3 GLU 37 2HB GLU 37 13.907 -2.369 0.270 151 HG2 GLU 37 1HG GLU 37 15.659 -1.337 -1.947 152 HG3 GLU 37 2HG GLU 37 15.846 -1.031 -0.222 153 H ALA 38 H ALA 38 11.303 -1.909 -2.218 154 HA ALA 38 HA ALA 38 9.602 -3.074 -0.300 155 HB1 ALA 38 1HB ALA 38 7.778 -2.068 -1.576 156 HB2 ALA 38 2HB ALA 38 8.880 -1.757 -2.917 157 HB3 ALA 38 3HB ALA 38 9.112 -0.934 -1.376 158 H ARG 39 H ARG 39 10.050 -3.748 -3.768 159 HA ARG 39 HA ARG 39 8.096 -5.789 -3.854 160 HB2 ARG 39 1HB ARG 39 8.789 -4.645 -5.874 161 HB3 ARG 39 2HB ARG 39 10.423 -5.270 -5.699 162 HG2 ARG 39 1HG ARG 39 9.737 -7.478 -6.179 163 HG3 ARG 39 2HG ARG 39 8.022 -7.067 -6.022 164 HD2 ARG 39 1HD ARG 39 8.179 -5.636 -7.985 165 HD3 ARG 39 2HD ARG 39 9.905 -5.962 -8.109 166 HE ARG 39 HE ARG 39 8.513 -8.404 -8.178 167 HH11 ARG 39 1HH1 ARG 39 9.051 -5.547 -10.139 168 HH12 ARG 39 2HH1 ARG 39 8.785 -6.378 -11.637 169 HH21 ARG 39 1HH2 ARG 39 8.175 -9.489 -10.126 170 HH22 ARG 39 2HH2 ARG 39 8.282 -8.630 -11.632 171 H LYS 40 H LYS 40 11.596 -5.875 -3.288 172 HA LYS 40 HA LYS 40 12.079 -8.585 -3.412 173 HB2 LYS 40 1HB LYS 40 13.127 -6.563 -1.430 174 HB3 LYS 40 2HB LYS 40 13.741 -8.207 -1.544 175 HG2 LYS 40 1HG LYS 40 14.436 -7.802 -3.841 176 HG3 LYS 40 2HG LYS 40 13.794 -6.160 -3.750 177 HD2 LYS 40 1HD LYS 40 15.367 -5.645 -1.952 178 HD3 LYS 40 2HD LYS 40 16.001 -7.288 -2.029 179 HE2 LYS 40 1HE LYS 40 16.724 -6.901 -4.330 180 HE3 LYS 40 2HE LYS 40 16.081 -5.262 -4.261 181 HZ1 LYS 40 1HZ LYS 40 17.649 -4.739 -2.514 182 HZ2 LYS 40 2HZ LYS 40 18.470 -5.318 -3.882 183 HZ3 LYS 40 3HZ LYS 40 18.252 -6.325 -2.541 184 H MET 41 H MET 41 10.768 -6.776 -0.660 185 HA MET 41 HA MET 41 10.393 -9.136 0.931 186 HB2 MET 41 1HB MET 41 9.280 -6.343 1.276 187 HB3 MET 41 2HB MET 41 9.192 -7.626 2.474 188 HG2 MET 41 1HG MET 41 11.701 -6.337 1.433 189 HG3 MET 41 2HG MET 41 10.949 -6.059 3.002 190 HE1 MET 41 1HE MET 41 14.034 -6.881 2.559 191 HE2 MET 41 2HE MET 41 14.227 -8.020 3.892 192 HE3 MET 41 3HE MET 41 13.307 -6.533 4.129 193 H ALA 42 H ALA 42 8.208 -6.928 -0.806 194 HA ALA 42 HA ALA 42 5.840 -8.202 0.046 195 HB1 ALA 42 1HB ALA 42 6.274 -6.455 -2.363 196 HB2 ALA 42 2HB ALA 42 5.890 -5.903 -0.732 197 HB3 ALA 42 3HB ALA 42 4.722 -6.864 -1.636 198 H GLU 43 H GLU 43 7.804 -8.629 -2.885 199 HA GLU 43 HA GLU 43 5.933 -10.276 -4.218 200 HB2 GLU 43 1HB GLU 43 7.820 -9.156 -5.356 201 HB3 GLU 43 2HB GLU 43 8.933 -10.248 -4.543 202 HG2 GLU 43 1HG GLU 43 8.032 -12.134 -5.693 203 HG3 GLU 43 2HG GLU 43 6.728 -11.160 -6.372 204 H LYS 44 H LYS 44 8.612 -10.919 -2.026 205 HA LYS 44 HA LYS 44 8.394 -13.758 -2.106 206 HB2 LYS 44 1HB LYS 44 10.401 -12.373 -1.336 207 HB3 LYS 44 2HB LYS 44 9.525 -12.105 0.160 208 HG2 LYS 44 1HG LYS 44 10.058 -14.878 -0.836 209 HG3 LYS 44 2HG LYS 44 11.277 -13.981 0.068 210 HD2 LYS 44 1HD LYS 44 8.494 -14.252 1.122 211 HD3 LYS 44 2HD LYS 44 9.659 -15.561 1.338 212 HE2 LYS 44 1HE LYS 44 10.070 -12.705 2.202 213 HE3 LYS 44 2HE LYS 44 9.542 -14.008 3.261 214 HZ1 LYS 44 1HZ LYS 44 12.131 -13.915 1.808 215 HZ2 LYS 44 2HZ LYS 44 11.623 -15.154 2.839 216 HZ3 LYS 44 3HZ LYS 44 11.913 -13.608 3.456 217 H ALA 45 H ALA 45 6.930 -11.191 -0.252 218 HA ALA 45 HA ALA 45 5.599 -12.985 1.572 219 HB1 ALA 45 1HB ALA 45 6.336 -10.835 2.396 220 HB2 ALA 45 2HB ALA 45 4.576 -10.940 2.480 221 HB3 ALA 45 3HB ALA 45 5.345 -10.012 1.194 222 H ASN 46 H ASN 46 5.159 -12.779 -1.469 223 HA ASN 46 HA ASN 46 3.519 -12.834 -3.017 224 HB2 ASN 46 1HB ASN 46 1.712 -14.383 -2.587 225 HB3 ASN 46 2HB ASN 46 3.204 -15.003 -1.900 226 HD21 ASN 46 1HD2 ASN 46 3.363 -15.287 0.288 227 HD22 ASN 46 2HD2 ASN 46 2.026 -15.100 1.371 228 H LEU 47 H LEU 47 3.507 -10.420 -1.471 229 HA LEU 47 HA LEU 47 0.740 -9.697 -1.095 230 HB2 LEU 47 1HB LEU 47 3.136 -7.883 -1.310 231 HB3 LEU 47 2HB LEU 47 1.563 -7.466 -0.675 232 HG LEU 47 HG LEU 47 3.607 -9.281 0.587 233 HD11 LEU 47 1HD1 LEU 47 2.391 -6.665 1.441 234 HD12 LEU 47 2HD1 LEU 47 4.020 -6.889 0.802 235 HD13 LEU 47 3HD1 LEU 47 3.574 -7.603 2.353 236 HD21 LEU 47 1HD2 LEU 47 1.363 -10.191 0.935 237 HD22 LEU 47 2HD2 LEU 47 0.829 -8.623 1.539 238 HD23 LEU 47 3HD2 LEU 47 2.042 -9.543 2.427 239 H ILE 48 H ILE 48 -0.369 -8.122 -2.373 240 HA ILE 48 HA ILE 48 0.445 -8.220 -5.161 241 HB ILE 48 HB ILE 48 -2.097 -7.112 -3.955 242 HG12 ILE 48 1HG1 ILE 48 -1.482 -9.744 -5.322 243 HG13 ILE 48 2HG1 ILE 48 -1.936 -9.515 -3.637 244 HG21 ILE 48 1HG2 ILE 48 -1.557 -6.050 -6.084 245 HG22 ILE 48 2HG2 ILE 48 -2.941 -7.128 -6.265 246 HG23 ILE 48 3HG2 ILE 48 -1.351 -7.633 -6.835 247 HD11 ILE 48 1HD1 ILE 48 -3.690 -8.965 -6.018 248 HD12 ILE 48 2HD1 ILE 48 -4.145 -8.771 -4.326 249 HD13 ILE 48 3HD1 ILE 48 -3.783 -10.375 -4.963 250 H LEU 49 H LEU 49 2.140 -6.874 -5.289 251 HA LEU 49 HA LEU 49 2.023 -4.186 -4.227 252 HB2 LEU 49 1HB LEU 49 4.123 -5.423 -4.127 253 HB3 LEU 49 2HB LEU 49 4.117 -5.612 -5.870 254 HG LEU 49 HG LEU 49 4.272 -3.106 -6.056 255 HD11 LEU 49 1HD1 LEU 49 4.830 -3.319 -3.102 256 HD12 LEU 49 2HD1 LEU 49 3.451 -2.513 -3.852 257 HD13 LEU 49 3HD1 LEU 49 5.080 -1.883 -4.095 258 HD21 LEU 49 1HD2 LEU 49 6.513 -4.522 -4.624 259 HD22 LEU 49 2HD2 LEU 49 6.661 -3.040 -5.568 260 HD23 LEU 49 3HD2 LEU 49 6.208 -4.551 -6.361 261 H ILE 50 H ILE 50 1.048 -2.618 -5.285 262 HA ILE 50 HA ILE 50 1.011 -2.736 -8.229 263 HB ILE 50 HB ILE 50 -0.843 -1.066 -6.530 264 HG12 ILE 50 1HG1 ILE 50 -1.402 -3.807 -7.700 265 HG13 ILE 50 2HG1 ILE 50 -1.093 -3.498 -5.995 266 HG21 ILE 50 1HG2 ILE 50 -0.581 -0.399 -8.866 267 HG22 ILE 50 2HG2 ILE 50 -2.197 -1.037 -8.572 268 HG23 ILE 50 3HG2 ILE 50 -0.991 -2.032 -9.386 269 HD11 ILE 50 1HD1 ILE 50 -3.093 -2.110 -5.883 270 HD12 ILE 50 2HD1 ILE 50 -3.468 -3.739 -6.445 271 HD13 ILE 50 3HD1 ILE 50 -3.395 -2.405 -7.594 272 H THR 51 H THR 51 2.746 -1.640 -8.868 273 HA THR 51 HA THR 51 3.713 0.656 -7.430 274 HB THR 51 HB THR 51 5.352 0.730 -9.420 275 HG1 THR 51 HG1 THR 51 3.700 -0.942 -10.457 276 HG21 THR 51 1HG2 THR 51 6.675 -1.107 -8.488 277 HG22 THR 51 2HG2 THR 51 5.249 -1.713 -7.648 278 HG23 THR 51 3HG2 THR 51 5.932 -0.148 -7.209 279 H VAL 52 H VAL 52 2.412 2.379 -7.584 280 HA VAL 52 HA VAL 52 1.914 3.467 -10.274 281 HB VAL 52 HB VAL 52 -0.125 4.579 -9.278 282 HG11 VAL 52 1HG1 VAL 52 -0.128 1.568 -9.388 283 HG12 VAL 52 2HG1 VAL 52 -0.379 2.669 -10.743 284 HG13 VAL 52 3HG1 VAL 52 -1.566 2.590 -9.438 285 HG21 VAL 52 1HG2 VAL 52 0.409 4.354 -6.927 286 HG22 VAL 52 2HG2 VAL 52 0.348 2.597 -7.058 287 HG23 VAL 52 3HG2 VAL 52 -1.120 3.548 -7.277 288 H GLY 53 H GLY 53 2.469 5.629 -10.546 289 HA2 GLY 53 1HA GLY 53 3.270 7.032 -8.070 290 HA3 GLY 53 2HA GLY 53 4.208 7.150 -9.552 291 H ASP 54 H ASP 54 1.391 8.104 -7.868 292 HA ASP 54 HA ASP 54 1.110 10.655 -8.626 293 HB2 ASP 54 1HB ASP 54 0.857 9.713 -11.008 294 HB3 ASP 54 2HB ASP 54 -0.695 9.080 -10.474 295 H GLU 55 H GLU 55 -0.869 11.548 -7.762 296 HA GLU 55 HA GLU 55 -1.973 9.889 -5.725 297 HB2 GLU 55 1HB GLU 55 -2.949 12.614 -6.570 298 HB3 GLU 55 2HB GLU 55 -3.174 11.835 -5.008 299 HG2 GLU 55 1HG GLU 55 -0.581 11.834 -4.916 300 HG3 GLU 55 2HG GLU 55 -0.716 13.081 -6.155 301 H GLU 56 H GLU 56 -2.935 10.798 -8.924 302 HA GLU 56 HA GLU 56 -5.675 9.949 -8.569 303 HB2 GLU 56 1HB GLU 56 -4.117 10.581 -11.080 304 HB3 GLU 56 2HB GLU 56 -5.853 10.315 -11.000 305 HG2 GLU 56 1HG GLU 56 -4.427 12.501 -9.508 306 HG3 GLU 56 2HG GLU 56 -5.148 12.704 -11.104 307 H GLU 57 H GLU 57 -2.677 8.656 -9.910 308 HA GLU 57 HA GLU 57 -3.839 6.245 -10.867 309 HB2 GLU 57 1HB GLU 57 -1.099 7.284 -10.533 310 HB3 GLU 57 2HB GLU 57 -1.259 5.539 -10.475 311 HG2 GLU 57 1HG GLU 57 -0.760 6.486 -12.728 312 HG3 GLU 57 2HG GLU 57 -2.179 5.449 -12.646 313 H LEU 58 H LEU 58 -2.639 7.290 -7.760 314 HA LEU 58 HA LEU 58 -2.573 4.825 -6.449 315 HB2 LEU 58 1HB LEU 58 -1.866 6.925 -5.378 316 HB3 LEU 58 2HB LEU 58 -3.525 7.489 -5.375 317 HG LEU 58 HG LEU 58 -4.127 5.618 -3.858 318 HD11 LEU 58 1HD1 LEU 58 -2.470 4.260 -2.828 319 HD12 LEU 58 2HD1 LEU 58 -1.168 5.156 -3.606 320 HD13 LEU 58 3HD1 LEU 58 -2.237 4.144 -4.572 321 HD21 LEU 58 1HD2 LEU 58 -3.023 6.524 -1.859 322 HD22 LEU 58 2HD2 LEU 58 -3.642 7.793 -2.918 323 HD23 LEU 58 3HD2 LEU 58 -1.918 7.426 -2.896 324 H LYS 59 H LYS 59 -5.249 7.006 -7.168 325 HA LYS 59 HA LYS 59 -7.284 5.583 -5.878 326 HB2 LYS 59 1HB LYS 59 -7.426 7.386 -8.280 327 HB3 LYS 59 2HB LYS 59 -8.822 6.834 -7.365 328 HG2 LYS 59 1HG LYS 59 -8.130 8.038 -5.433 329 HG3 LYS 59 2HG LYS 59 -6.567 8.417 -6.162 330 HD2 LYS 59 1HD LYS 59 -7.638 9.794 -7.832 331 HD3 LYS 59 2HD LYS 59 -9.232 9.337 -7.232 332 HE2 LYS 59 1HE LYS 59 -8.777 10.439 -5.120 333 HE3 LYS 59 2HE LYS 59 -7.142 10.829 -5.652 334 HZ1 LYS 59 1HZ LYS 59 -8.015 12.247 -7.348 335 HZ2 LYS 59 2HZ LYS 59 -8.727 12.689 -5.871 336 HZ3 LYS 59 3HZ LYS 59 -9.608 11.783 -6.993 337 H LYS 60 H LYS 60 -5.634 4.958 -8.776 338 HA LYS 60 HA LYS 60 -7.713 3.311 -9.931 339 HB2 LYS 60 1HB LYS 60 -4.846 3.472 -10.823 340 HB3 LYS 60 2HB LYS 60 -6.276 3.115 -11.790 341 HG2 LYS 60 1HG LYS 60 -5.896 5.753 -10.418 342 HG3 LYS 60 2HG LYS 60 -5.250 5.429 -12.039 343 HD2 LYS 60 1HD LYS 60 -7.471 5.011 -12.879 344 HD3 LYS 60 2HD LYS 60 -8.147 5.135 -11.254 345 HE2 LYS 60 1HE LYS 60 -8.535 7.187 -12.493 346 HE3 LYS 60 2HE LYS 60 -7.443 7.479 -11.145 347 HZ1 LYS 60 1HZ LYS 60 -6.676 8.600 -13.125 348 HZ2 LYS 60 2HZ LYS 60 -6.660 7.148 -13.989 349 HZ3 LYS 60 3HZ LYS 60 -5.576 7.379 -12.711 350 H ALA 61 H ALA 61 -4.567 2.902 -8.380 351 HA ALA 61 HA ALA 61 -4.521 0.073 -8.476 352 HB1 ALA 61 1HB ALA 61 -2.766 0.271 -6.770 353 HB2 ALA 61 2HB ALA 61 -3.155 1.981 -6.580 354 HB3 ALA 61 3HB ALA 61 -2.506 1.389 -8.109 355 H ILE 62 H ILE 62 -5.617 2.437 -6.111 356 HA ILE 62 HA ILE 62 -6.400 0.708 -4.060 357 HB ILE 62 HB ILE 62 -7.459 3.403 -4.898 358 HG12 ILE 62 1HG1 ILE 62 -5.790 2.525 -2.533 359 HG13 ILE 62 2HG1 ILE 62 -5.156 3.267 -4.000 360 HG21 ILE 62 1HG2 ILE 62 -9.274 2.222 -3.779 361 HG22 ILE 62 2HG2 ILE 62 -8.647 3.524 -2.768 362 HG23 ILE 62 3HG2 ILE 62 -8.207 1.851 -2.425 363 HD11 ILE 62 1HD1 ILE 62 -5.339 4.866 -2.177 364 HD12 ILE 62 2HD1 ILE 62 -7.073 4.555 -2.072 365 HD13 ILE 62 3HD1 ILE 62 -6.395 5.297 -3.523 366 H LYS 63 H LYS 63 -8.247 1.880 -6.863 367 HA LYS 63 HA LYS 63 -10.684 0.667 -6.185 368 HB2 LYS 63 1HB LYS 63 -10.558 2.408 -7.877 369 HB3 LYS 63 2HB LYS 63 -9.583 1.371 -8.910 370 HG2 LYS 63 1HG LYS 63 -11.442 -0.158 -9.181 371 HG3 LYS 63 2HG LYS 63 -12.423 0.807 -8.079 372 HD2 LYS 63 1HD LYS 63 -12.299 2.698 -9.624 373 HD3 LYS 63 2HD LYS 63 -11.308 1.738 -10.724 374 HE2 LYS 63 1HE LYS 63 -13.638 1.789 -11.449 375 HE3 LYS 63 2HE LYS 63 -13.141 0.156 -11.011 376 HZ1 LYS 63 1HZ LYS 63 -14.654 1.986 -9.228 377 HZ2 LYS 63 2HZ LYS 63 -14.275 0.369 -8.922 378 HZ3 LYS 63 3HZ LYS 63 -15.353 0.763 -10.161 379 H LYS 64 H LYS 64 -7.999 -0.517 -8.208 380 HA LYS 64 HA LYS 64 -9.360 -2.939 -8.857 381 HB2 LYS 64 1HB LYS 64 -7.278 -3.663 -9.872 382 HB3 LYS 64 2HB LYS 64 -7.634 -2.007 -10.330 383 HG2 LYS 64 1HG LYS 64 -6.023 -1.208 -8.674 384 HG3 LYS 64 2HG LYS 64 -5.648 -2.879 -8.245 385 HD2 LYS 64 1HD LYS 64 -3.982 -1.978 -9.786 386 HD3 LYS 64 2HD LYS 64 -4.886 -3.294 -10.537 387 HE2 LYS 64 1HE LYS 64 -6.265 -1.691 -11.735 388 HE3 LYS 64 2HE LYS 64 -5.435 -0.354 -10.940 389 HZ1 LYS 64 1HZ LYS 64 -3.380 -1.063 -12.016 390 HZ2 LYS 64 2HZ LYS 64 -4.577 -0.708 -13.152 391 HZ3 LYS 64 3HZ LYS 64 -4.205 -2.315 -12.798 392 H ALA 65 H ALA 65 -7.254 -1.940 -6.261 393 HA ALA 65 HA ALA 65 -6.621 -4.502 -5.256 394 HB1 ALA 65 1HB ALA 65 -5.460 -2.472 -4.521 395 HB2 ALA 65 2HB ALA 65 -6.126 -3.363 -3.154 396 HB3 ALA 65 3HB ALA 65 -6.937 -1.910 -3.740 397 H ASP 66 H ASP 66 -9.248 -2.244 -4.542 398 HA ASP 66 HA ASP 66 -10.657 -3.836 -2.704 399 HB2 ASP 66 1HB ASP 66 -11.178 -1.507 -2.913 400 HB3 ASP 66 2HB ASP 66 -11.547 -1.673 -4.616 401 H ASP 67 H ASP 67 -10.701 -3.678 -6.212 402 HA ASP 67 HA ASP 67 -12.908 -5.382 -6.651 403 HB2 ASP 67 1HB ASP 67 -11.917 -3.854 -8.357 404 HB3 ASP 67 2HB ASP 67 -10.531 -4.934 -8.467 405 H ILE 68 H ILE 68 -9.399 -6.035 -6.680 406 HA ILE 68 HA ILE 68 -9.634 -8.797 -7.244 407 HB ILE 68 HB ILE 68 -7.388 -7.305 -5.873 408 HG12 ILE 68 1HG1 ILE 68 -7.677 -8.193 -8.751 409 HG13 ILE 68 2HG1 ILE 68 -7.908 -6.545 -8.177 410 HG21 ILE 68 1HG2 ILE 68 -5.975 -9.214 -6.469 411 HG22 ILE 68 2HG2 ILE 68 -7.387 -10.063 -7.099 412 HG23 ILE 68 3HG2 ILE 68 -7.277 -9.690 -5.379 413 HD11 ILE 68 1HD1 ILE 68 -5.576 -6.455 -7.477 414 HD12 ILE 68 2HD1 ILE 68 -5.718 -6.840 -9.191 415 HD13 ILE 68 3HD1 ILE 68 -5.342 -8.113 -8.033 416 H ALA 69 H ALA 69 -9.641 -6.955 -4.264 417 HA ALA 69 HA ALA 69 -9.282 -9.089 -2.468 418 HB1 ALA 69 1HB ALA 69 -10.790 -6.513 -2.026 419 HB2 ALA 69 2HB ALA 69 -9.049 -6.723 -1.839 420 HB3 ALA 69 3HB ALA 69 -10.161 -7.584 -0.773 421 H LYS 70 H LYS 70 -12.292 -7.419 -3.388 422 HA LYS 70 HA LYS 70 -13.968 -9.179 -1.949 423 HB2 LYS 70 1HB LYS 70 -14.530 -7.285 -4.208 424 HB3 LYS 70 2HB LYS 70 -15.764 -8.218 -3.376 425 HG2 LYS 70 1HG LYS 70 -15.440 -7.051 -1.363 426 HG3 LYS 70 2HG LYS 70 -13.897 -6.389 -1.907 427 HD2 LYS 70 1HD LYS 70 -15.086 -5.073 -3.613 428 HD3 LYS 70 2HD LYS 70 -16.621 -5.710 -3.015 429 HE2 LYS 70 1HE LYS 70 -16.368 -4.618 -0.936 430 HE3 LYS 70 2HE LYS 70 -14.677 -4.241 -1.261 431 HZ1 LYS 70 1HZ LYS 70 -16.176 -2.324 -1.530 432 HZ2 LYS 70 2HZ LYS 70 -16.956 -3.130 -2.801 433 HZ3 LYS 70 3HZ LYS 70 -15.323 -2.704 -2.946 434 H LYS 71 H LYS 71 -12.344 -9.646 -4.846 435 HA LYS 71 HA LYS 71 -14.053 -10.794 -6.614 436 HB2 LYS 71 1HB LYS 71 -11.513 -10.441 -6.761 437 HB3 LYS 71 2HB LYS 71 -11.366 -12.017 -6.006 438 HG2 LYS 71 1HG LYS 71 -12.921 -11.613 -8.540 439 HG3 LYS 71 2HG LYS 71 -11.182 -11.893 -8.541 440 HD2 LYS 71 1HD LYS 71 -11.574 -14.006 -7.298 441 HD3 LYS 71 2HD LYS 71 -13.311 -13.731 -7.448 442 HE2 LYS 71 1HE LYS 71 -13.124 -13.782 -9.874 443 HE3 LYS 71 2HE LYS 71 -11.381 -14.007 -9.749 444 HZ1 LYS 71 1HZ LYS 71 -13.455 -15.900 -8.786 445 HZ2 LYS 71 2HZ LYS 71 -11.788 -16.112 -8.613 446 HZ3 LYS 71 3HZ LYS 71 -12.481 -16.100 -10.154 447 H GLN 72 H GLN 72 -12.577 -12.404 -3.799 448 HA GLN 72 HA GLN 72 -14.569 -14.523 -4.199 449 HB2 GLN 72 1HB GLN 72 -12.822 -16.207 -3.470 450 HB3 GLN 72 2HB GLN 72 -12.647 -15.537 -5.083 451 HG2 GLN 72 1HG GLN 72 -10.940 -13.972 -4.208 452 HG3 GLN 72 2HG GLN 72 -11.087 -14.749 -2.634 453 HE21 GLN 72 1HE2 GLN 72 -8.795 -14.519 -4.438 454 HE22 GLN 72 2HE2 GLN 72 -8.263 -16.140 -4.723 455 H ASN 73 H ASN 73 -12.050 -13.659 -1.793 456 HA ASN 73 HA ASN 73 -14.067 -14.172 0.291 457 HB2 ASN 73 1HB ASN 73 -12.472 -15.943 0.396 458 HB3 ASN 73 2HB ASN 73 -11.122 -14.821 0.291 459 HD21 ASN 73 1HD2 ASN 73 -10.387 -13.828 2.111 460 HD22 ASN 73 2HD2 ASN 73 -10.978 -14.172 3.697 461 H SER 74 H SER 74 -11.437 -12.161 -0.735 462 HA SER 74 HA SER 74 -10.856 -11.062 1.797 463 HB2 SER 74 1HB SER 74 -9.941 -10.144 -0.917 464 HB3 SER 74 2HB SER 74 -9.183 -9.775 0.632 465 HG SER 74 HG SER 74 -8.285 -11.601 -0.634 466 H SER 75 H SER 75 -13.627 -10.441 0.614 467 HA SER 75 HA SER 75 -13.953 -7.771 0.043 468 HB2 SER 75 1HB SER 75 -16.147 -8.039 1.401 469 HB3 SER 75 2HB SER 75 -15.901 -9.066 -0.012 470 HG SER 75 HG SER 75 -15.802 -9.717 2.720 471 H GLU 76 H GLU 76 -13.198 -9.235 3.159 472 HA GLU 76 HA GLU 76 -12.679 -6.519 4.176 473 HB2 GLU 76 1HB GLU 76 -14.162 -7.939 5.605 474 HB3 GLU 76 2HB GLU 76 -12.853 -9.103 5.748 475 HG2 GLU 76 1HG GLU 76 -12.789 -7.842 7.719 476 HG3 GLU 76 2HG GLU 76 -11.468 -7.228 6.728 477 H ALA 77 H ALA 77 -10.671 -6.084 3.414 478 HA ALA 77 HA ALA 77 -8.571 -8.106 3.848 479 HB1 ALA 77 1HB ALA 77 -9.205 -7.937 1.471 480 HB2 ALA 77 2HB ALA 77 -7.535 -7.450 1.763 481 HB3 ALA 77 3HB ALA 77 -8.779 -6.226 1.499 482 H LYS 78 H LYS 78 -6.339 -6.900 3.390 483 HA LYS 78 HA LYS 78 -6.388 -4.314 4.781 484 HB2 LYS 78 1HB LYS 78 -4.545 -6.650 5.283 485 HB3 LYS 78 2HB LYS 78 -4.173 -5.017 5.813 486 HG2 LYS 78 1HG LYS 78 -6.196 -4.999 7.179 487 HG3 LYS 78 2HG LYS 78 -6.565 -6.639 6.648 488 HD2 LYS 78 1HD LYS 78 -4.568 -7.481 7.687 489 HD3 LYS 78 2HD LYS 78 -4.040 -5.846 8.088 490 HE2 LYS 78 1HE LYS 78 -4.995 -7.016 10.019 491 HE3 LYS 78 2HE LYS 78 -5.911 -5.574 9.595 492 HZ1 LYS 78 1HZ LYS 78 -6.682 -8.295 8.702 493 HZ2 LYS 78 2HZ LYS 78 -7.614 -6.879 8.641 494 HZ3 LYS 78 3HZ LYS 78 -7.257 -7.595 10.133 495 H ILE 79 H ILE 79 -5.126 -2.770 3.924 496 HA ILE 79 HA ILE 79 -3.411 -3.526 1.653 497 HB ILE 79 HB ILE 79 -5.257 -1.130 1.737 498 HG12 ILE 79 1HG1 ILE 79 -5.450 -3.650 0.074 499 HG13 ILE 79 2HG1 ILE 79 -6.490 -3.241 1.437 500 HG21 ILE 79 1HG2 ILE 79 -3.227 -0.668 0.496 501 HG22 ILE 79 2HG2 ILE 79 -4.590 -0.819 -0.613 502 HG23 ILE 79 3HG2 ILE 79 -3.439 -2.143 -0.446 503 HD11 ILE 79 1HD1 ILE 79 -6.286 -1.713 -1.151 504 HD12 ILE 79 2HD1 ILE 79 -7.330 -1.305 0.211 505 HD13 ILE 79 3HD1 ILE 79 -7.591 -2.803 -0.682 506 H LEU 80 H LEU 80 -1.449 -2.563 1.629 507 HA LEU 80 HA LEU 80 -0.938 -0.451 3.625 508 HB2 LEU 80 1HB LEU 80 0.387 -2.767 3.351 509 HB3 LEU 80 2HB LEU 80 1.269 -1.826 2.161 510 HG LEU 80 HG LEU 80 1.098 -1.367 5.135 511 HD11 LEU 80 1HD1 LEU 80 2.746 -2.976 4.355 512 HD12 LEU 80 2HD1 LEU 80 3.524 -1.528 4.995 513 HD13 LEU 80 3HD1 LEU 80 3.413 -1.771 3.252 514 HD21 LEU 80 1HD2 LEU 80 2.239 0.502 3.063 515 HD22 LEU 80 2HD2 LEU 80 2.451 0.652 4.807 516 HD23 LEU 80 3HD2 LEU 80 0.844 0.813 4.096 517 H ILE 81 H ILE 81 -0.746 1.581 2.806 518 HA ILE 81 HA ILE 81 0.189 1.825 0.022 519 HB ILE 81 HB ILE 81 -1.346 3.876 1.644 520 HG12 ILE 81 1HG1 ILE 81 -2.217 2.356 -0.821 521 HG13 ILE 81 2HG1 ILE 81 -2.676 1.896 0.816 522 HG21 ILE 81 1HG2 ILE 81 -1.345 5.236 -0.338 523 HG22 ILE 81 2HG2 ILE 81 -0.535 3.972 -1.260 524 HG23 ILE 81 3HG2 ILE 81 0.324 4.802 0.035 525 HD11 ILE 81 1HD1 ILE 81 -4.444 3.138 -0.307 526 HD12 ILE 81 2HD1 ILE 81 -3.347 4.499 -0.546 527 HD13 ILE 81 3HD1 ILE 81 -3.829 4.029 1.085 528 H LEU 82 H LEU 82 2.327 2.055 0.076 529 HA LEU 82 HA LEU 82 3.577 3.728 2.116 530 HB2 LEU 82 1HB LEU 82 4.741 2.053 -0.112 531 HB3 LEU 82 2HB LEU 82 5.701 3.008 1.000 532 HG LEU 82 HG LEU 82 3.919 0.701 1.791 533 HD11 LEU 82 1HD1 LEU 82 6.921 0.880 1.603 534 HD12 LEU 82 2HD1 LEU 82 5.872 -0.023 0.509 535 HD13 LEU 82 3HD1 LEU 82 5.998 -0.497 2.203 536 HD21 LEU 82 1HD2 LEU 82 4.130 2.382 3.542 537 HD22 LEU 82 2HD2 LEU 82 5.885 2.336 3.392 538 HD23 LEU 82 3HD2 LEU 82 5.010 0.917 3.969 539 H LEU 83 H LEU 83 3.240 5.834 1.670 540 HA LEU 83 HA LEU 83 3.905 6.742 -1.048 541 HB2 LEU 83 1HB LEU 83 2.217 8.482 -0.885 542 HB3 LEU 83 2HB LEU 83 1.495 6.887 -0.806 543 HG LEU 83 HG LEU 83 1.950 8.672 1.601 544 HD11 LEU 83 1HD1 LEU 83 -0.446 9.139 1.460 545 HD12 LEU 83 2HD1 LEU 83 -0.534 8.221 -0.044 546 HD13 LEU 83 3HD1 LEU 83 0.410 9.708 0.028 547 HD21 LEU 83 1HD2 LEU 83 0.185 6.251 1.280 548 HD22 LEU 83 2HD2 LEU 83 0.409 7.213 2.738 549 HD23 LEU 83 3HD2 LEU 83 1.742 6.257 2.100 550 H GLU 84 H GLU 84 5.268 8.473 -1.200 551 HA GLU 84 HA GLU 84 6.212 9.571 1.324 552 HB2 GLU 84 1HB GLU 84 7.070 10.108 -1.529 553 HB3 GLU 84 2HB GLU 84 7.828 10.811 -0.109 554 HG2 GLU 84 1HG GLU 84 8.429 8.550 0.656 555 HG3 GLU 84 2HG GLU 84 7.732 7.891 -0.825 556 H LYS 85 H LYS 85 4.539 10.776 2.063 557 HA LYS 85 HA LYS 85 4.752 13.504 1.370 558 HB2 LYS 85 1HB LYS 85 2.476 14.002 0.723 559 HB3 LYS 85 2HB LYS 85 3.116 12.805 -0.391 560 HG2 LYS 85 1HG LYS 85 1.901 11.052 0.738 561 HG3 LYS 85 2HG LYS 85 1.325 12.198 1.949 562 HD2 LYS 85 1HD LYS 85 0.710 12.287 -1.004 563 HD3 LYS 85 2HD LYS 85 -0.390 11.740 0.260 564 HE2 LYS 85 1HE LYS 85 -0.277 13.993 1.278 565 HE3 LYS 85 2HE LYS 85 0.737 14.520 -0.062 566 HZ1 LYS 85 1HZ LYS 85 -1.095 13.951 -1.579 567 HZ2 LYS 85 2HZ LYS 85 -1.526 15.151 -0.464 568 HZ3 LYS 85 3HZ LYS 85 -2.064 13.564 -0.244 569 HA PRO 86 HA PRO 86 3.340 13.622 5.636 570 HB2 PRO 86 1HB PRO 86 2.088 16.233 5.146 571 HB3 PRO 86 2HB PRO 86 3.447 15.827 6.196 572 HG2 PRO 86 1HG PRO 86 3.773 17.237 3.927 573 HG3 PRO 86 2HG PRO 86 5.002 16.105 4.519 574 HD2 PRO 86 1HD PRO 86 2.969 15.727 2.351 575 HD3 PRO 86 2HD PRO 86 4.679 15.247 2.387 576 H VAL 87 H VAL 87 1.616 12.454 6.285 577 HA VAL 87 HA VAL 87 -0.978 13.036 5.020 578 HB VAL 87 HB VAL 87 -1.605 10.676 5.331 579 HG11 VAL 87 1HG1 VAL 87 -0.231 9.746 3.537 580 HG12 VAL 87 2HG1 VAL 87 0.920 11.067 3.735 581 HG13 VAL 87 3HG1 VAL 87 -0.723 11.402 3.188 582 HG21 VAL 87 1HG2 VAL 87 0.116 9.003 5.840 583 HG22 VAL 87 2HG2 VAL 87 -0.159 10.103 7.192 584 HG23 VAL 87 3HG2 VAL 87 1.266 10.298 6.171 585 H SER 88 H SER 88 -2.734 13.246 6.254 586 HA SER 88 HA SER 88 -2.427 13.030 9.159 587 HB2 SER 88 1HB SER 88 -3.249 15.192 8.320 588 HB3 SER 88 2HB SER 88 -4.574 14.381 7.492 589 HG SER 88 HG SER 88 -4.735 15.362 9.817 590 HA PRO 89 HA PRO 89 -4.752 9.251 9.510 591 HB2 PRO 89 1HB PRO 89 -6.421 10.774 11.467 592 HB3 PRO 89 2HB PRO 89 -5.680 9.178 11.624 593 HG2 PRO 89 1HG PRO 89 -4.582 11.276 12.818 594 HG3 PRO 89 2HG PRO 89 -3.567 10.051 12.037 595 HD2 PRO 89 1HD PRO 89 -4.263 12.799 11.119 596 HD3 PRO 89 2HD PRO 89 -2.765 11.878 10.893 597 H GLU 90 H GLU 90 -6.598 12.268 9.325 598 HA GLU 90 HA GLU 90 -9.078 11.207 8.592 599 HB2 GLU 90 1HB GLU 90 -8.562 13.586 9.267 600 HB3 GLU 90 2HB GLU 90 -7.938 13.839 7.643 601 HG2 GLU 90 1HG GLU 90 -10.173 14.676 7.755 602 HG3 GLU 90 2HG GLU 90 -10.157 13.235 6.741 603 H TYR 91 H TYR 91 -6.209 11.884 6.668 604 HA TYR 91 HA TYR 91 -7.536 11.551 4.153 605 HB2 TYR 91 1HB TYR 91 -4.663 11.807 4.973 606 HB3 TYR 91 2HB TYR 91 -5.084 11.335 3.329 607 HD1 TYR 91 HD1 TYR 91 -6.403 12.883 1.906 608 HD2 TYR 91 HD2 TYR 91 -4.902 14.064 5.697 609 HE1 TYR 91 HE1 TYR 91 -6.746 15.235 1.297 610 HE2 TYR 91 HE2 TYR 91 -5.241 16.426 5.106 611 HH TYR 91 HH TYR 91 -5.418 17.800 3.063 612 H GLU 92 H GLU 92 -5.755 9.435 6.337 613 HA GLU 92 HA GLU 92 -5.598 7.193 4.672 614 HB2 GLU 92 1HB GLU 92 -4.475 7.271 6.850 615 HB3 GLU 92 2HB GLU 92 -6.034 7.299 7.666 616 HG2 GLU 92 1HG GLU 92 -6.552 5.084 6.731 617 HG3 GLU 92 2HG GLU 92 -4.968 5.075 5.957 618 H LYS 93 H LYS 93 -8.121 8.354 6.823 619 HA LYS 93 HA LYS 93 -9.908 6.216 6.515 620 HB2 LYS 93 1HB LYS 93 -10.036 7.848 8.346 621 HB3 LYS 93 2HB LYS 93 -10.457 9.110 7.197 622 HG2 LYS 93 1HG LYS 93 -12.528 7.934 6.659 623 HG3 LYS 93 2HG LYS 93 -12.104 6.667 7.813 624 HD2 LYS 93 1HD LYS 93 -12.118 8.301 9.623 625 HD3 LYS 93 2HD LYS 93 -12.516 9.579 8.474 626 HE2 LYS 93 1HE LYS 93 -14.620 8.457 7.952 627 HE3 LYS 93 2HE LYS 93 -14.220 7.168 9.086 628 HZ1 LYS 93 1HZ LYS 93 -15.715 8.772 10.080 629 HZ2 LYS 93 2HZ LYS 93 -14.619 10.028 9.782 630 HZ3 LYS 93 3HZ LYS 93 -14.220 8.797 10.871 631 H LYS 94 H LYS 94 -9.229 9.006 4.552 632 HA LYS 94 HA LYS 94 -11.657 8.848 3.041 633 HB2 LYS 94 1HB LYS 94 -10.349 10.952 3.343 634 HB3 LYS 94 2HB LYS 94 -9.094 10.273 2.319 635 HG2 LYS 94 1HG LYS 94 -10.449 10.339 0.412 636 HG3 LYS 94 2HG LYS 94 -11.922 10.543 1.362 637 HD2 LYS 94 1HD LYS 94 -11.301 12.635 0.289 638 HD3 LYS 94 2HD LYS 94 -11.165 12.777 2.041 639 HE2 LYS 94 1HE LYS 94 -9.269 13.835 0.976 640 HE3 LYS 94 2HE LYS 94 -8.741 12.407 1.860 641 HZ1 LYS 94 1HZ LYS 94 -8.646 11.184 -0.201 642 HZ2 LYS 94 2HZ LYS 94 -7.709 12.582 -0.330 643 HZ3 LYS 94 3HZ LYS 94 -9.229 12.515 -1.066 644 H LEU 95 H LEU 95 -8.345 7.671 2.631 645 HA LEU 95 HA LEU 95 -8.887 6.479 0.065 646 HB2 LEU 95 1HB LEU 95 -6.656 5.931 2.033 647 HB3 LEU 95 2HB LEU 95 -6.715 5.354 0.379 648 HG LEU 95 HG LEU 95 -6.548 8.251 1.209 649 HD11 LEU 95 1HD1 LEU 95 -4.467 6.421 0.030 650 HD12 LEU 95 2HD1 LEU 95 -4.488 7.053 1.677 651 HD13 LEU 95 3HD1 LEU 95 -4.278 8.150 0.314 652 HD21 LEU 95 1HD2 LEU 95 -6.458 6.960 -1.515 653 HD22 LEU 95 2HD2 LEU 95 -6.134 8.662 -1.179 654 HD23 LEU 95 3HD2 LEU 95 -7.740 7.996 -0.887 655 H GLN 96 H GLN 96 -8.857 5.504 3.402 656 HA GLN 96 HA GLN 96 -9.383 2.744 3.077 657 HB2 GLN 96 1HB GLN 96 -8.523 3.951 5.133 658 HB3 GLN 96 2HB GLN 96 -10.147 4.560 5.376 659 HG2 GLN 96 1HG GLN 96 -10.956 2.290 5.693 660 HG3 GLN 96 2HG GLN 96 -9.329 1.660 5.439 661 HE21 GLN 96 1HE2 GLN 96 -9.288 0.753 7.505 662 HE22 GLN 96 2HE2 GLN 96 -9.092 1.714 8.925 663 H LYS 97 H LYS 97 -11.253 5.595 2.815 664 HA LYS 97 HA LYS 97 -13.842 4.358 3.021 665 HB2 LYS 97 1HB LYS 97 -13.449 6.738 3.557 666 HB3 LYS 97 2HB LYS 97 -13.042 7.038 1.874 667 HG2 LYS 97 1HG LYS 97 -15.329 6.338 1.245 668 HG3 LYS 97 2HG LYS 97 -15.712 6.182 2.961 669 HD2 LYS 97 1HD LYS 97 -15.086 8.570 3.257 670 HD3 LYS 97 2HD LYS 97 -14.883 8.691 1.508 671 HE2 LYS 97 1HE LYS 97 -17.067 9.517 2.164 672 HE3 LYS 97 2HE LYS 97 -17.228 8.048 1.204 673 HZ1 LYS 97 1HZ LYS 97 -17.527 6.799 3.262 674 HZ2 LYS 97 2HZ LYS 97 -18.705 7.996 3.097 675 HZ3 LYS 97 3HZ LYS 97 -17.413 8.226 4.162 676 H TYR 98 H TYR 98 -11.670 5.318 0.393 677 HA TYR 98 HA TYR 98 -13.512 5.022 -1.719 678 HB2 TYR 98 1HB TYR 98 -10.496 4.809 -1.739 679 HB3 TYR 98 2HB TYR 98 -11.495 4.866 -3.185 680 HD1 TYR 98 HD1 TYR 98 -13.474 6.960 -1.914 681 HD2 TYR 98 HD2 TYR 98 -9.243 6.778 -2.348 682 HE1 TYR 98 HE1 TYR 98 -13.371 9.413 -1.895 683 HE2 TYR 98 HE2 TYR 98 -9.134 9.234 -2.329 684 HH TYR 98 HH TYR 98 -10.650 11.155 -2.843 685 H ALA 99 H ALA 99 -11.091 2.784 -0.432 686 HA ALA 99 HA ALA 99 -12.367 0.607 -1.943 687 HB1 ALA 99 1HB ALA 99 -9.679 0.789 -0.581 688 HB2 ALA 99 2HB ALA 99 -9.995 0.720 -2.317 689 HB3 ALA 99 3HB ALA 99 -10.323 -0.685 -1.303 690 H ASP 100 H ASP 100 -13.111 -1.260 -0.821 691 HA ASP 100 HA ASP 100 -13.574 -0.784 2.026 692 HB2 ASP 100 1HB ASP 100 -14.606 -2.906 0.137 693 HB3 ASP 100 2HB ASP 100 -14.926 -2.918 1.865 694 H ALA 101 H ALA 101 -11.751 -1.098 2.983 695 HA ALA 101 HA ALA 101 -10.897 -3.696 3.644 696 HB1 ALA 101 1HB ALA 101 -9.820 -3.620 1.440 697 HB2 ALA 101 2HB ALA 101 -8.616 -3.596 2.729 698 HB3 ALA 101 3HB ALA 101 -9.024 -2.107 1.876 699 H GLU 102 H GLU 102 -8.792 -3.477 4.965 700 HA GLU 102 HA GLU 102 -8.926 -0.956 6.450 701 HB2 GLU 102 1HB GLU 102 -7.304 -3.378 7.197 702 HB3 GLU 102 2HB GLU 102 -7.873 -2.074 8.225 703 HG2 GLU 102 1HG GLU 102 -10.141 -2.861 8.058 704 HG3 GLU 102 2HG GLU 102 -9.652 -4.115 6.918 705 H VAL 103 H VAL 103 -7.787 0.364 4.978 706 HA VAL 103 HA VAL 103 -5.137 -0.493 4.181 707 HB VAL 103 HB VAL 103 -6.696 0.829 2.638 708 HG11 VAL 103 1HG1 VAL 103 -6.781 3.180 2.794 709 HG12 VAL 103 2HG1 VAL 103 -5.595 3.211 4.106 710 HG13 VAL 103 3HG1 VAL 103 -7.223 2.568 4.390 711 HG21 VAL 103 1HG2 VAL 103 -4.290 0.411 2.229 712 HG22 VAL 103 2HG2 VAL 103 -3.924 1.932 3.040 713 HG23 VAL 103 3HG2 VAL 103 -4.864 1.932 1.549 714 H ARG 104 H ARG 104 -3.279 0.248 4.939 715 HA ARG 104 HA ARG 104 -3.381 2.179 7.160 716 HB2 ARG 104 1HB ARG 104 -2.789 -0.166 7.802 717 HB3 ARG 104 2HB ARG 104 -1.406 -0.075 6.723 718 HG2 ARG 104 1HG ARG 104 -0.402 1.639 8.070 719 HG3 ARG 104 2HG ARG 104 -1.839 1.729 9.090 720 HD2 ARG 104 1HD ARG 104 -0.053 -0.680 8.773 721 HD3 ARG 104 2HD ARG 104 -0.055 0.423 10.149 722 HE ARG 104 HE ARG 104 -2.607 -0.376 10.100 723 HH11 ARG 104 1HH1 ARG 104 0.371 -2.217 9.918 724 HH12 ARG 104 2HH1 ARG 104 -0.315 -3.621 10.686 725 HH21 ARG 104 1HH2 ARG 104 -3.490 -2.228 11.108 726 HH22 ARG 104 2HH2 ARG 104 -2.480 -3.625 11.366 727 H VAL 105 H VAL 105 -2.818 4.068 6.178 728 HA VAL 105 HA VAL 105 -0.964 4.031 3.983 729 HB VAL 105 HB VAL 105 -1.256 6.422 3.813 730 HG11 VAL 105 1HG1 VAL 105 -3.718 6.509 3.505 731 HG12 VAL 105 2HG1 VAL 105 -3.827 4.933 4.288 732 HG13 VAL 105 3HG1 VAL 105 -2.947 5.104 2.770 733 HG21 VAL 105 1HG2 VAL 105 -2.750 7.648 5.353 734 HG22 VAL 105 2HG2 VAL 105 -1.277 7.071 6.131 735 HG23 VAL 105 3HG2 VAL 105 -2.801 6.223 6.393 736 H ARG 106 H ARG 106 1.195 4.389 4.082 737 HA ARG 106 HA ARG 106 2.289 5.468 6.595 738 HB2 ARG 106 1HB ARG 106 3.206 3.021 5.093 739 HB3 ARG 106 2HB ARG 106 4.224 3.847 6.259 740 HG2 ARG 106 1HG ARG 106 1.516 2.704 6.908 741 HG3 ARG 106 2HG ARG 106 3.033 1.831 7.122 742 HD2 ARG 106 1HD ARG 106 2.560 2.721 9.237 743 HD3 ARG 106 2HD ARG 106 3.771 3.807 8.562 744 HE ARG 106 HE ARG 106 1.112 4.711 8.033 745 HH11 ARG 106 1HH1 ARG 106 3.597 4.596 10.499 746 HH12 ARG 106 2HH1 ARG 106 3.001 5.983 11.348 747 HH21 ARG 106 1HH2 ARG 106 0.315 6.528 9.159 748 HH22 ARG 106 2HH2 ARG 106 1.127 7.078 10.593 749 H THR 107 H THR 107 3.935 6.891 6.368 750 HA THR 107 HA THR 107 4.653 7.578 3.609 751 HB THR 107 HB THR 107 3.575 9.358 4.994 752 HG1 THR 107 HG1 THR 107 4.767 10.839 4.036 753 HG21 THR 107 1HG2 THR 107 4.927 10.487 6.716 754 HG22 THR 107 2HG2 THR 107 6.124 9.197 6.597 755 HG23 THR 107 3HG2 THR 107 4.496 8.839 7.169 756 H VAL 108 H VAL 108 6.765 7.631 2.966 757 HA VAL 108 HA VAL 108 8.788 6.809 4.939 758 HB VAL 108 HB VAL 108 9.824 5.338 3.238 759 HG11 VAL 108 1HG1 VAL 108 8.219 3.503 3.404 760 HG12 VAL 108 2HG1 VAL 108 6.958 4.645 3.871 761 HG13 VAL 108 3HG1 VAL 108 8.347 4.384 4.927 762 HG21 VAL 108 1HG2 VAL 108 8.518 4.665 1.263 763 HG22 VAL 108 2HG2 VAL 108 8.952 6.374 1.220 764 HG23 VAL 108 3HG2 VAL 108 7.312 5.891 1.656 765 H THR 109 H THR 109 11.033 7.158 4.137 766 HA THR 109 HA THR 109 11.235 9.228 2.062 767 HB THR 109 HB THR 109 13.059 10.274 3.564 768 HG1 THR 109 HG1 THR 109 12.320 8.311 5.157 769 HG21 THR 109 1HG2 THR 109 10.965 11.403 3.014 770 HG22 THR 109 2HG2 THR 109 11.423 11.710 4.688 771 HG23 THR 109 3HG2 THR 109 10.150 10.546 4.323 772 H SER 110 H SER 110 12.301 6.289 3.281 773 HA SER 110 HA SER 110 14.537 6.273 1.433 774 HB2 SER 110 1HB SER 110 14.935 5.689 4.378 775 HB3 SER 110 2HB SER 110 16.147 5.478 3.116 776 HG SER 110 HG SER 110 15.179 7.946 2.924 777 HA PRO 111 HA PRO 111 13.405 2.195 0.230 778 HB2 PRO 111 1HB PRO 111 16.236 1.605 1.005 779 HB3 PRO 111 2HB PRO 111 15.335 1.086 -0.426 780 HG2 PRO 111 1HG PRO 111 17.038 3.151 -0.523 781 HG3 PRO 111 2HG PRO 111 15.537 3.136 -1.463 782 HD2 PRO 111 1HD PRO 111 16.258 4.769 0.875 783 HD3 PRO 111 2HD PRO 111 14.990 5.030 -0.339 784 H ASP 112 H ASP 112 15.558 2.145 3.084 785 HA ASP 112 HA ASP 112 14.816 -0.409 3.956 786 HB2 ASP 112 1HB ASP 112 16.022 1.935 5.413 787 HB3 ASP 112 2HB ASP 112 15.698 0.408 6.222 788 H GLU 113 H GLU 113 13.312 2.696 4.553 789 HA GLU 113 HA GLU 113 11.696 1.864 6.726 790 HB2 GLU 113 1HB GLU 113 11.218 4.053 4.699 791 HB3 GLU 113 2HB GLU 113 10.332 3.852 6.204 792 HG2 GLU 113 1HG GLU 113 12.411 4.198 7.457 793 HG3 GLU 113 2HG GLU 113 13.270 4.442 5.935 794 H ALA 114 H ALA 114 11.253 1.874 3.231 795 HA ALA 114 HA ALA 114 8.533 1.211 3.148 796 HB1 ALA 114 1HB ALA 114 10.691 0.496 1.164 797 HB2 ALA 114 2HB ALA 114 9.780 2.006 1.200 798 HB3 ALA 114 3HB ALA 114 8.954 0.485 0.856 799 H LYS 115 H LYS 115 11.399 -0.902 2.983 800 HA LYS 115 HA LYS 115 9.859 -3.284 2.958 801 HB2 LYS 115 1HB LYS 115 12.038 -4.425 3.434 802 HB3 LYS 115 2HB LYS 115 12.027 -3.402 2.012 803 HG2 LYS 115 1HG LYS 115 13.206 -1.663 3.238 804 HG3 LYS 115 2HG LYS 115 13.221 -2.693 4.676 805 HD2 LYS 115 1HD LYS 115 14.598 -4.308 3.612 806 HD3 LYS 115 2HD LYS 115 14.372 -3.560 2.031 807 HE2 LYS 115 1HE LYS 115 15.619 -1.606 2.763 808 HE3 LYS 115 2HE LYS 115 15.815 -2.313 4.367 809 HZ1 LYS 115 1HZ LYS 115 16.888 -3.420 1.825 810 HZ2 LYS 115 2HZ LYS 115 17.076 -4.120 3.360 811 HZ3 LYS 115 3HZ LYS 115 17.787 -2.625 3.021 812 H ARG 116 H ARG 116 11.144 -1.285 5.494 813 HA ARG 116 HA ARG 116 10.839 -3.033 7.671 814 HB2 ARG 116 1HB ARG 116 12.013 -0.930 7.912 815 HB3 ARG 116 2HB ARG 116 10.567 -0.027 7.491 816 HG2 ARG 116 1HG ARG 116 10.903 0.127 9.846 817 HG3 ARG 116 2HG ARG 116 9.490 -0.885 9.552 818 HD2 ARG 116 1HD ARG 116 10.814 -2.884 9.928 819 HD3 ARG 116 2HD ARG 116 12.264 -1.904 10.134 820 HE ARG 116 HE ARG 116 10.578 -0.920 12.010 821 HH11 ARG 116 1HH1 ARG 116 11.718 -4.146 11.264 822 HH12 ARG 116 2HH1 ARG 116 11.613 -4.696 12.904 823 HH21 ARG 116 1HH2 ARG 116 10.433 -1.643 14.167 824 HH22 ARG 116 2HH2 ARG 116 10.873 -3.276 14.555 825 H TRP 117 H TRP 117 8.562 -0.719 6.207 826 HA TRP 117 HA TRP 117 6.462 -1.259 8.025 827 HB2 TRP 117 1HB TRP 117 6.465 0.000 5.288 828 HB3 TRP 117 2HB TRP 117 5.012 -0.150 6.272 829 HD1 TRP 117 HD1 TRP 117 7.493 2.318 5.484 830 HE1 TRP 117 HE1 TRP 117 7.712 4.100 7.328 831 HE3 TRP 117 HE3 TRP 117 5.047 -0.116 9.252 832 HZ2 TRP 117 HZ2 TRP 117 6.941 4.428 10.025 833 HZ3 TRP 117 HZ3 TRP 117 4.833 0.997 11.432 834 HH2 TRP 117 HH2 TRP 117 5.760 3.225 11.809 835 H ILE 118 H ILE 118 7.372 -2.693 4.954 836 HA ILE 118 HA ILE 118 5.019 -4.155 4.495 837 HB ILE 118 HB ILE 118 7.868 -4.803 3.735 838 HG12 ILE 118 1HG1 ILE 118 5.584 -3.593 2.161 839 HG13 ILE 118 2HG1 ILE 118 6.944 -2.697 2.830 840 HG21 ILE 118 1HG2 ILE 118 6.906 -6.332 2.070 841 HG22 ILE 118 2HG2 ILE 118 5.301 -6.045 2.743 842 HG23 ILE 118 3HG2 ILE 118 6.535 -6.842 3.718 843 HD11 ILE 118 1HD1 ILE 118 7.105 -4.835 0.725 844 HD12 ILE 118 2HD1 ILE 118 8.466 -3.936 1.392 845 HD13 ILE 118 3HD1 ILE 118 7.227 -3.096 0.459 846 H LYS 119 H LYS 119 7.931 -4.936 6.338 847 HA LYS 119 HA LYS 119 7.118 -7.525 7.143 848 HB2 LYS 119 1HB LYS 119 9.055 -5.541 8.334 849 HB3 LYS 119 2HB LYS 119 8.821 -7.159 8.982 850 HG2 LYS 119 1HG LYS 119 9.654 -6.604 6.147 851 HG3 LYS 119 2HG LYS 119 10.784 -6.907 7.469 852 HD2 LYS 119 1HD LYS 119 9.734 -9.087 7.856 853 HD3 LYS 119 2HD LYS 119 8.622 -8.784 6.523 854 HE2 LYS 119 1HE LYS 119 10.454 -8.732 4.954 855 HE3 LYS 119 2HE LYS 119 11.620 -8.890 6.266 856 HZ1 LYS 119 1HZ LYS 119 11.270 -11.004 5.185 857 HZ2 LYS 119 2HZ LYS 119 9.605 -10.922 5.473 858 HZ3 LYS 119 3HZ LYS 119 10.681 -11.069 6.767 859 H GLU 120 H GLU 120 6.743 -4.324 8.563 860 HA GLU 120 HA GLU 120 5.585 -5.204 11.001 861 HB2 GLU 120 1HB GLU 120 6.718 -3.000 10.609 862 HB3 GLU 120 2HB GLU 120 5.320 -2.502 9.671 863 HG2 GLU 120 1HG GLU 120 5.224 -1.595 11.910 864 HG3 GLU 120 2HG GLU 120 3.905 -2.735 11.644 865 H PHE 121 H PHE 121 4.341 -4.691 7.833 866 HA PHE 121 HA PHE 121 1.581 -4.533 8.724 867 HB2 PHE 121 1HB PHE 121 2.234 -3.112 6.883 868 HB3 PHE 121 2HB PHE 121 2.835 -4.495 5.978 869 HD1 PHE 121 HD1 PHE 121 -0.301 -3.199 7.520 870 HD2 PHE 121 HD2 PHE 121 1.486 -5.463 4.387 871 HE1 PHE 121 HE1 PHE 121 -2.499 -3.437 6.441 872 HE2 PHE 121 HE2 PHE 121 -0.710 -5.706 3.307 873 HZ PHE 121 HZ PHE 121 -2.703 -4.692 4.332 874 H SER 122 H SER 122 3.621 -6.746 6.825 875 HA SER 122 HA SER 122 1.558 -8.473 6.057 876 HB2 SER 122 1HB SER 122 3.450 -10.117 5.631 877 HB3 SER 122 2HB SER 122 3.569 -8.561 4.812 878 HG SER 122 HG SER 122 5.119 -7.914 6.244 879 H GLU 123 H GLU 123 4.098 -9.258 8.474 880 HA GLU 123 HA GLU 123 2.335 -11.275 9.572 881 HB2 GLU 123 1HB GLU 123 4.189 -11.853 11.055 882 HB3 GLU 123 2HB GLU 123 4.719 -11.785 9.383 883 HG2 GLU 123 1HG GLU 123 5.783 -9.671 9.741 884 HG3 GLU 123 2HG GLU 123 5.116 -9.563 11.370 885 H GLU 124 H GLU 124 3.556 -8.120 10.395 886 HA GLU 124 HA GLU 124 3.081 -6.620 12.019 887 HB2 GLU 124 1HB GLU 124 0.870 -6.858 10.864 888 HB3 GLU 124 2HB GLU 124 0.399 -8.002 12.111 889 HG2 GLU 124 1HG GLU 124 0.706 -6.250 13.808 890 HG3 GLU 124 2HG GLU 124 1.111 -5.108 12.526 Start of MODEL 12 1 HA MET 21 HA MET 21 -7.990 -11.804 3.746 2 HB2 MET 21 1HB MET 21 -5.590 -11.315 5.492 3 HB3 MET 21 2HB MET 21 -7.020 -10.316 5.284 4 HG2 MET 21 1HG MET 21 -6.716 -12.837 6.866 5 HG3 MET 21 2HG MET 21 -7.192 -11.238 7.426 6 HE1 MET 21 1HE MET 21 -10.420 -13.368 8.052 7 HE2 MET 21 2HE MET 21 -9.218 -12.297 8.772 8 HE3 MET 21 3HE MET 21 -8.749 -13.905 8.219 9 H THR 22 H THR 22 -7.463 -11.139 1.752 10 HA THR 22 HA THR 22 -4.856 -11.595 0.658 11 HB THR 22 HB THR 22 -7.003 -9.819 -0.512 12 HG1 THR 22 HG1 THR 22 -6.937 -12.545 -0.106 13 HG21 THR 22 1HG2 THR 22 -4.806 -11.471 -1.775 14 HG22 THR 22 2HG2 THR 22 -4.808 -9.716 -1.605 15 HG23 THR 22 3HG2 THR 22 -5.996 -10.500 -2.644 16 H LEU 23 H LEU 23 -3.148 -10.256 0.588 17 HA LEU 23 HA LEU 23 -3.473 -7.678 1.955 18 HB2 LEU 23 1HB LEU 23 -1.011 -9.386 1.636 19 HB3 LEU 23 2HB LEU 23 -1.111 -7.895 2.555 20 HG LEU 23 HG LEU 23 -2.553 -10.473 3.188 21 HD11 LEU 23 1HD1 LEU 23 -0.303 -9.074 4.621 22 HD12 LEU 23 2HD1 LEU 23 -0.158 -10.548 3.662 23 HD13 LEU 23 3HD1 LEU 23 -1.118 -10.550 5.143 24 HD21 LEU 23 1HD2 LEU 23 -3.892 -8.533 3.797 25 HD22 LEU 23 2HD2 LEU 23 -2.519 -7.853 4.671 26 HD23 LEU 23 3HD2 LEU 23 -3.265 -9.348 5.229 27 H PHE 24 H PHE 24 -3.192 -5.892 0.861 28 HA PHE 24 HA PHE 24 -1.828 -6.023 -1.752 29 HB2 PHE 24 1HB PHE 24 -3.955 -4.055 -0.888 30 HB3 PHE 24 2HB PHE 24 -3.262 -4.217 -2.495 31 HD1 PHE 24 HD1 PHE 24 -5.555 -5.675 -0.045 32 HD2 PHE 24 HD2 PHE 24 -3.968 -5.964 -3.982 33 HE1 PHE 24 HE1 PHE 24 -7.346 -7.245 -0.646 34 HE2 PHE 24 HE2 PHE 24 -5.753 -7.535 -4.586 35 HZ PHE 24 HZ PHE 24 -7.447 -8.178 -2.924 36 H VAL 25 H VAL 25 -0.479 -4.270 -2.325 37 HA VAL 25 HA VAL 25 -0.044 -2.222 -0.312 38 HB VAL 25 HB VAL 25 1.573 -3.815 0.412 39 HG11 VAL 25 1HG1 VAL 25 2.620 -3.936 -2.408 40 HG12 VAL 25 2HG1 VAL 25 1.663 -5.187 -1.617 41 HG13 VAL 25 3HG1 VAL 25 3.271 -4.791 -1.010 42 HG21 VAL 25 1HG2 VAL 25 2.927 -1.680 -1.231 43 HG22 VAL 25 2HG2 VAL 25 3.683 -2.602 0.069 44 HG23 VAL 25 3HG2 VAL 25 2.338 -1.517 0.425 45 H LEU 26 H LEU 26 -0.062 -0.357 -1.246 46 HA LEU 26 HA LEU 26 0.665 -0.126 -4.087 47 HB2 LEU 26 1HB LEU 26 -0.984 1.682 -2.306 48 HB3 LEU 26 2HB LEU 26 -0.501 2.098 -3.933 49 HG LEU 26 HG LEU 26 -1.810 0.164 -4.787 50 HD11 LEU 26 1HD1 LEU 26 -2.798 -0.039 -1.952 51 HD12 LEU 26 2HD1 LEU 26 -1.819 -1.238 -2.799 52 HD13 LEU 26 3HD1 LEU 26 -3.460 -0.893 -3.347 53 HD21 LEU 26 1HD2 LEU 26 -3.997 1.194 -4.430 54 HD22 LEU 26 2HD2 LEU 26 -2.749 2.389 -4.779 55 HD23 LEU 26 3HD2 LEU 26 -3.317 2.165 -3.126 56 H ILE 27 H ILE 27 1.887 1.870 -4.674 57 HA ILE 27 HA ILE 27 3.393 3.049 -2.494 58 HB ILE 27 HB ILE 27 4.696 1.079 -2.850 59 HG12 ILE 27 1HG1 ILE 27 6.042 3.384 -4.279 60 HG13 ILE 27 2HG1 ILE 27 5.934 3.202 -2.531 61 HG21 ILE 27 1HG2 ILE 27 4.757 1.792 -5.779 62 HG22 ILE 27 2HG2 ILE 27 3.849 0.466 -5.051 63 HG23 ILE 27 3HG2 ILE 27 5.615 0.448 -5.024 64 HD11 ILE 27 1HD1 ILE 27 7.360 1.335 -4.413 65 HD12 ILE 27 2HD1 ILE 27 7.262 1.162 -2.661 66 HD13 ILE 27 3HD1 ILE 27 8.115 2.534 -3.365 67 H LEU 28 H LEU 28 3.380 5.188 -2.908 68 HA LEU 28 HA LEU 28 3.951 6.028 -5.682 69 HB2 LEU 28 1HB LEU 28 2.534 7.307 -3.423 70 HB3 LEU 28 2HB LEU 28 3.573 8.364 -4.350 71 HG LEU 28 HG LEU 28 2.233 7.311 -6.382 72 HD11 LEU 28 1HD1 LEU 28 0.935 5.772 -4.996 73 HD12 LEU 28 2HD1 LEU 28 -0.094 6.949 -5.818 74 HD13 LEU 28 3HD1 LEU 28 0.273 7.147 -4.107 75 HD21 LEU 28 1HD2 LEU 28 0.703 9.227 -6.242 76 HD22 LEU 28 2HD2 LEU 28 2.368 9.676 -5.868 77 HD23 LEU 28 3HD2 LEU 28 1.194 9.481 -4.566 78 H SER 29 H SER 29 6.146 5.294 -5.360 79 HA SER 29 HA SER 29 7.742 7.577 -4.553 80 HB2 SER 29 1HB SER 29 7.852 6.081 -2.573 81 HB3 SER 29 2HB SER 29 8.393 4.766 -3.614 82 HG SER 29 HG SER 29 9.762 7.103 -2.827 83 H ASN 30 H ASN 30 9.486 7.884 -6.009 84 HA ASN 30 HA ASN 30 10.219 5.450 -7.482 85 HB2 ASN 30 1HB ASN 30 10.979 7.023 -9.359 86 HB3 ASN 30 2HB ASN 30 9.251 6.757 -9.183 87 HD21 ASN 30 1HD2 ASN 30 7.947 8.421 -8.475 88 HD22 ASN 30 2HD2 ASN 30 8.478 10.066 -8.429 89 H ASP 31 H ASP 31 11.640 5.143 -5.729 90 HA ASP 31 HA ASP 31 14.234 6.318 -6.441 91 HB2 ASP 31 1HB ASP 31 13.726 6.757 -4.084 92 HB3 ASP 31 2HB ASP 31 13.403 5.053 -3.821 93 H LYS 32 H LYS 32 15.765 4.852 -7.171 94 HA LYS 32 HA LYS 32 14.694 2.456 -8.233 95 HB2 LYS 32 1HB LYS 32 17.439 3.649 -8.201 96 HB3 LYS 32 2HB LYS 32 17.201 2.006 -8.774 97 HG2 LYS 32 1HG LYS 32 17.141 3.338 -10.696 98 HG3 LYS 32 2HG LYS 32 15.456 2.961 -10.349 99 HD2 LYS 32 1HD LYS 32 15.438 5.239 -10.870 100 HD3 LYS 32 2HD LYS 32 15.410 5.205 -9.107 101 HE2 LYS 32 1HE LYS 32 17.807 5.614 -9.045 102 HE3 LYS 32 2HE LYS 32 17.873 5.587 -10.805 103 HZ1 LYS 32 1HZ LYS 32 16.503 7.584 -9.093 104 HZ2 LYS 32 2HZ LYS 32 16.320 7.511 -10.770 105 HZ3 LYS 32 3HZ LYS 32 17.835 7.840 -10.100 106 H LYS 33 H LYS 33 16.507 3.131 -5.326 107 HA LYS 33 HA LYS 33 17.131 0.354 -4.838 108 HB2 LYS 33 1HB LYS 33 18.634 2.127 -4.043 109 HB3 LYS 33 2HB LYS 33 17.348 2.774 -3.036 110 HG2 LYS 33 1HG LYS 33 18.900 1.504 -1.696 111 HG3 LYS 33 2HG LYS 33 17.334 0.691 -1.737 112 HD2 LYS 33 1HD LYS 33 18.178 -0.833 -3.462 113 HD3 LYS 33 2HD LYS 33 19.744 -0.021 -3.408 114 HE2 LYS 33 1HE LYS 33 20.012 -0.669 -1.075 115 HE3 LYS 33 2HE LYS 33 18.429 -1.445 -1.097 116 HZ1 LYS 33 1HZ LYS 33 20.810 -2.246 -2.677 117 HZ2 LYS 33 2HZ LYS 33 19.279 -2.946 -2.828 118 HZ3 LYS 33 3HZ LYS 33 20.130 -3.089 -1.375 119 H LEU 34 H LEU 34 14.974 2.791 -3.423 120 HA LEU 34 HA LEU 34 13.758 1.185 -1.496 121 HB2 LEU 34 1HB LEU 34 13.424 3.503 -1.344 122 HB3 LEU 34 2HB LEU 34 12.857 3.612 -2.992 123 HG LEU 34 HG LEU 34 10.739 2.635 -2.405 124 HD11 LEU 34 1HD1 LEU 34 11.709 1.116 -0.621 125 HD12 LEU 34 2HD1 LEU 34 10.139 1.848 -0.295 126 HD13 LEU 34 3HD1 LEU 34 11.585 2.504 0.461 127 HD21 LEU 34 1HD2 LEU 34 10.988 5.027 -2.084 128 HD22 LEU 34 2HD2 LEU 34 11.557 4.757 -0.436 129 HD23 LEU 34 3HD2 LEU 34 9.899 4.344 -0.877 130 H ILE 35 H ILE 35 12.726 1.773 -4.868 131 HA ILE 35 HA ILE 35 10.348 0.313 -4.747 132 HB ILE 35 HB ILE 35 12.185 0.802 -7.090 133 HG12 ILE 35 1HG1 ILE 35 9.542 2.031 -6.268 134 HG13 ILE 35 2HG1 ILE 35 11.123 2.791 -6.114 135 HG21 ILE 35 1HG2 ILE 35 9.407 -0.377 -7.109 136 HG22 ILE 35 2HG2 ILE 35 10.898 -1.220 -7.526 137 HG23 ILE 35 3HG2 ILE 35 10.325 0.109 -8.534 138 HD11 ILE 35 1HD1 ILE 35 9.829 3.609 -8.040 139 HD12 ILE 35 2HD1 ILE 35 9.857 1.982 -8.720 140 HD13 ILE 35 3HD1 ILE 35 11.363 2.874 -8.506 141 H GLU 36 H GLU 36 13.659 -0.787 -5.426 142 HA GLU 36 HA GLU 36 12.932 -3.458 -6.017 143 HB2 GLU 36 1HB GLU 36 15.526 -2.310 -5.000 144 HB3 GLU 36 2HB GLU 36 15.318 -3.990 -5.467 145 HG2 GLU 36 1HG GLU 36 14.569 -3.119 -7.722 146 HG3 GLU 36 2HG GLU 36 15.183 -1.550 -7.197 147 H GLU 37 H GLU 37 14.219 -2.016 -3.003 148 HA GLU 37 HA GLU 37 14.138 -4.389 -1.514 149 HB2 GLU 37 1HB GLU 37 13.914 -1.538 -0.538 150 HB3 GLU 37 2HB GLU 37 14.206 -2.933 0.489 151 HG2 GLU 37 1HG GLU 37 16.254 -3.351 -0.984 152 HG3 GLU 37 2HG GLU 37 16.010 -1.700 -1.552 153 H ALA 38 H ALA 38 11.710 -1.873 -1.981 154 HA ALA 38 HA ALA 38 9.805 -2.861 -0.161 155 HB1 ALA 38 1HB ALA 38 9.339 -1.302 -2.703 156 HB2 ALA 38 2HB ALA 38 9.692 -0.610 -1.119 157 HB3 ALA 38 3HB ALA 38 8.191 -1.499 -1.378 158 H ARG 39 H ARG 39 10.278 -3.467 -3.638 159 HA ARG 39 HA ARG 39 8.032 -5.176 -3.883 160 HB2 ARG 39 1HB ARG 39 9.183 -4.090 -5.823 161 HB3 ARG 39 2HB ARG 39 10.511 -5.223 -5.604 162 HG2 ARG 39 1HG ARG 39 8.817 -7.090 -5.893 163 HG3 ARG 39 2HG ARG 39 7.674 -5.834 -6.387 164 HD2 ARG 39 1HD ARG 39 9.194 -5.149 -8.183 165 HD3 ARG 39 2HD ARG 39 10.320 -6.418 -7.705 166 HE ARG 39 HE ARG 39 8.146 -7.866 -8.162 167 HH11 ARG 39 1HH1 ARG 39 9.571 -5.270 -10.036 168 HH12 ARG 39 2HH1 ARG 39 8.970 -5.858 -11.553 169 HH21 ARG 39 1HH2 ARG 39 7.351 -8.634 -10.172 170 HH22 ARG 39 2HH2 ARG 39 7.704 -7.759 -11.628 171 H LYS 40 H LYS 40 11.477 -5.808 -3.281 172 HA LYS 40 HA LYS 40 11.425 -8.574 -3.522 173 HB2 LYS 40 1HB LYS 40 13.100 -6.833 -1.716 174 HB3 LYS 40 2HB LYS 40 13.374 -8.557 -1.932 175 HG2 LYS 40 1HG LYS 40 13.775 -8.203 -4.310 176 HG3 LYS 40 2HG LYS 40 13.482 -6.475 -4.108 177 HD2 LYS 40 1HD LYS 40 15.381 -6.357 -2.546 178 HD3 LYS 40 2HD LYS 40 15.688 -8.074 -2.809 179 HE2 LYS 40 1HE LYS 40 15.764 -5.929 -4.928 180 HE3 LYS 40 2HE LYS 40 17.172 -6.650 -4.152 181 HZ1 LYS 40 1HZ LYS 40 16.566 -8.781 -5.088 182 HZ2 LYS 40 2HZ LYS 40 16.707 -7.635 -6.321 183 HZ3 LYS 40 3HZ LYS 40 15.180 -8.120 -5.791 184 H MET 41 H MET 41 10.679 -6.582 -0.685 185 HA MET 41 HA MET 41 10.253 -8.698 1.117 186 HB2 MET 41 1HB MET 41 9.179 -5.891 0.995 187 HB3 MET 41 2HB MET 41 8.696 -7.004 2.266 188 HG2 MET 41 1HG MET 41 11.513 -6.135 1.672 189 HG3 MET 41 2HG MET 41 10.495 -5.530 2.977 190 HE1 MET 41 1HE MET 41 13.438 -6.706 3.445 191 HE2 MET 41 2HE MET 41 13.155 -7.661 4.901 192 HE3 MET 41 3HE MET 41 12.403 -6.075 4.725 193 H ALA 42 H ALA 42 7.906 -6.852 -0.816 194 HA ALA 42 HA ALA 42 5.677 -8.416 -0.034 195 HB1 ALA 42 1HB ALA 42 6.059 -6.563 -2.373 196 HB2 ALA 42 2HB ALA 42 5.377 -6.160 -0.797 197 HB3 ALA 42 3HB ALA 42 4.517 -7.255 -1.877 198 H GLU 43 H GLU 43 8.009 -8.695 -2.593 199 HA GLU 43 HA GLU 43 6.603 -10.373 -4.342 200 HB2 GLU 43 1HB GLU 43 8.830 -9.137 -4.707 201 HB3 GLU 43 2HB GLU 43 9.580 -10.515 -3.913 202 HG2 GLU 43 1HG GLU 43 9.707 -10.784 -6.295 203 HG3 GLU 43 2HG GLU 43 8.616 -11.995 -5.622 204 H LYS 44 H LYS 44 8.878 -11.070 -1.712 205 HA LYS 44 HA LYS 44 8.490 -13.912 -1.882 206 HB2 LYS 44 1HB LYS 44 9.968 -12.097 -0.009 207 HB3 LYS 44 2HB LYS 44 9.704 -13.775 0.426 208 HG2 LYS 44 1HG LYS 44 11.868 -13.580 -0.547 209 HG3 LYS 44 2HG LYS 44 10.833 -14.442 -1.682 210 HD2 LYS 44 1HD LYS 44 10.571 -12.460 -3.022 211 HD3 LYS 44 2HD LYS 44 11.444 -11.493 -1.832 212 HE2 LYS 44 1HE LYS 44 12.880 -12.042 -3.715 213 HE3 LYS 44 2HE LYS 44 13.462 -12.815 -2.241 214 HZ1 LYS 44 1HZ LYS 44 11.897 -14.122 -4.401 215 HZ2 LYS 44 2HZ LYS 44 12.396 -14.874 -2.971 216 HZ3 LYS 44 3HZ LYS 44 13.545 -14.341 -4.087 217 H ALA 45 H ALA 45 6.979 -11.291 -0.214 218 HA ALA 45 HA ALA 45 5.758 -12.967 1.796 219 HB1 ALA 45 1HB ALA 45 6.393 -10.706 2.389 220 HB2 ALA 45 2HB ALA 45 4.647 -10.909 2.535 221 HB3 ALA 45 3HB ALA 45 5.323 -10.062 1.144 222 H ASN 46 H ASN 46 5.204 -12.444 -1.380 223 HA ASN 46 HA ASN 46 3.554 -12.977 -2.824 224 HB2 ASN 46 1HB ASN 46 3.502 -15.003 -1.211 225 HB3 ASN 46 2HB ASN 46 2.028 -14.277 -0.581 226 HD21 ASN 46 1HD2 ASN 46 3.541 -15.758 -3.339 227 HD22 ASN 46 2HD2 ASN 46 2.085 -16.101 -4.211 228 H LEU 47 H LEU 47 3.462 -10.457 -1.690 229 HA LEU 47 HA LEU 47 0.630 -9.935 -1.152 230 HB2 LEU 47 1HB LEU 47 2.855 -7.914 -1.292 231 HB3 LEU 47 2HB LEU 47 1.279 -7.717 -0.565 232 HG LEU 47 HG LEU 47 3.536 -9.418 0.482 233 HD11 LEU 47 1HD1 LEU 47 2.234 -6.909 1.525 234 HD12 LEU 47 2HD1 LEU 47 3.839 -7.024 0.802 235 HD13 LEU 47 3HD1 LEU 47 3.503 -7.826 2.336 236 HD21 LEU 47 1HD2 LEU 47 0.816 -8.952 1.686 237 HD22 LEU 47 2HD2 LEU 47 2.121 -9.916 2.369 238 HD23 LEU 47 3HD2 LEU 47 1.318 -10.440 0.889 239 H ILE 48 H ILE 48 -0.337 -8.049 -2.337 240 HA ILE 48 HA ILE 48 0.463 -8.172 -5.154 241 HB ILE 48 HB ILE 48 -2.117 -7.175 -3.931 242 HG12 ILE 48 1HG1 ILE 48 -1.466 -9.706 -5.460 243 HG13 ILE 48 2HG1 ILE 48 -1.826 -9.603 -3.740 244 HG21 ILE 48 1HG2 ILE 48 -1.360 -7.558 -6.827 245 HG22 ILE 48 2HG2 ILE 48 -1.573 -6.009 -6.011 246 HG23 ILE 48 3HG2 ILE 48 -2.952 -7.089 -6.229 247 HD11 ILE 48 1HD1 ILE 48 -3.735 -10.416 -4.982 248 HD12 ILE 48 2HD1 ILE 48 -3.719 -8.968 -5.988 249 HD13 ILE 48 3HD1 ILE 48 -4.086 -8.843 -4.268 250 H LEU 49 H LEU 49 2.106 -6.744 -5.278 251 HA LEU 49 HA LEU 49 1.842 -4.068 -4.187 252 HB2 LEU 49 1HB LEU 49 3.998 -5.170 -4.004 253 HB3 LEU 49 2HB LEU 49 4.055 -5.417 -5.737 254 HG LEU 49 HG LEU 49 4.122 -2.920 -6.013 255 HD11 LEU 49 1HD1 LEU 49 4.556 -2.981 -3.033 256 HD12 LEU 49 2HD1 LEU 49 3.174 -2.276 -3.872 257 HD13 LEU 49 3HD1 LEU 49 4.780 -1.579 -4.078 258 HD21 LEU 49 1HD2 LEU 49 6.479 -2.725 -5.412 259 HD22 LEU 49 2HD2 LEU 49 6.132 -4.282 -6.164 260 HD23 LEU 49 3HD2 LEU 49 6.347 -4.173 -4.418 261 H ILE 50 H ILE 50 1.358 -2.289 -5.325 262 HA ILE 50 HA ILE 50 1.269 -2.514 -8.264 263 HB ILE 50 HB ILE 50 -0.688 -0.896 -6.622 264 HG12 ILE 50 1HG1 ILE 50 -1.167 -3.560 -7.992 265 HG13 ILE 50 2HG1 ILE 50 -0.980 -3.350 -6.255 266 HG21 ILE 50 1HG2 ILE 50 -0.304 -0.057 -8.871 267 HG22 ILE 50 2HG2 ILE 50 -1.919 -0.754 -8.745 268 HG23 ILE 50 3HG2 ILE 50 -0.629 -1.655 -9.541 269 HD11 ILE 50 1HD1 ILE 50 -2.983 -1.973 -6.197 270 HD12 ILE 50 2HD1 ILE 50 -3.316 -3.558 -6.896 271 HD13 ILE 50 3HD1 ILE 50 -3.162 -2.147 -7.942 272 H THR 51 H THR 51 2.968 -1.350 -8.902 273 HA THR 51 HA THR 51 3.945 0.931 -7.497 274 HB THR 51 HB THR 51 5.373 1.224 -9.563 275 HG1 THR 51 HG1 THR 51 4.170 0.260 -11.151 276 HG21 THR 51 1HG2 THR 51 5.383 -1.493 -8.248 277 HG22 THR 51 2HG2 THR 51 6.154 -0.037 -7.619 278 HG23 THR 51 3HG2 THR 51 6.736 -0.765 -9.116 279 H VAL 52 H VAL 52 3.247 2.965 -7.610 280 HA VAL 52 HA VAL 52 1.790 3.867 -9.992 281 HB VAL 52 HB VAL 52 0.724 3.971 -7.161 282 HG11 VAL 52 1HG1 VAL 52 -1.166 5.251 -8.068 283 HG12 VAL 52 2HG1 VAL 52 -0.337 5.350 -9.621 284 HG13 VAL 52 3HG1 VAL 52 0.357 6.131 -8.199 285 HG21 VAL 52 1HG2 VAL 52 -1.214 2.821 -8.106 286 HG22 VAL 52 2HG2 VAL 52 0.266 1.889 -8.341 287 HG23 VAL 52 3HG2 VAL 52 -0.431 2.795 -9.686 288 H GLY 53 H GLY 53 2.256 5.979 -10.520 289 HA2 GLY 53 1HA GLY 53 3.083 7.699 -8.273 290 HA3 GLY 53 2HA GLY 53 3.903 7.790 -9.828 291 H ASP 54 H ASP 54 0.994 8.452 -8.073 292 HA ASP 54 HA ASP 54 0.474 10.907 -9.089 293 HB2 ASP 54 1HB ASP 54 0.134 9.827 -11.306 294 HB3 ASP 54 2HB ASP 54 -1.168 8.870 -10.615 295 H GLU 55 H GLU 55 -1.488 11.781 -8.223 296 HA GLU 55 HA GLU 55 -2.382 10.573 -5.851 297 HB2 GLU 55 1HB GLU 55 -3.130 12.952 -7.466 298 HB3 GLU 55 2HB GLU 55 -4.251 12.421 -6.220 299 HG2 GLU 55 1HG GLU 55 -1.356 12.790 -5.602 300 HG3 GLU 55 2HG GLU 55 -2.445 14.184 -5.652 301 H GLU 56 H GLU 56 -3.886 10.865 -9.041 302 HA GLU 56 HA GLU 56 -6.301 9.626 -8.054 303 HB2 GLU 56 1HB GLU 56 -5.507 10.657 -10.768 304 HB3 GLU 56 2HB GLU 56 -7.057 9.892 -10.437 305 HG2 GLU 56 1HG GLU 56 -7.577 11.602 -8.797 306 HG3 GLU 56 2HG GLU 56 -6.008 12.364 -9.070 307 H GLU 57 H GLU 57 -3.481 8.715 -9.939 308 HA GLU 57 HA GLU 57 -4.479 6.213 -10.798 309 HB2 GLU 57 1HB GLU 57 -1.644 7.077 -10.243 310 HB3 GLU 57 2HB GLU 57 -2.076 5.526 -10.945 311 HG2 GLU 57 1HG GLU 57 -3.247 6.827 -12.765 312 HG3 GLU 57 2HG GLU 57 -2.438 8.257 -12.127 313 H LEU 58 H LEU 58 -3.118 7.332 -7.780 314 HA LEU 58 HA LEU 58 -2.811 4.884 -6.464 315 HB2 LEU 58 1HB LEU 58 -2.133 7.057 -5.504 316 HB3 LEU 58 2HB LEU 58 -3.819 7.504 -5.335 317 HG LEU 58 HG LEU 58 -4.113 5.594 -3.754 318 HD11 LEU 58 1HD1 LEU 58 -2.163 4.526 -2.804 319 HD12 LEU 58 2HD1 LEU 58 -1.107 5.441 -3.880 320 HD13 LEU 58 3HD1 LEU 58 -2.217 4.244 -4.543 321 HD21 LEU 58 1HD2 LEU 58 -3.776 7.844 -2.916 322 HD22 LEU 58 2HD2 LEU 58 -2.027 7.643 -3.021 323 HD23 LEU 58 3HD2 LEU 58 -2.960 6.675 -1.878 324 H LYS 59 H LYS 59 -5.640 6.946 -6.906 325 HA LYS 59 HA LYS 59 -7.477 5.409 -5.464 326 HB2 LYS 59 1HB LYS 59 -7.993 7.199 -7.827 327 HB3 LYS 59 2HB LYS 59 -9.204 6.642 -6.680 328 HG2 LYS 59 1HG LYS 59 -8.171 7.889 -4.903 329 HG3 LYS 59 2HG LYS 59 -6.829 8.345 -5.952 330 HD2 LYS 59 1HD LYS 59 -8.380 10.191 -5.758 331 HD3 LYS 59 2HD LYS 59 -8.415 9.557 -7.404 332 HE2 LYS 59 1HE LYS 59 -10.445 8.290 -6.859 333 HE3 LYS 59 2HE LYS 59 -10.411 8.952 -5.225 334 HZ1 LYS 59 1HZ LYS 59 -10.755 10.487 -7.741 335 HZ2 LYS 59 2HZ LYS 59 -10.617 11.179 -6.205 336 HZ3 LYS 59 3HZ LYS 59 -11.938 10.192 -6.570 337 H LYS 60 H LYS 60 -6.125 4.997 -8.561 338 HA LYS 60 HA LYS 60 -8.207 3.259 -9.547 339 HB2 LYS 60 1HB LYS 60 -5.466 3.743 -10.704 340 HB3 LYS 60 2HB LYS 60 -6.910 3.187 -11.549 341 HG2 LYS 60 1HG LYS 60 -6.769 5.845 -10.166 342 HG3 LYS 60 2HG LYS 60 -6.280 5.623 -11.863 343 HD2 LYS 60 1HD LYS 60 -8.557 4.670 -12.283 344 HD3 LYS 60 2HD LYS 60 -9.000 5.144 -10.644 345 HE2 LYS 60 1HE LYS 60 -9.763 6.841 -12.149 346 HE3 LYS 60 2HE LYS 60 -8.399 7.486 -11.237 347 HZ1 LYS 60 1HZ LYS 60 -6.964 7.012 -13.126 348 HZ2 LYS 60 2HZ LYS 60 -8.223 8.044 -13.573 349 HZ3 LYS 60 3HZ LYS 60 -8.278 6.409 -14.002 350 H ALA 61 H ALA 61 -4.908 2.970 -8.309 351 HA ALA 61 HA ALA 61 -4.746 0.148 -8.549 352 HB1 ALA 61 1HB ALA 61 -3.313 2.043 -6.684 353 HB2 ALA 61 2HB ALA 61 -2.752 1.506 -8.267 354 HB3 ALA 61 3HB ALA 61 -2.883 0.352 -6.940 355 H ILE 62 H ILE 62 -5.878 2.365 -6.074 356 HA ILE 62 HA ILE 62 -6.497 0.516 -4.061 357 HB ILE 62 HB ILE 62 -7.732 3.179 -4.767 358 HG12 ILE 62 1HG1 ILE 62 -5.887 2.375 -2.510 359 HG13 ILE 62 2HG1 ILE 62 -5.364 3.146 -4.004 360 HG21 ILE 62 1HG2 ILE 62 -9.404 1.882 -3.590 361 HG22 ILE 62 2HG2 ILE 62 -8.774 3.158 -2.547 362 HG23 ILE 62 3HG2 ILE 62 -8.240 1.493 -2.323 363 HD11 ILE 62 1HD1 ILE 62 -7.257 4.343 -1.997 364 HD12 ILE 62 2HD1 ILE 62 -6.660 5.116 -3.466 365 HD13 ILE 62 3HD1 ILE 62 -5.544 4.727 -2.158 366 H LYS 63 H LYS 63 -8.533 1.835 -6.677 367 HA LYS 63 HA LYS 63 -10.821 0.308 -6.100 368 HB2 LYS 63 1HB LYS 63 -10.782 2.302 -7.588 369 HB3 LYS 63 2HB LYS 63 -9.934 1.351 -8.799 370 HG2 LYS 63 1HG LYS 63 -11.872 -0.183 -8.893 371 HG3 LYS 63 2HG LYS 63 -12.720 0.869 -7.761 372 HD2 LYS 63 1HD LYS 63 -11.685 1.714 -10.468 373 HD3 LYS 63 2HD LYS 63 -13.355 1.270 -10.119 374 HE2 LYS 63 1HE LYS 63 -11.842 3.555 -8.854 375 HE3 LYS 63 2HE LYS 63 -13.025 3.705 -10.150 376 HZ1 LYS 63 1HZ LYS 63 -13.554 2.724 -7.400 377 HZ2 LYS 63 2HZ LYS 63 -14.698 2.768 -8.643 378 HZ3 LYS 63 3HZ LYS 63 -14.040 4.205 -8.048 379 H LYS 64 H LYS 64 -7.962 -0.370 -8.023 380 HA LYS 64 HA LYS 64 -8.859 -2.783 -9.194 381 HB2 LYS 64 1HB LYS 64 -6.906 -1.541 -10.023 382 HB3 LYS 64 2HB LYS 64 -6.047 -1.887 -8.529 383 HG2 LYS 64 1HG LYS 64 -6.104 -4.274 -9.044 384 HG3 LYS 64 2HG LYS 64 -6.966 -3.926 -10.543 385 HD2 LYS 64 1HD LYS 64 -5.061 -2.586 -11.316 386 HD3 LYS 64 2HD LYS 64 -4.200 -2.961 -9.823 387 HE2 LYS 64 1HE LYS 64 -3.428 -4.406 -11.604 388 HE3 LYS 64 2HE LYS 64 -4.291 -5.350 -10.393 389 HZ1 LYS 64 1HZ LYS 64 -5.469 -4.406 -12.949 390 HZ2 LYS 64 2HZ LYS 64 -6.212 -5.412 -11.810 391 HZ3 LYS 64 3HZ LYS 64 -4.874 -5.964 -12.676 392 H ALA 65 H ALA 65 -6.900 -2.134 -6.295 393 HA ALA 65 HA ALA 65 -6.628 -4.790 -5.435 394 HB1 ALA 65 1HB ALA 65 -6.735 -2.278 -3.764 395 HB2 ALA 65 2HB ALA 65 -5.296 -2.940 -4.540 396 HB3 ALA 65 3HB ALA 65 -6.094 -3.838 -3.249 397 H ASP 66 H ASP 66 -9.080 -2.354 -4.776 398 HA ASP 66 HA ASP 66 -10.667 -3.760 -2.961 399 HB2 ASP 66 1HB ASP 66 -10.929 -1.361 -3.462 400 HB3 ASP 66 2HB ASP 66 -11.511 -1.759 -5.073 401 H ASP 67 H ASP 67 -10.529 -3.847 -6.468 402 HA ASP 67 HA ASP 67 -12.829 -5.477 -6.848 403 HB2 ASP 67 1HB ASP 67 -11.926 -4.115 -8.669 404 HB3 ASP 67 2HB ASP 67 -10.426 -5.035 -8.635 405 H ILE 68 H ILE 68 -9.351 -6.140 -6.728 406 HA ILE 68 HA ILE 68 -9.403 -8.867 -7.297 407 HB ILE 68 HB ILE 68 -7.495 -7.424 -5.446 408 HG12 ILE 68 1HG1 ILE 68 -7.239 -7.967 -8.412 409 HG13 ILE 68 2HG1 ILE 68 -7.672 -6.410 -7.715 410 HG21 ILE 68 1HG2 ILE 68 -5.922 -9.212 -5.989 411 HG22 ILE 68 2HG2 ILE 68 -7.151 -10.001 -6.974 412 HG23 ILE 68 3HG2 ILE 68 -7.379 -9.856 -5.231 413 HD11 ILE 68 1HD1 ILE 68 -5.071 -7.869 -7.306 414 HD12 ILE 68 2HD1 ILE 68 -5.500 -6.312 -6.599 415 HD13 ILE 68 3HD1 ILE 68 -5.330 -6.469 -8.347 416 H ALA 69 H ALA 69 -9.662 -7.182 -4.200 417 HA ALA 69 HA ALA 69 -9.631 -9.501 -2.582 418 HB1 ALA 69 1HB ALA 69 -9.087 -7.245 -1.763 419 HB2 ALA 69 2HB ALA 69 -10.317 -8.043 -0.783 420 HB3 ALA 69 3HB ALA 69 -10.782 -6.794 -1.937 421 H LYS 70 H LYS 70 -12.332 -7.401 -3.588 422 HA LYS 70 HA LYS 70 -14.269 -8.705 -2.056 423 HB2 LYS 70 1HB LYS 70 -14.445 -6.979 -4.489 424 HB3 LYS 70 2HB LYS 70 -15.885 -7.604 -3.699 425 HG2 LYS 70 1HG LYS 70 -15.298 -6.485 -1.648 426 HG3 LYS 70 2HG LYS 70 -13.780 -5.932 -2.352 427 HD2 LYS 70 1HD LYS 70 -14.954 -4.550 -3.929 428 HD3 LYS 70 2HD LYS 70 -16.508 -5.205 -3.402 429 HE2 LYS 70 1HE LYS 70 -16.348 -4.163 -1.298 430 HE3 LYS 70 2HE LYS 70 -14.636 -3.810 -1.520 431 HZ1 LYS 70 1HZ LYS 70 -16.822 -2.601 -3.114 432 HZ2 LYS 70 2HZ LYS 70 -15.174 -2.208 -3.191 433 HZ3 LYS 70 3HZ LYS 70 -16.067 -1.860 -1.792 434 H LYS 71 H LYS 71 -13.139 -9.467 -5.278 435 HA LYS 71 HA LYS 71 -15.299 -11.047 -6.069 436 HB2 LYS 71 1HB LYS 71 -12.365 -11.369 -6.717 437 HB3 LYS 71 2HB LYS 71 -13.661 -12.236 -7.528 438 HG2 LYS 71 1HG LYS 71 -14.609 -9.990 -8.165 439 HG3 LYS 71 2HG LYS 71 -13.107 -9.282 -7.574 440 HD2 LYS 71 1HD LYS 71 -13.339 -11.353 -9.758 441 HD3 LYS 71 2HD LYS 71 -13.065 -9.629 -10.003 442 HE2 LYS 71 1HE LYS 71 -10.942 -9.764 -8.857 443 HE3 LYS 71 2HE LYS 71 -11.225 -11.460 -8.468 444 HZ1 LYS 71 1HZ LYS 71 -11.219 -11.953 -10.841 445 HZ2 LYS 71 2HZ LYS 71 -9.759 -11.254 -10.356 446 HZ3 LYS 71 3HZ LYS 71 -10.901 -10.330 -11.193 447 H GLN 72 H GLN 72 -12.617 -11.703 -3.904 448 HA GLN 72 HA GLN 72 -13.808 -14.357 -3.434 449 HB2 GLN 72 1HB GLN 72 -11.450 -15.175 -2.977 450 HB3 GLN 72 2HB GLN 72 -11.888 -14.875 -4.650 451 HG2 GLN 72 1HG GLN 72 -10.698 -12.782 -4.637 452 HG3 GLN 72 2HG GLN 72 -10.356 -12.953 -2.917 453 HE21 GLN 72 1HE2 GLN 72 -9.635 -14.135 -6.113 454 HE22 GLN 72 2HE2 GLN 72 -8.169 -14.949 -5.691 455 H ASN 73 H ASN 73 -11.704 -11.880 -1.903 456 HA ASN 73 HA ASN 73 -12.049 -13.393 0.584 457 HB2 ASN 73 1HB ASN 73 -9.792 -13.464 -0.680 458 HB3 ASN 73 2HB ASN 73 -9.549 -11.863 0.008 459 HD21 ASN 73 1HD2 ASN 73 -9.913 -15.254 0.692 460 HD22 ASN 73 2HD2 ASN 73 -9.310 -15.196 2.311 461 H SER 74 H SER 74 -13.323 -10.727 -0.404 462 HA SER 74 HA SER 74 -12.162 -8.672 1.139 463 HB2 SER 74 1HB SER 74 -14.428 -7.534 0.736 464 HB3 SER 74 2HB SER 74 -13.421 -7.935 -0.655 465 HG SER 74 HG SER 74 -15.373 -9.739 0.297 466 H SER 75 H SER 75 -13.399 -11.257 2.575 467 HA SER 75 HA SER 75 -15.123 -10.272 4.553 468 HB2 SER 75 1HB SER 75 -14.123 -12.113 5.981 469 HB3 SER 75 2HB SER 75 -14.739 -12.646 4.419 470 HG SER 75 HG SER 75 -12.125 -12.508 5.362 471 H GLU 76 H GLU 76 -11.610 -10.343 4.311 472 HA GLU 76 HA GLU 76 -11.497 -7.822 5.709 473 HB2 GLU 76 1HB GLU 76 -11.202 -9.428 7.557 474 HB3 GLU 76 2HB GLU 76 -9.867 -10.177 6.687 475 HG2 GLU 76 1HG GLU 76 -8.694 -7.980 6.744 476 HG3 GLU 76 2HG GLU 76 -9.981 -7.381 7.788 477 H ALA 77 H ALA 77 -10.379 -6.596 4.393 478 HA ALA 77 HA ALA 77 -8.121 -7.794 2.940 479 HB1 ALA 77 1HB ALA 77 -8.498 -6.133 1.184 480 HB2 ALA 77 2HB ALA 77 -9.874 -5.491 2.079 481 HB3 ALA 77 3HB ALA 77 -9.930 -7.131 1.432 482 H LYS 78 H LYS 78 -6.218 -7.091 3.638 483 HA LYS 78 HA LYS 78 -6.103 -4.465 4.934 484 HB2 LYS 78 1HB LYS 78 -4.177 -6.785 5.012 485 HB3 LYS 78 2HB LYS 78 -3.831 -5.210 5.704 486 HG2 LYS 78 1HG LYS 78 -5.955 -5.558 7.086 487 HG3 LYS 78 2HG LYS 78 -5.838 -7.249 6.589 488 HD2 LYS 78 1HD LYS 78 -3.591 -7.382 7.520 489 HD3 LYS 78 2HD LYS 78 -3.663 -5.681 7.975 490 HE2 LYS 78 1HE LYS 78 -4.155 -6.784 9.956 491 HE3 LYS 78 2HE LYS 78 -5.742 -6.351 9.330 492 HZ1 LYS 78 1HZ LYS 78 -6.065 -8.577 8.554 493 HZ2 LYS 78 2HZ LYS 78 -5.581 -8.652 10.173 494 HZ3 LYS 78 3HZ LYS 78 -4.474 -9.005 8.949 495 H ILE 79 H ILE 79 -5.389 -2.843 3.778 496 HA ILE 79 HA ILE 79 -3.581 -3.413 1.527 497 HB ILE 79 HB ILE 79 -5.516 -1.100 1.790 498 HG12 ILE 79 1HG1 ILE 79 -5.655 -3.550 0.017 499 HG13 ILE 79 2HG1 ILE 79 -6.671 -3.245 1.426 500 HG21 ILE 79 1HG2 ILE 79 -3.761 -1.942 -0.517 501 HG22 ILE 79 2HG2 ILE 79 -3.519 -0.530 0.510 502 HG23 ILE 79 3HG2 ILE 79 -4.932 -0.624 -0.541 503 HD11 ILE 79 1HD1 ILE 79 -7.853 -2.770 -0.640 504 HD12 ILE 79 2HD1 ILE 79 -6.611 -1.604 -1.097 505 HD13 ILE 79 3HD1 ILE 79 -7.630 -1.299 0.309 506 H LEU 80 H LEU 80 -1.633 -2.485 1.594 507 HA LEU 80 HA LEU 80 -1.163 -0.387 3.607 508 HB2 LEU 80 1HB LEU 80 0.165 -2.487 3.805 509 HB3 LEU 80 2HB LEU 80 0.831 -2.180 2.207 510 HG LEU 80 HG LEU 80 1.801 -0.047 3.107 511 HD11 LEU 80 1HD1 LEU 80 0.331 0.275 5.004 512 HD12 LEU 80 2HD1 LEU 80 2.006 0.159 5.543 513 HD13 LEU 80 3HD1 LEU 80 0.919 -1.215 5.741 514 HD21 LEU 80 1HD2 LEU 80 2.665 -2.591 4.471 515 HD22 LEU 80 2HD2 LEU 80 3.647 -1.143 4.251 516 HD23 LEU 80 3HD2 LEU 80 3.132 -2.081 2.850 517 H ILE 81 H ILE 81 -0.956 1.627 2.830 518 HA ILE 81 HA ILE 81 -0.170 1.929 0.012 519 HB ILE 81 HB ILE 81 -1.658 3.835 1.823 520 HG12 ILE 81 1HG1 ILE 81 -2.455 2.530 -0.787 521 HG13 ILE 81 2HG1 ILE 81 -2.951 1.962 0.805 522 HG21 ILE 81 1HG2 ILE 81 -0.092 5.095 0.441 523 HG22 ILE 81 2HG2 ILE 81 -1.752 5.367 -0.089 524 HG23 ILE 81 3HG2 ILE 81 -0.700 4.286 -1.003 525 HD11 ILE 81 1HD1 ILE 81 -3.626 4.629 -0.414 526 HD12 ILE 81 2HD1 ILE 81 -4.130 4.065 1.180 527 HD13 ILE 81 3HD1 ILE 81 -4.709 3.244 -0.269 528 H LEU 82 H LEU 82 1.966 1.977 0.005 529 HA LEU 82 HA LEU 82 3.434 3.554 1.971 530 HB2 LEU 82 1HB LEU 82 4.038 1.177 1.141 531 HB3 LEU 82 2HB LEU 82 4.578 1.967 -0.322 532 HG LEU 82 HG LEU 82 6.397 1.408 1.280 533 HD11 LEU 82 1HD1 LEU 82 7.550 3.561 1.134 534 HD12 LEU 82 2HD1 LEU 82 6.028 4.339 0.697 535 HD13 LEU 82 3HD1 LEU 82 6.744 3.138 -0.377 536 HD21 LEU 82 1HD2 LEU 82 6.672 2.729 3.291 537 HD22 LEU 82 2HD2 LEU 82 5.151 1.839 3.345 538 HD23 LEU 82 3HD2 LEU 82 5.152 3.564 2.978 539 H LEU 83 H LEU 83 4.312 5.526 1.484 540 HA LEU 83 HA LEU 83 4.849 6.284 -1.227 541 HB2 LEU 83 1HB LEU 83 3.302 8.342 -1.016 542 HB3 LEU 83 2HB LEU 83 2.623 6.807 -1.518 543 HG LEU 83 HG LEU 83 1.841 6.467 0.846 544 HD11 LEU 83 1HD1 LEU 83 1.699 8.422 2.301 545 HD12 LEU 83 2HD1 LEU 83 2.658 9.348 1.148 546 HD13 LEU 83 3HD1 LEU 83 3.373 7.970 1.981 547 HD21 LEU 83 1HD2 LEU 83 0.832 8.906 -0.606 548 HD22 LEU 83 2HD2 LEU 83 -0.042 8.018 0.642 549 HD23 LEU 83 3HD2 LEU 83 0.336 7.238 -0.894 550 H GLU 84 H GLU 84 5.607 8.573 -1.378 551 HA GLU 84 HA GLU 84 6.639 9.529 1.212 552 HB2 GLU 84 1HB GLU 84 7.638 10.090 -1.593 553 HB3 GLU 84 2HB GLU 84 8.279 10.830 -0.135 554 HG2 GLU 84 1HG GLU 84 8.967 8.620 0.670 555 HG3 GLU 84 2HG GLU 84 8.356 7.902 -0.820 556 H LYS 85 H LYS 85 5.123 10.857 1.930 557 HA LYS 85 HA LYS 85 4.579 13.340 0.699 558 HB2 LYS 85 1HB LYS 85 3.142 11.871 -0.717 559 HB3 LYS 85 2HB LYS 85 2.305 11.337 0.735 560 HG2 LYS 85 1HG LYS 85 1.697 13.740 1.133 561 HG3 LYS 85 2HG LYS 85 2.318 14.074 -0.483 562 HD2 LYS 85 1HD LYS 85 0.719 12.482 -1.428 563 HD3 LYS 85 2HD LYS 85 0.104 12.140 0.192 564 HE2 LYS 85 1HE LYS 85 -0.402 14.608 0.382 565 HE3 LYS 85 2HE LYS 85 -0.067 14.722 -1.341 566 HZ1 LYS 85 1HZ LYS 85 -1.837 13.138 -1.769 567 HZ2 LYS 85 2HZ LYS 85 -2.429 14.467 -0.895 568 HZ3 LYS 85 3HZ LYS 85 -2.146 13.002 -0.108 569 HA PRO 86 HA PRO 86 3.446 13.907 5.050 570 HB2 PRO 86 1HB PRO 86 2.124 16.372 4.123 571 HB3 PRO 86 2HB PRO 86 3.417 16.176 5.308 572 HG2 PRO 86 1HG PRO 86 3.868 17.247 2.886 573 HG3 PRO 86 2HG PRO 86 5.076 16.248 3.712 574 HD2 PRO 86 1HD PRO 86 3.231 15.527 1.471 575 HD3 PRO 86 2HD PRO 86 4.925 15.060 1.735 576 H VAL 87 H VAL 87 1.756 12.745 5.800 577 HA VAL 87 HA VAL 87 -0.861 13.143 4.520 578 HB VAL 87 HB VAL 87 -1.326 10.705 4.824 579 HG11 VAL 87 1HG1 VAL 87 0.951 11.427 2.982 580 HG12 VAL 87 2HG1 VAL 87 -0.772 11.587 2.637 581 HG13 VAL 87 3HG1 VAL 87 -0.058 9.987 2.842 582 HG21 VAL 87 1HG2 VAL 87 1.649 10.543 5.306 583 HG22 VAL 87 2HG2 VAL 87 0.571 9.169 5.056 584 HG23 VAL 87 3HG2 VAL 87 0.383 10.190 6.482 585 H SER 88 H SER 88 -2.444 13.569 5.839 586 HA SER 88 HA SER 88 -2.128 13.054 8.702 587 HB2 SER 88 1HB SER 88 -4.218 14.742 7.303 588 HB3 SER 88 2HB SER 88 -3.856 14.713 9.028 589 HG SER 88 HG SER 88 -1.823 15.595 8.574 590 HA PRO 89 HA PRO 89 -4.935 9.644 9.060 591 HB2 PRO 89 1HB PRO 89 -6.642 11.498 10.680 592 HB3 PRO 89 2HB PRO 89 -6.168 9.828 11.016 593 HG2 PRO 89 1HG PRO 89 -4.939 11.860 12.221 594 HG3 PRO 89 2HG PRO 89 -4.038 10.427 11.697 595 HD2 PRO 89 1HD PRO 89 -4.061 13.162 10.557 596 HD3 PRO 89 2HD PRO 89 -2.793 11.926 10.503 597 H GLU 90 H GLU 90 -6.557 12.766 8.593 598 HA GLU 90 HA GLU 90 -9.019 12.016 7.657 599 HB2 GLU 90 1HB GLU 90 -7.538 14.362 7.806 600 HB3 GLU 90 2HB GLU 90 -7.905 14.206 6.097 601 HG2 GLU 90 1HG GLU 90 -9.973 14.070 8.269 602 HG3 GLU 90 2HG GLU 90 -9.532 15.547 7.419 603 H TYR 91 H TYR 91 -5.999 12.193 5.832 604 HA TYR 91 HA TYR 91 -7.210 11.685 3.293 605 HB2 TYR 91 1HB TYR 91 -4.328 11.547 4.201 606 HB3 TYR 91 2HB TYR 91 -4.850 11.373 2.528 607 HD1 TYR 91 HD1 TYR 91 -4.767 13.735 5.388 608 HD2 TYR 91 HD2 TYR 91 -5.282 13.262 1.192 609 HE1 TYR 91 HE1 TYR 91 -4.675 16.176 5.108 610 HE2 TYR 91 HE2 TYR 91 -5.194 15.699 0.904 611 HH TYR 91 HH TYR 91 -5.505 17.712 2.140 612 H GLU 92 H GLU 92 -5.602 9.732 5.738 613 HA GLU 92 HA GLU 92 -5.510 7.314 4.290 614 HB2 GLU 92 1HB GLU 92 -4.199 7.541 6.290 615 HB3 GLU 92 2HB GLU 92 -5.624 7.888 7.254 616 HG2 GLU 92 1HG GLU 92 -6.421 5.645 6.979 617 HG3 GLU 92 2HG GLU 92 -5.106 5.265 5.873 618 H LYS 93 H LYS 93 -7.884 8.693 6.498 619 HA LYS 93 HA LYS 93 -9.687 6.527 6.448 620 HB2 LYS 93 1HB LYS 93 -10.357 9.431 6.953 621 HB3 LYS 93 2HB LYS 93 -11.251 8.023 7.506 622 HG2 LYS 93 1HG LYS 93 -8.471 8.771 8.389 623 HG3 LYS 93 2HG LYS 93 -9.950 9.083 9.295 624 HD2 LYS 93 1HD LYS 93 -9.073 6.325 8.465 625 HD3 LYS 93 2HD LYS 93 -8.633 7.055 10.009 626 HE2 LYS 93 1HE LYS 93 -11.436 6.545 9.017 627 HE3 LYS 93 2HE LYS 93 -10.581 5.605 10.237 628 HZ1 LYS 93 1HZ LYS 93 -10.457 7.637 11.597 629 HZ2 LYS 93 2HZ LYS 93 -12.045 7.144 11.305 630 HZ3 LYS 93 3HZ LYS 93 -11.401 8.450 10.452 631 H LYS 94 H LYS 94 -9.245 9.391 4.494 632 HA LYS 94 HA LYS 94 -11.604 9.340 2.996 633 HB2 LYS 94 1HB LYS 94 -9.933 11.178 3.003 634 HB3 LYS 94 2HB LYS 94 -8.836 10.154 2.088 635 HG2 LYS 94 1HG LYS 94 -10.499 10.078 0.260 636 HG3 LYS 94 2HG LYS 94 -11.504 11.205 1.174 637 HD2 LYS 94 1HD LYS 94 -9.578 12.795 1.182 638 HD3 LYS 94 2HD LYS 94 -8.728 11.689 0.103 639 HE2 LYS 94 1HE LYS 94 -10.501 11.923 -1.549 640 HE3 LYS 94 2HE LYS 94 -11.381 12.999 -0.467 641 HZ1 LYS 94 1HZ LYS 94 -10.195 14.284 -2.079 642 HZ2 LYS 94 2HZ LYS 94 -8.735 13.515 -1.706 643 HZ3 LYS 94 3HZ LYS 94 -9.472 14.524 -0.570 644 H LEU 95 H LEU 95 -8.442 7.868 2.312 645 HA LEU 95 HA LEU 95 -9.319 6.524 -0.039 646 HB2 LEU 95 1HB LEU 95 -6.945 5.913 1.727 647 HB3 LEU 95 2HB LEU 95 -7.176 5.363 0.077 648 HG LEU 95 HG LEU 95 -6.833 8.244 0.916 649 HD11 LEU 95 1HD1 LEU 95 -4.918 6.377 -0.471 650 HD12 LEU 95 2HD1 LEU 95 -4.787 6.941 1.196 651 HD13 LEU 95 3HD1 LEU 95 -4.646 8.088 -0.136 652 HD21 LEU 95 1HD2 LEU 95 -7.009 6.984 -1.818 653 HD22 LEU 95 2HD2 LEU 95 -6.619 8.671 -1.491 654 HD23 LEU 95 3HD2 LEU 95 -8.209 8.039 -1.073 655 H GLN 96 H GLN 96 -9.095 5.686 3.349 656 HA GLN 96 HA GLN 96 -9.659 2.934 3.149 657 HB2 GLN 96 1HB GLN 96 -8.757 4.131 5.159 658 HB3 GLN 96 2HB GLN 96 -10.345 4.825 5.412 659 HG2 GLN 96 1HG GLN 96 -9.943 1.851 5.356 660 HG3 GLN 96 2HG GLN 96 -9.637 2.799 6.807 661 HE21 GLN 96 1HE2 GLN 96 -11.803 4.685 6.241 662 HE22 GLN 96 2HE2 GLN 96 -13.271 3.846 6.588 663 H LYS 97 H LYS 97 -11.691 5.798 3.165 664 HA LYS 97 HA LYS 97 -14.162 4.381 3.416 665 HB2 LYS 97 1HB LYS 97 -13.505 7.162 2.460 666 HB3 LYS 97 2HB LYS 97 -15.150 6.548 2.540 667 HG2 LYS 97 1HG LYS 97 -15.029 6.304 4.905 668 HG3 LYS 97 2HG LYS 97 -13.296 6.634 4.905 669 HD2 LYS 97 1HD LYS 97 -13.763 8.912 4.074 670 HD3 LYS 97 2HD LYS 97 -15.492 8.570 4.172 671 HE2 LYS 97 1HE LYS 97 -15.329 8.243 6.559 672 HE3 LYS 97 2HE LYS 97 -13.579 8.443 6.499 673 HZ1 LYS 97 1HZ LYS 97 -14.702 10.450 7.253 674 HZ2 LYS 97 2HZ LYS 97 -15.568 10.535 5.805 675 HZ3 LYS 97 3HZ LYS 97 -13.888 10.720 5.795 676 H TYR 98 H TYR 98 -12.113 5.199 0.702 677 HA TYR 98 HA TYR 98 -14.142 4.855 -1.278 678 HB2 TYR 98 1HB TYR 98 -11.132 4.927 -1.495 679 HB3 TYR 98 2HB TYR 98 -12.202 4.788 -2.885 680 HD1 TYR 98 HD1 TYR 98 -14.365 6.691 -1.782 681 HD2 TYR 98 HD2 TYR 98 -10.132 7.005 -2.098 682 HE1 TYR 98 HE1 TYR 98 -14.561 9.135 -1.890 683 HE2 TYR 98 HE2 TYR 98 -10.319 9.454 -2.200 684 HH TYR 98 HH TYR 98 -12.069 11.130 -2.886 685 H ALA 99 H ALA 99 -11.425 2.810 -0.226 686 HA ALA 99 HA ALA 99 -12.611 0.551 -1.668 687 HB1 ALA 99 1HB ALA 99 -10.215 0.870 -1.940 688 HB2 ALA 99 2HB ALA 99 -10.539 -0.637 -1.084 689 HB3 ALA 99 3HB ALA 99 -9.988 0.783 -0.194 690 H ASP 100 H ASP 100 -13.277 -1.342 -0.597 691 HA ASP 100 HA ASP 100 -13.968 -0.864 2.201 692 HB2 ASP 100 1HB ASP 100 -14.777 -3.021 0.250 693 HB3 ASP 100 2HB ASP 100 -15.184 -3.090 1.959 694 H ALA 101 H ALA 101 -12.298 -1.147 3.414 695 HA ALA 101 HA ALA 101 -11.077 -3.635 3.910 696 HB1 ALA 101 1HB ALA 101 -9.421 -1.665 2.319 697 HB2 ALA 101 2HB ALA 101 -10.014 -3.214 1.722 698 HB3 ALA 101 3HB ALA 101 -8.836 -3.167 3.035 699 H GLU 102 H GLU 102 -8.849 -3.051 5.089 700 HA GLU 102 HA GLU 102 -9.250 -0.528 6.528 701 HB2 GLU 102 1HB GLU 102 -7.982 -1.721 8.405 702 HB3 GLU 102 2HB GLU 102 -9.663 -2.132 8.162 703 HG2 GLU 102 1HG GLU 102 -8.967 -4.150 6.942 704 HG3 GLU 102 2HG GLU 102 -7.281 -3.732 7.246 705 H VAL 103 H VAL 103 -7.970 0.636 5.158 706 HA VAL 103 HA VAL 103 -5.366 -0.376 4.419 707 HB VAL 103 HB VAL 103 -6.878 0.950 2.834 708 HG11 VAL 103 1HG1 VAL 103 -6.919 3.285 2.900 709 HG12 VAL 103 2HG1 VAL 103 -5.655 3.357 4.137 710 HG13 VAL 103 3HG1 VAL 103 -7.280 2.777 4.552 711 HG21 VAL 103 1HG2 VAL 103 -4.052 1.926 3.167 712 HG22 VAL 103 2HG2 VAL 103 -5.012 1.955 1.688 713 HG23 VAL 103 3HG2 VAL 103 -4.516 0.415 2.387 714 H ARG 104 H ARG 104 -3.445 0.432 4.996 715 HA ARG 104 HA ARG 104 -3.400 2.488 7.103 716 HB2 ARG 104 1HB ARG 104 -1.706 0.009 6.756 717 HB3 ARG 104 2HB ARG 104 -1.268 1.322 7.841 718 HG2 ARG 104 1HG ARG 104 -3.031 0.890 9.284 719 HG3 ARG 104 2HG ARG 104 -3.932 -0.016 8.066 720 HD2 ARG 104 1HD ARG 104 -2.909 -1.428 9.843 721 HD3 ARG 104 2HD ARG 104 -2.416 -1.851 8.205 722 HE ARG 104 HE ARG 104 -0.600 -0.032 9.467 723 HH11 ARG 104 1HH1 ARG 104 -1.524 -3.383 9.201 724 HH12 ARG 104 2HH1 ARG 104 0.042 -4.001 9.631 725 HH21 ARG 104 1HH2 ARG 104 1.483 -0.814 10.011 726 HH22 ARG 104 2HH2 ARG 104 1.758 -2.526 10.081 727 H VAL 105 H VAL 105 -2.685 4.314 6.138 728 HA VAL 105 HA VAL 105 -0.945 4.045 3.847 729 HB VAL 105 HB VAL 105 -1.159 6.410 3.493 730 HG11 VAL 105 1HG1 VAL 105 -3.609 6.613 3.276 731 HG12 VAL 105 2HG1 VAL 105 -3.791 5.162 4.261 732 HG13 VAL 105 3HG1 VAL 105 -2.990 5.069 2.696 733 HG21 VAL 105 1HG2 VAL 105 -2.535 6.512 6.173 734 HG22 VAL 105 2HG2 VAL 105 -2.496 7.839 5.011 735 HG23 VAL 105 3HG2 VAL 105 -0.997 7.258 5.738 736 H ARG 106 H ARG 106 1.247 4.397 3.870 737 HA ARG 106 HA ARG 106 2.410 5.355 6.399 738 HB2 ARG 106 1HB ARG 106 3.278 2.937 4.810 739 HB3 ARG 106 2HB ARG 106 4.232 3.656 6.102 740 HG2 ARG 106 1HG ARG 106 1.472 2.482 6.404 741 HG3 ARG 106 2HG ARG 106 2.985 1.701 6.865 742 HD2 ARG 106 1HD ARG 106 1.955 4.299 8.000 743 HD3 ARG 106 2HD ARG 106 1.815 2.727 8.779 744 HE ARG 106 HE ARG 106 4.309 2.701 8.782 745 HH11 ARG 106 1HH1 ARG 106 2.585 5.746 8.647 746 HH12 ARG 106 2HH1 ARG 106 3.843 6.640 9.431 747 HH21 ARG 106 1HH2 ARG 106 5.960 3.880 9.843 748 HH22 ARG 106 2HH2 ARG 106 5.758 5.579 10.126 749 H THR 107 H THR 107 3.621 7.043 6.095 750 HA THR 107 HA THR 107 4.811 7.525 3.471 751 HB THR 107 HB THR 107 3.457 9.324 4.510 752 HG1 THR 107 HG1 THR 107 4.787 10.861 3.806 753 HG21 THR 107 1HG2 THR 107 4.358 10.578 6.413 754 HG22 THR 107 2HG2 THR 107 5.651 9.394 6.580 755 HG23 THR 107 3HG2 THR 107 3.977 8.915 6.856 756 H VAL 108 H VAL 108 7.014 7.663 3.162 757 HA VAL 108 HA VAL 108 8.718 7.078 5.496 758 HB VAL 108 HB VAL 108 10.096 5.583 4.117 759 HG11 VAL 108 1HG1 VAL 108 8.355 4.624 5.518 760 HG12 VAL 108 2HG1 VAL 108 8.552 3.685 4.039 761 HG13 VAL 108 3HG1 VAL 108 7.188 4.791 4.207 762 HG21 VAL 108 1HG2 VAL 108 9.287 4.784 1.950 763 HG22 VAL 108 2HG2 VAL 108 9.596 6.520 1.920 764 HG23 VAL 108 3HG2 VAL 108 7.941 5.920 2.032 765 H THR 109 H THR 109 11.015 7.582 5.153 766 HA THR 109 HA THR 109 11.415 9.685 3.128 767 HB THR 109 HB THR 109 13.059 10.690 4.792 768 HG1 THR 109 HG1 THR 109 12.243 8.545 6.213 769 HG21 THR 109 1HG2 THR 109 11.294 11.877 6.036 770 HG22 THR 109 2HG2 THR 109 10.119 10.686 5.477 771 HG23 THR 109 3HG2 THR 109 10.921 11.744 4.317 772 H SER 110 H SER 110 12.296 6.655 4.061 773 HA SER 110 HA SER 110 14.681 6.747 2.420 774 HB2 SER 110 1HB SER 110 14.794 5.736 5.275 775 HB3 SER 110 2HB SER 110 16.099 5.630 4.094 776 HG SER 110 HG SER 110 15.291 8.162 4.204 777 HA PRO 111 HA PRO 111 13.307 2.861 0.820 778 HB2 PRO 111 1HB PRO 111 16.080 1.926 1.433 779 HB3 PRO 111 2HB PRO 111 15.138 1.747 -0.050 780 HG2 PRO 111 1HG PRO 111 17.047 3.583 0.115 781 HG3 PRO 111 2HG PRO 111 15.522 3.935 -0.716 782 HD2 PRO 111 1HD PRO 111 16.493 4.868 1.934 783 HD3 PRO 111 2HD PRO 111 15.431 5.679 0.770 784 H ASP 112 H ASP 112 15.468 2.538 3.617 785 HA ASP 112 HA ASP 112 14.854 -0.054 4.358 786 HB2 ASP 112 1HB ASP 112 15.713 2.267 6.090 787 HB3 ASP 112 2HB ASP 112 15.703 0.586 6.615 788 H GLU 113 H GLU 113 13.230 2.938 5.302 789 HA GLU 113 HA GLU 113 11.662 1.933 7.381 790 HB2 GLU 113 1HB GLU 113 11.015 4.118 5.400 791 HB3 GLU 113 2HB GLU 113 10.131 3.822 6.889 792 HG2 GLU 113 1HG GLU 113 12.125 4.328 8.185 793 HG3 GLU 113 2HG GLU 113 13.031 4.602 6.697 794 H ALA 114 H ALA 114 10.967 2.179 3.920 795 HA ALA 114 HA ALA 114 8.289 1.349 4.069 796 HB1 ALA 114 1HB ALA 114 9.218 2.555 2.163 797 HB2 ALA 114 2HB ALA 114 8.424 1.062 1.665 798 HB3 ALA 114 3HB ALA 114 10.184 1.142 1.741 799 H LYS 115 H LYS 115 11.248 -0.498 3.324 800 HA LYS 115 HA LYS 115 9.851 -2.905 2.824 801 HB2 LYS 115 1HB LYS 115 11.981 -4.016 2.840 802 HB3 LYS 115 2HB LYS 115 12.152 -2.477 2.014 803 HG2 LYS 115 1HG LYS 115 13.228 -1.517 3.956 804 HG3 LYS 115 2HG LYS 115 12.980 -3.015 4.859 805 HD2 LYS 115 1HD LYS 115 14.346 -4.206 3.171 806 HD3 LYS 115 2HD LYS 115 14.654 -2.665 2.375 807 HE2 LYS 115 1HE LYS 115 15.752 -1.833 4.380 808 HE3 LYS 115 2HE LYS 115 15.409 -3.350 5.210 809 HZ1 LYS 115 1HZ LYS 115 17.089 -3.068 2.772 810 HZ2 LYS 115 2HZ LYS 115 16.790 -4.506 3.618 811 HZ3 LYS 115 3HZ LYS 115 17.674 -3.266 4.352 812 H ARG 116 H ARG 116 11.029 -1.399 5.739 813 HA ARG 116 HA ARG 116 10.726 -3.626 7.463 814 HB2 ARG 116 1HB ARG 116 10.643 -0.653 7.955 815 HB3 ARG 116 2HB ARG 116 10.439 -1.824 9.249 816 HG2 ARG 116 1HG ARG 116 12.646 -2.737 8.790 817 HG3 ARG 116 2HG ARG 116 12.850 -1.590 7.463 818 HD2 ARG 116 1HD ARG 116 12.727 0.268 9.013 819 HD3 ARG 116 2HD ARG 116 12.410 -0.837 10.351 820 HE ARG 116 HE ARG 116 14.793 -1.660 9.242 821 HH11 ARG 116 1HH1 ARG 116 13.581 1.277 10.710 822 HH12 ARG 116 2HH1 ARG 116 15.119 1.737 11.362 823 HH21 ARG 116 1HH2 ARG 116 16.832 -1.040 10.070 824 HH22 ARG 116 2HH2 ARG 116 16.971 0.426 10.983 825 H TRP 117 H TRP 117 8.546 -0.941 6.623 826 HA TRP 117 HA TRP 117 6.409 -1.767 8.256 827 HB2 TRP 117 1HB TRP 117 6.204 -0.212 5.671 828 HB3 TRP 117 2HB TRP 117 5.008 -0.265 6.957 829 HD1 TRP 117 HD1 TRP 117 6.524 2.381 5.784 830 HE1 TRP 117 HE1 TRP 117 7.695 3.949 7.453 831 HE3 TRP 117 HE3 TRP 117 7.080 -0.859 9.723 832 HZ2 TRP 117 HZ2 TRP 117 8.714 3.833 10.073 833 HZ3 TRP 117 HZ3 TRP 117 8.161 -0.038 11.766 834 HH2 TRP 117 HH2 TRP 117 8.962 2.259 11.939 835 H ILE 118 H ILE 118 7.141 -2.421 4.852 836 HA ILE 118 HA ILE 118 4.827 -3.930 4.302 837 HB ILE 118 HB ILE 118 7.566 -4.104 3.031 838 HG12 ILE 118 1HG1 ILE 118 5.052 -2.646 2.182 839 HG13 ILE 118 2HG1 ILE 118 6.489 -1.893 2.862 840 HG21 ILE 118 1HG2 ILE 118 4.922 -5.182 2.056 841 HG22 ILE 118 2HG2 ILE 118 6.297 -6.139 2.607 842 HG23 ILE 118 3HG2 ILE 118 6.429 -5.171 1.137 843 HD11 ILE 118 1HD1 ILE 118 6.399 -1.619 0.453 844 HD12 ILE 118 2HD1 ILE 118 6.341 -3.369 0.245 845 HD13 ILE 118 3HD1 ILE 118 7.781 -2.610 0.922 846 H LYS 119 H LYS 119 7.984 -4.833 5.598 847 HA LYS 119 HA LYS 119 7.588 -7.624 5.601 848 HB2 LYS 119 1HB LYS 119 9.792 -6.579 5.904 849 HB3 LYS 119 2HB LYS 119 9.274 -5.931 7.455 850 HG2 LYS 119 1HG LYS 119 8.986 -8.228 8.291 851 HG3 LYS 119 2HG LYS 119 9.582 -8.842 6.750 852 HD2 LYS 119 1HD LYS 119 11.381 -8.844 8.353 853 HD3 LYS 119 2HD LYS 119 11.699 -7.614 7.127 854 HE2 LYS 119 1HE LYS 119 10.932 -5.876 8.618 855 HE3 LYS 119 2HE LYS 119 10.469 -7.073 9.825 856 HZ1 LYS 119 1HZ LYS 119 12.571 -6.090 10.388 857 HZ2 LYS 119 2HZ LYS 119 13.224 -6.503 8.886 858 HZ3 LYS 119 3HZ LYS 119 12.809 -7.714 9.991 859 H GLU 120 H GLU 120 7.083 -5.173 8.130 860 HA GLU 120 HA GLU 120 6.074 -6.936 10.088 861 HB2 GLU 120 1HB GLU 120 5.612 -3.975 9.695 862 HB3 GLU 120 2HB GLU 120 5.133 -4.870 11.129 863 HG2 GLU 120 1HG GLU 120 7.480 -5.421 11.558 864 HG3 GLU 120 2HG GLU 120 7.949 -4.497 10.132 865 H PHE 121 H PHE 121 4.534 -5.076 7.538 866 HA PHE 121 HA PHE 121 1.848 -5.540 8.220 867 HB2 PHE 121 1HB PHE 121 2.575 -3.836 6.611 868 HB3 PHE 121 2HB PHE 121 3.115 -5.091 5.507 869 HD1 PHE 121 HD1 PHE 121 0.082 -3.797 7.217 870 HD2 PHE 121 HD2 PHE 121 1.682 -5.909 3.886 871 HE1 PHE 121 HE1 PHE 121 -2.135 -3.793 6.152 872 HE2 PHE 121 HE2 PHE 121 -0.533 -5.910 2.819 873 HZ PHE 121 HZ PHE 121 -2.444 -4.852 3.951 874 H SER 122 H SER 122 4.231 -7.545 6.735 875 HA SER 122 HA SER 122 2.246 -9.497 5.852 876 HB2 SER 122 1HB SER 122 5.260 -9.563 5.578 877 HB3 SER 122 2HB SER 122 4.103 -10.602 4.748 878 HG SER 122 HG SER 122 4.493 -7.811 4.425 879 H GLU 123 H GLU 123 3.866 -8.746 8.628 880 HA GLU 123 HA GLU 123 3.814 -11.527 9.578 881 HB2 GLU 123 1HB GLU 123 6.147 -10.788 9.092 882 HB3 GLU 123 2HB GLU 123 5.946 -9.490 10.258 883 HG2 GLU 123 1HG GLU 123 5.603 -11.149 12.030 884 HG3 GLU 123 2HG GLU 123 5.843 -12.439 10.851 885 H GLU 124 H GLU 124 1.654 -10.532 10.161 886 HA GLU 124 HA GLU 124 1.811 -9.667 12.923 887 HB2 GLU 124 1HB GLU 124 -0.021 -7.942 12.450 888 HB3 GLU 124 2HB GLU 124 1.626 -7.523 12.004 889 HG2 GLU 124 1HG GLU 124 1.187 -7.942 9.700 890 HG3 GLU 124 2HG GLU 124 -0.394 -8.626 10.073 Start of MODEL 13 1 HA MET 21 HA MET 21 -8.511 -11.954 3.061 2 HB2 MET 21 1HB MET 21 -7.410 -10.244 4.437 3 HB3 MET 21 2HB MET 21 -8.161 -11.477 5.438 4 HG2 MET 21 1HG MET 21 -5.981 -12.526 5.776 5 HG3 MET 21 2HG MET 21 -5.230 -11.281 4.783 6 HE1 MET 21 1HE MET 21 -8.129 -10.921 7.453 7 HE2 MET 21 2HE MET 21 -7.196 -10.512 8.890 8 HE3 MET 21 3HE MET 21 -7.034 -12.109 8.159 9 H THR 22 H THR 22 -7.774 -10.993 1.237 10 HA THR 22 HA THR 22 -5.098 -11.626 0.331 11 HB THR 22 HB THR 22 -7.049 -9.740 -1.002 12 HG1 THR 22 HG1 THR 22 -7.009 -12.542 -0.820 13 HG21 THR 22 1HG2 THR 22 -4.804 -11.452 -2.087 14 HG22 THR 22 2HG2 THR 22 -4.739 -9.707 -1.848 15 HG23 THR 22 3HG2 THR 22 -5.847 -10.395 -3.035 16 H LEU 23 H LEU 23 -3.357 -10.299 0.341 17 HA LEU 23 HA LEU 23 -3.711 -7.717 1.707 18 HB2 LEU 23 1HB LEU 23 -1.284 -9.511 1.633 19 HB3 LEU 23 2HB LEU 23 -1.409 -7.993 2.499 20 HG LEU 23 HG LEU 23 -2.991 -10.498 3.090 21 HD11 LEU 23 1HD1 LEU 23 -0.760 -9.158 4.615 22 HD12 LEU 23 2HD1 LEU 23 -0.643 -10.677 3.725 23 HD13 LEU 23 3HD1 LEU 23 -1.680 -10.566 5.148 24 HD21 LEU 23 1HD2 LEU 23 -3.779 -9.284 5.064 25 HD22 LEU 23 2HD2 LEU 23 -4.290 -8.498 3.571 26 HD23 LEU 23 3HD2 LEU 23 -2.947 -7.833 4.503 27 H PHE 24 H PHE 24 -3.230 -5.940 0.619 28 HA PHE 24 HA PHE 24 -1.565 -6.181 -1.808 29 HB2 PHE 24 1HB PHE 24 -3.870 -4.287 -1.307 30 HB3 PHE 24 2HB PHE 24 -2.861 -4.300 -2.747 31 HD1 PHE 24 HD1 PHE 24 -5.382 -6.161 -0.836 32 HD2 PHE 24 HD2 PHE 24 -3.233 -5.851 -4.490 33 HE1 PHE 24 HE1 PHE 24 -6.902 -7.787 -1.863 34 HE2 PHE 24 HE2 PHE 24 -4.754 -7.477 -5.528 35 HZ PHE 24 HZ PHE 24 -6.595 -8.446 -4.210 36 H VAL 25 H VAL 25 -0.438 -4.191 -2.414 37 HA VAL 25 HA VAL 25 -0.234 -2.147 -0.384 38 HB VAL 25 HB VAL 25 1.479 -3.562 0.451 39 HG11 VAL 25 1HG1 VAL 25 3.305 -4.446 -0.874 40 HG12 VAL 25 2HG1 VAL 25 2.639 -3.698 -2.324 41 HG13 VAL 25 3HG1 VAL 25 1.756 -4.994 -1.518 42 HG21 VAL 25 1HG2 VAL 25 2.061 -1.201 0.383 43 HG22 VAL 25 2HG2 VAL 25 2.760 -1.404 -1.222 44 HG23 VAL 25 3HG2 VAL 25 3.496 -2.202 0.167 45 H LEU 26 H LEU 26 -0.588 -0.375 -1.447 46 HA LEU 26 HA LEU 26 0.419 -0.020 -4.169 47 HB2 LEU 26 1HB LEU 26 -1.360 1.715 -2.448 48 HB3 LEU 26 2HB LEU 26 -0.797 2.180 -4.038 49 HG LEU 26 HG LEU 26 -2.959 1.428 -4.424 50 HD11 LEU 26 1HD1 LEU 26 -1.349 0.394 -5.943 51 HD12 LEU 26 2HD1 LEU 26 -2.770 -0.619 -5.689 52 HD13 LEU 26 3HD1 LEU 26 -1.254 -1.007 -4.876 53 HD21 LEU 26 1HD2 LEU 26 -2.418 -0.912 -2.609 54 HD22 LEU 26 2HD2 LEU 26 -3.912 -0.622 -3.500 55 HD23 LEU 26 3HD2 LEU 26 -3.411 0.498 -2.233 56 H ILE 27 H ILE 27 1.656 1.988 -4.646 57 HA ILE 27 HA ILE 27 3.089 3.060 -2.360 58 HB ILE 27 HB ILE 27 4.350 1.063 -2.720 59 HG12 ILE 27 1HG1 ILE 27 5.834 3.359 -4.022 60 HG13 ILE 27 2HG1 ILE 27 5.643 3.135 -2.286 61 HG21 ILE 27 1HG2 ILE 27 3.610 0.501 -4.952 62 HG22 ILE 27 2HG2 ILE 27 5.373 0.498 -4.881 63 HG23 ILE 27 3HG2 ILE 27 4.523 1.853 -5.622 64 HD11 ILE 27 1HD1 ILE 27 7.834 2.413 -3.034 65 HD12 ILE 27 2HD1 ILE 27 7.091 1.276 -4.158 66 HD13 ILE 27 3HD1 ILE 27 6.901 1.048 -2.420 67 H LEU 28 H LEU 28 2.979 5.220 -2.749 68 HA LEU 28 HA LEU 28 3.924 6.084 -5.405 69 HB2 LEU 28 1HB LEU 28 2.281 7.420 -3.300 70 HB3 LEU 28 2HB LEU 28 3.332 8.422 -4.278 71 HG LEU 28 HG LEU 28 2.174 7.510 -6.310 72 HD11 LEU 28 1HD1 LEU 28 0.020 6.445 -6.035 73 HD12 LEU 28 2HD1 LEU 28 0.225 6.442 -4.283 74 HD13 LEU 28 3HD1 LEU 28 1.289 5.468 -5.296 75 HD21 LEU 28 1HD2 LEU 28 1.642 9.698 -5.394 76 HD22 LEU 28 2HD2 LEU 28 0.478 8.965 -4.290 77 HD23 LEU 28 3HD2 LEU 28 0.195 8.914 -6.030 78 H SER 29 H SER 29 5.972 5.219 -4.646 79 HA SER 29 HA SER 29 7.558 7.518 -3.893 80 HB2 SER 29 1HB SER 29 7.213 6.078 -1.803 81 HB3 SER 29 2HB SER 29 8.119 4.817 -2.637 82 HG SER 29 HG SER 29 9.080 6.841 -1.245 83 H ASN 30 H ASN 30 8.164 7.564 -6.132 84 HA ASN 30 HA ASN 30 8.948 4.981 -7.245 85 HB2 ASN 30 1HB ASN 30 8.354 7.642 -8.535 86 HB3 ASN 30 2HB ASN 30 8.987 6.266 -9.432 87 HD21 ASN 30 1HD2 ASN 30 6.247 7.528 -7.669 88 HD22 ASN 30 2HD2 ASN 30 5.100 6.371 -8.252 89 H ASP 31 H ASP 31 10.920 4.744 -6.201 90 HA ASP 31 HA ASP 31 13.052 6.161 -7.649 91 HB2 ASP 31 1HB ASP 31 13.329 6.482 -5.252 92 HB3 ASP 31 2HB ASP 31 13.207 4.748 -4.980 93 H LYS 32 H LYS 32 14.575 4.862 -8.764 94 HA LYS 32 HA LYS 32 13.575 2.460 -9.801 95 HB2 LYS 32 1HB LYS 32 16.348 3.634 -9.812 96 HB3 LYS 32 2HB LYS 32 16.000 2.089 -10.571 97 HG2 LYS 32 1HG LYS 32 15.929 3.693 -12.287 98 HG3 LYS 32 2HG LYS 32 14.250 3.290 -11.936 99 HD2 LYS 32 1HD LYS 32 14.019 5.313 -10.615 100 HD3 LYS 32 2HD LYS 32 15.720 5.701 -10.876 101 HE2 LYS 32 1HE LYS 32 15.301 5.860 -13.287 102 HE3 LYS 32 2HE LYS 32 13.598 5.497 -13.008 103 HZ1 LYS 32 1HZ LYS 32 13.456 7.510 -11.654 104 HZ2 LYS 32 2HZ LYS 32 13.918 7.856 -13.241 105 HZ3 LYS 32 3HZ LYS 32 15.069 7.869 -12.005 106 H LYS 33 H LYS 33 16.173 2.937 -7.411 107 HA LYS 33 HA LYS 33 16.652 0.152 -7.067 108 HB2 LYS 33 1HB LYS 33 18.398 1.783 -6.616 109 HB3 LYS 33 2HB LYS 33 17.421 2.527 -5.359 110 HG2 LYS 33 1HG LYS 33 17.552 0.463 -4.045 111 HG3 LYS 33 2HG LYS 33 18.558 -0.261 -5.300 112 HD2 LYS 33 1HD LYS 33 19.277 2.264 -3.818 113 HD3 LYS 33 2HD LYS 33 19.818 0.656 -3.337 114 HE2 LYS 33 1HE LYS 33 20.910 0.380 -5.510 115 HE3 LYS 33 2HE LYS 33 20.375 1.992 -5.982 116 HZ1 LYS 33 1HZ LYS 33 21.704 2.941 -4.243 117 HZ2 LYS 33 2HZ LYS 33 22.682 1.939 -5.190 118 HZ3 LYS 33 3HZ LYS 33 22.150 1.412 -3.676 119 H LEU 34 H LEU 34 14.868 2.586 -5.235 120 HA LEU 34 HA LEU 34 14.181 1.078 -2.991 121 HB2 LEU 34 1HB LEU 34 13.810 3.581 -3.595 122 HB3 LEU 34 2HB LEU 34 12.286 3.029 -4.250 123 HG LEU 34 HG LEU 34 13.145 3.348 -1.433 124 HD11 LEU 34 1HD1 LEU 34 11.668 4.914 -2.528 125 HD12 LEU 34 2HD1 LEU 34 10.835 4.079 -1.215 126 HD13 LEU 34 3HD1 LEU 34 10.538 3.609 -2.893 127 HD21 LEU 34 1HD2 LEU 34 12.712 0.956 -1.440 128 HD22 LEU 34 2HD2 LEU 34 11.173 1.220 -2.257 129 HD23 LEU 34 3HD2 LEU 34 11.411 1.812 -0.614 130 H ILE 35 H ILE 35 12.307 1.580 -5.994 131 HA ILE 35 HA ILE 35 10.056 0.117 -5.340 132 HB ILE 35 HB ILE 35 11.370 0.652 -7.994 133 HG12 ILE 35 1HG1 ILE 35 8.817 1.653 -6.709 134 HG13 ILE 35 2HG1 ILE 35 10.337 2.538 -6.802 135 HG21 ILE 35 1HG2 ILE 35 10.209 -1.462 -8.258 136 HG22 ILE 35 2HG2 ILE 35 9.355 -0.177 -9.111 137 HG23 ILE 35 3HG2 ILE 35 8.743 -0.765 -7.565 138 HD11 ILE 35 1HD1 ILE 35 8.736 3.303 -8.468 139 HD12 ILE 35 2HD1 ILE 35 8.664 1.679 -9.151 140 HD13 ILE 35 3HD1 ILE 35 10.166 2.600 -9.224 141 H GLU 36 H GLU 36 13.179 -1.029 -6.405 142 HA GLU 36 HA GLU 36 12.252 -3.721 -6.858 143 HB2 GLU 36 1HB GLU 36 15.010 -2.532 -6.694 144 HB3 GLU 36 2HB GLU 36 14.731 -4.253 -6.923 145 HG2 GLU 36 1HG GLU 36 13.410 -3.687 -8.958 146 HG3 GLU 36 2HG GLU 36 13.919 -2.016 -8.752 147 H GLU 37 H GLU 37 14.122 -2.091 -4.294 148 HA GLU 37 HA GLU 37 14.457 -4.384 -2.681 149 HB2 GLU 37 1HB GLU 37 14.430 -1.447 -1.982 150 HB3 GLU 37 2HB GLU 37 14.764 -2.706 -0.801 151 HG2 GLU 37 1HG GLU 37 16.631 -3.461 -2.318 152 HG3 GLU 37 2HG GLU 37 16.370 -1.974 -3.229 153 H ALA 38 H ALA 38 11.913 -1.976 -2.891 154 HA ALA 38 HA ALA 38 10.413 -2.837 -0.657 155 HB1 ALA 38 1HB ALA 38 9.459 -1.445 -3.157 156 HB2 ALA 38 2HB ALA 38 10.084 -0.652 -1.712 157 HB3 ALA 38 3HB ALA 38 8.577 -1.564 -1.635 158 H ARG 39 H ARG 39 10.190 -3.633 -4.130 159 HA ARG 39 HA ARG 39 7.962 -5.340 -3.810 160 HB2 ARG 39 1HB ARG 39 8.413 -4.492 -6.001 161 HB3 ARG 39 2HB ARG 39 10.017 -5.219 -6.012 162 HG2 ARG 39 1HG ARG 39 9.138 -7.404 -6.175 163 HG3 ARG 39 2HG ARG 39 7.493 -6.870 -5.806 164 HD2 ARG 39 1HD ARG 39 7.674 -7.287 -8.175 165 HD3 ARG 39 2HD ARG 39 7.536 -5.548 -7.921 166 HE ARG 39 HE ARG 39 10.245 -6.545 -8.129 167 HH11 ARG 39 1HH1 ARG 39 7.493 -5.224 -9.840 168 HH12 ARG 39 2HH1 ARG 39 8.434 -4.659 -11.181 169 HH21 ARG 39 1HH2 ARG 39 11.491 -5.810 -9.900 170 HH22 ARG 39 2HH2 ARG 39 10.709 -4.997 -11.217 171 H LYS 40 H LYS 40 11.457 -6.047 -3.940 172 HA LYS 40 HA LYS 40 11.132 -8.837 -3.975 173 HB2 LYS 40 1HB LYS 40 13.443 -7.170 -2.973 174 HB3 LYS 40 2HB LYS 40 13.501 -8.915 -3.205 175 HG2 LYS 40 1HG LYS 40 12.947 -8.575 -5.591 176 HG3 LYS 40 2HG LYS 40 13.027 -6.835 -5.327 177 HD2 LYS 40 1HD LYS 40 15.375 -7.047 -4.667 178 HD3 LYS 40 2HD LYS 40 15.289 -8.792 -4.933 179 HE2 LYS 40 1HE LYS 40 14.620 -8.302 -7.298 180 HE3 LYS 40 2HE LYS 40 14.974 -6.603 -6.986 181 HZ1 LYS 40 1HZ LYS 40 16.928 -8.825 -6.728 182 HZ2 LYS 40 2HZ LYS 40 17.252 -7.180 -6.519 183 HZ3 LYS 40 3HZ LYS 40 16.826 -7.768 -8.043 184 H MET 41 H MET 41 11.137 -6.536 -1.352 185 HA MET 41 HA MET 41 11.156 -8.482 0.731 186 HB2 MET 41 1HB MET 41 11.901 -6.202 1.102 187 HB3 MET 41 2HB MET 41 10.324 -5.581 0.641 188 HG2 MET 41 1HG MET 41 10.517 -5.490 2.986 189 HG3 MET 41 2HG MET 41 9.351 -6.743 2.586 190 HE1 MET 41 1HE MET 41 10.657 -6.399 5.439 191 HE2 MET 41 2HE MET 41 11.052 -8.063 5.862 192 HE3 MET 41 3HE MET 41 9.519 -7.694 5.072 193 H ALA 42 H ALA 42 8.620 -6.477 -0.781 194 HA ALA 42 HA ALA 42 6.511 -7.561 0.796 195 HB1 ALA 42 1HB ALA 42 6.388 -5.331 -0.195 196 HB2 ALA 42 2HB ALA 42 5.024 -6.333 -0.682 197 HB3 ALA 42 3HB ALA 42 6.353 -6.049 -1.804 198 H GLU 43 H GLU 43 7.957 -8.451 -2.227 199 HA GLU 43 HA GLU 43 5.897 -10.006 -3.315 200 HB2 GLU 43 1HB GLU 43 8.097 -9.238 -4.404 201 HB3 GLU 43 2HB GLU 43 8.824 -10.642 -3.634 202 HG2 GLU 43 1HG GLU 43 8.223 -11.112 -5.939 203 HG3 GLU 43 2HG GLU 43 7.284 -12.106 -4.823 204 H LYS 44 H LYS 44 8.676 -10.806 -1.274 205 HA LYS 44 HA LYS 44 8.049 -13.548 -0.909 206 HB2 LYS 44 1HB LYS 44 9.747 -11.660 0.710 207 HB3 LYS 44 2HB LYS 44 9.641 -13.391 1.009 208 HG2 LYS 44 1HG LYS 44 10.415 -13.765 -1.328 209 HG3 LYS 44 2HG LYS 44 10.691 -12.026 -1.452 210 HD2 LYS 44 1HD LYS 44 12.290 -12.106 0.344 211 HD3 LYS 44 2HD LYS 44 11.920 -13.807 0.628 212 HE2 LYS 44 1HE LYS 44 13.102 -12.689 -1.909 213 HE3 LYS 44 2HE LYS 44 14.021 -13.481 -0.629 214 HZ1 LYS 44 1HZ LYS 44 11.889 -14.724 -2.284 215 HZ2 LYS 44 2HZ LYS 44 12.690 -15.487 -1.006 216 HZ3 LYS 44 3HZ LYS 44 13.550 -15.031 -2.388 217 H ALA 45 H ALA 45 6.944 -10.642 0.600 218 HA ALA 45 HA ALA 45 5.851 -11.958 2.918 219 HB1 ALA 45 1HB ALA 45 5.425 -9.161 1.885 220 HB2 ALA 45 2HB ALA 45 6.642 -9.656 3.061 221 HB3 ALA 45 3HB ALA 45 4.929 -9.767 3.464 222 H ASN 46 H ASN 46 5.024 -12.055 -0.196 223 HA ASN 46 HA ASN 46 3.203 -12.642 -1.390 224 HB2 ASN 46 1HB ASN 46 1.978 -13.265 1.304 225 HB3 ASN 46 2HB ASN 46 1.308 -13.745 -0.251 226 HD21 ASN 46 1HD2 ASN 46 3.621 -14.416 2.185 227 HD22 ASN 46 2HD2 ASN 46 4.259 -15.866 1.491 228 H LEU 47 H LEU 47 3.574 -9.924 -0.472 229 HA LEU 47 HA LEU 47 0.832 -8.936 -0.303 230 HB2 LEU 47 1HB LEU 47 3.427 -7.397 -0.363 231 HB3 LEU 47 2HB LEU 47 1.844 -6.745 -0.013 232 HG LEU 47 HG LEU 47 3.375 -8.691 1.711 233 HD11 LEU 47 1HD1 LEU 47 3.548 -6.840 3.265 234 HD12 LEU 47 2HD1 LEU 47 2.667 -5.795 2.151 235 HD13 LEU 47 3HD1 LEU 47 4.262 -6.403 1.713 236 HD21 LEU 47 1HD2 LEU 47 1.578 -8.335 3.340 237 HD22 LEU 47 2HD2 LEU 47 0.987 -9.100 1.865 238 HD23 LEU 47 3HD2 LEU 47 0.694 -7.384 2.147 239 H ILE 48 H ILE 48 -0.237 -8.229 -2.053 240 HA ILE 48 HA ILE 48 1.050 -8.388 -4.626 241 HB ILE 48 HB ILE 48 -1.754 -7.493 -3.928 242 HG12 ILE 48 1HG1 ILE 48 -0.690 -10.156 -4.908 243 HG13 ILE 48 2HG1 ILE 48 -1.291 -9.822 -3.290 244 HG21 ILE 48 1HG2 ILE 48 -0.556 -8.254 -6.593 245 HG22 ILE 48 2HG2 ILE 48 -1.009 -6.626 -6.093 246 HG23 ILE 48 3HG2 ILE 48 -2.250 -7.862 -6.297 247 HD11 ILE 48 1HD1 ILE 48 -2.910 -9.730 -5.824 248 HD12 ILE 48 2HD1 ILE 48 -3.514 -9.410 -4.199 249 HD13 ILE 48 3HD1 ILE 48 -2.929 -11.019 -4.620 250 H LEU 49 H LEU 49 2.509 -6.833 -4.923 251 HA LEU 49 HA LEU 49 2.002 -4.095 -4.144 252 HB2 LEU 49 1HB LEU 49 4.237 -5.053 -3.863 253 HB3 LEU 49 2HB LEU 49 4.335 -5.363 -5.586 254 HG LEU 49 HG LEU 49 4.132 -2.852 -5.923 255 HD11 LEU 49 1HD1 LEU 49 4.807 -1.453 -4.025 256 HD12 LEU 49 2HD1 LEU 49 4.714 -2.862 -2.969 257 HD13 LEU 49 3HD1 LEU 49 3.257 -2.249 -3.752 258 HD21 LEU 49 1HD2 LEU 49 6.233 -4.061 -6.176 259 HD22 LEU 49 2HD2 LEU 49 6.542 -3.895 -4.449 260 HD23 LEU 49 3HD2 LEU 49 6.492 -2.463 -5.477 261 H ILE 50 H ILE 50 1.285 -2.530 -5.421 262 HA ILE 50 HA ILE 50 1.379 -2.951 -8.337 263 HB ILE 50 HB ILE 50 -0.831 -1.532 -6.831 264 HG12 ILE 50 1HG1 ILE 50 -0.951 -4.177 -8.301 265 HG13 ILE 50 2HG1 ILE 50 -0.829 -4.026 -6.552 266 HG21 ILE 50 1HG2 ILE 50 -0.420 -0.591 -9.037 267 HG22 ILE 50 2HG2 ILE 50 -1.956 -1.457 -9.009 268 HG23 ILE 50 3HG2 ILE 50 -0.541 -2.195 -9.760 269 HD11 ILE 50 1HD1 ILE 50 -3.089 -2.978 -8.240 270 HD12 ILE 50 2HD1 ILE 50 -2.973 -2.897 -6.482 271 HD13 ILE 50 3HD1 ILE 50 -3.115 -4.460 -7.285 272 H THR 51 H THR 51 2.974 -1.644 -8.971 273 HA THR 51 HA THR 51 3.675 0.762 -7.644 274 HB THR 51 HB THR 51 5.004 1.147 -9.828 275 HG1 THR 51 HG1 THR 51 5.100 -1.417 -10.515 276 HG21 THR 51 1HG2 THR 51 5.995 0.319 -7.747 277 HG22 THR 51 2HG2 THR 51 6.702 -0.482 -9.149 278 HG23 THR 51 3HG2 THR 51 5.504 -1.322 -8.165 279 H VAL 52 H VAL 52 3.038 2.798 -7.964 280 HA VAL 52 HA VAL 52 1.557 3.603 -10.307 281 HB VAL 52 HB VAL 52 -0.285 2.631 -9.143 282 HG11 VAL 52 1HG1 VAL 52 0.733 2.347 -6.961 283 HG12 VAL 52 2HG1 VAL 52 -0.832 3.146 -6.804 284 HG13 VAL 52 3HG1 VAL 52 0.655 4.086 -6.674 285 HG21 VAL 52 1HG2 VAL 52 -0.302 5.580 -8.512 286 HG22 VAL 52 2HG2 VAL 52 -1.717 4.530 -8.620 287 HG23 VAL 52 3HG2 VAL 52 -0.744 4.855 -10.055 288 H GLY 53 H GLY 53 1.936 5.761 -10.689 289 HA2 GLY 53 1HA GLY 53 2.788 7.347 -8.347 290 HA3 GLY 53 2HA GLY 53 3.640 7.451 -9.878 291 H ASP 54 H ASP 54 0.782 8.234 -8.129 292 HA ASP 54 HA ASP 54 0.432 10.782 -8.913 293 HB2 ASP 54 1HB ASP 54 0.100 10.014 -11.249 294 HB3 ASP 54 2HB ASP 54 -1.240 9.008 -10.719 295 H GLU 55 H GLU 55 -1.374 11.656 -7.795 296 HA GLU 55 HA GLU 55 -2.299 9.959 -5.703 297 HB2 GLU 55 1HB GLU 55 -3.270 12.731 -6.383 298 HB3 GLU 55 2HB GLU 55 -3.373 11.922 -4.824 299 HG2 GLU 55 1HG GLU 55 -0.921 11.922 -4.674 300 HG3 GLU 55 2HG GLU 55 -0.841 12.790 -6.203 301 H GLU 56 H GLU 56 -3.664 11.183 -8.671 302 HA GLU 56 HA GLU 56 -6.347 10.377 -8.044 303 HB2 GLU 56 1HB GLU 56 -5.091 11.069 -10.703 304 HB3 GLU 56 2HB GLU 56 -6.811 10.888 -10.401 305 HG2 GLU 56 1HG GLU 56 -6.736 12.777 -8.853 306 HG3 GLU 56 2HG GLU 56 -5.011 12.969 -9.179 307 H GLU 57 H GLU 57 -3.630 9.099 -9.880 308 HA GLU 57 HA GLU 57 -5.029 6.786 -10.767 309 HB2 GLU 57 1HB GLU 57 -2.077 7.353 -10.651 310 HB3 GLU 57 2HB GLU 57 -2.792 5.943 -11.416 311 HG2 GLU 57 1HG GLU 57 -3.246 8.811 -12.202 312 HG3 GLU 57 2HG GLU 57 -2.273 7.625 -13.071 313 H LEU 58 H LEU 58 -3.362 7.622 -7.867 314 HA LEU 58 HA LEU 58 -2.950 5.055 -6.825 315 HB2 LEU 58 1HB LEU 58 -2.074 7.025 -5.709 316 HB3 LEU 58 2HB LEU 58 -3.696 7.621 -5.417 317 HG LEU 58 HG LEU 58 -4.125 5.743 -3.898 318 HD11 LEU 58 1HD1 LEU 58 -2.687 4.070 -4.900 319 HD12 LEU 58 2HD1 LEU 58 -2.277 4.286 -3.198 320 HD13 LEU 58 3HD1 LEU 58 -1.257 4.996 -4.448 321 HD21 LEU 58 1HD2 LEU 58 -2.608 6.427 -2.093 322 HD22 LEU 58 2HD2 LEU 58 -3.265 7.811 -2.970 323 HD23 LEU 58 3HD2 LEU 58 -1.609 7.281 -3.271 324 H LYS 59 H LYS 59 -5.792 7.156 -6.851 325 HA LYS 59 HA LYS 59 -7.466 5.508 -5.314 326 HB2 LYS 59 1HB LYS 59 -8.502 7.245 -7.513 327 HB3 LYS 59 2HB LYS 59 -9.241 6.888 -5.956 328 HG2 LYS 59 1HG LYS 59 -7.221 8.105 -4.951 329 HG3 LYS 59 2HG LYS 59 -6.970 8.728 -6.580 330 HD2 LYS 59 1HD LYS 59 -9.394 9.100 -4.833 331 HD3 LYS 59 2HD LYS 59 -8.223 10.312 -5.335 332 HE2 LYS 59 1HE LYS 59 -10.020 8.811 -7.217 333 HE3 LYS 59 2HE LYS 59 -10.373 10.412 -6.575 334 HZ1 LYS 59 1HZ LYS 59 -8.080 9.669 -8.300 335 HZ2 LYS 59 2HZ LYS 59 -8.300 11.194 -7.602 336 HZ3 LYS 59 3HZ LYS 59 -9.409 10.617 -8.739 337 H LYS 60 H LYS 60 -6.541 5.447 -8.573 338 HA LYS 60 HA LYS 60 -8.495 3.547 -9.461 339 HB2 LYS 60 1HB LYS 60 -5.816 4.157 -10.703 340 HB3 LYS 60 2HB LYS 60 -7.259 3.541 -11.505 341 HG2 LYS 60 1HG LYS 60 -7.358 6.163 -10.091 342 HG3 LYS 60 2HG LYS 60 -6.619 6.058 -11.706 343 HD2 LYS 60 1HD LYS 60 -8.756 4.926 -12.463 344 HD3 LYS 60 2HD LYS 60 -9.448 5.392 -10.907 345 HE2 LYS 60 1HE LYS 60 -10.054 7.028 -12.569 346 HE3 LYS 60 2HE LYS 60 -8.928 7.750 -11.423 347 HZ1 LYS 60 1HZ LYS 60 -7.140 7.456 -13.011 348 HZ2 LYS 60 2HZ LYS 60 -8.408 8.329 -13.722 349 HZ3 LYS 60 3HZ LYS 60 -8.193 6.696 -14.100 350 H ALA 61 H ALA 61 -5.116 3.406 -8.422 351 HA ALA 61 HA ALA 61 -4.742 0.645 -8.885 352 HB1 ALA 61 1HB ALA 61 -2.886 2.237 -8.660 353 HB2 ALA 61 2HB ALA 61 -2.727 0.878 -7.546 354 HB3 ALA 61 3HB ALA 61 -3.280 2.443 -6.954 355 H ILE 62 H ILE 62 -5.652 2.487 -5.990 356 HA ILE 62 HA ILE 62 -5.839 0.328 -4.200 357 HB ILE 62 HB ILE 62 -7.596 2.794 -4.209 358 HG12 ILE 62 1HG1 ILE 62 -4.995 2.385 -2.725 359 HG13 ILE 62 2HG1 ILE 62 -5.116 3.262 -4.248 360 HG21 ILE 62 1HG2 ILE 62 -7.804 2.384 -1.816 361 HG22 ILE 62 2HG2 ILE 62 -6.794 0.945 -1.964 362 HG23 ILE 62 3HG2 ILE 62 -8.377 0.995 -2.741 363 HD11 ILE 62 1HD1 ILE 62 -6.599 4.884 -3.210 364 HD12 ILE 62 2HD1 ILE 62 -5.077 4.764 -2.327 365 HD13 ILE 62 3HD1 ILE 62 -6.528 3.990 -1.692 366 H LYS 63 H LYS 63 -8.211 1.720 -6.424 367 HA LYS 63 HA LYS 63 -10.402 0.104 -5.702 368 HB2 LYS 63 1HB LYS 63 -10.581 2.177 -7.035 369 HB3 LYS 63 2HB LYS 63 -9.778 1.374 -8.375 370 HG2 LYS 63 1HG LYS 63 -11.651 -0.260 -8.435 371 HG3 LYS 63 2HG LYS 63 -12.471 0.714 -7.212 372 HD2 LYS 63 1HD LYS 63 -12.414 2.642 -8.721 373 HD3 LYS 63 2HD LYS 63 -11.617 1.657 -9.947 374 HE2 LYS 63 1HE LYS 63 -13.581 0.151 -9.949 375 HE3 LYS 63 2HE LYS 63 -14.375 1.234 -8.806 376 HZ1 LYS 63 1HZ LYS 63 -13.501 1.946 -11.553 377 HZ2 LYS 63 2HZ LYS 63 -14.234 3.003 -10.455 378 HZ3 LYS 63 3HZ LYS 63 -15.096 1.677 -11.055 379 H LYS 64 H LYS 64 -7.834 -0.287 -8.081 380 HA LYS 64 HA LYS 64 -8.709 -2.653 -9.298 381 HB2 LYS 64 1HB LYS 64 -6.844 -1.187 -10.087 382 HB3 LYS 64 2HB LYS 64 -5.857 -1.795 -8.767 383 HG2 LYS 64 1HG LYS 64 -6.240 -4.107 -9.747 384 HG3 LYS 64 2HG LYS 64 -6.870 -3.276 -11.172 385 HD2 LYS 64 1HD LYS 64 -4.118 -2.936 -9.981 386 HD3 LYS 64 2HD LYS 64 -4.509 -3.824 -11.451 387 HE2 LYS 64 1HE LYS 64 -5.076 -0.890 -11.074 388 HE3 LYS 64 2HE LYS 64 -3.591 -1.508 -11.790 389 HZ1 LYS 64 1HZ LYS 64 -4.945 -2.598 -13.500 390 HZ2 LYS 64 2HZ LYS 64 -5.150 -0.918 -13.499 391 HZ3 LYS 64 3HZ LYS 64 -6.344 -1.912 -12.834 392 H ALA 65 H ALA 65 -6.807 -2.066 -6.391 393 HA ALA 65 HA ALA 65 -6.196 -4.755 -5.787 394 HB1 ALA 65 1HB ALA 65 -6.463 -2.406 -3.912 395 HB2 ALA 65 2HB ALA 65 -5.005 -2.859 -4.795 396 HB3 ALA 65 3HB ALA 65 -5.656 -3.933 -3.556 397 H ASP 66 H ASP 66 -8.792 -2.605 -4.665 398 HA ASP 66 HA ASP 66 -10.185 -4.334 -3.001 399 HB2 ASP 66 1HB ASP 66 -10.875 -2.052 -3.113 400 HB3 ASP 66 2HB ASP 66 -11.147 -2.146 -4.848 401 H ASP 67 H ASP 67 -10.346 -3.979 -6.494 402 HA ASP 67 HA ASP 67 -12.492 -5.697 -7.005 403 HB2 ASP 67 1HB ASP 67 -11.669 -4.150 -8.677 404 HB3 ASP 67 2HB ASP 67 -10.115 -4.975 -8.724 405 H ILE 68 H ILE 68 -9.031 -6.358 -6.702 406 HA ILE 68 HA ILE 68 -9.287 -9.128 -7.423 407 HB ILE 68 HB ILE 68 -7.010 -7.756 -5.979 408 HG12 ILE 68 1HG1 ILE 68 -7.312 -8.343 -8.930 409 HG13 ILE 68 2HG1 ILE 68 -7.529 -6.757 -8.196 410 HG21 ILE 68 1HG2 ILE 68 -6.969 -10.178 -5.726 411 HG22 ILE 68 2HG2 ILE 68 -5.662 -9.643 -6.782 412 HG23 ILE 68 3HG2 ILE 68 -7.109 -10.377 -7.472 413 HD11 ILE 68 1HD1 ILE 68 -5.338 -6.967 -9.224 414 HD12 ILE 68 2HD1 ILE 68 -4.980 -8.360 -8.203 415 HD13 ILE 68 3HD1 ILE 68 -5.199 -6.767 -7.478 416 H ALA 69 H ALA 69 -8.939 -7.306 -4.411 417 HA ALA 69 HA ALA 69 -8.664 -9.366 -2.583 418 HB1 ALA 69 1HB ALA 69 -8.543 -6.879 -2.143 419 HB2 ALA 69 2HB ALA 69 -9.361 -7.841 -0.912 420 HB3 ALA 69 3HB ALA 69 -10.306 -6.900 -2.066 421 H LYS 70 H LYS 70 -11.646 -7.808 -3.675 422 HA LYS 70 HA LYS 70 -13.305 -9.373 -2.019 423 HB2 LYS 70 1HB LYS 70 -13.806 -7.568 -4.339 424 HB3 LYS 70 2HB LYS 70 -15.123 -8.450 -3.580 425 HG2 LYS 70 1HG LYS 70 -14.618 -7.398 -1.444 426 HG3 LYS 70 2HG LYS 70 -13.283 -6.518 -2.188 427 HD2 LYS 70 1HD LYS 70 -14.735 -5.208 -3.491 428 HD3 LYS 70 2HD LYS 70 -16.100 -6.288 -3.202 429 HE2 LYS 70 1HE LYS 70 -16.187 -4.149 -1.919 430 HE3 LYS 70 2HE LYS 70 -16.254 -5.603 -0.923 431 HZ1 LYS 70 1HZ LYS 70 -13.848 -3.917 -1.393 432 HZ2 LYS 70 2HZ LYS 70 -13.892 -5.335 -0.461 433 HZ3 LYS 70 3HZ LYS 70 -14.771 -3.977 0.035 434 H LYS 71 H LYS 71 -12.102 -9.776 -5.239 435 HA LYS 71 HA LYS 71 -13.996 -11.496 -6.313 436 HB2 LYS 71 1HB LYS 71 -12.161 -10.508 -7.611 437 HB3 LYS 71 2HB LYS 71 -11.002 -11.503 -6.740 438 HG2 LYS 71 1HG LYS 71 -12.097 -13.517 -7.655 439 HG3 LYS 71 2HG LYS 71 -13.164 -12.470 -8.595 440 HD2 LYS 71 1HD LYS 71 -11.225 -11.517 -9.737 441 HD3 LYS 71 2HD LYS 71 -10.155 -12.556 -8.794 442 HE2 LYS 71 1HE LYS 71 -12.271 -13.466 -10.742 443 HE3 LYS 71 2HE LYS 71 -10.528 -13.486 -11.011 444 HZ1 LYS 71 1HZ LYS 71 -12.010 -15.063 -8.974 445 HZ2 LYS 71 2HZ LYS 71 -10.327 -15.037 -9.140 446 HZ3 LYS 71 3HZ LYS 71 -11.286 -15.662 -10.381 447 H GLN 72 H GLN 72 -11.428 -12.099 -4.016 448 HA GLN 72 HA GLN 72 -12.195 -14.951 -4.031 449 HB2 GLN 72 1HB GLN 72 -9.786 -15.440 -3.430 450 HB3 GLN 72 2HB GLN 72 -10.090 -14.901 -5.076 451 HG2 GLN 72 1HG GLN 72 -9.422 -12.610 -4.381 452 HG3 GLN 72 2HG GLN 72 -8.977 -13.267 -2.807 453 HE21 GLN 72 1HE2 GLN 72 -6.833 -12.679 -3.061 454 HE22 GLN 72 2HE2 GLN 72 -5.768 -13.519 -4.138 455 H ASN 73 H ASN 73 -10.683 -12.444 -1.981 456 HA ASN 73 HA ASN 73 -11.272 -14.141 0.344 457 HB2 ASN 73 1HB ASN 73 -9.002 -12.211 -0.081 458 HB3 ASN 73 2HB ASN 73 -9.383 -12.935 1.476 459 HD21 ASN 73 1HD2 ASN 73 -10.170 -15.495 0.216 460 HD22 ASN 73 2HD2 ASN 73 -8.684 -16.255 -0.234 461 H SER 74 H SER 74 -12.935 -12.052 -0.914 462 HA SER 74 HA SER 74 -12.959 -9.560 0.101 463 HB2 SER 74 1HB SER 74 -15.312 -9.491 -0.386 464 HB3 SER 74 2HB SER 74 -14.502 -10.510 -1.571 465 HG SER 74 HG SER 74 -15.212 -12.109 0.380 466 H SER 75 H SER 75 -13.649 -12.367 2.031 467 HA SER 75 HA SER 75 -15.252 -11.435 4.053 468 HB2 SER 75 1HB SER 75 -12.756 -13.106 4.438 469 HB3 SER 75 2HB SER 75 -14.173 -13.066 5.488 470 HG SER 75 HG SER 75 -15.225 -14.319 4.144 471 H GLU 76 H GLU 76 -11.781 -10.866 3.599 472 HA GLU 76 HA GLU 76 -12.047 -8.391 5.088 473 HB2 GLU 76 1HB GLU 76 -11.335 -10.217 6.729 474 HB3 GLU 76 2HB GLU 76 -9.827 -10.295 5.831 475 HG2 GLU 76 1HG GLU 76 -9.391 -8.897 7.659 476 HG3 GLU 76 2HG GLU 76 -9.588 -7.808 6.284 477 H ALA 77 H ALA 77 -11.178 -6.905 3.808 478 HA ALA 77 HA ALA 77 -8.909 -7.665 2.100 479 HB1 ALA 77 1HB ALA 77 -9.512 -5.820 0.656 480 HB2 ALA 77 2HB ALA 77 -10.779 -5.318 1.775 481 HB3 ALA 77 3HB ALA 77 -10.921 -6.850 0.912 482 H LYS 78 H LYS 78 -7.003 -7.042 2.888 483 HA LYS 78 HA LYS 78 -6.901 -4.509 4.381 484 HB2 LYS 78 1HB LYS 78 -5.166 -6.946 4.819 485 HB3 LYS 78 2HB LYS 78 -5.069 -5.435 5.712 486 HG2 LYS 78 1HG LYS 78 -7.469 -5.844 6.402 487 HG3 LYS 78 2HG LYS 78 -7.279 -7.469 5.744 488 HD2 LYS 78 1HD LYS 78 -6.884 -7.480 8.138 489 HD3 LYS 78 2HD LYS 78 -5.391 -7.848 7.274 490 HE2 LYS 78 1HE LYS 78 -4.501 -5.711 7.683 491 HE3 LYS 78 2HE LYS 78 -6.071 -5.060 8.153 492 HZ1 LYS 78 1HZ LYS 78 -4.663 -5.430 10.070 493 HZ2 LYS 78 2HZ LYS 78 -4.497 -7.069 9.684 494 HZ3 LYS 78 3HZ LYS 78 -6.007 -6.446 10.127 495 H ILE 79 H ILE 79 -5.562 -3.015 3.641 496 HA ILE 79 HA ILE 79 -3.680 -3.781 1.513 497 HB ILE 79 HB ILE 79 -5.528 -1.383 1.462 498 HG12 ILE 79 1HG1 ILE 79 -5.574 -3.886 -0.242 499 HG13 ILE 79 2HG1 ILE 79 -6.701 -3.530 1.066 500 HG21 ILE 79 1HG2 ILE 79 -3.556 -2.393 -0.582 501 HG22 ILE 79 2HG2 ILE 79 -3.404 -0.925 0.382 502 HG23 ILE 79 3HG2 ILE 79 -4.685 -1.062 -0.822 503 HD11 ILE 79 1HD1 ILE 79 -6.373 -1.920 -1.456 504 HD12 ILE 79 2HD1 ILE 79 -7.523 -1.596 -0.159 505 HD13 ILE 79 3HD1 ILE 79 -7.669 -3.069 -1.120 506 H LEU 80 H LEU 80 -1.787 -2.631 1.438 507 HA LEU 80 HA LEU 80 -1.358 -0.602 3.537 508 HB2 LEU 80 1HB LEU 80 0.045 -2.820 3.296 509 HB3 LEU 80 2HB LEU 80 0.829 -1.962 1.982 510 HG LEU 80 HG LEU 80 0.784 -1.074 4.877 511 HD11 LEU 80 1HD1 LEU 80 2.143 -3.064 4.511 512 HD12 LEU 80 2HD1 LEU 80 3.151 -1.660 4.861 513 HD13 LEU 80 3HD1 LEU 80 3.000 -2.247 3.204 514 HD21 LEU 80 1HD2 LEU 80 2.450 0.575 4.188 515 HD22 LEU 80 2HD2 LEU 80 0.915 0.830 3.357 516 HD23 LEU 80 3HD2 LEU 80 2.262 0.068 2.509 517 H ILE 81 H ILE 81 -0.950 1.473 2.858 518 HA ILE 81 HA ILE 81 -0.226 1.827 0.020 519 HB ILE 81 HB ILE 81 -1.748 3.737 1.803 520 HG12 ILE 81 1HG1 ILE 81 -2.528 2.355 -0.773 521 HG13 ILE 81 2HG1 ILE 81 -3.050 1.859 0.834 522 HG21 ILE 81 1HG2 ILE 81 -0.782 4.128 -1.030 523 HG22 ILE 81 2HG2 ILE 81 -0.173 4.964 0.398 524 HG23 ILE 81 3HG2 ILE 81 -1.831 5.231 -0.140 525 HD11 ILE 81 1HD1 ILE 81 -4.204 4.000 1.103 526 HD12 ILE 81 2HD1 ILE 81 -4.783 3.108 -0.304 527 HD13 ILE 81 3HD1 ILE 81 -3.686 4.471 -0.515 528 H LEU 82 H LEU 82 1.884 2.031 -0.028 529 HA LEU 82 HA LEU 82 3.257 3.436 2.151 530 HB2 LEU 82 1HB LEU 82 3.820 1.048 1.479 531 HB3 LEU 82 2HB LEU 82 4.462 1.715 -0.009 532 HG LEU 82 HG LEU 82 6.077 3.045 1.334 533 HD11 LEU 82 1HD1 LEU 82 4.915 1.437 3.603 534 HD12 LEU 82 2HD1 LEU 82 4.892 3.191 3.423 535 HD13 LEU 82 3HD1 LEU 82 6.419 2.351 3.688 536 HD21 LEU 82 1HD2 LEU 82 6.715 0.924 0.333 537 HD22 LEU 82 2HD2 LEU 82 6.122 0.061 1.752 538 HD23 LEU 82 3HD2 LEU 82 7.507 1.142 1.892 539 H LEU 83 H LEU 83 3.559 5.544 1.697 540 HA LEU 83 HA LEU 83 4.471 6.245 -1.003 541 HB2 LEU 83 1HB LEU 83 2.973 8.368 -0.623 542 HB3 LEU 83 2HB LEU 83 2.311 6.900 -1.319 543 HG LEU 83 HG LEU 83 1.426 6.293 0.943 544 HD11 LEU 83 1HD1 LEU 83 2.954 7.570 2.322 545 HD12 LEU 83 2HD1 LEU 83 1.284 8.038 2.646 546 HD13 LEU 83 3HD1 LEU 83 2.317 9.075 1.664 547 HD21 LEU 83 1HD2 LEU 83 0.521 8.943 -0.171 548 HD22 LEU 83 2HD2 LEU 83 -0.414 7.896 0.896 549 HD23 LEU 83 3HD2 LEU 83 0.007 7.351 -0.727 550 H GLU 84 H GLU 84 5.464 8.383 -1.159 551 HA GLU 84 HA GLU 84 6.564 9.301 1.412 552 HB2 GLU 84 1HB GLU 84 8.184 8.810 -0.401 553 HB3 GLU 84 2HB GLU 84 7.380 9.987 -1.428 554 HG2 GLU 84 1HG GLU 84 7.997 11.766 0.133 555 HG3 GLU 84 2HG GLU 84 8.808 10.580 1.156 556 H LYS 85 H LYS 85 5.158 10.657 2.294 557 HA LYS 85 HA LYS 85 4.417 13.146 1.127 558 HB2 LYS 85 1HB LYS 85 2.411 10.907 1.163 559 HB3 LYS 85 2HB LYS 85 1.872 12.554 1.430 560 HG2 LYS 85 1HG LYS 85 2.800 13.192 -0.743 561 HG3 LYS 85 2HG LYS 85 3.301 11.522 -1.007 562 HD2 LYS 85 1HD LYS 85 0.989 10.790 -0.926 563 HD3 LYS 85 2HD LYS 85 0.458 12.435 -0.570 564 HE2 LYS 85 1HE LYS 85 1.867 11.543 -3.083 565 HE3 LYS 85 2HE LYS 85 0.140 11.859 -2.931 566 HZ1 LYS 85 1HZ LYS 85 1.353 13.735 -3.891 567 HZ2 LYS 85 2HZ LYS 85 2.283 13.868 -2.489 568 HZ3 LYS 85 3HZ LYS 85 0.619 14.154 -2.428 569 HA PRO 86 HA PRO 86 3.337 13.637 5.494 570 HB2 PRO 86 1HB PRO 86 1.824 16.006 5.071 571 HB3 PRO 86 2HB PRO 86 3.517 15.905 5.555 572 HG2 PRO 86 1HG PRO 86 2.577 16.902 3.127 573 HG3 PRO 86 2HG PRO 86 4.243 16.411 3.466 574 HD2 PRO 86 1HD PRO 86 2.078 14.931 2.046 575 HD3 PRO 86 2HD PRO 86 3.830 14.937 1.749 576 H VAL 87 H VAL 87 1.855 12.451 6.436 577 HA VAL 87 HA VAL 87 -0.841 12.425 5.261 578 HB VAL 87 HB VAL 87 0.483 10.140 6.711 579 HG11 VAL 87 1HG1 VAL 87 -1.929 10.147 6.811 580 HG12 VAL 87 2HG1 VAL 87 -1.348 8.836 5.786 581 HG13 VAL 87 3HG1 VAL 87 -2.008 10.298 5.059 582 HG21 VAL 87 1HG2 VAL 87 0.726 9.076 4.514 583 HG22 VAL 87 2HG2 VAL 87 1.682 10.553 4.634 584 HG23 VAL 87 3HG2 VAL 87 0.159 10.556 3.743 585 H SER 88 H SER 88 -2.333 13.227 6.542 586 HA SER 88 HA SER 88 -1.975 13.084 9.444 587 HB2 SER 88 1HB SER 88 -4.032 14.601 7.814 588 HB3 SER 88 2HB SER 88 -3.787 14.726 9.555 589 HG SER 88 HG SER 88 -2.743 16.411 8.370 590 HA PRO 89 HA PRO 89 -4.806 9.769 10.247 591 HB2 PRO 89 1HB PRO 89 -6.509 11.803 11.639 592 HB3 PRO 89 2HB PRO 89 -6.024 10.189 12.175 593 HG2 PRO 89 1HG PRO 89 -4.802 12.349 13.126 594 HG3 PRO 89 2HG PRO 89 -3.884 10.880 12.749 595 HD2 PRO 89 1HD PRO 89 -4.001 13.463 11.289 596 HD3 PRO 89 2HD PRO 89 -2.679 12.288 11.399 597 H GLU 90 H GLU 90 -6.341 12.830 9.292 598 HA GLU 90 HA GLU 90 -8.775 11.661 8.436 599 HB2 GLU 90 1HB GLU 90 -7.500 14.323 7.829 600 HB3 GLU 90 2HB GLU 90 -9.091 13.863 7.238 601 HG2 GLU 90 1HG GLU 90 -8.271 14.078 10.126 602 HG3 GLU 90 2HG GLU 90 -9.264 15.227 9.234 603 H TYR 91 H TYR 91 -5.689 12.028 6.890 604 HA TYR 91 HA TYR 91 -6.682 11.715 4.207 605 HB2 TYR 91 1HB TYR 91 -4.471 12.813 4.857 606 HB3 TYR 91 2HB TYR 91 -3.863 11.196 5.163 607 HD1 TYR 91 HD1 TYR 91 -5.378 13.305 2.503 608 HD2 TYR 91 HD2 TYR 91 -2.953 9.931 3.408 609 HE1 TYR 91 HE1 TYR 91 -4.792 13.094 0.126 610 HE2 TYR 91 HE2 TYR 91 -2.358 9.714 1.036 611 HH TYR 91 HH TYR 91 -3.301 10.349 -1.161 612 H GLU 92 H GLU 92 -5.308 9.623 6.696 613 HA GLU 92 HA GLU 92 -5.220 7.231 5.277 614 HB2 GLU 92 1HB GLU 92 -4.288 7.532 7.530 615 HB3 GLU 92 2HB GLU 92 -5.915 7.684 8.185 616 HG2 GLU 92 1HG GLU 92 -6.406 5.395 7.480 617 HG3 GLU 92 2HG GLU 92 -4.768 5.254 6.848 618 H LYS 93 H LYS 93 -7.862 8.661 7.160 619 HA LYS 93 HA LYS 93 -9.748 6.633 6.546 620 HB2 LYS 93 1HB LYS 93 -10.005 8.001 8.535 621 HB3 LYS 93 2HB LYS 93 -10.100 9.459 7.565 622 HG2 LYS 93 1HG LYS 93 -12.288 8.793 8.393 623 HG3 LYS 93 2HG LYS 93 -12.223 8.730 6.633 624 HD2 LYS 93 1HD LYS 93 -13.406 6.799 7.491 625 HD3 LYS 93 2HD LYS 93 -11.889 6.293 6.752 626 HE2 LYS 93 1HE LYS 93 -10.863 6.093 8.946 627 HE3 LYS 93 2HE LYS 93 -12.340 6.680 9.711 628 HZ1 LYS 93 1HZ LYS 93 -13.500 4.738 9.034 629 HZ2 LYS 93 2HZ LYS 93 -12.055 4.216 9.736 630 HZ3 LYS 93 3HZ LYS 93 -12.224 4.221 8.053 631 H LYS 94 H LYS 94 -8.631 9.475 4.938 632 HA LYS 94 HA LYS 94 -10.767 9.856 3.137 633 HB2 LYS 94 1HB LYS 94 -8.993 11.526 3.465 634 HB3 LYS 94 2HB LYS 94 -7.811 10.417 2.789 635 HG2 LYS 94 1HG LYS 94 -8.366 12.031 1.129 636 HG3 LYS 94 2HG LYS 94 -9.060 10.483 0.645 637 HD2 LYS 94 1HD LYS 94 -10.697 12.171 0.236 638 HD3 LYS 94 2HD LYS 94 -11.223 11.240 1.636 639 HE2 LYS 94 1HE LYS 94 -11.566 13.629 1.986 640 HE3 LYS 94 2HE LYS 94 -10.390 12.981 3.125 641 HZ1 LYS 94 1HZ LYS 94 -9.692 14.420 0.623 642 HZ2 LYS 94 2HZ LYS 94 -8.617 13.905 1.822 643 HZ3 LYS 94 3HZ LYS 94 -9.732 15.128 2.157 644 H LEU 95 H LEU 95 -7.706 8.067 2.813 645 HA LEU 95 HA LEU 95 -8.403 6.965 0.276 646 HB2 LEU 95 1HB LEU 95 -6.269 6.138 2.244 647 HB3 LEU 95 2HB LEU 95 -6.397 5.559 0.593 648 HG LEU 95 HG LEU 95 -5.878 8.419 1.419 649 HD11 LEU 95 1HD1 LEU 95 -3.667 8.053 0.440 650 HD12 LEU 95 2HD1 LEU 95 -4.073 6.362 0.161 651 HD13 LEU 95 3HD1 LEU 95 -3.960 6.980 1.807 652 HD21 LEU 95 1HD2 LEU 95 -6.031 7.161 -1.317 653 HD22 LEU 95 2HD2 LEU 95 -5.495 8.805 -0.978 654 HD23 LEU 95 3HD2 LEU 95 -7.159 8.334 -0.638 655 H GLN 96 H GLN 96 -8.691 5.903 3.598 656 HA GLN 96 HA GLN 96 -9.522 3.243 3.044 657 HB2 GLN 96 1HB GLN 96 -8.666 4.178 5.249 658 HB3 GLN 96 2HB GLN 96 -10.241 4.917 5.458 659 HG2 GLN 96 1HG GLN 96 -10.075 1.974 5.003 660 HG3 GLN 96 2HG GLN 96 -9.657 2.633 6.581 661 HE21 GLN 96 1HE2 GLN 96 -11.846 0.887 5.897 662 HE22 GLN 96 2HE2 GLN 96 -13.295 1.728 6.356 663 H LYS 97 H LYS 97 -11.071 6.327 2.944 664 HA LYS 97 HA LYS 97 -13.763 5.304 2.905 665 HB2 LYS 97 1HB LYS 97 -13.249 7.575 3.696 666 HB3 LYS 97 2HB LYS 97 -12.680 8.006 2.091 667 HG2 LYS 97 1HG LYS 97 -14.936 7.633 1.205 668 HG3 LYS 97 2HG LYS 97 -15.495 7.242 2.832 669 HD2 LYS 97 1HD LYS 97 -14.868 9.480 3.590 670 HD3 LYS 97 2HD LYS 97 -14.294 9.871 1.968 671 HE2 LYS 97 1HE LYS 97 -16.517 10.785 2.335 672 HE3 LYS 97 2HE LYS 97 -16.554 9.537 1.091 673 HZ1 LYS 97 1HZ LYS 97 -17.366 9.198 3.927 674 HZ2 LYS 97 2HZ LYS 97 -17.360 7.971 2.764 675 HZ3 LYS 97 3HZ LYS 97 -18.402 9.287 2.596 676 H TYR 98 H TYR 98 -11.285 5.920 0.532 677 HA TYR 98 HA TYR 98 -13.030 6.085 -1.715 678 HB2 TYR 98 1HB TYR 98 -10.079 5.820 -1.366 679 HB3 TYR 98 2HB TYR 98 -10.778 5.469 -2.943 680 HD1 TYR 98 HD1 TYR 98 -12.361 7.300 -3.914 681 HD2 TYR 98 HD2 TYR 98 -9.514 8.016 -0.840 682 HE1 TYR 98 HE1 TYR 98 -12.382 9.697 -4.460 683 HE2 TYR 98 HE2 TYR 98 -9.531 10.413 -1.372 684 HH TYR 98 HH TYR 98 -11.854 11.811 -3.501 685 H ALA 99 H ALA 99 -11.491 3.439 -0.051 686 HA ALA 99 HA ALA 99 -12.764 1.587 -1.959 687 HB1 ALA 99 1HB ALA 99 -10.071 1.227 -0.642 688 HB2 ALA 99 2HB ALA 99 -10.349 1.603 -2.344 689 HB3 ALA 99 3HB ALA 99 -10.878 0.055 -1.685 690 H ASP 100 H ASP 100 -13.783 -0.192 -1.051 691 HA ASP 100 HA ASP 100 -14.306 -0.027 1.780 692 HB2 ASP 100 1HB ASP 100 -16.169 -0.653 0.415 693 HB3 ASP 100 2HB ASP 100 -15.244 -1.919 -0.380 694 H ALA 101 H ALA 101 -12.625 -0.521 2.944 695 HA ALA 101 HA ALA 101 -11.736 -3.153 3.344 696 HB1 ALA 101 1HB ALA 101 -9.795 -1.380 1.851 697 HB2 ALA 101 2HB ALA 101 -10.574 -2.821 1.199 698 HB3 ALA 101 3HB ALA 101 -9.431 -2.965 2.536 699 H GLU 102 H GLU 102 -9.521 -2.962 4.642 700 HA GLU 102 HA GLU 102 -9.574 -0.414 6.085 701 HB2 GLU 102 1HB GLU 102 -8.758 -1.556 8.064 702 HB3 GLU 102 2HB GLU 102 -10.301 -2.198 7.562 703 HG2 GLU 102 1HG GLU 102 -9.314 -4.199 6.761 704 HG3 GLU 102 2HG GLU 102 -7.687 -3.524 6.904 705 H VAL 103 H VAL 103 -8.045 0.709 5.103 706 HA VAL 103 HA VAL 103 -5.635 -0.675 4.226 707 HB VAL 103 HB VAL 103 -6.924 0.751 2.605 708 HG11 VAL 103 1HG1 VAL 103 -6.801 3.117 2.674 709 HG12 VAL 103 2HG1 VAL 103 -5.718 3.085 4.071 710 HG13 VAL 103 3HG1 VAL 103 -7.408 2.584 4.244 711 HG21 VAL 103 1HG2 VAL 103 -4.963 1.702 1.562 712 HG22 VAL 103 2HG2 VAL 103 -4.573 0.129 2.258 713 HG23 VAL 103 3HG2 VAL 103 -4.076 1.605 3.082 714 H ARG 104 H ARG 104 -3.640 -0.169 4.872 715 HA ARG 104 HA ARG 104 -3.402 1.678 7.158 716 HB2 ARG 104 1HB ARG 104 -2.870 -0.805 7.448 717 HB3 ARG 104 2HB ARG 104 -1.494 -0.537 6.390 718 HG2 ARG 104 1HG ARG 104 -0.545 1.031 7.976 719 HG3 ARG 104 2HG ARG 104 -1.955 0.852 9.023 720 HD2 ARG 104 1HD ARG 104 0.085 -1.256 8.314 721 HD3 ARG 104 2HD ARG 104 -0.198 -0.526 9.894 722 HE ARG 104 HE ARG 104 -2.593 -1.659 9.183 723 HH11 ARG 104 1HH1 ARG 104 0.671 -2.818 9.797 724 HH12 ARG 104 2HH1 ARG 104 0.142 -4.427 10.180 725 HH21 ARG 104 1HH2 ARG 104 -3.250 -3.763 9.676 726 HH22 ARG 104 2HH2 ARG 104 -2.075 -4.981 10.087 727 H VAL 105 H VAL 105 -2.887 3.602 6.195 728 HA VAL 105 HA VAL 105 -1.093 3.597 3.932 729 HB VAL 105 HB VAL 105 -1.547 5.925 3.661 730 HG11 VAL 105 1HG1 VAL 105 -4.009 5.927 3.513 731 HG12 VAL 105 2HG1 VAL 105 -4.041 4.438 4.454 732 HG13 VAL 105 3HG1 VAL 105 -3.278 4.460 2.865 733 HG21 VAL 105 1HG2 VAL 105 -1.414 6.684 5.955 734 HG22 VAL 105 2HG2 VAL 105 -2.916 5.849 6.346 735 HG23 VAL 105 3HG2 VAL 105 -2.930 7.214 5.229 736 H ARG 106 H ARG 106 1.060 3.921 4.059 737 HA ARG 106 HA ARG 106 2.150 4.945 6.607 738 HB2 ARG 106 1HB ARG 106 3.286 2.702 4.924 739 HB3 ARG 106 2HB ARG 106 4.012 3.354 6.381 740 HG2 ARG 106 1HG ARG 106 1.308 2.041 6.330 741 HG3 ARG 106 2HG ARG 106 2.808 1.170 6.633 742 HD2 ARG 106 1HD ARG 106 2.012 1.622 8.767 743 HD3 ARG 106 2HD ARG 106 3.189 2.904 8.498 744 HE ARG 106 HE ARG 106 0.963 4.126 7.732 745 HH11 ARG 106 1HH1 ARG 106 1.549 2.099 10.522 746 HH12 ARG 106 2HH1 ARG 106 0.359 2.891 11.507 747 HH21 ARG 106 1HH2 ARG 106 -0.610 5.169 9.023 748 HH22 ARG 106 2HH2 ARG 106 -0.867 4.641 10.655 749 H THR 107 H THR 107 3.986 6.238 6.458 750 HA THR 107 HA THR 107 4.631 7.109 3.724 751 HB THR 107 HB THR 107 3.579 8.839 5.174 752 HG1 THR 107 HG1 THR 107 4.834 10.355 4.322 753 HG21 THR 107 1HG2 THR 107 6.118 8.584 6.786 754 HG22 THR 107 2HG2 THR 107 4.492 8.177 7.332 755 HG23 THR 107 3HG2 THR 107 4.908 9.853 6.975 756 H VAL 108 H VAL 108 6.760 7.300 3.093 757 HA VAL 108 HA VAL 108 8.829 6.489 5.017 758 HB VAL 108 HB VAL 108 9.923 5.144 3.188 759 HG11 VAL 108 1HG1 VAL 108 7.256 4.208 4.228 760 HG12 VAL 108 2HG1 VAL 108 8.818 4.051 5.032 761 HG13 VAL 108 3HG1 VAL 108 8.501 3.165 3.541 762 HG21 VAL 108 1HG2 VAL 108 7.198 5.382 1.912 763 HG22 VAL 108 2HG2 VAL 108 8.479 4.290 1.389 764 HG23 VAL 108 3HG2 VAL 108 8.709 6.035 1.279 765 H THR 109 H THR 109 10.925 7.220 4.562 766 HA THR 109 HA THR 109 11.108 9.226 2.409 767 HB THR 109 HB THR 109 12.828 10.341 3.972 768 HG1 THR 109 HG1 THR 109 12.311 8.296 5.478 769 HG21 THR 109 1HG2 THR 109 10.627 11.289 3.408 770 HG22 THR 109 2HG2 THR 109 11.096 11.648 5.067 771 HG23 THR 109 3HG2 THR 109 9.909 10.387 4.742 772 H SER 110 H SER 110 12.366 6.417 3.807 773 HA SER 110 HA SER 110 14.656 6.490 1.983 774 HB2 SER 110 1HB SER 110 14.760 5.558 4.864 775 HB3 SER 110 2HB SER 110 16.087 5.477 3.707 776 HG SER 110 HG SER 110 15.615 7.896 3.555 777 HA PRO 111 HA PRO 111 13.201 2.669 0.439 778 HB2 PRO 111 1HB PRO 111 16.058 1.829 0.511 779 HB3 PRO 111 2HB PRO 111 14.906 1.790 -0.828 780 HG2 PRO 111 1HG PRO 111 16.779 3.663 -0.729 781 HG3 PRO 111 2HG PRO 111 15.137 4.058 -1.266 782 HD2 PRO 111 1HD PRO 111 16.470 4.637 1.339 783 HD3 PRO 111 2HD PRO 111 15.312 5.615 0.419 784 H ASP 112 H ASP 112 15.445 2.502 3.169 785 HA ASP 112 HA ASP 112 14.896 -0.267 3.664 786 HB2 ASP 112 1HB ASP 112 16.354 1.844 5.228 787 HB3 ASP 112 2HB ASP 112 16.038 0.249 5.908 788 H GLU 113 H GLU 113 13.487 2.739 4.673 789 HA GLU 113 HA GLU 113 12.068 1.749 6.924 790 HB2 GLU 113 1HB GLU 113 11.319 4.042 5.101 791 HB3 GLU 113 2HB GLU 113 10.697 3.754 6.720 792 HG2 GLU 113 1HG GLU 113 12.940 4.088 7.633 793 HG3 GLU 113 2HG GLU 113 13.545 4.406 6.008 794 H ALA 114 H ALA 114 11.469 1.852 3.493 795 HA ALA 114 HA ALA 114 8.770 1.189 3.401 796 HB1 ALA 114 1HB ALA 114 10.976 0.394 1.502 797 HB2 ALA 114 2HB ALA 114 10.019 1.873 1.430 798 HB3 ALA 114 3HB ALA 114 9.251 0.311 1.152 799 H LYS 115 H LYS 115 11.597 -0.949 3.328 800 HA LYS 115 HA LYS 115 10.174 -3.370 3.339 801 HB2 LYS 115 1HB LYS 115 12.967 -2.741 4.304 802 HB3 LYS 115 2HB LYS 115 12.336 -4.366 4.073 803 HG2 LYS 115 1HG LYS 115 12.098 -4.001 1.712 804 HG3 LYS 115 2HG LYS 115 12.532 -2.302 1.889 805 HD2 LYS 115 1HD LYS 115 14.363 -4.595 2.588 806 HD3 LYS 115 2HD LYS 115 14.377 -3.758 1.035 807 HE2 LYS 115 1HE LYS 115 14.895 -1.660 2.158 808 HE3 LYS 115 2HE LYS 115 14.843 -2.468 3.722 809 HZ1 LYS 115 1HZ LYS 115 16.812 -2.874 1.542 810 HZ2 LYS 115 2HZ LYS 115 16.684 -3.906 2.880 811 HZ3 LYS 115 3HZ LYS 115 17.098 -2.279 3.108 812 H ARG 116 H ARG 116 11.125 -1.209 5.897 813 HA ARG 116 HA ARG 116 10.806 -2.987 8.077 814 HB2 ARG 116 1HB ARG 116 12.002 -0.744 8.070 815 HB3 ARG 116 2HB ARG 116 10.413 0.004 8.146 816 HG2 ARG 116 1HG ARG 116 9.994 -1.246 10.254 817 HG3 ARG 116 2HG ARG 116 11.662 -1.815 10.192 818 HD2 ARG 116 1HD ARG 116 11.640 0.068 11.630 819 HD3 ARG 116 2HD ARG 116 12.367 0.595 10.114 820 HE ARG 116 HE ARG 116 9.510 1.067 10.508 821 HH11 ARG 116 1HH1 ARG 116 12.758 2.366 10.363 822 HH12 ARG 116 2HH1 ARG 116 12.230 4.014 10.250 823 HH21 ARG 116 1HH2 ARG 116 8.815 3.235 10.383 824 HH22 ARG 116 2HH2 ARG 116 9.987 4.510 10.270 825 H TRP 117 H TRP 117 8.625 -0.645 6.529 826 HA TRP 117 HA TRP 117 6.426 -1.191 8.255 827 HB2 TRP 117 1HB TRP 117 6.568 0.098 5.529 828 HB3 TRP 117 2HB TRP 117 5.072 -0.057 6.444 829 HD1 TRP 117 HD1 TRP 117 7.753 2.328 5.842 830 HE1 TRP 117 HE1 TRP 117 7.787 4.177 7.632 831 HE3 TRP 117 HE3 TRP 117 4.729 0.131 9.329 832 HZ2 TRP 117 HZ2 TRP 117 6.686 4.636 10.187 833 HZ3 TRP 117 HZ3 TRP 117 4.274 1.344 11.422 834 HH2 TRP 117 HH2 TRP 117 5.232 3.548 11.840 835 H ILE 118 H ILE 118 7.546 -2.527 5.215 836 HA ILE 118 HA ILE 118 5.286 -4.036 4.545 837 HB ILE 118 HB ILE 118 8.208 -4.553 4.001 838 HG12 ILE 118 1HG1 ILE 118 5.987 -3.566 2.199 839 HG13 ILE 118 2HG1 ILE 118 7.157 -2.524 2.998 840 HG21 ILE 118 1HG2 ILE 118 7.092 -6.682 3.905 841 HG22 ILE 118 2HG2 ILE 118 7.419 -6.136 2.259 842 HG23 ILE 118 3HG2 ILE 118 5.793 -6.000 2.927 843 HD11 ILE 118 1HD1 ILE 118 7.694 -2.954 0.642 844 HD12 ILE 118 2HD1 ILE 118 7.845 -4.672 1.009 845 HD13 ILE 118 3HD1 ILE 118 8.955 -3.514 1.738 846 H LYS 119 H LYS 119 8.118 -4.897 6.517 847 HA LYS 119 HA LYS 119 7.348 -7.529 7.124 848 HB2 LYS 119 1HB LYS 119 9.613 -6.673 7.512 849 HB3 LYS 119 2HB LYS 119 9.005 -5.590 8.754 850 HG2 LYS 119 1HG LYS 119 8.339 -7.518 10.108 851 HG3 LYS 119 2HG LYS 119 8.962 -8.601 8.865 852 HD2 LYS 119 1HD LYS 119 10.617 -6.553 10.337 853 HD3 LYS 119 2HD LYS 119 10.521 -8.258 10.773 854 HE2 LYS 119 1HE LYS 119 11.442 -8.887 8.620 855 HE3 LYS 119 2HE LYS 119 11.459 -7.202 8.108 856 HZ1 LYS 119 1HZ LYS 119 13.089 -6.711 9.786 857 HZ2 LYS 119 2HZ LYS 119 13.642 -8.000 8.844 858 HZ3 LYS 119 3HZ LYS 119 13.021 -8.290 10.387 859 H GLU 120 H GLU 120 6.540 -4.457 8.596 860 HA GLU 120 HA GLU 120 5.345 -5.420 10.961 861 HB2 GLU 120 1HB GLU 120 6.098 -3.034 10.297 862 HB3 GLU 120 2HB GLU 120 4.525 -2.898 9.532 863 HG2 GLU 120 1HG GLU 120 4.908 -3.560 12.439 864 HG3 GLU 120 2HG GLU 120 4.714 -1.921 11.827 865 H PHE 121 H PHE 121 3.927 -4.406 7.861 866 HA PHE 121 HA PHE 121 1.247 -4.959 8.593 867 HB2 PHE 121 1HB PHE 121 1.832 -3.368 6.832 868 HB3 PHE 121 2HB PHE 121 2.517 -4.667 5.864 869 HD1 PHE 121 HD1 PHE 121 1.194 -5.821 4.341 870 HD2 PHE 121 HD2 PHE 121 -0.664 -3.490 7.378 871 HE1 PHE 121 HE1 PHE 121 -0.990 -6.164 3.264 872 HE2 PHE 121 HE2 PHE 121 -2.852 -3.833 6.307 873 HZ PHE 121 HZ PHE 121 -3.018 -5.170 4.247 874 H SER 122 H SER 122 3.699 -6.865 6.895 875 HA SER 122 HA SER 122 1.846 -8.901 6.118 876 HB2 SER 122 1HB SER 122 3.936 -10.168 5.508 877 HB3 SER 122 2HB SER 122 3.782 -8.583 4.749 878 HG SER 122 HG SER 122 5.342 -7.789 6.033 879 H GLU 123 H GLU 123 3.553 -8.212 8.989 880 HA GLU 123 HA GLU 123 3.766 -10.899 9.944 881 HB2 GLU 123 1HB GLU 123 5.229 -9.040 10.725 882 HB3 GLU 123 2HB GLU 123 3.838 -8.329 11.531 883 HG2 GLU 123 1HG GLU 123 5.262 -9.574 13.074 884 HG3 GLU 123 2HG GLU 123 3.642 -10.260 12.972 885 H GLU 124 H GLU 124 1.723 -8.153 10.954 886 HA GLU 124 HA GLU 124 -0.305 -8.042 11.961 887 HB2 GLU 124 1HB GLU 124 -0.564 -10.603 10.415 888 HB3 GLU 124 2HB GLU 124 -1.873 -10.024 11.432 889 HG2 GLU 124 1HG GLU 124 -0.648 -8.274 9.338 890 HG3 GLU 124 2HG GLU 124 -1.909 -9.439 8.938 Start of MODEL 14 1 HA MET 21 HA MET 21 -8.725 -11.706 2.872 2 HB2 MET 21 1HB MET 21 -7.246 -10.896 4.599 3 HB3 MET 21 2HB MET 21 -8.319 -12.097 5.301 4 HG2 MET 21 1HG MET 21 -5.475 -12.609 4.452 5 HG3 MET 21 2HG MET 21 -5.990 -12.254 6.097 6 HE1 MET 21 1HE MET 21 -4.247 -14.813 5.369 7 HE2 MET 21 2HE MET 21 -5.065 -16.033 6.345 8 HE3 MET 21 3HE MET 21 -4.802 -14.415 6.994 9 H THR 22 H THR 22 -7.172 -10.342 1.920 10 HA THR 22 HA THR 22 -4.735 -11.646 0.913 11 HB THR 22 HB THR 22 -6.421 -9.707 -0.693 12 HG1 THR 22 HG1 THR 22 -6.128 -12.494 -1.187 13 HG21 THR 22 1HG2 THR 22 -4.052 -9.674 -1.273 14 HG22 THR 22 2HG2 THR 22 -4.989 -10.428 -2.563 15 HG23 THR 22 3HG2 THR 22 -4.054 -11.428 -1.452 16 H LEU 23 H LEU 23 -2.913 -10.313 0.840 17 HA LEU 23 HA LEU 23 -3.246 -7.740 2.203 18 HB2 LEU 23 1HB LEU 23 -0.797 -9.473 1.904 19 HB3 LEU 23 2HB LEU 23 -0.846 -7.935 2.744 20 HG LEU 23 HG LEU 23 -2.286 -10.463 3.544 21 HD11 LEU 23 1HD1 LEU 23 0.090 -10.517 4.018 22 HD12 LEU 23 2HD1 LEU 23 -0.834 -10.354 5.511 23 HD13 LEU 23 3HD1 LEU 23 -0.017 -8.952 4.824 24 HD21 LEU 23 1HD2 LEU 23 -3.672 -8.546 4.058 25 HD22 LEU 23 2HD2 LEU 23 -2.307 -7.734 4.823 26 HD23 LEU 23 3HD2 LEU 23 -2.974 -9.200 5.539 27 H PHE 24 H PHE 24 -3.421 -6.158 0.812 28 HA PHE 24 HA PHE 24 -1.870 -6.208 -1.676 29 HB2 PHE 24 1HB PHE 24 -4.065 -4.306 -0.822 30 HB3 PHE 24 2HB PHE 24 -3.316 -4.378 -2.410 31 HD1 PHE 24 HD1 PHE 24 -5.554 -6.106 -0.064 32 HD2 PHE 24 HD2 PHE 24 -3.989 -5.994 -4.018 33 HE1 PHE 24 HE1 PHE 24 -7.267 -7.712 -0.782 34 HE2 PHE 24 HE2 PHE 24 -5.696 -7.602 -4.743 35 HZ PHE 24 HZ PHE 24 -7.341 -8.463 -3.128 36 H VAL 25 H VAL 25 -0.409 -4.575 -2.180 37 HA VAL 25 HA VAL 25 -0.065 -2.474 -0.185 38 HB VAL 25 HB VAL 25 1.576 -4.057 0.528 39 HG11 VAL 25 1HG1 VAL 25 2.648 -4.103 -2.287 40 HG12 VAL 25 2HG1 VAL 25 1.705 -5.388 -1.533 41 HG13 VAL 25 3HG1 VAL 25 3.299 -4.975 -0.899 42 HG21 VAL 25 1HG2 VAL 25 3.652 -2.779 0.222 43 HG22 VAL 25 2HG2 VAL 25 2.274 -1.734 0.566 44 HG23 VAL 25 3HG2 VAL 25 2.886 -1.869 -1.081 45 H LEU 26 H LEU 26 -0.024 -0.596 -1.079 46 HA LEU 26 HA LEU 26 0.820 -0.338 -3.892 47 HB2 LEU 26 1HB LEU 26 -0.642 1.853 -2.510 48 HB3 LEU 26 2HB LEU 26 -0.700 1.366 -4.189 49 HG LEU 26 HG LEU 26 -2.094 -0.027 -1.897 50 HD11 LEU 26 1HD1 LEU 26 -4.132 0.746 -2.967 51 HD12 LEU 26 2HD1 LEU 26 -3.185 1.582 -4.195 52 HD13 LEU 26 3HD1 LEU 26 -3.106 2.104 -2.513 53 HD21 LEU 26 1HD2 LEU 26 -2.208 -0.619 -4.846 54 HD22 LEU 26 2HD2 LEU 26 -3.131 -1.420 -3.575 55 HD23 LEU 26 3HD2 LEU 26 -1.378 -1.598 -3.637 56 H ILE 27 H ILE 27 2.001 1.722 -4.345 57 HA ILE 27 HA ILE 27 3.267 2.932 -2.038 58 HB ILE 27 HB ILE 27 4.715 1.048 -2.310 59 HG12 ILE 27 1HG1 ILE 27 6.005 3.464 -3.595 60 HG13 ILE 27 2HG1 ILE 27 5.811 3.207 -1.864 61 HG21 ILE 27 1HG2 ILE 27 4.104 0.396 -4.570 62 HG22 ILE 27 2HG2 ILE 27 5.857 0.522 -4.408 63 HG23 ILE 27 3HG2 ILE 27 4.952 1.801 -5.218 64 HD11 ILE 27 1HD1 ILE 27 7.264 1.255 -1.987 65 HD12 ILE 27 2HD1 ILE 27 8.070 2.702 -2.589 66 HD13 ILE 27 3HD1 ILE 27 7.452 1.503 -3.723 67 H LEU 28 H LEU 28 2.981 5.040 -2.462 68 HA LEU 28 HA LEU 28 3.445 5.978 -5.205 69 HB2 LEU 28 1HB LEU 28 1.697 6.761 -3.144 70 HB3 LEU 28 2HB LEU 28 2.890 8.041 -3.246 71 HG LEU 28 HG LEU 28 2.380 8.283 -5.657 72 HD11 LEU 28 1HD1 LEU 28 0.278 6.221 -5.026 73 HD12 LEU 28 2HD1 LEU 28 1.598 6.087 -6.188 74 HD13 LEU 28 3HD1 LEU 28 0.281 7.224 -6.478 75 HD21 LEU 28 1HD2 LEU 28 1.294 9.716 -4.017 76 HD22 LEU 28 2HD2 LEU 28 0.012 8.523 -3.807 77 HD23 LEU 28 3HD2 LEU 28 0.202 9.352 -5.354 78 H SER 29 H SER 29 5.675 5.340 -4.942 79 HA SER 29 HA SER 29 7.247 7.645 -4.163 80 HB2 SER 29 1HB SER 29 7.792 4.861 -3.107 81 HB3 SER 29 2HB SER 29 8.939 6.190 -3.022 82 HG SER 29 HG SER 29 6.420 6.763 -2.063 83 H ASN 30 H ASN 30 7.623 7.939 -6.454 84 HA ASN 30 HA ASN 30 8.544 5.635 -7.925 85 HB2 ASN 30 1HB ASN 30 8.852 7.340 -9.790 86 HB3 ASN 30 2HB ASN 30 7.213 7.137 -9.183 87 HD21 ASN 30 1HD2 ASN 30 9.848 9.289 -9.597 88 HD22 ASN 30 2HD2 ASN 30 9.083 10.694 -8.942 89 H ASP 31 H ASP 31 10.331 5.090 -6.701 90 HA ASP 31 HA ASP 31 12.750 6.565 -7.498 91 HB2 ASP 31 1HB ASP 31 12.373 6.405 -5.008 92 HB3 ASP 31 2HB ASP 31 12.489 4.657 -5.164 93 H LYS 32 H LYS 32 14.613 5.042 -8.014 94 HA LYS 32 HA LYS 32 13.544 2.720 -9.407 95 HB2 LYS 32 1HB LYS 32 16.334 3.882 -9.331 96 HB3 LYS 32 2HB LYS 32 15.870 2.474 -10.276 97 HG2 LYS 32 1HG LYS 32 14.707 5.233 -10.596 98 HG3 LYS 32 2HG LYS 32 15.956 4.525 -11.620 99 HD2 LYS 32 1HD LYS 32 14.414 2.756 -12.293 100 HD3 LYS 32 2HD LYS 32 13.168 3.431 -11.244 101 HE2 LYS 32 1HE LYS 32 14.435 4.881 -13.565 102 HE3 LYS 32 2HE LYS 32 12.888 4.041 -13.632 103 HZ1 LYS 32 1HZ LYS 32 12.590 6.405 -13.284 104 HZ2 LYS 32 2HZ LYS 32 13.530 6.351 -11.882 105 HZ3 LYS 32 3HZ LYS 32 12.047 5.543 -11.934 106 H LYS 33 H LYS 33 15.462 3.448 -6.570 107 HA LYS 33 HA LYS 33 16.202 0.645 -6.239 108 HB2 LYS 33 1HB LYS 33 16.819 3.049 -4.518 109 HB3 LYS 33 2HB LYS 33 17.471 1.434 -4.286 110 HG2 LYS 33 1HG LYS 33 18.597 1.570 -6.444 111 HG3 LYS 33 2HG LYS 33 17.932 3.187 -6.689 112 HD2 LYS 33 1HD LYS 33 19.108 3.958 -4.673 113 HD3 LYS 33 2HD LYS 33 19.794 2.345 -4.469 114 HE2 LYS 33 1HE LYS 33 20.225 4.158 -6.840 115 HE3 LYS 33 2HE LYS 33 21.376 3.883 -5.534 116 HZ1 LYS 33 1HZ LYS 33 20.391 1.855 -7.464 117 HZ2 LYS 33 2HZ LYS 33 21.423 1.527 -6.166 118 HZ3 LYS 33 3HZ LYS 33 21.939 2.535 -7.421 119 H LEU 34 H LEU 34 14.272 3.138 -4.647 120 HA LEU 34 HA LEU 34 13.460 1.714 -2.389 121 HB2 LEU 34 1HB LEU 34 13.035 4.203 -3.274 122 HB3 LEU 34 2HB LEU 34 11.496 3.504 -3.730 123 HG LEU 34 HG LEU 34 12.618 3.538 -0.928 124 HD11 LEU 34 1HD1 LEU 34 12.055 5.772 -1.679 125 HD12 LEU 34 2HD1 LEU 34 10.888 5.208 -0.483 126 HD13 LEU 34 3HD1 LEU 34 10.464 5.215 -2.195 127 HD21 LEU 34 1HD2 LEU 34 11.137 1.645 -1.299 128 HD22 LEU 34 2HD2 LEU 34 9.910 2.720 -1.965 129 HD23 LEU 34 3HD2 LEU 34 10.361 2.846 -0.266 130 H ILE 35 H ILE 35 11.916 1.948 -5.574 131 HA ILE 35 HA ILE 35 9.732 0.283 -5.071 132 HB ILE 35 HB ILE 35 11.202 0.951 -7.613 133 HG12 ILE 35 1HG1 ILE 35 8.481 1.737 -6.546 134 HG13 ILE 35 2HG1 ILE 35 9.925 2.744 -6.508 135 HG21 ILE 35 1HG2 ILE 35 8.662 -0.658 -7.384 136 HG22 ILE 35 2HG2 ILE 35 10.232 -1.266 -7.911 137 HG23 ILE 35 3HG2 ILE 35 9.384 -0.063 -8.881 138 HD11 ILE 35 1HD1 ILE 35 8.429 3.393 -8.307 139 HD12 ILE 35 2HD1 ILE 35 8.528 1.768 -8.987 140 HD13 ILE 35 3HD1 ILE 35 9.962 2.792 -8.940 141 H GLU 36 H GLU 36 12.978 -0.505 -6.312 142 HA GLU 36 HA GLU 36 12.492 -3.233 -6.740 143 HB2 GLU 36 1HB GLU 36 14.992 -1.654 -6.251 144 HB3 GLU 36 2HB GLU 36 15.046 -3.405 -6.406 145 HG2 GLU 36 1HG GLU 36 13.928 -1.514 -8.459 146 HG3 GLU 36 2HG GLU 36 15.526 -2.251 -8.514 147 H GLU 37 H GLU 37 14.010 -1.637 -3.920 148 HA GLU 37 HA GLU 37 14.358 -4.034 -2.477 149 HB2 GLU 37 1HB GLU 37 14.198 -1.176 -1.526 150 HB3 GLU 37 2HB GLU 37 14.595 -2.527 -0.476 151 HG2 GLU 37 1HG GLU 37 16.439 -2.999 -2.261 152 HG3 GLU 37 2HG GLU 37 16.187 -1.304 -2.674 153 H ALA 38 H ALA 38 11.653 -1.804 -2.687 154 HA ALA 38 HA ALA 38 10.202 -2.874 -0.491 155 HB1 ALA 38 1HB ALA 38 8.283 -1.682 -1.406 156 HB2 ALA 38 2HB ALA 38 9.154 -1.411 -2.917 157 HB3 ALA 38 3HB ALA 38 9.719 -0.658 -1.425 158 H ARG 39 H ARG 39 10.112 -3.514 -4.000 159 HA ARG 39 HA ARG 39 8.013 -5.404 -3.809 160 HB2 ARG 39 1HB ARG 39 8.491 -4.388 -5.956 161 HB3 ARG 39 2HB ARG 39 10.107 -5.083 -5.962 162 HG2 ARG 39 1HG ARG 39 9.220 -7.305 -6.129 163 HG3 ARG 39 2HG ARG 39 7.568 -6.718 -5.934 164 HD2 ARG 39 1HD ARG 39 7.863 -5.435 -8.057 165 HD3 ARG 39 2HD ARG 39 9.438 -6.205 -8.251 166 HE ARG 39 HE ARG 39 7.193 -8.014 -7.890 167 HH11 ARG 39 1HH1 ARG 39 9.292 -6.370 -10.172 168 HH12 ARG 39 2HH1 ARG 39 8.915 -7.446 -11.478 169 HH21 ARG 39 1HH2 ARG 39 6.700 -9.413 -9.595 170 HH22 ARG 39 2HH2 ARG 39 7.442 -9.191 -11.149 171 H LYS 40 H LYS 40 11.539 -5.727 -3.674 172 HA LYS 40 HA LYS 40 11.687 -8.496 -3.936 173 HB2 LYS 40 1HB LYS 40 13.421 -6.598 -2.357 174 HB3 LYS 40 2HB LYS 40 13.810 -8.300 -2.587 175 HG2 LYS 40 1HG LYS 40 13.911 -7.990 -4.981 176 HG3 LYS 40 2HG LYS 40 13.416 -6.307 -4.810 177 HD2 LYS 40 1HD LYS 40 15.461 -5.843 -3.541 178 HD3 LYS 40 2HD LYS 40 15.954 -7.527 -3.729 179 HE2 LYS 40 1HE LYS 40 15.482 -5.577 -5.985 180 HE3 LYS 40 2HE LYS 40 17.060 -6.040 -5.349 181 HZ1 LYS 40 1HZ LYS 40 16.641 -8.312 -6.023 182 HZ2 LYS 40 2HZ LYS 40 16.488 -7.277 -7.351 183 HZ3 LYS 40 3HZ LYS 40 15.108 -7.896 -6.599 184 H MET 41 H MET 41 10.947 -6.541 -1.111 185 HA MET 41 HA MET 41 10.814 -8.785 0.667 186 HB2 MET 41 1HB MET 41 10.206 -5.877 0.848 187 HB3 MET 41 2HB MET 41 9.463 -6.946 2.028 188 HG2 MET 41 1HG MET 41 11.564 -5.938 2.802 189 HG3 MET 41 2HG MET 41 11.603 -7.699 2.787 190 HE1 MET 41 1HE MET 41 14.216 -6.046 3.116 191 HE2 MET 41 2HE MET 41 15.310 -6.808 1.963 192 HE3 MET 41 3HE MET 41 14.242 -7.801 2.954 193 H ALA 42 H ALA 42 8.365 -6.684 -0.851 194 HA ALA 42 HA ALA 42 6.148 -8.029 0.295 195 HB1 ALA 42 1HB ALA 42 6.237 -6.276 -2.152 196 HB2 ALA 42 2HB ALA 42 6.039 -5.723 -0.489 197 HB3 ALA 42 3HB ALA 42 4.796 -6.724 -1.241 198 H GLU 43 H GLU 43 7.866 -8.461 -2.741 199 HA GLU 43 HA GLU 43 5.948 -10.076 -4.031 200 HB2 GLU 43 1HB GLU 43 8.011 -8.908 -5.028 201 HB3 GLU 43 2HB GLU 43 8.918 -10.302 -4.463 202 HG2 GLU 43 1HG GLU 43 8.348 -10.559 -6.791 203 HG3 GLU 43 2HG GLU 43 7.501 -11.764 -5.820 204 H LYS 44 H LYS 44 8.781 -10.813 -2.036 205 HA LYS 44 HA LYS 44 8.421 -13.644 -2.062 206 HB2 LYS 44 1HB LYS 44 9.919 -11.890 -0.122 207 HB3 LYS 44 2HB LYS 44 10.036 -13.643 -0.215 208 HG2 LYS 44 1HG LYS 44 10.859 -13.419 -2.537 209 HG3 LYS 44 2HG LYS 44 10.855 -11.664 -2.326 210 HD2 LYS 44 1HD LYS 44 12.367 -11.966 -0.376 211 HD3 LYS 44 2HD LYS 44 12.437 -13.683 -0.769 212 HE2 LYS 44 1HE LYS 44 13.465 -13.219 -2.886 213 HE3 LYS 44 2HE LYS 44 13.230 -11.485 -2.670 214 HZ1 LYS 44 1HZ LYS 44 15.497 -12.099 -2.183 215 HZ2 LYS 44 2HZ LYS 44 14.991 -13.224 -1.028 216 HZ3 LYS 44 3HZ LYS 44 14.735 -11.573 -0.769 217 H ALA 45 H ALA 45 7.201 -11.008 -0.162 218 HA ALA 45 HA ALA 45 6.119 -12.644 1.928 219 HB1 ALA 45 1HB ALA 45 5.565 -9.772 1.218 220 HB2 ALA 45 2HB ALA 45 6.747 -10.347 2.392 221 HB3 ALA 45 3HB ALA 45 5.024 -10.586 2.685 222 H ASN 46 H ASN 46 5.334 -12.325 -1.211 223 HA ASN 46 HA ASN 46 3.584 -12.951 -2.495 224 HB2 ASN 46 1HB ASN 46 2.538 -14.110 0.093 225 HB3 ASN 46 2HB ASN 46 1.840 -14.416 -1.492 226 HD21 ASN 46 1HD2 ASN 46 4.368 -14.576 -2.879 227 HD22 ASN 46 2HD2 ASN 46 5.104 -16.064 -2.392 228 H LEU 47 H LEU 47 3.614 -10.346 -1.373 229 HA LEU 47 HA LEU 47 0.798 -9.756 -0.875 230 HB2 LEU 47 1HB LEU 47 3.036 -7.765 -1.162 231 HB3 LEU 47 2HB LEU 47 1.476 -7.528 -0.410 232 HG LEU 47 HG LEU 47 3.802 -9.098 0.669 233 HD11 LEU 47 1HD1 LEU 47 3.680 -7.468 2.473 234 HD12 LEU 47 2HD1 LEU 47 2.320 -6.680 1.670 235 HD13 LEU 47 3HD1 LEU 47 3.913 -6.678 0.912 236 HD21 LEU 47 1HD2 LEU 47 1.058 -8.813 1.873 237 HD22 LEU 47 2HD2 LEU 47 2.443 -9.639 2.585 238 HD23 LEU 47 3HD2 LEU 47 1.688 -10.281 1.126 239 H ILE 48 H ILE 48 -0.377 -8.307 -2.227 240 HA ILE 48 HA ILE 48 0.508 -8.387 -4.995 241 HB ILE 48 HB ILE 48 -2.111 -7.393 -3.858 242 HG12 ILE 48 1HG1 ILE 48 -1.353 -10.000 -5.199 243 HG13 ILE 48 2HG1 ILE 48 -1.861 -9.786 -3.527 244 HG21 ILE 48 1HG2 ILE 48 -1.579 -6.312 -5.972 245 HG22 ILE 48 2HG2 ILE 48 -2.900 -7.459 -6.187 246 HG23 ILE 48 3HG2 ILE 48 -1.271 -7.881 -6.716 247 HD11 ILE 48 1HD1 ILE 48 -3.570 -9.322 -5.959 248 HD12 ILE 48 2HD1 ILE 48 -4.078 -9.119 -4.282 249 HD13 ILE 48 3HD1 ILE 48 -3.642 -10.719 -4.884 250 H LEU 49 H LEU 49 2.096 -6.933 -5.187 251 HA LEU 49 HA LEU 49 1.817 -4.266 -4.095 252 HB2 LEU 49 1HB LEU 49 3.977 -5.349 -3.927 253 HB3 LEU 49 2HB LEU 49 4.029 -5.590 -5.662 254 HG LEU 49 HG LEU 49 4.059 -3.086 -5.926 255 HD11 LEU 49 1HD1 LEU 49 3.137 -2.487 -3.748 256 HD12 LEU 49 2HD1 LEU 49 4.718 -1.746 -3.998 257 HD13 LEU 49 3HD1 LEU 49 4.562 -3.159 -2.954 258 HD21 LEU 49 1HD2 LEU 49 6.421 -2.873 -5.355 259 HD22 LEU 49 2HD2 LEU 49 6.080 -4.426 -6.118 260 HD23 LEU 49 3HD2 LEU 49 6.318 -4.332 -4.372 261 H ILE 50 H ILE 50 0.786 -2.749 -5.166 262 HA ILE 50 HA ILE 50 0.929 -2.762 -8.109 263 HB ILE 50 HB ILE 50 -1.060 -1.261 -6.394 264 HG12 ILE 50 1HG1 ILE 50 -1.447 -3.829 -7.956 265 HG13 ILE 50 2HG1 ILE 50 -1.349 -3.717 -6.203 266 HG21 ILE 50 1HG2 ILE 50 -2.261 -0.958 -8.512 267 HG22 ILE 50 2HG2 ILE 50 -0.958 -1.788 -9.362 268 HG23 ILE 50 3HG2 ILE 50 -0.649 -0.245 -8.566 269 HD11 ILE 50 1HD1 ILE 50 -3.647 -3.933 -6.959 270 HD12 ILE 50 2HD1 ILE 50 -3.476 -2.468 -7.927 271 HD13 ILE 50 3HD1 ILE 50 -3.381 -2.379 -6.168 272 H THR 51 H THR 51 2.713 -1.621 -8.571 273 HA THR 51 HA THR 51 3.490 0.655 -6.977 274 HB THR 51 HB THR 51 4.762 -0.391 -9.510 275 HG1 THR 51 HG1 THR 51 4.980 -1.150 -6.799 276 HG21 THR 51 1HG2 THR 51 5.838 1.341 -7.283 277 HG22 THR 51 2HG2 THR 51 5.449 1.878 -8.916 278 HG23 THR 51 3HG2 THR 51 6.768 0.737 -8.654 279 H VAL 52 H VAL 52 2.736 2.609 -7.309 280 HA VAL 52 HA VAL 52 2.143 3.506 -10.038 281 HB VAL 52 HB VAL 52 0.164 4.784 -8.998 282 HG11 VAL 52 1HG1 VAL 52 -0.129 2.948 -10.586 283 HG12 VAL 52 2HG1 VAL 52 -1.381 2.922 -9.343 284 HG13 VAL 52 3HG1 VAL 52 -0.034 1.785 -9.263 285 HG21 VAL 52 1HG2 VAL 52 -0.896 3.711 -7.068 286 HG22 VAL 52 2HG2 VAL 52 0.695 4.356 -6.663 287 HG23 VAL 52 3HG2 VAL 52 0.485 2.625 -6.920 288 H GLY 53 H GLY 53 2.705 5.642 -10.420 289 HA2 GLY 53 1HA GLY 53 3.528 7.188 -8.039 290 HA3 GLY 53 2HA GLY 53 4.475 7.196 -9.521 291 H ASP 54 H ASP 54 1.676 8.309 -7.910 292 HA ASP 54 HA ASP 54 1.390 10.790 -8.815 293 HB2 ASP 54 1HB ASP 54 1.239 9.868 -11.163 294 HB3 ASP 54 2HB ASP 54 -0.264 9.080 -10.695 295 H GLU 55 H GLU 55 -0.637 11.741 -8.112 296 HA GLU 55 HA GLU 55 -1.881 10.287 -6.035 297 HB2 GLU 55 1HB GLU 55 -2.733 12.850 -7.385 298 HB3 GLU 55 2HB GLU 55 -3.431 12.219 -5.903 299 HG2 GLU 55 1HG GLU 55 -1.143 12.336 -4.886 300 HG3 GLU 55 2HG GLU 55 -0.626 13.200 -6.333 301 H GLU 56 H GLU 56 -2.776 10.925 -9.381 302 HA GLU 56 HA GLU 56 -5.437 9.865 -9.033 303 HB2 GLU 56 1HB GLU 56 -3.929 10.538 -11.563 304 HB3 GLU 56 2HB GLU 56 -5.646 10.173 -11.458 305 HG2 GLU 56 1HG GLU 56 -4.224 12.535 -10.256 306 HG3 GLU 56 2HG GLU 56 -5.339 12.547 -11.622 307 H GLU 57 H GLU 57 -2.321 8.720 -10.085 308 HA GLU 57 HA GLU 57 -3.146 6.233 -11.129 309 HB2 GLU 57 1HB GLU 57 -0.570 7.180 -9.895 310 HB3 GLU 57 2HB GLU 57 -0.781 5.523 -10.438 311 HG2 GLU 57 1HG GLU 57 -1.226 7.883 -12.232 312 HG3 GLU 57 2HG GLU 57 0.340 7.093 -12.052 313 H LEU 58 H LEU 58 -2.476 7.365 -7.863 314 HA LEU 58 HA LEU 58 -2.626 4.844 -6.601 315 HB2 LEU 58 1HB LEU 58 -1.699 6.902 -5.546 316 HB3 LEU 58 2HB LEU 58 -3.330 7.536 -5.425 317 HG LEU 58 HG LEU 58 -3.941 5.669 -3.936 318 HD11 LEU 58 1HD1 LEU 58 -2.177 4.235 -3.010 319 HD12 LEU 58 2HD1 LEU 58 -1.029 4.925 -4.156 320 HD13 LEU 58 3HD1 LEU 58 -2.399 3.983 -4.741 321 HD21 LEU 58 1HD2 LEU 58 -3.185 7.758 -2.958 322 HD22 LEU 58 2HD2 LEU 58 -1.509 7.219 -3.058 323 HD23 LEU 58 3HD2 LEU 58 -2.640 6.390 -1.988 324 H LYS 59 H LYS 59 -5.054 7.233 -7.496 325 HA LYS 59 HA LYS 59 -7.280 6.137 -6.239 326 HB2 LYS 59 1HB LYS 59 -6.916 7.763 -8.709 327 HB3 LYS 59 2HB LYS 59 -8.501 7.103 -8.336 328 HG2 LYS 59 1HG LYS 59 -8.638 8.325 -6.316 329 HG3 LYS 59 2HG LYS 59 -6.934 8.775 -6.393 330 HD2 LYS 59 1HD LYS 59 -8.457 10.621 -7.020 331 HD3 LYS 59 2HD LYS 59 -7.344 10.178 -8.310 332 HE2 LYS 59 1HE LYS 59 -9.535 10.561 -9.234 333 HE3 LYS 59 2HE LYS 59 -9.138 8.851 -9.361 334 HZ1 LYS 59 1HZ LYS 59 -10.562 8.355 -7.541 335 HZ2 LYS 59 2HZ LYS 59 -11.434 9.325 -8.615 336 HZ3 LYS 59 3HZ LYS 59 -10.807 9.994 -7.198 337 H LYS 60 H LYS 60 -5.541 5.072 -8.985 338 HA LYS 60 HA LYS 60 -7.639 3.256 -9.832 339 HB2 LYS 60 1HB LYS 60 -4.851 3.638 -10.920 340 HB3 LYS 60 2HB LYS 60 -6.200 2.830 -11.718 341 HG2 LYS 60 1HG LYS 60 -7.396 4.848 -11.965 342 HG3 LYS 60 2HG LYS 60 -6.307 5.707 -10.861 343 HD2 LYS 60 1HD LYS 60 -5.863 6.301 -13.198 344 HD3 LYS 60 2HD LYS 60 -4.487 5.452 -12.496 345 HE2 LYS 60 1HE LYS 60 -4.948 4.668 -14.757 346 HE3 LYS 60 2HE LYS 60 -5.200 3.385 -13.577 347 HZ1 LYS 60 1HZ LYS 60 -6.961 3.444 -15.227 348 HZ2 LYS 60 2HZ LYS 60 -7.338 5.039 -14.810 349 HZ3 LYS 60 3HZ LYS 60 -7.576 3.793 -13.690 350 H ALA 61 H ALA 61 -4.375 3.133 -8.467 351 HA ALA 61 HA ALA 61 -4.091 0.351 -8.325 352 HB1 ALA 61 1HB ALA 61 -2.454 0.787 -6.551 353 HB2 ALA 61 2HB ALA 61 -3.024 2.451 -6.437 354 HB3 ALA 61 3HB ALA 61 -2.240 1.886 -7.910 355 H ILE 62 H ILE 62 -5.395 2.661 -5.986 356 HA ILE 62 HA ILE 62 -6.088 0.851 -3.962 357 HB ILE 62 HB ILE 62 -7.359 3.488 -4.718 358 HG12 ILE 62 1HG1 ILE 62 -5.423 2.775 -2.507 359 HG13 ILE 62 2HG1 ILE 62 -4.985 3.575 -4.013 360 HG21 ILE 62 1HG2 ILE 62 -7.756 1.843 -2.227 361 HG22 ILE 62 2HG2 ILE 62 -8.965 2.190 -3.464 362 HG23 ILE 62 3HG2 ILE 62 -8.329 3.495 -2.462 363 HD11 ILE 62 1HD1 ILE 62 -5.172 5.158 -2.181 364 HD12 ILE 62 2HD1 ILE 62 -6.844 4.665 -1.915 365 HD13 ILE 62 3HD1 ILE 62 -6.391 5.472 -3.417 366 H LYS 63 H LYS 63 -7.989 2.051 -6.710 367 HA LYS 63 HA LYS 63 -10.382 0.739 -5.950 368 HB2 LYS 63 1HB LYS 63 -10.260 2.729 -7.437 369 HB3 LYS 63 2HB LYS 63 -9.571 1.710 -8.691 370 HG2 LYS 63 1HG LYS 63 -11.589 0.432 -8.848 371 HG3 LYS 63 2HG LYS 63 -12.275 1.264 -7.453 372 HD2 LYS 63 1HD LYS 63 -13.193 2.142 -9.538 373 HD3 LYS 63 2HD LYS 63 -12.257 3.368 -8.684 374 HE2 LYS 63 1HE LYS 63 -10.342 2.899 -10.161 375 HE3 LYS 63 2HE LYS 63 -11.324 1.723 -11.033 376 HZ1 LYS 63 1HZ LYS 63 -11.871 4.632 -10.817 377 HZ2 LYS 63 2HZ LYS 63 -12.847 3.512 -11.626 378 HZ3 LYS 63 3HZ LYS 63 -11.285 3.827 -12.185 379 H LYS 64 H LYS 64 -7.662 -0.188 -7.976 380 HA LYS 64 HA LYS 64 -8.939 -2.489 -9.079 381 HB2 LYS 64 1HB LYS 64 -6.894 -1.201 -9.983 382 HB3 LYS 64 2HB LYS 64 -5.959 -2.145 -8.830 383 HG2 LYS 64 1HG LYS 64 -6.564 -4.189 -9.894 384 HG3 LYS 64 2HG LYS 64 -7.742 -3.370 -10.923 385 HD2 LYS 64 1HD LYS 64 -5.874 -3.716 -12.304 386 HD3 LYS 64 2HD LYS 64 -5.771 -2.023 -11.820 387 HE2 LYS 64 1HE LYS 64 -3.586 -2.928 -11.636 388 HE3 LYS 64 2HE LYS 64 -4.203 -2.749 -9.995 389 HZ1 LYS 64 1HZ LYS 64 -4.230 -5.282 -11.539 390 HZ2 LYS 64 2HZ LYS 64 -4.682 -5.089 -9.925 391 HZ3 LYS 64 3HZ LYS 64 -3.068 -4.879 -10.379 392 H ALA 65 H ALA 65 -6.817 -1.899 -6.316 393 HA ALA 65 HA ALA 65 -6.501 -4.591 -5.519 394 HB1 ALA 65 1HB ALA 65 -5.853 -3.679 -3.346 395 HB2 ALA 65 2HB ALA 65 -6.484 -2.100 -3.813 396 HB3 ALA 65 3HB ALA 65 -5.093 -2.779 -4.660 397 H ASP 66 H ASP 66 -8.909 -2.142 -4.786 398 HA ASP 66 HA ASP 66 -10.456 -3.454 -2.884 399 HB2 ASP 66 1HB ASP 66 -10.847 -1.136 -3.435 400 HB3 ASP 66 2HB ASP 66 -11.240 -1.547 -5.097 401 H ASP 67 H ASP 67 -10.566 -3.642 -6.407 402 HA ASP 67 HA ASP 67 -12.899 -5.233 -6.575 403 HB2 ASP 67 1HB ASP 67 -12.226 -3.935 -8.477 404 HB3 ASP 67 2HB ASP 67 -10.658 -4.732 -8.536 405 H ILE 68 H ILE 68 -9.447 -6.044 -6.612 406 HA ILE 68 HA ILE 68 -9.744 -8.789 -7.188 407 HB ILE 68 HB ILE 68 -7.546 -7.493 -5.573 408 HG12 ILE 68 1HG1 ILE 68 -7.612 -8.015 -8.550 409 HG13 ILE 68 2HG1 ILE 68 -7.944 -6.446 -7.821 410 HG21 ILE 68 1HG2 ILE 68 -7.567 -10.054 -7.169 411 HG22 ILE 68 2HG2 ILE 68 -7.597 -9.936 -5.410 412 HG23 ILE 68 3HG2 ILE 68 -6.183 -9.381 -6.308 413 HD11 ILE 68 1HD1 ILE 68 -5.691 -6.409 -6.882 414 HD12 ILE 68 2HD1 ILE 68 -5.665 -6.569 -8.638 415 HD13 ILE 68 3HD1 ILE 68 -5.362 -7.977 -7.620 416 H ALA 69 H ALA 69 -9.711 -6.987 -4.170 417 HA ALA 69 HA ALA 69 -9.368 -9.149 -2.425 418 HB1 ALA 69 1HB ALA 69 -10.107 -7.636 -0.677 419 HB2 ALA 69 2HB ALA 69 -10.738 -6.520 -1.888 420 HB3 ALA 69 3HB ALA 69 -9.004 -6.820 -1.783 421 H LYS 70 H LYS 70 -12.387 -7.331 -3.005 422 HA LYS 70 HA LYS 70 -13.882 -9.225 -1.485 423 HB2 LYS 70 1HB LYS 70 -15.831 -7.953 -2.160 424 HB3 LYS 70 2HB LYS 70 -14.574 -6.923 -1.486 425 HG2 LYS 70 1HG LYS 70 -13.901 -6.452 -3.892 426 HG3 LYS 70 2HG LYS 70 -15.421 -7.218 -4.355 427 HD2 LYS 70 1HD LYS 70 -15.807 -4.868 -4.259 428 HD3 LYS 70 2HD LYS 70 -16.592 -5.586 -2.851 429 HE2 LYS 70 1HE LYS 70 -14.779 -4.907 -1.429 430 HE3 LYS 70 2HE LYS 70 -13.846 -4.347 -2.814 431 HZ1 LYS 70 1HZ LYS 70 -14.799 -2.464 -1.802 432 HZ2 LYS 70 2HZ LYS 70 -16.334 -3.169 -1.721 433 HZ3 LYS 70 3HZ LYS 70 -15.683 -2.729 -3.217 434 H LYS 71 H LYS 71 -12.839 -9.241 -4.655 435 HA LYS 71 HA LYS 71 -14.813 -10.266 -6.210 436 HB2 LYS 71 1HB LYS 71 -12.548 -9.932 -7.029 437 HB3 LYS 71 2HB LYS 71 -11.957 -11.232 -6.006 438 HG2 LYS 71 1HG LYS 71 -13.410 -12.804 -7.283 439 HG3 LYS 71 2HG LYS 71 -13.788 -11.475 -8.381 440 HD2 LYS 71 1HD LYS 71 -11.403 -11.239 -8.898 441 HD3 LYS 71 2HD LYS 71 -11.041 -12.585 -7.816 442 HE2 LYS 71 1HE LYS 71 -12.422 -14.058 -9.214 443 HE3 LYS 71 2HE LYS 71 -12.739 -12.709 -10.305 444 HZ1 LYS 71 1HZ LYS 71 -10.090 -13.924 -9.742 445 HZ2 LYS 71 2HZ LYS 71 -10.346 -12.577 -10.732 446 HZ3 LYS 71 3HZ LYS 71 -10.981 -14.081 -11.170 447 H GLN 72 H GLN 72 -12.955 -12.027 -3.745 448 HA GLN 72 HA GLN 72 -14.823 -14.266 -4.153 449 HB2 GLN 72 1HB GLN 72 -12.715 -15.717 -3.540 450 HB3 GLN 72 2HB GLN 72 -13.007 -15.193 -5.192 451 HG2 GLN 72 1HG GLN 72 -11.380 -13.482 -5.040 452 HG3 GLN 72 2HG GLN 72 -11.248 -13.659 -3.294 453 HE21 GLN 72 1HE2 GLN 72 -9.184 -13.795 -5.364 454 HE22 GLN 72 2HE2 GLN 72 -8.429 -15.341 -5.167 455 H ASN 73 H ASN 73 -12.176 -13.394 -1.901 456 HA ASN 73 HA ASN 73 -13.902 -14.345 0.291 457 HB2 ASN 73 1HB ASN 73 -12.079 -15.910 -0.137 458 HB3 ASN 73 2HB ASN 73 -10.902 -14.612 0.027 459 HD21 ASN 73 1HD2 ASN 73 -13.107 -16.712 1.693 460 HD22 ASN 73 2HD2 ASN 73 -12.522 -16.391 3.290 461 H SER 74 H SER 74 -11.564 -12.022 -0.741 462 HA SER 74 HA SER 74 -10.910 -11.123 1.878 463 HB2 SER 74 1HB SER 74 -10.019 -10.067 -0.798 464 HB3 SER 74 2HB SER 74 -9.260 -9.751 0.765 465 HG SER 74 HG SER 74 -8.272 -11.483 -0.482 466 H SER 75 H SER 75 -13.690 -10.577 0.857 467 HA SER 75 HA SER 75 -14.206 -7.950 0.273 468 HB2 SER 75 1HB SER 75 -16.298 -8.292 1.730 469 HB3 SER 75 2HB SER 75 -16.049 -9.417 0.395 470 HG SER 75 HG SER 75 -15.818 -9.832 3.156 471 H GLU 76 H GLU 76 -13.209 -9.292 3.387 472 HA GLU 76 HA GLU 76 -12.666 -6.519 4.225 473 HB2 GLU 76 1HB GLU 76 -14.050 -7.753 5.864 474 HB3 GLU 76 2HB GLU 76 -12.815 -9.005 5.951 475 HG2 GLU 76 1HG GLU 76 -11.230 -7.431 6.874 476 HG3 GLU 76 2HG GLU 76 -12.395 -6.121 6.708 477 H ALA 77 H ALA 77 -10.721 -6.128 3.341 478 HA ALA 77 HA ALA 77 -8.607 -8.145 3.717 479 HB1 ALA 77 1HB ALA 77 -7.587 -7.360 1.664 480 HB2 ALA 77 2HB ALA 77 -8.845 -6.139 1.479 481 HB3 ALA 77 3HB ALA 77 -9.254 -7.849 1.360 482 H LYS 78 H LYS 78 -6.383 -7.125 3.593 483 HA LYS 78 HA LYS 78 -6.382 -4.563 5.037 484 HB2 LYS 78 1HB LYS 78 -4.364 -6.787 5.391 485 HB3 LYS 78 2HB LYS 78 -4.509 -5.317 6.346 486 HG2 LYS 78 1HG LYS 78 -6.723 -6.103 7.136 487 HG3 LYS 78 2HG LYS 78 -6.455 -7.612 6.264 488 HD2 LYS 78 1HD LYS 78 -5.849 -8.026 8.515 489 HD3 LYS 78 2HD LYS 78 -4.337 -7.873 7.617 490 HE2 LYS 78 1HE LYS 78 -4.144 -6.663 9.684 491 HE3 LYS 78 2HE LYS 78 -4.194 -5.513 8.350 492 HZ1 LYS 78 1HZ LYS 78 -6.656 -5.332 8.845 493 HZ2 LYS 78 2HZ LYS 78 -5.609 -4.656 9.983 494 HZ3 LYS 78 3HZ LYS 78 -6.336 -6.149 10.292 495 H ILE 79 H ILE 79 -5.254 -3.002 4.087 496 HA ILE 79 HA ILE 79 -3.463 -3.757 1.868 497 HB ILE 79 HB ILE 79 -5.233 -1.302 1.988 498 HG12 ILE 79 1HG1 ILE 79 -5.583 -3.837 0.368 499 HG13 ILE 79 2HG1 ILE 79 -6.570 -3.356 1.747 500 HG21 ILE 79 1HG2 ILE 79 -4.626 -1.044 -0.382 501 HG22 ILE 79 2HG2 ILE 79 -3.537 -2.424 -0.241 502 HG23 ILE 79 3HG2 ILE 79 -3.219 -0.953 0.678 503 HD11 ILE 79 1HD1 ILE 79 -7.702 -2.910 -0.354 504 HD12 ILE 79 2HD1 ILE 79 -6.363 -1.886 -0.874 505 HD13 ILE 79 3HD1 ILE 79 -7.355 -1.409 0.504 506 H LEU 80 H LEU 80 -1.576 -2.563 1.646 507 HA LEU 80 HA LEU 80 -1.043 -0.543 3.737 508 HB2 LEU 80 1HB LEU 80 0.248 -2.862 3.614 509 HB3 LEU 80 2HB LEU 80 1.150 -2.040 2.349 510 HG LEU 80 HG LEU 80 0.959 -1.217 5.253 511 HD11 LEU 80 1HD1 LEU 80 2.409 -3.131 4.812 512 HD12 LEU 80 2HD1 LEU 80 3.339 -1.712 5.287 513 HD13 LEU 80 3HD1 LEU 80 3.275 -2.198 3.594 514 HD21 LEU 80 1HD2 LEU 80 2.564 0.536 4.706 515 HD22 LEU 80 2HD2 LEU 80 1.047 0.766 3.836 516 HD23 LEU 80 3HD2 LEU 80 2.454 0.112 2.998 517 H ILE 81 H ILE 81 -0.609 1.459 2.948 518 HA ILE 81 HA ILE 81 0.307 1.633 0.152 519 HB ILE 81 HB ILE 81 -1.398 3.614 1.675 520 HG12 ILE 81 1HG1 ILE 81 -1.926 2.240 -0.960 521 HG13 ILE 81 2HG1 ILE 81 -2.499 1.598 0.573 522 HG21 ILE 81 1HG2 ILE 81 0.369 4.725 0.328 523 HG22 ILE 81 2HG2 ILE 81 -1.263 5.070 -0.247 524 HG23 ILE 81 3HG2 ILE 81 -0.252 3.904 -1.103 525 HD11 ILE 81 1HD1 ILE 81 -3.232 4.246 -0.661 526 HD12 ILE 81 2HD1 ILE 81 -3.773 3.682 0.920 527 HD13 ILE 81 3HD1 ILE 81 -4.259 2.817 -0.537 528 H LEU 82 H LEU 82 2.383 2.035 0.112 529 HA LEU 82 HA LEU 82 3.654 3.634 2.201 530 HB2 LEU 82 1HB LEU 82 4.827 2.210 -0.194 531 HB3 LEU 82 2HB LEU 82 5.749 2.998 1.070 532 HG LEU 82 HG LEU 82 3.924 0.645 1.551 533 HD11 LEU 82 1HD1 LEU 82 6.906 0.728 1.151 534 HD12 LEU 82 2HD1 LEU 82 5.727 -0.026 0.078 535 HD13 LEU 82 3HD1 LEU 82 5.990 -0.675 1.698 536 HD21 LEU 82 1HD2 LEU 82 5.117 0.491 3.669 537 HD22 LEU 82 2HD2 LEU 82 4.338 2.063 3.499 538 HD23 LEU 82 3HD2 LEU 82 6.074 1.909 3.244 539 H LEU 83 H LEU 83 3.305 5.784 1.874 540 HA LEU 83 HA LEU 83 3.761 6.789 -0.852 541 HB2 LEU 83 1HB LEU 83 2.069 8.520 -0.475 542 HB3 LEU 83 2HB LEU 83 1.389 6.906 -0.459 543 HG LEU 83 HG LEU 83 1.982 8.467 2.069 544 HD11 LEU 83 1HD1 LEU 83 -0.582 8.267 0.501 545 HD12 LEU 83 2HD1 LEU 83 0.407 9.712 0.700 546 HD13 LEU 83 3HD1 LEU 83 -0.405 9.001 2.095 547 HD21 LEU 83 1HD2 LEU 83 0.499 6.928 3.135 548 HD22 LEU 83 2HD2 LEU 83 1.703 5.988 2.255 549 HD23 LEU 83 3HD2 LEU 83 0.082 6.182 1.595 550 H GLU 84 H GLU 84 5.048 8.571 -1.073 551 HA GLU 84 HA GLU 84 6.154 9.647 1.412 552 HB2 GLU 84 1HB GLU 84 7.743 9.035 -0.363 553 HB3 GLU 84 2HB GLU 84 6.936 10.132 -1.476 554 HG2 GLU 84 1HG GLU 84 7.547 12.015 0.016 555 HG3 GLU 84 2HG GLU 84 8.458 10.881 1.010 556 H LYS 85 H LYS 85 4.548 10.891 2.175 557 HA LYS 85 HA LYS 85 4.685 13.583 1.440 558 HB2 LYS 85 1HB LYS 85 2.379 14.026 0.781 559 HB3 LYS 85 2HB LYS 85 3.122 12.914 -0.355 560 HG2 LYS 85 1HG LYS 85 1.996 11.054 0.925 561 HG3 LYS 85 2HG LYS 85 1.083 12.312 1.763 562 HD2 LYS 85 1HD LYS 85 1.126 11.773 -1.205 563 HD3 LYS 85 2HD LYS 85 -0.218 11.489 -0.099 564 HE2 LYS 85 1HE LYS 85 -0.442 13.861 0.302 565 HE3 LYS 85 2HE LYS 85 0.983 14.193 -0.681 566 HZ1 LYS 85 1HZ LYS 85 -1.558 13.009 -1.668 567 HZ2 LYS 85 2HZ LYS 85 -0.189 13.339 -2.610 568 HZ3 LYS 85 3HZ LYS 85 -1.056 14.609 -1.905 569 HA PRO 86 HA PRO 86 3.018 13.682 5.623 570 HB2 PRO 86 1HB PRO 86 1.561 16.151 5.240 571 HB3 PRO 86 2HB PRO 86 3.070 15.897 6.115 572 HG2 PRO 86 1HG PRO 86 2.884 17.307 3.780 573 HG3 PRO 86 2HG PRO 86 4.354 16.485 4.322 574 HD2 PRO 86 1HD PRO 86 2.333 15.620 2.295 575 HD3 PRO 86 2HD PRO 86 4.101 15.439 2.276 576 H VAL 87 H VAL 87 1.430 12.512 6.350 577 HA VAL 87 HA VAL 87 -1.074 12.468 4.824 578 HB VAL 87 HB VAL 87 -0.110 10.392 6.782 579 HG11 VAL 87 1HG1 VAL 87 -2.484 10.373 6.334 580 HG12 VAL 87 2HG1 VAL 87 -1.710 8.964 5.607 581 HG13 VAL 87 3HG1 VAL 87 -2.172 10.336 4.599 582 HG21 VAL 87 1HG2 VAL 87 0.256 10.442 3.786 583 HG22 VAL 87 2HG2 VAL 87 0.618 9.075 4.840 584 HG23 VAL 87 3HG2 VAL 87 1.534 10.574 4.994 585 H SER 88 H SER 88 -2.747 13.461 5.714 586 HA SER 88 HA SER 88 -2.809 13.952 8.579 587 HB2 SER 88 1HB SER 88 -4.726 14.831 6.403 588 HB3 SER 88 2HB SER 88 -4.693 15.424 8.064 589 HG SER 88 HG SER 88 -2.293 15.818 7.314 590 HA PRO 89 HA PRO 89 -5.576 10.737 9.834 591 HB2 PRO 89 1HB PRO 89 -7.736 12.278 10.801 592 HB3 PRO 89 2HB PRO 89 -6.380 11.648 11.738 593 HG2 PRO 89 1HG PRO 89 -6.799 14.360 10.600 594 HG3 PRO 89 2HG PRO 89 -5.943 13.876 12.073 595 HD2 PRO 89 1HD PRO 89 -4.625 14.649 9.873 596 HD3 PRO 89 2HD PRO 89 -4.000 13.358 10.919 597 H GLU 90 H GLU 90 -7.431 13.446 8.449 598 HA GLU 90 HA GLU 90 -9.537 11.964 7.401 599 HB2 GLU 90 1HB GLU 90 -8.342 14.620 6.720 600 HB3 GLU 90 2HB GLU 90 -9.600 13.949 5.693 601 HG2 GLU 90 1HG GLU 90 -10.430 15.524 7.410 602 HG3 GLU 90 2HG GLU 90 -11.159 13.924 7.497 603 H TYR 91 H TYR 91 -6.377 12.686 6.021 604 HA TYR 91 HA TYR 91 -6.880 11.925 3.371 605 HB2 TYR 91 1HB TYR 91 -4.806 13.097 4.420 606 HB3 TYR 91 2HB TYR 91 -4.228 11.464 4.715 607 HD1 TYR 91 HD1 TYR 91 -4.710 14.068 2.258 608 HD2 TYR 91 HD2 TYR 91 -3.773 9.949 2.768 609 HE1 TYR 91 HE1 TYR 91 -3.802 14.000 -0.026 610 HE2 TYR 91 HE2 TYR 91 -2.861 9.871 0.485 611 HH TYR 91 HH TYR 91 -3.246 11.223 -1.702 612 H GLU 92 H GLU 92 -5.830 10.068 6.181 613 HA GLU 92 HA GLU 92 -5.372 7.599 4.984 614 HB2 GLU 92 1HB GLU 92 -4.756 8.093 7.288 615 HB3 GLU 92 2HB GLU 92 -6.449 8.262 7.729 616 HG2 GLU 92 1HG GLU 92 -6.801 5.873 7.179 617 HG3 GLU 92 2HG GLU 92 -5.072 5.752 6.830 618 H LYS 93 H LYS 93 -8.325 8.820 6.547 619 HA LYS 93 HA LYS 93 -9.775 6.451 5.985 620 HB2 LYS 93 1HB LYS 93 -11.722 7.647 6.867 621 HB3 LYS 93 2HB LYS 93 -10.329 7.781 7.927 622 HG2 LYS 93 1HG LYS 93 -9.897 10.033 6.932 623 HG3 LYS 93 2HG LYS 93 -11.441 9.884 6.090 624 HD2 LYS 93 1HD LYS 93 -11.036 9.802 9.081 625 HD3 LYS 93 2HD LYS 93 -11.689 11.158 8.160 626 HE2 LYS 93 1HE LYS 93 -13.588 9.818 7.477 627 HE3 LYS 93 2HE LYS 93 -12.921 8.407 8.295 628 HZ1 LYS 93 1HZ LYS 93 -13.134 9.583 10.398 629 HZ2 LYS 93 2HZ LYS 93 -14.629 9.454 9.621 630 HZ3 LYS 93 3HZ LYS 93 -13.793 10.920 9.605 631 H LYS 94 H LYS 94 -9.153 9.294 4.134 632 HA LYS 94 HA LYS 94 -11.342 9.078 2.344 633 HB2 LYS 94 1HB LYS 94 -8.536 10.098 1.851 634 HB3 LYS 94 2HB LYS 94 -9.865 10.265 0.717 635 HG2 LYS 94 1HG LYS 94 -9.662 11.501 3.451 636 HG3 LYS 94 2HG LYS 94 -9.546 12.326 1.898 637 HD2 LYS 94 1HD LYS 94 -11.883 11.597 1.418 638 HD3 LYS 94 2HD LYS 94 -11.968 10.968 3.065 639 HE2 LYS 94 1HE LYS 94 -12.963 13.159 3.009 640 HE3 LYS 94 2HE LYS 94 -11.454 13.229 3.917 641 HZ1 LYS 94 1HZ LYS 94 -11.679 15.104 2.414 642 HZ2 LYS 94 2HZ LYS 94 -11.805 14.062 1.087 643 HZ3 LYS 94 3HZ LYS 94 -10.361 14.142 1.965 644 H LEU 95 H LEU 95 -8.059 7.747 2.285 645 HA LEU 95 HA LEU 95 -8.463 6.266 -0.125 646 HB2 LEU 95 1HB LEU 95 -6.384 5.774 2.005 647 HB3 LEU 95 2HB LEU 95 -6.311 5.284 0.325 648 HG LEU 95 HG LEU 95 -6.155 8.112 1.369 649 HD11 LEU 95 1HD1 LEU 95 -3.871 8.027 0.464 650 HD12 LEU 95 2HD1 LEU 95 -4.103 6.322 0.079 651 HD13 LEU 95 3HD1 LEU 95 -4.127 6.859 1.759 652 HD21 LEU 95 1HD2 LEU 95 -7.330 8.068 -0.759 653 HD22 LEU 95 2HD2 LEU 95 -6.045 7.091 -1.469 654 HD23 LEU 95 3HD2 LEU 95 -5.715 8.747 -0.959 655 H GLN 96 H GLN 96 -8.697 5.610 3.299 656 HA GLN 96 HA GLN 96 -9.033 2.797 3.111 657 HB2 GLN 96 1HB GLN 96 -8.273 4.038 5.136 658 HB3 GLN 96 2HB GLN 96 -9.892 4.686 5.307 659 HG2 GLN 96 1HG GLN 96 -10.781 2.541 5.785 660 HG3 GLN 96 2HG GLN 96 -9.255 1.743 5.397 661 HE21 GLN 96 1HE2 GLN 96 -10.987 3.694 7.699 662 HE22 GLN 96 2HE2 GLN 96 -9.868 3.498 9.004 663 H LYS 97 H LYS 97 -11.220 5.525 2.914 664 HA LYS 97 HA LYS 97 -13.597 3.885 2.934 665 HB2 LYS 97 1HB LYS 97 -13.635 6.224 3.716 666 HB3 LYS 97 2HB LYS 97 -13.227 6.764 2.095 667 HG2 LYS 97 1HG LYS 97 -15.335 5.782 1.276 668 HG3 LYS 97 2HG LYS 97 -15.748 5.355 2.938 669 HD2 LYS 97 1HD LYS 97 -15.679 7.705 3.569 670 HD3 LYS 97 2HD LYS 97 -15.227 8.146 1.923 671 HE2 LYS 97 1HE LYS 97 -17.794 6.779 2.717 672 HE3 LYS 97 2HE LYS 97 -17.622 8.500 2.385 673 HZ1 LYS 97 1HZ LYS 97 -18.479 7.306 0.474 674 HZ2 LYS 97 2HZ LYS 97 -17.117 6.309 0.447 675 HZ3 LYS 97 3HZ LYS 97 -16.960 7.962 0.126 676 H TYR 98 H TYR 98 -11.395 5.179 0.565 677 HA TYR 98 HA TYR 98 -12.998 5.054 -1.732 678 HB2 TYR 98 1HB TYR 98 -10.612 6.052 -1.331 679 HB3 TYR 98 2HB TYR 98 -10.058 4.454 -1.815 680 HD1 TYR 98 HD1 TYR 98 -10.158 3.756 -4.116 681 HD2 TYR 98 HD2 TYR 98 -11.815 7.487 -2.920 682 HE1 TYR 98 HE1 TYR 98 -10.312 4.439 -6.472 683 HE2 TYR 98 HE2 TYR 98 -11.981 8.173 -5.274 684 HH TYR 98 HH TYR 98 -11.633 6.029 -7.855 685 H ALA 99 H ALA 99 -10.672 2.692 -0.456 686 HA ALA 99 HA ALA 99 -12.095 0.563 -1.917 687 HB1 ALA 99 1HB ALA 99 -9.717 0.624 -2.415 688 HB2 ALA 99 2HB ALA 99 -10.085 -0.814 -1.462 689 HB3 ALA 99 3HB ALA 99 -9.331 0.584 -0.695 690 H ASP 100 H ASP 100 -13.404 -0.725 -0.697 691 HA ASP 100 HA ASP 100 -13.555 -0.168 2.116 692 HB2 ASP 100 1HB ASP 100 -15.569 -0.688 0.727 693 HB3 ASP 100 2HB ASP 100 -14.983 -2.340 0.564 694 H ALA 101 H ALA 101 -11.925 -0.810 3.237 695 HA ALA 101 HA ALA 101 -11.387 -3.498 3.880 696 HB1 ALA 101 1HB ALA 101 -10.325 -3.537 1.663 697 HB2 ALA 101 2HB ALA 101 -9.119 -3.678 2.942 698 HB3 ALA 101 3HB ALA 101 -9.342 -2.142 2.107 699 H GLU 102 H GLU 102 -8.872 -3.325 4.868 700 HA GLU 102 HA GLU 102 -8.921 -0.859 6.480 701 HB2 GLU 102 1HB GLU 102 -7.461 -3.360 7.270 702 HB3 GLU 102 2HB GLU 102 -8.001 -2.024 8.272 703 HG2 GLU 102 1HG GLU 102 -10.295 -2.722 8.048 704 HG3 GLU 102 2HG GLU 102 -9.817 -4.016 6.948 705 H VAL 103 H VAL 103 -7.666 0.363 5.022 706 HA VAL 103 HA VAL 103 -5.071 -0.699 4.271 707 HB VAL 103 HB VAL 103 -6.425 0.643 2.630 708 HG11 VAL 103 1HG1 VAL 103 -6.533 3.011 2.767 709 HG12 VAL 103 2HG1 VAL 103 -5.517 3.036 4.212 710 HG13 VAL 103 3HG1 VAL 103 -7.158 2.376 4.290 711 HG21 VAL 103 1HG2 VAL 103 -4.008 0.265 2.391 712 HG22 VAL 103 2HG2 VAL 103 -3.705 1.763 3.271 713 HG23 VAL 103 3HG2 VAL 103 -4.523 1.807 1.710 714 H ARG 104 H ARG 104 -3.232 -0.247 5.210 715 HA ARG 104 HA ARG 104 -3.220 1.713 7.394 716 HB2 ARG 104 1HB ARG 104 -2.602 -0.705 7.838 717 HB3 ARG 104 2HB ARG 104 -1.190 -0.452 6.824 718 HG2 ARG 104 1HG ARG 104 -0.271 1.117 8.349 719 HG3 ARG 104 2HG ARG 104 -1.772 1.183 9.279 720 HD2 ARG 104 1HD ARG 104 0.038 -1.212 8.981 721 HD3 ARG 104 2HD ARG 104 -0.112 -0.194 10.413 722 HE ARG 104 HE ARG 104 -2.644 -1.027 10.023 723 HH11 ARG 104 1HH1 ARG 104 0.397 -2.755 10.216 724 HH12 ARG 104 2HH1 ARG 104 -0.326 -4.213 10.832 725 HH21 ARG 104 1HH2 ARG 104 -3.594 -2.944 10.833 726 HH22 ARG 104 2HH2 ARG 104 -2.589 -4.326 11.169 727 H VAL 105 H VAL 105 -2.714 3.631 6.468 728 HA VAL 105 HA VAL 105 -0.943 3.736 4.217 729 HB VAL 105 HB VAL 105 -1.295 6.130 4.190 730 HG11 VAL 105 1HG1 VAL 105 -3.734 6.172 3.911 731 HG12 VAL 105 2HG1 VAL 105 -3.841 4.610 4.725 732 HG13 VAL 105 3HG1 VAL 105 -3.001 4.744 3.179 733 HG21 VAL 105 1HG2 VAL 105 -1.242 6.665 6.528 734 HG22 VAL 105 2HG2 VAL 105 -2.714 5.738 6.819 735 HG23 VAL 105 3HG2 VAL 105 -2.776 7.213 5.854 736 H ARG 106 H ARG 106 1.187 4.169 4.213 737 HA ARG 106 HA ARG 106 2.422 4.984 6.758 738 HB2 ARG 106 1HB ARG 106 3.240 2.773 4.888 739 HB3 ARG 106 2HB ARG 106 4.367 3.480 6.033 740 HG2 ARG 106 1HG ARG 106 1.775 2.109 6.728 741 HG3 ARG 106 2HG ARG 106 3.391 1.415 6.884 742 HD2 ARG 106 1HD ARG 106 3.960 3.285 8.432 743 HD3 ARG 106 2HD ARG 106 2.274 3.790 8.363 744 HE ARG 106 HE ARG 106 2.587 1.044 9.129 745 HH11 ARG 106 1HH1 ARG 106 2.616 4.349 10.269 746 HH12 ARG 106 2HH1 ARG 106 2.252 3.930 11.913 747 HH21 ARG 106 1HH2 ARG 106 2.105 0.475 11.308 748 HH22 ARG 106 2HH2 ARG 106 1.940 1.729 12.497 749 H THR 107 H THR 107 3.686 6.696 6.600 750 HA THR 107 HA THR 107 4.333 7.740 3.976 751 HB THR 107 HB THR 107 3.488 9.309 5.648 752 HG1 THR 107 HG1 THR 107 4.726 10.719 4.709 753 HG21 THR 107 1HG2 THR 107 4.832 9.927 7.609 754 HG22 THR 107 2HG2 THR 107 5.967 8.632 7.231 755 HG23 THR 107 3HG2 THR 107 4.307 8.245 7.679 756 H VAL 108 H VAL 108 6.238 7.525 3.009 757 HA VAL 108 HA VAL 108 8.545 6.648 4.621 758 HB VAL 108 HB VAL 108 9.283 5.236 2.719 759 HG11 VAL 108 1HG1 VAL 108 7.694 3.404 3.082 760 HG12 VAL 108 2HG1 VAL 108 6.566 4.538 3.825 761 HG13 VAL 108 3HG1 VAL 108 8.121 4.212 4.591 762 HG21 VAL 108 1HG2 VAL 108 8.068 6.363 0.923 763 HG22 VAL 108 2HG2 VAL 108 6.537 5.804 1.598 764 HG23 VAL 108 3HG2 VAL 108 7.696 4.639 0.955 765 H THR 109 H THR 109 10.613 7.207 3.753 766 HA THR 109 HA THR 109 10.576 9.196 1.586 767 HB THR 109 HB THR 109 12.407 10.420 2.867 768 HG1 THR 109 HG1 THR 109 11.785 8.427 4.658 769 HG21 THR 109 1HG2 THR 109 10.153 11.332 2.650 770 HG22 THR 109 2HG2 THR 109 10.813 11.679 4.248 771 HG23 THR 109 3HG2 THR 109 9.626 10.390 4.046 772 H SER 110 H SER 110 12.073 6.520 3.162 773 HA SER 110 HA SER 110 13.969 6.323 0.952 774 HB2 SER 110 1HB SER 110 14.765 6.156 3.868 775 HB3 SER 110 2HB SER 110 15.816 5.759 2.508 776 HG SER 110 HG SER 110 14.662 8.194 2.197 777 HA PRO 111 HA PRO 111 12.750 2.194 0.424 778 HB2 PRO 111 1HB PRO 111 15.608 1.403 0.704 779 HB3 PRO 111 2HB PRO 111 14.450 1.009 -0.569 780 HG2 PRO 111 1HG PRO 111 16.337 2.868 -0.933 781 HG3 PRO 111 2HG PRO 111 14.720 3.040 -1.631 782 HD2 PRO 111 1HD PRO 111 15.954 4.470 0.649 783 HD3 PRO 111 2HD PRO 111 14.683 5.000 -0.467 784 H ASP 112 H ASP 112 15.277 2.460 2.922 785 HA ASP 112 HA ASP 112 14.823 -0.034 4.086 786 HB2 ASP 112 1HB ASP 112 16.217 2.440 4.931 787 HB3 ASP 112 2HB ASP 112 15.835 1.259 6.182 788 H GLU 113 H GLU 113 13.191 3.013 4.631 789 HA GLU 113 HA GLU 113 11.807 2.228 6.981 790 HB2 GLU 113 1HB GLU 113 10.938 4.201 4.858 791 HB3 GLU 113 2HB GLU 113 10.303 4.090 6.494 792 HG2 GLU 113 1HG GLU 113 12.418 4.773 7.413 793 HG3 GLU 113 2HG GLU 113 13.155 4.762 5.808 794 H ALA 114 H ALA 114 11.026 2.131 3.544 795 HA ALA 114 HA ALA 114 8.404 1.187 3.704 796 HB1 ALA 114 1HB ALA 114 10.484 0.804 1.558 797 HB2 ALA 114 2HB ALA 114 9.268 2.079 1.650 798 HB3 ALA 114 3HB ALA 114 8.779 0.408 1.371 799 H LYS 115 H LYS 115 11.465 -0.580 3.485 800 HA LYS 115 HA LYS 115 10.422 -3.165 3.262 801 HB2 LYS 115 1HB LYS 115 13.018 -2.156 4.422 802 HB3 LYS 115 2HB LYS 115 12.649 -3.869 4.268 803 HG2 LYS 115 1HG LYS 115 12.447 -3.631 1.858 804 HG3 LYS 115 2HG LYS 115 12.755 -1.899 1.990 805 HD2 LYS 115 1HD LYS 115 14.694 -4.021 2.903 806 HD3 LYS 115 2HD LYS 115 14.739 -3.282 1.303 807 HE2 LYS 115 1HE LYS 115 14.964 -1.065 2.404 808 HE3 LYS 115 2HE LYS 115 15.064 -1.895 3.956 809 HZ1 LYS 115 1HZ LYS 115 16.954 -2.300 1.697 810 HZ2 LYS 115 2HZ LYS 115 17.070 -2.976 3.250 811 HZ3 LYS 115 3HZ LYS 115 17.247 -1.304 3.042 812 H ARG 116 H ARG 116 10.963 -1.140 6.069 813 HA ARG 116 HA ARG 116 10.618 -3.149 8.038 814 HB2 ARG 116 1HB ARG 116 10.163 -0.167 8.227 815 HB3 ARG 116 2HB ARG 116 10.275 -1.267 9.592 816 HG2 ARG 116 1HG ARG 116 12.571 -1.764 9.060 817 HG3 ARG 116 2HG ARG 116 12.474 -0.776 7.601 818 HD2 ARG 116 1HD ARG 116 11.966 1.187 9.038 819 HD3 ARG 116 2HD ARG 116 12.239 0.169 10.452 820 HE ARG 116 HE ARG 116 14.516 -0.130 9.036 821 HH11 ARG 116 1HH1 ARG 116 12.746 2.658 10.169 822 HH12 ARG 116 2HH1 ARG 116 14.155 3.665 10.289 823 HH21 ARG 116 1HH2 ARG 116 16.378 1.189 9.182 824 HH22 ARG 116 2HH2 ARG 116 16.222 2.830 9.730 825 H TRP 117 H TRP 117 8.399 -0.785 6.600 826 HA TRP 117 HA TRP 117 6.168 -1.448 8.183 827 HB2 TRP 117 1HB TRP 117 6.186 -0.291 5.390 828 HB3 TRP 117 2HB TRP 117 4.834 -0.254 6.515 829 HD1 TRP 117 HD1 TRP 117 7.120 2.067 5.207 830 HE1 TRP 117 HE1 TRP 117 7.715 3.958 6.844 831 HE3 TRP 117 HE3 TRP 117 5.517 -0.088 9.559 832 HZ2 TRP 117 HZ2 TRP 117 7.536 4.468 9.612 833 HZ3 TRP 117 HZ3 TRP 117 5.766 1.172 11.657 834 HH2 TRP 117 HH2 TRP 117 6.754 3.401 11.681 835 H ILE 118 H ILE 118 7.225 -2.589 5.006 836 HA ILE 118 HA ILE 118 5.037 -4.278 4.474 837 HB ILE 118 HB ILE 118 7.916 -4.526 3.579 838 HG12 ILE 118 1HG1 ILE 118 5.502 -3.390 2.152 839 HG13 ILE 118 2HG1 ILE 118 6.752 -2.426 2.931 840 HG21 ILE 118 1HG2 ILE 118 5.446 -5.883 2.500 841 HG22 ILE 118 2HG2 ILE 118 6.775 -6.662 3.361 842 HG23 ILE 118 3HG2 ILE 118 7.053 -5.946 1.773 843 HD11 ILE 118 1HD1 ILE 118 8.405 -3.298 1.377 844 HD12 ILE 118 2HD1 ILE 118 7.064 -2.537 0.522 845 HD13 ILE 118 3HD1 ILE 118 7.168 -4.293 0.610 846 H LYS 119 H LYS 119 8.110 -4.842 6.119 847 HA LYS 119 HA LYS 119 7.858 -7.593 6.538 848 HB2 LYS 119 1HB LYS 119 9.963 -6.437 6.873 849 HB3 LYS 119 2HB LYS 119 9.274 -5.488 8.180 850 HG2 LYS 119 1HG LYS 119 9.094 -7.428 9.577 851 HG3 LYS 119 2HG LYS 119 9.583 -8.482 8.248 852 HD2 LYS 119 1HD LYS 119 11.430 -8.075 9.804 853 HD3 LYS 119 2HD LYS 119 11.778 -7.432 8.200 854 HE2 LYS 119 1HE LYS 119 11.158 -5.191 8.968 855 HE3 LYS 119 2HE LYS 119 10.809 -5.836 10.571 856 HZ1 LYS 119 1HZ LYS 119 13.010 -4.813 10.432 857 HZ2 LYS 119 2HZ LYS 119 13.462 -5.920 9.239 858 HZ3 LYS 119 3HZ LYS 119 13.113 -6.459 10.805 859 H GLU 120 H GLU 120 6.871 -4.865 8.602 860 HA GLU 120 HA GLU 120 5.853 -6.530 10.671 861 HB2 GLU 120 1HB GLU 120 5.261 -3.639 10.039 862 HB3 GLU 120 2HB GLU 120 4.778 -4.464 11.513 863 HG2 GLU 120 1HG GLU 120 7.237 -4.921 11.898 864 HG3 GLU 120 2HG GLU 120 7.548 -3.771 10.596 865 H PHE 121 H PHE 121 4.442 -5.090 7.799 866 HA PHE 121 HA PHE 121 1.733 -5.451 8.551 867 HB2 PHE 121 1HB PHE 121 2.552 -3.875 6.796 868 HB3 PHE 121 2HB PHE 121 2.859 -5.261 5.755 869 HD1 PHE 121 HD1 PHE 121 1.190 -6.027 4.338 870 HD2 PHE 121 HD2 PHE 121 0.145 -3.605 7.678 871 HE1 PHE 121 HE1 PHE 121 -1.132 -5.925 3.535 872 HE2 PHE 121 HE2 PHE 121 -2.180 -3.502 6.880 873 HZ PHE 121 HZ PHE 121 -2.819 -4.662 4.808 874 H SER 122 H SER 122 4.100 -7.564 7.133 875 HA SER 122 HA SER 122 2.184 -9.499 6.220 876 HB2 SER 122 1HB SER 122 4.428 -9.276 5.181 877 HB3 SER 122 2HB SER 122 5.161 -9.818 6.690 878 HG SER 122 HG SER 122 3.583 -11.703 6.311 879 H GLU 123 H GLU 123 3.078 -8.553 9.235 880 HA GLU 123 HA GLU 123 2.874 -11.243 10.392 881 HB2 GLU 123 1HB GLU 123 3.738 -8.645 11.676 882 HB3 GLU 123 2HB GLU 123 3.690 -10.208 12.477 883 HG2 GLU 123 1HG GLU 123 5.434 -9.464 10.141 884 HG3 GLU 123 2HG GLU 123 5.950 -9.631 11.818 885 H GLU 124 H GLU 124 0.654 -9.498 9.312 886 HA GLU 124 HA GLU 124 -0.925 -8.832 11.630 887 HB2 GLU 124 1HB GLU 124 -1.597 -8.972 8.687 888 HB3 GLU 124 2HB GLU 124 -2.745 -8.483 9.926 889 HG2 GLU 124 1HG GLU 124 -0.144 -7.093 9.327 890 HG3 GLU 124 2HG GLU 124 -1.729 -6.587 8.745 Start of MODEL 15 1 HA MET 21 HA MET 21 -8.493 -11.748 3.461 2 HB2 MET 21 1HB MET 21 -7.434 -9.837 4.515 3 HB3 MET 21 2HB MET 21 -8.284 -10.778 5.729 4 HG2 MET 21 1HG MET 21 -5.316 -10.854 5.225 5 HG3 MET 21 2HG MET 21 -6.109 -9.930 6.496 6 HE1 MET 21 1HE MET 21 -4.358 -12.734 8.553 7 HE2 MET 21 2HE MET 21 -4.586 -11.000 8.339 8 HE3 MET 21 3HE MET 21 -3.729 -11.935 7.113 9 H THR 22 H THR 22 -7.422 -10.941 1.714 10 HA THR 22 HA THR 22 -4.743 -11.957 1.174 11 HB THR 22 HB THR 22 -6.611 -10.330 -0.569 12 HG1 THR 22 HG1 THR 22 -6.325 -12.737 -1.516 13 HG21 THR 22 1HG2 THR 22 -4.094 -11.843 -1.277 14 HG22 THR 22 2HG2 THR 22 -4.265 -10.089 -1.238 15 HG23 THR 22 3HG2 THR 22 -5.167 -11.038 -2.421 16 H LEU 23 H LEU 23 -2.979 -10.524 0.693 17 HA LEU 23 HA LEU 23 -3.353 -7.980 2.088 18 HB2 LEU 23 1HB LEU 23 -0.833 -9.604 1.788 19 HB3 LEU 23 2HB LEU 23 -0.991 -8.116 2.702 20 HG LEU 23 HG LEU 23 -2.289 -10.767 3.333 21 HD11 LEU 23 1HD1 LEU 23 -0.206 -9.140 4.771 22 HD12 LEU 23 2HD1 LEU 23 0.055 -10.662 3.918 23 HD13 LEU 23 3HD1 LEU 23 -0.945 -10.627 5.370 24 HD21 LEU 23 1HD2 LEU 23 -3.175 -9.666 5.332 25 HD22 LEU 23 2HD2 LEU 23 -3.833 -8.964 3.855 26 HD23 LEU 23 3HD2 LEU 23 -2.566 -8.119 4.746 27 H PHE 24 H PHE 24 -3.284 -6.240 0.923 28 HA PHE 24 HA PHE 24 -1.745 -6.235 -1.591 29 HB2 PHE 24 1HB PHE 24 -4.138 -4.555 -0.804 30 HB3 PHE 24 2HB PHE 24 -3.246 -4.391 -2.307 31 HD1 PHE 24 HD1 PHE 24 -5.293 -6.780 -0.340 32 HD2 PHE 24 HD2 PHE 24 -3.841 -5.635 -4.171 33 HE1 PHE 24 HE1 PHE 24 -6.786 -8.422 -1.392 34 HE2 PHE 24 HE2 PHE 24 -5.326 -7.281 -5.230 35 HZ PHE 24 HZ PHE 24 -6.803 -8.676 -3.841 36 H VAL 25 H VAL 25 -0.352 -4.523 -1.979 37 HA VAL 25 HA VAL 25 -0.362 -2.323 -0.090 38 HB VAL 25 HB VAL 25 1.243 -3.580 1.047 39 HG11 VAL 25 1HG1 VAL 25 3.144 -4.702 -0.020 40 HG12 VAL 25 2HG1 VAL 25 2.514 -4.243 -1.602 41 HG13 VAL 25 3HG1 VAL 25 1.596 -5.342 -0.573 42 HG21 VAL 25 1HG2 VAL 25 1.997 -1.330 0.750 43 HG22 VAL 25 2HG2 VAL 25 2.653 -1.701 -0.842 44 HG23 VAL 25 3HG2 VAL 25 3.399 -2.393 0.603 45 H LEU 26 H LEU 26 -0.053 -0.479 -0.985 46 HA LEU 26 HA LEU 26 0.850 -0.352 -3.774 47 HB2 LEU 26 1HB LEU 26 -0.699 1.583 -2.057 48 HB3 LEU 26 2HB LEU 26 -0.095 1.970 -3.652 49 HG LEU 26 HG LEU 26 -1.525 0.052 -4.517 50 HD11 LEU 26 1HD1 LEU 26 -2.753 0.292 -1.785 51 HD12 LEU 26 2HD1 LEU 26 -1.897 -1.112 -2.422 52 HD13 LEU 26 3HD1 LEU 26 -3.423 -0.606 -3.147 53 HD21 LEU 26 1HD2 LEU 26 -2.121 2.391 -4.792 54 HD22 LEU 26 2HD2 LEU 26 -2.891 2.387 -3.207 55 HD23 LEU 26 3HD2 LEU 26 -3.550 1.399 -4.511 56 H ILE 27 H ILE 27 2.261 1.438 -4.350 57 HA ILE 27 HA ILE 27 3.694 2.663 -2.124 58 HB ILE 27 HB ILE 27 5.093 0.783 -2.568 59 HG12 ILE 27 1HG1 ILE 27 6.264 3.167 -4.025 60 HG13 ILE 27 2HG1 ILE 27 6.236 2.967 -2.275 61 HG21 ILE 27 1HG2 ILE 27 5.945 0.222 -4.782 62 HG22 ILE 27 2HG2 ILE 27 5.010 1.542 -5.483 63 HG23 ILE 27 3HG2 ILE 27 4.181 0.169 -4.749 64 HD11 ILE 27 1HD1 ILE 27 8.410 2.417 -3.202 65 HD12 ILE 27 2HD1 ILE 27 7.673 1.188 -4.232 66 HD13 ILE 27 3HD1 ILE 27 7.657 0.997 -2.477 67 H LEU 28 H LEU 28 3.609 4.790 -2.458 68 HA LEU 28 HA LEU 28 4.157 5.706 -5.211 69 HB2 LEU 28 1HB LEU 28 1.925 6.300 -3.850 70 HB3 LEU 28 2HB LEU 28 2.974 7.536 -3.183 71 HG LEU 28 HG LEU 28 3.452 8.259 -5.555 72 HD11 LEU 28 1HD1 LEU 28 1.260 6.265 -6.040 73 HD12 LEU 28 2HD1 LEU 28 2.838 6.376 -6.824 74 HD13 LEU 28 3HD1 LEU 28 1.599 7.588 -7.153 75 HD21 LEU 28 1HD2 LEU 28 1.371 9.502 -5.756 76 HD22 LEU 28 2HD2 LEU 28 1.915 9.464 -4.078 77 HD23 LEU 28 3HD2 LEU 28 0.598 8.417 -4.603 78 H SER 29 H SER 29 6.343 5.227 -4.504 79 HA SER 29 HA SER 29 7.587 7.710 -3.669 80 HB2 SER 29 1HB SER 29 7.434 5.985 -1.683 81 HB3 SER 29 2HB SER 29 8.682 5.126 -2.579 82 HG SER 29 HG SER 29 9.040 7.871 -2.145 83 H ASN 30 H ASN 30 8.267 7.939 -5.894 84 HA ASN 30 HA ASN 30 9.207 5.492 -7.136 85 HB2 ASN 30 1HB ASN 30 8.990 8.257 -8.341 86 HB3 ASN 30 2HB ASN 30 9.246 6.752 -9.218 87 HD21 ASN 30 1HD2 ASN 30 7.525 5.250 -9.354 88 HD22 ASN 30 2HD2 ASN 30 5.887 5.737 -9.093 89 H ASP 31 H ASP 31 11.067 5.203 -5.860 90 HA ASP 31 HA ASP 31 13.336 6.549 -7.159 91 HB2 ASP 31 1HB ASP 31 13.568 6.814 -4.762 92 HB3 ASP 31 2HB ASP 31 13.258 5.104 -4.496 93 H LYS 32 H LYS 32 14.803 5.191 -8.265 94 HA LYS 32 HA LYS 32 13.586 3.051 -9.544 95 HB2 LYS 32 1HB LYS 32 16.534 3.635 -9.303 96 HB3 LYS 32 2HB LYS 32 15.808 2.544 -10.475 97 HG2 LYS 32 1HG LYS 32 15.319 5.510 -10.277 98 HG3 LYS 32 2HG LYS 32 16.326 4.696 -11.475 99 HD2 LYS 32 1HD LYS 32 14.333 3.467 -12.265 100 HD3 LYS 32 2HD LYS 32 13.348 4.365 -11.111 101 HE2 LYS 32 1HE LYS 32 13.153 5.382 -13.286 102 HE3 LYS 32 2HE LYS 32 14.034 6.464 -12.210 103 HZ1 LYS 32 1HZ LYS 32 15.098 6.385 -14.346 104 HZ2 LYS 32 2HZ LYS 32 15.215 4.700 -14.283 105 HZ3 LYS 32 3HZ LYS 32 16.108 5.649 -13.206 106 H LYS 33 H LYS 33 15.968 2.916 -6.876 107 HA LYS 33 HA LYS 33 15.997 0.033 -6.948 108 HB2 LYS 33 1HB LYS 33 17.588 0.120 -5.180 109 HB3 LYS 33 2HB LYS 33 17.980 1.441 -6.269 110 HG2 LYS 33 1HG LYS 33 16.875 3.014 -4.762 111 HG3 LYS 33 2HG LYS 33 16.478 1.688 -3.670 112 HD2 LYS 33 1HD LYS 33 18.895 1.242 -3.394 113 HD3 LYS 33 2HD LYS 33 19.243 2.641 -4.414 114 HE2 LYS 33 1HE LYS 33 18.045 4.077 -2.816 115 HE3 LYS 33 2HE LYS 33 17.758 2.674 -1.789 116 HZ1 LYS 33 1HZ LYS 33 20.151 2.426 -1.532 117 HZ2 LYS 33 2HZ LYS 33 19.643 3.952 -1.013 118 HZ3 LYS 33 3HZ LYS 33 20.415 3.784 -2.505 119 H LEU 34 H LEU 34 14.362 2.526 -5.144 120 HA LEU 34 HA LEU 34 13.434 0.924 -3.003 121 HB2 LEU 34 1HB LEU 34 13.439 3.315 -2.820 122 HB3 LEU 34 2HB LEU 34 12.409 3.477 -4.224 123 HG LEU 34 HG LEU 34 10.495 2.740 -3.032 124 HD11 LEU 34 1HD1 LEU 34 10.775 2.178 -0.539 125 HD12 LEU 34 2HD1 LEU 34 12.445 1.802 -0.978 126 HD13 LEU 34 3HD1 LEU 34 11.117 0.932 -1.738 127 HD21 LEU 34 1HD2 LEU 34 10.376 4.350 -1.198 128 HD22 LEU 34 2HD2 LEU 34 11.135 5.045 -2.630 129 HD23 LEU 34 3HD2 LEU 34 12.128 4.544 -1.262 130 H ILE 35 H ILE 35 12.075 1.746 -6.153 131 HA ILE 35 HA ILE 35 9.545 0.608 -5.795 132 HB ILE 35 HB ILE 35 11.180 1.168 -8.255 133 HG12 ILE 35 1HG1 ILE 35 8.715 2.437 -7.040 134 HG13 ILE 35 2HG1 ILE 35 10.350 3.087 -6.991 135 HG21 ILE 35 1HG2 ILE 35 9.225 0.722 -9.625 136 HG22 ILE 35 2HG2 ILE 35 8.328 0.195 -8.202 137 HG23 ILE 35 3HG2 ILE 35 9.717 -0.735 -8.762 138 HD11 ILE 35 1HD1 ILE 35 8.721 2.668 -9.482 139 HD12 ILE 35 2HD1 ILE 35 10.323 3.399 -9.386 140 HD13 ILE 35 3HD1 ILE 35 8.941 4.201 -8.641 141 H GLU 36 H GLU 36 12.575 -0.845 -6.947 142 HA GLU 36 HA GLU 36 11.289 -3.352 -7.484 143 HB2 GLU 36 1HB GLU 36 13.610 -4.227 -7.763 144 HB3 GLU 36 2HB GLU 36 13.207 -2.878 -8.808 145 HG2 GLU 36 1HG GLU 36 14.506 -1.383 -7.495 146 HG3 GLU 36 2HG GLU 36 14.741 -2.603 -6.242 147 H GLU 37 H GLU 37 13.331 -2.081 -4.870 148 HA GLU 37 HA GLU 37 13.573 -4.546 -3.509 149 HB2 GLU 37 1HB GLU 37 13.959 -1.692 -2.650 150 HB3 GLU 37 2HB GLU 37 14.167 -3.032 -1.528 151 HG2 GLU 37 1HG GLU 37 15.651 -2.716 -4.127 152 HG3 GLU 37 2HG GLU 37 16.279 -2.268 -2.539 153 H ALA 38 H ALA 38 11.138 -2.025 -3.391 154 HA ALA 38 HA ALA 38 9.772 -2.898 -1.093 155 HB1 ALA 38 1HB ALA 38 7.833 -1.731 -2.004 156 HB2 ALA 38 2HB ALA 38 8.616 -1.635 -3.582 157 HB3 ALA 38 3HB ALA 38 9.294 -0.764 -2.206 158 H ARG 39 H ARG 39 9.572 -3.905 -4.489 159 HA ARG 39 HA ARG 39 7.510 -5.816 -3.964 160 HB2 ARG 39 1HB ARG 39 7.816 -4.854 -6.210 161 HB3 ARG 39 2HB ARG 39 9.375 -5.661 -6.336 162 HG2 ARG 39 1HG ARG 39 8.373 -7.803 -6.363 163 HG3 ARG 39 2HG ARG 39 6.801 -7.160 -5.883 164 HD2 ARG 39 1HD ARG 39 6.689 -7.631 -8.210 165 HD3 ARG 39 2HD ARG 39 6.788 -5.879 -8.041 166 HE ARG 39 HE ARG 39 9.372 -6.641 -8.374 167 HH11 ARG 39 1HH1 ARG 39 6.424 -7.181 -10.155 168 HH12 ARG 39 2HH1 ARG 39 7.210 -7.286 -11.696 169 HH21 ARG 39 1HH2 ARG 39 10.430 -6.759 -10.407 170 HH22 ARG 39 2HH2 ARG 39 9.497 -7.041 -11.841 171 H LYS 40 H LYS 40 11.046 -5.932 -4.083 172 HA LYS 40 HA LYS 40 11.459 -8.680 -3.994 173 HB2 LYS 40 1HB LYS 40 12.952 -6.732 -2.229 174 HB3 LYS 40 2HB LYS 40 13.537 -8.260 -2.866 175 HG2 LYS 40 1HG LYS 40 12.881 -5.859 -4.545 176 HG3 LYS 40 2HG LYS 40 14.495 -6.261 -3.961 177 HD2 LYS 40 1HD LYS 40 14.370 -8.387 -5.191 178 HD3 LYS 40 2HD LYS 40 12.778 -7.916 -5.783 179 HE2 LYS 40 1HE LYS 40 14.506 -7.458 -7.450 180 HE3 LYS 40 2HE LYS 40 13.734 -5.976 -6.891 181 HZ1 LYS 40 1HZ LYS 40 16.417 -7.004 -6.171 182 HZ2 LYS 40 2HZ LYS 40 15.667 -5.750 -5.316 183 HZ3 LYS 40 3HZ LYS 40 16.041 -5.549 -6.958 184 H MET 41 H MET 41 10.626 -6.432 -1.432 185 HA MET 41 HA MET 41 10.687 -8.300 0.691 186 HB2 MET 41 1HB MET 41 10.922 -5.754 0.727 187 HB3 MET 41 2HB MET 41 9.171 -5.700 0.604 188 HG2 MET 41 1HG MET 41 9.846 -5.443 2.866 189 HG3 MET 41 2HG MET 41 9.005 -6.981 2.682 190 HE1 MET 41 1HE MET 41 11.608 -7.835 5.452 191 HE2 MET 41 2HE MET 41 9.903 -7.752 5.009 192 HE3 MET 41 3HE MET 41 10.826 -6.269 5.245 193 H ALA 42 H ALA 42 8.010 -6.790 -1.134 194 HA ALA 42 HA ALA 42 6.010 -8.151 0.422 195 HB1 ALA 42 1HB ALA 42 4.416 -7.036 -1.033 196 HB2 ALA 42 2HB ALA 42 5.729 -6.513 -2.086 197 HB3 ALA 42 3HB ALA 42 5.631 -5.911 -0.433 198 H GLU 43 H GLU 43 7.396 -8.605 -2.811 199 HA GLU 43 HA GLU 43 5.472 -10.448 -3.737 200 HB2 GLU 43 1HB GLU 43 7.205 -9.269 -5.143 201 HB3 GLU 43 2HB GLU 43 8.393 -10.395 -4.504 202 HG2 GLU 43 1HG GLU 43 7.652 -11.109 -6.682 203 HG3 GLU 43 2HG GLU 43 7.126 -12.261 -5.456 204 H LYS 44 H LYS 44 8.609 -10.878 -2.159 205 HA LYS 44 HA LYS 44 8.487 -13.689 -1.933 206 HB2 LYS 44 1HB LYS 44 10.592 -12.521 -1.729 207 HB3 LYS 44 2HB LYS 44 10.003 -11.604 -0.354 208 HG2 LYS 44 1HG LYS 44 10.004 -14.545 -0.074 209 HG3 LYS 44 2HG LYS 44 11.576 -13.747 -0.124 210 HD2 LYS 44 1HD LYS 44 10.909 -12.291 1.716 211 HD3 LYS 44 2HD LYS 44 9.313 -13.042 1.745 212 HE2 LYS 44 1HE LYS 44 10.270 -15.158 2.387 213 HE3 LYS 44 2HE LYS 44 11.901 -14.511 2.215 214 HZ1 LYS 44 1HZ LYS 44 11.562 -13.078 4.057 215 HZ2 LYS 44 2HZ LYS 44 11.054 -14.618 4.539 216 HZ3 LYS 44 3HZ LYS 44 9.914 -13.441 4.133 217 H ALA 45 H ALA 45 7.145 -11.083 -0.071 218 HA ALA 45 HA ALA 45 6.451 -12.730 2.184 219 HB1 ALA 45 1HB ALA 45 5.290 -10.748 3.014 220 HB2 ALA 45 2HB ALA 45 5.587 -9.939 1.476 221 HB3 ALA 45 3HB ALA 45 6.940 -10.377 2.515 222 H ASN 46 H ASN 46 5.314 -12.580 -0.860 223 HA ASN 46 HA ASN 46 3.510 -13.438 -1.910 224 HB2 ASN 46 1HB ASN 46 2.713 -14.373 0.852 225 HB3 ASN 46 2HB ASN 46 1.917 -14.859 -0.640 226 HD21 ASN 46 1HD2 ASN 46 3.352 -16.419 1.393 227 HD22 ASN 46 2HD2 ASN 46 4.589 -17.276 0.540 228 H LEU 47 H LEU 47 3.547 -10.734 -0.996 229 HA LEU 47 HA LEU 47 0.684 -10.208 -0.582 230 HB2 LEU 47 1HB LEU 47 2.757 -8.059 -0.746 231 HB3 LEU 47 2HB LEU 47 1.234 -8.059 0.110 232 HG LEU 47 HG LEU 47 3.754 -9.485 0.940 233 HD11 LEU 47 1HD1 LEU 47 2.265 -7.152 2.124 234 HD12 LEU 47 2HD1 LEU 47 3.807 -7.079 1.272 235 HD13 LEU 47 3HD1 LEU 47 3.692 -7.923 2.817 236 HD21 LEU 47 1HD2 LEU 47 1.093 -9.367 2.347 237 HD22 LEU 47 2HD2 LEU 47 2.570 -10.117 2.952 238 HD23 LEU 47 3HD2 LEU 47 1.759 -10.783 1.534 239 H ILE 48 H ILE 48 -0.229 -8.426 -1.937 240 HA ILE 48 HA ILE 48 0.806 -8.604 -4.669 241 HB ILE 48 HB ILE 48 -1.848 -7.560 -3.662 242 HG12 ILE 48 1HG1 ILE 48 -1.111 -10.069 -5.191 243 HG13 ILE 48 2HG1 ILE 48 -1.590 -10.000 -3.499 244 HG21 ILE 48 1HG2 ILE 48 -0.839 -7.877 -6.489 245 HG22 ILE 48 2HG2 ILE 48 -1.158 -6.354 -5.660 246 HG23 ILE 48 3HG2 ILE 48 -2.488 -7.450 -6.035 247 HD11 ILE 48 1HD1 ILE 48 -3.403 -10.771 -4.918 248 HD12 ILE 48 2HD1 ILE 48 -3.322 -9.276 -5.849 249 HD13 ILE 48 3HD1 ILE 48 -3.804 -9.233 -4.152 250 H LEU 49 H LEU 49 2.458 -7.211 -4.761 251 HA LEU 49 HA LEU 49 2.243 -4.532 -3.664 252 HB2 LEU 49 1HB LEU 49 4.315 -5.954 -3.510 253 HB3 LEU 49 2HB LEU 49 4.487 -5.806 -5.242 254 HG LEU 49 HG LEU 49 5.982 -4.334 -3.850 255 HD11 LEU 49 1HD1 LEU 49 5.728 -2.371 -5.271 256 HD12 LEU 49 2HD1 LEU 49 4.149 -2.957 -5.794 257 HD13 LEU 49 3HD1 LEU 49 5.605 -3.868 -6.196 258 HD21 LEU 49 1HD2 LEU 49 5.025 -2.266 -2.962 259 HD22 LEU 49 2HD2 LEU 49 4.413 -3.693 -2.129 260 HD23 LEU 49 3HD2 LEU 49 3.408 -2.868 -3.321 261 H ILE 50 H ILE 50 1.513 -2.862 -4.797 262 HA ILE 50 HA ILE 50 1.432 -3.095 -7.738 263 HB ILE 50 HB ILE 50 -0.378 -1.410 -5.995 264 HG12 ILE 50 1HG1 ILE 50 -1.013 -4.004 -7.426 265 HG13 ILE 50 2HG1 ILE 50 -0.732 -3.864 -5.693 266 HG21 ILE 50 1HG2 ILE 50 -0.080 -0.498 -8.218 267 HG22 ILE 50 2HG2 ILE 50 -1.700 -1.177 -8.063 268 HG23 ILE 50 3HG2 ILE 50 -0.453 -2.063 -8.938 269 HD11 ILE 50 1HD1 ILE 50 -3.105 -3.968 -6.223 270 HD12 ILE 50 2HD1 ILE 50 -2.950 -2.524 -7.225 271 HD13 ILE 50 3HD1 ILE 50 -2.679 -2.423 -5.485 272 H THR 51 H THR 51 2.931 -1.884 -8.680 273 HA THR 51 HA THR 51 3.923 0.515 -7.357 274 HB THR 51 HB THR 51 5.531 0.483 -9.371 275 HG1 THR 51 HG1 THR 51 5.689 -1.882 -10.049 276 HG21 THR 51 1HG2 THR 51 5.553 -1.754 -7.348 277 HG22 THR 51 2HG2 THR 51 6.240 -0.143 -7.140 278 HG23 THR 51 3HG2 THR 51 6.936 -1.254 -8.319 279 H VAL 52 H VAL 52 3.282 2.496 -7.915 280 HA VAL 52 HA VAL 52 2.206 2.945 -10.612 281 HB VAL 52 HB VAL 52 0.551 4.565 -9.529 282 HG11 VAL 52 1HG1 VAL 52 -0.170 2.474 -10.541 283 HG12 VAL 52 2HG1 VAL 52 -1.105 2.812 -9.083 284 HG13 VAL 52 3HG1 VAL 52 0.186 1.611 -9.045 285 HG21 VAL 52 1HG2 VAL 52 1.196 2.905 -7.094 286 HG22 VAL 52 2HG2 VAL 52 -0.112 4.078 -7.229 287 HG23 VAL 52 3HG2 VAL 52 1.564 4.615 -7.309 288 H GLY 53 H GLY 53 2.664 4.979 -11.486 289 HA2 GLY 53 1HA GLY 53 4.171 6.796 -9.707 290 HA3 GLY 53 2HA GLY 53 4.571 6.580 -11.405 291 H ASP 54 H ASP 54 2.456 7.970 -9.126 292 HA ASP 54 HA ASP 54 1.872 10.357 -9.834 293 HB2 ASP 54 1HB ASP 54 1.367 9.614 -12.206 294 HB3 ASP 54 2HB ASP 54 -0.057 8.795 -11.577 295 H GLU 55 H GLU 55 0.121 11.202 -8.597 296 HA GLU 55 HA GLU 55 -0.713 9.385 -6.563 297 HB2 GLU 55 1HB GLU 55 -0.231 12.006 -6.520 298 HB3 GLU 55 2HB GLU 55 -1.976 12.061 -6.775 299 HG2 GLU 55 1HG GLU 55 -2.259 10.600 -4.801 300 HG3 GLU 55 2HG GLU 55 -0.522 10.695 -4.525 301 H GLU 56 H GLU 56 -2.110 10.563 -9.477 302 HA GLU 56 HA GLU 56 -4.796 9.828 -8.707 303 HB2 GLU 56 1HB GLU 56 -3.639 10.715 -11.349 304 HB3 GLU 56 2HB GLU 56 -5.348 10.412 -11.061 305 HG2 GLU 56 1HG GLU 56 -3.668 12.461 -9.632 306 HG3 GLU 56 2HG GLU 56 -4.812 12.794 -10.937 307 H GLU 57 H GLU 57 -2.082 8.461 -10.430 308 HA GLU 57 HA GLU 57 -3.414 6.118 -11.308 309 HB2 GLU 57 1HB GLU 57 -0.631 7.014 -11.072 310 HB3 GLU 57 2HB GLU 57 -0.849 5.284 -10.867 311 HG2 GLU 57 1HG GLU 57 -0.359 5.977 -13.193 312 HG3 GLU 57 2HG GLU 57 -1.861 5.074 -13.008 313 H LEU 58 H LEU 58 -1.951 7.118 -8.298 314 HA LEU 58 HA LEU 58 -2.018 4.662 -6.951 315 HB2 LEU 58 1HB LEU 58 -0.936 6.744 -6.093 316 HB3 LEU 58 2HB LEU 58 -2.531 7.393 -5.762 317 HG LEU 58 HG LEU 58 -2.887 5.367 -4.257 318 HD11 LEU 58 1HD1 LEU 58 -0.933 4.237 -3.424 319 HD12 LEU 58 2HD1 LEU 58 0.112 5.200 -4.467 320 HD13 LEU 58 3HD1 LEU 58 -1.017 4.047 -5.174 321 HD21 LEU 58 1HD2 LEU 58 -0.741 7.341 -3.496 322 HD22 LEU 58 2HD2 LEU 58 -1.732 6.394 -2.385 323 HD23 LEU 58 3HD2 LEU 58 -2.479 7.624 -3.406 324 H LYS 59 H LYS 59 -4.478 7.130 -7.477 325 HA LYS 59 HA LYS 59 -6.490 6.153 -5.828 326 HB2 LYS 59 1HB LYS 59 -6.905 7.455 -8.510 327 HB3 LYS 59 2HB LYS 59 -8.061 7.387 -7.192 328 HG2 LYS 59 1HG LYS 59 -5.463 8.902 -7.216 329 HG3 LYS 59 2HG LYS 59 -7.080 9.587 -7.347 330 HD2 LYS 59 1HD LYS 59 -7.514 8.511 -5.064 331 HD3 LYS 59 2HD LYS 59 -5.763 8.300 -4.975 332 HE2 LYS 59 1HE LYS 59 -7.252 10.905 -5.283 333 HE3 LYS 59 2HE LYS 59 -6.402 10.342 -3.845 334 HZ1 LYS 59 1HZ LYS 59 -4.342 10.350 -5.221 335 HZ2 LYS 59 2HZ LYS 59 -5.004 11.881 -4.958 336 HZ3 LYS 59 3HZ LYS 59 -5.214 11.118 -6.457 337 H LYS 60 H LYS 60 -5.421 5.147 -8.932 338 HA LYS 60 HA LYS 60 -7.703 3.506 -9.515 339 HB2 LYS 60 1HB LYS 60 -4.997 3.515 -10.847 340 HB3 LYS 60 2HB LYS 60 -6.535 3.004 -11.540 341 HG2 LYS 60 1HG LYS 60 -6.121 5.798 -10.548 342 HG3 LYS 60 2HG LYS 60 -5.619 5.314 -12.184 343 HD2 LYS 60 1HD LYS 60 -8.408 4.987 -11.076 344 HD3 LYS 60 2HD LYS 60 -7.887 6.344 -12.074 345 HE2 LYS 60 1HE LYS 60 -7.340 4.800 -13.890 346 HE3 LYS 60 2HE LYS 60 -7.853 3.440 -12.893 347 HZ1 LYS 60 1HZ LYS 60 -9.578 5.662 -13.837 348 HZ2 LYS 60 2HZ LYS 60 -10.083 4.405 -12.826 349 HZ3 LYS 60 3HZ LYS 60 -9.596 4.070 -14.409 350 H ALA 61 H ALA 61 -4.397 3.032 -8.384 351 HA ALA 61 HA ALA 61 -4.454 0.204 -8.363 352 HB1 ALA 61 1HB ALA 61 -2.496 0.415 -6.857 353 HB2 ALA 61 2HB ALA 61 -2.782 2.155 -6.779 354 HB3 ALA 61 3HB ALA 61 -2.354 1.397 -8.314 355 H ILE 62 H ILE 62 -5.317 2.690 -6.041 356 HA ILE 62 HA ILE 62 -5.818 1.076 -3.805 357 HB ILE 62 HB ILE 62 -7.166 3.651 -4.640 358 HG12 ILE 62 1HG1 ILE 62 -4.977 3.164 -2.614 359 HG13 ILE 62 2HG1 ILE 62 -4.690 3.717 -4.262 360 HG21 ILE 62 1HG2 ILE 62 -7.827 3.867 -2.280 361 HG22 ILE 62 2HG2 ILE 62 -7.207 2.243 -1.972 362 HG23 ILE 62 3HG2 ILE 62 -8.577 2.474 -3.060 363 HD11 ILE 62 1HD1 ILE 62 -4.624 5.567 -2.721 364 HD12 ILE 62 2HD1 ILE 62 -6.239 5.172 -2.135 365 HD13 ILE 62 3HD1 ILE 62 -6.013 5.725 -3.794 366 H LYS 63 H LYS 63 -8.086 2.203 -6.328 367 HA LYS 63 HA LYS 63 -10.253 0.681 -5.296 368 HB2 LYS 63 1HB LYS 63 -10.571 2.689 -6.713 369 HB3 LYS 63 2HB LYS 63 -9.920 1.799 -8.085 370 HG2 LYS 63 1HG LYS 63 -11.756 0.189 -7.904 371 HG3 LYS 63 2HG LYS 63 -12.414 1.102 -6.547 372 HD2 LYS 63 1HD LYS 63 -12.788 3.020 -7.966 373 HD3 LYS 63 2HD LYS 63 -12.008 2.206 -9.324 374 HE2 LYS 63 1HE LYS 63 -14.514 1.262 -7.938 375 HE3 LYS 63 2HE LYS 63 -14.472 2.149 -9.460 376 HZ1 LYS 63 1HZ LYS 63 -14.694 -0.226 -9.828 377 HZ2 LYS 63 2HZ LYS 63 -13.259 -0.527 -8.982 378 HZ3 LYS 63 3HZ LYS 63 -13.221 0.331 -10.444 379 H LYS 64 H LYS 64 -7.739 0.049 -7.665 380 HA LYS 64 HA LYS 64 -8.854 -2.312 -8.732 381 HB2 LYS 64 1HB LYS 64 -6.974 -1.137 -9.796 382 HB3 LYS 64 2HB LYS 64 -5.938 -1.567 -8.442 383 HG2 LYS 64 1HG LYS 64 -6.059 -3.886 -8.990 384 HG3 LYS 64 2HG LYS 64 -7.296 -3.586 -10.210 385 HD2 LYS 64 1HD LYS 64 -5.133 -3.940 -11.255 386 HD3 LYS 64 2HD LYS 64 -5.679 -2.284 -11.515 387 HE2 LYS 64 1HE LYS 64 -4.231 -1.519 -9.702 388 HE3 LYS 64 2HE LYS 64 -3.691 -3.177 -9.431 389 HZ1 LYS 64 1HZ LYS 64 -3.287 -1.589 -11.907 390 HZ2 LYS 64 2HZ LYS 64 -2.803 -3.195 -11.690 391 HZ3 LYS 64 3HZ LYS 64 -2.100 -1.969 -10.764 392 H ALA 65 H ALA 65 -6.713 -1.727 -5.970 393 HA ALA 65 HA ALA 65 -6.379 -4.400 -5.173 394 HB1 ALA 65 1HB ALA 65 -5.826 -3.501 -2.973 395 HB2 ALA 65 2HB ALA 65 -6.505 -1.938 -3.429 396 HB3 ALA 65 3HB ALA 65 -5.064 -2.545 -4.246 397 H ASP 66 H ASP 66 -8.821 -1.991 -4.332 398 HA ASP 66 HA ASP 66 -10.465 -3.463 -2.651 399 HB2 ASP 66 1HB ASP 66 -10.799 -1.083 -3.088 400 HB3 ASP 66 2HB ASP 66 -11.201 -1.419 -4.764 401 H ASP 67 H ASP 67 -10.637 -3.160 -6.181 402 HA ASP 67 HA ASP 67 -12.800 -4.897 -6.578 403 HB2 ASP 67 1HB ASP 67 -10.674 -3.739 -8.317 404 HB3 ASP 67 2HB ASP 67 -11.620 -5.080 -8.951 405 H ILE 68 H ILE 68 -9.294 -5.545 -6.761 406 HA ILE 68 HA ILE 68 -9.599 -8.234 -7.620 407 HB ILE 68 HB ILE 68 -7.251 -6.922 -6.234 408 HG12 ILE 68 1HG1 ILE 68 -7.750 -7.492 -9.165 409 HG13 ILE 68 2HG1 ILE 68 -7.858 -5.909 -8.403 410 HG21 ILE 68 1HG2 ILE 68 -7.163 -9.346 -5.992 411 HG22 ILE 68 2HG2 ILE 68 -5.917 -8.780 -7.102 412 HG23 ILE 68 3HG2 ILE 68 -7.378 -9.536 -7.732 413 HD11 ILE 68 1HD1 ILE 68 -5.480 -6.002 -7.866 414 HD12 ILE 68 2HD1 ILE 68 -5.761 -6.179 -9.599 415 HD13 ILE 68 3HD1 ILE 68 -5.372 -7.593 -8.619 416 H ALA 69 H ALA 69 -9.405 -6.727 -4.457 417 HA ALA 69 HA ALA 69 -8.870 -9.040 -2.945 418 HB1 ALA 69 1HB ALA 69 -9.581 -7.730 -1.020 419 HB2 ALA 69 2HB ALA 69 -10.307 -6.530 -2.089 420 HB3 ALA 69 3HB ALA 69 -8.559 -6.766 -2.087 421 H LYS 70 H LYS 70 -11.958 -7.295 -3.271 422 HA LYS 70 HA LYS 70 -13.392 -9.289 -1.847 423 HB2 LYS 70 1HB LYS 70 -15.390 -8.077 -2.608 424 HB3 LYS 70 2HB LYS 70 -14.215 -7.054 -1.786 425 HG2 LYS 70 1HG LYS 70 -13.388 -6.416 -4.099 426 HG3 LYS 70 2HG LYS 70 -14.837 -7.203 -4.723 427 HD2 LYS 70 1HD LYS 70 -15.135 -4.775 -4.467 428 HD3 LYS 70 2HD LYS 70 -16.240 -5.691 -3.440 429 HE2 LYS 70 1HE LYS 70 -14.947 -5.245 -1.503 430 HE3 LYS 70 2HE LYS 70 -13.605 -4.621 -2.458 431 HZ1 LYS 70 1HZ LYS 70 -14.899 -2.731 -3.068 432 HZ2 LYS 70 2HZ LYS 70 -14.945 -2.880 -1.384 433 HZ3 LYS 70 3HZ LYS 70 -16.280 -3.350 -2.306 434 H LYS 71 H LYS 71 -12.321 -9.217 -5.003 435 HA LYS 71 HA LYS 71 -14.332 -10.107 -6.605 436 HB2 LYS 71 1HB LYS 71 -11.870 -9.670 -7.161 437 HB3 LYS 71 2HB LYS 71 -11.572 -11.326 -6.664 438 HG2 LYS 71 1HG LYS 71 -13.560 -10.643 -8.808 439 HG3 LYS 71 2HG LYS 71 -11.845 -10.868 -9.151 440 HD2 LYS 71 1HD LYS 71 -11.983 -13.133 -8.183 441 HD3 LYS 71 2HD LYS 71 -13.712 -12.896 -7.923 442 HE2 LYS 71 1HE LYS 71 -14.042 -12.615 -10.323 443 HE3 LYS 71 2HE LYS 71 -12.313 -12.818 -10.594 444 HZ1 LYS 71 1HZ LYS 71 -14.154 -14.859 -9.477 445 HZ2 LYS 71 2HZ LYS 71 -12.489 -15.062 -9.692 446 HZ3 LYS 71 3HZ LYS 71 -13.495 -14.860 -11.034 447 H GLN 72 H GLN 72 -12.419 -12.053 -4.323 448 HA GLN 72 HA GLN 72 -14.433 -14.151 -4.690 449 HB2 GLN 72 1HB GLN 72 -12.652 -15.894 -4.494 450 HB3 GLN 72 2HB GLN 72 -12.625 -14.960 -5.980 451 HG2 GLN 72 1HG GLN 72 -10.771 -13.629 -5.134 452 HG3 GLN 72 2HG GLN 72 -10.821 -14.519 -3.612 453 HE21 GLN 72 1HE2 GLN 72 -8.675 -14.241 -5.584 454 HE22 GLN 72 2HE2 GLN 72 -8.251 -15.854 -6.047 455 H ASN 73 H ASN 73 -11.647 -13.355 -2.580 456 HA ASN 73 HA ASN 73 -13.165 -14.554 -0.356 457 HB2 ASN 73 1HB ASN 73 -11.026 -15.258 0.613 458 HB3 ASN 73 2HB ASN 73 -11.260 -15.937 -0.992 459 HD21 ASN 73 1HD2 ASN 73 -8.832 -15.365 0.637 460 HD22 ASN 73 2HD2 ASN 73 -7.817 -14.414 -0.391 461 H SER 74 H SER 74 -11.211 -11.856 -1.331 462 HA SER 74 HA SER 74 -10.456 -11.265 1.394 463 HB2 SER 74 1HB SER 74 -8.798 -11.362 -0.482 464 HB3 SER 74 2HB SER 74 -9.517 -9.880 -1.110 465 HG SER 74 HG SER 74 -9.044 -8.934 0.963 466 H SER 75 H SER 75 -13.221 -10.654 0.456 467 HA SER 75 HA SER 75 -13.753 -8.065 -0.210 468 HB2 SER 75 1HB SER 75 -15.462 -9.840 0.135 469 HB3 SER 75 2HB SER 75 -15.281 -9.641 1.874 470 HG SER 75 HG SER 75 -16.477 -7.918 1.792 471 H GLU 76 H GLU 76 -12.863 -9.210 3.043 472 HA GLU 76 HA GLU 76 -12.425 -6.378 3.724 473 HB2 GLU 76 1HB GLU 76 -13.899 -7.564 5.323 474 HB3 GLU 76 2HB GLU 76 -12.616 -8.732 5.619 475 HG2 GLU 76 1HG GLU 76 -11.210 -7.022 6.564 476 HG3 GLU 76 2HG GLU 76 -12.387 -5.777 6.150 477 H ALA 77 H ALA 77 -10.447 -5.944 3.000 478 HA ALA 77 HA ALA 77 -8.327 -7.946 3.390 479 HB1 ALA 77 1HB ALA 77 -8.363 -5.663 1.426 480 HB2 ALA 77 2HB ALA 77 -8.906 -7.295 1.052 481 HB3 ALA 77 3HB ALA 77 -7.221 -7.006 1.486 482 H LYS 78 H LYS 78 -6.163 -7.142 3.780 483 HA LYS 78 HA LYS 78 -6.096 -4.569 5.203 484 HB2 LYS 78 1HB LYS 78 -4.069 -6.817 5.227 485 HB3 LYS 78 2HB LYS 78 -3.969 -5.332 6.158 486 HG2 LYS 78 1HG LYS 78 -6.038 -6.017 7.354 487 HG3 LYS 78 2HG LYS 78 -5.961 -7.560 6.498 488 HD2 LYS 78 1HD LYS 78 -3.735 -7.964 7.436 489 HD3 LYS 78 2HD LYS 78 -3.820 -6.432 8.303 490 HE2 LYS 78 1HE LYS 78 -5.871 -7.317 9.450 491 HE3 LYS 78 2HE LYS 78 -5.525 -8.879 8.711 492 HZ1 LYS 78 1HZ LYS 78 -3.729 -7.395 10.554 493 HZ2 LYS 78 2HZ LYS 78 -3.371 -8.888 9.839 494 HZ3 LYS 78 3HZ LYS 78 -4.643 -8.762 10.950 495 H ILE 79 H ILE 79 -5.162 -2.915 4.160 496 HA ILE 79 HA ILE 79 -3.343 -3.545 1.928 497 HB ILE 79 HB ILE 79 -5.367 -1.300 1.899 498 HG12 ILE 79 1HG1 ILE 79 -5.477 -3.944 0.430 499 HG13 ILE 79 2HG1 ILE 79 -6.497 -3.494 1.796 500 HG21 ILE 79 1HG2 ILE 79 -3.374 -0.865 0.572 501 HG22 ILE 79 2HG2 ILE 79 -4.766 -1.127 -0.476 502 HG23 ILE 79 3HG2 ILE 79 -3.572 -2.405 -0.260 503 HD11 ILE 79 1HD1 ILE 79 -7.468 -1.688 0.470 504 HD12 ILE 79 2HD1 ILE 79 -7.683 -3.257 -0.308 505 HD13 ILE 79 3HD1 ILE 79 -6.447 -2.142 -0.894 506 H LEU 80 H LEU 80 -1.460 -2.435 1.984 507 HA LEU 80 HA LEU 80 -1.368 -0.031 3.685 508 HB2 LEU 80 1HB LEU 80 0.624 -2.133 3.079 509 HB3 LEU 80 2HB LEU 80 1.239 -0.487 3.150 510 HG LEU 80 HG LEU 80 0.215 -0.291 5.435 511 HD11 LEU 80 1HD1 LEU 80 -0.358 -2.355 6.599 512 HD12 LEU 80 2HD1 LEU 80 -0.138 -3.261 5.100 513 HD13 LEU 80 3HD1 LEU 80 -1.431 -2.066 5.229 514 HD21 LEU 80 1HD2 LEU 80 1.977 -1.596 6.534 515 HD22 LEU 80 2HD2 LEU 80 2.588 -0.705 5.141 516 HD23 LEU 80 3HD2 LEU 80 2.290 -2.439 5.017 517 H ILE 81 H ILE 81 -0.810 1.894 2.832 518 HA ILE 81 HA ILE 81 0.055 1.913 0.014 519 HB ILE 81 HB ILE 81 -1.426 4.106 1.494 520 HG12 ILE 81 1HG1 ILE 81 -2.371 2.425 -0.836 521 HG13 ILE 81 2HG1 ILE 81 -2.803 2.094 0.839 522 HG21 ILE 81 1HG2 ILE 81 0.225 4.890 -0.189 523 HG22 ILE 81 2HG2 ILE 81 -1.438 5.298 -0.602 524 HG23 ILE 81 3HG2 ILE 81 -0.632 3.957 -1.412 525 HD11 ILE 81 1HD1 ILE 81 -4.569 3.289 -0.339 526 HD12 ILE 81 2HD1 ILE 81 -3.451 4.611 -0.679 527 HD13 ILE 81 3HD1 ILE 81 -3.914 4.253 0.985 528 H LEU 82 H LEU 82 2.216 2.106 0.094 529 HA LEU 82 HA LEU 82 3.440 3.756 2.163 530 HB2 LEU 82 1HB LEU 82 4.472 1.810 0.129 531 HB3 LEU 82 2HB LEU 82 5.568 2.942 0.891 532 HG LEU 82 HG LEU 82 5.119 1.995 3.074 533 HD11 LEU 82 1HD1 LEU 82 3.198 0.142 1.675 534 HD12 LEU 82 2HD1 LEU 82 2.761 1.436 2.792 535 HD13 LEU 82 3HD1 LEU 82 3.684 0.047 3.367 536 HD21 LEU 82 1HD2 LEU 82 6.057 -0.212 2.750 537 HD22 LEU 82 2HD2 LEU 82 6.820 0.949 1.663 538 HD23 LEU 82 3HD2 LEU 82 5.609 -0.172 1.044 539 H LEU 83 H LEU 83 3.218 5.860 1.690 540 HA LEU 83 HA LEU 83 4.048 6.741 -0.984 541 HB2 LEU 83 1HB LEU 83 2.329 8.440 -1.014 542 HB3 LEU 83 2HB LEU 83 1.613 6.843 -0.929 543 HG LEU 83 HG LEU 83 1.826 8.820 1.362 544 HD11 LEU 83 1HD1 LEU 83 -0.529 7.960 -0.305 545 HD12 LEU 83 2HD1 LEU 83 0.286 9.521 -0.391 546 HD13 LEU 83 3HD1 LEU 83 -0.578 9.058 1.075 547 HD21 LEU 83 1HD2 LEU 83 0.400 6.173 1.219 548 HD22 LEU 83 2HD2 LEU 83 0.289 7.337 2.537 549 HD23 LEU 83 3HD2 LEU 83 1.821 6.537 2.196 550 H GLU 84 H GLU 84 5.132 8.705 -1.096 551 HA GLU 84 HA GLU 84 5.958 9.731 1.516 552 HB2 GLU 84 1HB GLU 84 7.639 11.023 0.131 553 HB3 GLU 84 2HB GLU 84 7.817 9.275 0.106 554 HG2 GLU 84 1HG GLU 84 6.768 9.159 -2.063 555 HG3 GLU 84 2HG GLU 84 6.449 10.892 -2.034 556 H LYS 85 H LYS 85 4.235 10.900 2.130 557 HA LYS 85 HA LYS 85 4.383 13.623 1.441 558 HB2 LYS 85 1HB LYS 85 2.096 13.996 0.644 559 HB3 LYS 85 2HB LYS 85 2.981 12.962 -0.465 560 HG2 LYS 85 1HG LYS 85 1.848 11.004 0.465 561 HG3 LYS 85 2HG LYS 85 0.952 12.055 1.563 562 HD2 LYS 85 1HD LYS 85 0.846 12.148 -1.453 563 HD3 LYS 85 2HD LYS 85 -0.389 11.462 -0.399 564 HE2 LYS 85 1HE LYS 85 -0.701 13.683 0.630 565 HE3 LYS 85 2HE LYS 85 0.486 14.348 -0.490 566 HZ1 LYS 85 1HZ LYS 85 -1.736 14.758 -1.273 567 HZ2 LYS 85 2HZ LYS 85 -2.107 13.111 -1.228 568 HZ3 LYS 85 3HZ LYS 85 -0.958 13.687 -2.332 569 HA PRO 86 HA PRO 86 2.591 13.881 5.543 570 HB2 PRO 86 1HB PRO 86 0.885 16.127 4.673 571 HB3 PRO 86 2HB PRO 86 2.146 16.093 5.907 572 HG2 PRO 86 1HG PRO 86 2.511 17.359 3.575 573 HG3 PRO 86 2HG PRO 86 3.836 16.501 4.385 574 HD2 PRO 86 1HD PRO 86 2.163 15.637 2.056 575 HD3 PRO 86 2HD PRO 86 3.911 15.455 2.319 576 H VAL 87 H VAL 87 1.100 12.433 6.211 577 HA VAL 87 HA VAL 87 -1.570 12.552 5.002 578 HB VAL 87 HB VAL 87 -1.756 10.085 5.093 579 HG11 VAL 87 1HG1 VAL 87 -0.414 9.625 3.102 580 HG12 VAL 87 2HG1 VAL 87 0.498 11.109 3.376 581 HG13 VAL 87 3HG1 VAL 87 -1.222 11.189 2.994 582 HG21 VAL 87 1HG2 VAL 87 -0.082 9.552 6.740 583 HG22 VAL 87 2HG2 VAL 87 1.192 10.192 5.706 584 HG23 VAL 87 3HG2 VAL 87 0.316 8.738 5.227 585 H SER 88 H SER 88 -3.024 12.943 6.466 586 HA SER 88 HA SER 88 -2.568 12.352 9.270 587 HB2 SER 88 1HB SER 88 -3.535 14.505 8.771 588 HB3 SER 88 2HB SER 88 -4.785 13.773 7.769 589 HG SER 88 HG SER 88 -4.853 14.293 10.371 590 HA PRO 89 HA PRO 89 -5.049 8.583 9.473 591 HB2 PRO 89 1HB PRO 89 -6.345 9.926 11.798 592 HB3 PRO 89 2HB PRO 89 -5.640 8.309 11.685 593 HG2 PRO 89 1HG PRO 89 -4.351 10.260 12.953 594 HG3 PRO 89 2HG PRO 89 -3.472 9.091 11.947 595 HD2 PRO 89 1HD PRO 89 -4.194 11.930 11.365 596 HD3 PRO 89 2HD PRO 89 -2.736 11.020 10.919 597 H GLU 90 H GLU 90 -6.461 11.784 9.766 598 HA GLU 90 HA GLU 90 -9.133 11.099 9.088 599 HB2 GLU 90 1HB GLU 90 -8.393 13.238 10.167 600 HB3 GLU 90 2HB GLU 90 -7.676 13.715 8.636 601 HG2 GLU 90 1HG GLU 90 -9.794 14.798 8.892 602 HG3 GLU 90 2HG GLU 90 -9.904 13.610 7.596 603 H TYR 91 H TYR 91 -6.298 12.087 7.263 604 HA TYR 91 HA TYR 91 -7.530 12.197 4.713 605 HB2 TYR 91 1HB TYR 91 -5.371 13.291 5.273 606 HB3 TYR 91 2HB TYR 91 -4.626 11.706 5.418 607 HD1 TYR 91 HD1 TYR 91 -6.560 13.741 2.956 608 HD2 TYR 91 HD2 TYR 91 -3.491 10.866 3.592 609 HE1 TYR 91 HE1 TYR 91 -6.008 13.809 0.562 610 HE2 TYR 91 HE2 TYR 91 -2.931 10.924 1.199 611 HH TYR 91 HH TYR 91 -4.250 13.313 -0.931 612 H GLU 92 H GLU 92 -5.810 9.690 6.511 613 HA GLU 92 HA GLU 92 -5.785 7.676 4.599 614 HB2 GLU 92 1HB GLU 92 -4.573 7.546 6.712 615 HB3 GLU 92 2HB GLU 92 -6.086 7.476 7.599 616 HG2 GLU 92 1HG GLU 92 -6.605 5.331 6.518 617 HG3 GLU 92 2HG GLU 92 -5.060 5.420 5.671 618 H LYS 93 H LYS 93 -8.336 8.688 6.817 619 HA LYS 93 HA LYS 93 -10.137 6.600 6.402 620 HB2 LYS 93 1HB LYS 93 -10.552 9.489 7.144 621 HB3 LYS 93 2HB LYS 93 -11.892 8.360 7.009 622 HG2 LYS 93 1HG LYS 93 -9.532 7.971 8.834 623 HG3 LYS 93 2HG LYS 93 -11.064 8.694 9.324 624 HD2 LYS 93 1HD LYS 93 -12.238 6.637 8.742 625 HD3 LYS 93 2HD LYS 93 -10.726 5.912 8.198 626 HE2 LYS 93 1HE LYS 93 -11.353 5.152 10.442 627 HE3 LYS 93 2HE LYS 93 -9.828 6.035 10.449 628 HZ1 LYS 93 1HZ LYS 93 -11.319 6.643 12.287 629 HZ2 LYS 93 2HZ LYS 93 -12.451 7.217 11.170 630 HZ3 LYS 93 3HZ LYS 93 -10.938 7.959 11.298 631 H LYS 94 H LYS 94 -9.374 9.374 4.418 632 HA LYS 94 HA LYS 94 -11.672 9.316 2.773 633 HB2 LYS 94 1HB LYS 94 -8.861 10.196 2.083 634 HB3 LYS 94 2HB LYS 94 -10.295 10.541 1.130 635 HG2 LYS 94 1HG LYS 94 -11.204 11.881 2.934 636 HG3 LYS 94 2HG LYS 94 -9.820 11.480 3.951 637 HD2 LYS 94 1HD LYS 94 -9.513 13.680 2.993 638 HD3 LYS 94 2HD LYS 94 -8.333 12.564 2.309 639 HE2 LYS 94 1HE LYS 94 -9.224 13.964 0.557 640 HE3 LYS 94 2HE LYS 94 -9.774 12.308 0.319 641 HZ1 LYS 94 1HZ LYS 94 -11.365 14.518 1.510 642 HZ2 LYS 94 2HZ LYS 94 -11.897 12.923 1.322 643 HZ3 LYS 94 3HZ LYS 94 -11.566 13.868 -0.039 644 H LEU 95 H LEU 95 -8.508 7.753 2.511 645 HA LEU 95 HA LEU 95 -9.212 6.445 0.038 646 HB2 LEU 95 1HB LEU 95 -6.822 6.098 1.851 647 HB3 LEU 95 2HB LEU 95 -7.017 5.295 0.308 648 HG LEU 95 HG LEU 95 -5.574 7.070 -0.139 649 HD11 LEU 95 1HD1 LEU 95 -6.790 8.581 -1.593 650 HD12 LEU 95 2HD1 LEU 95 -8.309 8.116 -0.828 651 HD13 LEU 95 3HD1 LEU 95 -7.393 6.932 -1.760 652 HD21 LEU 95 1HD2 LEU 95 -7.384 8.882 1.439 653 HD22 LEU 95 2HD2 LEU 95 -5.923 9.374 0.581 654 HD23 LEU 95 3HD2 LEU 95 -5.811 8.271 1.953 655 H GLN 96 H GLN 96 -9.078 5.651 3.435 656 HA GLN 96 HA GLN 96 -9.362 2.842 3.159 657 HB2 GLN 96 1HB GLN 96 -8.539 4.062 5.202 658 HB3 GLN 96 2HB GLN 96 -10.191 4.574 5.496 659 HG2 GLN 96 1HG GLN 96 -10.894 2.326 5.864 660 HG3 GLN 96 2HG GLN 96 -9.326 1.691 5.369 661 HE21 GLN 96 1HE2 GLN 96 -9.617 4.563 7.300 662 HE22 GLN 96 2HE2 GLN 96 -8.999 3.885 8.761 663 H LYS 97 H LYS 97 -11.624 5.521 3.314 664 HA LYS 97 HA LYS 97 -13.939 3.800 3.306 665 HB2 LYS 97 1HB LYS 97 -13.991 6.061 4.308 666 HB3 LYS 97 2HB LYS 97 -13.724 6.759 2.719 667 HG2 LYS 97 1HG LYS 97 -15.850 5.907 1.947 668 HG3 LYS 97 2HG LYS 97 -16.110 5.093 3.492 669 HD2 LYS 97 1HD LYS 97 -16.170 7.225 4.640 670 HD3 LYS 97 2HD LYS 97 -15.804 8.072 3.137 671 HE2 LYS 97 1HE LYS 97 -17.902 7.298 2.174 672 HE3 LYS 97 2HE LYS 97 -18.264 6.403 3.648 673 HZ1 LYS 97 1HZ LYS 97 -18.370 8.466 4.859 674 HZ2 LYS 97 2HZ LYS 97 -19.421 8.537 3.538 675 HZ3 LYS 97 3HZ LYS 97 -17.940 9.349 3.483 676 H TYR 98 H TYR 98 -11.844 5.230 0.953 677 HA TYR 98 HA TYR 98 -13.599 5.185 -1.281 678 HB2 TYR 98 1HB TYR 98 -11.467 6.513 -1.114 679 HB3 TYR 98 2HB TYR 98 -10.576 5.008 -1.294 680 HD1 TYR 98 HD1 TYR 98 -13.038 7.197 -3.002 681 HD2 TYR 98 HD2 TYR 98 -10.068 4.185 -3.432 682 HE1 TYR 98 HE1 TYR 98 -13.127 7.469 -5.441 683 HE2 TYR 98 HE2 TYR 98 -10.149 4.447 -5.876 684 HH TYR 98 HH TYR 98 -11.647 7.069 -7.388 685 H ALA 99 H ALA 99 -10.980 3.017 -0.262 686 HA ALA 99 HA ALA 99 -12.247 0.843 -1.795 687 HB1 ALA 99 1HB ALA 99 -10.053 -0.328 -1.440 688 HB2 ALA 99 2HB ALA 99 -9.433 1.174 -0.754 689 HB3 ALA 99 3HB ALA 99 -9.954 1.122 -2.438 690 H ASP 100 H ASP 100 -13.387 -0.607 -0.591 691 HA ASP 100 HA ASP 100 -13.415 -0.151 2.249 692 HB2 ASP 100 1HB ASP 100 -15.518 -0.630 1.077 693 HB3 ASP 100 2HB ASP 100 -14.915 -2.230 0.648 694 H ALA 101 H ALA 101 -11.773 -0.786 3.262 695 HA ALA 101 HA ALA 101 -11.237 -3.480 3.864 696 HB1 ALA 101 1HB ALA 101 -8.945 -3.604 2.959 697 HB2 ALA 101 2HB ALA 101 -9.189 -2.061 2.142 698 HB3 ALA 101 3HB ALA 101 -10.133 -3.470 1.662 699 H GLU 102 H GLU 102 -8.762 -3.265 4.931 700 HA GLU 102 HA GLU 102 -8.948 -0.807 6.532 701 HB2 GLU 102 1HB GLU 102 -7.350 -3.267 7.216 702 HB3 GLU 102 2HB GLU 102 -7.796 -1.927 8.257 703 HG2 GLU 102 1HG GLU 102 -10.138 -2.597 8.134 704 HG3 GLU 102 2HG GLU 102 -9.681 -3.958 7.108 705 H VAL 103 H VAL 103 -7.868 0.527 5.060 706 HA VAL 103 HA VAL 103 -5.230 -0.295 4.185 707 HB VAL 103 HB VAL 103 -6.924 1.056 2.737 708 HG11 VAL 103 1HG1 VAL 103 -6.791 3.420 2.824 709 HG12 VAL 103 2HG1 VAL 103 -5.542 3.368 4.073 710 HG13 VAL 103 3HG1 VAL 103 -7.196 2.864 4.449 711 HG21 VAL 103 1HG2 VAL 103 -5.089 2.086 1.505 712 HG22 VAL 103 2HG2 VAL 103 -4.675 0.457 2.035 713 HG23 VAL 103 3HG2 VAL 103 -4.026 1.851 2.893 714 H ARG 104 H ARG 104 -3.380 0.446 4.922 715 HA ARG 104 HA ARG 104 -3.441 2.424 7.102 716 HB2 ARG 104 1HB ARG 104 -2.944 0.136 7.883 717 HB3 ARG 104 2HB ARG 104 -1.611 0.038 6.744 718 HG2 ARG 104 1HG ARG 104 -0.436 1.796 7.930 719 HG3 ARG 104 2HG ARG 104 -1.794 1.965 9.049 720 HD2 ARG 104 1HD ARG 104 -1.479 -0.300 9.830 721 HD3 ARG 104 2HD ARG 104 -0.205 -0.564 8.642 722 HE ARG 104 HE ARG 104 0.300 1.618 10.459 723 HH11 ARG 104 1HH1 ARG 104 0.551 -1.845 9.987 724 HH12 ARG 104 2HH1 ARG 104 1.922 -2.018 11.042 725 HH21 ARG 104 1HH2 ARG 104 2.115 1.372 11.860 726 HH22 ARG 104 2HH2 ARG 104 2.806 -0.210 12.090 727 H VAL 105 H VAL 105 -2.836 4.245 6.047 728 HA VAL 105 HA VAL 105 -1.001 4.122 3.843 729 HB VAL 105 HB VAL 105 -1.207 6.541 3.693 730 HG11 VAL 105 1HG1 VAL 105 -2.904 5.241 2.611 731 HG12 VAL 105 2HG1 VAL 105 -3.659 6.669 3.321 732 HG13 VAL 105 3HG1 VAL 105 -3.820 5.099 4.110 733 HG21 VAL 105 1HG2 VAL 105 -2.833 6.350 6.226 734 HG22 VAL 105 2HG2 VAL 105 -2.691 7.786 5.211 735 HG23 VAL 105 3HG2 VAL 105 -1.269 7.143 6.034 736 H ARG 106 H ARG 106 1.146 4.400 3.887 737 HA ARG 106 HA ARG 106 2.349 5.129 6.478 738 HB2 ARG 106 1HB ARG 106 3.387 3.197 4.397 739 HB3 ARG 106 2HB ARG 106 4.233 3.648 5.868 740 HG2 ARG 106 1HG ARG 106 1.539 2.309 5.840 741 HG3 ARG 106 2HG ARG 106 3.068 1.437 5.936 742 HD2 ARG 106 1HD ARG 106 2.236 1.658 8.155 743 HD3 ARG 106 2HD ARG 106 3.596 2.765 7.993 744 HE ARG 106 HE ARG 106 1.079 4.029 7.461 745 HH11 ARG 106 1HH1 ARG 106 3.280 3.050 9.998 746 HH12 ARG 106 2HH1 ARG 106 2.680 4.207 11.143 747 HH21 ARG 106 1HH2 ARG 106 0.291 5.559 8.959 748 HH22 ARG 106 2HH2 ARG 106 0.984 5.632 10.552 749 H THR 107 H THR 107 3.368 6.992 6.405 750 HA THR 107 HA THR 107 4.121 8.130 3.850 751 HB THR 107 HB THR 107 3.029 9.653 5.317 752 HG1 THR 107 HG1 THR 107 4.363 11.185 4.802 753 HG21 THR 107 1HG2 THR 107 3.921 10.266 7.537 754 HG22 THR 107 2HG2 THR 107 5.116 8.977 7.389 755 HG23 THR 107 3HG2 THR 107 3.398 8.584 7.454 756 H VAL 108 H VAL 108 5.895 7.227 3.059 757 HA VAL 108 HA VAL 108 8.158 6.687 4.830 758 HB VAL 108 HB VAL 108 9.114 5.439 2.913 759 HG11 VAL 108 1HG1 VAL 108 7.520 3.574 2.981 760 HG12 VAL 108 2HG1 VAL 108 6.308 4.645 3.684 761 HG13 VAL 108 3HG1 VAL 108 7.782 4.273 4.578 762 HG21 VAL 108 1HG2 VAL 108 7.696 4.957 0.965 763 HG22 VAL 108 2HG2 VAL 108 8.087 6.673 1.083 764 HG23 VAL 108 3HG2 VAL 108 6.492 6.098 1.568 765 H THR 109 H THR 109 10.241 7.426 4.403 766 HA THR 109 HA THR 109 10.512 9.525 2.351 767 HB THR 109 HB THR 109 12.095 10.647 4.069 768 HG1 THR 109 HG1 THR 109 11.283 8.578 5.511 769 HG21 THR 109 1HG2 THR 109 10.257 11.930 5.054 770 HG22 THR 109 2HG2 THR 109 9.112 10.693 4.539 771 HG23 THR 109 3HG2 THR 109 9.981 11.645 3.335 772 H SER 110 H SER 110 11.423 6.588 3.244 773 HA SER 110 HA SER 110 14.020 6.728 1.996 774 HB2 SER 110 1HB SER 110 13.765 5.713 4.840 775 HB3 SER 110 2HB SER 110 15.235 5.751 3.870 776 HG SER 110 HG SER 110 14.187 8.201 3.915 777 HA PRO 111 HA PRO 111 12.682 2.868 0.472 778 HB2 PRO 111 1HB PRO 111 15.463 1.887 0.521 779 HB3 PRO 111 2HB PRO 111 14.393 2.156 -0.855 780 HG2 PRO 111 1HG PRO 111 16.470 3.771 -0.362 781 HG3 PRO 111 2HG PRO 111 14.944 4.392 -1.018 782 HD2 PRO 111 1HD PRO 111 15.987 4.503 1.786 783 HD3 PRO 111 2HD PRO 111 15.141 5.750 0.848 784 H ASP 112 H ASP 112 14.732 2.819 3.317 785 HA ASP 112 HA ASP 112 14.295 0.025 3.824 786 HB2 ASP 112 1HB ASP 112 15.557 2.218 5.448 787 HB3 ASP 112 2HB ASP 112 15.313 0.599 6.096 788 H GLU 113 H GLU 113 12.807 3.028 4.829 789 HA GLU 113 HA GLU 113 11.211 2.035 6.913 790 HB2 GLU 113 1HB GLU 113 10.570 4.210 4.911 791 HB3 GLU 113 2HB GLU 113 9.695 3.921 6.407 792 HG2 GLU 113 1HG GLU 113 11.707 4.434 7.685 793 HG3 GLU 113 2HG GLU 113 12.584 4.724 6.184 794 H ALA 114 H ALA 114 10.716 2.193 3.431 795 HA ALA 114 HA ALA 114 8.117 1.247 3.254 796 HB1 ALA 114 1HB ALA 114 8.704 0.552 0.971 797 HB2 ALA 114 2HB ALA 114 10.412 0.778 1.353 798 HB3 ALA 114 3HB ALA 114 9.319 2.162 1.351 799 H LYS 115 H LYS 115 11.145 -0.619 3.137 800 HA LYS 115 HA LYS 115 9.950 -3.154 2.951 801 HB2 LYS 115 1HB LYS 115 12.628 -2.350 4.093 802 HB3 LYS 115 2HB LYS 115 12.150 -4.007 3.761 803 HG2 LYS 115 1HG LYS 115 11.981 -3.521 1.395 804 HG3 LYS 115 2HG LYS 115 12.356 -1.823 1.696 805 HD2 LYS 115 1HD LYS 115 14.196 -4.133 2.328 806 HD3 LYS 115 2HD LYS 115 14.305 -3.125 0.883 807 HE2 LYS 115 1HE LYS 115 14.705 -1.163 2.247 808 HE3 LYS 115 2HE LYS 115 14.506 -2.112 3.718 809 HZ1 LYS 115 1HZ LYS 115 16.658 -2.449 1.705 810 HZ2 LYS 115 2HZ LYS 115 16.458 -3.405 3.083 811 HZ3 LYS 115 3HZ LYS 115 16.826 -1.759 3.242 812 H ARG 116 H ARG 116 10.774 -1.139 5.703 813 HA ARG 116 HA ARG 116 10.470 -3.134 7.692 814 HB2 ARG 116 1HB ARG 116 11.734 -1.007 7.967 815 HB3 ARG 116 2HB ARG 116 10.205 -0.140 7.987 816 HG2 ARG 116 1HG ARG 116 9.557 -1.177 10.034 817 HG3 ARG 116 2HG ARG 116 10.932 -2.284 9.968 818 HD2 ARG 116 1HD ARG 116 11.050 0.713 10.289 819 HD3 ARG 116 2HD ARG 116 11.386 -0.488 11.536 820 HE ARG 116 HE ARG 116 13.180 -1.207 9.756 821 HH11 ARG 116 1HH1 ARG 116 12.302 2.016 10.799 822 HH12 ARG 116 2HH1 ARG 116 13.851 2.695 10.420 823 HH21 ARG 116 1HH2 ARG 116 15.223 -0.317 9.264 824 HH22 ARG 116 2HH2 ARG 116 15.514 1.369 9.542 825 H TRP 117 H TRP 117 8.259 -0.691 6.367 826 HA TRP 117 HA TRP 117 6.124 -1.303 8.129 827 HB2 TRP 117 1HB TRP 117 6.152 0.040 5.427 828 HB3 TRP 117 2HB TRP 117 4.696 -0.136 6.402 829 HD1 TRP 117 HD1 TRP 117 7.007 2.435 5.636 830 HE1 TRP 117 HE1 TRP 117 7.288 4.143 7.544 831 HE3 TRP 117 HE3 TRP 117 4.955 -0.277 9.456 832 HZ2 TRP 117 HZ2 TRP 117 6.712 4.308 10.306 833 HZ3 TRP 117 HZ3 TRP 117 4.859 0.728 11.696 834 HH2 TRP 117 HH2 TRP 117 5.719 2.972 12.110 835 H ILE 118 H ILE 118 6.962 -2.441 4.885 836 HA ILE 118 HA ILE 118 4.768 -4.167 4.535 837 HB ILE 118 HB ILE 118 7.594 -4.405 3.475 838 HG12 ILE 118 1HG1 ILE 118 5.065 -3.380 2.164 839 HG13 ILE 118 2HG1 ILE 118 6.353 -2.364 2.804 840 HG21 ILE 118 1HG2 ILE 118 6.646 -5.915 1.779 841 HG22 ILE 118 2HG2 ILE 118 5.098 -5.869 2.624 842 HG23 ILE 118 3HG2 ILE 118 6.511 -6.576 3.410 843 HD11 ILE 118 1HD1 ILE 118 6.623 -4.333 0.544 844 HD12 ILE 118 2HD1 ILE 118 7.902 -3.295 1.172 845 HD13 ILE 118 3HD1 ILE 118 6.495 -2.581 0.385 846 H LYS 119 H LYS 119 7.903 -4.599 6.077 847 HA LYS 119 HA LYS 119 7.770 -7.319 6.681 848 HB2 LYS 119 1HB LYS 119 9.805 -6.027 6.932 849 HB3 LYS 119 2HB LYS 119 9.067 -5.038 8.180 850 HG2 LYS 119 1HG LYS 119 8.942 -6.964 9.653 851 HG3 LYS 119 2HG LYS 119 9.649 -7.982 8.397 852 HD2 LYS 119 1HD LYS 119 11.700 -6.723 8.464 853 HD3 LYS 119 2HD LYS 119 10.993 -5.558 9.586 854 HE2 LYS 119 1HE LYS 119 11.402 -8.487 10.160 855 HE3 LYS 119 2HE LYS 119 12.476 -7.197 10.691 856 HZ1 LYS 119 1HZ LYS 119 10.626 -6.241 11.935 857 HZ2 LYS 119 2HZ LYS 119 10.959 -7.819 12.442 858 HZ3 LYS 119 3HZ LYS 119 9.626 -7.515 11.450 859 H GLU 120 H GLU 120 6.676 -4.520 8.586 860 HA GLU 120 HA GLU 120 5.688 -6.073 10.756 861 HB2 GLU 120 1HB GLU 120 6.312 -3.629 10.833 862 HB3 GLU 120 2HB GLU 120 4.827 -3.288 9.959 863 HG2 GLU 120 1HG GLU 120 3.545 -4.299 11.802 864 HG3 GLU 120 2HG GLU 120 5.051 -4.545 12.683 865 H PHE 121 H PHE 121 4.407 -5.078 7.708 866 HA PHE 121 HA PHE 121 1.649 -5.518 8.316 867 HB2 PHE 121 1HB PHE 121 2.212 -3.961 6.591 868 HB3 PHE 121 2HB PHE 121 3.181 -5.155 5.743 869 HD1 PHE 121 HD1 PHE 121 -0.256 -5.490 7.129 870 HD2 PHE 121 HD2 PHE 121 2.205 -5.301 3.663 871 HE1 PHE 121 HE1 PHE 121 -2.195 -6.033 5.722 872 HE2 PHE 121 HE2 PHE 121 0.267 -5.842 2.252 873 HZ PHE 121 HZ PHE 121 -1.938 -6.208 3.282 874 H SER 122 H SER 122 4.168 -7.388 6.683 875 HA SER 122 HA SER 122 2.454 -9.403 5.690 876 HB2 SER 122 1HB SER 122 5.414 -9.617 6.267 877 HB3 SER 122 2HB SER 122 4.482 -10.599 5.138 878 HG SER 122 HG SER 122 4.879 -7.788 4.947 879 H GLU 123 H GLU 123 3.939 -8.933 8.784 880 HA GLU 123 HA GLU 123 3.388 -11.717 9.537 881 HB2 GLU 123 1HB GLU 123 5.036 -9.646 10.997 882 HB3 GLU 123 2HB GLU 123 4.894 -11.348 11.415 883 HG2 GLU 123 1HG GLU 123 6.110 -10.259 8.885 884 HG3 GLU 123 2HG GLU 123 7.000 -10.845 10.288 885 H GLU 124 H GLU 124 1.395 -9.490 9.328 886 HA GLU 124 HA GLU 124 0.546 -9.371 12.146 887 HB2 GLU 124 1HB GLU 124 0.993 -7.199 10.887 888 HB3 GLU 124 2HB GLU 124 -0.424 -7.580 9.919 889 HG2 GLU 124 1HG GLU 124 -1.053 -6.054 11.647 890 HG3 GLU 124 2HG GLU 124 -1.776 -7.625 11.989 Start of MODEL 16 1 HA MET 21 HA MET 21 -8.054 -12.629 3.237 2 HB2 MET 21 1HB MET 21 -7.016 -11.113 4.759 3 HB3 MET 21 2HB MET 21 -7.388 -12.568 5.668 4 HG2 MET 21 1HG MET 21 -4.685 -11.797 4.590 5 HG3 MET 21 2HG MET 21 -5.211 -11.670 6.266 6 HE1 MET 21 1HE MET 21 -3.138 -13.024 7.153 7 HE2 MET 21 2HE MET 21 -2.525 -13.098 5.501 8 HE3 MET 21 3HE MET 21 -2.613 -14.566 6.477 9 H THR 22 H THR 22 -7.161 -10.905 1.997 10 HA THR 22 HA THR 22 -4.607 -11.601 0.706 11 HB THR 22 HB THR 22 -6.808 -9.900 -0.480 12 HG1 THR 22 HG1 THR 22 -6.191 -12.661 -0.864 13 HG21 THR 22 1HG2 THR 22 -4.574 -9.504 -1.407 14 HG22 THR 22 2HG2 THR 22 -5.614 -10.308 -2.583 15 HG23 THR 22 3HG2 THR 22 -4.390 -11.232 -1.711 16 H LEU 23 H LEU 23 -2.993 -10.127 0.688 17 HA LEU 23 HA LEU 23 -3.534 -7.568 2.038 18 HB2 LEU 23 1HB LEU 23 -0.996 -9.200 2.001 19 HB3 LEU 23 2HB LEU 23 -1.204 -7.667 2.820 20 HG LEU 23 HG LEU 23 -2.628 -10.241 3.504 21 HD11 LEU 23 1HD1 LEU 23 -0.476 -8.728 4.976 22 HD12 LEU 23 2HD1 LEU 23 -0.253 -10.238 4.096 23 HD13 LEU 23 3HD1 LEU 23 -1.283 -10.195 5.526 24 HD21 LEU 23 1HD2 LEU 23 -3.442 -9.010 5.464 25 HD22 LEU 23 2HD2 LEU 23 -4.037 -8.315 3.957 26 HD23 LEU 23 3HD2 LEU 23 -2.718 -7.533 4.827 27 H PHE 24 H PHE 24 -3.339 -5.852 0.788 28 HA PHE 24 HA PHE 24 -1.761 -6.062 -1.689 29 HB2 PHE 24 1HB PHE 24 -3.905 -4.063 -0.933 30 HB3 PHE 24 2HB PHE 24 -3.082 -4.148 -2.484 31 HD1 PHE 24 HD1 PHE 24 -3.889 -5.523 -4.190 32 HD2 PHE 24 HD2 PHE 24 -5.325 -6.028 -0.218 33 HE1 PHE 24 HE1 PHE 24 -5.606 -7.074 -5.012 34 HE2 PHE 24 HE2 PHE 24 -7.043 -7.581 -1.033 35 HZ PHE 24 HZ PHE 24 -7.189 -8.104 -3.433 36 H VAL 25 H VAL 25 -0.352 -4.359 -2.276 37 HA VAL 25 HA VAL 25 0.134 -2.309 -0.267 38 HB VAL 25 HB VAL 25 1.720 -3.961 0.409 39 HG11 VAL 25 1HG1 VAL 25 3.378 -4.939 -1.066 40 HG12 VAL 25 2HG1 VAL 25 2.707 -4.053 -2.433 41 HG13 VAL 25 3HG1 VAL 25 1.749 -5.300 -1.637 42 HG21 VAL 25 1HG2 VAL 25 2.536 -1.675 0.441 43 HG22 VAL 25 2HG2 VAL 25 3.106 -1.835 -1.220 44 HG23 VAL 25 3HG2 VAL 25 3.851 -2.789 0.063 45 H LEU 26 H LEU 26 0.232 -0.426 -1.158 46 HA LEU 26 HA LEU 26 0.969 -0.178 -4.003 47 HB2 LEU 26 1HB LEU 26 -0.865 1.497 -2.281 48 HB3 LEU 26 2HB LEU 26 -0.257 2.049 -3.822 49 HG LEU 26 HG LEU 26 -1.421 0.203 -4.957 50 HD11 LEU 26 1HD1 LEU 26 -2.533 -0.435 -2.233 51 HD12 LEU 26 2HD1 LEU 26 -1.427 -1.447 -3.163 52 HD13 LEU 26 3HD1 LEU 26 -3.058 -1.145 -3.761 53 HD21 LEU 26 1HD2 LEU 26 -3.162 1.851 -3.138 54 HD22 LEU 26 2HD2 LEU 26 -3.694 1.028 -4.604 55 HD23 LEU 26 3HD2 LEU 26 -2.526 2.343 -4.707 56 H ILE 27 H ILE 27 2.147 1.820 -4.541 57 HA ILE 27 HA ILE 27 3.476 3.141 -2.329 58 HB ILE 27 HB ILE 27 4.936 1.280 -2.527 59 HG12 ILE 27 1HG1 ILE 27 6.217 3.478 -4.167 60 HG13 ILE 27 2HG1 ILE 27 6.010 3.548 -2.417 61 HG21 ILE 27 1HG2 ILE 27 5.015 1.763 -5.500 62 HG22 ILE 27 2HG2 ILE 27 4.158 0.454 -4.690 63 HG23 ILE 27 3HG2 ILE 27 5.921 0.528 -4.626 64 HD11 ILE 27 1HD1 ILE 27 7.424 1.572 -2.180 65 HD12 ILE 27 2HD1 ILE 27 8.262 2.877 -3.018 66 HD13 ILE 27 3HD1 ILE 27 7.626 1.509 -3.931 67 H LEU 28 H LEU 28 3.166 5.244 -2.856 68 HA LEU 28 HA LEU 28 3.475 6.036 -5.666 69 HB2 LEU 28 1HB LEU 28 2.940 7.853 -3.316 70 HB3 LEU 28 2HB LEU 28 2.677 8.194 -5.013 71 HG LEU 28 HG LEU 28 1.073 6.322 -3.281 72 HD11 LEU 28 1HD1 LEU 28 0.572 8.634 -2.880 73 HD12 LEU 28 2HD1 LEU 28 -0.736 7.922 -3.826 74 HD13 LEU 28 3HD1 LEU 28 0.460 8.952 -4.609 75 HD21 LEU 28 1HD2 LEU 28 0.635 6.980 -6.186 76 HD22 LEU 28 2HD2 LEU 28 -0.285 5.854 -5.186 77 HD23 LEU 28 3HD2 LEU 28 1.385 5.493 -5.610 78 H SER 29 H SER 29 5.698 5.391 -5.609 79 HA SER 29 HA SER 29 7.365 7.675 -5.007 80 HB2 SER 29 1HB SER 29 8.013 4.898 -3.986 81 HB3 SER 29 2HB SER 29 9.117 6.269 -3.948 82 HG SER 29 HG SER 29 6.711 6.888 -2.859 83 H ASN 30 H ASN 30 8.835 7.987 -6.721 84 HA ASN 30 HA ASN 30 9.489 5.495 -8.147 85 HB2 ASN 30 1HB ASN 30 10.032 6.857 -10.139 86 HB3 ASN 30 2HB ASN 30 8.346 7.012 -9.669 87 HD21 ASN 30 1HD2 ASN 30 10.049 8.765 -11.271 88 HD22 ASN 30 2HD2 ASN 30 9.992 10.313 -10.502 89 H ASP 31 H ASP 31 11.038 5.091 -6.554 90 HA ASP 31 HA ASP 31 13.562 6.447 -7.188 91 HB2 ASP 31 1HB ASP 31 13.121 6.788 -4.853 92 HB3 ASP 31 2HB ASP 31 12.737 5.092 -4.625 93 H LYS 32 H LYS 32 15.299 5.100 -7.807 94 HA LYS 32 HA LYS 32 14.544 2.740 -9.123 95 HB2 LYS 32 1HB LYS 32 17.325 3.546 -8.281 96 HB3 LYS 32 2HB LYS 32 16.910 2.362 -9.513 97 HG2 LYS 32 1HG LYS 32 15.604 4.416 -10.539 98 HG3 LYS 32 2HG LYS 32 16.805 5.321 -9.614 99 HD2 LYS 32 1HD LYS 32 17.369 3.180 -11.653 100 HD3 LYS 32 2HD LYS 32 17.580 4.915 -11.889 101 HE2 LYS 32 1HE LYS 32 19.302 4.978 -10.198 102 HE3 LYS 32 2HE LYS 32 19.030 3.280 -9.810 103 HZ1 LYS 32 1HZ LYS 32 19.995 4.297 -12.426 104 HZ2 LYS 32 2HZ LYS 32 19.786 2.673 -12.005 105 HZ3 LYS 32 3HZ LYS 32 20.970 3.601 -11.231 106 H LYS 33 H LYS 33 16.450 3.129 -6.136 107 HA LYS 33 HA LYS 33 16.782 0.323 -5.775 108 HB2 LYS 33 1HB LYS 33 18.374 2.026 -4.936 109 HB3 LYS 33 2HB LYS 33 17.161 2.565 -3.785 110 HG2 LYS 33 1HG LYS 33 17.187 0.350 -2.735 111 HG3 LYS 33 2HG LYS 33 18.435 -0.161 -3.873 112 HD2 LYS 33 1HD LYS 33 19.913 1.606 -3.024 113 HD3 LYS 33 2HD LYS 33 18.665 2.081 -1.870 114 HE2 LYS 33 1HE LYS 33 18.767 -0.160 -0.867 115 HE3 LYS 33 2HE LYS 33 20.047 -0.596 -1.998 116 HZ1 LYS 33 1HZ LYS 33 21.428 1.136 -1.050 117 HZ2 LYS 33 2HZ LYS 33 20.934 0.056 0.149 118 HZ3 LYS 33 3HZ LYS 33 20.199 1.571 0.025 119 H LEU 34 H LEU 34 14.743 2.766 -4.224 120 HA LEU 34 HA LEU 34 13.595 1.182 -2.238 121 HB2 LEU 34 1HB LEU 34 13.304 3.495 -2.076 122 HB3 LEU 34 2HB LEU 34 12.710 3.621 -3.712 123 HG LEU 34 HG LEU 34 10.613 2.508 -3.012 124 HD11 LEU 34 1HD1 LEU 34 10.094 2.137 -0.741 125 HD12 LEU 34 2HD1 LEU 34 11.591 2.894 -0.205 126 HD13 LEU 34 3HD1 LEU 34 11.639 1.344 -1.048 127 HD21 LEU 34 1HD2 LEU 34 10.746 4.927 -3.135 128 HD22 LEU 34 2HD2 LEU 34 11.364 4.991 -1.484 129 HD23 LEU 34 3HD2 LEU 34 9.718 4.432 -1.789 130 H ILE 35 H ILE 35 12.557 1.679 -5.591 131 HA ILE 35 HA ILE 35 10.098 0.343 -5.387 132 HB ILE 35 HB ILE 35 11.904 0.997 -7.690 133 HG12 ILE 35 1HG1 ILE 35 9.089 1.814 -6.939 134 HG13 ILE 35 2HG1 ILE 35 10.545 2.762 -6.654 135 HG21 ILE 35 1HG2 ILE 35 9.306 -0.513 -7.935 136 HG22 ILE 35 2HG2 ILE 35 10.912 -1.164 -8.263 137 HG23 ILE 35 3HG2 ILE 35 10.265 0.134 -9.266 138 HD11 ILE 35 1HD1 ILE 35 9.493 1.976 -9.358 139 HD12 ILE 35 2HD1 ILE 35 10.884 3.012 -9.031 140 HD13 ILE 35 3HD1 ILE 35 9.260 3.543 -8.583 141 H GLU 36 H GLU 36 13.359 -0.849 -5.945 142 HA GLU 36 HA GLU 36 12.539 -3.552 -6.405 143 HB2 GLU 36 1HB GLU 36 15.213 -2.441 -5.537 144 HB3 GLU 36 2HB GLU 36 14.925 -4.103 -6.028 145 HG2 GLU 36 1HG GLU 36 14.232 -3.291 -8.249 146 HG3 GLU 36 2HG GLU 36 14.625 -1.652 -7.737 147 H GLU 37 H GLU 37 13.801 -1.756 -3.614 148 HA GLU 37 HA GLU 37 13.945 -3.843 -1.773 149 HB2 GLU 37 1HB GLU 37 13.276 -0.936 -1.273 150 HB3 GLU 37 2HB GLU 37 13.751 -2.087 -0.033 151 HG2 GLU 37 1HG GLU 37 15.452 -1.232 -2.363 152 HG3 GLU 37 2HG GLU 37 15.592 -0.632 -0.713 153 H ALA 38 H ALA 38 11.224 -1.759 -2.619 154 HA ALA 38 HA ALA 38 9.420 -2.629 -0.662 155 HB1 ALA 38 1HB ALA 38 9.063 -0.638 -2.054 156 HB2 ALA 38 2HB ALA 38 7.675 -1.727 -2.097 157 HB3 ALA 38 3HB ALA 38 8.797 -1.675 -3.457 158 H ARG 39 H ARG 39 9.963 -3.816 -3.975 159 HA ARG 39 HA ARG 39 7.964 -5.827 -3.779 160 HB2 ARG 39 1HB ARG 39 8.601 -5.044 -5.960 161 HB3 ARG 39 2HB ARG 39 10.273 -5.522 -5.698 162 HG2 ARG 39 1HG ARG 39 9.763 -7.805 -5.855 163 HG3 ARG 39 2HG ARG 39 8.030 -7.523 -5.654 164 HD2 ARG 39 1HD ARG 39 9.699 -6.668 -8.022 165 HD3 ARG 39 2HD ARG 39 8.615 -8.058 -7.975 166 HE ARG 39 HE ARG 39 7.831 -5.231 -7.976 167 HH11 ARG 39 1HH1 ARG 39 6.933 -8.615 -8.090 168 HH12 ARG 39 2HH1 ARG 39 5.303 -8.299 -8.592 169 HH21 ARG 39 1HH2 ARG 39 5.678 -4.817 -8.647 170 HH22 ARG 39 2HH2 ARG 39 4.586 -6.144 -8.895 171 H LYS 40 H LYS 40 11.441 -5.768 -3.180 172 HA LYS 40 HA LYS 40 11.958 -8.473 -2.966 173 HB2 LYS 40 1HB LYS 40 13.056 -6.188 -1.330 174 HB3 LYS 40 2HB LYS 40 13.694 -7.825 -1.261 175 HG2 LYS 40 1HG LYS 40 14.232 -7.717 -3.637 176 HG3 LYS 40 2HG LYS 40 13.592 -6.075 -3.708 177 HD2 LYS 40 1HD LYS 40 15.287 -5.335 -2.123 178 HD3 LYS 40 2HD LYS 40 15.909 -6.982 -2.004 179 HE2 LYS 40 1HE LYS 40 15.851 -5.281 -4.495 180 HE3 LYS 40 2HE LYS 40 17.272 -5.626 -3.508 181 HZ1 LYS 40 1HZ LYS 40 15.665 -7.624 -5.007 182 HZ2 LYS 40 2HZ LYS 40 16.997 -7.981 -4.029 183 HZ3 LYS 40 3HZ LYS 40 17.202 -7.062 -5.432 184 H MET 41 H MET 41 10.493 -6.322 -0.601 185 HA MET 41 HA MET 41 10.287 -8.421 1.370 186 HB2 MET 41 1HB MET 41 9.203 -5.607 1.334 187 HB3 MET 41 2HB MET 41 9.064 -6.711 2.695 188 HG2 MET 41 1HG MET 41 11.627 -5.686 1.507 189 HG3 MET 41 2HG MET 41 10.873 -5.133 2.999 190 HE1 MET 41 1HE MET 41 11.203 -8.245 5.323 191 HE2 MET 41 2HE MET 41 9.828 -7.811 4.309 192 HE3 MET 41 3HE MET 41 10.696 -6.561 5.200 193 H ALA 42 H ALA 42 8.067 -6.622 -0.744 194 HA ALA 42 HA ALA 42 5.725 -7.811 0.361 195 HB1 ALA 42 1HB ALA 42 5.684 -5.632 -0.723 196 HB2 ALA 42 2HB ALA 42 4.539 -6.751 -1.459 197 HB3 ALA 42 3HB ALA 42 6.063 -6.392 -2.269 198 H GLU 43 H GLU 43 7.679 -8.520 -2.511 199 HA GLU 43 HA GLU 43 5.973 -10.487 -3.594 200 HB2 GLU 43 1HB GLU 43 8.148 -9.319 -4.538 201 HB3 GLU 43 2HB GLU 43 8.950 -10.707 -3.827 202 HG2 GLU 43 1HG GLU 43 6.760 -10.827 -5.888 203 HG3 GLU 43 2HG GLU 43 8.482 -11.003 -6.210 204 H LYS 44 H LYS 44 8.744 -10.636 -1.413 205 HA LYS 44 HA LYS 44 8.709 -13.395 -0.878 206 HB2 LYS 44 1HB LYS 44 10.588 -11.885 -0.381 207 HB3 LYS 44 2HB LYS 44 9.630 -11.122 0.879 208 HG2 LYS 44 1HG LYS 44 9.644 -13.099 2.197 209 HG3 LYS 44 2HG LYS 44 10.357 -14.037 0.880 210 HD2 LYS 44 1HD LYS 44 12.356 -12.645 0.978 211 HD3 LYS 44 2HD LYS 44 11.657 -11.723 2.308 212 HE2 LYS 44 1HE LYS 44 11.588 -13.760 3.670 213 HE3 LYS 44 2HE LYS 44 12.300 -14.670 2.340 214 HZ1 LYS 44 1HZ LYS 44 13.593 -12.393 3.738 215 HZ2 LYS 44 2HZ LYS 44 14.280 -13.315 2.498 216 HZ3 LYS 44 3HZ LYS 44 13.948 -14.026 3.996 217 H ALA 45 H ALA 45 6.990 -10.682 0.534 218 HA ALA 45 HA ALA 45 5.865 -12.217 2.680 219 HB1 ALA 45 1HB ALA 45 5.206 -9.458 1.687 220 HB2 ALA 45 2HB ALA 45 6.284 -9.867 3.020 221 HB3 ALA 45 3HB ALA 45 4.555 -10.190 3.153 222 H ASN 46 H ASN 46 5.279 -12.088 -0.545 223 HA ASN 46 HA ASN 46 3.669 -12.871 -1.921 224 HB2 ASN 46 1HB ASN 46 3.743 -14.776 -0.264 225 HB3 ASN 46 2HB ASN 46 2.363 -14.041 0.543 226 HD21 ASN 46 1HD2 ASN 46 1.171 -15.925 0.133 227 HD22 ASN 46 2HD2 ASN 46 0.509 -16.247 -1.432 228 H LEU 47 H LEU 47 3.453 -10.283 -1.165 229 HA LEU 47 HA LEU 47 0.591 -9.801 -0.703 230 HB2 LEU 47 1HB LEU 47 2.724 -7.699 -0.993 231 HB3 LEU 47 2HB LEU 47 1.150 -7.546 -0.243 232 HG LEU 47 HG LEU 47 3.505 -9.068 0.869 233 HD11 LEU 47 1HD1 LEU 47 3.772 -6.657 0.986 234 HD12 LEU 47 2HD1 LEU 47 3.482 -7.329 2.591 235 HD13 LEU 47 3HD1 LEU 47 2.181 -6.505 1.732 236 HD21 LEU 47 1HD2 LEU 47 2.168 -9.446 2.828 237 HD22 LEU 47 2HD2 LEU 47 1.320 -10.096 1.424 238 HD23 LEU 47 3HD2 LEU 47 0.819 -8.558 2.127 239 H ILE 48 H ILE 48 -0.362 -8.028 -2.090 240 HA ILE 48 HA ILE 48 0.523 -8.368 -4.867 241 HB ILE 48 HB ILE 48 -2.069 -7.197 -3.835 242 HG12 ILE 48 1HG1 ILE 48 -1.456 -9.917 -5.012 243 HG13 ILE 48 2HG1 ILE 48 -1.885 -9.589 -3.339 244 HG21 ILE 48 1HG2 ILE 48 -2.827 -7.368 -6.153 245 HG22 ILE 48 2HG2 ILE 48 -1.236 -7.958 -6.635 246 HG23 ILE 48 3HG2 ILE 48 -1.418 -6.314 -6.019 247 HD11 ILE 48 1HD1 ILE 48 -3.660 -9.168 -5.731 248 HD12 ILE 48 2HD1 ILE 48 -4.092 -8.843 -4.053 249 HD13 ILE 48 3HD1 ILE 48 -3.763 -10.496 -4.574 250 H LEU 49 H LEU 49 2.010 -6.903 -5.389 251 HA LEU 49 HA LEU 49 1.884 -4.221 -4.237 252 HB2 LEU 49 1HB LEU 49 4.005 -5.380 -4.051 253 HB3 LEU 49 2HB LEU 49 4.044 -5.657 -5.780 254 HG LEU 49 HG LEU 49 4.147 -3.145 -6.072 255 HD11 LEU 49 1HD1 LEU 49 4.761 -3.232 -3.123 256 HD12 LEU 49 2HD1 LEU 49 3.323 -2.519 -3.858 257 HD13 LEU 49 3HD1 LEU 49 4.914 -1.825 -4.178 258 HD21 LEU 49 1HD2 LEU 49 6.100 -4.574 -6.336 259 HD22 LEU 49 2HD2 LEU 49 6.406 -4.489 -4.600 260 HD23 LEU 49 3HD2 LEU 49 6.537 -3.036 -5.590 261 H ILE 50 H ILE 50 1.059 -2.588 -5.354 262 HA ILE 50 HA ILE 50 1.286 -2.687 -8.292 263 HB ILE 50 HB ILE 50 -0.839 -1.146 -6.791 264 HG12 ILE 50 1HG1 ILE 50 -2.290 -2.984 -8.080 265 HG13 ILE 50 2HG1 ILE 50 -0.832 -3.938 -7.847 266 HG21 ILE 50 1HG2 ILE 50 -1.858 -0.907 -9.001 267 HG22 ILE 50 2HG2 ILE 50 -0.517 -1.804 -9.716 268 HG23 ILE 50 3HG2 ILE 50 -0.228 -0.235 -8.966 269 HD11 ILE 50 1HD1 ILE 50 -2.435 -2.618 -5.673 270 HD12 ILE 50 2HD1 ILE 50 -0.984 -3.593 -5.442 271 HD13 ILE 50 3HD1 ILE 50 -2.451 -4.332 -6.083 272 H THR 51 H THR 51 2.869 -1.388 -8.895 273 HA THR 51 HA THR 51 3.651 0.850 -7.214 274 HB THR 51 HB THR 51 4.987 -0.035 -9.774 275 HG1 THR 51 HG1 THR 51 5.392 -0.994 -7.111 276 HG21 THR 51 1HG2 THR 51 6.044 1.341 -7.298 277 HG22 THR 51 2HG2 THR 51 5.684 2.133 -8.831 278 HG23 THR 51 3HG2 THR 51 6.976 0.936 -8.739 279 H VAL 52 H VAL 52 2.328 2.555 -7.521 280 HA VAL 52 HA VAL 52 2.031 3.580 -10.268 281 HB VAL 52 HB VAL 52 -0.091 4.692 -9.420 282 HG11 VAL 52 1HG1 VAL 52 -0.210 2.796 -10.913 283 HG12 VAL 52 2HG1 VAL 52 -1.477 2.670 -9.692 284 HG13 VAL 52 3HG1 VAL 52 -0.021 1.684 -9.560 285 HG21 VAL 52 1HG2 VAL 52 0.269 2.703 -7.182 286 HG22 VAL 52 2HG2 VAL 52 -1.207 3.612 -7.505 287 HG23 VAL 52 3HG2 VAL 52 0.266 4.462 -7.040 288 H GLY 53 H GLY 53 2.449 5.771 -10.567 289 HA2 GLY 53 1HA GLY 53 3.264 7.228 -8.129 290 HA3 GLY 53 2HA GLY 53 4.102 7.392 -9.666 291 H ASP 54 H ASP 54 1.406 8.280 -7.765 292 HA ASP 54 HA ASP 54 0.941 10.793 -8.487 293 HB2 ASP 54 1HB ASP 54 0.634 9.949 -10.874 294 HB3 ASP 54 2HB ASP 54 -0.839 9.166 -10.318 295 H GLU 55 H GLU 55 -1.071 11.615 -7.604 296 HA GLU 55 HA GLU 55 -2.068 9.952 -5.509 297 HB2 GLU 55 1HB GLU 55 -3.099 12.629 -6.456 298 HB3 GLU 55 2HB GLU 55 -3.509 11.846 -4.941 299 HG2 GLU 55 1HG GLU 55 -1.918 13.536 -4.456 300 HG3 GLU 55 2HG GLU 55 -1.114 11.979 -4.282 301 H GLU 56 H GLU 56 -3.158 10.802 -8.703 302 HA GLU 56 HA GLU 56 -5.809 9.732 -8.213 303 HB2 GLU 56 1HB GLU 56 -4.535 10.737 -10.760 304 HB3 GLU 56 2HB GLU 56 -6.219 10.258 -10.590 305 HG2 GLU 56 1HG GLU 56 -4.842 12.559 -9.228 306 HG3 GLU 56 2HG GLU 56 -6.063 12.646 -10.497 307 H GLU 57 H GLU 57 -2.810 8.812 -9.821 308 HA GLU 57 HA GLU 57 -3.714 6.352 -10.878 309 HB2 GLU 57 1HB GLU 57 -0.978 7.271 -9.982 310 HB3 GLU 57 2HB GLU 57 -1.263 5.672 -10.651 311 HG2 GLU 57 1HG GLU 57 -1.904 8.234 -12.083 312 HG3 GLU 57 2HG GLU 57 -0.408 7.321 -12.288 313 H LEU 58 H LEU 58 -2.595 7.333 -7.686 314 HA LEU 58 HA LEU 58 -2.483 4.863 -6.417 315 HB2 LEU 58 1HB LEU 58 -1.909 6.969 -5.284 316 HB3 LEU 58 2HB LEU 58 -3.592 7.455 -5.322 317 HG LEU 58 HG LEU 58 -4.124 5.451 -3.905 318 HD11 LEU 58 1HD1 LEU 58 -2.035 4.223 -4.511 319 HD12 LEU 58 2HD1 LEU 58 -2.404 4.266 -2.789 320 HD13 LEU 58 3HD1 LEU 58 -1.157 5.324 -3.450 321 HD21 LEU 58 1HD2 LEU 58 -3.915 7.695 -2.947 322 HD22 LEU 58 2HD2 LEU 58 -2.190 7.426 -2.706 323 HD23 LEU 58 3HD2 LEU 58 -3.364 6.448 -1.830 324 H LYS 59 H LYS 59 -5.237 6.952 -7.088 325 HA LYS 59 HA LYS 59 -7.189 5.374 -5.834 326 HB2 LYS 59 1HB LYS 59 -7.452 7.374 -8.065 327 HB3 LYS 59 2HB LYS 59 -8.801 6.708 -7.153 328 HG2 LYS 59 1HG LYS 59 -7.964 7.704 -5.116 329 HG3 LYS 59 2HG LYS 59 -6.534 8.293 -5.963 330 HD2 LYS 59 1HD LYS 59 -7.893 9.743 -7.333 331 HD3 LYS 59 2HD LYS 59 -9.371 9.087 -6.619 332 HE2 LYS 59 1HE LYS 59 -8.928 11.179 -5.572 333 HE3 LYS 59 2HE LYS 59 -8.552 9.915 -4.404 334 HZ1 LYS 59 1HZ LYS 59 -6.204 10.153 -4.991 335 HZ2 LYS 59 2HZ LYS 59 -6.849 11.600 -4.404 336 HZ3 LYS 59 3HZ LYS 59 -6.591 11.408 -6.067 337 H LYS 60 H LYS 60 -5.528 4.936 -8.729 338 HA LYS 60 HA LYS 60 -7.585 3.295 -9.964 339 HB2 LYS 60 1HB LYS 60 -4.770 3.836 -10.910 340 HB3 LYS 60 2HB LYS 60 -6.142 3.286 -11.874 341 HG2 LYS 60 1HG LYS 60 -6.125 5.905 -10.406 342 HG3 LYS 60 2HG LYS 60 -5.555 5.735 -12.083 343 HD2 LYS 60 1HD LYS 60 -7.699 5.040 -12.815 344 HD3 LYS 60 2HD LYS 60 -8.281 4.845 -11.165 345 HE2 LYS 60 1HE LYS 60 -8.000 7.298 -10.850 346 HE3 LYS 60 2HE LYS 60 -7.592 7.424 -12.562 347 HZ1 LYS 60 1HZ LYS 60 -10.153 6.398 -11.463 348 HZ2 LYS 60 2HZ LYS 60 -9.762 6.510 -13.105 349 HZ3 LYS 60 3HZ LYS 60 -9.920 7.915 -12.178 350 H ALA 61 H ALA 61 -4.398 2.976 -8.486 351 HA ALA 61 HA ALA 61 -4.253 0.141 -8.695 352 HB1 ALA 61 1HB ALA 61 -2.516 0.335 -6.958 353 HB2 ALA 61 2HB ALA 61 -2.944 2.032 -6.738 354 HB3 ALA 61 3HB ALA 61 -2.264 1.484 -8.270 355 H ILE 62 H ILE 62 -5.427 2.417 -6.304 356 HA ILE 62 HA ILE 62 -6.304 0.646 -4.326 357 HB ILE 62 HB ILE 62 -7.218 3.377 -5.192 358 HG12 ILE 62 1HG1 ILE 62 -5.912 2.384 -2.655 359 HG13 ILE 62 2HG1 ILE 62 -5.060 3.121 -4.007 360 HG21 ILE 62 1HG2 ILE 62 -9.191 2.173 -4.328 361 HG22 ILE 62 2HG2 ILE 62 -8.709 3.535 -3.319 362 HG23 ILE 62 3HG2 ILE 62 -8.318 1.890 -2.822 363 HD11 ILE 62 1HD1 ILE 62 -7.145 4.451 -2.295 364 HD12 ILE 62 2HD1 ILE 62 -6.298 5.190 -3.654 365 HD13 ILE 62 3HD1 ILE 62 -5.403 4.709 -2.214 366 H LYS 63 H LYS 63 -7.887 1.795 -7.271 367 HA LYS 63 HA LYS 63 -10.421 0.702 -6.832 368 HB2 LYS 63 1HB LYS 63 -9.903 2.362 -8.583 369 HB3 LYS 63 2HB LYS 63 -9.002 1.140 -9.466 370 HG2 LYS 63 1HG LYS 63 -11.185 1.446 -10.448 371 HG3 LYS 63 2HG LYS 63 -11.060 -0.166 -9.740 372 HD2 LYS 63 1HD LYS 63 -12.312 0.558 -7.796 373 HD3 LYS 63 2HD LYS 63 -12.362 2.211 -8.410 374 HE2 LYS 63 1HE LYS 63 -14.473 1.067 -8.819 375 HE3 LYS 63 2HE LYS 63 -13.665 1.458 -10.337 376 HZ1 LYS 63 1HZ LYS 63 -13.628 -1.200 -9.012 377 HZ2 LYS 63 2HZ LYS 63 -12.902 -0.820 -10.491 378 HZ3 LYS 63 3HZ LYS 63 -14.585 -0.784 -10.342 379 H LYS 64 H LYS 64 -7.581 -0.688 -8.479 380 HA LYS 64 HA LYS 64 -8.953 -3.116 -9.098 381 HB2 LYS 64 1HB LYS 64 -6.812 -3.955 -9.878 382 HB3 LYS 64 2HB LYS 64 -7.085 -2.329 -10.475 383 HG2 LYS 64 1HG LYS 64 -5.596 -1.464 -8.708 384 HG3 LYS 64 2HG LYS 64 -5.272 -3.125 -8.211 385 HD2 LYS 64 1HD LYS 64 -3.488 -2.333 -9.649 386 HD3 LYS 64 2HD LYS 64 -4.397 -3.602 -10.469 387 HE2 LYS 64 1HE LYS 64 -5.645 -1.894 -11.709 388 HE3 LYS 64 2HE LYS 64 -4.724 -0.633 -10.894 389 HZ1 LYS 64 1HZ LYS 64 -2.715 -1.476 -11.921 390 HZ2 LYS 64 2HZ LYS 64 -3.863 -1.105 -13.104 391 HZ3 LYS 64 3HZ LYS 64 -3.584 -2.716 -12.675 392 H ALA 65 H ALA 65 -6.870 -2.049 -6.470 393 HA ALA 65 HA ALA 65 -6.458 -4.553 -5.256 394 HB1 ALA 65 1HB ALA 65 -5.943 -3.295 -3.230 395 HB2 ALA 65 2HB ALA 65 -6.658 -1.845 -3.936 396 HB3 ALA 65 3HB ALA 65 -5.198 -2.542 -4.640 397 H ASP 66 H ASP 66 -8.928 -2.079 -4.710 398 HA ASP 66 HA ASP 66 -10.475 -3.432 -2.814 399 HB2 ASP 66 1HB ASP 66 -10.877 -1.125 -3.139 400 HB3 ASP 66 2HB ASP 66 -11.091 -1.312 -4.862 401 H ASP 67 H ASP 67 -10.540 -3.508 -6.343 402 HA ASP 67 HA ASP 67 -12.858 -5.100 -6.603 403 HB2 ASP 67 1HB ASP 67 -11.964 -3.775 -8.461 404 HB3 ASP 67 2HB ASP 67 -10.532 -4.800 -8.510 405 H ILE 68 H ILE 68 -9.398 -5.978 -6.681 406 HA ILE 68 HA ILE 68 -9.773 -8.721 -7.149 407 HB ILE 68 HB ILE 68 -7.508 -7.334 -5.709 408 HG12 ILE 68 1HG1 ILE 68 -7.688 -8.304 -8.568 409 HG13 ILE 68 2HG1 ILE 68 -7.921 -6.632 -8.073 410 HG21 ILE 68 1HG2 ILE 68 -7.633 -10.124 -6.853 411 HG22 ILE 68 2HG2 ILE 68 -7.555 -9.700 -5.143 412 HG23 ILE 68 3HG2 ILE 68 -6.191 -9.344 -6.203 413 HD11 ILE 68 1HD1 ILE 68 -5.397 -8.236 -7.734 414 HD12 ILE 68 2HD1 ILE 68 -5.629 -6.560 -7.238 415 HD13 ILE 68 3HD1 ILE 68 -5.687 -6.989 -8.947 416 H ALA 69 H ALA 69 -9.450 -6.909 -4.124 417 HA ALA 69 HA ALA 69 -9.403 -9.134 -2.405 418 HB1 ALA 69 1HB ALA 69 -10.412 -6.371 -1.757 419 HB2 ALA 69 2HB ALA 69 -8.711 -6.832 -1.796 420 HB3 ALA 69 3HB ALA 69 -9.798 -7.579 -0.626 421 H LYS 70 H LYS 70 -12.088 -6.960 -3.246 422 HA LYS 70 HA LYS 70 -13.907 -8.400 -1.561 423 HB2 LYS 70 1HB LYS 70 -14.307 -6.199 -3.550 424 HB3 LYS 70 2HB LYS 70 -15.557 -6.778 -2.457 425 HG2 LYS 70 1HG LYS 70 -14.527 -5.899 -0.590 426 HG3 LYS 70 2HG LYS 70 -12.941 -5.860 -1.359 427 HD2 LYS 70 1HD LYS 70 -13.767 -3.617 -1.128 428 HD3 LYS 70 2HD LYS 70 -13.736 -4.054 -2.830 429 HE2 LYS 70 1HE LYS 70 -16.122 -4.475 -2.796 430 HE3 LYS 70 2HE LYS 70 -16.182 -4.117 -1.071 431 HZ1 LYS 70 1HZ LYS 70 -15.180 -2.138 -3.022 432 HZ2 LYS 70 2HZ LYS 70 -15.753 -1.872 -1.449 433 HZ3 LYS 70 3HZ LYS 70 -16.834 -2.281 -2.686 434 H LYS 71 H LYS 71 -12.926 -8.771 -4.782 435 HA LYS 71 HA LYS 71 -15.282 -9.970 -5.786 436 HB2 LYS 71 1HB LYS 71 -13.444 -9.216 -7.239 437 HB3 LYS 71 2HB LYS 71 -12.386 -10.431 -6.542 438 HG2 LYS 71 1HG LYS 71 -14.881 -11.441 -7.735 439 HG3 LYS 71 2HG LYS 71 -13.712 -10.739 -8.854 440 HD2 LYS 71 1HD LYS 71 -11.976 -12.230 -7.937 441 HD3 LYS 71 2HD LYS 71 -13.184 -12.956 -6.873 442 HE2 LYS 71 1HE LYS 71 -12.790 -14.319 -8.872 443 HE3 LYS 71 2HE LYS 71 -14.447 -13.725 -8.799 444 HZ1 LYS 71 1HZ LYS 71 -13.861 -11.996 -10.381 445 HZ2 LYS 71 2HZ LYS 71 -13.523 -13.523 -11.020 446 HZ3 LYS 71 3HZ LYS 71 -12.267 -12.556 -10.440 447 H GLN 72 H GLN 72 -12.611 -11.066 -3.821 448 HA GLN 72 HA GLN 72 -13.874 -13.730 -3.718 449 HB2 GLN 72 1HB GLN 72 -11.495 -14.647 -3.511 450 HB3 GLN 72 2HB GLN 72 -12.045 -14.125 -5.097 451 HG2 GLN 72 1HG GLN 72 -10.887 -11.963 -4.729 452 HG3 GLN 72 2HG GLN 72 -10.253 -12.605 -3.217 453 HE21 GLN 72 1HE2 GLN 72 -8.139 -12.347 -3.955 454 HE22 GLN 72 2HE2 GLN 72 -7.443 -13.414 -5.122 455 H ASN 73 H ASN 73 -11.607 -11.591 -1.939 456 HA ASN 73 HA ASN 73 -11.899 -13.441 0.319 457 HB2 ASN 73 1HB ASN 73 -9.441 -11.969 -0.595 458 HB3 ASN 73 2HB ASN 73 -9.547 -12.853 0.925 459 HD21 ASN 73 1HD2 ASN 73 -7.823 -13.297 -1.367 460 HD22 ASN 73 2HD2 ASN 73 -8.136 -14.914 -1.912 461 H SER 74 H SER 74 -13.208 -10.683 -0.228 462 HA SER 74 HA SER 74 -12.052 -8.855 1.580 463 HB2 SER 74 1HB SER 74 -14.425 -7.796 1.422 464 HB3 SER 74 2HB SER 74 -13.360 -7.824 0.018 465 HG SER 74 HG SER 74 -15.782 -8.973 0.352 466 H SER 75 H SER 75 -13.172 -11.655 2.627 467 HA SER 75 HA SER 75 -14.829 -11.078 4.792 468 HB2 SER 75 1HB SER 75 -13.377 -12.988 5.889 469 HB3 SER 75 2HB SER 75 -14.434 -13.353 4.525 470 HG SER 75 HG SER 75 -12.750 -13.757 3.328 471 H GLU 76 H GLU 76 -11.341 -10.768 4.391 472 HA GLU 76 HA GLU 76 -11.388 -8.389 5.988 473 HB2 GLU 76 1HB GLU 76 -10.999 -10.223 7.692 474 HB3 GLU 76 2HB GLU 76 -9.485 -10.567 6.862 475 HG2 GLU 76 1HG GLU 76 -8.895 -9.180 8.654 476 HG3 GLU 76 2HG GLU 76 -8.895 -8.121 7.242 477 H ALA 77 H ALA 77 -10.596 -7.204 4.356 478 HA ALA 77 HA ALA 77 -8.122 -8.127 3.055 479 HB1 ALA 77 1HB ALA 77 -9.999 -7.772 1.527 480 HB2 ALA 77 2HB ALA 77 -8.692 -6.629 1.215 481 HB3 ALA 77 3HB ALA 77 -10.138 -6.103 2.081 482 H LYS 78 H LYS 78 -6.363 -6.721 2.884 483 HA LYS 78 HA LYS 78 -6.573 -4.168 4.316 484 HB2 LYS 78 1HB LYS 78 -4.329 -6.156 4.703 485 HB3 LYS 78 2HB LYS 78 -4.430 -4.561 5.431 486 HG2 LYS 78 1HG LYS 78 -6.483 -5.299 6.617 487 HG3 LYS 78 2HG LYS 78 -6.213 -6.920 5.976 488 HD2 LYS 78 1HD LYS 78 -4.003 -6.952 7.066 489 HD3 LYS 78 2HD LYS 78 -4.338 -5.362 7.753 490 HE2 LYS 78 1HE LYS 78 -6.370 -6.370 8.827 491 HE3 LYS 78 2HE LYS 78 -5.783 -7.946 8.298 492 HZ1 LYS 78 1HZ LYS 78 -4.381 -6.069 10.117 493 HZ2 LYS 78 2HZ LYS 78 -3.738 -7.538 9.564 494 HZ3 LYS 78 3HZ LYS 78 -5.114 -7.527 10.553 495 H ILE 79 H ILE 79 -5.272 -2.544 3.532 496 HA ILE 79 HA ILE 79 -3.599 -3.195 1.197 497 HB ILE 79 HB ILE 79 -5.473 -0.832 1.375 498 HG12 ILE 79 1HG1 ILE 79 -5.640 -3.281 -0.398 499 HG13 ILE 79 2HG1 ILE 79 -6.669 -2.968 0.999 500 HG21 ILE 79 1HG2 ILE 79 -4.819 -0.425 -0.959 501 HG22 ILE 79 2HG2 ILE 79 -3.660 -1.751 -0.848 502 HG23 ILE 79 3HG2 ILE 79 -3.450 -0.311 0.150 503 HD11 ILE 79 1HD1 ILE 79 -7.574 -0.996 -0.114 504 HD12 ILE 79 2HD1 ILE 79 -7.810 -2.451 -1.080 505 HD13 ILE 79 3HD1 ILE 79 -6.540 -1.306 -1.507 506 H LEU 80 H LEU 80 -1.586 -2.574 1.629 507 HA LEU 80 HA LEU 80 -1.115 -0.377 3.508 508 HB2 LEU 80 1HB LEU 80 0.135 -2.470 3.822 509 HB3 LEU 80 2HB LEU 80 0.796 -2.324 2.198 510 HG LEU 80 HG LEU 80 1.857 -0.146 2.965 511 HD11 LEU 80 1HD1 LEU 80 2.198 0.124 5.364 512 HD12 LEU 80 2HD1 LEU 80 1.143 -1.254 5.675 513 HD13 LEU 80 3HD1 LEU 80 0.487 0.213 4.950 514 HD21 LEU 80 1HD2 LEU 80 3.720 -1.302 4.064 515 HD22 LEU 80 2HD2 LEU 80 3.139 -2.179 2.649 516 HD23 LEU 80 3HD2 LEU 80 2.703 -2.729 4.266 517 H ILE 81 H ILE 81 -1.063 1.608 2.603 518 HA ILE 81 HA ILE 81 0.078 1.857 -0.096 519 HB ILE 81 HB ILE 81 -1.466 3.930 1.472 520 HG12 ILE 81 1HG1 ILE 81 -2.339 2.317 -0.936 521 HG13 ILE 81 2HG1 ILE 81 -2.848 1.984 0.718 522 HG21 ILE 81 1HG2 ILE 81 -1.450 5.236 -0.548 523 HG22 ILE 81 2HG2 ILE 81 -0.620 3.948 -1.416 524 HG23 ILE 81 3HG2 ILE 81 0.210 4.815 -0.126 525 HD11 ILE 81 1HD1 ILE 81 -4.550 3.206 -0.533 526 HD12 ILE 81 2HD1 ILE 81 -3.400 4.516 -0.816 527 HD13 ILE 81 3HD1 ILE 81 -3.942 4.156 0.823 528 H LEU 82 H LEU 82 2.152 2.354 -0.174 529 HA LEU 82 HA LEU 82 3.323 3.951 1.992 530 HB2 LEU 82 1HB LEU 82 4.668 2.410 -0.231 531 HB3 LEU 82 2HB LEU 82 5.487 3.249 1.072 532 HG LEU 82 HG LEU 82 3.688 0.843 1.365 533 HD11 LEU 82 1HD1 LEU 82 5.735 -0.295 2.050 534 HD12 LEU 82 2HD1 LEU 82 6.661 1.166 1.709 535 HD13 LEU 82 3HD1 LEU 82 5.850 0.309 0.398 536 HD21 LEU 82 1HD2 LEU 82 3.458 2.293 3.284 537 HD22 LEU 82 2HD2 LEU 82 5.210 2.419 3.435 538 HD23 LEU 82 3HD2 LEU 82 4.409 0.872 3.718 539 H LEU 83 H LEU 83 3.572 6.044 1.669 540 HA LEU 83 HA LEU 83 4.103 7.028 -1.031 541 HB2 LEU 83 1HB LEU 83 2.503 8.908 -0.669 542 HB3 LEU 83 2HB LEU 83 1.750 7.346 -0.937 543 HG LEU 83 HG LEU 83 2.068 8.603 1.800 544 HD11 LEU 83 1HD1 LEU 83 -0.314 8.624 -0.050 545 HD12 LEU 83 2HD1 LEU 83 0.697 10.017 0.339 546 HD13 LEU 83 3HD1 LEU 83 -0.271 9.251 1.599 547 HD21 LEU 83 1HD2 LEU 83 0.191 6.443 0.870 548 HD22 LEU 83 2HD2 LEU 83 0.434 7.019 2.519 549 HD23 LEU 83 3HD2 LEU 83 1.717 6.133 1.696 550 H GLU 84 H GLU 84 5.485 8.773 -1.088 551 HA GLU 84 HA GLU 84 6.625 9.507 1.480 552 HB2 GLU 84 1HB GLU 84 8.083 9.048 -0.472 553 HB3 GLU 84 2HB GLU 84 7.353 10.402 -1.321 554 HG2 GLU 84 1HG GLU 84 8.184 11.890 0.500 555 HG3 GLU 84 2HG GLU 84 9.055 10.505 1.156 556 H LYS 85 H LYS 85 5.046 10.690 2.442 557 HA LYS 85 HA LYS 85 5.428 13.460 2.154 558 HB2 LYS 85 1HB LYS 85 3.215 14.223 1.599 559 HB3 LYS 85 2HB LYS 85 3.725 13.122 0.328 560 HG2 LYS 85 1HG LYS 85 2.377 11.345 1.326 561 HG3 LYS 85 2HG LYS 85 1.868 12.449 2.604 562 HD2 LYS 85 1HD LYS 85 1.339 12.797 -0.348 563 HD3 LYS 85 2HD LYS 85 0.166 12.256 0.853 564 HE2 LYS 85 1HE LYS 85 1.558 14.933 0.868 565 HE3 LYS 85 2HE LYS 85 -0.071 14.646 0.269 566 HZ1 LYS 85 1HZ LYS 85 -0.756 13.985 2.465 567 HZ2 LYS 85 2HZ LYS 85 -0.044 15.516 2.538 568 HZ3 LYS 85 3HZ LYS 85 0.818 14.160 3.063 569 HA PRO 86 HA PRO 86 3.875 13.081 6.408 570 HB2 PRO 86 1HB PRO 86 2.518 15.686 6.012 571 HB3 PRO 86 2HB PRO 86 3.699 15.214 7.239 572 HG2 PRO 86 1HG PRO 86 4.370 16.857 5.239 573 HG3 PRO 86 2HG PRO 86 5.506 15.646 5.859 574 HD2 PRO 86 1HD PRO 86 3.840 15.583 3.371 575 HD3 PRO 86 2HD PRO 86 5.516 15.046 3.620 576 H VAL 87 H VAL 87 2.160 11.759 6.786 577 HA VAL 87 HA VAL 87 -0.168 12.062 5.032 578 HB VAL 87 HB VAL 87 -0.791 9.774 5.680 579 HG11 VAL 87 1HG1 VAL 87 1.024 8.614 4.517 580 HG12 VAL 87 2HG1 VAL 87 2.045 10.042 4.697 581 HG13 VAL 87 3HG1 VAL 87 0.584 10.120 3.711 582 HG21 VAL 87 1HG2 VAL 87 1.788 9.786 7.247 583 HG22 VAL 87 2HG2 VAL 87 0.777 8.373 6.940 584 HG23 VAL 87 3HG2 VAL 87 0.158 9.705 7.918 585 H SER 88 H SER 88 -2.203 12.290 5.741 586 HA SER 88 HA SER 88 -2.558 13.064 8.532 587 HB2 SER 88 1HB SER 88 -4.557 13.239 6.270 588 HB3 SER 88 2HB SER 88 -4.576 14.128 7.790 589 HG SER 88 HG SER 88 -2.425 14.960 6.965 590 HA PRO 89 HA PRO 89 -4.201 9.026 9.512 591 HB2 PRO 89 1HB PRO 89 -5.588 9.839 11.768 592 HB3 PRO 89 2HB PRO 89 -3.880 9.392 11.730 593 HG2 PRO 89 1HG PRO 89 -5.133 12.101 11.664 594 HG3 PRO 89 2HG PRO 89 -3.674 11.557 12.513 595 HD2 PRO 89 1HD PRO 89 -3.522 12.971 10.245 596 HD3 PRO 89 2HD PRO 89 -2.370 11.667 10.597 597 H GLU 90 H GLU 90 -6.244 11.901 9.360 598 HA GLU 90 HA GLU 90 -8.714 10.489 9.182 599 HB2 GLU 90 1HB GLU 90 -7.925 13.289 8.373 600 HB3 GLU 90 2HB GLU 90 -9.567 12.675 8.244 601 HG2 GLU 90 1HG GLU 90 -7.988 12.875 10.800 602 HG3 GLU 90 2HG GLU 90 -9.210 14.024 10.260 603 H TYR 91 H TYR 91 -6.332 11.614 6.875 604 HA TYR 91 HA TYR 91 -7.864 11.179 4.535 605 HB2 TYR 91 1HB TYR 91 -5.824 12.621 4.665 606 HB3 TYR 91 2HB TYR 91 -4.850 11.164 4.816 607 HD1 TYR 91 HD1 TYR 91 -7.393 12.703 2.558 608 HD2 TYR 91 HD2 TYR 91 -3.939 10.241 2.895 609 HE1 TYR 91 HE1 TYR 91 -7.261 12.566 0.107 610 HE2 TYR 91 HE2 TYR 91 -3.799 10.097 0.444 611 HH TYR 91 HH TYR 91 -5.549 12.123 -1.625 612 H GLU 92 H GLU 92 -5.902 9.140 6.563 613 HA GLU 92 HA GLU 92 -5.646 6.931 4.844 614 HB2 GLU 92 1HB GLU 92 -4.306 7.155 6.856 615 HB3 GLU 92 2HB GLU 92 -5.746 7.091 7.862 616 HG2 GLU 92 1HG GLU 92 -6.146 4.808 7.182 617 HG3 GLU 92 2HG GLU 92 -4.743 4.857 6.117 618 H LYS 93 H LYS 93 -8.179 7.927 7.083 619 HA LYS 93 HA LYS 93 -9.763 5.573 6.787 620 HB2 LYS 93 1HB LYS 93 -10.564 8.337 7.730 621 HB3 LYS 93 2HB LYS 93 -11.523 6.877 7.907 622 HG2 LYS 93 1HG LYS 93 -8.814 7.290 9.145 623 HG3 LYS 93 2HG LYS 93 -10.345 7.576 9.968 624 HD2 LYS 93 1HD LYS 93 -9.786 4.914 8.715 625 HD3 LYS 93 2HD LYS 93 -9.099 5.309 10.287 626 HE2 LYS 93 1HE LYS 93 -11.120 4.160 10.713 627 HE3 LYS 93 2HE LYS 93 -11.439 5.858 11.049 628 HZ1 LYS 93 1HZ LYS 93 -12.159 4.486 8.514 629 HZ2 LYS 93 2HZ LYS 93 -12.588 6.058 8.972 630 HZ3 LYS 93 3HZ LYS 93 -13.224 4.734 9.803 631 H LYS 94 H LYS 94 -9.525 8.694 5.265 632 HA LYS 94 HA LYS 94 -11.809 8.551 3.616 633 HB2 LYS 94 1HB LYS 94 -10.444 10.600 4.100 634 HB3 LYS 94 2HB LYS 94 -9.187 9.953 3.062 635 HG2 LYS 94 1HG LYS 94 -10.741 10.020 1.162 636 HG3 LYS 94 2HG LYS 94 -11.972 10.722 2.217 637 HD2 LYS 94 1HD LYS 94 -10.473 12.619 2.673 638 HD3 LYS 94 2HD LYS 94 -9.276 11.924 1.581 639 HE2 LYS 94 1HE LYS 94 -10.474 13.643 0.415 640 HE3 LYS 94 2HE LYS 94 -10.935 12.080 -0.255 641 HZ1 LYS 94 1HZ LYS 94 -12.510 13.680 1.689 642 HZ2 LYS 94 2HZ LYS 94 -12.949 12.159 1.100 643 HZ3 LYS 94 3HZ LYS 94 -12.861 13.477 0.047 644 H LEU 95 H LEU 95 -8.542 7.310 3.335 645 HA LEU 95 HA LEU 95 -8.808 6.519 0.603 646 HB2 LEU 95 1HB LEU 95 -6.773 5.876 2.720 647 HB3 LEU 95 2HB LEU 95 -6.694 5.211 1.098 648 HG LEU 95 HG LEU 95 -6.651 8.158 1.762 649 HD11 LEU 95 1HD1 LEU 95 -4.612 7.146 2.508 650 HD12 LEU 95 2HD1 LEU 95 -4.294 8.028 1.014 651 HD13 LEU 95 3HD1 LEU 95 -4.438 6.270 0.986 652 HD21 LEU 95 1HD2 LEU 95 -7.621 7.761 -0.411 653 HD22 LEU 95 2HD2 LEU 95 -6.296 6.683 -0.844 654 HD23 LEU 95 3HD2 LEU 95 -5.991 8.404 -0.604 655 H GLN 96 H GLN 96 -8.986 4.724 3.717 656 HA GLN 96 HA GLN 96 -9.745 2.358 2.282 657 HB2 GLN 96 1HB GLN 96 -10.387 1.424 4.545 658 HB3 GLN 96 2HB GLN 96 -8.707 1.852 4.331 659 HG2 GLN 96 1HG GLN 96 -8.962 2.720 6.359 660 HG3 GLN 96 2HG GLN 96 -9.591 4.110 5.461 661 HE21 GLN 96 1HE2 GLN 96 -12.078 2.475 4.832 662 HE22 GLN 96 2HE2 GLN 96 -13.002 2.546 6.291 663 H LYS 97 H LYS 97 -11.319 5.190 2.982 664 HA LYS 97 HA LYS 97 -13.968 4.060 2.973 665 HB2 LYS 97 1HB LYS 97 -13.442 6.313 3.926 666 HB3 LYS 97 2HB LYS 97 -13.150 6.885 2.289 667 HG2 LYS 97 1HG LYS 97 -15.430 6.499 1.677 668 HG3 LYS 97 2HG LYS 97 -15.756 5.712 3.220 669 HD2 LYS 97 1HD LYS 97 -16.623 7.958 3.274 670 HD3 LYS 97 2HD LYS 97 -15.248 7.842 4.369 671 HE2 LYS 97 1HE LYS 97 -13.811 8.873 2.698 672 HE3 LYS 97 2HE LYS 97 -15.158 8.942 1.564 673 HZ1 LYS 97 1HZ LYS 97 -14.820 11.066 2.643 674 HZ2 LYS 97 2HZ LYS 97 -15.006 10.358 4.166 675 HZ3 LYS 97 3HZ LYS 97 -16.313 10.417 3.097 676 H TYR 98 H TYR 98 -11.619 5.058 0.588 677 HA TYR 98 HA TYR 98 -13.442 5.036 -1.630 678 HB2 TYR 98 1HB TYR 98 -10.423 4.907 -1.512 679 HB3 TYR 98 2HB TYR 98 -11.336 4.958 -3.012 680 HD1 TYR 98 HD1 TYR 98 -13.420 6.979 -2.269 681 HD2 TYR 98 HD2 TYR 98 -9.225 6.899 -1.570 682 HE1 TYR 98 HE1 TYR 98 -13.384 9.437 -2.232 683 HE2 TYR 98 HE2 TYR 98 -9.179 9.355 -1.522 684 HH TYR 98 HH TYR 98 -10.538 11.236 -2.426 685 H ALA 99 H ALA 99 -10.913 2.840 -0.475 686 HA ALA 99 HA ALA 99 -12.164 0.661 -2.012 687 HB1 ALA 99 1HB ALA 99 -9.360 1.055 -0.997 688 HB2 ALA 99 2HB ALA 99 -9.904 0.830 -2.661 689 HB3 ALA 99 3HB ALA 99 -9.960 -0.515 -1.525 690 H ASP 100 H ASP 100 -13.026 -1.038 -0.912 691 HA ASP 100 HA ASP 100 -13.195 -0.661 1.959 692 HB2 ASP 100 1HB ASP 100 -14.577 -2.581 0.092 693 HB3 ASP 100 2HB ASP 100 -14.720 -2.702 1.841 694 H ALA 101 H ALA 101 -11.395 -1.105 2.787 695 HA ALA 101 HA ALA 101 -10.765 -3.749 3.538 696 HB1 ALA 101 1HB ALA 101 -8.789 -2.337 1.722 697 HB2 ALA 101 2HB ALA 101 -9.666 -3.817 1.333 698 HB3 ALA 101 3HB ALA 101 -8.469 -3.816 2.628 699 H GLU 102 H GLU 102 -8.693 -3.563 4.989 700 HA GLU 102 HA GLU 102 -8.875 -0.982 6.305 701 HB2 GLU 102 1HB GLU 102 -6.915 -3.071 7.155 702 HB3 GLU 102 2HB GLU 102 -7.766 -1.855 8.098 703 HG2 GLU 102 1HG GLU 102 -9.879 -3.162 7.661 704 HG3 GLU 102 2HG GLU 102 -8.845 -4.449 7.030 705 H VAL 103 H VAL 103 -7.992 0.407 4.879 706 HA VAL 103 HA VAL 103 -5.432 -0.113 3.671 707 HB VAL 103 HB VAL 103 -7.025 2.460 3.657 708 HG11 VAL 103 1HG1 VAL 103 -4.816 1.473 1.878 709 HG12 VAL 103 2HG1 VAL 103 -4.704 2.782 3.058 710 HG13 VAL 103 3HG1 VAL 103 -5.744 2.952 1.640 711 HG21 VAL 103 1HG2 VAL 103 -7.794 1.783 1.453 712 HG22 VAL 103 2HG2 VAL 103 -8.328 0.643 2.691 713 HG23 VAL 103 3HG2 VAL 103 -6.977 0.235 1.636 714 H ARG 104 H ARG 104 -3.642 0.113 4.736 715 HA ARG 104 HA ARG 104 -3.443 2.123 6.878 716 HB2 ARG 104 1HB ARG 104 -1.738 -0.337 6.406 717 HB3 ARG 104 2HB ARG 104 -1.627 0.756 7.782 718 HG2 ARG 104 1HG ARG 104 -3.818 0.097 8.540 719 HG3 ARG 104 2HG ARG 104 -4.047 -0.905 7.107 720 HD2 ARG 104 1HD ARG 104 -3.453 -2.303 8.972 721 HD3 ARG 104 2HD ARG 104 -2.130 -2.289 7.810 722 HE ARG 104 HE ARG 104 -0.987 -0.716 9.310 723 HH11 ARG 104 1HH1 ARG 104 -3.628 -2.607 10.630 724 HH12 ARG 104 2HH1 ARG 104 -3.018 -2.543 12.253 725 HH21 ARG 104 1HH2 ARG 104 -0.202 -0.629 11.449 726 HH22 ARG 104 2HH2 ARG 104 -1.078 -1.421 12.718 727 H VAL 105 H VAL 105 -2.444 3.909 6.202 728 HA VAL 105 HA VAL 105 -0.645 3.638 3.893 729 HB VAL 105 HB VAL 105 -1.244 5.833 3.209 730 HG11 VAL 105 1HG1 VAL 105 -3.791 4.502 4.151 731 HG12 VAL 105 2HG1 VAL 105 -2.855 3.967 2.761 732 HG13 VAL 105 3HG1 VAL 105 -3.592 5.565 2.760 733 HG21 VAL 105 1HG2 VAL 105 -2.778 7.276 4.472 734 HG22 VAL 105 2HG2 VAL 105 -1.300 6.952 5.378 735 HG23 VAL 105 3HG2 VAL 105 -2.791 6.104 5.790 736 H ARG 106 H ARG 106 1.420 4.146 4.058 737 HA ARG 106 HA ARG 106 2.320 5.497 6.517 738 HB2 ARG 106 1HB ARG 106 3.546 3.071 5.194 739 HB3 ARG 106 2HB ARG 106 4.314 3.982 6.482 740 HG2 ARG 106 1HG ARG 106 1.801 2.343 6.633 741 HG3 ARG 106 2HG ARG 106 3.333 2.064 7.456 742 HD2 ARG 106 1HD ARG 106 3.040 4.076 8.765 743 HD3 ARG 106 2HD ARG 106 1.550 4.450 7.906 744 HE ARG 106 HE ARG 106 1.916 2.221 9.795 745 HH11 ARG 106 1HH1 ARG 106 -0.156 4.371 7.974 746 HH12 ARG 106 2HH1 ARG 106 -1.587 3.979 8.878 747 HH21 ARG 106 1HH2 ARG 106 0.038 1.720 11.016 748 HH22 ARG 106 2HH2 ARG 106 -1.464 2.493 10.626 749 H THR 107 H THR 107 4.140 6.774 6.365 750 HA THR 107 HA THR 107 4.728 7.731 3.697 751 HB THR 107 HB THR 107 4.346 9.341 5.539 752 HG1 THR 107 HG1 THR 107 5.698 10.661 4.592 753 HG21 THR 107 1HG2 THR 107 6.072 9.698 7.237 754 HG22 THR 107 2HG2 THR 107 6.957 8.294 6.641 755 HG23 THR 107 3HG2 THR 107 5.369 8.088 7.375 756 H VAL 108 H VAL 108 6.611 7.466 2.625 757 HA VAL 108 HA VAL 108 8.720 5.910 3.955 758 HB VAL 108 HB VAL 108 7.602 4.328 2.575 759 HG11 VAL 108 1HG1 VAL 108 6.339 5.826 1.144 760 HG12 VAL 108 2HG1 VAL 108 7.225 4.654 0.168 761 HG13 VAL 108 3HG1 VAL 108 7.818 6.309 0.312 762 HG21 VAL 108 1HG2 VAL 108 9.334 3.756 0.898 763 HG22 VAL 108 2HG2 VAL 108 9.992 4.128 2.490 764 HG23 VAL 108 3HG2 VAL 108 10.088 5.321 1.196 765 H THR 109 H THR 109 10.379 7.252 4.156 766 HA THR 109 HA THR 109 10.976 9.138 1.999 767 HB THR 109 HB THR 109 12.609 10.076 3.698 768 HG1 THR 109 HG1 THR 109 12.596 9.272 5.717 769 HG21 THR 109 1HG2 THR 109 9.679 9.993 4.432 770 HG22 THR 109 2HG2 THR 109 10.439 11.115 3.304 771 HG23 THR 109 3HG2 THR 109 10.844 11.179 5.018 772 H SER 110 H SER 110 12.023 6.159 3.274 773 HA SER 110 HA SER 110 14.449 6.268 1.635 774 HB2 SER 110 1HB SER 110 14.429 5.086 4.418 775 HB3 SER 110 2HB SER 110 15.820 5.340 3.368 776 HG SER 110 HG SER 110 15.569 7.564 3.626 777 HA PRO 111 HA PRO 111 13.310 2.241 0.090 778 HB2 PRO 111 1HB PRO 111 16.100 1.472 0.826 779 HB3 PRO 111 2HB PRO 111 15.225 1.226 -0.690 780 HG2 PRO 111 1HG PRO 111 17.056 3.143 -0.480 781 HG3 PRO 111 2HG PRO 111 15.562 3.400 -1.398 782 HD2 PRO 111 1HD PRO 111 16.346 4.450 1.272 783 HD3 PRO 111 2HD PRO 111 15.324 5.184 0.021 784 H ASP 112 H ASP 112 15.388 2.217 2.980 785 HA ASP 112 HA ASP 112 14.642 -0.281 3.991 786 HB2 ASP 112 1HB ASP 112 16.570 0.778 4.898 787 HB3 ASP 112 2HB ASP 112 15.655 2.210 5.353 788 H GLU 113 H GLU 113 13.184 2.898 4.458 789 HA GLU 113 HA GLU 113 11.478 2.340 6.575 790 HB2 GLU 113 1HB GLU 113 11.166 4.224 4.242 791 HB3 GLU 113 2HB GLU 113 10.045 4.180 5.595 792 HG2 GLU 113 1HG GLU 113 12.995 4.708 5.842 793 HG3 GLU 113 2HG GLU 113 11.756 5.959 5.760 794 H ALA 114 H ALA 114 10.932 1.934 3.096 795 HA ALA 114 HA ALA 114 8.263 1.084 3.242 796 HB1 ALA 114 1HB ALA 114 8.632 0.120 1.020 797 HB2 ALA 114 2HB ALA 114 10.370 0.348 1.214 798 HB3 ALA 114 3HB ALA 114 9.299 1.747 1.146 799 H LYS 115 H LYS 115 11.301 -0.718 3.374 800 HA LYS 115 HA LYS 115 10.180 -3.292 3.340 801 HB2 LYS 115 1HB LYS 115 12.778 -2.376 4.590 802 HB3 LYS 115 2HB LYS 115 12.343 -4.048 4.266 803 HG2 LYS 115 1HG LYS 115 12.024 -3.043 1.808 804 HG3 LYS 115 2HG LYS 115 13.245 -1.926 2.419 805 HD2 LYS 115 1HD LYS 115 13.470 -4.936 2.444 806 HD3 LYS 115 2HD LYS 115 14.225 -3.873 1.259 807 HE2 LYS 115 1HE LYS 115 14.735 -3.658 4.213 808 HE3 LYS 115 2HE LYS 115 15.699 -4.676 3.147 809 HZ1 LYS 115 1HZ LYS 115 16.237 -2.695 1.839 810 HZ2 LYS 115 2HZ LYS 115 16.759 -2.555 3.448 811 HZ3 LYS 115 3HZ LYS 115 15.373 -1.737 2.937 812 H ARG 116 H ARG 116 10.643 -0.971 5.896 813 HA ARG 116 HA ARG 116 10.220 -2.733 8.083 814 HB2 ARG 116 1HB ARG 116 9.680 0.238 7.948 815 HB3 ARG 116 2HB ARG 116 9.881 -0.719 9.408 816 HG2 ARG 116 1HG ARG 116 12.006 -0.259 7.326 817 HG3 ARG 116 2HG ARG 116 11.867 0.604 8.858 818 HD2 ARG 116 1HD ARG 116 12.171 -1.480 10.075 819 HD3 ARG 116 2HD ARG 116 12.264 -2.369 8.556 820 HE ARG 116 HE ARG 116 14.235 -0.602 8.236 821 HH11 ARG 116 1HH1 ARG 116 13.436 -2.660 10.958 822 HH12 ARG 116 2HH1 ARG 116 15.079 -2.786 11.498 823 HH21 ARG 116 1HH2 ARG 116 16.378 -0.788 8.920 824 HH22 ARG 116 2HH2 ARG 116 16.763 -1.722 10.331 825 H TRP 117 H TRP 117 8.057 -0.399 6.462 826 HA TRP 117 HA TRP 117 5.794 -1.043 7.994 827 HB2 TRP 117 1HB TRP 117 5.928 0.147 5.218 828 HB3 TRP 117 2HB TRP 117 4.524 0.176 6.280 829 HD1 TRP 117 HD1 TRP 117 7.075 2.416 5.188 830 HE1 TRP 117 HE1 TRP 117 7.559 4.276 6.898 831 HE3 TRP 117 HE3 TRP 117 4.827 0.352 9.293 832 HZ2 TRP 117 HZ2 TRP 117 7.052 4.799 9.621 833 HZ3 TRP 117 HZ3 TRP 117 4.874 1.600 11.412 834 HH2 TRP 117 HH2 TRP 117 5.963 3.778 11.572 835 H ILE 118 H ILE 118 7.005 -2.335 4.936 836 HA ILE 118 HA ILE 118 4.728 -3.928 4.368 837 HB ILE 118 HB ILE 118 7.600 -4.249 3.483 838 HG12 ILE 118 1HG1 ILE 118 5.169 -3.150 2.051 839 HG13 ILE 118 2HG1 ILE 118 6.457 -2.178 2.752 840 HG21 ILE 118 1HG2 ILE 118 6.453 -6.391 3.355 841 HG22 ILE 118 2HG2 ILE 118 6.726 -5.738 1.740 842 HG23 ILE 118 3HG2 ILE 118 5.124 -5.642 2.470 843 HD11 ILE 118 1HD1 ILE 118 8.048 -3.156 1.192 844 HD12 ILE 118 2HD1 ILE 118 6.703 -2.392 0.345 845 HD13 ILE 118 3HD1 ILE 118 6.764 -4.148 0.500 846 H LYS 119 H LYS 119 7.751 -4.563 6.094 847 HA LYS 119 HA LYS 119 7.346 -7.287 6.610 848 HB2 LYS 119 1HB LYS 119 9.478 -6.038 6.977 849 HB3 LYS 119 2HB LYS 119 8.749 -5.275 8.379 850 HG2 LYS 119 1HG LYS 119 10.156 -7.051 9.126 851 HG3 LYS 119 2HG LYS 119 8.479 -7.521 9.398 852 HD2 LYS 119 1HD LYS 119 9.688 -8.329 6.819 853 HD3 LYS 119 2HD LYS 119 10.293 -9.137 8.264 854 HE2 LYS 119 1HE LYS 119 7.376 -8.939 7.524 855 HE3 LYS 119 2HE LYS 119 8.404 -10.314 7.136 856 HZ1 LYS 119 1HZ LYS 119 7.882 -9.326 9.885 857 HZ2 LYS 119 2HZ LYS 119 8.748 -10.716 9.461 858 HZ3 LYS 119 3HZ LYS 119 7.082 -10.634 9.165 859 H GLU 120 H GLU 120 6.514 -4.414 8.504 860 HA GLU 120 HA GLU 120 5.234 -5.685 10.652 861 HB2 GLU 120 1HB GLU 120 5.893 -3.314 10.649 862 HB3 GLU 120 2HB GLU 120 4.690 -2.977 9.415 863 HG2 GLU 120 1HG GLU 120 3.755 -2.252 11.435 864 HG3 GLU 120 2HG GLU 120 2.958 -3.780 11.064 865 H PHE 121 H PHE 121 3.996 -4.498 7.566 866 HA PHE 121 HA PHE 121 1.261 -4.877 8.057 867 HB2 PHE 121 1HB PHE 121 2.218 -3.494 6.236 868 HB3 PHE 121 2HB PHE 121 2.720 -4.963 5.411 869 HD1 PHE 121 HD1 PHE 121 -0.369 -3.480 6.887 870 HD2 PHE 121 HD2 PHE 121 1.385 -5.723 3.725 871 HE1 PHE 121 HE1 PHE 121 -2.543 -3.556 5.740 872 HE2 PHE 121 HE2 PHE 121 -0.785 -5.801 2.573 873 HZ PHE 121 HZ PHE 121 -2.752 -4.720 3.579 874 H SER 122 H SER 122 3.718 -7.039 6.756 875 HA SER 122 HA SER 122 1.924 -9.087 5.956 876 HB2 SER 122 1HB SER 122 4.231 -8.851 5.074 877 HB3 SER 122 2HB SER 122 4.863 -9.304 6.655 878 HG SER 122 HG SER 122 3.110 -10.949 5.134 879 H GLU 123 H GLU 123 3.174 -8.129 9.012 880 HA GLU 123 HA GLU 123 2.577 -10.731 10.219 881 HB2 GLU 123 1HB GLU 123 3.779 -8.258 11.473 882 HB3 GLU 123 2HB GLU 123 3.627 -9.834 12.234 883 HG2 GLU 123 1HG GLU 123 5.344 -9.121 9.873 884 HG3 GLU 123 2HG GLU 123 5.884 -9.508 11.505 885 H GLU 124 H GLU 124 0.988 -7.942 9.478 886 HA GLU 124 HA GLU 124 -0.505 -7.690 11.952 887 HB2 GLU 124 1HB GLU 124 0.214 -5.703 10.595 888 HB3 GLU 124 2HB GLU 124 -0.895 -6.224 9.335 889 HG2 GLU 124 1HG GLU 124 -1.909 -4.476 10.627 890 HG3 GLU 124 2HG GLU 124 -2.764 -5.990 10.917 Start of MODEL 17 1 HA MET 21 HA MET 21 -8.991 -11.065 3.436 2 HB2 MET 21 1HB MET 21 -7.268 -9.865 4.763 3 HB3 MET 21 2HB MET 21 -8.468 -10.665 5.761 4 HG2 MET 21 1HG MET 21 -6.448 -11.059 6.839 5 HG3 MET 21 2HG MET 21 -6.782 -12.557 5.981 6 HE1 MET 21 1HE MET 21 -2.878 -12.339 5.860 7 HE2 MET 21 2HE MET 21 -4.266 -13.340 6.283 8 HE3 MET 21 3HE MET 21 -3.943 -11.856 7.180 9 H THR 22 H THR 22 -7.482 -9.837 2.150 10 HA THR 22 HA THR 22 -5.118 -11.355 1.262 11 HB THR 22 HB THR 22 -6.823 -9.542 -0.467 12 HG1 THR 22 HG1 THR 22 -6.515 -12.331 -0.828 13 HG21 THR 22 1HG2 THR 22 -5.462 -10.367 -2.318 14 HG22 THR 22 2HG2 THR 22 -4.513 -11.347 -1.202 15 HG23 THR 22 3HG2 THR 22 -4.443 -9.588 -1.107 16 H LEU 23 H LEU 23 -3.236 -10.089 0.842 17 HA LEU 23 HA LEU 23 -3.351 -7.458 2.142 18 HB2 LEU 23 1HB LEU 23 -1.031 -9.367 1.884 19 HB3 LEU 23 2HB LEU 23 -0.986 -7.814 2.697 20 HG LEU 23 HG LEU 23 -2.620 -10.208 3.544 21 HD11 LEU 23 1HD1 LEU 23 -0.239 -10.491 3.958 22 HD12 LEU 23 2HD1 LEU 23 -1.119 -10.258 5.469 23 HD13 LEU 23 3HD1 LEU 23 -0.186 -8.930 4.778 24 HD21 LEU 23 1HD2 LEU 23 -3.780 -8.146 4.070 25 HD22 LEU 23 2HD2 LEU 23 -2.320 -7.490 4.812 26 HD23 LEU 23 3HD2 LEU 23 -3.133 -8.875 5.541 27 H PHE 24 H PHE 24 -3.223 -5.825 0.808 28 HA PHE 24 HA PHE 24 -1.662 -6.107 -1.678 29 HB2 PHE 24 1HB PHE 24 -3.860 -4.114 -1.087 30 HB3 PHE 24 2HB PHE 24 -3.052 -4.354 -2.627 31 HD1 PHE 24 HD1 PHE 24 -3.669 -6.144 -4.084 32 HD2 PHE 24 HD2 PHE 24 -5.472 -5.747 -0.253 33 HE1 PHE 24 HE1 PHE 24 -5.407 -7.756 -4.737 34 HE2 PHE 24 HE2 PHE 24 -7.209 -7.358 -0.895 35 HZ PHE 24 HZ PHE 24 -7.179 -8.367 -3.143 36 H VAL 25 H VAL 25 -0.430 -4.217 -2.355 37 HA VAL 25 HA VAL 25 -0.096 -2.128 -0.378 38 HB VAL 25 HB VAL 25 1.544 -3.609 0.469 39 HG11 VAL 25 1HG1 VAL 25 2.620 -3.909 -2.323 40 HG12 VAL 25 2HG1 VAL 25 1.714 -5.126 -1.427 41 HG13 VAL 25 3HG1 VAL 25 3.310 -4.622 -0.867 42 HG21 VAL 25 1HG2 VAL 25 3.645 -2.392 0.103 43 HG22 VAL 25 2HG2 VAL 25 2.280 -1.302 0.342 44 HG23 VAL 25 3HG2 VAL 25 2.919 -1.573 -1.279 45 H LEU 26 H LEU 26 -0.168 -0.294 -1.367 46 HA LEU 26 HA LEU 26 0.741 -0.069 -4.155 47 HB2 LEU 26 1HB LEU 26 -1.045 1.742 -2.517 48 HB3 LEU 26 2HB LEU 26 -0.480 2.123 -4.127 49 HG LEU 26 HG LEU 26 -2.639 1.378 -4.487 50 HD11 LEU 26 1HD1 LEU 26 -0.972 -1.105 -4.790 51 HD12 LEU 26 2HD1 LEU 26 -1.054 0.232 -5.939 52 HD13 LEU 26 3HD1 LEU 26 -2.486 -0.749 -5.623 53 HD21 LEU 26 1HD2 LEU 26 -3.118 0.589 -2.247 54 HD22 LEU 26 2HD2 LEU 26 -2.157 -0.862 -2.535 55 HD23 LEU 26 3HD2 LEU 26 -3.641 -0.589 -3.450 56 H ILE 27 H ILE 27 1.847 2.038 -4.676 57 HA ILE 27 HA ILE 27 3.280 3.228 -2.448 58 HB ILE 27 HB ILE 27 4.712 1.370 -2.851 59 HG12 ILE 27 1HG1 ILE 27 5.887 3.748 -4.310 60 HG13 ILE 27 2HG1 ILE 27 5.839 3.557 -2.561 61 HG21 ILE 27 1HG2 ILE 27 3.847 0.710 -5.028 62 HG22 ILE 27 2HG2 ILE 27 5.608 0.795 -5.045 63 HG23 ILE 27 3HG2 ILE 27 4.657 2.087 -5.777 64 HD11 ILE 27 1HD1 ILE 27 8.029 3.013 -3.469 65 HD12 ILE 27 2HD1 ILE 27 7.306 1.765 -4.484 66 HD13 ILE 27 3HD1 ILE 27 7.276 1.600 -2.727 67 H LEU 28 H LEU 28 3.407 5.381 -2.780 68 HA LEU 28 HA LEU 28 3.604 6.300 -5.587 69 HB2 LEU 28 1HB LEU 28 2.597 7.761 -3.140 70 HB3 LEU 28 2HB LEU 28 2.908 8.540 -4.672 71 HG LEU 28 HG LEU 28 1.169 7.013 -5.685 72 HD11 LEU 28 1HD1 LEU 28 1.133 5.302 -3.955 73 HD12 LEU 28 2HD1 LEU 28 -0.456 6.035 -4.159 74 HD13 LEU 28 3HD1 LEU 28 0.549 6.486 -2.786 75 HD21 LEU 28 1HD2 LEU 28 0.313 8.917 -3.511 76 HD22 LEU 28 2HD2 LEU 28 -0.689 8.365 -4.852 77 HD23 LEU 28 3HD2 LEU 28 0.738 9.353 -5.165 78 H SER 29 H SER 29 5.860 5.761 -5.403 79 HA SER 29 HA SER 29 7.310 8.178 -4.752 80 HB2 SER 29 1HB SER 29 7.571 6.693 -2.734 81 HB3 SER 29 2HB SER 29 8.314 5.485 -3.780 82 HG SER 29 HG SER 29 9.616 7.252 -2.542 83 H ASN 30 H ASN 30 8.245 8.637 -6.780 84 HA ASN 30 HA ASN 30 8.806 6.306 -8.428 85 HB2 ASN 30 1HB ASN 30 9.543 8.054 -10.138 86 HB3 ASN 30 2HB ASN 30 7.842 8.049 -9.695 87 HD21 ASN 30 1HD2 ASN 30 10.805 9.809 -9.642 88 HD22 ASN 30 2HD2 ASN 30 10.159 11.281 -9.002 89 H ASP 31 H ASP 31 10.354 5.417 -7.101 90 HA ASP 31 HA ASP 31 13.036 6.414 -7.775 91 HB2 ASP 31 1HB ASP 31 12.567 6.268 -5.294 92 HB3 ASP 31 2HB ASP 31 12.383 4.529 -5.502 93 H LYS 32 H LYS 32 14.577 4.576 -8.315 94 HA LYS 32 HA LYS 32 13.108 2.463 -9.683 95 HB2 LYS 32 1HB LYS 32 16.044 3.130 -9.677 96 HB3 LYS 32 2HB LYS 32 15.318 1.807 -10.579 97 HG2 LYS 32 1HG LYS 32 13.782 3.705 -11.526 98 HG3 LYS 32 2HG LYS 32 15.128 4.737 -11.035 99 HD2 LYS 32 1HD LYS 32 16.659 3.393 -12.367 100 HD3 LYS 32 2HD LYS 32 15.330 2.323 -12.818 101 HE2 LYS 32 1HE LYS 32 15.548 5.256 -13.482 102 HE3 LYS 32 2HE LYS 32 15.832 3.923 -14.598 103 HZ1 LYS 32 1HZ LYS 32 13.635 4.784 -14.922 104 HZ2 LYS 32 2HZ LYS 32 13.260 4.614 -13.286 105 HZ3 LYS 32 3HZ LYS 32 13.505 3.241 -14.242 106 H LYS 33 H LYS 33 15.369 2.842 -6.997 107 HA LYS 33 HA LYS 33 15.644 -0.029 -6.688 108 HB2 LYS 33 1HB LYS 33 16.813 2.316 -5.206 109 HB3 LYS 33 2HB LYS 33 17.025 0.665 -4.652 110 HG2 LYS 33 1HG LYS 33 18.969 1.199 -5.849 111 HG3 LYS 33 2HG LYS 33 18.022 0.167 -6.917 112 HD2 LYS 33 1HD LYS 33 17.241 2.118 -8.142 113 HD3 LYS 33 2HD LYS 33 18.121 3.182 -7.043 114 HE2 LYS 33 1HE LYS 33 19.364 1.095 -8.834 115 HE3 LYS 33 2HE LYS 33 19.326 2.826 -9.160 116 HZ1 LYS 33 1HZ LYS 33 20.617 3.185 -7.139 117 HZ2 LYS 33 2HZ LYS 33 21.439 2.179 -8.220 118 HZ3 LYS 33 3HZ LYS 33 20.675 1.519 -6.865 119 H LEU 34 H LEU 34 14.077 2.663 -5.052 120 HA LEU 34 HA LEU 34 13.312 1.378 -2.691 121 HB2 LEU 34 1HB LEU 34 13.078 3.867 -3.582 122 HB3 LEU 34 2HB LEU 34 11.462 3.333 -3.991 123 HG LEU 34 HG LEU 34 12.619 3.169 -1.204 124 HD11 LEU 34 1HD1 LEU 34 10.867 5.292 -2.428 125 HD12 LEU 34 2HD1 LEU 34 12.532 5.488 -1.881 126 HD13 LEU 34 3HD1 LEU 34 11.254 5.151 -0.714 127 HD21 LEU 34 1HD2 LEU 34 10.765 1.637 -1.618 128 HD22 LEU 34 2HD2 LEU 34 9.782 2.977 -2.209 129 HD23 LEU 34 3HD2 LEU 34 10.288 2.934 -0.521 130 H ILE 35 H ILE 35 11.831 1.409 -5.874 131 HA ILE 35 HA ILE 35 9.452 0.048 -5.207 132 HB ILE 35 HB ILE 35 10.927 0.574 -7.752 133 HG12 ILE 35 1HG1 ILE 35 8.765 1.595 -8.382 134 HG13 ILE 35 2HG1 ILE 35 8.089 1.086 -6.840 135 HG21 ILE 35 1HG2 ILE 35 9.282 -0.685 -9.055 136 HG22 ILE 35 2HG2 ILE 35 8.596 -1.328 -7.563 137 HG23 ILE 35 3HG2 ILE 35 10.247 -1.741 -8.024 138 HD11 ILE 35 1HD1 ILE 35 9.667 2.520 -5.670 139 HD12 ILE 35 2HD1 ILE 35 8.693 3.435 -6.823 140 HD13 ILE 35 3HD1 ILE 35 10.363 3.016 -7.213 141 H GLU 36 H GLU 36 12.625 -1.086 -6.318 142 HA GLU 36 HA GLU 36 11.910 -3.810 -6.515 143 HB2 GLU 36 1HB GLU 36 14.648 -2.653 -5.966 144 HB3 GLU 36 2HB GLU 36 14.300 -4.268 -6.569 145 HG2 GLU 36 1HG GLU 36 13.230 -3.187 -8.559 146 HG3 GLU 36 2HG GLU 36 13.867 -1.654 -7.975 147 H GLU 37 H GLU 37 13.519 -1.976 -3.930 148 HA GLU 37 HA GLU 37 13.887 -4.034 -2.099 149 HB2 GLU 37 1HB GLU 37 13.304 -1.105 -1.665 150 HB3 GLU 37 2HB GLU 37 13.730 -2.202 -0.360 151 HG2 GLU 37 1HG GLU 37 15.454 -1.657 -2.764 152 HG3 GLU 37 2HG GLU 37 15.626 -0.861 -1.200 153 H ALA 38 H ALA 38 11.049 -1.994 -2.639 154 HA ALA 38 HA ALA 38 9.521 -2.974 -0.481 155 HB1 ALA 38 1HB ALA 38 8.574 -1.782 -3.085 156 HB2 ALA 38 2HB ALA 38 8.991 -0.884 -1.625 157 HB3 ALA 38 3HB ALA 38 7.607 -1.976 -1.624 158 H ARG 39 H ARG 39 9.609 -3.905 -3.920 159 HA ARG 39 HA ARG 39 7.575 -5.875 -3.585 160 HB2 ARG 39 1HB ARG 39 7.793 -4.897 -5.740 161 HB3 ARG 39 2HB ARG 39 9.493 -5.331 -5.838 162 HG2 ARG 39 1HG ARG 39 9.001 -7.614 -6.143 163 HG3 ARG 39 2HG ARG 39 7.306 -7.406 -5.668 164 HD2 ARG 39 1HD ARG 39 6.849 -6.166 -7.666 165 HD3 ARG 39 2HD ARG 39 8.559 -6.083 -8.081 166 HE ARG 39 HE ARG 39 8.037 -8.757 -7.987 167 HH11 ARG 39 1HH1 ARG 39 6.586 -6.046 -9.672 168 HH12 ARG 39 2HH1 ARG 39 6.160 -6.977 -11.072 169 HH21 ARG 39 1HH2 ARG 39 7.461 -9.986 -9.843 170 HH22 ARG 39 2HH2 ARG 39 6.659 -9.207 -11.172 171 H LYS 40 H LYS 40 11.085 -5.961 -3.387 172 HA LYS 40 HA LYS 40 11.345 -8.768 -3.565 173 HB2 LYS 40 1HB LYS 40 13.062 -6.686 -2.220 174 HB3 LYS 40 2HB LYS 40 13.495 -8.392 -2.271 175 HG2 LYS 40 1HG LYS 40 13.486 -8.335 -4.703 176 HG3 LYS 40 2HG LYS 40 13.017 -6.636 -4.670 177 HD2 LYS 40 1HD LYS 40 15.107 -6.067 -3.563 178 HD3 LYS 40 2HD LYS 40 15.569 -7.771 -3.531 179 HE2 LYS 40 1HE LYS 40 15.118 -6.077 -5.987 180 HE3 LYS 40 2HE LYS 40 16.673 -6.633 -5.371 181 HZ1 LYS 40 1HZ LYS 40 16.015 -8.053 -7.144 182 HZ2 LYS 40 2HZ LYS 40 14.488 -8.312 -6.469 183 HZ3 LYS 40 3HZ LYS 40 15.864 -8.936 -5.711 184 H MET 41 H MET 41 10.540 -6.633 -0.912 185 HA MET 41 HA MET 41 10.473 -8.779 1.014 186 HB2 MET 41 1HB MET 41 9.676 -5.885 1.084 187 HB3 MET 41 2HB MET 41 9.239 -6.975 2.392 188 HG2 MET 41 1HG MET 41 12.040 -6.434 1.440 189 HG3 MET 41 2HG MET 41 11.275 -5.713 2.856 190 HE1 MET 41 1HE MET 41 13.939 -8.270 4.294 191 HE2 MET 41 2HE MET 41 13.402 -6.592 4.328 192 HE3 MET 41 3HE MET 41 14.065 -7.275 2.844 193 H ALA 42 H ALA 42 8.100 -6.833 -0.756 194 HA ALA 42 HA ALA 42 5.810 -8.019 0.378 195 HB1 ALA 42 1HB ALA 42 4.584 -7.018 -1.453 196 HB2 ALA 42 2HB ALA 42 6.089 -6.706 -2.314 197 HB3 ALA 42 3HB ALA 42 5.757 -5.885 -0.789 198 H GLU 43 H GLU 43 7.656 -8.870 -2.555 199 HA GLU 43 HA GLU 43 5.915 -10.860 -3.464 200 HB2 GLU 43 1HB GLU 43 8.787 -10.272 -3.895 201 HB3 GLU 43 2HB GLU 43 8.253 -11.908 -4.257 202 HG2 GLU 43 1HG GLU 43 6.412 -10.809 -5.641 203 HG3 GLU 43 2HG GLU 43 7.364 -9.334 -5.499 204 H LYS 44 H LYS 44 8.620 -10.948 -1.218 205 HA LYS 44 HA LYS 44 8.532 -13.716 -0.641 206 HB2 LYS 44 1HB LYS 44 10.486 -12.266 -0.222 207 HB3 LYS 44 2HB LYS 44 9.581 -11.400 1.005 208 HG2 LYS 44 1HG LYS 44 10.000 -14.343 1.276 209 HG3 LYS 44 2HG LYS 44 11.301 -13.225 1.681 210 HD2 LYS 44 1HD LYS 44 9.705 -12.050 3.206 211 HD3 LYS 44 2HD LYS 44 8.540 -13.336 2.891 212 HE2 LYS 44 1HE LYS 44 9.727 -13.755 4.968 213 HE3 LYS 44 2HE LYS 44 10.135 -14.980 3.767 214 HZ1 LYS 44 1HZ LYS 44 12.071 -14.136 5.012 215 HZ2 LYS 44 2HZ LYS 44 11.808 -12.600 4.358 216 HZ3 LYS 44 3HZ LYS 44 12.208 -13.890 3.345 217 H ALA 45 H ALA 45 6.912 -10.904 0.679 218 HA ALA 45 HA ALA 45 5.768 -12.340 2.889 219 HB1 ALA 45 1HB ALA 45 5.271 -9.558 1.869 220 HB2 ALA 45 2HB ALA 45 6.337 -10.024 3.192 221 HB3 ALA 45 3HB ALA 45 4.593 -10.225 3.353 222 H ASN 46 H ASN 46 5.118 -12.415 -0.290 223 HA ASN 46 HA ASN 46 3.421 -13.213 -1.554 224 HB2 ASN 46 1HB ASN 46 3.281 -14.899 0.305 225 HB3 ASN 46 2HB ASN 46 2.037 -13.903 1.048 226 HD21 ASN 46 1HD2 ASN 46 0.548 -15.594 0.893 227 HD22 ASN 46 2HD2 ASN 46 -0.180 -16.038 -0.612 228 H LEU 47 H LEU 47 3.495 -10.477 -0.888 229 HA LEU 47 HA LEU 47 0.661 -9.741 -0.668 230 HB2 LEU 47 1HB LEU 47 2.946 -7.806 -0.869 231 HB3 LEU 47 2HB LEU 47 1.347 -7.538 -0.218 232 HG LEU 47 HG LEU 47 3.602 -9.062 1.062 233 HD11 LEU 47 1HD1 LEU 47 3.396 -7.357 2.788 234 HD12 LEU 47 2HD1 LEU 47 2.092 -6.590 1.881 235 HD13 LEU 47 3HD1 LEU 47 3.726 -6.629 1.215 236 HD21 LEU 47 1HD2 LEU 47 0.796 -8.706 2.084 237 HD22 LEU 47 2HD2 LEU 47 2.132 -9.495 2.922 238 HD23 LEU 47 3HD2 LEU 47 1.466 -10.211 1.454 239 H ILE 48 H ILE 48 -0.033 -7.936 -2.144 240 HA ILE 48 HA ILE 48 1.033 -8.390 -4.846 241 HB ILE 48 HB ILE 48 -1.637 -7.202 -4.063 242 HG12 ILE 48 1HG1 ILE 48 -0.928 -9.974 -5.059 243 HG13 ILE 48 2HG1 ILE 48 -1.495 -9.566 -3.442 244 HG21 ILE 48 1HG2 ILE 48 -0.564 -8.073 -6.747 245 HG22 ILE 48 2HG2 ILE 48 -0.831 -6.410 -6.225 246 HG23 ILE 48 3HG2 ILE 48 -2.203 -7.500 -6.433 247 HD11 ILE 48 1HD1 ILE 48 -3.640 -8.888 -4.353 248 HD12 ILE 48 2HD1 ILE 48 -3.255 -10.548 -4.809 249 HD13 ILE 48 3HD1 ILE 48 -3.073 -9.246 -5.984 250 H LEU 49 H LEU 49 2.604 -6.943 -5.167 251 HA LEU 49 HA LEU 49 2.366 -4.231 -4.138 252 HB2 LEU 49 1HB LEU 49 4.463 -5.551 -3.863 253 HB3 LEU 49 2HB LEU 49 4.649 -5.574 -5.600 254 HG LEU 49 HG LEU 49 6.097 -3.938 -4.309 255 HD11 LEU 49 1HD1 LEU 49 5.835 -3.760 -6.706 256 HD12 LEU 49 2HD1 LEU 49 5.887 -2.159 -5.971 257 HD13 LEU 49 3HD1 LEU 49 4.347 -2.839 -6.498 258 HD21 LEU 49 1HD2 LEU 49 5.080 -1.787 -3.725 259 HD22 LEU 49 2HD2 LEU 49 4.446 -3.111 -2.748 260 HD23 LEU 49 3HD2 LEU 49 3.486 -2.456 -4.075 261 H ILE 50 H ILE 50 1.468 -2.700 -5.320 262 HA ILE 50 HA ILE 50 1.778 -2.842 -8.251 263 HB ILE 50 HB ILE 50 -0.565 -1.660 -6.748 264 HG12 ILE 50 1HG1 ILE 50 -0.427 -4.171 -8.434 265 HG13 ILE 50 2HG1 ILE 50 -0.504 -4.140 -6.676 266 HG21 ILE 50 1HG2 ILE 50 -1.584 -1.403 -8.957 267 HG22 ILE 50 2HG2 ILE 50 -0.115 -2.023 -9.709 268 HG23 ILE 50 3HG2 ILE 50 -0.079 -0.492 -8.835 269 HD11 ILE 50 1HD1 ILE 50 -2.671 -4.630 -7.642 270 HD12 ILE 50 2HD1 ILE 50 -2.621 -3.122 -8.557 271 HD13 ILE 50 3HD1 ILE 50 -2.702 -3.083 -6.795 272 H THR 51 H THR 51 2.990 -1.267 -9.025 273 HA THR 51 HA THR 51 3.615 1.058 -7.429 274 HB THR 51 HB THR 51 5.011 1.652 -9.489 275 HG1 THR 51 HG1 THR 51 4.178 0.449 -11.114 276 HG21 THR 51 1HG2 THR 51 5.539 -0.975 -8.099 277 HG22 THR 51 2HG2 THR 51 5.976 0.623 -7.493 278 HG23 THR 51 3HG2 THR 51 6.737 -0.004 -8.954 279 H VAL 52 H VAL 52 2.786 3.092 -7.705 280 HA VAL 52 HA VAL 52 1.051 3.561 -10.009 281 HB VAL 52 HB VAL 52 -0.290 2.555 -8.134 282 HG11 VAL 52 1HG1 VAL 52 0.277 5.195 -6.793 283 HG12 VAL 52 2HG1 VAL 52 0.843 3.612 -6.258 284 HG13 VAL 52 3HG1 VAL 52 -0.881 3.983 -6.243 285 HG21 VAL 52 1HG2 VAL 52 -1.032 5.341 -9.003 286 HG22 VAL 52 2HG2 VAL 52 -2.140 4.132 -8.364 287 HG23 VAL 52 3HG2 VAL 52 -1.329 3.855 -9.903 288 H GLY 53 H GLY 53 0.460 5.742 -10.326 289 HA2 GLY 53 1HA GLY 53 2.449 7.649 -9.472 290 HA3 GLY 53 2HA GLY 53 1.167 7.919 -10.637 291 H ASP 54 H ASP 54 0.994 9.952 -9.558 292 HA ASP 54 HA ASP 54 0.569 10.612 -6.969 293 HB2 ASP 54 1HB ASP 54 -0.608 11.766 -9.483 294 HB3 ASP 54 2HB ASP 54 -0.856 12.518 -7.918 295 H GLU 55 H GLU 55 -1.429 11.517 -5.957 296 HA GLU 55 HA GLU 55 -2.955 9.608 -4.886 297 HB2 GLU 55 1HB GLU 55 -4.036 12.368 -5.420 298 HB3 GLU 55 2HB GLU 55 -4.433 11.304 -4.077 299 HG2 GLU 55 1HG GLU 55 -2.145 11.497 -3.243 300 HG3 GLU 55 2HG GLU 55 -1.752 12.573 -4.583 301 H GLU 56 H GLU 56 -3.994 11.445 -7.778 302 HA GLU 56 HA GLU 56 -6.566 10.276 -7.891 303 HB2 GLU 56 1HB GLU 56 -4.902 11.510 -10.085 304 HB3 GLU 56 2HB GLU 56 -6.602 11.088 -10.239 305 HG2 GLU 56 1HG GLU 56 -5.456 13.067 -8.284 306 HG3 GLU 56 2HG GLU 56 -6.291 13.464 -9.785 307 H GLU 57 H GLU 57 -3.496 9.380 -9.390 308 HA GLU 57 HA GLU 57 -4.548 7.151 -10.812 309 HB2 GLU 57 1HB GLU 57 -1.721 7.680 -9.871 310 HB3 GLU 57 2HB GLU 57 -2.197 6.471 -11.057 311 HG2 GLU 57 1HG GLU 57 -2.420 9.458 -11.333 312 HG3 GLU 57 2HG GLU 57 -1.309 8.390 -12.190 313 H LEU 58 H LEU 58 -3.175 7.659 -7.621 314 HA LEU 58 HA LEU 58 -3.085 5.024 -6.716 315 HB2 LEU 58 1HB LEU 58 -2.149 6.826 -5.418 316 HB3 LEU 58 2HB LEU 58 -3.722 7.569 -5.233 317 HG LEU 58 HG LEU 58 -4.465 5.696 -3.843 318 HD11 LEU 58 1HD1 LEU 58 -3.144 3.906 -4.782 319 HD12 LEU 58 2HD1 LEU 58 -2.833 4.034 -3.050 320 HD13 LEU 58 3HD1 LEU 58 -1.659 4.659 -4.207 321 HD21 LEU 58 1HD2 LEU 58 -1.867 6.922 -2.934 322 HD22 LEU 58 2HD2 LEU 58 -3.077 6.177 -1.892 323 HD23 LEU 58 3HD2 LEU 58 -3.467 7.646 -2.786 324 H LYS 59 H LYS 59 -5.799 7.277 -6.925 325 HA LYS 59 HA LYS 59 -7.767 5.852 -5.612 326 HB2 LYS 59 1HB LYS 59 -7.891 7.601 -8.039 327 HB3 LYS 59 2HB LYS 59 -9.333 6.850 -7.377 328 HG2 LYS 59 1HG LYS 59 -8.959 8.000 -5.256 329 HG3 LYS 59 2HG LYS 59 -7.509 8.756 -5.930 330 HD2 LYS 59 1HD LYS 59 -8.745 10.037 -7.449 331 HD3 LYS 59 2HD LYS 59 -10.184 9.031 -7.265 332 HE2 LYS 59 1HE LYS 59 -10.530 11.129 -6.141 333 HE3 LYS 59 2HE LYS 59 -10.402 9.845 -4.943 334 HZ1 LYS 59 1HZ LYS 59 -9.151 11.791 -4.284 335 HZ2 LYS 59 2HZ LYS 59 -8.234 11.724 -5.709 336 HZ3 LYS 59 3HZ LYS 59 -8.108 10.488 -4.557 337 H LYS 60 H LYS 60 -6.429 5.387 -8.755 338 HA LYS 60 HA LYS 60 -8.388 3.416 -9.511 339 HB2 LYS 60 1HB LYS 60 -5.815 4.154 -10.897 340 HB3 LYS 60 2HB LYS 60 -7.242 3.400 -11.609 341 HG2 LYS 60 1HG LYS 60 -8.535 5.381 -11.292 342 HG3 LYS 60 2HG LYS 60 -7.238 6.137 -10.352 343 HD2 LYS 60 1HD LYS 60 -5.819 6.150 -12.354 344 HD3 LYS 60 2HD LYS 60 -7.090 5.348 -13.277 345 HE2 LYS 60 1HE LYS 60 -7.244 7.630 -13.835 346 HE3 LYS 60 2HE LYS 60 -8.562 7.325 -12.706 347 HZ1 LYS 60 1HZ LYS 60 -5.967 8.641 -12.120 348 HZ2 LYS 60 2HZ LYS 60 -7.095 8.204 -10.929 349 HZ3 LYS 60 3HZ LYS 60 -7.508 9.351 -12.101 350 H ALA 61 H ALA 61 -5.046 3.454 -8.377 351 HA ALA 61 HA ALA 61 -4.567 0.674 -8.733 352 HB1 ALA 61 1HB ALA 61 -3.281 2.633 -6.832 353 HB2 ALA 61 2HB ALA 61 -2.722 2.224 -8.455 354 HB3 ALA 61 3HB ALA 61 -2.688 1.009 -7.178 355 H ILE 62 H ILE 62 -5.811 2.642 -6.101 356 HA ILE 62 HA ILE 62 -6.079 0.609 -4.176 357 HB ILE 62 HB ILE 62 -7.591 3.188 -4.594 358 HG12 ILE 62 1HG1 ILE 62 -5.505 2.382 -2.559 359 HG13 ILE 62 2HG1 ILE 62 -5.196 3.348 -3.999 360 HG21 ILE 62 1HG2 ILE 62 -7.777 1.274 -2.276 361 HG22 ILE 62 2HG2 ILE 62 -9.065 1.697 -3.406 362 HG23 ILE 62 3HG2 ILE 62 -8.433 2.911 -2.295 363 HD11 ILE 62 1HD1 ILE 62 -7.002 4.118 -1.721 364 HD12 ILE 62 2HD1 ILE 62 -6.665 5.089 -3.155 365 HD13 ILE 62 3HD1 ILE 62 -5.374 4.729 -2.010 366 H LYS 63 H LYS 63 -8.272 1.794 -6.701 367 HA LYS 63 HA LYS 63 -10.381 0.011 -6.035 368 HB2 LYS 63 1HB LYS 63 -10.829 2.051 -7.278 369 HB3 LYS 63 2HB LYS 63 -9.802 1.508 -8.596 370 HG2 LYS 63 1HG LYS 63 -12.239 1.303 -9.035 371 HG3 LYS 63 2HG LYS 63 -11.343 -0.204 -9.198 372 HD2 LYS 63 1HD LYS 63 -13.458 -0.577 -8.053 373 HD3 LYS 63 2HD LYS 63 -12.103 -0.897 -6.974 374 HE2 LYS 63 1HE LYS 63 -12.414 1.258 -5.903 375 HE3 LYS 63 2HE LYS 63 -13.713 1.653 -7.029 376 HZ1 LYS 63 1HZ LYS 63 -13.786 -0.662 -5.162 377 HZ2 LYS 63 2HZ LYS 63 -15.053 -0.081 -6.125 378 HZ3 LYS 63 3HZ LYS 63 -14.488 0.846 -4.832 379 H LYS 64 H LYS 64 -7.543 -0.229 -8.096 380 HA LYS 64 HA LYS 64 -8.174 -2.673 -9.342 381 HB2 LYS 64 1HB LYS 64 -5.525 -1.481 -8.532 382 HB3 LYS 64 2HB LYS 64 -5.654 -3.006 -9.397 383 HG2 LYS 64 1HG LYS 64 -6.803 -1.841 -11.231 384 HG3 LYS 64 2HG LYS 64 -6.592 -0.316 -10.367 385 HD2 LYS 64 1HD LYS 64 -4.192 -0.532 -10.487 386 HD3 LYS 64 2HD LYS 64 -4.339 -2.127 -11.223 387 HE2 LYS 64 1HE LYS 64 -5.225 0.496 -12.419 388 HE3 LYS 64 2HE LYS 64 -3.832 -0.467 -12.909 389 HZ1 LYS 64 1HZ LYS 64 -5.677 -0.821 -14.401 390 HZ2 LYS 64 2HZ LYS 64 -6.679 -1.287 -13.123 391 HZ3 LYS 64 3HZ LYS 64 -5.354 -2.249 -13.552 392 H ALA 65 H ALA 65 -6.387 -1.998 -6.351 393 HA ALA 65 HA ALA 65 -6.015 -4.652 -5.532 394 HB1 ALA 65 1HB ALA 65 -5.606 -3.713 -3.312 395 HB2 ALA 65 2HB ALA 65 -6.298 -2.176 -3.830 396 HB3 ALA 65 3HB ALA 65 -4.806 -2.763 -4.563 397 H ASP 66 H ASP 66 -8.564 -2.330 -4.700 398 HA ASP 66 HA ASP 66 -10.090 -3.980 -3.042 399 HB2 ASP 66 1HB ASP 66 -10.585 -1.685 -3.013 400 HB3 ASP 66 2HB ASP 66 -10.743 -1.597 -4.751 401 H ASP 67 H ASP 67 -10.193 -3.550 -6.557 402 HA ASP 67 HA ASP 67 -12.392 -5.251 -7.043 403 HB2 ASP 67 1HB ASP 67 -11.634 -3.699 -8.742 404 HB3 ASP 67 2HB ASP 67 -10.068 -4.499 -8.824 405 H ILE 68 H ILE 68 -8.890 -5.873 -7.046 406 HA ILE 68 HA ILE 68 -9.035 -8.601 -7.741 407 HB ILE 68 HB ILE 68 -6.940 -7.196 -6.064 408 HG12 ILE 68 1HG1 ILE 68 -6.948 -7.848 -9.020 409 HG13 ILE 68 2HG1 ILE 68 -7.282 -6.258 -8.347 410 HG21 ILE 68 1HG2 ILE 68 -6.840 -9.605 -5.755 411 HG22 ILE 68 2HG2 ILE 68 -5.463 -9.051 -6.711 412 HG23 ILE 68 3HG2 ILE 68 -6.824 -9.846 -7.502 413 HD11 ILE 68 1HD1 ILE 68 -4.689 -7.767 -8.104 414 HD12 ILE 68 2HD1 ILE 68 -5.024 -6.174 -7.423 415 HD13 ILE 68 3HD1 ILE 68 -5.008 -6.400 -9.172 416 H ALA 69 H ALA 69 -9.304 -6.906 -4.683 417 HA ALA 69 HA ALA 69 -9.331 -9.180 -3.002 418 HB1 ALA 69 1HB ALA 69 -8.964 -6.908 -2.157 419 HB2 ALA 69 2HB ALA 69 -10.303 -7.701 -1.325 420 HB3 ALA 69 3HB ALA 69 -10.629 -6.489 -2.565 421 H LYS 70 H LYS 70 -11.937 -7.291 -4.509 422 HA LYS 70 HA LYS 70 -14.149 -8.515 -3.384 423 HB2 LYS 70 1HB LYS 70 -13.801 -7.543 -6.220 424 HB3 LYS 70 2HB LYS 70 -15.355 -7.902 -5.489 425 HG2 LYS 70 1HG LYS 70 -13.467 -5.787 -4.482 426 HG3 LYS 70 2HG LYS 70 -14.805 -5.486 -5.593 427 HD2 LYS 70 1HD LYS 70 -16.388 -6.286 -3.935 428 HD3 LYS 70 2HD LYS 70 -15.066 -6.663 -2.831 429 HE2 LYS 70 1HE LYS 70 -14.434 -4.240 -2.907 430 HE3 LYS 70 2HE LYS 70 -15.924 -3.948 -3.805 431 HZ1 LYS 70 1HZ LYS 70 -16.200 -3.534 -1.435 432 HZ2 LYS 70 2HZ LYS 70 -15.757 -5.132 -1.091 433 HZ3 LYS 70 3HZ LYS 70 -17.182 -4.818 -1.944 434 H LYS 71 H LYS 71 -12.175 -9.613 -6.059 435 HA LYS 71 HA LYS 71 -13.685 -11.595 -7.173 436 HB2 LYS 71 1HB LYS 71 -10.750 -11.727 -6.448 437 HB3 LYS 71 2HB LYS 71 -11.555 -12.806 -7.575 438 HG2 LYS 71 1HG LYS 71 -11.963 -11.023 -9.104 439 HG3 LYS 71 2HG LYS 71 -11.415 -9.825 -7.935 440 HD2 LYS 71 1HD LYS 71 -9.633 -10.086 -9.452 441 HD3 LYS 71 2HD LYS 71 -9.160 -10.982 -8.013 442 HE2 LYS 71 1HE LYS 71 -10.451 -12.287 -10.397 443 HE3 LYS 71 2HE LYS 71 -8.709 -12.086 -10.250 444 HZ1 LYS 71 1HZ LYS 71 -9.273 -14.251 -9.500 445 HZ2 LYS 71 2HZ LYS 71 -10.484 -13.671 -8.481 446 HZ3 LYS 71 3HZ LYS 71 -8.862 -13.350 -8.128 447 H GLN 72 H GLN 72 -11.713 -11.804 -4.248 448 HA GLN 72 HA GLN 72 -13.214 -14.231 -3.545 449 HB2 GLN 72 1HB GLN 72 -11.106 -15.146 -2.535 450 HB3 GLN 72 2HB GLN 72 -11.134 -15.056 -4.289 451 HG2 GLN 72 1HG GLN 72 -9.789 -13.028 -4.216 452 HG3 GLN 72 2HG GLN 72 -9.779 -13.089 -2.455 453 HE21 GLN 72 1HE2 GLN 72 -8.559 -14.657 -1.415 454 HE22 GLN 72 2HE2 GLN 72 -7.305 -15.530 -2.224 455 H ASN 73 H ASN 73 -11.229 -11.582 -2.152 456 HA ASN 73 HA ASN 73 -12.075 -12.565 0.466 457 HB2 ASN 73 1HB ASN 73 -9.394 -11.607 -0.461 458 HB3 ASN 73 2HB ASN 73 -9.806 -11.643 1.250 459 HD21 ASN 73 1HD2 ASN 73 -7.939 -13.126 1.276 460 HD22 ASN 73 2HD2 ASN 73 -8.226 -14.805 0.980 461 H SER 74 H SER 74 -13.008 -10.091 -1.210 462 HA SER 74 HA SER 74 -12.110 -7.848 0.293 463 HB2 SER 74 1HB SER 74 -12.967 -7.690 -2.012 464 HB3 SER 74 2HB SER 74 -14.586 -8.060 -1.417 465 HG SER 74 HG SER 74 -13.131 -5.917 -0.306 466 H SER 75 H SER 75 -14.060 -10.297 1.331 467 HA SER 75 HA SER 75 -16.027 -9.033 2.849 468 HB2 SER 75 1HB SER 75 -15.640 -11.017 4.440 469 HB3 SER 75 2HB SER 75 -16.077 -11.401 2.775 470 HG SER 75 HG SER 75 -14.305 -12.651 3.559 471 H GLU 76 H GLU 76 -12.620 -9.615 3.483 472 HA GLU 76 HA GLU 76 -12.371 -7.144 4.868 473 HB2 GLU 76 1HB GLU 76 -13.227 -8.676 6.693 474 HB3 GLU 76 2HB GLU 76 -11.758 -9.621 6.490 475 HG2 GLU 76 1HG GLU 76 -11.456 -8.152 8.343 476 HG3 GLU 76 2HG GLU 76 -10.438 -7.584 7.019 477 H ALA 77 H ALA 77 -10.335 -6.410 4.581 478 HA ALA 77 HA ALA 77 -8.152 -8.235 4.048 479 HB1 ALA 77 1HB ALA 77 -9.080 -6.307 1.917 480 HB2 ALA 77 2HB ALA 77 -9.255 -8.060 1.856 481 HB3 ALA 77 3HB ALA 77 -7.647 -7.334 1.841 482 H LYS 78 H LYS 78 -6.089 -6.983 3.696 483 HA LYS 78 HA LYS 78 -6.267 -4.316 4.917 484 HB2 LYS 78 1HB LYS 78 -4.197 -6.433 5.536 485 HB3 LYS 78 2HB LYS 78 -4.120 -4.768 6.089 486 HG2 LYS 78 1HG LYS 78 -6.352 -5.179 7.206 487 HG3 LYS 78 2HG LYS 78 -6.101 -6.887 6.857 488 HD2 LYS 78 1HD LYS 78 -4.296 -5.122 8.516 489 HD3 LYS 78 2HD LYS 78 -5.405 -6.344 9.132 490 HE2 LYS 78 1HE LYS 78 -3.493 -7.568 9.143 491 HE3 LYS 78 2HE LYS 78 -4.009 -7.892 7.490 492 HZ1 LYS 78 1HZ LYS 78 -2.552 -6.005 6.808 493 HZ2 LYS 78 2HZ LYS 78 -1.721 -7.332 7.444 494 HZ3 LYS 78 3HZ LYS 78 -1.949 -5.948 8.392 495 H ILE 79 H ILE 79 -5.032 -2.762 4.019 496 HA ILE 79 HA ILE 79 -3.271 -3.561 1.797 497 HB ILE 79 HB ILE 79 -5.168 -1.203 1.778 498 HG12 ILE 79 1HG1 ILE 79 -5.279 -3.795 0.221 499 HG13 ILE 79 2HG1 ILE 79 -6.368 -3.330 1.528 500 HG21 ILE 79 1HG2 ILE 79 -4.476 -0.953 -0.568 501 HG22 ILE 79 2HG2 ILE 79 -3.307 -2.254 -0.349 502 HG23 ILE 79 3HG2 ILE 79 -3.126 -0.748 0.547 503 HD11 ILE 79 1HD1 ILE 79 -6.100 -1.955 -1.136 504 HD12 ILE 79 2HD1 ILE 79 -7.178 -1.464 0.171 505 HD13 ILE 79 3HD1 ILE 79 -7.415 -3.015 -0.631 506 H LEU 80 H LEU 80 -1.370 -2.427 1.636 507 HA LEU 80 HA LEU 80 -0.948 -0.258 3.598 508 HB2 LEU 80 1HB LEU 80 0.434 -2.548 3.526 509 HB3 LEU 80 2HB LEU 80 1.331 -1.683 2.288 510 HG LEU 80 HG LEU 80 1.016 -0.865 5.186 511 HD11 LEU 80 1HD1 LEU 80 2.557 -2.724 4.791 512 HD12 LEU 80 2HD1 LEU 80 3.404 -1.267 5.309 513 HD13 LEU 80 3HD1 LEU 80 3.429 -1.746 3.612 514 HD21 LEU 80 1HD2 LEU 80 2.606 0.931 4.651 515 HD22 LEU 80 2HD2 LEU 80 1.063 1.125 3.821 516 HD23 LEU 80 3HD2 LEU 80 2.468 0.523 2.942 517 H ILE 81 H ILE 81 -0.462 1.728 2.766 518 HA ILE 81 HA ILE 81 0.309 1.830 -0.078 519 HB ILE 81 HB ILE 81 -1.208 3.932 1.485 520 HG12 ILE 81 1HG1 ILE 81 -2.070 2.174 -0.825 521 HG13 ILE 81 2HG1 ILE 81 -2.580 1.984 0.848 522 HG21 ILE 81 1HG2 ILE 81 0.330 4.938 -0.118 523 HG22 ILE 81 2HG2 ILE 81 -1.341 5.140 -0.645 524 HG23 ILE 81 3HG2 ILE 81 -0.321 3.917 -1.401 525 HD11 ILE 81 1HD1 ILE 81 -3.687 4.151 0.759 526 HD12 ILE 81 2HD1 ILE 81 -4.291 3.066 -0.492 527 HD13 ILE 81 3HD1 ILE 81 -3.162 4.353 -0.911 528 H LEU 82 H LEU 82 2.445 2.069 -0.098 529 HA LEU 82 HA LEU 82 3.749 3.787 1.872 530 HB2 LEU 82 1HB LEU 82 4.872 2.026 -0.312 531 HB3 LEU 82 2HB LEU 82 5.848 2.981 0.786 532 HG LEU 82 HG LEU 82 4.006 0.742 1.629 533 HD11 LEU 82 1HD1 LEU 82 6.044 -0.527 2.026 534 HD12 LEU 82 2HD1 LEU 82 7.009 0.805 1.394 535 HD13 LEU 82 3HD1 LEU 82 5.911 -0.071 0.327 536 HD21 LEU 82 1HD2 LEU 82 5.152 0.952 3.784 537 HD22 LEU 82 2HD2 LEU 82 4.300 2.435 3.354 538 HD23 LEU 82 3HD2 LEU 82 6.051 2.337 3.167 539 H LEU 83 H LEU 83 3.353 5.861 1.330 540 HA LEU 83 HA LEU 83 4.165 6.699 -1.376 541 HB2 LEU 83 1HB LEU 83 2.579 8.685 -0.876 542 HB3 LEU 83 2HB LEU 83 1.896 7.157 -1.384 543 HG LEU 83 HG LEU 83 1.382 6.654 1.017 544 HD11 LEU 83 1HD1 LEU 83 1.400 8.477 2.624 545 HD12 LEU 83 2HD1 LEU 83 2.174 9.526 1.437 546 HD13 LEU 83 3HD1 LEU 83 3.029 8.113 2.055 547 HD21 LEU 83 1HD2 LEU 83 -0.321 7.517 -0.484 548 HD22 LEU 83 2HD2 LEU 83 0.182 9.170 -0.128 549 HD23 LEU 83 3HD2 LEU 83 -0.532 8.173 1.140 550 H GLU 84 H GLU 84 4.705 9.230 -1.268 551 HA GLU 84 HA GLU 84 6.041 9.720 1.313 552 HB2 GLU 84 1HB GLU 84 7.656 9.377 -0.527 553 HB3 GLU 84 2HB GLU 84 6.902 10.691 -1.419 554 HG2 GLU 84 1HG GLU 84 7.510 12.224 0.434 555 HG3 GLU 84 2HG GLU 84 8.382 10.891 1.192 556 H LYS 85 H LYS 85 4.462 10.851 2.253 557 HA LYS 85 HA LYS 85 4.558 13.607 1.922 558 HB2 LYS 85 1HB LYS 85 2.217 14.125 1.351 559 HB3 LYS 85 2HB LYS 85 3.063 13.354 0.022 560 HG2 LYS 85 1HG LYS 85 1.959 11.241 0.536 561 HG3 LYS 85 2HG LYS 85 1.112 12.008 1.881 562 HD2 LYS 85 1HD LYS 85 0.896 12.849 -1.011 563 HD3 LYS 85 2HD LYS 85 -0.276 11.838 -0.164 564 HE2 LYS 85 1HE LYS 85 -0.851 13.611 1.318 565 HE3 LYS 85 2HE LYS 85 0.489 14.602 0.756 566 HZ1 LYS 85 1HZ LYS 85 -1.849 13.799 -0.898 567 HZ2 LYS 85 2HZ LYS 85 -0.574 14.806 -1.381 568 HZ3 LYS 85 3HZ LYS 85 -1.633 15.313 -0.167 569 HA PRO 86 HA PRO 86 3.290 13.025 6.140 570 HB2 PRO 86 1HB PRO 86 2.354 15.538 6.695 571 HB3 PRO 86 2HB PRO 86 4.068 15.112 6.673 572 HG2 PRO 86 1HG PRO 86 2.419 16.451 4.570 573 HG3 PRO 86 2HG PRO 86 4.074 16.804 5.091 574 HD2 PRO 86 1HD PRO 86 3.537 15.424 2.833 575 HD3 PRO 86 2HD PRO 86 4.975 15.098 3.823 576 H VAL 87 H VAL 87 1.510 11.902 6.635 577 HA VAL 87 HA VAL 87 -1.090 12.929 5.717 578 HB VAL 87 HB VAL 87 -1.866 10.537 5.619 579 HG11 VAL 87 1HG1 VAL 87 -1.383 11.798 3.603 580 HG12 VAL 87 2HG1 VAL 87 -0.889 10.115 3.410 581 HG13 VAL 87 3HG1 VAL 87 0.322 11.361 3.718 582 HG21 VAL 87 1HG2 VAL 87 1.095 9.967 5.750 583 HG22 VAL 87 2HG2 VAL 87 -0.154 8.797 5.322 584 HG23 VAL 87 3HG2 VAL 87 -0.116 9.495 6.942 585 H SER 88 H SER 88 -2.401 13.435 7.282 586 HA SER 88 HA SER 88 -2.045 12.388 9.960 587 HB2 SER 88 1HB SER 88 -4.076 14.358 8.877 588 HB3 SER 88 2HB SER 88 -3.743 14.035 10.577 589 HG SER 88 HG SER 88 -1.489 14.668 9.978 590 HA PRO 89 HA PRO 89 -4.929 9.113 10.305 591 HB2 PRO 89 1HB PRO 89 -6.661 10.953 11.918 592 HB3 PRO 89 2HB PRO 89 -6.216 9.271 12.229 593 HG2 PRO 89 1HG PRO 89 -4.965 11.225 13.504 594 HG3 PRO 89 2HG PRO 89 -4.058 9.826 12.897 595 HD2 PRO 89 1HD PRO 89 -4.158 12.609 11.867 596 HD3 PRO 89 2HD PRO 89 -2.840 11.426 11.796 597 H GLU 90 H GLU 90 -6.692 12.196 9.846 598 HA GLU 90 HA GLU 90 -9.044 11.079 8.819 599 HB2 GLU 90 1HB GLU 90 -8.967 13.387 9.561 600 HB3 GLU 90 2HB GLU 90 -7.823 13.792 8.287 601 HG2 GLU 90 1HG GLU 90 -9.508 13.310 6.601 602 HG3 GLU 90 2HG GLU 90 -10.655 12.865 7.862 603 H TYR 91 H TYR 91 -6.056 11.994 7.202 604 HA TYR 91 HA TYR 91 -7.029 11.857 4.558 605 HB2 TYR 91 1HB TYR 91 -4.233 11.533 5.654 606 HB3 TYR 91 2HB TYR 91 -4.610 11.623 3.936 607 HD1 TYR 91 HD1 TYR 91 -4.958 13.700 2.877 608 HD2 TYR 91 HD2 TYR 91 -4.756 13.513 7.119 609 HE1 TYR 91 HE1 TYR 91 -4.860 16.153 2.976 610 HE2 TYR 91 HE2 TYR 91 -4.652 15.966 7.231 611 HH TYR 91 HH TYR 91 -5.470 17.957 4.742 612 H GLU 92 H GLU 92 -5.759 9.444 6.755 613 HA GLU 92 HA GLU 92 -5.390 7.351 4.945 614 HB2 GLU 92 1HB GLU 92 -4.536 7.271 7.213 615 HB3 GLU 92 2HB GLU 92 -6.168 7.307 7.861 616 HG2 GLU 92 1HG GLU 92 -6.630 5.128 6.892 617 HG3 GLU 92 2HG GLU 92 -5.021 5.116 6.168 618 H LYS 93 H LYS 93 -8.254 8.569 6.548 619 HA LYS 93 HA LYS 93 -9.945 6.370 5.962 620 HB2 LYS 93 1HB LYS 93 -10.450 7.927 7.780 621 HB3 LYS 93 2HB LYS 93 -10.608 9.247 6.630 622 HG2 LYS 93 1HG LYS 93 -12.537 8.132 5.619 623 HG3 LYS 93 2HG LYS 93 -12.381 6.820 6.787 624 HD2 LYS 93 1HD LYS 93 -12.793 8.370 8.613 625 HD3 LYS 93 2HD LYS 93 -12.885 9.713 7.473 626 HE2 LYS 93 1HE LYS 93 -15.111 8.973 8.131 627 HE3 LYS 93 2HE LYS 93 -14.831 8.687 6.416 628 HZ1 LYS 93 1HZ LYS 93 -14.380 6.367 6.908 629 HZ2 LYS 93 2HZ LYS 93 -15.913 6.802 7.466 630 HZ3 LYS 93 3HZ LYS 93 -14.635 6.638 8.558 631 H LYS 94 H LYS 94 -8.858 9.134 4.206 632 HA LYS 94 HA LYS 94 -10.926 9.297 2.284 633 HB2 LYS 94 1HB LYS 94 -9.198 11.053 2.724 634 HB3 LYS 94 2HB LYS 94 -8.002 10.012 1.972 635 HG2 LYS 94 1HG LYS 94 -9.294 10.118 -0.134 636 HG3 LYS 94 2HG LYS 94 -10.392 11.263 0.642 637 HD2 LYS 94 1HD LYS 94 -8.443 12.742 1.087 638 HD3 LYS 94 2HD LYS 94 -7.435 11.627 0.166 639 HE2 LYS 94 1HE LYS 94 -8.057 13.447 -1.263 640 HE3 LYS 94 2HE LYS 94 -8.911 12.000 -1.796 641 HZ1 LYS 94 1HZ LYS 94 -10.055 14.189 -0.148 642 HZ2 LYS 94 2HZ LYS 94 -10.878 12.792 -0.612 643 HZ3 LYS 94 3HZ LYS 94 -10.375 13.903 -1.782 644 H LEU 95 H LEU 95 -7.751 7.712 2.271 645 HA LEU 95 HA LEU 95 -8.191 6.401 -0.231 646 HB2 LEU 95 1HB LEU 95 -6.147 5.882 1.930 647 HB3 LEU 95 2HB LEU 95 -6.148 5.103 0.365 648 HG LEU 95 HG LEU 95 -4.532 6.767 0.174 649 HD11 LEU 95 1HD1 LEU 95 -5.395 8.380 -1.418 650 HD12 LEU 95 2HD1 LEU 95 -7.043 8.016 -0.911 651 HD13 LEU 95 3HD1 LEU 95 -6.075 6.779 -1.712 652 HD21 LEU 95 1HD2 LEU 95 -5.025 7.973 2.229 653 HD22 LEU 95 2HD2 LEU 95 -6.421 8.723 1.457 654 HD23 LEU 95 3HD2 LEU 95 -4.796 9.077 0.873 655 H GLN 96 H GLN 96 -8.626 5.591 3.136 656 HA GLN 96 HA GLN 96 -9.005 2.797 2.786 657 HB2 GLN 96 1HB GLN 96 -8.387 4.037 4.924 658 HB3 GLN 96 2HB GLN 96 -10.080 4.483 5.046 659 HG2 GLN 96 1HG GLN 96 -10.729 2.189 5.249 660 HG3 GLN 96 2HG GLN 96 -9.082 1.643 4.953 661 HE21 GLN 96 1HE2 GLN 96 -7.942 3.793 6.579 662 HE22 GLN 96 2HE2 GLN 96 -8.228 3.340 8.221 663 H LYS 97 H LYS 97 -11.029 5.564 2.407 664 HA LYS 97 HA LYS 97 -13.507 4.105 2.521 665 HB2 LYS 97 1HB LYS 97 -13.241 6.549 3.057 666 HB3 LYS 97 2HB LYS 97 -13.022 6.837 1.336 667 HG2 LYS 97 1HG LYS 97 -15.246 6.015 0.879 668 HG3 LYS 97 2HG LYS 97 -15.469 5.609 2.582 669 HD2 LYS 97 1HD LYS 97 -15.138 8.017 3.130 670 HD3 LYS 97 2HD LYS 97 -15.109 8.358 1.397 671 HE2 LYS 97 1HE LYS 97 -17.317 8.778 2.323 672 HE3 LYS 97 2HE LYS 97 -17.363 7.434 1.183 673 HZ1 LYS 97 1HZ LYS 97 -17.345 5.896 3.036 674 HZ2 LYS 97 2HZ LYS 97 -18.641 6.967 3.184 675 HZ3 LYS 97 3HZ LYS 97 -17.262 7.174 4.140 676 H TYR 98 H TYR 98 -11.182 4.869 0.035 677 HA TYR 98 HA TYR 98 -12.934 4.593 -2.189 678 HB2 TYR 98 1HB TYR 98 -9.931 4.325 -2.030 679 HB3 TYR 98 2HB TYR 98 -10.846 4.345 -3.532 680 HD1 TYR 98 HD1 TYR 98 -8.631 6.253 -2.235 681 HD2 TYR 98 HD2 TYR 98 -12.834 6.498 -2.844 682 HE1 TYR 98 HE1 TYR 98 -8.478 8.706 -2.273 683 HE2 TYR 98 HE2 TYR 98 -12.691 8.950 -2.885 684 HH TYR 98 HH TYR 98 -11.227 10.716 -2.103 685 H ALA 99 H ALA 99 -11.100 2.295 -0.318 686 HA ALA 99 HA ALA 99 -12.067 0.130 -2.084 687 HB1 ALA 99 1HB ALA 99 -9.516 0.337 -0.490 688 HB2 ALA 99 2HB ALA 99 -9.686 0.178 -2.239 689 HB3 ALA 99 3HB ALA 99 -10.105 -1.172 -1.184 690 H ASP 100 H ASP 100 -12.809 -1.810 -0.998 691 HA ASP 100 HA ASP 100 -13.464 -1.323 1.813 692 HB2 ASP 100 1HB ASP 100 -14.266 -3.545 -0.079 693 HB3 ASP 100 2HB ASP 100 -14.671 -3.542 1.636 694 H ALA 101 H ALA 101 -11.636 -1.451 2.830 695 HA ALA 101 HA ALA 101 -10.639 -3.941 3.677 696 HB1 ALA 101 1HB ALA 101 -9.514 -3.934 1.483 697 HB2 ALA 101 2HB ALA 101 -8.354 -3.788 2.803 698 HB3 ALA 101 3HB ALA 101 -8.800 -2.366 1.861 699 H GLU 102 H GLU 102 -8.656 -3.530 5.102 700 HA GLU 102 HA GLU 102 -8.903 -0.874 6.312 701 HB2 GLU 102 1HB GLU 102 -7.226 -3.137 7.376 702 HB3 GLU 102 2HB GLU 102 -7.885 -1.757 8.232 703 HG2 GLU 102 1HG GLU 102 -10.156 -2.691 7.884 704 HG3 GLU 102 2HG GLU 102 -9.403 -4.133 7.201 705 H VAL 103 H VAL 103 -7.726 0.375 4.824 706 HA VAL 103 HA VAL 103 -5.048 -0.491 4.138 707 HB VAL 103 HB VAL 103 -6.560 0.727 2.487 708 HG11 VAL 103 1HG1 VAL 103 -6.694 3.088 2.531 709 HG12 VAL 103 2HG1 VAL 103 -5.595 3.192 3.911 710 HG13 VAL 103 3HG1 VAL 103 -7.219 2.520 4.118 711 HG21 VAL 103 1HG2 VAL 103 -3.825 1.898 2.957 712 HG22 VAL 103 2HG2 VAL 103 -4.713 1.869 1.433 713 HG23 VAL 103 3HG2 VAL 103 -4.149 0.364 2.154 714 H ARG 104 H ARG 104 -3.226 0.227 4.949 715 HA ARG 104 HA ARG 104 -3.354 2.229 7.103 716 HB2 ARG 104 1HB ARG 104 -2.732 -0.181 7.658 717 HB3 ARG 104 2HB ARG 104 -1.270 0.072 6.718 718 HG2 ARG 104 1HG ARG 104 -0.517 1.761 8.243 719 HG3 ARG 104 2HG ARG 104 -2.043 1.695 9.128 720 HD2 ARG 104 1HD ARG 104 -0.057 -0.559 8.856 721 HD3 ARG 104 2HD ARG 104 -0.286 0.446 10.286 722 HE ARG 104 HE ARG 104 -2.705 -0.491 10.109 723 HH11 ARG 104 1HH1 ARG 104 0.256 -2.262 9.457 724 HH12 ARG 104 2HH1 ARG 104 -0.440 -3.805 9.866 725 HH21 ARG 104 1HH2 ARG 104 -3.588 -2.509 10.670 726 HH22 ARG 104 2HH2 ARG 104 -2.597 -3.938 10.593 727 H VAL 105 H VAL 105 -2.827 4.105 6.090 728 HA VAL 105 HA VAL 105 -1.048 4.088 3.842 729 HB VAL 105 HB VAL 105 -1.371 6.508 3.731 730 HG11 VAL 105 1HG1 VAL 105 -3.008 5.084 2.669 731 HG12 VAL 105 2HG1 VAL 105 -3.804 6.505 3.346 732 HG13 VAL 105 3HG1 VAL 105 -3.914 4.953 4.176 733 HG21 VAL 105 1HG2 VAL 105 -2.986 6.185 6.258 734 HG22 VAL 105 2HG2 VAL 105 -2.873 7.655 5.291 735 HG23 VAL 105 3HG2 VAL 105 -1.443 7.025 6.109 736 H ARG 106 H ARG 106 1.090 4.528 3.803 737 HA ARG 106 HA ARG 106 2.355 5.547 6.259 738 HB2 ARG 106 1HB ARG 106 2.746 2.950 4.941 739 HB3 ARG 106 2HB ARG 106 4.240 3.818 5.259 740 HG2 ARG 106 1HG ARG 106 3.638 2.254 7.054 741 HG3 ARG 106 2HG ARG 106 3.726 3.925 7.615 742 HD2 ARG 106 1HD ARG 106 1.231 4.031 7.288 743 HD3 ARG 106 2HD ARG 106 1.272 2.289 7.035 744 HE ARG 106 HE ARG 106 2.367 2.277 9.350 745 HH11 ARG 106 1HH1 ARG 106 -0.025 4.627 8.331 746 HH12 ARG 106 2HH1 ARG 106 -0.704 4.806 9.920 747 HH21 ARG 106 1HH2 ARG 106 1.497 2.535 11.437 748 HH22 ARG 106 2HH2 ARG 106 0.181 3.637 11.694 749 H THR 107 H THR 107 4.123 6.848 5.962 750 HA THR 107 HA THR 107 4.758 7.498 3.170 751 HB THR 107 HB THR 107 3.792 9.400 4.333 752 HG1 THR 107 HG1 THR 107 6.343 10.356 4.349 753 HG21 THR 107 1HG2 THR 107 4.347 8.839 6.633 754 HG22 THR 107 2HG2 THR 107 4.937 10.453 6.240 755 HG23 THR 107 3HG2 THR 107 6.059 9.095 6.303 756 H VAL 108 H VAL 108 6.736 7.140 2.447 757 HA VAL 108 HA VAL 108 8.867 6.564 4.399 758 HB VAL 108 HB VAL 108 9.719 4.796 2.876 759 HG11 VAL 108 1HG1 VAL 108 6.912 4.349 3.877 760 HG12 VAL 108 2HG1 VAL 108 8.392 4.199 4.826 761 HG13 VAL 108 3HG1 VAL 108 8.084 3.090 3.489 762 HG21 VAL 108 1HG2 VAL 108 7.082 5.168 1.456 763 HG22 VAL 108 2HG2 VAL 108 8.234 3.865 1.161 764 HG23 VAL 108 3HG2 VAL 108 8.678 5.534 0.801 765 H THR 109 H THR 109 10.947 7.107 3.796 766 HA THR 109 HA THR 109 11.174 8.718 1.339 767 HB THR 109 HB THR 109 13.011 9.953 2.526 768 HG1 THR 109 HG1 THR 109 12.240 8.181 4.550 769 HG21 THR 109 1HG2 THR 109 11.498 11.347 3.868 770 HG22 THR 109 2HG2 THR 109 10.267 10.088 3.779 771 HG23 THR 109 3HG2 THR 109 10.784 10.921 2.314 772 H SER 110 H SER 110 12.585 6.291 3.404 773 HA SER 110 HA SER 110 14.676 5.814 1.386 774 HB2 SER 110 1HB SER 110 14.768 5.208 4.351 775 HB3 SER 110 2HB SER 110 16.065 4.925 3.192 776 HG SER 110 HG SER 110 15.141 7.498 3.142 777 HA PRO 111 HA PRO 111 12.803 1.939 0.480 778 HB2 PRO 111 1HB PRO 111 15.566 0.899 0.236 779 HB3 PRO 111 2HB PRO 111 14.253 0.896 -0.942 780 HG2 PRO 111 1HG PRO 111 16.309 2.573 -1.186 781 HG3 PRO 111 2HG PRO 111 14.660 3.078 -1.599 782 HD2 PRO 111 1HD PRO 111 16.290 3.712 0.820 783 HD3 PRO 111 2HD PRO 111 15.160 4.737 -0.083 784 H ASP 112 H ASP 112 15.163 2.147 3.051 785 HA ASP 112 HA ASP 112 14.753 -0.558 3.932 786 HB2 ASP 112 1HB ASP 112 16.113 -0.028 5.829 787 HB3 ASP 112 2HB ASP 112 16.841 0.745 4.429 788 H GLU 113 H GLU 113 13.279 2.539 4.555 789 HA GLU 113 HA GLU 113 11.823 1.833 6.875 790 HB2 GLU 113 1HB GLU 113 11.063 3.799 4.705 791 HB3 GLU 113 2HB GLU 113 10.372 3.727 6.319 792 HG2 GLU 113 1HG GLU 113 12.550 4.299 7.270 793 HG3 GLU 113 2HG GLU 113 13.227 4.391 5.643 794 H ALA 114 H ALA 114 11.142 1.627 3.432 795 HA ALA 114 HA ALA 114 8.510 0.736 3.503 796 HB1 ALA 114 1HB ALA 114 8.931 -0.193 1.285 797 HB2 ALA 114 2HB ALA 114 10.668 -0.040 1.541 798 HB3 ALA 114 3HB ALA 114 9.662 1.404 1.446 799 H LYS 115 H LYS 115 11.530 -1.112 3.591 800 HA LYS 115 HA LYS 115 10.393 -3.671 3.675 801 HB2 LYS 115 1HB LYS 115 13.032 -2.668 4.755 802 HB3 LYS 115 2HB LYS 115 12.595 -4.366 4.644 803 HG2 LYS 115 1HG LYS 115 12.275 -4.000 2.166 804 HG3 LYS 115 2HG LYS 115 13.023 -2.420 2.395 805 HD2 LYS 115 1HD LYS 115 14.335 -4.988 3.259 806 HD3 LYS 115 2HD LYS 115 14.557 -4.295 1.652 807 HE2 LYS 115 1HE LYS 115 15.117 -2.780 4.191 808 HE3 LYS 115 2HE LYS 115 16.336 -3.743 3.357 809 HZ1 LYS 115 1HZ LYS 115 16.506 -1.460 2.683 810 HZ2 LYS 115 2HZ LYS 115 14.872 -1.412 2.244 811 HZ3 LYS 115 3HZ LYS 115 15.954 -2.380 1.369 812 H ARG 116 H ARG 116 11.108 -1.347 6.217 813 HA ARG 116 HA ARG 116 10.643 -3.024 8.430 814 HB2 ARG 116 1HB ARG 116 10.330 -0.038 8.103 815 HB3 ARG 116 2HB ARG 116 10.174 -0.866 9.645 816 HG2 ARG 116 1HG ARG 116 12.647 -1.257 8.035 817 HG3 ARG 116 2HG ARG 116 12.428 0.245 8.933 818 HD2 ARG 116 1HD ARG 116 13.684 -1.438 10.211 819 HD3 ARG 116 2HD ARG 116 12.178 -0.981 10.999 820 HE ARG 116 HE ARG 116 11.257 -3.095 10.358 821 HH11 ARG 116 1HH1 ARG 116 14.686 -2.778 9.745 822 HH12 ARG 116 2HH1 ARG 116 14.977 -4.485 9.791 823 HH21 ARG 116 1HH2 ARG 116 11.641 -5.341 10.434 824 HH22 ARG 116 2HH2 ARG 116 13.252 -5.941 10.181 825 H TRP 117 H TRP 117 8.477 -0.762 6.738 826 HA TRP 117 HA TRP 117 6.235 -1.282 8.364 827 HB2 TRP 117 1HB TRP 117 6.374 -0.204 5.545 828 HB3 TRP 117 2HB TRP 117 4.920 -0.215 6.536 829 HD1 TRP 117 HD1 TRP 117 7.398 2.118 5.492 830 HE1 TRP 117 HE1 TRP 117 7.699 4.060 7.151 831 HE3 TRP 117 HE3 TRP 117 5.086 0.065 9.563 832 HZ2 TRP 117 HZ2 TRP 117 7.042 4.642 9.835 833 HZ3 TRP 117 HZ3 TRP 117 4.968 1.382 11.638 834 HH2 TRP 117 HH2 TRP 117 5.926 3.621 11.770 835 H ILE 118 H ILE 118 7.312 -2.716 5.315 836 HA ILE 118 HA ILE 118 5.008 -4.216 4.768 837 HB ILE 118 HB ILE 118 7.888 -4.768 4.045 838 HG12 ILE 118 1HG1 ILE 118 5.590 -3.649 2.424 839 HG13 ILE 118 2HG1 ILE 118 6.864 -2.683 3.158 840 HG21 ILE 118 1HG2 ILE 118 6.623 -6.854 3.984 841 HG22 ILE 118 2HG2 ILE 118 7.025 -6.316 2.353 842 HG23 ILE 118 3HG2 ILE 118 5.392 -6.088 2.979 843 HD11 ILE 118 1HD1 ILE 118 7.257 -3.025 0.789 844 HD12 ILE 118 2HD1 ILE 118 7.247 -4.773 1.029 845 HD13 ILE 118 3HD1 ILE 118 8.517 -3.791 1.758 846 H LYS 119 H LYS 119 7.893 -5.055 6.671 847 HA LYS 119 HA LYS 119 7.076 -7.694 7.273 848 HB2 LYS 119 1HB LYS 119 8.947 -5.802 8.691 849 HB3 LYS 119 2HB LYS 119 8.679 -7.455 9.222 850 HG2 LYS 119 1HG LYS 119 9.468 -8.266 7.045 851 HG3 LYS 119 2HG LYS 119 9.780 -6.600 6.555 852 HD2 LYS 119 1HD LYS 119 11.421 -6.344 8.306 853 HD3 LYS 119 2HD LYS 119 11.036 -7.943 8.945 854 HE2 LYS 119 1HE LYS 119 11.815 -8.956 6.858 855 HE3 LYS 119 2HE LYS 119 12.211 -7.357 6.231 856 HZ1 LYS 119 1HZ LYS 119 14.147 -8.547 7.131 857 HZ2 LYS 119 2HZ LYS 119 13.427 -8.565 8.660 858 HZ3 LYS 119 3HZ LYS 119 13.856 -7.094 7.945 859 H GLU 120 H GLU 120 6.495 -4.599 8.851 860 HA GLU 120 HA GLU 120 5.233 -5.710 11.154 861 HB2 GLU 120 1HB GLU 120 5.143 -2.922 9.994 862 HB3 GLU 120 2HB GLU 120 4.449 -3.373 11.543 863 HG2 GLU 120 1HG GLU 120 7.353 -3.464 10.780 864 HG3 GLU 120 2HG GLU 120 6.581 -2.323 11.879 865 H PHE 121 H PHE 121 4.213 -5.021 7.962 866 HA PHE 121 HA PHE 121 1.396 -4.825 8.641 867 HB2 PHE 121 1HB PHE 121 2.201 -3.335 6.941 868 HB3 PHE 121 2HB PHE 121 2.918 -4.662 6.038 869 HD1 PHE 121 HD1 PHE 121 -0.336 -3.275 7.162 870 HD2 PHE 121 HD2 PHE 121 1.726 -5.734 4.365 871 HE1 PHE 121 HE1 PHE 121 -2.385 -3.464 5.816 872 HE2 PHE 121 HE2 PHE 121 -0.320 -5.925 3.019 873 HZ PHE 121 HZ PHE 121 -2.379 -4.792 3.744 874 H SER 122 H SER 122 3.647 -7.141 7.313 875 HA SER 122 HA SER 122 1.615 -8.895 6.317 876 HB2 SER 122 1HB SER 122 3.633 -10.502 6.167 877 HB3 SER 122 2HB SER 122 3.644 -9.059 5.155 878 HG SER 122 HG SER 122 5.170 -8.165 6.395 879 H GLU 123 H GLU 123 3.961 -9.195 8.996 880 HA GLU 123 HA GLU 123 2.148 -11.179 10.188 881 HB2 GLU 123 1HB GLU 123 4.226 -11.880 11.477 882 HB3 GLU 123 2HB GLU 123 4.212 -12.230 9.756 883 HG2 GLU 123 1HG GLU 123 5.537 -10.122 9.422 884 HG3 GLU 123 2HG GLU 123 5.702 -10.039 11.175 885 H GLU 124 H GLU 124 1.025 -9.078 10.829 886 HA GLU 124 HA GLU 124 2.245 -7.770 13.120 887 HB2 GLU 124 1HB GLU 124 0.123 -6.368 13.051 888 HB3 GLU 124 2HB GLU 124 1.219 -6.217 11.686 889 HG2 GLU 124 1HG GLU 124 -0.211 -7.716 10.382 890 HG3 GLU 124 2HG GLU 124 -1.317 -7.837 11.751 Start of MODEL 18 1 HA MET 21 HA MET 21 -8.369 -11.805 3.323 2 HB2 MET 21 1HB MET 21 -7.588 -9.763 4.280 3 HB3 MET 21 2HB MET 21 -8.146 -10.765 5.607 4 HG2 MET 21 1HG MET 21 -5.275 -10.361 4.802 5 HG3 MET 21 2HG MET 21 -6.087 -9.576 6.152 6 HE1 MET 21 1HE MET 21 -4.177 -10.369 7.813 7 HE2 MET 21 2HE MET 21 -3.338 -11.138 6.467 8 HE3 MET 21 3HE MET 21 -3.636 -12.043 7.950 9 H THR 22 H THR 22 -7.347 -10.916 1.567 10 HA THR 22 HA THR 22 -4.612 -11.792 1.046 11 HB THR 22 HB THR 22 -6.602 -10.364 -0.744 12 HG1 THR 22 HG1 THR 22 -7.021 -12.638 -0.075 13 HG21 THR 22 1HG2 THR 22 -4.295 -9.914 -1.421 14 HG22 THR 22 2HG2 THR 22 -5.084 -10.988 -2.577 15 HG23 THR 22 3HG2 THR 22 -3.942 -11.641 -1.402 16 H LEU 23 H LEU 23 -2.889 -10.382 0.907 17 HA LEU 23 HA LEU 23 -3.456 -7.717 1.993 18 HB2 LEU 23 1HB LEU 23 -0.905 -9.325 2.026 19 HB3 LEU 23 2HB LEU 23 -1.111 -7.738 2.742 20 HG LEU 23 HG LEU 23 -2.569 -10.240 3.598 21 HD11 LEU 23 1HD1 LEU 23 -0.339 -8.708 4.924 22 HD12 LEU 23 2HD1 LEU 23 -0.213 -10.307 4.191 23 HD13 LEU 23 3HD1 LEU 23 -1.213 -10.071 5.623 24 HD21 LEU 23 1HD2 LEU 23 -2.576 -7.453 4.749 25 HD22 LEU 23 2HD2 LEU 23 -3.337 -8.867 5.480 26 HD23 LEU 23 3HD2 LEU 23 -3.921 -8.252 3.934 27 H PHE 24 H PHE 24 -3.314 -6.060 0.713 28 HA PHE 24 HA PHE 24 -1.696 -6.258 -1.740 29 HB2 PHE 24 1HB PHE 24 -4.034 -4.427 -1.133 30 HB3 PHE 24 2HB PHE 24 -3.151 -4.495 -2.653 31 HD1 PHE 24 HD1 PHE 24 -5.475 -6.303 -0.448 32 HD2 PHE 24 HD2 PHE 24 -3.612 -6.172 -4.271 33 HE1 PHE 24 HE1 PHE 24 -7.038 -8.016 -1.263 34 HE2 PHE 24 HE2 PHE 24 -5.171 -7.885 -5.094 35 HZ PHE 24 HZ PHE 24 -6.888 -8.810 -3.589 36 H VAL 25 H VAL 25 -0.203 -4.680 -2.196 37 HA VAL 25 HA VAL 25 0.033 -2.506 -0.241 38 HB VAL 25 HB VAL 25 1.736 -4.059 0.405 39 HG11 VAL 25 1HG1 VAL 25 3.465 -4.873 -1.084 40 HG12 VAL 25 2HG1 VAL 25 2.733 -4.011 -2.434 41 HG13 VAL 25 3HG1 VAL 25 1.871 -5.346 -1.672 42 HG21 VAL 25 1HG2 VAL 25 2.373 -1.719 0.487 43 HG22 VAL 25 2HG2 VAL 25 2.960 -1.801 -1.173 44 HG23 VAL 25 3HG2 VAL 25 3.769 -2.723 0.093 45 H LEU 26 H LEU 26 0.092 -0.598 -1.085 46 HA LEU 26 HA LEU 26 0.604 -0.298 -3.973 47 HB2 LEU 26 1HB LEU 26 -0.959 1.550 -2.168 48 HB3 LEU 26 2HB LEU 26 -0.894 1.581 -3.920 49 HG LEU 26 HG LEU 26 -2.110 -0.665 -2.309 50 HD11 LEU 26 1HD1 LEU 26 -3.464 1.594 -3.768 51 HD12 LEU 26 2HD1 LEU 26 -3.378 1.396 -2.018 52 HD13 LEU 26 3HD1 LEU 26 -4.265 0.227 -2.995 53 HD21 LEU 26 1HD2 LEU 26 -3.083 -1.313 -4.467 54 HD22 LEU 26 2HD2 LEU 26 -1.321 -1.376 -4.479 55 HD23 LEU 26 3HD2 LEU 26 -2.161 -0.031 -5.251 56 H ILE 27 H ILE 27 1.679 1.782 -4.580 57 HA ILE 27 HA ILE 27 3.255 2.983 -2.454 58 HB ILE 27 HB ILE 27 4.572 1.032 -2.899 59 HG12 ILE 27 1HG1 ILE 27 5.799 3.419 -4.300 60 HG13 ILE 27 2HG1 ILE 27 5.824 3.121 -2.565 61 HG21 ILE 27 1HG2 ILE 27 4.490 1.812 -5.808 62 HG22 ILE 27 2HG2 ILE 27 3.651 0.448 -5.071 63 HG23 ILE 27 3HG2 ILE 27 5.415 0.474 -5.125 64 HD11 ILE 27 1HD1 ILE 27 7.130 1.410 -4.668 65 HD12 ILE 27 2HD1 ILE 27 7.162 1.116 -2.929 66 HD13 ILE 27 3HD1 ILE 27 7.945 2.548 -3.596 67 H LEU 28 H LEU 28 3.483 5.118 -2.841 68 HA LEU 28 HA LEU 28 3.929 5.918 -5.662 69 HB2 LEU 28 1HB LEU 28 2.859 7.614 -3.394 70 HB3 LEU 28 2HB LEU 28 3.250 8.207 -4.989 71 HG LEU 28 HG LEU 28 1.435 6.686 -5.880 72 HD11 LEU 28 1HD1 LEU 28 0.711 6.535 -2.962 73 HD12 LEU 28 2HD1 LEU 28 1.273 5.190 -3.956 74 HD13 LEU 28 3HD1 LEU 28 -0.268 5.968 -4.310 75 HD21 LEU 28 1HD2 LEU 28 0.664 8.854 -3.934 76 HD22 LEU 28 2HD2 LEU 28 -0.343 8.232 -5.241 77 HD23 LEU 28 3HD2 LEU 28 1.151 9.092 -5.612 78 H SER 29 H SER 29 6.129 5.240 -5.181 79 HA SER 29 HA SER 29 7.642 7.551 -4.300 80 HB2 SER 29 1HB SER 29 7.440 6.083 -2.284 81 HB3 SER 29 2HB SER 29 8.231 4.794 -3.187 82 HG SER 29 HG SER 29 9.822 6.793 -3.483 83 H ASN 30 H ASN 30 8.265 7.801 -6.533 84 HA ASN 30 HA ASN 30 9.317 5.425 -7.828 85 HB2 ASN 30 1HB ASN 30 8.988 8.274 -8.784 86 HB3 ASN 30 2HB ASN 30 9.693 6.997 -9.769 87 HD21 ASN 30 1HD2 ASN 30 7.265 8.606 -10.141 88 HD22 ASN 30 2HD2 ASN 30 5.979 7.465 -10.320 89 H ASP 31 H ASP 31 11.038 5.101 -6.362 90 HA ASP 31 HA ASP 31 13.436 6.489 -7.347 91 HB2 ASP 31 1HB ASP 31 12.904 5.193 -4.681 92 HB3 ASP 31 2HB ASP 31 14.545 5.394 -5.282 93 H LYS 32 H LYS 32 15.129 5.121 -8.101 94 HA LYS 32 HA LYS 32 14.155 2.690 -9.241 95 HB2 LYS 32 1HB LYS 32 16.995 3.722 -9.114 96 HB3 LYS 32 2HB LYS 32 16.416 2.424 -10.148 97 HG2 LYS 32 1HG LYS 32 15.684 5.339 -10.292 98 HG3 LYS 32 2HG LYS 32 16.622 4.407 -11.459 99 HD2 LYS 32 1HD LYS 32 13.704 4.004 -10.791 100 HD3 LYS 32 2HD LYS 32 14.341 4.762 -12.250 101 HE2 LYS 32 1HE LYS 32 15.428 2.657 -12.865 102 HE3 LYS 32 2HE LYS 32 14.792 1.902 -11.406 103 HZ1 LYS 32 1HZ LYS 32 13.197 2.981 -13.663 104 HZ2 LYS 32 2HZ LYS 32 12.544 2.351 -12.238 105 HZ3 LYS 32 3HZ LYS 32 13.419 1.349 -13.281 106 H LYS 33 H LYS 33 16.215 3.502 -6.519 107 HA LYS 33 HA LYS 33 16.899 0.787 -5.917 108 HB2 LYS 33 1HB LYS 33 18.390 2.552 -5.211 109 HB3 LYS 33 2HB LYS 33 17.106 3.331 -4.298 110 HG2 LYS 33 1HG LYS 33 18.522 2.216 -2.751 111 HG3 LYS 33 2HG LYS 33 17.013 1.307 -2.841 112 HD2 LYS 33 1HD LYS 33 18.664 -0.341 -2.893 113 HD3 LYS 33 2HD LYS 33 18.222 -0.137 -4.588 114 HE2 LYS 33 1HE LYS 33 20.629 -0.260 -4.374 115 HE3 LYS 33 2HE LYS 33 20.154 1.358 -4.890 116 HZ1 LYS 33 1HZ LYS 33 20.379 2.098 -2.588 117 HZ2 LYS 33 2HZ LYS 33 21.829 1.467 -3.176 118 HZ3 LYS 33 3HZ LYS 33 20.878 0.549 -2.125 119 H LEU 34 H LEU 34 14.618 3.147 -4.585 120 HA LEU 34 HA LEU 34 13.725 1.628 -2.423 121 HB2 LEU 34 1HB LEU 34 13.365 4.102 -2.887 122 HB3 LEU 34 2HB LEU 34 12.060 3.623 -3.949 123 HG LEU 34 HG LEU 34 11.583 4.367 -1.477 124 HD11 LEU 34 1HD1 LEU 34 9.899 3.611 -3.079 125 HD12 LEU 34 2HD1 LEU 34 9.580 3.027 -1.446 126 HD13 LEU 34 3HD1 LEU 34 10.262 1.938 -2.656 127 HD21 LEU 34 1HD2 LEU 34 13.114 2.769 -0.465 128 HD22 LEU 34 2HD2 LEU 34 12.157 1.440 -1.123 129 HD23 LEU 34 3HD2 LEU 34 11.453 2.526 0.075 130 H ILE 35 H ILE 35 12.372 1.925 -5.703 131 HA ILE 35 HA ILE 35 10.145 0.280 -5.307 132 HB ILE 35 HB ILE 35 11.709 0.949 -7.792 133 HG12 ILE 35 1HG1 ILE 35 8.984 1.785 -6.770 134 HG13 ILE 35 2HG1 ILE 35 10.444 2.769 -6.742 135 HG21 ILE 35 1HG2 ILE 35 9.891 -0.016 -9.111 136 HG22 ILE 35 2HG2 ILE 35 9.142 -0.626 -7.635 137 HG23 ILE 35 3HG2 ILE 35 10.714 -1.242 -8.148 138 HD11 ILE 35 1HD1 ILE 35 10.483 2.783 -9.180 139 HD12 ILE 35 2HD1 ILE 35 8.962 3.422 -8.553 140 HD13 ILE 35 3HD1 ILE 35 9.025 1.788 -9.211 141 H GLU 36 H GLU 36 13.461 -0.538 -6.255 142 HA GLU 36 HA GLU 36 13.034 -3.257 -6.797 143 HB2 GLU 36 1HB GLU 36 15.477 -1.820 -5.760 144 HB3 GLU 36 2HB GLU 36 15.473 -3.520 -6.203 145 HG2 GLU 36 1HG GLU 36 14.866 -1.216 -8.037 146 HG3 GLU 36 2HG GLU 36 16.372 -2.129 -7.977 147 H GLU 37 H GLU 37 14.417 -1.840 -3.815 148 HA GLU 37 HA GLU 37 14.389 -4.261 -2.399 149 HB2 GLU 37 1HB GLU 37 14.404 -1.431 -1.336 150 HB3 GLU 37 2HB GLU 37 14.723 -2.867 -0.371 151 HG2 GLU 37 1HG GLU 37 16.597 -3.367 -2.007 152 HG3 GLU 37 2HG GLU 37 16.367 -1.726 -2.606 153 H ALA 38 H ALA 38 11.954 -1.741 -2.709 154 HA ALA 38 HA ALA 38 10.244 -2.617 -0.650 155 HB1 ALA 38 1HB ALA 38 9.482 -1.235 -3.222 156 HB2 ALA 38 2HB ALA 38 10.007 -0.433 -1.742 157 HB3 ALA 38 3HB ALA 38 8.497 -1.345 -1.762 158 H ARG 39 H ARG 39 10.158 -3.334 -4.166 159 HA ARG 39 HA ARG 39 7.978 -5.137 -3.888 160 HB2 ARG 39 1HB ARG 39 8.609 -4.035 -6.049 161 HB3 ARG 39 2HB ARG 39 9.989 -5.125 -6.135 162 HG2 ARG 39 1HG ARG 39 8.096 -6.969 -5.789 163 HG3 ARG 39 2HG ARG 39 7.096 -5.691 -6.499 164 HD2 ARG 39 1HD ARG 39 9.549 -6.961 -7.697 165 HD3 ARG 39 2HD ARG 39 7.887 -7.096 -8.269 166 HE ARG 39 HE ARG 39 8.235 -4.480 -8.459 167 HH11 ARG 39 1HH1 ARG 39 10.345 -7.104 -9.398 168 HH12 ARG 39 2HH1 ARG 39 11.146 -6.189 -10.635 169 HH21 ARG 39 1HH2 ARG 39 9.278 -3.269 -10.094 170 HH22 ARG 39 2HH2 ARG 39 10.547 -4.002 -11.022 171 H LYS 40 H LYS 40 11.486 -5.544 -3.872 172 HA LYS 40 HA LYS 40 11.469 -8.344 -4.143 173 HB2 LYS 40 1HB LYS 40 13.483 -6.480 -2.891 174 HB3 LYS 40 2HB LYS 40 13.761 -8.208 -3.088 175 HG2 LYS 40 1HG LYS 40 13.606 -8.032 -5.465 176 HG3 LYS 40 2HG LYS 40 13.087 -6.353 -5.358 177 HD2 LYS 40 1HD LYS 40 15.280 -5.765 -4.397 178 HD3 LYS 40 2HD LYS 40 15.790 -7.446 -4.589 179 HE2 LYS 40 1HE LYS 40 15.484 -7.297 -6.986 180 HE3 LYS 40 2HE LYS 40 14.863 -5.657 -6.830 181 HZ1 LYS 40 1HZ LYS 40 17.179 -5.715 -7.541 182 HZ2 LYS 40 2HZ LYS 40 17.612 -6.506 -6.112 183 HZ3 LYS 40 3HZ LYS 40 17.007 -4.930 -6.055 184 H MET 41 H MET 41 11.178 -6.269 -1.308 185 HA MET 41 HA MET 41 11.111 -8.476 0.524 186 HB2 MET 41 1HB MET 41 10.407 -5.562 0.780 187 HB3 MET 41 2HB MET 41 10.117 -6.701 2.086 188 HG2 MET 41 1HG MET 41 12.772 -6.052 0.836 189 HG3 MET 41 2HG MET 41 12.192 -5.538 2.419 190 HE1 MET 41 1HE MET 41 14.397 -6.476 3.588 191 HE2 MET 41 2HE MET 41 14.995 -6.941 1.995 192 HE3 MET 41 3HE MET 41 15.016 -8.107 3.320 193 H ALA 42 H ALA 42 8.650 -6.369 -0.947 194 HA ALA 42 HA ALA 42 6.448 -7.577 0.341 195 HB1 ALA 42 1HB ALA 42 6.317 -5.383 -0.714 196 HB2 ALA 42 2HB ALA 42 5.069 -6.473 -1.318 197 HB3 ALA 42 3HB ALA 42 6.494 -6.135 -2.300 198 H GLU 43 H GLU 43 8.124 -8.317 -2.647 199 HA GLU 43 HA GLU 43 6.378 -10.254 -3.675 200 HB2 GLU 43 1HB GLU 43 8.223 -9.308 -4.976 201 HB3 GLU 43 2HB GLU 43 9.387 -10.059 -3.895 202 HG2 GLU 43 1HG GLU 43 8.603 -12.265 -4.599 203 HG3 GLU 43 2HG GLU 43 7.460 -11.499 -5.701 204 H LYS 44 H LYS 44 9.142 -10.414 -1.524 205 HA LYS 44 HA LYS 44 9.122 -13.184 -0.999 206 HB2 LYS 44 1HB LYS 44 11.009 -11.586 -0.565 207 HB3 LYS 44 2HB LYS 44 10.089 -10.939 0.783 208 HG2 LYS 44 1HG LYS 44 11.693 -12.442 1.660 209 HG3 LYS 44 2HG LYS 44 10.115 -13.220 1.792 210 HD2 LYS 44 1HD LYS 44 10.566 -14.554 -0.171 211 HD3 LYS 44 2HD LYS 44 12.093 -13.706 -0.428 212 HE2 LYS 44 1HE LYS 44 12.436 -15.895 0.613 213 HE3 LYS 44 2HE LYS 44 12.957 -14.581 1.665 214 HZ1 LYS 44 1HZ LYS 44 10.369 -16.017 1.878 215 HZ2 LYS 44 2HZ LYS 44 10.910 -14.794 2.908 216 HZ3 LYS 44 3HZ LYS 44 11.714 -16.279 2.865 217 H ALA 45 H ALA 45 7.554 -10.419 0.489 218 HA ALA 45 HA ALA 45 6.449 -11.916 2.674 219 HB1 ALA 45 1HB ALA 45 5.855 -9.120 1.734 220 HB2 ALA 45 2HB ALA 45 7.066 -9.572 2.934 221 HB3 ALA 45 3HB ALA 45 5.353 -9.824 3.270 222 H ASN 46 H ASN 46 5.753 -11.968 -0.459 223 HA ASN 46 HA ASN 46 4.032 -12.640 -1.750 224 HB2 ASN 46 1HB ASN 46 2.947 -13.657 0.880 225 HB3 ASN 46 2HB ASN 46 2.286 -14.069 -0.697 226 HD21 ASN 46 1HD2 ASN 46 5.033 -14.120 -1.871 227 HD22 ASN 46 2HD2 ASN 46 5.708 -15.625 -1.348 228 H LEU 47 H LEU 47 3.985 -9.974 -0.858 229 HA LEU 47 HA LEU 47 1.131 -9.405 -0.520 230 HB2 LEU 47 1HB LEU 47 3.441 -7.467 -0.633 231 HB3 LEU 47 2HB LEU 47 1.800 -7.116 -0.140 232 HG LEU 47 HG LEU 47 3.776 -8.838 1.356 233 HD11 LEU 47 1HD1 LEU 47 2.605 -6.143 2.018 234 HD12 LEU 47 2HD1 LEU 47 4.241 -6.431 1.436 235 HD13 LEU 47 3HD1 LEU 47 3.740 -7.062 3.003 236 HD21 LEU 47 1HD2 LEU 47 2.078 -8.890 3.124 237 HD22 LEU 47 2HD2 LEU 47 1.519 -9.681 1.651 238 HD23 LEU 47 3HD2 LEU 47 0.947 -8.062 2.053 239 H ILE 48 H ILE 48 -0.071 -8.411 -2.106 240 HA ILE 48 HA ILE 48 1.030 -8.496 -4.781 241 HB ILE 48 HB ILE 48 -1.715 -7.615 -3.863 242 HG12 ILE 48 1HG1 ILE 48 -0.766 -10.261 -4.991 243 HG13 ILE 48 2HG1 ILE 48 -1.251 -9.969 -3.325 244 HG21 ILE 48 1HG2 ILE 48 -2.365 -7.930 -6.209 245 HG22 ILE 48 2HG2 ILE 48 -0.688 -8.294 -6.620 246 HG23 ILE 48 3HG2 ILE 48 -1.125 -6.687 -6.038 247 HD11 ILE 48 1HD1 ILE 48 -3.519 -9.476 -4.072 248 HD12 ILE 48 2HD1 ILE 48 -3.004 -11.084 -4.576 249 HD13 ILE 48 3HD1 ILE 48 -3.031 -9.763 -5.743 250 H LEU 49 H LEU 49 2.429 -6.888 -5.186 251 HA LEU 49 HA LEU 49 1.911 -4.206 -4.199 252 HB2 LEU 49 1HB LEU 49 4.187 -5.088 -4.069 253 HB3 LEU 49 2HB LEU 49 4.213 -5.320 -5.807 254 HG LEU 49 HG LEU 49 3.916 -2.816 -6.037 255 HD11 LEU 49 1HD1 LEU 49 3.070 -2.330 -3.823 256 HD12 LEU 49 2HD1 LEU 49 4.571 -1.450 -4.111 257 HD13 LEU 49 3HD1 LEU 49 4.576 -2.895 -3.100 258 HD21 LEU 49 1HD2 LEU 49 6.398 -3.849 -4.681 259 HD22 LEU 49 2HD2 LEU 49 6.278 -2.339 -5.582 260 HD23 LEU 49 3HD2 LEU 49 6.054 -3.879 -6.411 261 H ILE 50 H ILE 50 0.936 -2.688 -5.319 262 HA ILE 50 HA ILE 50 0.974 -2.872 -8.263 263 HB ILE 50 HB ILE 50 -1.079 -1.435 -6.564 264 HG12 ILE 50 1HG1 ILE 50 -1.346 -4.026 -8.115 265 HG13 ILE 50 2HG1 ILE 50 -1.231 -3.904 -6.362 266 HG21 ILE 50 1HG2 ILE 50 -0.734 -0.409 -8.747 267 HG22 ILE 50 2HG2 ILE 50 -2.312 -1.194 -8.667 268 HG23 ILE 50 3HG2 ILE 50 -0.983 -1.969 -9.531 269 HD11 ILE 50 1HD1 ILE 50 -3.330 -2.654 -6.317 270 HD12 ILE 50 2HD1 ILE 50 -3.524 -4.238 -7.068 271 HD13 ILE 50 3HD1 ILE 50 -3.444 -2.790 -8.071 272 H THR 51 H THR 51 2.700 -1.666 -8.791 273 HA THR 51 HA THR 51 3.461 0.669 -7.304 274 HB THR 51 HB THR 51 4.569 -0.171 -9.984 275 HG1 THR 51 HG1 THR 51 4.546 -1.915 -8.366 276 HG21 THR 51 1HG2 THR 51 6.618 0.877 -9.146 277 HG22 THR 51 2HG2 THR 51 5.799 1.281 -7.637 278 HG23 THR 51 3HG2 THR 51 5.277 2.023 -9.149 279 H VAL 52 H VAL 52 2.802 2.687 -7.644 280 HA VAL 52 HA VAL 52 1.683 3.403 -10.265 281 HB VAL 52 HB VAL 52 -0.055 4.768 -9.056 282 HG11 VAL 52 1HG1 VAL 52 -1.575 2.908 -8.728 283 HG12 VAL 52 2HG1 VAL 52 -0.216 1.784 -8.680 284 HG13 VAL 52 3HG1 VAL 52 -0.589 2.655 -10.167 285 HG21 VAL 52 1HG2 VAL 52 -0.647 4.099 -6.774 286 HG22 VAL 52 2HG2 VAL 52 0.969 4.801 -6.849 287 HG23 VAL 52 3HG2 VAL 52 0.772 3.054 -6.717 288 H GLY 53 H GLY 53 1.090 5.944 -10.016 289 HA2 GLY 53 1HA GLY 53 3.133 7.361 -8.514 290 HA3 GLY 53 2HA GLY 53 3.250 7.467 -10.265 291 H ASP 54 H ASP 54 1.592 8.455 -7.453 292 HA ASP 54 HA ASP 54 0.804 10.627 -7.155 293 HB2 ASP 54 1HB ASP 54 1.242 11.436 -9.398 294 HB3 ASP 54 2HB ASP 54 -0.095 10.489 -10.040 295 H GLU 55 H GLU 55 -1.394 11.427 -6.696 296 HA GLU 55 HA GLU 55 -2.797 9.439 -5.393 297 HB2 GLU 55 1HB GLU 55 -3.794 12.140 -6.293 298 HB3 GLU 55 2HB GLU 55 -4.590 11.118 -5.104 299 HG2 GLU 55 1HG GLU 55 -2.639 11.278 -3.649 300 HG3 GLU 55 2HG GLU 55 -1.831 12.291 -4.844 301 H GLU 56 H GLU 56 -3.598 10.981 -8.492 302 HA GLU 56 HA GLU 56 -6.052 9.672 -8.883 303 HB2 GLU 56 1HB GLU 56 -4.098 10.692 -10.949 304 HB3 GLU 56 2HB GLU 56 -5.779 10.279 -11.254 305 HG2 GLU 56 1HG GLU 56 -4.834 12.437 -9.382 306 HG3 GLU 56 2HG GLU 56 -5.425 12.693 -11.024 307 H GLU 57 H GLU 57 -2.757 8.736 -9.600 308 HA GLU 57 HA GLU 57 -3.471 6.357 -11.015 309 HB2 GLU 57 1HB GLU 57 -0.970 7.642 -10.117 310 HB3 GLU 57 2HB GLU 57 -0.922 5.896 -10.293 311 HG2 GLU 57 1HG GLU 57 -0.187 7.175 -12.296 312 HG3 GLU 57 2HG GLU 57 -1.479 6.017 -12.588 313 H LEU 58 H LEU 58 -2.915 7.217 -7.698 314 HA LEU 58 HA LEU 58 -2.653 4.528 -6.767 315 HB2 LEU 58 1HB LEU 58 -1.774 6.383 -5.450 316 HB3 LEU 58 2HB LEU 58 -3.387 7.046 -5.273 317 HG LEU 58 HG LEU 58 -4.059 5.029 -4.012 318 HD11 LEU 58 1HD1 LEU 58 -1.151 4.291 -4.241 319 HD12 LEU 58 2HD1 LEU 58 -2.518 3.424 -4.936 320 HD13 LEU 58 3HD1 LEU 58 -2.323 3.504 -3.186 321 HD21 LEU 58 1HD2 LEU 58 -1.682 6.527 -2.935 322 HD22 LEU 58 2HD2 LEU 58 -2.748 5.508 -1.967 323 HD23 LEU 58 3HD2 LEU 58 -3.383 6.956 -2.754 324 H LYS 59 H LYS 59 -5.311 6.768 -7.238 325 HA LYS 59 HA LYS 59 -7.216 5.486 -5.699 326 HB2 LYS 59 1HB LYS 59 -7.528 7.168 -8.159 327 HB3 LYS 59 2HB LYS 59 -8.895 6.617 -7.196 328 HG2 LYS 59 1HG LYS 59 -8.093 7.829 -5.279 329 HG3 LYS 59 2HG LYS 59 -6.620 8.284 -6.140 330 HD2 LYS 59 1HD LYS 59 -7.936 9.565 -7.739 331 HD3 LYS 59 2HD LYS 59 -9.424 9.079 -6.922 332 HE2 LYS 59 1HE LYS 59 -8.742 10.242 -4.913 333 HE3 LYS 59 2HE LYS 59 -7.189 10.650 -5.645 334 HZ1 LYS 59 1HZ LYS 59 -8.307 12.001 -7.265 335 HZ2 LYS 59 2HZ LYS 59 -8.785 12.487 -5.712 336 HZ3 LYS 59 3HZ LYS 59 -9.827 11.552 -6.660 337 H LYS 60 H LYS 60 -6.818 5.214 -9.165 338 HA LYS 60 HA LYS 60 -8.514 3.083 -9.641 339 HB2 LYS 60 1HB LYS 60 -6.967 2.641 -11.597 340 HB3 LYS 60 2HB LYS 60 -7.588 4.285 -11.463 341 HG2 LYS 60 1HG LYS 60 -5.454 4.854 -10.229 342 HG3 LYS 60 2HG LYS 60 -4.855 3.275 -10.761 343 HD2 LYS 60 1HD LYS 60 -4.096 4.978 -12.310 344 HD3 LYS 60 2HD LYS 60 -5.248 3.912 -13.111 345 HE2 LYS 60 1HE LYS 60 -6.999 5.550 -12.883 346 HE3 LYS 60 2HE LYS 60 -5.955 6.588 -11.913 347 HZ1 LYS 60 1HZ LYS 60 -4.529 6.909 -13.819 348 HZ2 LYS 60 2HZ LYS 60 -6.119 7.336 -14.214 349 HZ3 LYS 60 3HZ LYS 60 -5.484 5.867 -14.755 350 H ALA 61 H ALA 61 -5.277 3.067 -8.268 351 HA ALA 61 HA ALA 61 -4.883 0.244 -8.519 352 HB1 ALA 61 1HB ALA 61 -3.480 2.246 -6.755 353 HB2 ALA 61 2HB ALA 61 -2.983 1.742 -8.369 354 HB3 ALA 61 3HB ALA 61 -2.959 0.585 -7.042 355 H ILE 62 H ILE 62 -5.814 2.387 -5.828 356 HA ILE 62 HA ILE 62 -6.185 0.375 -3.896 357 HB ILE 62 HB ILE 62 -7.917 2.847 -4.061 358 HG12 ILE 62 1HG1 ILE 62 -5.164 2.647 -2.818 359 HG13 ILE 62 2HG1 ILE 62 -5.521 3.484 -4.326 360 HG21 ILE 62 1HG2 ILE 62 -6.871 1.254 -1.723 361 HG22 ILE 62 2HG2 ILE 62 -8.503 1.165 -2.383 362 HG23 ILE 62 3HG2 ILE 62 -7.937 2.658 -1.633 363 HD11 ILE 62 1HD1 ILE 62 -5.332 5.023 -2.443 364 HD12 ILE 62 2HD1 ILE 62 -6.652 4.185 -1.628 365 HD13 ILE 62 3HD1 ILE 62 -6.952 5.044 -3.140 366 H LYS 63 H LYS 63 -8.330 1.754 -6.319 367 HA LYS 63 HA LYS 63 -10.669 0.345 -5.700 368 HB2 LYS 63 1HB LYS 63 -10.568 2.268 -7.239 369 HB3 LYS 63 2HB LYS 63 -9.672 1.294 -8.394 370 HG2 LYS 63 1HG LYS 63 -11.573 -0.141 -8.736 371 HG3 LYS 63 2HG LYS 63 -12.472 0.692 -7.467 372 HD2 LYS 63 1HD LYS 63 -13.210 1.484 -9.630 373 HD3 LYS 63 2HD LYS 63 -12.346 2.777 -8.794 374 HE2 LYS 63 1HE LYS 63 -10.320 2.205 -10.088 375 HE3 LYS 63 2HE LYS 63 -11.249 0.992 -10.964 376 HZ1 LYS 63 1HZ LYS 63 -11.724 3.924 -10.968 377 HZ2 LYS 63 2HZ LYS 63 -12.717 2.790 -11.734 378 HZ3 LYS 63 3HZ LYS 63 -11.121 2.996 -12.249 379 H LYS 64 H LYS 64 -7.930 -0.484 -7.786 380 HA LYS 64 HA LYS 64 -9.000 -2.951 -8.694 381 HB2 LYS 64 1HB LYS 64 -7.272 -1.876 -9.975 382 HB3 LYS 64 2HB LYS 64 -6.167 -1.909 -8.608 383 HG2 LYS 64 1HG LYS 64 -6.010 -4.308 -8.729 384 HG3 LYS 64 2HG LYS 64 -7.238 -4.359 -9.992 385 HD2 LYS 64 1HD LYS 64 -4.617 -2.904 -10.285 386 HD3 LYS 64 2HD LYS 64 -4.858 -4.579 -10.781 387 HE2 LYS 64 1HE LYS 64 -6.431 -2.215 -11.800 388 HE3 LYS 64 2HE LYS 64 -5.099 -2.995 -12.651 389 HZ1 LYS 64 1HZ LYS 64 -7.226 -3.784 -13.452 390 HZ2 LYS 64 2HZ LYS 64 -7.667 -4.282 -11.901 391 HZ3 LYS 64 3HZ LYS 64 -6.385 -5.045 -12.700 392 H ALA 65 H ALA 65 -6.928 -2.052 -5.982 393 HA ALA 65 HA ALA 65 -6.218 -4.613 -5.117 394 HB1 ALA 65 1HB ALA 65 -5.202 -2.574 -4.231 395 HB2 ALA 65 2HB ALA 65 -5.831 -3.587 -2.932 396 HB3 ALA 65 3HB ALA 65 -6.722 -2.154 -3.442 397 H ASP 66 H ASP 66 -8.956 -2.574 -4.109 398 HA ASP 66 HA ASP 66 -10.220 -4.560 -2.535 399 HB2 ASP 66 1HB ASP 66 -10.831 -2.294 -2.146 400 HB3 ASP 66 2HB ASP 66 -11.221 -2.032 -3.842 401 H ASP 67 H ASP 67 -10.321 -3.751 -5.920 402 HA ASP 67 HA ASP 67 -12.592 -5.181 -6.720 403 HB2 ASP 67 1HB ASP 67 -11.380 -3.572 -8.156 404 HB3 ASP 67 2HB ASP 67 -10.036 -4.701 -8.268 405 H ILE 68 H ILE 68 -9.175 -6.171 -6.684 406 HA ILE 68 HA ILE 68 -9.678 -8.863 -7.448 407 HB ILE 68 HB ILE 68 -7.297 -7.748 -5.950 408 HG12 ILE 68 1HG1 ILE 68 -7.663 -8.189 -8.922 409 HG13 ILE 68 2HG1 ILE 68 -7.739 -6.621 -8.125 410 HG21 ILE 68 1HG2 ILE 68 -7.459 -10.180 -5.798 411 HG22 ILE 68 2HG2 ILE 68 -6.099 -9.700 -6.813 412 HG23 ILE 68 3HG2 ILE 68 -7.587 -10.289 -7.553 413 HD11 ILE 68 1HD1 ILE 68 -5.585 -6.961 -9.182 414 HD12 ILE 68 2HD1 ILE 68 -5.337 -8.433 -8.244 415 HD13 ILE 68 3HD1 ILE 68 -5.408 -6.870 -7.432 416 H ALA 69 H ALA 69 -9.432 -7.187 -4.379 417 HA ALA 69 HA ALA 69 -9.278 -9.387 -2.670 418 HB1 ALA 69 1HB ALA 69 -8.874 -7.076 -1.952 419 HB2 ALA 69 2HB ALA 69 -10.061 -7.881 -0.924 420 HB3 ALA 69 3HB ALA 69 -10.592 -6.724 -2.144 421 H LYS 70 H LYS 70 -12.180 -7.465 -3.467 422 HA LYS 70 HA LYS 70 -13.919 -9.356 -2.220 423 HB2 LYS 70 1HB LYS 70 -14.363 -6.962 -3.958 424 HB3 LYS 70 2HB LYS 70 -15.674 -8.040 -3.509 425 HG2 LYS 70 1HG LYS 70 -15.363 -7.557 -1.186 426 HG3 LYS 70 2HG LYS 70 -13.888 -6.651 -1.527 427 HD2 LYS 70 1HD LYS 70 -15.150 -4.964 -2.701 428 HD3 LYS 70 2HD LYS 70 -16.634 -5.901 -2.518 429 HE2 LYS 70 1HE LYS 70 -16.455 -4.042 -0.899 430 HE3 LYS 70 2HE LYS 70 -16.572 -5.623 -0.130 431 HZ1 LYS 70 1HZ LYS 70 -14.000 -4.207 -0.602 432 HZ2 LYS 70 2HZ LYS 70 -14.259 -5.599 0.339 433 HZ3 LYS 70 3HZ LYS 70 -14.884 -4.109 0.847 434 H LYS 71 H LYS 71 -12.405 -9.330 -5.211 435 HA LYS 71 HA LYS 71 -14.323 -10.188 -6.987 436 HB2 LYS 71 1HB LYS 71 -11.918 -9.648 -7.496 437 HB3 LYS 71 2HB LYS 71 -11.493 -11.235 -6.879 438 HG2 LYS 71 1HG LYS 71 -11.598 -11.228 -9.306 439 HG3 LYS 71 2HG LYS 71 -12.824 -12.291 -8.618 440 HD2 LYS 71 1HD LYS 71 -13.678 -10.938 -10.500 441 HD3 LYS 71 2HD LYS 71 -14.539 -10.627 -8.995 442 HE2 LYS 71 1HE LYS 71 -14.082 -8.554 -10.199 443 HE3 LYS 71 2HE LYS 71 -13.232 -8.595 -8.658 444 HZ1 LYS 71 1HZ LYS 71 -11.764 -7.762 -10.315 445 HZ2 LYS 71 2HZ LYS 71 -12.073 -9.073 -11.344 446 HZ3 LYS 71 3HZ LYS 71 -11.234 -9.315 -9.899 447 H GLN 72 H GLN 72 -12.474 -12.111 -4.640 448 HA GLN 72 HA GLN 72 -14.398 -14.258 -5.179 449 HB2 GLN 72 1HB GLN 72 -12.517 -15.936 -4.889 450 HB3 GLN 72 2HB GLN 72 -12.564 -15.037 -6.398 451 HG2 GLN 72 1HG GLN 72 -10.821 -13.550 -5.581 452 HG3 GLN 72 2HG GLN 72 -10.783 -14.421 -4.052 453 HE21 GLN 72 1HE2 GLN 72 -8.656 -13.986 -5.953 454 HE22 GLN 72 2HE2 GLN 72 -8.104 -15.549 -6.434 455 H ASN 73 H ASN 73 -11.707 -13.565 -2.871 456 HA ASN 73 HA ASN 73 -13.423 -14.815 -0.820 457 HB2 ASN 73 1HB ASN 73 -11.518 -16.246 -1.530 458 HB3 ASN 73 2HB ASN 73 -10.412 -14.999 -0.965 459 HD21 ASN 73 1HD2 ASN 73 -9.482 -16.361 0.542 460 HD22 ASN 73 2HD2 ASN 73 -10.300 -16.855 1.983 461 H SER 74 H SER 74 -11.040 -12.363 -1.464 462 HA SER 74 HA SER 74 -10.556 -11.804 1.305 463 HB2 SER 74 1HB SER 74 -8.765 -11.806 -0.409 464 HB3 SER 74 2HB SER 74 -9.496 -10.375 -1.127 465 HG SER 74 HG SER 74 -9.235 -9.383 0.988 466 H SER 75 H SER 75 -13.258 -11.184 0.269 467 HA SER 75 HA SER 75 -13.762 -8.635 -0.516 468 HB2 SER 75 1HB SER 75 -15.414 -10.250 1.430 469 HB3 SER 75 2HB SER 75 -15.998 -8.905 0.452 470 HG SER 75 HG SER 75 -16.301 -10.284 -1.088 471 H GLU 76 H GLU 76 -12.976 -9.592 2.814 472 HA GLU 76 HA GLU 76 -12.842 -6.703 3.387 473 HB2 GLU 76 1HB GLU 76 -14.302 -8.003 4.950 474 HB3 GLU 76 2HB GLU 76 -12.897 -8.958 5.406 475 HG2 GLU 76 1HG GLU 76 -11.795 -6.956 6.250 476 HG3 GLU 76 2HG GLU 76 -13.187 -5.985 5.779 477 H ALA 77 H ALA 77 -10.850 -6.139 2.741 478 HA ALA 77 HA ALA 77 -8.624 -7.956 3.370 479 HB1 ALA 77 1HB ALA 77 -9.095 -7.693 0.971 480 HB2 ALA 77 2HB ALA 77 -7.497 -7.094 1.410 481 HB3 ALA 77 3HB ALA 77 -8.815 -5.959 1.122 482 H LYS 78 H LYS 78 -6.517 -6.927 3.594 483 HA LYS 78 HA LYS 78 -6.666 -4.259 4.830 484 HB2 LYS 78 1HB LYS 78 -4.652 -6.472 5.319 485 HB3 LYS 78 2HB LYS 78 -4.643 -4.895 6.093 486 HG2 LYS 78 1HG LYS 78 -6.711 -5.388 7.229 487 HG3 LYS 78 2HG LYS 78 -6.852 -6.924 6.368 488 HD2 LYS 78 1HD LYS 78 -4.763 -7.684 7.420 489 HD3 LYS 78 2HD LYS 78 -4.668 -6.162 8.307 490 HE2 LYS 78 1HE LYS 78 -6.948 -8.123 8.510 491 HE3 LYS 78 2HE LYS 78 -5.596 -8.046 9.636 492 HZ1 LYS 78 1HZ LYS 78 -7.447 -6.848 10.529 493 HZ2 LYS 78 2HZ LYS 78 -7.604 -5.911 9.128 494 HZ3 LYS 78 3HZ LYS 78 -6.240 -5.734 10.122 495 H ILE 79 H ILE 79 -5.369 -2.689 3.965 496 HA ILE 79 HA ILE 79 -3.614 -3.510 1.747 497 HB ILE 79 HB ILE 79 -5.529 -1.167 1.682 498 HG12 ILE 79 1HG1 ILE 79 -5.601 -3.753 0.110 499 HG13 ILE 79 2HG1 ILE 79 -6.650 -3.372 1.476 500 HG21 ILE 79 1HG2 ILE 79 -4.833 -0.942 -0.663 501 HG22 ILE 79 2HG2 ILE 79 -3.658 -2.237 -0.430 502 HG23 ILE 79 3HG2 ILE 79 -3.481 -0.717 0.447 503 HD11 ILE 79 1HD1 ILE 79 -7.600 -1.509 0.221 504 HD12 ILE 79 2HD1 ILE 79 -7.793 -3.038 -0.635 505 HD13 ILE 79 3HD1 ILE 79 -6.551 -1.893 -1.143 506 H LEU 80 H LEU 80 -1.729 -2.386 1.537 507 HA LEU 80 HA LEU 80 -1.186 -0.304 3.560 508 HB2 LEU 80 1HB LEU 80 0.148 -2.634 3.177 509 HB3 LEU 80 2HB LEU 80 1.033 -1.597 2.071 510 HG LEU 80 HG LEU 80 0.755 -1.265 5.059 511 HD11 LEU 80 1HD1 LEU 80 2.365 -2.943 4.317 512 HD12 LEU 80 2HD1 LEU 80 3.171 -1.552 5.044 513 HD13 LEU 80 3HD1 LEU 80 3.148 -1.741 3.291 514 HD21 LEU 80 1HD2 LEU 80 2.068 0.580 3.069 515 HD22 LEU 80 2HD2 LEU 80 2.231 0.690 4.821 516 HD23 LEU 80 3HD2 LEU 80 0.658 0.940 4.065 517 H ILE 81 H ILE 81 -0.647 1.718 2.829 518 HA ILE 81 HA ILE 81 -0.014 1.983 -0.040 519 HB ILE 81 HB ILE 81 -1.492 3.937 1.735 520 HG12 ILE 81 1HG1 ILE 81 -2.325 2.663 -0.879 521 HG13 ILE 81 2HG1 ILE 81 -2.773 2.034 0.696 522 HG21 ILE 81 1HG2 ILE 81 0.131 5.103 0.307 523 HG22 ILE 81 2HG2 ILE 81 -1.530 5.461 -0.152 524 HG23 ILE 81 3HG2 ILE 81 -0.574 4.331 -1.112 525 HD11 ILE 81 1HD1 ILE 81 -3.479 4.778 -0.300 526 HD12 ILE 81 2HD1 ILE 81 -4.024 4.022 1.197 527 HD13 ILE 81 3HD1 ILE 81 -4.544 3.375 -0.359 528 H LEU 82 H LEU 82 2.150 2.053 -0.051 529 HA LEU 82 HA LEU 82 3.586 3.710 1.883 530 HB2 LEU 82 1HB LEU 82 4.531 1.806 -0.259 531 HB3 LEU 82 2HB LEU 82 5.611 2.750 0.747 532 HG LEU 82 HG LEU 82 3.659 0.707 1.805 533 HD11 LEU 82 1HD1 LEU 82 5.364 -0.363 0.437 534 HD12 LEU 82 2HD1 LEU 82 5.620 -0.711 2.147 535 HD13 LEU 82 3HD1 LEU 82 6.627 0.484 1.329 536 HD21 LEU 82 1HD2 LEU 82 5.964 2.137 3.123 537 HD22 LEU 82 2HD2 LEU 82 4.924 0.924 3.870 538 HD23 LEU 82 3HD2 LEU 82 4.256 2.483 3.388 539 H LEU 83 H LEU 83 3.429 5.822 1.316 540 HA LEU 83 HA LEU 83 4.320 6.503 -1.406 541 HB2 LEU 83 1HB LEU 83 2.794 8.589 -1.037 542 HB3 LEU 83 2HB LEU 83 2.116 7.085 -1.625 543 HG LEU 83 HG LEU 83 1.348 6.577 0.690 544 HD11 LEU 83 1HD1 LEU 83 1.302 8.364 2.343 545 HD12 LEU 83 2HD1 LEU 83 2.255 9.384 1.268 546 HD13 LEU 83 3HD1 LEU 83 2.954 7.908 1.929 547 HD21 LEU 83 1HD2 LEU 83 -0.491 8.189 0.684 548 HD22 LEU 83 2HD2 LEU 83 -0.161 7.574 -0.936 549 HD23 LEU 83 3HD2 LEU 83 0.388 9.185 -0.474 550 H GLU 84 H GLU 84 5.442 8.538 -1.615 551 HA GLU 84 HA GLU 84 6.547 9.474 0.934 552 HB2 GLU 84 1HB GLU 84 8.053 8.915 -1.028 553 HB3 GLU 84 2HB GLU 84 7.351 10.284 -1.873 554 HG2 GLU 84 1HG GLU 84 8.632 10.653 0.802 555 HG3 GLU 84 2HG GLU 84 9.613 10.551 -0.656 556 H LYS 85 H LYS 85 5.129 10.753 1.829 557 HA LYS 85 HA LYS 85 4.529 13.352 0.864 558 HB2 LYS 85 1HB LYS 85 2.348 11.260 0.782 559 HB3 LYS 85 2HB LYS 85 1.970 12.948 1.056 560 HG2 LYS 85 1HG LYS 85 2.912 13.520 -1.118 561 HG3 LYS 85 2HG LYS 85 3.323 11.825 -1.388 562 HD2 LYS 85 1HD LYS 85 0.940 11.238 -1.220 563 HD3 LYS 85 2HD LYS 85 0.547 12.943 -1.000 564 HE2 LYS 85 1HE LYS 85 1.887 11.748 -3.424 565 HE3 LYS 85 2HE LYS 85 0.185 12.195 -3.311 566 HZ1 LYS 85 1HZ LYS 85 0.918 14.499 -2.875 567 HZ2 LYS 85 2HZ LYS 85 1.368 13.933 -4.401 568 HZ3 LYS 85 3HZ LYS 85 2.516 14.026 -3.165 569 HA PRO 86 HA PRO 86 3.633 13.476 5.311 570 HB2 PRO 86 1HB PRO 86 2.362 16.064 4.966 571 HB3 PRO 86 2HB PRO 86 3.899 15.694 5.748 572 HG2 PRO 86 1HG PRO 86 3.696 17.074 3.399 573 HG3 PRO 86 2HG PRO 86 5.110 16.108 3.853 574 HD2 PRO 86 1HD PRO 86 2.859 15.421 2.003 575 HD3 PRO 86 2HD PRO 86 4.597 15.075 1.848 576 H VAL 87 H VAL 87 1.917 12.318 6.048 577 HA VAL 87 HA VAL 87 -0.722 12.920 4.887 578 HB VAL 87 HB VAL 87 -1.288 10.500 5.096 579 HG11 VAL 87 1HG1 VAL 87 -0.098 9.813 3.071 580 HG12 VAL 87 2HG1 VAL 87 1.020 11.162 3.272 581 HG13 VAL 87 3HG1 VAL 87 -0.686 11.471 2.947 582 HG21 VAL 87 1HG2 VAL 87 0.539 8.872 5.259 583 HG22 VAL 87 2HG2 VAL 87 0.403 9.846 6.723 584 HG23 VAL 87 3HG2 VAL 87 1.679 10.186 5.553 585 H SER 88 H SER 88 -2.427 13.032 6.216 586 HA SER 88 HA SER 88 -1.930 12.683 9.083 587 HB2 SER 88 1HB SER 88 -3.974 14.049 9.376 588 HB3 SER 88 2HB SER 88 -2.773 14.881 8.388 589 HG SER 88 HG SER 88 -4.510 15.106 7.160 590 HA PRO 89 HA PRO 89 -4.658 9.142 9.504 591 HB2 PRO 89 1HB PRO 89 -6.131 10.719 11.553 592 HB3 PRO 89 2HB PRO 89 -5.424 9.104 11.671 593 HG2 PRO 89 1HG PRO 89 -4.253 11.192 12.840 594 HG3 PRO 89 2HG PRO 89 -3.291 9.922 12.063 595 HD2 PRO 89 1HD PRO 89 -3.934 12.671 11.096 596 HD3 PRO 89 2HD PRO 89 -2.444 11.728 10.908 597 H GLU 90 H GLU 90 -6.024 12.380 9.384 598 HA GLU 90 HA GLU 90 -8.664 11.744 8.689 599 HB2 GLU 90 1HB GLU 90 -7.971 13.984 9.381 600 HB3 GLU 90 2HB GLU 90 -6.999 14.149 7.926 601 HG2 GLU 90 1HG GLU 90 -9.057 13.982 6.576 602 HG3 GLU 90 2HG GLU 90 -9.995 13.925 8.068 603 H TYR 91 H TYR 91 -5.840 12.438 6.639 604 HA TYR 91 HA TYR 91 -7.185 12.086 4.181 605 HB2 TYR 91 1HB TYR 91 -5.046 13.275 4.343 606 HB3 TYR 91 2HB TYR 91 -4.242 11.783 4.820 607 HD1 TYR 91 HD1 TYR 91 -3.091 10.644 3.177 608 HD2 TYR 91 HD2 TYR 91 -6.413 13.050 2.047 609 HE1 TYR 91 HE1 TYR 91 -2.662 10.117 0.813 610 HE2 TYR 91 HE2 TYR 91 -5.993 12.530 -0.319 611 HH TYR 91 HH TYR 91 -4.065 11.818 -1.740 612 H GLU 92 H GLU 92 -5.451 9.880 6.309 613 HA GLU 92 HA GLU 92 -5.460 7.619 4.667 614 HB2 GLU 92 1HB GLU 92 -4.179 7.669 6.724 615 HB3 GLU 92 2HB GLU 92 -5.649 7.840 7.674 616 HG2 GLU 92 1HG GLU 92 -6.380 5.638 6.945 617 HG3 GLU 92 2HG GLU 92 -4.906 5.452 6.003 618 H LYS 93 H LYS 93 -7.865 8.846 6.956 619 HA LYS 93 HA LYS 93 -9.692 6.728 6.707 620 HB2 LYS 93 1HB LYS 93 -9.722 8.433 8.522 621 HB3 LYS 93 2HB LYS 93 -10.294 9.619 7.358 622 HG2 LYS 93 1HG LYS 93 -12.329 8.348 7.016 623 HG3 LYS 93 2HG LYS 93 -11.747 7.092 8.111 624 HD2 LYS 93 1HD LYS 93 -11.709 8.725 9.944 625 HD3 LYS 93 2HD LYS 93 -12.316 9.964 8.845 626 HE2 LYS 93 1HE LYS 93 -13.756 7.404 9.529 627 HE3 LYS 93 2HE LYS 93 -14.078 8.969 10.271 628 HZ1 LYS 93 1HZ LYS 93 -14.728 9.835 8.131 629 HZ2 LYS 93 2HZ LYS 93 -15.634 8.451 8.477 630 HZ3 LYS 93 3HZ LYS 93 -14.356 8.372 7.377 631 H LYS 94 H LYS 94 -9.169 9.638 4.809 632 HA LYS 94 HA LYS 94 -11.522 9.532 3.267 633 HB2 LYS 94 1HB LYS 94 -8.786 10.589 2.541 634 HB3 LYS 94 2HB LYS 94 -10.237 10.853 1.587 635 HG2 LYS 94 1HG LYS 94 -9.763 11.804 4.406 636 HG3 LYS 94 2HG LYS 94 -9.726 12.794 2.946 637 HD2 LYS 94 1HD LYS 94 -12.129 11.305 4.010 638 HD3 LYS 94 2HD LYS 94 -11.842 13.037 4.162 639 HE2 LYS 94 1HE LYS 94 -12.161 11.533 1.565 640 HE3 LYS 94 2HE LYS 94 -13.401 12.516 2.339 641 HZ1 LYS 94 1HZ LYS 94 -11.966 14.446 2.096 642 HZ2 LYS 94 2HZ LYS 94 -12.282 13.736 0.594 643 HZ3 LYS 94 3HZ LYS 94 -10.786 13.500 1.340 644 H LEU 95 H LEU 95 -8.368 8.002 2.850 645 HA LEU 95 HA LEU 95 -9.119 6.770 0.357 646 HB2 LEU 95 1HB LEU 95 -6.756 6.252 2.164 647 HB3 LEU 95 2HB LEU 95 -6.956 5.604 0.547 648 HG LEU 95 HG LEU 95 -6.641 8.523 1.255 649 HD11 LEU 95 1HD1 LEU 95 -4.578 7.265 1.508 650 HD12 LEU 95 2HD1 LEU 95 -4.494 8.320 0.097 651 HD13 LEU 95 3HD1 LEU 95 -4.773 6.591 -0.110 652 HD21 LEU 95 1HD2 LEU 95 -6.500 8.865 -1.178 653 HD22 LEU 95 2HD2 LEU 95 -8.081 8.268 -0.676 654 HD23 LEU 95 3HD2 LEU 95 -6.923 7.170 -1.427 655 H GLN 96 H GLN 96 -8.968 5.855 3.737 656 HA GLN 96 HA GLN 96 -9.459 3.089 3.395 657 HB2 GLN 96 1HB GLN 96 -8.603 4.265 5.478 658 HB3 GLN 96 2HB GLN 96 -10.248 4.798 5.768 659 HG2 GLN 96 1HG GLN 96 -9.825 1.879 5.429 660 HG3 GLN 96 2HG GLN 96 -9.194 2.630 6.892 661 HE21 GLN 96 1HE2 GLN 96 -12.058 1.777 5.122 662 HE22 GLN 96 2HE2 GLN 96 -13.182 2.104 6.399 663 H LYS 97 H LYS 97 -11.543 5.920 3.683 664 HA LYS 97 HA LYS 97 -13.962 4.364 3.521 665 HB2 LYS 97 1HB LYS 97 -13.442 7.325 3.322 666 HB3 LYS 97 2HB LYS 97 -15.042 6.624 3.167 667 HG2 LYS 97 1HG LYS 97 -13.253 6.437 5.579 668 HG3 LYS 97 2HG LYS 97 -14.663 7.478 5.408 669 HD2 LYS 97 1HD LYS 97 -14.750 4.465 5.282 670 HD3 LYS 97 2HD LYS 97 -15.066 5.404 6.734 671 HE2 LYS 97 1HE LYS 97 -17.193 4.994 5.926 672 HE3 LYS 97 2HE LYS 97 -16.849 6.600 5.294 673 HZ1 LYS 97 1HZ LYS 97 -16.496 4.089 3.748 674 HZ2 LYS 97 2HZ LYS 97 -16.380 5.671 3.159 675 HZ3 LYS 97 3HZ LYS 97 -17.870 5.070 3.669 676 H TYR 98 H TYR 98 -11.721 5.669 1.272 677 HA TYR 98 HA TYR 98 -13.434 5.955 -0.963 678 HB2 TYR 98 1HB TYR 98 -11.199 6.963 -0.912 679 HB3 TYR 98 2HB TYR 98 -10.465 5.365 -0.861 680 HD1 TYR 98 HD1 TYR 98 -9.907 4.265 -2.850 681 HD2 TYR 98 HD2 TYR 98 -12.599 7.557 -2.983 682 HE1 TYR 98 HE1 TYR 98 -9.829 4.221 -5.306 683 HE2 TYR 98 HE2 TYR 98 -12.527 7.523 -5.441 684 HH TYR 98 HH TYR 98 -11.080 6.751 -7.233 685 H ALA 99 H ALA 99 -11.280 3.317 0.036 686 HA ALA 99 HA ALA 99 -12.860 1.489 -1.658 687 HB1 ALA 99 1HB ALA 99 -10.509 1.591 -2.302 688 HB2 ALA 99 2HB ALA 99 -10.895 0.012 -1.619 689 HB3 ALA 99 3HB ALA 99 -10.026 1.205 -0.650 690 H ASP 100 H ASP 100 -13.944 -0.158 -0.635 691 HA ASP 100 HA ASP 100 -14.072 -0.042 2.224 692 HB2 ASP 100 1HB ASP 100 -16.094 -0.563 1.004 693 HB3 ASP 100 2HB ASP 100 -15.325 -1.949 0.236 694 H ALA 101 H ALA 101 -12.312 -0.618 3.194 695 HA ALA 101 HA ALA 101 -11.553 -3.293 3.553 696 HB1 ALA 101 1HB ALA 101 -10.538 -3.074 1.329 697 HB2 ALA 101 2HB ALA 101 -9.289 -3.204 2.568 698 HB3 ALA 101 3HB ALA 101 -9.669 -1.634 1.860 699 H GLU 102 H GLU 102 -9.178 -3.140 4.659 700 HA GLU 102 HA GLU 102 -9.268 -0.729 6.343 701 HB2 GLU 102 1HB GLU 102 -7.779 -3.246 7.049 702 HB3 GLU 102 2HB GLU 102 -8.310 -1.940 8.095 703 HG2 GLU 102 1HG GLU 102 -10.638 -2.618 7.755 704 HG3 GLU 102 2HG GLU 102 -10.084 -3.961 6.756 705 H VAL 103 H VAL 103 -8.067 0.576 4.935 706 HA VAL 103 HA VAL 103 -5.428 -0.368 4.158 707 HB VAL 103 HB VAL 103 -6.963 0.994 2.585 708 HG11 VAL 103 1HG1 VAL 103 -7.378 2.794 4.297 709 HG12 VAL 103 2HG1 VAL 103 -6.906 3.345 2.690 710 HG13 VAL 103 3HG1 VAL 103 -5.716 3.332 4.000 711 HG21 VAL 103 1HG2 VAL 103 -4.613 0.418 2.131 712 HG22 VAL 103 2HG2 VAL 103 -4.116 1.894 2.954 713 HG23 VAL 103 3HG2 VAL 103 -5.067 1.989 1.472 714 H ARG 104 H ARG 104 -3.558 0.434 4.888 715 HA ARG 104 HA ARG 104 -3.693 2.474 7.009 716 HB2 ARG 104 1HB ARG 104 -3.183 0.031 7.715 717 HB3 ARG 104 2HB ARG 104 -1.622 0.287 6.947 718 HG2 ARG 104 1HG ARG 104 -1.146 2.123 8.450 719 HG3 ARG 104 2HG ARG 104 -2.744 1.959 9.183 720 HD2 ARG 104 1HD ARG 104 -2.089 -0.419 9.746 721 HD3 ARG 104 2HD ARG 104 -0.446 0.025 9.290 722 HE ARG 104 HE ARG 104 -1.518 1.855 11.184 723 HH11 ARG 104 1HH1 ARG 104 -0.137 -1.344 10.889 724 HH12 ARG 104 2HH1 ARG 104 0.425 -1.396 12.531 725 HH21 ARG 104 1HH2 ARG 104 -0.802 1.782 13.354 726 HH22 ARG 104 2HH2 ARG 104 0.053 0.383 13.929 727 H VAL 105 H VAL 105 -2.842 4.267 6.140 728 HA VAL 105 HA VAL 105 -1.065 3.997 3.887 729 HB VAL 105 HB VAL 105 -1.217 6.387 3.609 730 HG11 VAL 105 1HG1 VAL 105 -3.679 6.627 3.380 731 HG12 VAL 105 2HG1 VAL 105 -3.869 5.109 4.260 732 HG13 VAL 105 3HG1 VAL 105 -3.044 5.129 2.702 733 HG21 VAL 105 1HG2 VAL 105 -2.670 6.408 6.250 734 HG22 VAL 105 2HG2 VAL 105 -2.553 7.781 5.149 735 HG23 VAL 105 3HG2 VAL 105 -1.098 7.126 5.901 736 H ARG 106 H ARG 106 1.114 4.556 3.844 737 HA ARG 106 HA ARG 106 2.315 5.488 6.355 738 HB2 ARG 106 1HB ARG 106 3.076 3.015 4.817 739 HB3 ARG 106 2HB ARG 106 4.210 3.823 5.886 740 HG2 ARG 106 1HG ARG 106 1.545 2.683 6.704 741 HG3 ARG 106 2HG ARG 106 3.114 1.917 6.958 742 HD2 ARG 106 1HD ARG 106 3.776 3.985 8.248 743 HD3 ARG 106 2HD ARG 106 2.084 4.474 8.169 744 HE ARG 106 HE ARG 106 2.352 1.833 9.195 745 HH11 ARG 106 1HH1 ARG 106 2.670 5.209 10.070 746 HH12 ARG 106 2HH1 ARG 106 2.419 4.926 11.763 747 HH21 ARG 106 1HH2 ARG 106 2.040 1.456 11.434 748 HH22 ARG 106 2HH2 ARG 106 2.069 2.795 12.540 749 H THR 107 H THR 107 4.046 6.811 6.114 750 HA THR 107 HA THR 107 4.637 7.642 3.381 751 HB THR 107 HB THR 107 3.996 9.417 4.934 752 HG1 THR 107 HG1 THR 107 5.368 10.688 3.977 753 HG21 THR 107 1HG2 THR 107 6.439 8.615 6.513 754 HG22 THR 107 2HG2 THR 107 4.759 8.472 7.032 755 HG23 THR 107 3HG2 THR 107 5.475 10.065 6.794 756 H VAL 108 H VAL 108 6.562 7.334 2.434 757 HA VAL 108 HA VAL 108 8.706 6.117 4.041 758 HB VAL 108 HB VAL 108 7.647 4.276 2.920 759 HG11 VAL 108 1HG1 VAL 108 7.962 5.840 0.361 760 HG12 VAL 108 2HG1 VAL 108 6.446 5.476 1.185 761 HG13 VAL 108 3HG1 VAL 108 7.401 4.172 0.479 762 HG21 VAL 108 1HG2 VAL 108 10.200 5.107 1.559 763 HG22 VAL 108 2HG2 VAL 108 9.487 3.504 1.419 764 HG23 VAL 108 3HG2 VAL 108 10.028 4.092 2.991 765 H THR 109 H THR 109 10.582 7.126 3.835 766 HA THR 109 HA THR 109 11.072 8.639 1.355 767 HB THR 109 HB THR 109 12.593 10.082 2.759 768 HG1 THR 109 HG1 THR 109 11.767 8.317 4.679 769 HG21 THR 109 1HG2 THR 109 9.649 10.091 3.418 770 HG22 THR 109 2HG2 THR 109 10.410 10.867 2.030 771 HG23 THR 109 3HG2 THR 109 10.755 11.442 3.661 772 H SER 110 H SER 110 11.958 5.925 3.001 773 HA SER 110 HA SER 110 14.405 5.697 1.472 774 HB2 SER 110 1HB SER 110 14.627 5.111 4.408 775 HB3 SER 110 2HB SER 110 15.908 5.323 3.224 776 HG SER 110 HG SER 110 14.748 7.587 3.148 777 HA PRO 111 HA PRO 111 13.394 1.452 0.837 778 HB2 PRO 111 1HB PRO 111 16.165 1.153 1.942 779 HB3 PRO 111 2HB PRO 111 15.408 0.334 0.582 780 HG2 PRO 111 1HG PRO 111 17.035 2.394 0.171 781 HG3 PRO 111 2HG PRO 111 15.577 2.171 -0.812 782 HD2 PRO 111 1HD PRO 111 16.141 4.175 1.281 783 HD3 PRO 111 2HD PRO 111 14.978 4.233 -0.061 784 H ASP 112 H ASP 112 15.337 1.959 3.796 785 HA ASP 112 HA ASP 112 14.594 -0.430 5.032 786 HB2 ASP 112 1HB ASP 112 15.596 2.158 6.202 787 HB3 ASP 112 2HB ASP 112 15.314 0.717 7.173 788 H GLU 113 H GLU 113 13.071 2.745 5.180 789 HA GLU 113 HA GLU 113 11.284 2.223 7.274 790 HB2 GLU 113 1HB GLU 113 10.887 3.996 4.862 791 HB3 GLU 113 2HB GLU 113 9.924 4.046 6.331 792 HG2 GLU 113 1HG GLU 113 11.958 4.644 7.594 793 HG3 GLU 113 2HG GLU 113 12.848 4.695 6.071 794 H ALA 114 H ALA 114 10.916 1.837 3.769 795 HA ALA 114 HA ALA 114 8.297 0.831 3.782 796 HB1 ALA 114 1HB ALA 114 8.805 -0.043 1.551 797 HB2 ALA 114 2HB ALA 114 10.520 0.262 1.821 798 HB3 ALA 114 3HB ALA 114 9.387 1.609 1.743 799 H LYS 115 H LYS 115 11.434 -0.798 3.958 800 HA LYS 115 HA LYS 115 10.461 -3.433 3.872 801 HB2 LYS 115 1HB LYS 115 12.993 -2.362 5.128 802 HB3 LYS 115 2HB LYS 115 12.661 -4.063 4.830 803 HG2 LYS 115 1HG LYS 115 12.412 -3.480 2.399 804 HG3 LYS 115 2HG LYS 115 13.024 -1.878 2.799 805 HD2 LYS 115 1HD LYS 115 14.524 -4.413 3.425 806 HD3 LYS 115 2HD LYS 115 14.713 -3.537 1.909 807 HE2 LYS 115 1HE LYS 115 16.459 -2.718 3.180 808 HE3 LYS 115 2HE LYS 115 15.211 -1.501 3.423 809 HZ1 LYS 115 1HZ LYS 115 15.918 -3.694 5.297 810 HZ2 LYS 115 2HZ LYS 115 14.658 -2.594 5.538 811 HZ3 LYS 115 3HZ LYS 115 16.261 -2.046 5.503 812 H ARG 116 H ARG 116 10.758 -1.148 6.506 813 HA ARG 116 HA ARG 116 10.280 -2.968 8.623 814 HB2 ARG 116 1HB ARG 116 9.720 -0.009 8.384 815 HB3 ARG 116 2HB ARG 116 9.474 -0.924 9.862 816 HG2 ARG 116 1HG ARG 116 11.877 -1.485 9.875 817 HG3 ARG 116 2HG ARG 116 12.089 -0.470 8.444 818 HD2 ARG 116 1HD ARG 116 11.253 1.460 9.690 819 HD3 ARG 116 2HD ARG 116 11.031 0.450 11.115 820 HE ARG 116 HE ARG 116 13.714 0.740 9.954 821 HH11 ARG 116 1HH1 ARG 116 11.472 1.311 12.587 822 HH12 ARG 116 2HH1 ARG 116 12.702 1.837 13.689 823 HH21 ARG 116 1HH2 ARG 116 15.334 1.447 11.411 824 HH22 ARG 116 2HH2 ARG 116 14.889 1.916 13.023 825 H TRP 117 H TRP 117 8.105 -0.806 6.821 826 HA TRP 117 HA TRP 117 5.769 -1.594 8.198 827 HB2 TRP 117 1HB TRP 117 5.981 -0.377 5.437 828 HB3 TRP 117 2HB TRP 117 4.539 -0.416 6.445 829 HD1 TRP 117 HD1 TRP 117 6.769 2.048 5.356 830 HE1 TRP 117 HE1 TRP 117 7.174 3.920 7.075 831 HE3 TRP 117 HE3 TRP 117 5.041 -0.312 9.555 832 HZ2 TRP 117 HZ2 TRP 117 6.811 4.336 9.839 833 HZ3 TRP 117 HZ3 TRP 117 5.106 0.900 11.691 834 HH2 TRP 117 HH2 TRP 117 5.973 3.173 11.831 835 H ILE 118 H ILE 118 7.140 -2.595 5.092 836 HA ILE 118 HA ILE 118 5.094 -4.289 4.239 837 HB ILE 118 HB ILE 118 8.072 -4.415 3.758 838 HG12 ILE 118 1HG1 ILE 118 5.790 -3.520 1.985 839 HG13 ILE 118 2HG1 ILE 118 6.844 -2.441 2.893 840 HG21 ILE 118 1HG2 ILE 118 5.909 -6.016 2.403 841 HG22 ILE 118 2HG2 ILE 118 7.176 -6.647 3.453 842 HG23 ILE 118 3HG2 ILE 118 7.595 -5.935 1.894 843 HD11 ILE 118 1HD1 ILE 118 8.754 -3.206 1.596 844 HD12 ILE 118 2HD1 ILE 118 7.484 -2.568 0.552 845 HD13 ILE 118 3HD1 ILE 118 7.712 -4.311 0.701 846 H LYS 119 H LYS 119 7.848 -4.923 6.346 847 HA LYS 119 HA LYS 119 7.500 -7.706 6.560 848 HB2 LYS 119 1HB LYS 119 9.557 -6.425 7.171 849 HB3 LYS 119 2HB LYS 119 8.715 -5.827 8.589 850 HG2 LYS 119 1HG LYS 119 10.098 -7.591 9.309 851 HG3 LYS 119 2HG LYS 119 8.448 -8.209 9.319 852 HD2 LYS 119 1HD LYS 119 10.037 -8.626 6.849 853 HD3 LYS 119 2HD LYS 119 10.497 -9.563 8.269 854 HE2 LYS 119 1HE LYS 119 8.140 -10.328 8.456 855 HE3 LYS 119 2HE LYS 119 7.789 -9.493 6.947 856 HZ1 LYS 119 1HZ LYS 119 9.836 -11.619 7.211 857 HZ2 LYS 119 2HZ LYS 119 9.260 -10.925 5.779 858 HZ3 LYS 119 3HZ LYS 119 8.242 -11.905 6.715 859 H GLU 120 H GLU 120 6.409 -5.019 8.604 860 HA GLU 120 HA GLU 120 5.118 -6.609 10.555 861 HB2 GLU 120 1HB GLU 120 4.704 -3.723 9.760 862 HB3 GLU 120 2HB GLU 120 3.968 -4.473 11.170 863 HG2 GLU 120 1HG GLU 120 6.930 -4.246 10.696 864 HG3 GLU 120 2HG GLU 120 5.978 -3.147 11.693 865 H PHE 121 H PHE 121 3.879 -4.825 7.756 866 HA PHE 121 HA PHE 121 1.165 -5.332 8.148 867 HB2 PHE 121 1HB PHE 121 2.002 -3.637 6.607 868 HB3 PHE 121 2HB PHE 121 2.681 -4.886 5.572 869 HD1 PHE 121 HD1 PHE 121 -0.555 -3.746 7.004 870 HD2 PHE 121 HD2 PHE 121 1.458 -5.676 3.791 871 HE1 PHE 121 HE1 PHE 121 -2.661 -3.828 5.739 872 HE2 PHE 121 HE2 PHE 121 -0.645 -5.762 2.519 873 HZ PHE 121 HZ PHE 121 -2.707 -4.839 3.494 874 H SER 122 H SER 122 3.630 -7.238 6.515 875 HA SER 122 HA SER 122 1.832 -9.136 5.402 876 HB2 SER 122 1HB SER 122 4.124 -8.761 4.538 877 HB3 SER 122 2HB SER 122 4.783 -9.441 6.025 878 HG SER 122 HG SER 122 3.665 -10.704 3.839 879 H GLU 123 H GLU 123 4.010 -9.285 8.240 880 HA GLU 123 HA GLU 123 2.215 -11.295 9.376 881 HB2 GLU 123 1HB GLU 123 4.262 -12.583 10.131 882 HB3 GLU 123 2HB GLU 123 3.872 -12.672 8.419 883 HG2 GLU 123 1HG GLU 123 5.578 -10.900 8.016 884 HG3 GLU 123 2HG GLU 123 6.034 -11.029 9.713 885 H GLU 124 H GLU 124 1.457 -9.782 10.814 886 HA GLU 124 HA GLU 124 3.126 -8.294 12.567 887 HB2 GLU 124 1HB GLU 124 0.225 -9.083 12.939 888 HB3 GLU 124 2HB GLU 124 1.072 -7.802 13.796 889 HG2 GLU 124 1HG GLU 124 1.387 -6.620 11.657 890 HG3 GLU 124 2HG GLU 124 0.454 -7.879 10.852 Start of MODEL 19 1 HA MET 21 HA MET 21 -7.887 -11.842 3.546 2 HB2 MET 21 1HB MET 21 -7.074 -9.911 4.837 3 HB3 MET 21 2HB MET 21 -7.631 -11.197 5.892 4 HG2 MET 21 1HG MET 21 -4.740 -10.720 5.214 5 HG3 MET 21 2HG MET 21 -5.547 -10.044 6.627 6 HE1 MET 21 1HE MET 21 -7.444 -12.389 7.596 7 HE2 MET 21 2HE MET 21 -6.405 -11.450 8.665 8 HE3 MET 21 3HE MET 21 -6.379 -13.211 8.737 9 H THR 22 H THR 22 -7.315 -10.621 1.792 10 HA THR 22 HA THR 22 -4.716 -11.158 0.661 11 HB THR 22 HB THR 22 -6.672 -9.187 -0.487 12 HG1 THR 22 HG1 THR 22 -6.810 -12.026 -0.752 13 HG21 THR 22 1HG2 THR 22 -4.512 -9.475 -1.605 14 HG22 THR 22 2HG2 THR 22 -5.822 -10.095 -2.607 15 HG23 THR 22 3HG2 THR 22 -4.792 -11.212 -1.714 16 H LEU 23 H LEU 23 -2.973 -9.828 0.634 17 HA LEU 23 HA LEU 23 -3.283 -7.219 1.953 18 HB2 LEU 23 1HB LEU 23 -0.806 -8.930 1.747 19 HB3 LEU 23 2HB LEU 23 -0.970 -7.444 2.661 20 HG LEU 23 HG LEU 23 -2.391 -10.045 3.246 21 HD11 LEU 23 1HD1 LEU 23 -0.179 -8.618 4.713 22 HD12 LEU 23 2HD1 LEU 23 -0.023 -10.116 3.795 23 HD13 LEU 23 3HD1 LEU 23 -1.006 -10.076 5.257 24 HD21 LEU 23 1HD2 LEU 23 -3.784 -8.149 3.832 25 HD22 LEU 23 2HD2 LEU 23 -2.444 -7.412 4.710 26 HD23 LEU 23 3HD2 LEU 23 -3.153 -8.920 5.288 27 H PHE 24 H PHE 24 -3.037 -5.500 0.702 28 HA PHE 24 HA PHE 24 -1.471 -5.771 -1.787 29 HB2 PHE 24 1HB PHE 24 -3.733 -3.855 -1.189 30 HB3 PHE 24 2HB PHE 24 -2.836 -3.939 -2.697 31 HD1 PHE 24 HD1 PHE 24 -3.372 -5.525 -4.353 32 HD2 PHE 24 HD2 PHE 24 -5.198 -5.726 -0.519 33 HE1 PHE 24 HE1 PHE 24 -4.984 -7.168 -5.213 34 HE2 PHE 24 HE2 PHE 24 -6.807 -7.370 -1.365 35 HZ PHE 24 HZ PHE 24 -6.708 -8.093 -3.719 36 H VAL 25 H VAL 25 -0.208 -3.963 -2.453 37 HA VAL 25 HA VAL 25 0.260 -1.906 -0.401 38 HB VAL 25 HB VAL 25 2.483 -3.179 -1.993 39 HG11 VAL 25 1HG1 VAL 25 2.534 -1.290 0.354 40 HG12 VAL 25 2HG1 VAL 25 2.878 -0.873 -1.324 41 HG13 VAL 25 3HG1 VAL 25 3.946 -1.974 -0.452 42 HG21 VAL 25 1HG2 VAL 25 3.213 -4.268 0.064 43 HG22 VAL 25 2HG2 VAL 25 1.617 -4.831 -0.433 44 HG23 VAL 25 3HG2 VAL 25 1.772 -3.677 0.893 45 H LEU 26 H LEU 26 -0.466 -0.104 -1.423 46 HA LEU 26 HA LEU 26 0.431 0.418 -4.155 47 HB2 LEU 26 1HB LEU 26 -1.178 2.156 -2.272 48 HB3 LEU 26 2HB LEU 26 -0.727 2.604 -3.899 49 HG LEU 26 HG LEU 26 -2.910 1.939 -4.183 50 HD11 LEU 26 1HD1 LEU 26 -2.924 -0.162 -5.356 51 HD12 LEU 26 2HD1 LEU 26 -1.418 -0.640 -4.574 52 HD13 LEU 26 3HD1 LEU 26 -1.432 0.711 -5.708 53 HD21 LEU 26 1HD2 LEU 26 -3.299 1.147 -1.920 54 HD22 LEU 26 2HD2 LEU 26 -2.446 -0.353 -2.288 55 HD23 LEU 26 3HD2 LEU 26 -3.960 0.026 -3.110 56 H ILE 27 H ILE 27 1.759 2.305 -4.594 57 HA ILE 27 HA ILE 27 3.223 3.394 -2.339 58 HB ILE 27 HB ILE 27 4.463 1.375 -2.673 59 HG12 ILE 27 1HG1 ILE 27 5.931 3.640 -4.046 60 HG13 ILE 27 2HG1 ILE 27 5.796 3.424 -2.305 61 HG21 ILE 27 1HG2 ILE 27 5.396 0.708 -4.830 62 HG22 ILE 27 2HG2 ILE 27 4.620 2.092 -5.597 63 HG23 ILE 27 3HG2 ILE 27 3.635 0.809 -4.895 64 HD11 ILE 27 1HD1 ILE 27 7.955 2.681 -3.118 65 HD12 ILE 27 2HD1 ILE 27 7.168 1.549 -4.217 66 HD13 ILE 27 3HD1 ILE 27 7.031 1.325 -2.474 67 H LEU 28 H LEU 28 3.454 5.552 -2.750 68 HA LEU 28 HA LEU 28 4.048 6.267 -5.565 69 HB2 LEU 28 1HB LEU 28 3.335 8.260 -3.435 70 HB3 LEU 28 2HB LEU 28 3.236 8.441 -5.171 71 HG LEU 28 HG LEU 28 1.373 6.892 -3.385 72 HD11 LEU 28 1HD1 LEU 28 -0.278 8.473 -4.269 73 HD12 LEU 28 2HD1 LEU 28 1.000 9.287 -5.171 74 HD13 LEU 28 3HD1 LEU 28 1.028 9.286 -3.407 75 HD21 LEU 28 1HD2 LEU 28 1.411 7.044 -6.393 76 HD22 LEU 28 2HD2 LEU 28 0.115 6.356 -5.416 77 HD23 LEU 28 3HD2 LEU 28 1.713 5.613 -5.410 78 H SER 29 H SER 29 6.193 5.461 -5.080 79 HA SER 29 HA SER 29 7.872 7.704 -4.343 80 HB2 SER 29 1HB SER 29 7.651 6.371 -2.237 81 HB3 SER 29 2HB SER 29 8.315 4.978 -3.089 82 HG SER 29 HG SER 29 9.588 7.435 -2.461 83 H ASN 30 H ASN 30 8.715 7.862 -6.482 84 HA ASN 30 HA ASN 30 9.482 5.381 -7.767 85 HB2 ASN 30 1HB ASN 30 9.802 8.270 -8.599 86 HB3 ASN 30 2HB ASN 30 10.414 6.922 -9.551 87 HD21 ASN 30 1HD2 ASN 30 7.599 8.632 -8.477 88 HD22 ASN 30 2HD2 ASN 30 6.481 7.869 -9.556 89 H ASP 31 H ASP 31 10.915 4.701 -6.131 90 HA ASP 31 HA ASP 31 13.620 5.710 -6.685 91 HB2 ASP 31 1HB ASP 31 12.900 5.889 -4.276 92 HB3 ASP 31 2HB ASP 31 12.764 4.137 -4.250 93 H LYS 32 H LYS 32 14.687 4.379 -7.992 94 HA LYS 32 HA LYS 32 13.415 2.106 -9.020 95 HB2 LYS 32 1HB LYS 32 16.257 3.057 -9.337 96 HB3 LYS 32 2HB LYS 32 15.539 1.760 -10.281 97 HG2 LYS 32 1HG LYS 32 14.550 4.606 -10.206 98 HG3 LYS 32 2HG LYS 32 15.549 3.903 -11.480 99 HD2 LYS 32 1HD LYS 32 13.793 2.311 -12.013 100 HD3 LYS 32 2HD LYS 32 12.803 2.927 -10.690 101 HE2 LYS 32 1HE LYS 32 12.057 3.822 -12.828 102 HE3 LYS 32 2HE LYS 32 12.675 5.101 -11.789 103 HZ1 LYS 32 1HZ LYS 32 14.674 5.196 -13.034 104 HZ2 LYS 32 2HZ LYS 32 13.407 5.219 -14.151 105 HZ3 LYS 32 3HZ LYS 32 14.290 3.798 -13.906 106 H LYS 33 H LYS 33 15.995 2.356 -6.592 107 HA LYS 33 HA LYS 33 16.301 -0.534 -6.596 108 HB2 LYS 33 1HB LYS 33 18.047 -0.232 -4.950 109 HB3 LYS 33 2HB LYS 33 18.293 0.887 -6.276 110 HG2 LYS 33 1HG LYS 33 17.409 2.704 -4.942 111 HG3 LYS 33 2HG LYS 33 17.060 1.591 -3.624 112 HD2 LYS 33 1HD LYS 33 19.066 2.534 -2.956 113 HD3 LYS 33 2HD LYS 33 19.593 1.047 -3.738 114 HE2 LYS 33 1HE LYS 33 19.493 3.721 -5.123 115 HE3 LYS 33 2HE LYS 33 20.925 3.096 -4.312 116 HZ1 LYS 33 1HZ LYS 33 19.550 1.896 -6.649 117 HZ2 LYS 33 2HZ LYS 33 20.834 1.174 -5.826 118 HZ3 LYS 33 3HZ LYS 33 21.067 2.637 -6.635 119 H LEU 34 H LEU 34 14.667 1.924 -4.760 120 HA LEU 34 HA LEU 34 13.983 0.420 -2.470 121 HB2 LEU 34 1HB LEU 34 13.614 2.930 -3.084 122 HB3 LEU 34 2HB LEU 34 12.108 2.363 -3.773 123 HG LEU 34 HG LEU 34 12.898 2.714 -0.955 124 HD11 LEU 34 1HD1 LEU 34 11.387 4.228 -2.051 125 HD12 LEU 34 2HD1 LEU 34 10.551 3.350 -0.768 126 HD13 LEU 34 3HD1 LEU 34 10.310 2.889 -2.456 127 HD21 LEU 34 1HD2 LEU 34 12.568 0.312 -0.932 128 HD22 LEU 34 2HD2 LEU 34 11.032 0.495 -1.779 129 HD23 LEU 34 3HD2 LEU 34 11.216 1.121 -0.142 130 H ILE 35 H ILE 35 12.173 1.047 -5.472 131 HA ILE 35 HA ILE 35 9.954 -0.544 -5.032 132 HB ILE 35 HB ILE 35 11.351 0.062 -7.646 133 HG12 ILE 35 1HG1 ILE 35 8.957 1.360 -6.322 134 HG13 ILE 35 2HG1 ILE 35 10.585 2.029 -6.348 135 HG21 ILE 35 1HG2 ILE 35 9.221 -0.464 -8.733 136 HG22 ILE 35 2HG2 ILE 35 8.559 -0.978 -7.182 137 HG23 ILE 35 3HG2 ILE 35 9.894 -1.869 -7.910 138 HD11 ILE 35 1HD1 ILE 35 8.846 1.523 -8.754 139 HD12 ILE 35 2HD1 ILE 35 10.474 2.204 -8.778 140 HD13 ILE 35 3HD1 ILE 35 9.159 3.087 -8.003 141 H GLU 36 H GLU 36 13.155 -1.442 -6.088 142 HA GLU 36 HA GLU 36 12.591 -4.116 -6.834 143 HB2 GLU 36 1HB GLU 36 15.112 -2.813 -5.803 144 HB3 GLU 36 2HB GLU 36 15.042 -4.485 -6.338 145 HG2 GLU 36 1HG GLU 36 14.338 -2.121 -8.049 146 HG3 GLU 36 2HG GLU 36 15.909 -2.919 -8.038 147 H GLU 37 H GLU 37 13.950 -2.799 -3.817 148 HA GLU 37 HA GLU 37 14.019 -5.262 -2.460 149 HB2 GLU 37 1HB GLU 37 13.911 -2.450 -1.356 150 HB3 GLU 37 2HB GLU 37 14.321 -3.884 -0.425 151 HG2 GLU 37 1HG GLU 37 15.861 -2.865 -2.802 152 HG3 GLU 37 2HG GLU 37 16.288 -2.583 -1.115 153 H ALA 38 H ALA 38 11.614 -2.683 -2.547 154 HA ALA 38 HA ALA 38 9.935 -3.686 -0.515 155 HB1 ALA 38 1HB ALA 38 9.818 -1.378 -1.339 156 HB2 ALA 38 2HB ALA 38 8.247 -2.175 -1.411 157 HB3 ALA 38 3HB ALA 38 9.196 -1.962 -2.881 158 H ARG 39 H ARG 39 9.910 -4.179 -4.052 159 HA ARG 39 HA ARG 39 7.547 -5.765 -3.964 160 HB2 ARG 39 1HB ARG 39 8.347 -4.671 -6.059 161 HB3 ARG 39 2HB ARG 39 9.670 -5.834 -6.109 162 HG2 ARG 39 1HG ARG 39 7.815 -7.640 -6.006 163 HG3 ARG 39 2HG ARG 39 6.732 -6.313 -6.450 164 HD2 ARG 39 1HD ARG 39 7.998 -5.890 -8.467 165 HD3 ARG 39 2HD ARG 39 9.176 -7.121 -8.016 166 HE ARG 39 HE ARG 39 6.829 -8.482 -8.038 167 HH11 ARG 39 1HH1 ARG 39 8.461 -6.448 -10.370 168 HH12 ARG 39 2HH1 ARG 39 7.827 -7.288 -11.745 169 HH21 ARG 39 1HH2 ARG 39 5.982 -9.595 -9.847 170 HH22 ARG 39 2HH2 ARG 39 6.421 -9.090 -11.448 171 H LYS 40 H LYS 40 11.017 -6.568 -4.121 172 HA LYS 40 HA LYS 40 10.719 -9.336 -4.341 173 HB2 LYS 40 1HB LYS 40 12.935 -7.729 -3.064 174 HB3 LYS 40 2HB LYS 40 13.030 -9.456 -3.384 175 HG2 LYS 40 1HG LYS 40 12.808 -9.060 -5.763 176 HG3 LYS 40 2HG LYS 40 12.616 -7.330 -5.478 177 HD2 LYS 40 1HD LYS 40 14.872 -7.256 -4.507 178 HD3 LYS 40 2HD LYS 40 15.060 -8.979 -4.840 179 HE2 LYS 40 1HE LYS 40 14.598 -6.822 -6.897 180 HE3 LYS 40 2HE LYS 40 16.142 -7.600 -6.550 181 HZ1 LYS 40 1HZ LYS 40 15.192 -9.710 -7.241 182 HZ2 LYS 40 2HZ LYS 40 15.081 -8.572 -8.484 183 HZ3 LYS 40 3HZ LYS 40 13.714 -8.964 -7.575 184 H MET 41 H MET 41 10.741 -7.246 -1.518 185 HA MET 41 HA MET 41 10.590 -9.239 0.453 186 HB2 MET 41 1HB MET 41 11.031 -7.031 1.172 187 HB3 MET 41 2HB MET 41 9.628 -6.391 0.332 188 HG2 MET 41 1HG MET 41 8.142 -7.336 1.906 189 HG3 MET 41 2HG MET 41 9.427 -8.289 2.650 190 HE1 MET 41 1HE MET 41 11.518 -5.637 4.535 191 HE2 MET 41 2HE MET 41 11.831 -6.241 2.908 192 HE3 MET 41 3HE MET 41 11.282 -7.346 4.168 193 H ALA 42 H ALA 42 8.006 -7.425 -1.183 194 HA ALA 42 HA ALA 42 5.859 -8.868 -0.034 195 HB1 ALA 42 1HB ALA 42 4.545 -7.889 -1.921 196 HB2 ALA 42 2HB ALA 42 6.050 -7.207 -2.535 197 HB3 ALA 42 3HB ALA 42 5.440 -6.720 -0.954 198 H GLU 43 H GLU 43 7.882 -9.456 -2.828 199 HA GLU 43 HA GLU 43 6.314 -11.301 -4.198 200 HB2 GLU 43 1HB GLU 43 9.308 -11.079 -3.934 201 HB3 GLU 43 2HB GLU 43 8.530 -12.248 -4.990 202 HG2 GLU 43 1HG GLU 43 8.209 -9.269 -5.159 203 HG3 GLU 43 2HG GLU 43 9.268 -10.240 -6.176 204 H LYS 44 H LYS 44 8.830 -11.791 -1.757 205 HA LYS 44 HA LYS 44 8.341 -14.601 -1.496 206 HB2 LYS 44 1HB LYS 44 10.082 -12.610 -0.129 207 HB3 LYS 44 2HB LYS 44 9.749 -14.120 0.706 208 HG2 LYS 44 1HG LYS 44 11.816 -14.297 -0.507 209 HG3 LYS 44 2HG LYS 44 10.613 -15.358 -1.234 210 HD2 LYS 44 1HD LYS 44 10.189 -13.631 -2.954 211 HD3 LYS 44 2HD LYS 44 11.482 -12.655 -2.252 212 HE2 LYS 44 1HE LYS 44 13.072 -14.471 -2.685 213 HE3 LYS 44 2HE LYS 44 11.776 -15.427 -3.402 214 HZ1 LYS 44 1HZ LYS 44 11.510 -13.706 -5.088 215 HZ2 LYS 44 2HZ LYS 44 13.073 -14.346 -5.099 216 HZ3 LYS 44 3HZ LYS 44 12.790 -12.828 -4.411 217 H ALA 45 H ALA 45 7.132 -11.739 0.068 218 HA ALA 45 HA ALA 45 5.985 -13.207 2.273 219 HB1 ALA 45 1HB ALA 45 5.041 -11.043 2.948 220 HB2 ALA 45 2HB ALA 45 5.672 -10.326 1.465 221 HB3 ALA 45 3HB ALA 45 6.782 -10.964 2.675 222 H ASN 46 H ASN 46 5.194 -12.963 -0.873 223 HA ASN 46 HA ASN 46 3.373 -13.414 -2.123 224 HB2 ASN 46 1HB ASN 46 2.493 -14.587 0.502 225 HB3 ASN 46 2HB ASN 46 1.458 -14.640 -0.921 226 HD21 ASN 46 1HD2 ASN 46 2.030 -15.933 -2.654 227 HD22 ASN 46 2HD2 ASN 46 3.245 -17.161 -2.526 228 H LEU 47 H LEU 47 3.618 -10.822 -1.144 229 HA LEU 47 HA LEU 47 0.828 -10.006 -0.677 230 HB2 LEU 47 1HB LEU 47 3.199 -8.164 -0.659 231 HB3 LEU 47 2HB LEU 47 1.630 -7.923 0.070 232 HG LEU 47 HG LEU 47 3.779 -9.797 1.045 233 HD11 LEU 47 1HD1 LEU 47 3.873 -8.276 2.950 234 HD12 LEU 47 2HD1 LEU 47 2.660 -7.246 2.188 235 HD13 LEU 47 3HD1 LEU 47 4.245 -7.442 1.440 236 HD21 LEU 47 1HD2 LEU 47 2.328 -10.217 2.940 237 HD22 LEU 47 2HD2 LEU 47 1.540 -10.705 1.441 238 HD23 LEU 47 3HD2 LEU 47 1.078 -9.197 2.230 239 H ILE 48 H ILE 48 0.077 -8.117 -1.948 240 HA ILE 48 HA ILE 48 1.085 -8.364 -4.683 241 HB ILE 48 HB ILE 48 -1.548 -7.222 -3.738 242 HG12 ILE 48 1HG1 ILE 48 -0.865 -9.889 -5.005 243 HG13 ILE 48 2HG1 ILE 48 -1.376 -9.636 -3.342 244 HG21 ILE 48 1HG2 ILE 48 -2.184 -7.308 -6.109 245 HG22 ILE 48 2HG2 ILE 48 -0.553 -7.837 -6.522 246 HG23 ILE 48 3HG2 ILE 48 -0.812 -6.232 -5.840 247 HD11 ILE 48 1HD1 ILE 48 -3.553 -8.869 -4.126 248 HD12 ILE 48 2HD1 ILE 48 -3.189 -10.494 -4.710 249 HD13 ILE 48 3HD1 ILE 48 -3.037 -9.111 -5.794 250 H LEU 49 H LEU 49 2.743 -6.982 -4.830 251 HA LEU 49 HA LEU 49 2.595 -4.268 -3.848 252 HB2 LEU 49 1HB LEU 49 4.672 -5.887 -4.171 253 HB3 LEU 49 2HB LEU 49 4.663 -5.229 -5.791 254 HG LEU 49 HG LEU 49 6.259 -3.975 -4.605 255 HD11 LEU 49 1HD1 LEU 49 3.748 -2.326 -4.530 256 HD12 LEU 49 2HD1 LEU 49 4.777 -2.573 -5.943 257 HD13 LEU 49 3HD1 LEU 49 5.403 -1.716 -4.533 258 HD21 LEU 49 1HD2 LEU 49 5.777 -2.862 -2.457 259 HD22 LEU 49 2HD2 LEU 49 5.748 -4.623 -2.362 260 HD23 LEU 49 3HD2 LEU 49 4.237 -3.717 -2.400 261 H ILE 50 H ILE 50 1.578 -2.697 -4.952 262 HA ILE 50 HA ILE 50 1.479 -2.910 -7.894 263 HB ILE 50 HB ILE 50 -0.484 -1.425 -6.139 264 HG12 ILE 50 1HG1 ILE 50 -0.841 -4.069 -7.571 265 HG13 ILE 50 2HG1 ILE 50 -0.629 -3.886 -5.835 266 HG21 ILE 50 1HG2 ILE 50 -0.493 -2.057 -9.089 267 HG22 ILE 50 2HG2 ILE 50 -0.274 -0.469 -8.352 268 HG23 ILE 50 3HG2 ILE 50 -1.823 -1.302 -8.208 269 HD11 ILE 50 1HD1 ILE 50 -2.717 -2.637 -5.709 270 HD12 ILE 50 2HD1 ILE 50 -2.962 -4.231 -6.422 271 HD13 ILE 50 3HD1 ILE 50 -2.924 -2.801 -7.453 272 H THR 51 H THR 51 3.013 -1.619 -8.674 273 HA THR 51 HA THR 51 4.000 0.668 -7.297 274 HB THR 51 HB THR 51 5.102 1.051 -9.644 275 HG1 THR 51 HG1 THR 51 5.084 -1.513 -10.299 276 HG21 THR 51 1HG2 THR 51 6.299 0.260 -7.673 277 HG22 THR 51 2HG2 THR 51 6.814 -0.632 -9.105 278 HG23 THR 51 3HG2 THR 51 5.705 -1.376 -7.952 279 H VAL 52 H VAL 52 3.317 2.738 -7.402 280 HA VAL 52 HA VAL 52 1.431 3.495 -9.530 281 HB VAL 52 HB VAL 52 1.021 4.091 -6.590 282 HG11 VAL 52 1HG1 VAL 52 -0.738 4.606 -8.976 283 HG12 VAL 52 2HG1 VAL 52 0.099 5.814 -8.003 284 HG13 VAL 52 3HG1 VAL 52 -1.206 4.860 -7.296 285 HG21 VAL 52 1HG2 VAL 52 -0.413 2.107 -8.346 286 HG22 VAL 52 2HG2 VAL 52 -0.880 2.545 -6.703 287 HG23 VAL 52 3HG2 VAL 52 0.658 1.732 -6.996 288 H GLY 53 H GLY 53 1.352 5.762 -9.992 289 HA2 GLY 53 1HA GLY 53 2.786 7.565 -8.213 290 HA3 GLY 53 2HA GLY 53 3.436 7.448 -9.841 291 H ASP 54 H ASP 54 0.882 8.545 -7.856 292 HA ASP 54 HA ASP 54 0.152 10.874 -8.722 293 HB2 ASP 54 1HB ASP 54 -0.052 9.913 -11.086 294 HB3 ASP 54 2HB ASP 54 -1.474 9.049 -10.515 295 H GLU 55 H GLU 55 -1.737 11.554 -7.588 296 HA GLU 55 HA GLU 55 -2.710 9.690 -5.672 297 HB2 GLU 55 1HB GLU 55 -3.751 12.441 -6.354 298 HB3 GLU 55 2HB GLU 55 -4.192 11.504 -4.932 299 HG2 GLU 55 1HG GLU 55 -1.800 11.530 -4.243 300 HG3 GLU 55 2HG GLU 55 -1.484 12.635 -5.578 301 H GLU 56 H GLU 56 -3.802 10.709 -8.791 302 HA GLU 56 HA GLU 56 -6.463 9.654 -8.351 303 HB2 GLU 56 1HB GLU 56 -5.171 10.778 -10.836 304 HB3 GLU 56 2HB GLU 56 -6.857 10.292 -10.707 305 HG2 GLU 56 1HG GLU 56 -7.182 11.975 -8.945 306 HG3 GLU 56 2HG GLU 56 -5.508 12.493 -9.159 307 H GLU 57 H GLU 57 -3.428 8.702 -9.736 308 HA GLU 57 HA GLU 57 -4.386 6.323 -10.938 309 HB2 GLU 57 1HB GLU 57 -2.161 7.370 -11.429 310 HB3 GLU 57 2HB GLU 57 -1.614 6.816 -9.850 311 HG2 GLU 57 1HG GLU 57 -1.875 4.532 -10.488 312 HG3 GLU 57 2HG GLU 57 -2.664 4.988 -11.993 313 H LEU 58 H LEU 58 -3.437 7.249 -7.692 314 HA LEU 58 HA LEU 58 -3.558 4.729 -6.473 315 HB2 LEU 58 1HB LEU 58 -4.154 7.500 -5.507 316 HB3 LEU 58 2HB LEU 58 -4.559 6.130 -4.496 317 HG LEU 58 HG LEU 58 -1.806 6.904 -5.454 318 HD11 LEU 58 1HD1 LEU 58 -1.383 7.224 -3.056 319 HD12 LEU 58 2HD1 LEU 58 -3.076 6.861 -2.718 320 HD13 LEU 58 3HD1 LEU 58 -2.651 8.295 -3.654 321 HD21 LEU 58 1HD2 LEU 58 -2.713 4.536 -3.821 322 HD22 LEU 58 2HD2 LEU 58 -1.036 5.042 -4.013 323 HD23 LEU 58 3HD2 LEU 58 -1.956 4.494 -5.412 324 H LYS 59 H LYS 59 -6.098 7.057 -7.249 325 HA LYS 59 HA LYS 59 -8.280 5.747 -6.157 326 HB2 LYS 59 1HB LYS 59 -8.110 7.421 -8.659 327 HB3 LYS 59 2HB LYS 59 -9.618 6.937 -7.897 328 HG2 LYS 59 1HG LYS 59 -9.120 8.214 -5.937 329 HG3 LYS 59 2HG LYS 59 -7.487 8.553 -6.514 330 HD2 LYS 59 1HD LYS 59 -8.390 9.846 -8.369 331 HD3 LYS 59 2HD LYS 59 -10.033 9.464 -7.856 332 HE2 LYS 59 1HE LYS 59 -8.030 10.955 -6.171 333 HE3 LYS 59 2HE LYS 59 -9.233 11.735 -7.194 334 HZ1 LYS 59 1HZ LYS 59 -9.833 9.900 -4.935 335 HZ2 LYS 59 2HZ LYS 59 -10.973 10.688 -5.904 336 HZ3 LYS 59 3HZ LYS 59 -9.962 11.586 -4.894 337 H LYS 60 H LYS 60 -6.447 5.019 -8.957 338 HA LYS 60 HA LYS 60 -8.402 3.161 -10.028 339 HB2 LYS 60 1HB LYS 60 -5.590 3.690 -10.982 340 HB3 LYS 60 2HB LYS 60 -6.938 3.030 -11.904 341 HG2 LYS 60 1HG LYS 60 -7.471 5.656 -10.732 342 HG3 LYS 60 2HG LYS 60 -6.151 5.642 -11.913 343 HD2 LYS 60 1HD LYS 60 -8.853 4.423 -12.452 344 HD3 LYS 60 2HD LYS 60 -8.450 6.095 -12.853 345 HE2 LYS 60 1HE LYS 60 -6.929 3.688 -13.828 346 HE3 LYS 60 2HE LYS 60 -8.180 4.515 -14.756 347 HZ1 LYS 60 1HZ LYS 60 -6.816 6.542 -14.615 348 HZ2 LYS 60 2HZ LYS 60 -6.021 5.288 -15.419 349 HZ3 LYS 60 3HZ LYS 60 -5.602 5.665 -13.828 350 H ALA 61 H ALA 61 -5.148 3.125 -8.615 351 HA ALA 61 HA ALA 61 -4.789 0.318 -8.863 352 HB1 ALA 61 1HB ALA 61 -2.816 0.643 -7.475 353 HB2 ALA 61 2HB ALA 61 -3.359 2.267 -7.056 354 HB3 ALA 61 3HB ALA 61 -2.914 1.889 -8.719 355 H ILE 62 H ILE 62 -5.921 2.409 -6.235 356 HA ILE 62 HA ILE 62 -6.062 0.338 -4.285 357 HB ILE 62 HB ILE 62 -7.647 2.922 -4.348 358 HG12 ILE 62 1HG1 ILE 62 -5.023 2.352 -2.948 359 HG13 ILE 62 2HG1 ILE 62 -5.157 3.232 -4.468 360 HG21 ILE 62 1HG2 ILE 62 -6.931 1.094 -2.058 361 HG22 ILE 62 2HG2 ILE 62 -8.523 1.246 -2.799 362 HG23 ILE 62 3HG2 ILE 62 -7.819 2.613 -1.935 363 HD11 ILE 62 1HD1 ILE 62 -6.376 4.065 -1.845 364 HD12 ILE 62 2HD1 ILE 62 -6.474 4.953 -3.366 365 HD13 ILE 62 3HD1 ILE 62 -4.915 4.736 -2.570 366 H LYS 63 H LYS 63 -8.355 1.709 -6.602 367 HA LYS 63 HA LYS 63 -10.595 0.181 -5.801 368 HB2 LYS 63 1HB LYS 63 -10.679 2.194 -7.282 369 HB3 LYS 63 2HB LYS 63 -9.965 1.231 -8.568 370 HG2 LYS 63 1HG LYS 63 -11.907 -0.286 -8.462 371 HG3 LYS 63 2HG LYS 63 -12.631 0.773 -7.251 372 HD2 LYS 63 1HD LYS 63 -12.559 2.630 -8.870 373 HD3 LYS 63 2HD LYS 63 -11.913 1.523 -10.082 374 HE2 LYS 63 1HE LYS 63 -14.590 1.295 -8.712 375 HE3 LYS 63 2HE LYS 63 -14.315 1.837 -10.366 376 HZ1 LYS 63 1HZ LYS 63 -13.710 -0.868 -9.299 377 HZ2 LYS 63 2HZ LYS 63 -13.410 -0.351 -10.880 378 HZ3 LYS 63 3HZ LYS 63 -14.996 -0.464 -10.317 379 H LYS 64 H LYS 64 -7.942 -0.394 -8.026 380 HA LYS 64 HA LYS 64 -8.847 -2.884 -9.016 381 HB2 LYS 64 1HB LYS 64 -7.181 -1.705 -10.242 382 HB3 LYS 64 2HB LYS 64 -6.119 -1.614 -8.848 383 HG2 LYS 64 1HG LYS 64 -5.576 -3.904 -8.993 384 HG3 LYS 64 2HG LYS 64 -6.884 -4.216 -10.133 385 HD2 LYS 64 1HD LYS 64 -4.603 -4.140 -11.163 386 HD3 LYS 64 2HD LYS 64 -5.764 -3.017 -11.864 387 HE2 LYS 64 1HE LYS 64 -4.007 -2.049 -9.665 388 HE3 LYS 64 2HE LYS 64 -3.305 -2.268 -11.267 389 HZ1 LYS 64 1HZ LYS 64 -4.940 -0.775 -12.182 390 HZ2 LYS 64 2HZ LYS 64 -4.146 -0.008 -10.904 391 HZ3 LYS 64 3HZ LYS 64 -5.708 -0.614 -10.686 392 H ALA 65 H ALA 65 -6.876 -1.956 -6.241 393 HA ALA 65 HA ALA 65 -6.191 -4.531 -5.355 394 HB1 ALA 65 1HB ALA 65 -5.860 -3.500 -3.165 395 HB2 ALA 65 2HB ALA 65 -6.730 -2.063 -3.701 396 HB3 ALA 65 3HB ALA 65 -5.189 -2.487 -4.444 397 H ASP 66 H ASP 66 -8.942 -2.446 -4.521 398 HA ASP 66 HA ASP 66 -10.387 -4.223 -2.931 399 HB2 ASP 66 1HB ASP 66 -11.067 -1.921 -3.089 400 HB3 ASP 66 2HB ASP 66 -11.304 -2.052 -4.827 401 H ASP 67 H ASP 67 -10.271 -3.849 -6.425 402 HA ASP 67 HA ASP 67 -12.360 -5.595 -7.103 403 HB2 ASP 67 1HB ASP 67 -11.376 -3.964 -8.660 404 HB3 ASP 67 2HB ASP 67 -9.881 -4.893 -8.684 405 H ILE 68 H ILE 68 -8.850 -6.163 -6.935 406 HA ILE 68 HA ILE 68 -8.946 -8.889 -7.660 407 HB ILE 68 HB ILE 68 -6.872 -7.416 -6.026 408 HG12 ILE 68 1HG1 ILE 68 -6.906 -8.097 -8.974 409 HG13 ILE 68 2HG1 ILE 68 -7.271 -6.508 -8.309 410 HG21 ILE 68 1HG2 ILE 68 -6.705 -10.086 -7.418 411 HG22 ILE 68 2HG2 ILE 68 -6.672 -9.806 -5.678 412 HG23 ILE 68 3HG2 ILE 68 -5.344 -9.234 -6.689 413 HD11 ILE 68 1HD1 ILE 68 -4.643 -7.953 -8.077 414 HD12 ILE 68 2HD1 ILE 68 -5.007 -6.355 -7.424 415 HD13 ILE 68 3HD1 ILE 68 -5.003 -6.616 -9.169 416 H ALA 69 H ALA 69 -9.111 -7.238 -4.562 417 HA ALA 69 HA ALA 69 -8.894 -9.557 -2.944 418 HB1 ALA 69 1HB ALA 69 -9.487 -8.156 -1.116 419 HB2 ALA 69 2HB ALA 69 -10.239 -6.975 -2.187 420 HB3 ALA 69 3HB ALA 69 -8.491 -7.192 -2.206 421 H LYS 70 H LYS 70 -11.671 -7.678 -4.097 422 HA LYS 70 HA LYS 70 -13.515 -9.149 -2.498 423 HB2 LYS 70 1HB LYS 70 -13.701 -6.962 -4.488 424 HB3 LYS 70 2HB LYS 70 -15.143 -7.915 -4.185 425 HG2 LYS 70 1HG LYS 70 -15.043 -5.882 -2.811 426 HG3 LYS 70 2HG LYS 70 -15.077 -7.354 -1.839 427 HD2 LYS 70 1HD LYS 70 -12.566 -7.189 -1.704 428 HD3 LYS 70 2HD LYS 70 -12.707 -5.593 -2.446 429 HE2 LYS 70 1HE LYS 70 -13.960 -6.469 0.151 430 HE3 LYS 70 2HE LYS 70 -12.557 -5.415 -0.024 431 HZ1 LYS 70 1HZ LYS 70 -15.290 -4.820 -1.008 432 HZ2 LYS 70 2HZ LYS 70 -13.940 -3.802 -1.157 433 HZ3 LYS 70 3HZ LYS 70 -14.577 -4.161 0.380 434 H LYS 71 H LYS 71 -12.230 -9.687 -5.623 435 HA LYS 71 HA LYS 71 -14.385 -11.189 -6.661 436 HB2 LYS 71 1HB LYS 71 -12.476 -10.385 -8.028 437 HB3 LYS 71 2HB LYS 71 -11.424 -11.521 -7.198 438 HG2 LYS 71 1HG LYS 71 -12.641 -13.387 -8.111 439 HG3 LYS 71 2HG LYS 71 -13.816 -12.298 -8.850 440 HD2 LYS 71 1HD LYS 71 -12.059 -11.347 -10.253 441 HD3 LYS 71 2HD LYS 71 -10.874 -12.417 -9.504 442 HE2 LYS 71 1HE LYS 71 -11.575 -13.301 -11.651 443 HE3 LYS 71 2HE LYS 71 -12.111 -14.357 -10.346 444 HZ1 LYS 71 1HZ LYS 71 -13.794 -12.354 -11.748 445 HZ2 LYS 71 2HZ LYS 71 -14.309 -13.373 -10.499 446 HZ3 LYS 71 3HZ LYS 71 -13.846 -14.027 -11.987 447 H GLN 72 H GLN 72 -11.894 -11.849 -4.342 448 HA GLN 72 HA GLN 72 -12.720 -14.675 -4.290 449 HB2 GLN 72 1HB GLN 72 -10.309 -15.215 -3.752 450 HB3 GLN 72 2HB GLN 72 -10.647 -14.703 -5.399 451 HG2 GLN 72 1HG GLN 72 -9.905 -12.420 -4.793 452 HG3 GLN 72 2HG GLN 72 -9.463 -13.026 -3.199 453 HE21 GLN 72 1HE2 GLN 72 -7.846 -11.806 -5.292 454 HE22 GLN 72 2HE2 GLN 72 -6.582 -12.939 -5.631 455 H ASN 73 H ASN 73 -11.113 -12.144 -2.313 456 HA ASN 73 HA ASN 73 -11.484 -13.935 -0.020 457 HB2 ASN 73 1HB ASN 73 -9.108 -13.424 -1.025 458 HB3 ASN 73 2HB ASN 73 -9.249 -11.975 -0.032 459 HD21 ASN 73 1HD2 ASN 73 -9.478 -12.220 2.243 460 HD22 ASN 73 2HD2 ASN 73 -8.951 -13.668 3.036 461 H SER 74 H SER 74 -13.138 -11.494 -0.904 462 HA SER 74 HA SER 74 -12.488 -9.342 0.780 463 HB2 SER 74 1HB SER 74 -15.058 -8.838 0.341 464 HB3 SER 74 2HB SER 74 -13.799 -8.601 -0.866 465 HG SER 74 HG SER 74 -15.888 -9.972 -1.253 466 H SER 75 H SER 75 -13.261 -12.175 2.069 467 HA SER 75 HA SER 75 -15.102 -11.502 4.090 468 HB2 SER 75 1HB SER 75 -14.090 -13.807 3.612 469 HB3 SER 75 2HB SER 75 -12.664 -13.254 4.488 470 HG SER 75 HG SER 75 -13.969 -12.966 6.323 471 H GLU 76 H GLU 76 -11.724 -10.794 3.572 472 HA GLU 76 HA GLU 76 -11.845 -8.421 5.103 473 HB2 GLU 76 1HB GLU 76 -11.561 -9.974 6.997 474 HB3 GLU 76 2HB GLU 76 -10.116 -10.632 6.243 475 HG2 GLU 76 1HG GLU 76 -9.021 -8.458 6.434 476 HG3 GLU 76 2HG GLU 76 -10.466 -7.789 7.192 477 H ALA 77 H ALA 77 -10.304 -7.020 4.383 478 HA ALA 77 HA ALA 77 -7.969 -8.096 2.981 479 HB1 ALA 77 1HB ALA 77 -9.799 -5.998 1.816 480 HB2 ALA 77 2HB ALA 77 -9.662 -7.667 1.263 481 HB3 ALA 77 3HB ALA 77 -8.289 -6.570 1.105 482 H LYS 78 H LYS 78 -6.140 -6.921 3.252 483 HA LYS 78 HA LYS 78 -6.379 -4.334 4.645 484 HB2 LYS 78 1HB LYS 78 -4.229 -6.419 5.080 485 HB3 LYS 78 2HB LYS 78 -4.326 -4.857 5.874 486 HG2 LYS 78 1HG LYS 78 -6.339 -5.526 7.031 487 HG3 LYS 78 2HG LYS 78 -6.356 -7.065 6.165 488 HD2 LYS 78 1HD LYS 78 -4.141 -7.586 7.165 489 HD3 LYS 78 2HD LYS 78 -4.261 -6.103 8.112 490 HE2 LYS 78 1HE LYS 78 -6.271 -8.347 8.216 491 HE3 LYS 78 2HE LYS 78 -4.918 -8.184 9.332 492 HZ1 LYS 78 1HZ LYS 78 -5.819 -6.011 9.987 493 HZ2 LYS 78 2HZ LYS 78 -6.888 -7.277 10.313 494 HZ3 LYS 78 3HZ LYS 78 -7.165 -6.263 8.986 495 H ILE 79 H ILE 79 -4.934 -2.726 3.978 496 HA ILE 79 HA ILE 79 -3.253 -3.372 1.655 497 HB ILE 79 HB ILE 79 -5.303 -1.148 1.687 498 HG12 ILE 79 1HG1 ILE 79 -5.249 -3.692 0.049 499 HG13 ILE 79 2HG1 ILE 79 -6.330 -3.374 1.405 500 HG21 ILE 79 1HG2 ILE 79 -4.646 -0.821 -0.663 501 HG22 ILE 79 2HG2 ILE 79 -3.375 -2.025 -0.454 502 HG23 ILE 79 3HG2 ILE 79 -3.320 -0.518 0.459 503 HD11 ILE 79 1HD1 ILE 79 -7.347 -1.539 0.166 504 HD12 ILE 79 2HD1 ILE 79 -7.451 -3.057 -0.727 505 HD13 ILE 79 3HD1 ILE 79 -6.258 -1.843 -1.186 506 H LEU 80 H LEU 80 -1.373 -2.203 1.570 507 HA LEU 80 HA LEU 80 -1.071 0.069 3.418 508 HB2 LEU 80 1HB LEU 80 0.943 -1.536 1.855 509 HB3 LEU 80 2HB LEU 80 1.350 -0.004 2.609 510 HG LEU 80 HG LEU 80 0.643 -2.593 3.918 511 HD11 LEU 80 1HD1 LEU 80 2.962 -2.261 3.286 512 HD12 LEU 80 2HD1 LEU 80 2.780 -2.254 5.039 513 HD13 LEU 80 3HD1 LEU 80 2.989 -0.735 4.168 514 HD21 LEU 80 1HD2 LEU 80 0.738 -1.409 6.075 515 HD22 LEU 80 2HD2 LEU 80 -0.645 -0.932 5.092 516 HD23 LEU 80 3HD2 LEU 80 0.766 0.121 5.201 517 H ILE 81 H ILE 81 -0.774 2.121 2.680 518 HA ILE 81 HA ILE 81 -0.195 2.393 -0.194 519 HB ILE 81 HB ILE 81 -1.633 4.387 1.576 520 HG12 ILE 81 1HG1 ILE 81 -2.621 2.883 -0.855 521 HG13 ILE 81 2HG1 ILE 81 -2.980 2.422 0.806 522 HG21 ILE 81 1HG2 ILE 81 -1.860 5.739 -0.459 523 HG22 ILE 81 2HG2 ILE 81 -0.875 4.572 -1.340 524 HG23 ILE 81 3HG2 ILE 81 -0.168 5.505 -0.022 525 HD11 ILE 81 1HD1 ILE 81 -4.822 3.633 -0.217 526 HD12 ILE 81 2HD1 ILE 81 -3.760 5.009 -0.511 527 HD13 ILE 81 3HD1 ILE 81 -4.145 4.530 1.142 528 H LEU 82 H LEU 82 1.993 2.307 0.014 529 HA LEU 82 HA LEU 82 3.422 4.034 1.816 530 HB2 LEU 82 1HB LEU 82 4.488 2.695 -0.672 531 HB3 LEU 82 2HB LEU 82 5.417 3.301 0.681 532 HG LEU 82 HG LEU 82 3.666 0.850 0.608 533 HD11 LEU 82 1HD1 LEU 82 5.743 -0.287 1.193 534 HD12 LEU 82 2HD1 LEU 82 6.600 1.254 1.156 535 HD13 LEU 82 3HD1 LEU 82 5.898 0.598 -0.325 536 HD21 LEU 82 1HD2 LEU 82 3.245 1.867 2.724 537 HD22 LEU 82 2HD2 LEU 82 4.961 2.192 2.971 538 HD23 LEU 82 3HD2 LEU 82 4.369 0.530 2.976 539 H LEU 83 H LEU 83 4.326 6.005 1.369 540 HA LEU 83 HA LEU 83 4.653 7.034 -1.249 541 HB2 LEU 83 1HB LEU 83 3.007 8.989 -0.847 542 HB3 LEU 83 2HB LEU 83 2.381 7.468 -1.447 543 HG LEU 83 HG LEU 83 1.721 6.912 0.930 544 HD11 LEU 83 1HD1 LEU 83 2.277 9.834 1.380 545 HD12 LEU 83 2HD1 LEU 83 3.222 8.499 2.039 546 HD13 LEU 83 3HD1 LEU 83 1.540 8.712 2.524 547 HD21 LEU 83 1HD2 LEU 83 0.114 7.684 -0.735 548 HD22 LEU 83 2HD2 LEU 83 0.481 9.356 -0.317 549 HD23 LEU 83 3HD2 LEU 83 -0.279 8.298 0.870 550 H GLU 84 H GLU 84 5.464 9.325 -1.179 551 HA GLU 84 HA GLU 84 6.490 9.947 1.517 552 HB2 GLU 84 1HB GLU 84 7.714 10.668 -1.153 553 HB3 GLU 84 2HB GLU 84 8.397 11.024 0.427 554 HG2 GLU 84 1HG GLU 84 8.721 8.679 0.860 555 HG3 GLU 84 2HG GLU 84 7.922 8.257 -0.653 556 H LYS 85 H LYS 85 4.880 11.276 2.154 557 HA LYS 85 HA LYS 85 5.291 13.972 1.655 558 HB2 LYS 85 1HB LYS 85 3.089 14.636 0.726 559 HB3 LYS 85 2HB LYS 85 4.070 13.733 -0.409 560 HG2 LYS 85 1HG LYS 85 2.690 11.697 0.330 561 HG3 LYS 85 2HG LYS 85 1.575 12.890 1.007 562 HD2 LYS 85 1HD LYS 85 1.540 14.011 -1.230 563 HD3 LYS 85 2HD LYS 85 2.482 12.662 -1.863 564 HE2 LYS 85 1HE LYS 85 0.262 12.164 -2.418 565 HE3 LYS 85 2HE LYS 85 0.608 11.170 -1.006 566 HZ1 LYS 85 1HZ LYS 85 -0.507 12.815 0.371 567 HZ2 LYS 85 2HZ LYS 85 -1.551 12.226 -0.825 568 HZ3 LYS 85 3HZ LYS 85 -0.844 13.757 -0.990 569 HA PRO 86 HA PRO 86 3.442 14.131 5.657 570 HB2 PRO 86 1HB PRO 86 2.002 16.610 4.955 571 HB3 PRO 86 2HB PRO 86 3.233 16.341 6.190 572 HG2 PRO 86 1HG PRO 86 3.772 17.722 3.960 573 HG3 PRO 86 2HG PRO 86 4.979 16.663 4.712 574 HD2 PRO 86 1HD PRO 86 3.265 16.177 2.308 575 HD3 PRO 86 2HD PRO 86 4.969 15.758 2.583 576 H VAL 87 H VAL 87 1.836 12.785 6.209 577 HA VAL 87 HA VAL 87 -0.805 13.201 4.977 578 HB VAL 87 HB VAL 87 -1.298 10.818 5.438 579 HG11 VAL 87 1HG1 VAL 87 -0.569 11.443 3.227 580 HG12 VAL 87 2HG1 VAL 87 0.110 9.874 3.652 581 HG13 VAL 87 3HG1 VAL 87 1.121 11.317 3.712 582 HG21 VAL 87 1HG2 VAL 87 1.623 10.640 6.170 583 HG22 VAL 87 2HG2 VAL 87 0.535 9.270 5.952 584 HG23 VAL 87 3HG2 VAL 87 0.257 10.417 7.261 585 H SER 88 H SER 88 -2.392 13.771 6.279 586 HA SER 88 HA SER 88 -1.987 13.694 9.159 587 HB2 SER 88 1HB SER 88 -4.268 14.872 7.549 588 HB3 SER 88 2HB SER 88 -3.951 15.135 9.264 589 HG SER 88 HG SER 88 -1.785 15.703 7.711 590 HA PRO 89 HA PRO 89 -4.358 10.149 10.233 591 HB2 PRO 89 1HB PRO 89 -6.292 11.968 11.605 592 HB3 PRO 89 2HB PRO 89 -5.515 10.497 12.202 593 HG2 PRO 89 1HG PRO 89 -4.642 12.884 12.967 594 HG3 PRO 89 2HG PRO 89 -3.502 11.572 12.621 595 HD2 PRO 89 1HD PRO 89 -4.154 13.991 11.016 596 HD3 PRO 89 2HD PRO 89 -2.624 13.103 11.153 597 H GLU 90 H GLU 90 -6.452 12.894 9.326 598 HA GLU 90 HA GLU 90 -8.634 11.200 8.594 599 HB2 GLU 90 1HB GLU 90 -8.137 14.130 8.087 600 HB3 GLU 90 2HB GLU 90 -9.623 13.299 7.662 601 HG2 GLU 90 1HG GLU 90 -9.965 12.733 10.027 602 HG3 GLU 90 2HG GLU 90 -8.504 13.627 10.437 603 H TYR 91 H TYR 91 -5.781 12.061 7.002 604 HA TYR 91 HA TYR 91 -6.710 12.000 4.310 605 HB2 TYR 91 1HB TYR 91 -4.520 12.956 4.936 606 HB3 TYR 91 2HB TYR 91 -3.969 11.363 5.437 607 HD1 TYR 91 HD1 TYR 91 -4.790 13.498 2.565 608 HD2 TYR 91 HD2 TYR 91 -3.292 9.715 3.810 609 HE1 TYR 91 HE1 TYR 91 -3.947 13.088 0.294 610 HE2 TYR 91 HE2 TYR 91 -2.447 9.296 1.541 611 HH TYR 91 HH TYR 91 -3.079 10.135 -0.842 612 H GLU 92 H GLU 92 -5.523 9.607 6.592 613 HA GLU 92 HA GLU 92 -5.573 7.409 4.799 614 HB2 GLU 92 1HB GLU 92 -4.232 7.273 6.787 615 HB3 GLU 92 2HB GLU 92 -5.625 7.580 7.814 616 HG2 GLU 92 1HG GLU 92 -6.586 5.446 7.184 617 HG3 GLU 92 2HG GLU 92 -5.235 5.137 6.098 618 H LYS 93 H LYS 93 -7.890 8.831 7.010 619 HA LYS 93 HA LYS 93 -9.815 6.814 6.999 620 HB2 LYS 93 1HB LYS 93 -10.237 9.797 7.268 621 HB3 LYS 93 2HB LYS 93 -11.389 8.552 7.729 622 HG2 LYS 93 1HG LYS 93 -9.796 7.719 9.404 623 HG3 LYS 93 2HG LYS 93 -8.675 9.005 8.956 624 HD2 LYS 93 1HD LYS 93 -9.854 9.692 10.926 625 HD3 LYS 93 2HD LYS 93 -10.436 10.660 9.571 626 HE2 LYS 93 1HE LYS 93 -12.295 9.951 10.960 627 HE3 LYS 93 2HE LYS 93 -12.392 9.191 9.374 628 HZ1 LYS 93 1HZ LYS 93 -12.867 7.626 11.154 629 HZ2 LYS 93 2HZ LYS 93 -11.345 7.901 11.834 630 HZ3 LYS 93 3HZ LYS 93 -11.472 7.174 10.315 631 H LYS 94 H LYS 94 -9.361 9.604 4.866 632 HA LYS 94 HA LYS 94 -11.724 9.246 3.376 633 HB2 LYS 94 1HB LYS 94 -9.118 10.556 2.589 634 HB3 LYS 94 2HB LYS 94 -10.611 10.669 1.664 635 HG2 LYS 94 1HG LYS 94 -11.694 11.713 3.631 636 HG3 LYS 94 2HG LYS 94 -10.133 11.701 4.451 637 HD2 LYS 94 1HD LYS 94 -9.196 13.097 2.666 638 HD3 LYS 94 2HD LYS 94 -10.767 13.118 1.864 639 HE2 LYS 94 1HE LYS 94 -10.478 15.162 3.116 640 HE3 LYS 94 2HE LYS 94 -11.741 14.187 3.862 641 HZ1 LYS 94 1HZ LYS 94 -10.313 15.084 5.544 642 HZ2 LYS 94 2HZ LYS 94 -8.936 14.452 4.793 643 HZ3 LYS 94 3HZ LYS 94 -10.081 13.411 5.478 644 H LEU 95 H LEU 95 -8.471 7.942 2.981 645 HA LEU 95 HA LEU 95 -9.088 6.688 0.472 646 HB2 LEU 95 1HB LEU 95 -6.772 6.306 2.368 647 HB3 LEU 95 2HB LEU 95 -6.885 5.576 0.778 648 HG LEU 95 HG LEU 95 -6.790 8.545 1.327 649 HD11 LEU 95 1HD1 LEU 95 -4.557 8.435 0.335 650 HD12 LEU 95 2HD1 LEU 95 -4.692 6.680 0.236 651 HD13 LEU 95 3HD1 LEU 95 -4.665 7.474 1.810 652 HD21 LEU 95 1HD2 LEU 95 -6.494 8.737 -1.105 653 HD22 LEU 95 2HD2 LEU 95 -8.059 8.048 -0.678 654 HD23 LEU 95 3HD2 LEU 95 -6.765 7.003 -1.264 655 H GLN 96 H GLN 96 -9.017 5.719 3.842 656 HA GLN 96 HA GLN 96 -9.463 2.951 3.442 657 HB2 GLN 96 1HB GLN 96 -8.715 4.203 5.568 658 HB3 GLN 96 2HB GLN 96 -10.412 4.556 5.819 659 HG2 GLN 96 1HG GLN 96 -9.549 1.711 5.480 660 HG3 GLN 96 2HG GLN 96 -9.264 2.538 7.006 661 HE21 GLN 96 1HE2 GLN 96 -11.628 1.154 4.912 662 HE22 GLN 96 2HE2 GLN 96 -12.971 1.290 5.994 663 H LYS 97 H LYS 97 -11.574 5.761 3.738 664 HA LYS 97 HA LYS 97 -14.001 4.249 3.535 665 HB2 LYS 97 1HB LYS 97 -13.415 7.180 3.139 666 HB3 LYS 97 2HB LYS 97 -15.029 6.495 3.027 667 HG2 LYS 97 1HG LYS 97 -14.917 5.775 5.332 668 HG3 LYS 97 2HG LYS 97 -13.259 6.366 5.458 669 HD2 LYS 97 1HD LYS 97 -14.045 8.643 5.010 670 HD3 LYS 97 2HD LYS 97 -15.702 8.046 4.901 671 HE2 LYS 97 1HE LYS 97 -13.928 7.869 7.333 672 HE3 LYS 97 2HE LYS 97 -15.218 9.044 7.091 673 HZ1 LYS 97 1HZ LYS 97 -15.966 7.214 8.457 674 HZ2 LYS 97 2HZ LYS 97 -15.560 6.099 7.254 675 HZ3 LYS 97 3HZ LYS 97 -16.802 7.213 6.988 676 H TYR 98 H TYR 98 -11.753 5.584 1.235 677 HA TYR 98 HA TYR 98 -13.454 5.730 -1.004 678 HB2 TYR 98 1HB TYR 98 -11.255 6.814 -0.978 679 HB3 TYR 98 2HB TYR 98 -10.468 5.242 -0.911 680 HD1 TYR 98 HD1 TYR 98 -12.826 7.207 -3.028 681 HD2 TYR 98 HD2 TYR 98 -9.786 4.236 -2.891 682 HE1 TYR 98 HE1 TYR 98 -12.811 7.121 -5.484 683 HE2 TYR 98 HE2 TYR 98 -9.762 4.140 -5.347 684 HH TYR 98 HH TYR 98 -11.061 4.679 -7.230 685 H ALA 99 H ALA 99 -11.419 3.130 0.238 686 HA ALA 99 HA ALA 99 -12.820 1.274 -1.576 687 HB1 ALA 99 1HB ALA 99 -9.939 1.158 -0.675 688 HB2 ALA 99 2HB ALA 99 -10.513 1.542 -2.300 689 HB3 ALA 99 3HB ALA 99 -10.762 -0.073 -1.636 690 H ASP 100 H ASP 100 -13.870 -0.347 -0.545 691 HA ASP 100 HA ASP 100 -13.875 -0.454 2.294 692 HB2 ASP 100 1HB ASP 100 -15.874 -1.104 1.124 693 HB3 ASP 100 2HB ASP 100 -15.003 -2.326 0.206 694 H ALA 101 H ALA 101 -12.041 -0.931 3.197 695 HA ALA 101 HA ALA 101 -11.107 -3.560 3.447 696 HB1 ALA 101 1HB ALA 101 -9.331 -1.737 1.805 697 HB2 ALA 101 2HB ALA 101 -10.141 -3.187 1.211 698 HB3 ALA 101 3HB ALA 101 -8.880 -3.321 2.437 699 H GLU 102 H GLU 102 -8.855 -3.397 4.650 700 HA GLU 102 HA GLU 102 -8.988 -0.988 6.317 701 HB2 GLU 102 1HB GLU 102 -7.362 -3.467 6.846 702 HB3 GLU 102 2HB GLU 102 -7.714 -2.144 7.938 703 HG2 GLU 102 1HG GLU 102 -10.117 -2.794 7.840 704 HG3 GLU 102 2HG GLU 102 -9.619 -4.236 6.947 705 H VAL 103 H VAL 103 -7.948 0.428 4.876 706 HA VAL 103 HA VAL 103 -5.291 -0.312 3.982 707 HB VAL 103 HB VAL 103 -6.957 1.050 2.548 708 HG11 VAL 103 1HG1 VAL 103 -5.757 3.364 4.044 709 HG12 VAL 103 2HG1 VAL 103 -7.386 2.743 4.353 710 HG13 VAL 103 3HG1 VAL 103 -6.982 3.403 2.767 711 HG21 VAL 103 1HG2 VAL 103 -5.140 2.206 1.432 712 HG22 VAL 103 2HG2 VAL 103 -4.630 0.599 1.946 713 HG23 VAL 103 3HG2 VAL 103 -4.125 2.018 2.861 714 H ARG 104 H ARG 104 -3.469 0.379 4.793 715 HA ARG 104 HA ARG 104 -3.554 2.312 7.015 716 HB2 ARG 104 1HB ARG 104 -3.014 -0.045 7.682 717 HB3 ARG 104 2HB ARG 104 -1.616 0.018 6.623 718 HG2 ARG 104 1HG ARG 104 -0.739 1.899 7.985 719 HG3 ARG 104 2HG ARG 104 -2.095 1.666 9.093 720 HD2 ARG 104 1HD ARG 104 0.036 -0.356 8.408 721 HD3 ARG 104 2HD ARG 104 -0.117 0.527 9.924 722 HE ARG 104 HE ARG 104 -2.367 -0.679 10.072 723 HH11 ARG 104 1HH1 ARG 104 0.476 -2.042 8.539 724 HH12 ARG 104 2HH1 ARG 104 0.031 -3.686 8.896 725 HH21 ARG 104 1HH2 ARG 104 -2.946 -2.867 10.523 726 HH22 ARG 104 2HH2 ARG 104 -1.895 -4.145 9.993 727 H VAL 105 H VAL 105 -2.946 4.165 6.000 728 HA VAL 105 HA VAL 105 -1.172 4.085 3.768 729 HB VAL 105 HB VAL 105 -1.336 6.475 3.657 730 HG11 VAL 105 1HG1 VAL 105 -3.967 5.226 4.434 731 HG12 VAL 105 2HG1 VAL 105 -3.248 5.273 2.826 732 HG13 VAL 105 3HG1 VAL 105 -3.789 6.765 3.593 733 HG21 VAL 105 1HG2 VAL 105 -1.035 7.111 5.941 734 HG22 VAL 105 2HG2 VAL 105 -2.544 6.330 6.411 735 HG23 VAL 105 3HG2 VAL 105 -2.576 7.767 5.386 736 H ARG 106 H ARG 106 1.020 4.504 3.713 737 HA ARG 106 HA ARG 106 2.306 4.940 6.333 738 HB2 ARG 106 1HB ARG 106 3.241 3.020 4.195 739 HB3 ARG 106 2HB ARG 106 4.024 3.308 5.736 740 HG2 ARG 106 1HG ARG 106 1.219 2.265 5.570 741 HG3 ARG 106 2HG ARG 106 2.614 1.188 5.486 742 HD2 ARG 106 1HD ARG 106 1.907 1.227 7.750 743 HD3 ARG 106 2HD ARG 106 3.376 2.196 7.667 744 HE ARG 106 HE ARG 106 0.989 3.766 7.396 745 HH11 ARG 106 1HH1 ARG 106 3.141 2.256 9.708 746 HH12 ARG 106 2HH1 ARG 106 2.714 3.333 10.997 747 HH21 ARG 106 1HH2 ARG 106 0.410 5.163 9.098 748 HH22 ARG 106 2HH2 ARG 106 1.169 4.987 10.651 749 H THR 107 H THR 107 3.351 6.813 6.230 750 HA THR 107 HA THR 107 4.384 7.738 3.674 751 HB THR 107 HB THR 107 3.167 9.366 5.036 752 HG1 THR 107 HG1 THR 107 4.506 10.940 4.508 753 HG21 THR 107 1HG2 THR 107 4.149 10.238 7.127 754 HG22 THR 107 2HG2 THR 107 5.355 8.953 7.073 755 HG23 THR 107 3HG2 THR 107 3.648 8.554 7.265 756 H VAL 108 H VAL 108 6.406 7.424 3.069 757 HA VAL 108 HA VAL 108 8.253 6.352 5.085 758 HB VAL 108 HB VAL 108 9.460 5.303 3.174 759 HG11 VAL 108 1HG1 VAL 108 7.802 3.533 2.809 760 HG12 VAL 108 2HG1 VAL 108 6.545 4.583 3.465 761 HG13 VAL 108 3HG1 VAL 108 7.865 4.037 4.498 762 HG21 VAL 108 1HG2 VAL 108 7.070 6.243 1.585 763 HG22 VAL 108 2HG2 VAL 108 8.296 5.111 1.016 764 HG23 VAL 108 3HG2 VAL 108 8.737 6.779 1.379 765 H THR 109 H THR 109 10.245 7.179 5.371 766 HA THR 109 HA THR 109 10.897 9.607 3.846 767 HB THR 109 HB THR 109 12.445 10.040 5.860 768 HG1 THR 109 HG1 THR 109 10.619 8.303 7.179 769 HG21 THR 109 1HG2 THR 109 9.443 10.090 6.210 770 HG22 THR 109 2HG2 THR 109 10.428 11.344 5.454 771 HG23 THR 109 3HG2 THR 109 10.597 11.007 7.178 772 H SER 110 H SER 110 11.694 6.424 4.032 773 HA SER 110 HA SER 110 14.149 6.739 2.609 774 HB2 SER 110 1HB SER 110 14.257 5.496 5.375 775 HB3 SER 110 2HB SER 110 15.566 5.466 4.200 776 HG SER 110 HG SER 110 14.720 7.990 4.540 777 HA PRO 111 HA PRO 111 12.807 2.882 0.871 778 HB2 PRO 111 1HB PRO 111 15.639 1.986 1.058 779 HB3 PRO 111 2HB PRO 111 14.565 2.017 -0.339 780 HG2 PRO 111 1HG PRO 111 16.505 3.820 -0.076 781 HG3 PRO 111 2HG PRO 111 14.922 4.267 -0.739 782 HD2 PRO 111 1HD PRO 111 16.066 4.797 1.968 783 HD3 PRO 111 2HD PRO 111 15.006 5.814 0.970 784 H ASP 112 H ASP 112 15.153 2.693 3.505 785 HA ASP 112 HA ASP 112 14.660 0.043 4.278 786 HB2 ASP 112 1HB ASP 112 16.584 1.476 5.026 787 HB3 ASP 112 2HB ASP 112 15.468 2.315 6.101 788 H GLU 113 H GLU 113 13.137 3.081 5.259 789 HA GLU 113 HA GLU 113 11.512 2.102 7.311 790 HB2 GLU 113 1HB GLU 113 10.922 4.334 5.353 791 HB3 GLU 113 2HB GLU 113 10.051 4.047 6.852 792 HG2 GLU 113 1HG GLU 113 12.944 4.812 6.577 793 HG3 GLU 113 2HG GLU 113 11.629 5.841 7.139 794 H ALA 114 H ALA 114 10.894 2.418 3.840 795 HA ALA 114 HA ALA 114 8.273 1.504 3.748 796 HB1 ALA 114 1HB ALA 114 10.441 1.070 1.699 797 HB2 ALA 114 2HB ALA 114 9.433 2.511 1.841 798 HB3 ALA 114 3HB ALA 114 8.705 0.962 1.411 799 H LYS 115 H LYS 115 11.297 -0.316 3.632 800 HA LYS 115 HA LYS 115 10.155 -2.859 3.232 801 HB2 LYS 115 1HB LYS 115 12.773 -2.096 4.538 802 HB3 LYS 115 2HB LYS 115 12.336 -3.721 4.033 803 HG2 LYS 115 1HG LYS 115 12.177 -2.962 1.718 804 HG3 LYS 115 2HG LYS 115 12.624 -1.335 2.225 805 HD2 LYS 115 1HD LYS 115 14.571 -2.411 1.335 806 HD3 LYS 115 2HD LYS 115 14.773 -2.258 3.080 807 HE2 LYS 115 1HE LYS 115 13.592 -4.768 1.999 808 HE3 LYS 115 2HE LYS 115 15.323 -4.506 1.805 809 HZ1 LYS 115 1HZ LYS 115 15.536 -4.266 4.182 810 HZ2 LYS 115 2HZ LYS 115 14.795 -5.741 3.825 811 HZ3 LYS 115 3HZ LYS 115 13.870 -4.449 4.396 812 H ARG 116 H ARG 116 10.908 -1.031 6.154 813 HA ARG 116 HA ARG 116 10.379 -3.119 7.979 814 HB2 ARG 116 1HB ARG 116 10.983 -0.303 8.121 815 HB3 ARG 116 2HB ARG 116 9.708 -0.714 9.261 816 HG2 ARG 116 1HG ARG 116 11.829 -0.895 10.358 817 HG3 ARG 116 2HG ARG 116 11.148 -2.510 10.164 818 HD2 ARG 116 1HD ARG 116 12.557 -2.750 8.103 819 HD3 ARG 116 2HD ARG 116 13.335 -1.229 8.537 820 HE ARG 116 HE ARG 116 13.334 -3.347 10.542 821 HH11 ARG 116 1HH1 ARG 116 15.129 -1.513 8.152 822 HH12 ARG 116 2HH1 ARG 116 16.666 -2.130 8.664 823 HH21 ARG 116 1HH2 ARG 116 15.366 -4.134 11.220 824 HH22 ARG 116 2HH2 ARG 116 16.803 -3.617 10.396 825 H TRP 117 H TRP 117 8.303 -0.558 6.644 826 HA TRP 117 HA TRP 117 6.013 -1.160 8.157 827 HB2 TRP 117 1HB TRP 117 6.135 -0.033 5.352 828 HB3 TRP 117 2HB TRP 117 4.735 0.017 6.416 829 HD1 TRP 117 HD1 TRP 117 7.156 2.270 5.195 830 HE1 TRP 117 HE1 TRP 117 7.662 4.200 6.811 831 HE3 TRP 117 HE3 TRP 117 5.164 0.295 9.463 832 HZ2 TRP 117 HZ2 TRP 117 7.261 4.815 9.533 833 HZ3 TRP 117 HZ3 TRP 117 5.264 1.622 11.531 834 HH2 TRP 117 HH2 TRP 117 6.292 3.834 11.565 835 H ILE 118 H ILE 118 7.148 -2.409 5.045 836 HA ILE 118 HA ILE 118 4.824 -3.978 4.547 837 HB ILE 118 HB ILE 118 7.600 -4.288 3.389 838 HG12 ILE 118 1HG1 ILE 118 5.171 -2.841 2.306 839 HG13 ILE 118 2HG1 ILE 118 6.603 -2.065 2.977 840 HG21 ILE 118 1HG2 ILE 118 6.495 -5.496 1.572 841 HG22 ILE 118 2HG2 ILE 118 4.951 -5.348 2.409 842 HG23 ILE 118 3HG2 ILE 118 6.250 -6.305 3.121 843 HD11 ILE 118 1HD1 ILE 118 6.616 -2.035 0.543 844 HD12 ILE 118 2HD1 ILE 118 6.536 -3.796 0.514 845 HD13 ILE 118 3HD1 ILE 118 7.956 -2.988 1.177 846 H LYS 119 H LYS 119 7.980 -4.649 6.006 847 HA LYS 119 HA LYS 119 7.757 -7.418 6.264 848 HB2 LYS 119 1HB LYS 119 9.831 -6.163 6.735 849 HB3 LYS 119 2HB LYS 119 9.090 -5.496 8.183 850 HG2 LYS 119 1HG LYS 119 8.862 -7.792 9.075 851 HG3 LYS 119 2HG LYS 119 9.719 -8.392 7.657 852 HD2 LYS 119 1HD LYS 119 11.666 -7.021 8.275 853 HD3 LYS 119 2HD LYS 119 10.805 -6.466 9.711 854 HE2 LYS 119 1HE LYS 119 10.657 -8.786 10.504 855 HE3 LYS 119 2HE LYS 119 11.546 -9.321 9.080 856 HZ1 LYS 119 1HZ LYS 119 13.444 -8.042 9.805 857 HZ2 LYS 119 2HZ LYS 119 12.971 -9.109 11.029 858 HZ3 LYS 119 3HZ LYS 119 12.593 -7.466 11.149 859 H GLU 120 H GLU 120 6.721 -4.839 8.462 860 HA GLU 120 HA GLU 120 5.608 -6.584 10.410 861 HB2 GLU 120 1HB GLU 120 4.926 -3.690 9.860 862 HB3 GLU 120 2HB GLU 120 4.570 -4.577 11.335 863 HG2 GLU 120 1HG GLU 120 6.970 -4.824 11.753 864 HG3 GLU 120 2HG GLU 120 7.310 -3.904 10.288 865 H PHE 121 H PHE 121 4.302 -4.848 7.634 866 HA PHE 121 HA PHE 121 1.577 -5.377 8.089 867 HB2 PHE 121 1HB PHE 121 2.334 -3.632 6.568 868 HB3 PHE 121 2HB PHE 121 3.053 -4.836 5.507 869 HD1 PHE 121 HD1 PHE 121 1.884 -5.421 3.635 870 HD2 PHE 121 HD2 PHE 121 -0.255 -4.051 7.048 871 HE1 PHE 121 HE1 PHE 121 -0.215 -5.552 2.365 872 HE2 PHE 121 HE2 PHE 121 -2.361 -4.181 5.785 873 HZ PHE 121 HZ PHE 121 -2.342 -4.931 3.439 874 H SER 122 H SER 122 4.102 -7.374 6.862 875 HA SER 122 HA SER 122 2.559 -9.210 5.380 876 HB2 SER 122 1HB SER 122 5.103 -9.731 6.938 877 HB3 SER 122 2HB SER 122 4.457 -10.728 5.636 878 HG SER 122 HG SER 122 5.031 -7.992 5.217 879 H GLU 123 H GLU 123 2.989 -8.695 8.771 880 HA GLU 123 HA GLU 123 0.885 -10.304 9.612 881 HB2 GLU 123 1HB GLU 123 2.382 -12.165 8.884 882 HB3 GLU 123 2HB GLU 123 3.580 -11.615 10.044 883 HG2 GLU 123 1HG GLU 123 2.087 -12.106 11.876 884 HG3 GLU 123 2HG GLU 123 0.812 -12.561 10.746 885 H GLU 124 H GLU 124 0.593 -8.390 10.834 886 HA GLU 124 HA GLU 124 2.609 -7.891 12.899 887 HB2 GLU 124 1HB GLU 124 1.484 -5.741 13.291 888 HB3 GLU 124 2HB GLU 124 2.019 -5.915 11.630 889 HG2 GLU 124 1HG GLU 124 -0.809 -6.478 12.459 890 HG3 GLU 124 2HG GLU 124 -0.256 -4.860 12.043 Start of MODEL 20 1 HA MET 21 HA MET 21 -8.630 -11.435 4.136 2 HB2 MET 21 1HB MET 21 -7.257 -9.818 5.363 3 HB3 MET 21 2HB MET 21 -8.021 -10.954 6.463 4 HG2 MET 21 1HG MET 21 -5.948 -12.173 6.699 5 HG3 MET 21 2HG MET 21 -5.170 -11.127 5.514 6 HE1 MET 21 1HE MET 21 -3.183 -10.594 7.128 7 HE2 MET 21 2HE MET 21 -3.875 -11.674 8.337 8 HE3 MET 21 3HE MET 21 -3.379 -10.044 8.793 9 H THR 22 H THR 22 -7.940 -10.540 2.260 10 HA THR 22 HA THR 22 -5.416 -11.421 1.149 11 HB THR 22 HB THR 22 -7.220 -9.362 -0.105 12 HG1 THR 22 HG1 THR 22 -7.499 -12.172 -0.447 13 HG21 THR 22 1HG2 THR 22 -6.372 -10.345 -2.180 14 HG22 THR 22 2HG2 THR 22 -5.445 -11.523 -1.253 15 HG23 THR 22 3HG2 THR 22 -5.041 -9.809 -1.154 16 H LEU 23 H LEU 23 -3.563 -10.297 1.244 17 HA LEU 23 HA LEU 23 -3.706 -7.591 2.353 18 HB2 LEU 23 1HB LEU 23 -1.378 -9.509 2.274 19 HB3 LEU 23 2HB LEU 23 -1.345 -7.908 2.981 20 HG LEU 23 HG LEU 23 -2.954 -10.270 3.955 21 HD11 LEU 23 1HD1 LEU 23 -0.651 -8.759 5.174 22 HD12 LEU 23 2HD1 LEU 23 -0.582 -10.383 4.491 23 HD13 LEU 23 3HD1 LEU 23 -1.541 -10.075 5.938 24 HD21 LEU 23 1HD2 LEU 23 -4.239 -8.230 4.250 25 HD22 LEU 23 2HD2 LEU 23 -2.852 -7.443 5.001 26 HD23 LEU 23 3HD2 LEU 23 -3.634 -8.804 5.804 27 H PHE 24 H PHE 24 -3.543 -6.029 0.957 28 HA PHE 24 HA PHE 24 -1.924 -6.406 -1.474 29 HB2 PHE 24 1HB PHE 24 -3.926 -4.212 -0.913 30 HB3 PHE 24 2HB PHE 24 -3.168 -4.582 -2.453 31 HD1 PHE 24 HD1 PHE 24 -5.664 -5.688 0.010 32 HD2 PHE 24 HD2 PHE 24 -4.030 -6.279 -3.873 33 HE1 PHE 24 HE1 PHE 24 -7.575 -7.117 -0.573 34 HE2 PHE 24 HE2 PHE 24 -5.929 -7.715 -4.456 35 HZ PHE 24 HZ PHE 24 -7.710 -8.134 -2.811 36 H VAL 25 H VAL 25 -0.520 -4.642 -2.112 37 HA VAL 25 HA VAL 25 -0.138 -2.558 -0.124 38 HB VAL 25 HB VAL 25 1.538 -4.043 0.644 39 HG11 VAL 25 1HG1 VAL 25 2.523 -4.301 -2.192 40 HG12 VAL 25 2HG1 VAL 25 1.616 -5.527 -1.308 41 HG13 VAL 25 3HG1 VAL 25 3.229 -5.061 -0.766 42 HG21 VAL 25 1HG2 VAL 25 3.637 -2.797 0.080 43 HG22 VAL 25 2HG2 VAL 25 2.286 -1.775 0.572 44 HG23 VAL 25 3HG2 VAL 25 2.711 -1.907 -1.134 45 H LEU 26 H LEU 26 0.134 -0.682 -0.953 46 HA LEU 26 HA LEU 26 0.902 -0.423 -3.780 47 HB2 LEU 26 1HB LEU 26 -0.993 1.153 -2.067 48 HB3 LEU 26 2HB LEU 26 -0.245 1.866 -3.475 49 HG LEU 26 HG LEU 26 -1.298 0.095 -4.876 50 HD11 LEU 26 1HD1 LEU 26 -2.747 -0.609 -2.341 51 HD12 LEU 26 2HD1 LEU 26 -1.585 -1.628 -3.189 52 HD13 LEU 26 3HD1 LEU 26 -3.121 -1.217 -3.953 53 HD21 LEU 26 1HD2 LEU 26 -3.151 1.765 -3.201 54 HD22 LEU 26 2HD2 LEU 26 -3.568 1.009 -4.738 55 HD23 LEU 26 3HD2 LEU 26 -2.331 2.264 -4.679 56 H ILE 27 H ILE 27 2.043 1.631 -4.240 57 HA ILE 27 HA ILE 27 3.397 2.840 -1.971 58 HB ILE 27 HB ILE 27 4.870 0.988 -2.447 59 HG12 ILE 27 1HG1 ILE 27 6.003 3.526 -3.653 60 HG13 ILE 27 2HG1 ILE 27 5.925 3.163 -1.932 61 HG21 ILE 27 1HG2 ILE 27 5.848 0.600 -4.639 62 HG22 ILE 27 2HG2 ILE 27 4.926 1.948 -5.303 63 HG23 ILE 27 3HG2 ILE 27 4.085 0.511 -4.718 64 HD11 ILE 27 1HD1 ILE 27 8.153 2.787 -2.836 65 HD12 ILE 27 2HD1 ILE 27 7.497 1.617 -3.981 66 HD13 ILE 27 3HD1 ILE 27 7.436 1.286 -2.250 67 H LEU 28 H LEU 28 3.501 5.009 -2.305 68 HA LEU 28 HA LEU 28 3.893 5.846 -5.109 69 HB2 LEU 28 1HB LEU 28 1.670 6.431 -3.706 70 HB3 LEU 28 2HB LEU 28 2.691 7.759 -3.189 71 HG LEU 28 HG LEU 28 3.047 8.347 -5.589 72 HD11 LEU 28 1HD1 LEU 28 2.645 6.365 -6.754 73 HD12 LEU 28 2HD1 LEU 28 1.234 7.364 -7.117 74 HD13 LEU 28 3HD1 LEU 28 1.121 6.076 -5.918 75 HD21 LEU 28 1HD2 LEU 28 0.892 9.393 -5.880 76 HD22 LEU 28 2HD2 LEU 28 1.358 9.469 -4.180 77 HD23 LEU 28 3HD2 LEU 28 0.163 8.288 -4.715 78 H SER 29 H SER 29 6.102 5.486 -4.443 79 HA SER 29 HA SER 29 7.252 8.070 -3.813 80 HB2 SER 29 1HB SER 29 7.241 6.536 -1.702 81 HB3 SER 29 2HB SER 29 8.447 5.591 -2.567 82 HG SER 29 HG SER 29 8.891 8.338 -2.463 83 H ASN 30 H ASN 30 7.828 8.187 -6.083 84 HA ASN 30 HA ASN 30 8.848 5.722 -7.214 85 HB2 ASN 30 1HB ASN 30 8.349 8.405 -8.511 86 HB3 ASN 30 2HB ASN 30 8.836 6.944 -9.366 87 HD21 ASN 30 1HD2 ASN 30 7.377 5.221 -9.527 88 HD22 ASN 30 2HD2 ASN 30 5.679 5.441 -9.274 89 H ASP 31 H ASP 31 10.746 5.590 -6.000 90 HA ASP 31 HA ASP 31 12.915 6.914 -7.475 91 HB2 ASP 31 1HB ASP 31 13.184 7.432 -5.138 92 HB3 ASP 31 2HB ASP 31 12.921 5.758 -4.679 93 H LYS 32 H LYS 32 14.413 5.495 -8.510 94 HA LYS 32 HA LYS 32 13.263 3.111 -9.420 95 HB2 LYS 32 1HB LYS 32 16.035 4.230 -9.608 96 HB3 LYS 32 2HB LYS 32 15.708 2.592 -10.158 97 HG2 LYS 32 1HG LYS 32 15.613 4.115 -12.018 98 HG3 LYS 32 2HG LYS 32 14.009 3.461 -11.702 99 HD2 LYS 32 1HD LYS 32 13.453 5.538 -10.471 100 HD3 LYS 32 2HD LYS 32 15.033 6.186 -10.914 101 HE2 LYS 32 1HE LYS 32 14.465 6.038 -13.267 102 HE3 LYS 32 2HE LYS 32 12.914 5.301 -12.869 103 HZ1 LYS 32 1HZ LYS 32 13.773 8.050 -12.144 104 HZ2 LYS 32 2HZ LYS 32 12.299 7.343 -11.718 105 HZ3 LYS 32 3HZ LYS 32 12.651 7.641 -13.342 106 H LYS 33 H LYS 33 16.109 3.405 -7.256 107 HA LYS 33 HA LYS 33 16.225 0.591 -6.879 108 HB2 LYS 33 1HB LYS 33 17.944 1.087 -5.174 109 HB3 LYS 33 2HB LYS 33 18.250 1.884 -6.708 110 HG2 LYS 33 1HG LYS 33 17.219 3.952 -5.716 111 HG3 LYS 33 2HG LYS 33 17.230 3.114 -4.165 112 HD2 LYS 33 1HD LYS 33 19.650 3.669 -5.881 113 HD3 LYS 33 2HD LYS 33 19.188 4.571 -4.438 114 HE2 LYS 33 1HE LYS 33 19.826 1.624 -4.493 115 HE3 LYS 33 2HE LYS 33 20.965 2.889 -4.036 116 HZ1 LYS 33 1HZ LYS 33 19.541 3.484 -2.202 117 HZ2 LYS 33 2HZ LYS 33 19.918 1.841 -2.113 118 HZ3 LYS 33 3HZ LYS 33 18.396 2.330 -2.660 119 H LEU 34 H LEU 34 14.741 3.217 -5.094 120 HA LEU 34 HA LEU 34 14.036 1.883 -2.744 121 HB2 LEU 34 1HB LEU 34 13.622 4.216 -2.921 122 HB3 LEU 34 2HB LEU 34 12.657 4.000 -4.365 123 HG LEU 34 HG LEU 34 10.902 2.915 -3.009 124 HD11 LEU 34 1HD1 LEU 34 12.635 3.678 -0.690 125 HD12 LEU 34 2HD1 LEU 34 12.209 2.042 -1.202 126 HD13 LEU 34 3HD1 LEU 34 10.962 3.129 -0.585 127 HD21 LEU 34 1HD2 LEU 34 10.177 4.967 -1.847 128 HD22 LEU 34 2HD2 LEU 34 10.710 5.253 -3.503 129 HD23 LEU 34 3HD2 LEU 34 11.769 5.658 -2.152 130 H ILE 35 H ILE 35 12.168 2.198 -5.751 131 HA ILE 35 HA ILE 35 10.028 0.569 -4.998 132 HB ILE 35 HB ILE 35 11.138 1.274 -7.710 133 HG12 ILE 35 1HG1 ILE 35 8.654 2.163 -6.228 134 HG13 ILE 35 2HG1 ILE 35 10.141 3.094 -6.382 135 HG21 ILE 35 1HG2 ILE 35 10.019 -0.874 -7.921 136 HG22 ILE 35 2HG2 ILE 35 9.079 0.399 -8.697 137 HG23 ILE 35 3HG2 ILE 35 8.589 -0.223 -7.121 138 HD11 ILE 35 1HD1 ILE 35 9.824 3.229 -8.781 139 HD12 ILE 35 2HD1 ILE 35 8.416 3.857 -7.925 140 HD13 ILE 35 3HD1 ILE 35 8.363 2.253 -8.656 141 H GLU 36 H GLU 36 13.058 -0.233 -6.654 142 HA GLU 36 HA GLU 36 12.405 -2.904 -7.237 143 HB2 GLU 36 1HB GLU 36 15.104 -1.619 -6.821 144 HB3 GLU 36 2HB GLU 36 14.861 -3.235 -7.468 145 HG2 GLU 36 1HG GLU 36 13.501 -2.199 -9.296 146 HG3 GLU 36 2HG GLU 36 14.009 -0.626 -8.690 147 H GLU 37 H GLU 37 14.274 -1.556 -4.504 148 HA GLU 37 HA GLU 37 14.703 -4.080 -3.288 149 HB2 GLU 37 1HB GLU 37 14.836 -1.290 -2.147 150 HB3 GLU 37 2HB GLU 37 15.339 -2.732 -1.277 151 HG2 GLU 37 1HG GLU 37 16.523 -1.677 -3.833 152 HG3 GLU 37 2HG GLU 37 17.253 -1.616 -2.230 153 H ALA 38 H ALA 38 12.196 -1.633 -2.922 154 HA ALA 38 HA ALA 38 10.954 -2.801 -0.650 155 HB1 ALA 38 1HB ALA 38 10.555 -0.477 -1.301 156 HB2 ALA 38 2HB ALA 38 9.044 -1.382 -1.192 157 HB3 ALA 38 3HB ALA 38 9.746 -1.026 -2.769 158 H ARG 39 H ARG 39 10.429 -3.120 -4.141 159 HA ARG 39 HA ARG 39 8.199 -4.827 -3.967 160 HB2 ARG 39 1HB ARG 39 8.642 -3.771 -6.057 161 HB3 ARG 39 2HB ARG 39 10.258 -4.457 -6.134 162 HG2 ARG 39 1HG ARG 39 9.378 -6.657 -6.490 163 HG3 ARG 39 2HG ARG 39 7.718 -6.098 -6.239 164 HD2 ARG 39 1HD ARG 39 8.242 -6.352 -8.625 165 HD3 ARG 39 2HD ARG 39 7.919 -4.666 -8.220 166 HE ARG 39 HE ARG 39 10.693 -5.611 -8.308 167 HH11 ARG 39 1HH1 ARG 39 8.152 -3.658 -9.717 168 HH12 ARG 39 2HH1 ARG 39 9.241 -2.701 -10.666 169 HH21 ARG 39 1HH2 ARG 39 12.123 -4.362 -9.558 170 HH22 ARG 39 2HH2 ARG 39 11.506 -3.106 -10.580 171 H LYS 40 H LYS 40 11.681 -5.538 -4.203 172 HA LYS 40 HA LYS 40 11.535 -8.292 -4.464 173 HB2 LYS 40 1HB LYS 40 13.546 -6.611 -2.967 174 HB3 LYS 40 2HB LYS 40 13.759 -8.327 -3.292 175 HG2 LYS 40 1HG LYS 40 13.805 -7.945 -5.644 176 HG3 LYS 40 2HG LYS 40 13.347 -6.256 -5.433 177 HD2 LYS 40 1HD LYS 40 15.459 -5.859 -4.235 178 HD3 LYS 40 2HD LYS 40 15.916 -7.541 -4.516 179 HE2 LYS 40 1HE LYS 40 15.303 -5.550 -6.694 180 HE3 LYS 40 2HE LYS 40 16.925 -5.932 -6.126 181 HZ1 LYS 40 1HZ LYS 40 16.605 -8.212 -6.812 182 HZ2 LYS 40 2HZ LYS 40 16.332 -7.180 -8.121 183 HZ3 LYS 40 3HZ LYS 40 15.026 -7.880 -7.312 184 H MET 41 H MET 41 11.145 -6.316 -1.597 185 HA MET 41 HA MET 41 11.128 -8.451 0.266 186 HB2 MET 41 1HB MET 41 11.650 -6.105 0.820 187 HB3 MET 41 2HB MET 41 9.991 -5.659 0.449 188 HG2 MET 41 1HG MET 41 10.301 -5.819 2.804 189 HG3 MET 41 2HG MET 41 9.211 -7.091 2.266 190 HE1 MET 41 1HE MET 41 10.623 -7.058 5.123 191 HE2 MET 41 2HE MET 41 11.110 -8.746 5.272 192 HE3 MET 41 3HE MET 41 9.532 -8.339 4.594 193 H ALA 42 H ALA 42 8.513 -6.455 -1.142 194 HA ALA 42 HA ALA 42 6.468 -7.941 0.210 195 HB1 ALA 42 1HB ALA 42 4.909 -6.525 -1.014 196 HB2 ALA 42 2HB ALA 42 6.233 -5.917 -2.009 197 HB3 ALA 42 3HB ALA 42 6.197 -5.574 -0.279 198 H GLU 43 H GLU 43 7.878 -8.031 -2.981 199 HA GLU 43 HA GLU 43 5.878 -9.442 -4.338 200 HB2 GLU 43 1HB GLU 43 7.964 -8.258 -5.260 201 HB3 GLU 43 2HB GLU 43 8.821 -9.744 -4.887 202 HG2 GLU 43 1HG GLU 43 6.356 -9.872 -6.552 203 HG3 GLU 43 2HG GLU 43 7.857 -9.299 -7.273 204 H LYS 44 H LYS 44 8.731 -10.522 -2.533 205 HA LYS 44 HA LYS 44 8.102 -13.310 -2.860 206 HB2 LYS 44 1HB LYS 44 10.235 -11.772 -1.453 207 HB3 LYS 44 2HB LYS 44 9.944 -13.434 -0.967 208 HG2 LYS 44 1HG LYS 44 11.714 -13.383 -2.579 209 HG3 LYS 44 2HG LYS 44 10.300 -14.146 -3.304 210 HD2 LYS 44 1HD LYS 44 9.758 -12.028 -4.430 211 HD3 LYS 44 2HD LYS 44 11.200 -11.294 -3.725 212 HE2 LYS 44 1HE LYS 44 11.146 -13.656 -5.602 213 HE3 LYS 44 2HE LYS 44 11.598 -12.007 -6.030 214 HZ1 LYS 44 1HZ LYS 44 13.529 -13.422 -5.636 215 HZ2 LYS 44 2HZ LYS 44 13.020 -13.708 -4.051 216 HZ3 LYS 44 3HZ LYS 44 13.467 -12.147 -4.529 217 H ALA 45 H ALA 45 7.237 -10.834 -0.645 218 HA ALA 45 HA ALA 45 6.599 -12.563 1.554 219 HB1 ALA 45 1HB ALA 45 5.602 -10.610 2.577 220 HB2 ALA 45 2HB ALA 45 5.672 -9.741 1.044 221 HB3 ALA 45 3HB ALA 45 7.163 -10.185 1.875 222 H ASN 46 H ASN 46 5.302 -12.349 -1.383 223 HA ASN 46 HA ASN 46 3.386 -13.002 -2.371 224 HB2 ASN 46 1HB ASN 46 2.722 -14.105 0.365 225 HB3 ASN 46 2HB ASN 46 1.808 -14.442 -1.103 226 HD21 ASN 46 1HD2 ASN 46 4.617 -15.151 0.736 227 HD22 ASN 46 2HD2 ASN 46 5.223 -16.415 -0.277 228 H LEU 47 H LEU 47 3.625 -10.396 -1.230 229 HA LEU 47 HA LEU 47 0.859 -9.749 -0.543 230 HB2 LEU 47 1HB LEU 47 3.311 -7.988 -0.705 231 HB3 LEU 47 2HB LEU 47 1.725 -7.474 -0.171 232 HG LEU 47 HG LEU 47 3.453 -9.514 1.230 233 HD11 LEU 47 1HD1 LEU 47 2.823 -6.651 1.935 234 HD12 LEU 47 2HD1 LEU 47 4.379 -7.266 1.378 235 HD13 LEU 47 3HD1 LEU 47 3.733 -7.784 2.934 236 HD21 LEU 47 1HD2 LEU 47 1.085 -9.942 1.572 237 HD22 LEU 47 2HD2 LEU 47 0.828 -8.256 2.022 238 HD23 LEU 47 3HD2 LEU 47 1.814 -9.301 3.044 239 H ILE 48 H ILE 48 -0.464 -8.592 -1.906 240 HA ILE 48 HA ILE 48 0.279 -8.595 -4.689 241 HB ILE 48 HB ILE 48 -2.240 -7.548 -3.380 242 HG12 ILE 48 1HG1 ILE 48 -1.646 -10.191 -4.737 243 HG13 ILE 48 2HG1 ILE 48 -1.897 -9.953 -3.011 244 HG21 ILE 48 1HG2 ILE 48 -1.618 -8.132 -6.275 245 HG22 ILE 48 2HG2 ILE 48 -1.882 -6.542 -5.563 246 HG23 ILE 48 3HG2 ILE 48 -3.206 -7.705 -5.641 247 HD11 ILE 48 1HD1 ILE 48 -4.199 -9.276 -3.444 248 HD12 ILE 48 2HD1 ILE 48 -3.864 -10.889 -4.072 249 HD13 ILE 48 3HD1 ILE 48 -3.942 -9.513 -5.172 250 H LEU 49 H LEU 49 1.901 -7.161 -4.946 251 HA LEU 49 HA LEU 49 1.648 -4.447 -3.946 252 HB2 LEU 49 1HB LEU 49 3.782 -5.558 -3.675 253 HB3 LEU 49 2HB LEU 49 3.871 -5.886 -5.394 254 HG LEU 49 HG LEU 49 4.027 -3.433 -5.809 255 HD11 LEU 49 1HD1 LEU 49 4.316 -3.266 -2.815 256 HD12 LEU 49 2HD1 LEU 49 2.954 -2.654 -3.753 257 HD13 LEU 49 3HD1 LEU 49 4.557 -1.948 -3.960 258 HD21 LEU 49 1HD2 LEU 49 6.343 -3.229 -5.061 259 HD22 LEU 49 2HD2 LEU 49 6.016 -4.828 -5.732 260 HD23 LEU 49 3HD2 LEU 49 6.117 -4.607 -3.985 261 H ILE 50 H ILE 50 1.122 -2.734 -5.121 262 HA ILE 50 HA ILE 50 1.151 -2.995 -8.058 263 HB ILE 50 HB ILE 50 -0.757 -1.220 -6.531 264 HG12 ILE 50 1HG1 ILE 50 -1.329 -3.936 -7.752 265 HG13 ILE 50 2HG1 ILE 50 -1.193 -3.622 -6.025 266 HG21 ILE 50 1HG2 ILE 50 -0.269 -0.553 -8.828 267 HG22 ILE 50 2HG2 ILE 50 -1.930 -1.124 -8.681 268 HG23 ILE 50 3HG2 ILE 50 -0.701 -2.165 -9.397 269 HD11 ILE 50 1HD1 ILE 50 -3.513 -3.760 -6.715 270 HD12 ILE 50 2HD1 ILE 50 -3.260 -2.458 -7.878 271 HD13 ILE 50 3HD1 ILE 50 -3.126 -2.134 -6.150 272 H THR 51 H THR 51 3.027 -2.007 -8.519 273 HA THR 51 HA THR 51 3.873 0.382 -7.156 274 HB THR 51 HB THR 51 5.718 0.271 -8.958 275 HG1 THR 51 HG1 THR 51 5.301 -1.162 -10.456 276 HG21 THR 51 1HG2 THR 51 6.076 -0.423 -6.650 277 HG22 THR 51 2HG2 THR 51 6.881 -1.537 -7.756 278 HG23 THR 51 3HG2 THR 51 5.356 -1.996 -6.995 279 H VAL 52 H VAL 52 3.086 2.319 -7.652 280 HA VAL 52 HA VAL 52 2.363 2.864 -10.454 281 HB VAL 52 HB VAL 52 0.643 4.473 -9.473 282 HG11 VAL 52 1HG1 VAL 52 0.232 1.521 -9.002 283 HG12 VAL 52 2HG1 VAL 52 0.018 2.358 -10.539 284 HG13 VAL 52 3HG1 VAL 52 -1.041 2.730 -9.178 285 HG21 VAL 52 1HG2 VAL 52 1.549 4.473 -7.189 286 HG22 VAL 52 2HG2 VAL 52 1.096 2.777 -7.023 287 HG23 VAL 52 3HG2 VAL 52 -0.150 4.006 -7.228 288 H GLY 53 H GLY 53 2.382 5.212 -10.996 289 HA2 GLY 53 1HA GLY 53 4.084 6.817 -9.223 290 HA3 GLY 53 2HA GLY 53 4.566 6.607 -10.900 291 H ASP 54 H ASP 54 2.523 8.181 -8.698 292 HA ASP 54 HA ASP 54 1.982 10.538 -9.397 293 HB2 ASP 54 1HB ASP 54 1.664 9.857 -11.825 294 HB3 ASP 54 2HB ASP 54 0.141 9.123 -11.339 295 H GLU 55 H GLU 55 0.023 11.478 -8.518 296 HA GLU 55 HA GLU 55 -0.982 9.920 -6.408 297 HB2 GLU 55 1HB GLU 55 -0.853 12.539 -6.781 298 HB3 GLU 55 2HB GLU 55 -2.503 12.306 -7.349 299 HG2 GLU 55 1HG GLU 55 -3.048 11.206 -5.214 300 HG3 GLU 55 2HG GLU 55 -1.407 11.543 -4.662 301 H GLU 56 H GLU 56 -2.385 10.836 -9.527 302 HA GLU 56 HA GLU 56 -4.913 9.639 -9.004 303 HB2 GLU 56 1HB GLU 56 -3.605 10.429 -11.605 304 HB3 GLU 56 2HB GLU 56 -5.275 9.898 -11.454 305 HG2 GLU 56 1HG GLU 56 -5.717 11.792 -9.951 306 HG3 GLU 56 2HG GLU 56 -4.057 12.337 -10.181 307 H GLU 57 H GLU 57 -1.898 8.489 -10.352 308 HA GLU 57 HA GLU 57 -2.816 6.051 -11.424 309 HB2 GLU 57 1HB GLU 57 -0.147 6.846 -10.257 310 HB3 GLU 57 2HB GLU 57 -0.439 5.281 -10.999 311 HG2 GLU 57 1HG GLU 57 -0.921 7.858 -12.454 312 HG3 GLU 57 2HG GLU 57 0.650 7.058 -12.438 313 H LEU 58 H LEU 58 -1.692 6.947 -8.188 314 HA LEU 58 HA LEU 58 -1.965 4.435 -6.941 315 HB2 LEU 58 1HB LEU 58 -0.907 6.516 -5.970 316 HB3 LEU 58 2HB LEU 58 -2.516 7.114 -5.673 317 HG LEU 58 HG LEU 58 -2.915 5.069 -4.254 318 HD11 LEU 58 1HD1 LEU 58 -1.004 3.846 -3.429 319 HD12 LEU 58 2HD1 LEU 58 0.080 4.799 -4.441 320 HD13 LEU 58 3HD1 LEU 58 -1.088 3.707 -5.185 321 HD21 LEU 58 1HD2 LEU 58 -2.444 7.265 -3.291 322 HD22 LEU 58 2HD2 LEU 58 -0.714 6.935 -3.381 323 HD23 LEU 58 3HD2 LEU 58 -1.741 5.970 -2.322 324 H LYS 59 H LYS 59 -4.203 7.054 -7.537 325 HA LYS 59 HA LYS 59 -6.250 6.205 -5.885 326 HB2 LYS 59 1HB LYS 59 -5.949 8.459 -7.049 327 HB3 LYS 59 2HB LYS 59 -6.704 7.698 -8.442 328 HG2 LYS 59 1HG LYS 59 -8.725 7.302 -7.187 329 HG3 LYS 59 2HG LYS 59 -7.970 7.928 -5.720 330 HD2 LYS 59 1HD LYS 59 -9.311 9.683 -6.583 331 HD3 LYS 59 2HD LYS 59 -7.640 10.101 -6.960 332 HE2 LYS 59 1HE LYS 59 -8.977 10.562 -8.891 333 HE3 LYS 59 2HE LYS 59 -7.983 9.149 -9.235 334 HZ1 LYS 59 1HZ LYS 59 -10.847 9.115 -8.452 335 HZ2 LYS 59 2HZ LYS 59 -9.898 7.745 -8.735 336 HZ3 LYS 59 3HZ LYS 59 -10.233 8.813 -10.000 337 H LYS 60 H LYS 60 -5.266 5.131 -8.950 338 HA LYS 60 HA LYS 60 -7.740 3.712 -9.478 339 HB2 LYS 60 1HB LYS 60 -5.159 3.864 -11.035 340 HB3 LYS 60 2HB LYS 60 -6.670 3.160 -11.607 341 HG2 LYS 60 1HG LYS 60 -7.762 5.251 -11.604 342 HG3 LYS 60 2HG LYS 60 -6.448 6.008 -10.680 343 HD2 LYS 60 1HD LYS 60 -4.977 5.875 -12.565 344 HD3 LYS 60 2HD LYS 60 -6.099 4.843 -13.452 345 HE2 LYS 60 1HE LYS 60 -6.680 7.687 -12.638 346 HE3 LYS 60 2HE LYS 60 -6.069 7.212 -14.221 347 HZ1 LYS 60 1HZ LYS 60 -8.055 5.905 -14.575 348 HZ2 LYS 60 2HZ LYS 60 -8.477 7.501 -14.216 349 HZ3 LYS 60 3HZ LYS 60 -8.637 6.303 -13.037 350 H ALA 61 H ALA 61 -4.399 3.050 -8.565 351 HA ALA 61 HA ALA 61 -4.495 0.242 -8.705 352 HB1 ALA 61 1HB ALA 61 -2.881 2.034 -6.884 353 HB2 ALA 61 2HB ALA 61 -2.393 1.431 -8.468 354 HB3 ALA 61 3HB ALA 61 -2.595 0.311 -7.123 355 H ILE 62 H ILE 62 -5.304 2.542 -6.166 356 HA ILE 62 HA ILE 62 -5.998 0.773 -4.117 357 HB ILE 62 HB ILE 62 -7.178 3.478 -4.786 358 HG12 ILE 62 1HG1 ILE 62 -5.096 2.714 -2.730 359 HG13 ILE 62 2HG1 ILE 62 -4.723 3.401 -4.308 360 HG21 ILE 62 1HG2 ILE 62 -7.922 3.543 -2.439 361 HG22 ILE 62 2HG2 ILE 62 -7.410 1.864 -2.249 362 HG23 ILE 62 3HG2 ILE 62 -8.716 2.268 -3.365 363 HD11 ILE 62 1HD1 ILE 62 -6.314 4.731 -2.129 364 HD12 ILE 62 2HD1 ILE 62 -5.956 5.422 -3.710 365 HD13 ILE 62 3HD1 ILE 62 -4.646 5.090 -2.576 366 H LYS 63 H LYS 63 -7.966 2.086 -6.758 367 HA LYS 63 HA LYS 63 -10.409 0.951 -5.905 368 HB2 LYS 63 1HB LYS 63 -10.225 2.857 -7.487 369 HB3 LYS 63 2HB LYS 63 -9.608 1.750 -8.706 370 HG2 LYS 63 1HG LYS 63 -11.734 0.465 -8.512 371 HG3 LYS 63 2HG LYS 63 -12.342 1.737 -7.454 372 HD2 LYS 63 1HD LYS 63 -13.150 2.146 -9.673 373 HD3 LYS 63 2HD LYS 63 -11.936 3.368 -9.291 374 HE2 LYS 63 1HE LYS 63 -10.288 2.236 -10.607 375 HE3 LYS 63 2HE LYS 63 -11.350 0.848 -10.836 376 HZ1 LYS 63 1HZ LYS 63 -11.305 2.264 -12.791 377 HZ2 LYS 63 2HZ LYS 63 -11.835 3.585 -11.879 378 HZ3 LYS 63 3HZ LYS 63 -12.850 2.251 -12.102 379 H LYS 64 H LYS 64 -7.941 -0.145 -8.199 380 HA LYS 64 HA LYS 64 -9.421 -2.390 -9.117 381 HB2 LYS 64 1HB LYS 64 -6.440 -1.897 -9.199 382 HB3 LYS 64 2HB LYS 64 -7.300 -3.123 -10.122 383 HG2 LYS 64 1HG LYS 64 -8.524 -1.389 -11.311 384 HG3 LYS 64 2HG LYS 64 -7.701 -0.148 -10.367 385 HD2 LYS 64 1HD LYS 64 -6.393 -0.135 -12.234 386 HD3 LYS 64 2HD LYS 64 -5.551 -1.368 -11.298 387 HE2 LYS 64 1HE LYS 64 -7.617 -1.889 -13.434 388 HE3 LYS 64 2HE LYS 64 -5.874 -2.027 -13.644 389 HZ1 LYS 64 1HZ LYS 64 -6.801 -4.179 -13.269 390 HZ2 LYS 64 2HZ LYS 64 -7.579 -3.670 -11.859 391 HZ3 LYS 64 3HZ LYS 64 -5.891 -3.755 -11.909 392 H ALA 65 H ALA 65 -7.309 -1.846 -6.405 393 HA ALA 65 HA ALA 65 -6.791 -4.549 -5.753 394 HB1 ALA 65 1HB ALA 65 -6.920 -2.153 -3.923 395 HB2 ALA 65 2HB ALA 65 -5.499 -2.689 -4.817 396 HB3 ALA 65 3HB ALA 65 -6.178 -3.706 -3.547 397 H ASP 66 H ASP 66 -9.445 -2.367 -5.076 398 HA ASP 66 HA ASP 66 -10.790 -3.882 -3.131 399 HB2 ASP 66 1HB ASP 66 -11.356 -1.532 -3.703 400 HB3 ASP 66 2HB ASP 66 -12.000 -2.080 -5.246 401 H ASP 67 H ASP 67 -10.970 -3.907 -6.663 402 HA ASP 67 HA ASP 67 -13.027 -5.773 -6.970 403 HB2 ASP 67 1HB ASP 67 -10.742 -4.910 -8.698 404 HB3 ASP 67 2HB ASP 67 -11.700 -6.305 -9.180 405 H ILE 68 H ILE 68 -9.580 -6.226 -6.427 406 HA ILE 68 HA ILE 68 -9.644 -9.057 -6.875 407 HB ILE 68 HB ILE 68 -7.578 -7.475 -5.344 408 HG12 ILE 68 1HG1 ILE 68 -7.625 -8.134 -8.298 409 HG13 ILE 68 2HG1 ILE 68 -7.971 -6.548 -7.619 410 HG21 ILE 68 1HG2 ILE 68 -7.400 -9.870 -5.014 411 HG22 ILE 68 2HG2 ILE 68 -6.070 -9.305 -6.027 412 HG23 ILE 68 3HG2 ILE 68 -7.443 -10.138 -6.758 413 HD11 ILE 68 1HD1 ILE 68 -5.354 -8.025 -7.437 414 HD12 ILE 68 2HD1 ILE 68 -5.695 -6.449 -6.722 415 HD13 ILE 68 3HD1 ILE 68 -5.712 -6.645 -8.474 416 H ALA 69 H ALA 69 -9.794 -6.922 -4.078 417 HA ALA 69 HA ALA 69 -9.681 -8.880 -2.062 418 HB1 ALA 69 1HB ALA 69 -11.090 -6.212 -1.985 419 HB2 ALA 69 2HB ALA 69 -9.377 -6.471 -1.657 420 HB3 ALA 69 3HB ALA 69 -10.594 -7.177 -0.594 421 H LYS 70 H LYS 70 -12.480 -7.247 -3.520 422 HA LYS 70 HA LYS 70 -14.483 -8.608 -2.105 423 HB2 LYS 70 1HB LYS 70 -14.578 -7.501 -4.912 424 HB3 LYS 70 2HB LYS 70 -15.982 -7.885 -3.931 425 HG2 LYS 70 1HG LYS 70 -13.952 -5.872 -3.029 426 HG3 LYS 70 2HG LYS 70 -15.272 -5.434 -4.114 427 HD2 LYS 70 1HD LYS 70 -16.904 -6.095 -2.487 428 HD3 LYS 70 2HD LYS 70 -15.655 -6.757 -1.435 429 HE2 LYS 70 1HE LYS 70 -16.423 -4.584 -0.635 430 HE3 LYS 70 2HE LYS 70 -14.729 -4.528 -1.112 431 HZ1 LYS 70 1HZ LYS 70 -15.296 -3.419 -3.125 432 HZ2 LYS 70 2HZ LYS 70 -16.076 -2.599 -1.857 433 HZ3 LYS 70 3HZ LYS 70 -16.957 -3.641 -2.857 434 H LYS 71 H LYS 71 -12.673 -9.488 -4.927 435 HA LYS 71 HA LYS 71 -14.280 -11.475 -5.999 436 HB2 LYS 71 1HB LYS 71 -12.269 -10.627 -7.102 437 HB3 LYS 71 2HB LYS 71 -11.264 -11.340 -5.850 438 HG2 LYS 71 1HG LYS 71 -11.947 -13.569 -6.549 439 HG3 LYS 71 2HG LYS 71 -12.996 -12.867 -7.782 440 HD2 LYS 71 1HD LYS 71 -10.900 -13.611 -8.770 441 HD3 LYS 71 2HD LYS 71 -11.037 -11.856 -8.861 442 HE2 LYS 71 1HE LYS 71 -9.587 -11.642 -6.899 443 HE3 LYS 71 2HE LYS 71 -9.457 -13.397 -6.802 444 HZ1 LYS 71 1HZ LYS 71 -8.507 -11.695 -9.041 445 HZ2 LYS 71 2HZ LYS 71 -8.424 -13.383 -9.000 446 HZ3 LYS 71 3HZ LYS 71 -7.537 -12.468 -7.890 447 H GLN 72 H GLN 72 -12.006 -11.596 -3.293 448 HA GLN 72 HA GLN 72 -12.970 -14.335 -2.791 449 HB2 GLN 72 1HB GLN 72 -10.681 -14.851 -1.867 450 HB3 GLN 72 2HB GLN 72 -10.788 -14.655 -3.609 451 HG2 GLN 72 1HG GLN 72 -9.743 -12.553 -3.547 452 HG3 GLN 72 2HG GLN 72 -9.957 -12.409 -1.804 453 HE21 GLN 72 1HE2 GLN 72 -8.106 -13.880 -4.355 454 HE22 GLN 72 2HE2 GLN 72 -6.798 -14.414 -3.362 455 H ASN 73 H ASN 73 -11.431 -11.533 -1.139 456 HA ASN 73 HA ASN 73 -12.259 -12.813 1.359 457 HB2 ASN 73 1HB ASN 73 -9.618 -11.813 0.547 458 HB3 ASN 73 2HB ASN 73 -10.092 -11.482 2.208 459 HD21 ASN 73 1HD2 ASN 73 -11.227 -14.321 0.528 460 HD22 ASN 73 2HD2 ASN 73 -10.278 -15.458 1.420 461 H SER 74 H SER 74 -13.447 -10.378 -0.129 462 HA SER 74 HA SER 74 -12.760 -8.080 1.312 463 HB2 SER 74 1HB SER 74 -15.059 -7.262 0.504 464 HB3 SER 74 2HB SER 74 -13.824 -7.670 -0.688 465 HG SER 74 HG SER 74 -16.176 -9.040 0.005 466 H SER 75 H SER 75 -14.401 -10.716 2.607 467 HA SER 75 HA SER 75 -16.122 -9.489 4.437 468 HB2 SER 75 1HB SER 75 -14.319 -11.881 4.900 469 HB3 SER 75 2HB SER 75 -15.742 -11.460 5.853 470 HG SER 75 HG SER 75 -16.868 -11.582 3.711 471 H GLU 76 H GLU 76 -12.651 -9.830 4.344 472 HA GLU 76 HA GLU 76 -12.315 -7.415 5.788 473 HB2 GLU 76 1HB GLU 76 -12.576 -8.942 7.720 474 HB3 GLU 76 2HB GLU 76 -11.242 -9.917 7.113 475 HG2 GLU 76 1HG GLU 76 -9.708 -8.086 7.405 476 HG3 GLU 76 2HG GLU 76 -11.024 -7.015 7.879 477 H ALA 77 H ALA 77 -11.076 -6.599 4.233 478 HA ALA 77 HA ALA 77 -8.612 -8.065 3.548 479 HB1 ALA 77 1HB ALA 77 -8.636 -6.927 1.385 480 HB2 ALA 77 2HB ALA 77 -10.139 -6.113 1.820 481 HB3 ALA 77 3HB ALA 77 -10.111 -7.865 1.618 482 H LYS 78 H LYS 78 -6.697 -6.779 3.323 483 HA LYS 78 HA LYS 78 -6.903 -4.076 4.427 484 HB2 LYS 78 1HB LYS 78 -4.967 -6.161 5.449 485 HB3 LYS 78 2HB LYS 78 -5.022 -4.478 5.953 486 HG2 LYS 78 1HG LYS 78 -7.419 -4.944 6.680 487 HG3 LYS 78 2HG LYS 78 -7.025 -6.649 6.480 488 HD2 LYS 78 1HD LYS 78 -5.641 -4.695 8.313 489 HD3 LYS 78 2HD LYS 78 -6.750 -5.978 8.797 490 HE2 LYS 78 1HE LYS 78 -5.168 -7.630 7.833 491 HE3 LYS 78 2HE LYS 78 -4.044 -6.309 7.516 492 HZ1 LYS 78 1HZ LYS 78 -4.941 -7.360 10.126 493 HZ2 LYS 78 2HZ LYS 78 -4.246 -5.829 9.979 494 HZ3 LYS 78 3HZ LYS 78 -3.356 -7.199 9.536 495 H ILE 79 H ILE 79 -5.438 -2.645 3.673 496 HA ILE 79 HA ILE 79 -3.545 -3.629 1.636 497 HB ILE 79 HB ILE 79 -5.139 -1.056 1.496 498 HG12 ILE 79 1HG1 ILE 79 -5.510 -3.608 -0.088 499 HG13 ILE 79 2HG1 ILE 79 -6.585 -3.022 1.180 500 HG21 ILE 79 1HG2 ILE 79 -3.292 -2.355 -0.504 501 HG22 ILE 79 2HG2 ILE 79 -2.994 -0.866 0.390 502 HG23 ILE 79 3HG2 ILE 79 -4.281 -0.928 -0.814 503 HD11 ILE 79 1HD1 ILE 79 -6.028 -1.646 -1.439 504 HD12 ILE 79 2HD1 ILE 79 -7.106 -1.062 -0.170 505 HD13 ILE 79 3HD1 ILE 79 -7.480 -2.558 -1.026 506 H LEU 80 H LEU 80 -1.523 -2.694 1.675 507 HA LEU 80 HA LEU 80 -1.034 -0.649 3.747 508 HB2 LEU 80 1HB LEU 80 0.224 -2.985 3.495 509 HB3 LEU 80 2HB LEU 80 1.156 -2.094 2.305 510 HG LEU 80 HG LEU 80 0.950 -1.530 5.264 511 HD11 LEU 80 1HD1 LEU 80 3.337 -1.973 5.239 512 HD12 LEU 80 2HD1 LEU 80 3.279 -2.263 3.501 513 HD13 LEU 80 3HD1 LEU 80 2.438 -3.352 4.605 514 HD21 LEU 80 1HD2 LEU 80 2.347 0.082 3.136 515 HD22 LEU 80 2HD2 LEU 80 2.540 0.304 4.875 516 HD23 LEU 80 3HD2 LEU 80 0.976 0.603 4.113 517 H ILE 81 H ILE 81 -0.631 1.408 3.023 518 HA ILE 81 HA ILE 81 0.271 1.668 0.224 519 HB ILE 81 HB ILE 81 -1.378 3.641 1.818 520 HG12 ILE 81 1HG1 ILE 81 -2.030 2.054 -0.676 521 HG13 ILE 81 2HG1 ILE 81 -2.650 1.716 0.936 522 HG21 ILE 81 1HG2 ILE 81 -1.390 5.009 -0.210 523 HG22 ILE 81 2HG2 ILE 81 -0.307 3.860 -0.995 524 HG23 ILE 81 3HG2 ILE 81 0.250 4.785 0.399 525 HD11 ILE 81 1HD1 ILE 81 -3.174 4.212 -0.664 526 HD12 ILE 81 2HD1 ILE 81 -3.817 3.854 0.939 527 HD13 ILE 81 3HD1 ILE 81 -4.293 2.866 -0.442 528 H LEU 82 H LEU 82 2.394 1.956 0.279 529 HA LEU 82 HA LEU 82 3.588 3.698 2.306 530 HB2 LEU 82 1HB LEU 82 4.814 1.947 0.170 531 HB3 LEU 82 2HB LEU 82 5.743 2.961 1.257 532 HG LEU 82 HG LEU 82 3.961 0.691 2.139 533 HD11 LEU 82 1HD1 LEU 82 5.866 -0.132 0.876 534 HD12 LEU 82 2HD1 LEU 82 6.051 -0.492 2.593 535 HD13 LEU 82 3HD1 LEU 82 6.956 0.835 1.868 536 HD21 LEU 82 1HD2 LEU 82 5.011 0.990 4.295 537 HD22 LEU 82 2HD2 LEU 82 4.257 2.499 3.786 538 HD23 LEU 82 3HD2 LEU 82 6.003 2.303 3.662 539 H LEU 83 H LEU 83 3.182 5.781 1.735 540 HA LEU 83 HA LEU 83 4.070 6.582 -0.957 541 HB2 LEU 83 1HB LEU 83 2.363 8.496 -0.638 542 HB3 LEU 83 2HB LEU 83 1.790 6.917 -1.140 543 HG LEU 83 HG LEU 83 1.119 6.472 1.238 544 HD11 LEU 83 1HD1 LEU 83 1.748 9.391 1.612 545 HD12 LEU 83 2HD1 LEU 83 2.643 8.045 2.315 546 HD13 LEU 83 3HD1 LEU 83 0.966 8.328 2.783 547 HD21 LEU 83 1HD2 LEU 83 -0.496 7.233 -0.421 548 HD22 LEU 83 2HD2 LEU 83 -0.093 8.911 -0.057 549 HD23 LEU 83 3HD2 LEU 83 -0.858 7.901 1.171 550 H GLU 84 H GLU 84 4.960 8.767 -1.115 551 HA GLU 84 HA GLU 84 5.908 9.717 1.492 552 HB2 GLU 84 1HB GLU 84 7.490 11.126 0.169 553 HB3 GLU 84 2HB GLU 84 7.717 9.401 -0.064 554 HG2 GLU 84 1HG GLU 84 6.537 9.520 -2.189 555 HG3 GLU 84 2HG GLU 84 6.269 11.246 -1.951 556 H LYS 85 H LYS 85 4.354 10.891 2.319 557 HA LYS 85 HA LYS 85 3.807 13.492 1.381 558 HB2 LYS 85 1HB LYS 85 2.364 12.027 -0.163 559 HB3 LYS 85 2HB LYS 85 1.419 11.633 1.265 560 HG2 LYS 85 1HG LYS 85 0.841 13.975 1.555 561 HG3 LYS 85 2HG LYS 85 1.837 14.407 0.163 562 HD2 LYS 85 1HD LYS 85 0.397 12.977 -1.258 563 HD3 LYS 85 2HD LYS 85 -0.631 12.666 0.142 564 HE2 LYS 85 1HE LYS 85 -1.052 15.096 0.326 565 HE3 LYS 85 2HE LYS 85 -0.094 15.348 -1.130 566 HZ1 LYS 85 1HZ LYS 85 -2.538 13.671 -1.020 567 HZ2 LYS 85 2HZ LYS 85 -1.674 14.109 -2.409 568 HZ3 LYS 85 3HZ LYS 85 -2.516 15.284 -1.525 569 HA PRO 86 HA PRO 86 2.687 13.603 5.768 570 HB2 PRO 86 1HB PRO 86 1.240 16.080 5.063 571 HB3 PRO 86 2HB PRO 86 2.537 15.836 6.237 572 HG2 PRO 86 1HG PRO 86 2.971 17.137 3.939 573 HG3 PRO 86 2HG PRO 86 4.201 16.077 4.652 574 HD2 PRO 86 1HD PRO 86 2.331 15.546 2.372 575 HD3 PRO 86 2HD PRO 86 4.045 15.116 2.547 576 H VAL 87 H VAL 87 1.058 12.349 6.486 577 HA VAL 87 HA VAL 87 -1.591 12.712 5.266 578 HB VAL 87 HB VAL 87 -2.002 10.271 5.590 579 HG11 VAL 87 1HG1 VAL 87 -1.451 11.158 3.397 580 HG12 VAL 87 2HG1 VAL 87 -0.739 9.558 3.612 581 HG13 VAL 87 3HG1 VAL 87 0.271 10.999 3.746 582 HG21 VAL 87 1HG2 VAL 87 -0.070 8.774 5.832 583 HG22 VAL 87 2HG2 VAL 87 -0.292 9.795 7.253 584 HG23 VAL 87 3HG2 VAL 87 0.974 10.174 6.084 585 H SER 88 H SER 88 -3.196 13.049 6.594 586 HA SER 88 HA SER 88 -2.812 12.680 9.470 587 HB2 SER 88 1HB SER 88 -4.850 14.131 9.626 588 HB3 SER 88 2HB SER 88 -3.518 14.903 8.764 589 HG SER 88 HG SER 88 -4.939 15.173 7.245 590 HA PRO 89 HA PRO 89 -5.929 9.408 9.864 591 HB2 PRO 89 1HB PRO 89 -7.697 11.343 11.288 592 HB3 PRO 89 2HB PRO 89 -7.209 9.711 11.759 593 HG2 PRO 89 1HG PRO 89 -6.123 11.830 12.937 594 HG3 PRO 89 2HG PRO 89 -5.133 10.415 12.531 595 HD2 PRO 89 1HD PRO 89 -5.300 13.067 11.170 596 HD3 PRO 89 2HD PRO 89 -3.893 12.014 11.421 597 H GLU 90 H GLU 90 -6.919 12.625 8.922 598 HA GLU 90 HA GLU 90 -9.396 11.900 7.718 599 HB2 GLU 90 1HB GLU 90 -7.637 14.338 7.425 600 HB3 GLU 90 2HB GLU 90 -9.207 14.176 6.650 601 HG2 GLU 90 1HG GLU 90 -10.301 14.033 8.794 602 HG3 GLU 90 2HG GLU 90 -8.749 14.049 9.624 603 H TYR 91 H TYR 91 -6.142 12.565 6.437 604 HA TYR 91 HA TYR 91 -6.620 12.027 3.741 605 HB2 TYR 91 1HB TYR 91 -4.241 11.933 5.516 606 HB3 TYR 91 2HB TYR 91 -4.122 11.066 3.992 607 HD1 TYR 91 HD1 TYR 91 -3.536 12.194 2.056 608 HD2 TYR 91 HD2 TYR 91 -4.950 14.425 5.389 609 HE1 TYR 91 HE1 TYR 91 -2.951 14.279 0.898 610 HE2 TYR 91 HE2 TYR 91 -4.370 16.521 4.236 611 HH TYR 91 HH TYR 91 -3.622 16.672 0.948 612 H GLU 92 H GLU 92 -5.696 9.830 6.362 613 HA GLU 92 HA GLU 92 -5.606 7.447 4.940 614 HB2 GLU 92 1HB GLU 92 -4.830 7.650 7.241 615 HB3 GLU 92 2HB GLU 92 -6.469 7.967 7.792 616 HG2 GLU 92 1HG GLU 92 -7.110 5.706 6.994 617 HG3 GLU 92 2HG GLU 92 -5.412 5.419 6.619 618 H LYS 93 H LYS 93 -8.320 9.083 6.485 619 HA LYS 93 HA LYS 93 -10.230 7.063 6.182 620 HB2 LYS 93 1HB LYS 93 -10.378 9.093 7.665 621 HB3 LYS 93 2HB LYS 93 -10.747 10.037 6.230 622 HG2 LYS 93 1HG LYS 93 -12.762 8.739 5.863 623 HG3 LYS 93 2HG LYS 93 -12.379 7.729 7.258 624 HD2 LYS 93 1HD LYS 93 -12.431 9.803 8.660 625 HD3 LYS 93 2HD LYS 93 -13.040 10.668 7.250 626 HE2 LYS 93 1HE LYS 93 -14.875 10.018 8.694 627 HE3 LYS 93 2HE LYS 93 -14.963 9.144 7.166 628 HZ1 LYS 93 1HZ LYS 93 -13.994 7.219 8.238 629 HZ2 LYS 93 2HZ LYS 93 -15.390 7.697 9.058 630 HZ3 LYS 93 3HZ LYS 93 -13.871 8.054 9.704 631 H LYS 94 H LYS 94 -9.225 9.684 4.052 632 HA LYS 94 HA LYS 94 -11.281 9.516 2.160 633 HB2 LYS 94 1HB LYS 94 -8.381 10.200 1.643 634 HB3 LYS 94 2HB LYS 94 -9.745 10.614 0.616 635 HG2 LYS 94 1HG LYS 94 -9.248 11.639 3.403 636 HG3 LYS 94 2HG LYS 94 -8.995 12.529 1.902 637 HD2 LYS 94 1HD LYS 94 -11.390 12.364 1.407 638 HD3 LYS 94 2HD LYS 94 -11.637 11.481 2.915 639 HE2 LYS 94 1HE LYS 94 -12.230 13.810 3.212 640 HE3 LYS 94 2HE LYS 94 -10.801 13.424 4.169 641 HZ1 LYS 94 1HZ LYS 94 -10.777 14.775 1.522 642 HZ2 LYS 94 2HZ LYS 94 -9.426 14.436 2.480 643 HZ3 LYS 94 3HZ LYS 94 -10.581 15.543 3.017 644 H LEU 95 H LEU 95 -8.177 7.825 2.339 645 HA LEU 95 HA LEU 95 -8.660 6.394 -0.114 646 HB2 LEU 95 1HB LEU 95 -6.520 5.946 1.968 647 HB3 LEU 95 2HB LEU 95 -6.529 5.310 0.335 648 HG LEU 95 HG LEU 95 -6.288 8.219 1.105 649 HD11 LEU 95 1HD1 LEU 95 -4.292 6.300 -0.081 650 HD12 LEU 95 2HD1 LEU 95 -4.267 6.959 1.555 651 HD13 LEU 95 3HD1 LEU 95 -4.036 8.027 0.170 652 HD21 LEU 95 1HD2 LEU 95 -6.295 6.913 -1.613 653 HD22 LEU 95 2HD2 LEU 95 -5.889 8.599 -1.293 654 HD23 LEU 95 3HD2 LEU 95 -7.518 8.009 -0.969 655 H GLN 96 H GLN 96 -8.894 5.766 3.325 656 HA GLN 96 HA GLN 96 -9.234 2.950 3.114 657 HB2 GLN 96 1HB GLN 96 -8.482 4.142 5.177 658 HB3 GLN 96 2HB GLN 96 -10.109 4.782 5.356 659 HG2 GLN 96 1HG GLN 96 -10.978 2.509 5.586 660 HG3 GLN 96 2HG GLN 96 -9.346 1.870 5.414 661 HE21 GLN 96 1HE2 GLN 96 -8.196 4.078 6.980 662 HE22 GLN 96 2HE2 GLN 96 -8.584 3.731 8.629 663 H LYS 97 H LYS 97 -11.394 5.695 2.992 664 HA LYS 97 HA LYS 97 -13.773 4.073 3.121 665 HB2 LYS 97 1HB LYS 97 -13.757 6.398 3.925 666 HB3 LYS 97 2HB LYS 97 -13.438 6.958 2.291 667 HG2 LYS 97 1HG LYS 97 -15.580 6.108 1.550 668 HG3 LYS 97 2HG LYS 97 -15.897 5.456 3.158 669 HD2 LYS 97 1HD LYS 97 -15.878 7.694 4.093 670 HD3 LYS 97 2HD LYS 97 -15.480 8.371 2.513 671 HE2 LYS 97 1HE LYS 97 -17.867 8.601 3.046 672 HE3 LYS 97 2HE LYS 97 -17.593 7.604 1.618 673 HZ1 LYS 97 1HZ LYS 97 -19.266 6.650 3.074 674 HZ2 LYS 97 2HZ LYS 97 -18.158 6.581 4.347 675 HZ3 LYS 97 3HZ LYS 97 -17.918 5.634 2.968 676 H TYR 98 H TYR 98 -11.674 5.267 0.610 677 HA TYR 98 HA TYR 98 -13.529 5.178 -1.522 678 HB2 TYR 98 1HB TYR 98 -11.340 6.388 -1.581 679 HB3 TYR 98 2HB TYR 98 -10.533 4.828 -1.716 680 HD1 TYR 98 HD1 TYR 98 -13.558 6.284 -3.359 681 HD2 TYR 98 HD2 TYR 98 -9.702 4.557 -3.859 682 HE1 TYR 98 HE1 TYR 98 -13.849 6.362 -5.797 683 HE2 TYR 98 HE2 TYR 98 -9.983 4.630 -6.301 684 HH TYR 98 HH TYR 98 -12.532 6.372 -7.807 685 H ALA 99 H ALA 99 -11.026 2.858 -0.527 686 HA ALA 99 HA ALA 99 -12.408 0.757 -2.056 687 HB1 ALA 99 1HB ALA 99 -10.379 -0.585 -1.601 688 HB2 ALA 99 2HB ALA 99 -9.697 0.778 -0.711 689 HB3 ALA 99 3HB ALA 99 -10.005 0.918 -2.443 690 H ASP 100 H ASP 100 -13.130 -1.178 -0.928 691 HA ASP 100 HA ASP 100 -13.606 -0.614 1.899 692 HB2 ASP 100 1HB ASP 100 -14.596 -2.880 0.156 693 HB3 ASP 100 2HB ASP 100 -15.032 -2.650 1.845 694 H ALA 101 H ALA 101 -11.856 -0.917 2.974 695 HA ALA 101 HA ALA 101 -10.851 -3.454 3.632 696 HB1 ALA 101 1HB ALA 101 -9.816 -3.351 1.402 697 HB2 ALA 101 2HB ALA 101 -8.597 -3.275 2.675 698 HB3 ALA 101 3HB ALA 101 -9.073 -1.808 1.820 699 H GLU 102 H GLU 102 -9.161 -3.260 5.249 700 HA GLU 102 HA GLU 102 -9.115 -0.605 6.450 701 HB2 GLU 102 1HB GLU 102 -7.920 -3.197 7.440 702 HB3 GLU 102 2HB GLU 102 -8.009 -1.693 8.331 703 HG2 GLU 102 1HG GLU 102 -10.551 -1.882 7.972 704 HG3 GLU 102 2HG GLU 102 -10.204 -3.572 7.607 705 H VAL 103 H VAL 103 -7.839 0.538 5.017 706 HA VAL 103 HA VAL 103 -5.296 -0.569 4.214 707 HB VAL 103 HB VAL 103 -6.702 0.759 2.614 708 HG11 VAL 103 1HG1 VAL 103 -6.778 3.125 2.702 709 HG12 VAL 103 2HG1 VAL 103 -5.674 3.176 4.081 710 HG13 VAL 103 3HG1 VAL 103 -7.314 2.540 4.279 711 HG21 VAL 103 1HG2 VAL 103 -4.255 0.345 2.346 712 HG22 VAL 103 2HG2 VAL 103 -3.968 1.934 3.051 713 HG23 VAL 103 3HG2 VAL 103 -4.850 1.789 1.530 714 H ARG 104 H ARG 104 -3.413 -0.153 5.031 715 HA ARG 104 HA ARG 104 -3.215 1.756 7.248 716 HB2 ARG 104 1HB ARG 104 -2.517 -0.658 7.527 717 HB3 ARG 104 2HB ARG 104 -1.234 -0.356 6.366 718 HG2 ARG 104 1HG ARG 104 -0.234 1.274 7.852 719 HG3 ARG 104 2HG ARG 104 -1.556 1.060 9.004 720 HD2 ARG 104 1HD ARG 104 0.448 -1.029 8.153 721 HD3 ARG 104 2HD ARG 104 0.378 -0.217 9.716 722 HE ARG 104 HE ARG 104 -2.089 -1.433 9.313 723 HH11 ARG 104 1HH1 ARG 104 1.248 -2.397 9.746 724 HH12 ARG 104 2HH1 ARG 104 0.846 -3.938 10.433 725 HH21 ARG 104 1HH2 ARG 104 -2.618 -3.465 10.192 726 HH22 ARG 104 2HH2 ARG 104 -1.356 -4.569 10.657 727 H VAL 105 H VAL 105 -2.852 3.725 6.320 728 HA VAL 105 HA VAL 105 -1.080 3.900 4.044 729 HB VAL 105 HB VAL 105 -1.619 6.281 3.955 730 HG11 VAL 105 1HG1 VAL 105 -4.024 6.070 3.473 731 HG12 VAL 105 2HG1 VAL 105 -4.029 4.500 4.277 732 HG13 VAL 105 3HG1 VAL 105 -3.079 4.736 2.810 733 HG21 VAL 105 1HG2 VAL 105 -3.294 7.254 5.455 734 HG22 VAL 105 2HG2 VAL 105 -1.837 6.770 6.321 735 HG23 VAL 105 3HG2 VAL 105 -3.289 5.775 6.414 736 H ARG 106 H ARG 106 1.051 4.109 4.293 737 HA ARG 106 HA ARG 106 2.042 5.333 6.790 738 HB2 ARG 106 1HB ARG 106 3.175 3.016 5.223 739 HB3 ARG 106 2HB ARG 106 4.057 3.840 6.496 740 HG2 ARG 106 1HG ARG 106 1.430 2.407 6.862 741 HG3 ARG 106 2HG ARG 106 3.014 1.720 7.214 742 HD2 ARG 106 1HD ARG 106 2.187 2.468 9.286 743 HD3 ARG 106 2HD ARG 106 3.353 3.690 8.785 744 HE ARG 106 HE ARG 106 0.795 4.446 7.896 745 HH11 ARG 106 1HH1 ARG 106 2.591 4.123 10.893 746 HH12 ARG 106 2HH1 ARG 106 1.698 5.367 11.702 747 HH21 ARG 106 1HH2 ARG 106 -0.379 6.057 8.959 748 HH22 ARG 106 2HH2 ARG 106 0.012 6.480 10.597 749 H THR 107 H THR 107 3.585 6.873 6.619 750 HA THR 107 HA THR 107 4.206 7.783 3.926 751 HB THR 107 HB THR 107 3.392 9.400 5.659 752 HG1 THR 107 HG1 THR 107 4.435 10.828 4.534 753 HG21 THR 107 1HG2 THR 107 4.988 10.223 7.342 754 HG22 THR 107 2HG2 THR 107 6.105 8.930 6.901 755 HG23 THR 107 3HG2 THR 107 4.542 8.539 7.619 756 H VAL 108 H VAL 108 6.187 7.661 3.013 757 HA VAL 108 HA VAL 108 8.335 6.481 4.648 758 HB VAL 108 HB VAL 108 7.321 4.747 3.246 759 HG11 VAL 108 1HG1 VAL 108 6.471 6.132 1.437 760 HG12 VAL 108 2HG1 VAL 108 7.481 4.832 0.807 761 HG13 VAL 108 3HG1 VAL 108 8.118 6.475 0.909 762 HG21 VAL 108 1HG2 VAL 108 10.085 5.571 2.383 763 HG22 VAL 108 2HG2 VAL 108 9.364 3.993 2.073 764 HG23 VAL 108 3HG2 VAL 108 9.660 4.515 3.731 765 H THR 109 H THR 109 10.423 7.130 4.208 766 HA THR 109 HA THR 109 10.806 9.087 2.049 767 HB THR 109 HB THR 109 12.499 10.204 3.609 768 HG1 THR 109 HG1 THR 109 10.941 8.806 5.554 769 HG21 THR 109 1HG2 THR 109 10.376 11.256 3.011 770 HG22 THR 109 2HG2 THR 109 10.777 11.577 4.699 771 HG23 THR 109 3HG2 THR 109 9.562 10.364 4.296 772 H SER 110 H SER 110 11.888 6.285 3.688 773 HA SER 110 HA SER 110 14.236 6.184 1.950 774 HB2 SER 110 1HB SER 110 15.449 5.089 3.965 775 HB3 SER 110 2HB SER 110 15.311 6.843 3.913 776 HG SER 110 HG SER 110 13.905 6.806 5.529 777 HA PRO 111 HA PRO 111 12.916 2.225 0.633 778 HB2 PRO 111 1HB PRO 111 15.818 1.578 0.941 779 HB3 PRO 111 2HB PRO 111 14.745 1.299 -0.436 780 HG2 PRO 111 1HG PRO 111 16.476 3.299 -0.482 781 HG3 PRO 111 2HG PRO 111 14.832 3.523 -1.110 782 HD2 PRO 111 1HD PRO 111 16.032 4.476 1.445 783 HD3 PRO 111 2HD PRO 111 14.824 5.249 0.404 784 H ASP 112 H ASP 112 15.200 2.318 3.347 785 HA ASP 112 HA ASP 112 14.801 -0.388 4.105 786 HB2 ASP 112 1HB ASP 112 16.805 0.969 4.713 787 HB3 ASP 112 2HB ASP 112 15.799 1.879 5.835 788 H GLU 113 H GLU 113 13.325 2.651 5.128 789 HA GLU 113 HA GLU 113 11.799 1.529 7.238 790 HB2 GLU 113 1HB GLU 113 11.349 4.028 5.598 791 HB3 GLU 113 2HB GLU 113 10.424 3.603 7.032 792 HG2 GLU 113 1HG GLU 113 13.385 4.134 6.922 793 HG3 GLU 113 2HG GLU 113 12.151 5.218 7.559 794 H ALA 114 H ALA 114 11.228 2.019 3.799 795 HA ALA 114 HA ALA 114 8.555 1.245 3.641 796 HB1 ALA 114 1HB ALA 114 9.805 2.157 1.740 797 HB2 ALA 114 2HB ALA 114 9.031 0.632 1.321 798 HB3 ALA 114 3HB ALA 114 10.761 0.680 1.657 799 H LYS 115 H LYS 115 11.490 -0.737 3.425 800 HA LYS 115 HA LYS 115 10.222 -3.227 3.196 801 HB2 LYS 115 1HB LYS 115 12.932 -2.485 4.295 802 HB3 LYS 115 2HB LYS 115 12.416 -4.143 4.035 803 HG2 LYS 115 1HG LYS 115 12.073 -3.587 1.632 804 HG3 LYS 115 2HG LYS 115 12.768 -2.000 1.953 805 HD2 LYS 115 1HD LYS 115 14.194 -4.616 2.444 806 HD3 LYS 115 2HD LYS 115 14.379 -3.642 0.986 807 HE2 LYS 115 1HE LYS 115 16.194 -2.974 2.252 808 HE3 LYS 115 2HE LYS 115 15.000 -1.742 2.643 809 HZ1 LYS 115 1HZ LYS 115 16.007 -2.423 4.659 810 HZ2 LYS 115 2HZ LYS 115 15.807 -4.064 4.301 811 HZ3 LYS 115 3HZ LYS 115 14.461 -3.109 4.652 812 H ARG 116 H ARG 116 10.963 -1.252 5.986 813 HA ARG 116 HA ARG 116 10.603 -3.229 7.968 814 HB2 ARG 116 1HB ARG 116 11.705 -1.144 8.519 815 HB3 ARG 116 2HB ARG 116 10.268 -0.225 8.094 816 HG2 ARG 116 1HG ARG 116 10.478 -0.373 10.494 817 HG3 ARG 116 2HG ARG 116 9.060 -1.279 9.960 818 HD2 ARG 116 1HD ARG 116 10.485 -3.341 10.017 819 HD3 ARG 116 2HD ARG 116 11.740 -2.375 10.784 820 HE ARG 116 HE ARG 116 9.203 -2.245 12.131 821 HH11 ARG 116 1HH1 ARG 116 12.226 -3.985 11.846 822 HH12 ARG 116 2HH1 ARG 116 12.077 -4.749 13.398 823 HH21 ARG 116 1HH2 ARG 116 8.995 -3.266 14.163 824 HH22 ARG 116 2HH2 ARG 116 10.236 -4.352 14.705 825 H TRP 117 H TRP 117 8.366 -0.777 6.669 826 HA TRP 117 HA TRP 117 6.176 -1.568 8.261 827 HB2 TRP 117 1HB TRP 117 6.198 -0.126 5.604 828 HB3 TRP 117 2HB TRP 117 4.797 -0.268 6.662 829 HD1 TRP 117 HD1 TRP 117 7.320 2.150 5.827 830 HE1 TRP 117 HE1 TRP 117 7.699 3.856 7.713 831 HE3 TRP 117 HE3 TRP 117 4.993 -0.324 9.648 832 HZ2 TRP 117 HZ2 TRP 117 7.086 4.125 10.450 833 HZ3 TRP 117 HZ3 TRP 117 4.932 0.729 11.869 834 HH2 TRP 117 HH2 TRP 117 5.962 2.907 12.259 835 H ILE 118 H ILE 118 7.226 -2.514 5.027 836 HA ILE 118 HA ILE 118 5.059 -4.140 4.325 837 HB ILE 118 HB ILE 118 7.985 -4.424 3.614 838 HG12 ILE 118 1HG1 ILE 118 5.660 -3.298 2.036 839 HG13 ILE 118 2HG1 ILE 118 6.861 -2.332 2.888 840 HG21 ILE 118 1HG2 ILE 118 7.243 -5.852 1.764 841 HG22 ILE 118 2HG2 ILE 118 5.594 -5.791 2.386 842 HG23 ILE 118 3HG2 ILE 118 6.865 -6.564 3.333 843 HD11 ILE 118 1HD1 ILE 118 7.442 -4.217 0.615 844 HD12 ILE 118 2HD1 ILE 118 8.605 -3.178 1.438 845 HD13 ILE 118 3HD1 ILE 118 7.302 -2.464 0.489 846 H LYS 119 H LYS 119 8.042 -4.916 6.076 847 HA LYS 119 HA LYS 119 7.602 -7.662 6.399 848 HB2 LYS 119 1HB LYS 119 9.751 -6.480 6.828 849 HB3 LYS 119 2HB LYS 119 9.048 -5.791 8.283 850 HG2 LYS 119 1HG LYS 119 8.760 -8.042 9.201 851 HG3 LYS 119 2HG LYS 119 9.499 -8.718 7.749 852 HD2 LYS 119 1HD LYS 119 11.550 -7.431 8.236 853 HD3 LYS 119 2HD LYS 119 10.806 -6.853 9.728 854 HE2 LYS 119 1HE LYS 119 12.253 -8.708 10.234 855 HE3 LYS 119 2HE LYS 119 10.578 -9.197 10.475 856 HZ1 LYS 119 1HZ LYS 119 10.640 -10.253 8.280 857 HZ2 LYS 119 2HZ LYS 119 11.783 -10.914 9.329 858 HZ3 LYS 119 3HZ LYS 119 12.272 -9.837 8.122 859 H GLU 120 H GLU 120 6.762 -4.929 8.480 860 HA GLU 120 HA GLU 120 5.729 -6.459 10.614 861 HB2 GLU 120 1HB GLU 120 6.457 -4.137 10.862 862 HB3 GLU 120 2HB GLU 120 5.154 -3.604 9.810 863 HG2 GLU 120 1HG GLU 120 3.517 -4.389 11.435 864 HG3 GLU 120 2HG GLU 120 4.820 -4.930 12.491 865 H PHE 121 H PHE 121 4.259 -5.131 7.713 866 HA PHE 121 HA PHE 121 1.566 -5.732 8.519 867 HB2 PHE 121 1HB PHE 121 2.154 -3.882 6.968 868 HB3 PHE 121 2HB PHE 121 2.670 -5.072 5.781 869 HD1 PHE 121 HD1 PHE 121 1.173 -5.790 4.186 870 HD2 PHE 121 HD2 PHE 121 -0.304 -4.100 7.802 871 HE1 PHE 121 HE1 PHE 121 -1.113 -5.864 3.282 872 HE2 PHE 121 HE2 PHE 121 -2.594 -4.175 6.906 873 HZ PHE 121 HZ PHE 121 -3.000 -5.057 4.643 874 H SER 122 H SER 122 4.074 -7.282 6.637 875 HA SER 122 HA SER 122 2.531 -9.324 5.468 876 HB2 SER 122 1HB SER 122 4.770 -8.844 4.665 877 HB3 SER 122 2HB SER 122 5.461 -9.239 6.236 878 HG SER 122 HG SER 122 4.892 -11.392 5.919 879 H GLU 123 H GLU 123 4.315 -9.168 8.525 880 HA GLU 123 HA GLU 123 3.555 -11.905 9.129 881 HB2 GLU 123 1HB GLU 123 5.338 -9.973 10.612 882 HB3 GLU 123 2HB GLU 123 5.062 -11.647 11.075 883 HG2 GLU 123 1HG GLU 123 6.398 -10.639 8.578 884 HG3 GLU 123 2HG GLU 123 7.136 -11.530 9.910 885 H GLU 124 H GLU 124 1.266 -11.189 9.225 886 HA GLU 124 HA GLU 124 0.645 -10.490 12.015 887 HB2 GLU 124 1HB GLU 124 -1.041 -9.906 9.572 888 HB3 GLU 124 2HB GLU 124 -1.517 -9.592 11.234 889 HG2 GLU 124 1HG GLU 124 0.449 -8.060 11.414 890 HG3 GLU 124 2HG GLU 124 0.685 -8.266 9.678
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