NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
580107 | 2mqd | 25028 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 GLY 19 H GLY 19 -1.865 -18.341 3.436 2 HA2 GLY 19 1HA GLY 19 -3.741 -17.231 2.480 3 HA3 GLY 19 2HA GLY 19 -3.916 -18.967 2.113 4 H HIS 20 H HIS 20 -6.059 -19.600 2.456 5 HA HIS 20 HA HIS 20 -8.165 -19.587 3.152 6 HB2 HIS 20 1HB HIS 20 -8.436 -20.163 5.579 7 HB3 HIS 20 2HB HIS 20 -7.342 -21.165 4.656 8 HD1 HIS 20 1HD HIS 20 -4.794 -21.265 5.451 9 HD2 HIS 20 2HD HIS 20 -7.292 -18.517 7.444 10 HE1 HIS 20 1HE HIS 20 -3.459 -20.387 7.425 11 H MET 21 H MET 21 -7.267 -16.962 2.649 12 HA MET 21 HA MET 21 -8.224 -15.245 4.838 13 HB2 MET 21 1HB MET 21 -6.925 -13.508 3.838 14 HB3 MET 21 2HB MET 21 -5.946 -14.956 3.934 15 HG2 MET 21 1HG MET 21 -6.327 -15.368 1.501 16 HG3 MET 21 2HG MET 21 -7.283 -13.886 1.423 17 HE1 MET 21 3HE MET 21 -4.373 -12.249 -0.377 18 HE2 MET 21 1HE MET 21 -5.282 -13.740 -0.714 19 HE3 MET 21 2HE MET 21 -6.132 -12.293 -0.115 20 H LYS 22 H LYS 22 -8.823 -12.902 3.333 21 HA LYS 22 HA LYS 22 -10.761 -13.613 1.278 22 HB2 LYS 22 1HB LYS 22 -11.377 -11.548 3.442 23 HB3 LYS 22 2HB LYS 22 -12.345 -11.878 2.011 24 HG2 LYS 22 1HG LYS 22 -13.003 -14.057 2.847 25 HG3 LYS 22 2HG LYS 22 -11.857 -13.934 4.195 26 HD2 LYS 22 1HD LYS 22 -14.033 -13.439 5.033 27 HD3 LYS 22 2HD LYS 22 -13.043 -11.975 5.092 28 HE2 LYS 22 1HE LYS 22 -14.186 -11.380 2.813 29 HE3 LYS 22 2HE LYS 22 -15.302 -12.698 3.186 30 HZ1 LYS 22 3HZ LYS 22 -15.706 -11.455 5.346 31 HZ2 LYS 22 1HZ LYS 22 -16.267 -10.750 3.977 32 HZ3 LYS 22 2HZ LYS 22 -14.885 -10.194 4.675 33 H PHE 23 H PHE 23 -11.282 -11.347 0.185 34 HA PHE 23 HA PHE 23 -10.619 -9.635 -1.039 35 HB2 PHE 23 1HB PHE 23 -8.963 -9.011 1.396 36 HB3 PHE 23 2HB PHE 23 -8.752 -8.106 -0.083 37 HD1 PHE 23 1HD PHE 23 -12.150 -9.317 1.008 38 HD2 PHE 23 2HD PHE 23 -9.402 -5.984 0.759 39 HE1 PHE 23 1HE PHE 23 -13.970 -7.781 1.439 40 HE2 PHE 23 2HE PHE 23 -11.259 -4.437 1.282 41 HZ PHE 23 HZ PHE 23 -13.555 -5.313 1.624 42 H THR 24 H THR 24 -8.236 -8.696 -2.029 43 HA THR 24 HA THR 24 -6.331 -10.922 -2.279 44 HB THR 24 HB THR 24 -6.040 -9.890 -4.677 45 HG1 THR 24 1HG THR 24 -7.793 -9.041 -5.575 46 HG21 THR 24 3HG2 THR 24 -8.455 -11.648 -4.054 47 HG22 THR 24 1HG2 THR 24 -6.781 -12.231 -4.213 48 HG23 THR 24 2HG2 THR 24 -7.607 -11.542 -5.616 49 H ASP 25 H ASP 25 -4.200 -10.141 -2.560 50 HA ASP 25 HA ASP 25 -3.532 -8.041 -0.818 51 HB2 ASP 25 1HB ASP 25 -1.801 -9.238 -3.004 52 HB3 ASP 25 2HB ASP 25 -1.228 -8.330 -1.605 53 H GLN 26 H GLN 26 -3.590 -8.106 -4.376 54 HA GLN 26 HA GLN 26 -2.821 -5.574 -5.161 55 HB2 GLN 26 1HB GLN 26 -5.015 -7.475 -6.049 56 HB3 GLN 26 2HB GLN 26 -4.855 -5.928 -6.832 57 HG2 GLN 26 1HG GLN 26 -2.310 -7.444 -6.624 58 HG3 GLN 26 2HG GLN 26 -3.544 -8.239 -7.576 59 HE21 GLN 26 1HE2 GLN 26 -4.805 -6.014 -8.948 60 HE22 GLN 26 2HE2 GLN 26 -3.556 -5.405 -10.017 61 H GLN 27 H GLN 27 -5.998 -6.482 -3.789 62 HA GLN 27 HA GLN 27 -7.233 -3.894 -4.279 63 HB2 GLN 27 1HB GLN 27 -8.040 -6.302 -2.594 64 HB3 GLN 27 2HB GLN 27 -9.054 -4.926 -2.892 65 HG2 GLN 27 1HG GLN 27 -7.936 -6.557 -5.209 66 HG3 GLN 27 2HG GLN 27 -9.339 -7.102 -4.310 67 HE21 GLN 27 1HE2 GLN 27 -8.551 -5.592 -7.114 68 HE22 GLN 27 2HE2 GLN 27 -9.921 -4.544 -7.337 69 H ILE 28 H ILE 28 -5.517 -5.433 -1.662 70 HA ILE 28 HA ILE 28 -6.411 -3.576 0.399 71 HB ILE 28 HB ILE 28 -4.330 -5.797 0.359 72 HG12 ILE 28 1HG1 ILE 28 -7.100 -5.819 1.645 73 HG13 ILE 28 2HG1 ILE 28 -6.831 -6.396 0.021 74 HG21 ILE 28 1HG2 ILE 28 -3.776 -4.221 2.155 75 HG22 ILE 28 2HG2 ILE 28 -5.457 -4.235 2.729 76 HG23 ILE 28 3HG2 ILE 28 -4.433 -5.686 2.848 77 HD11 ILE 28 3HD1 ILE 28 -6.766 -8.339 1.318 78 HD12 ILE 28 1HD1 ILE 28 -5.069 -8.000 0.958 79 HD13 ILE 28 2HD1 ILE 28 -5.758 -7.604 2.555 80 H GLY 29 H GLY 29 -3.487 -3.964 -1.685 81 HA2 GLY 29 1HA GLY 29 -1.790 -2.288 -0.223 82 HA3 GLY 29 2HA GLY 29 -1.689 -2.542 -1.957 83 H VAL 30 H VAL 30 -4.225 -1.407 -2.679 84 HA VAL 30 HA VAL 30 -3.605 1.345 -2.884 85 HB VAL 30 HB VAL 30 -6.231 -0.171 -3.162 86 HG11 VAL 30 1HG1 VAL 30 -5.600 2.692 -3.996 87 HG12 VAL 30 2HG1 VAL 30 -7.068 1.778 -4.408 88 HG13 VAL 30 3HG1 VAL 30 -6.753 2.225 -2.725 89 HG21 VAL 30 3HG2 VAL 30 -4.465 -0.767 -4.808 90 HG22 VAL 30 1HG2 VAL 30 -5.745 0.179 -5.593 91 HG23 VAL 30 2HG2 VAL 30 -4.233 0.973 -5.144 92 H LEU 31 H LEU 31 -5.726 -0.348 -0.522 93 HA LEU 31 HA LEU 31 -6.522 2.023 0.912 94 HB2 LEU 31 1HB LEU 31 -6.356 -0.936 1.614 95 HB3 LEU 31 2HB LEU 31 -6.715 0.269 2.829 96 HG LEU 31 HG LEU 31 -8.802 0.743 2.062 97 HD11 LEU 31 1HD1 LEU 31 -8.195 -0.499 -0.657 98 HD12 LEU 31 2HD1 LEU 31 -8.372 1.238 -0.316 99 HD13 LEU 31 3HD1 LEU 31 -9.756 0.171 -0.131 100 HD21 LEU 31 3HD2 LEU 31 -8.678 -1.510 2.939 101 HD22 LEU 31 1HD2 LEU 31 -8.413 -2.153 1.286 102 HD23 LEU 31 2HD2 LEU 31 -9.955 -1.368 1.713 103 H ALA 32 H ALA 32 -3.800 -0.288 1.331 104 HA ALA 32 HA ALA 32 -2.800 0.873 3.720 105 HB1 ALA 32 1HB ALA 32 -0.775 -0.439 3.261 106 HB2 ALA 32 2HB ALA 32 -2.226 -1.409 2.940 107 HB3 ALA 32 3HB ALA 32 -1.299 -0.716 1.589 108 H GLY 33 H GLY 33 -2.296 1.879 0.362 109 HA2 GLY 33 1HA GLY 33 -0.186 3.801 1.226 110 HA3 GLY 33 2HA GLY 33 -0.607 3.404 -0.429 111 H LEU 34 H LEU 34 -3.660 3.784 0.213 112 HA LEU 34 HA LEU 34 -3.865 6.638 0.112 113 HB2 LEU 34 1HB LEU 34 -5.736 4.351 0.318 114 HB3 LEU 34 2HB LEU 34 -6.219 5.752 1.262 115 HG LEU 34 HG LEU 34 -6.205 7.213 -0.612 116 HD11 LEU 34 1HD1 LEU 34 -5.978 6.300 -2.963 117 HD12 LEU 34 2HD1 LEU 34 -5.300 4.817 -2.260 118 HD13 LEU 34 3HD1 LEU 34 -4.467 6.375 -2.058 119 HD21 LEU 34 3HD2 LEU 34 -8.104 6.196 -1.866 120 HD22 LEU 34 1HD2 LEU 34 -8.250 5.950 -0.123 121 HD23 LEU 34 2HD2 LEU 34 -7.707 4.613 -1.157 122 H ALA 35 H ALA 35 -3.629 4.339 2.718 123 HA ALA 35 HA ALA 35 -4.099 6.144 4.909 124 HB1 ALA 35 1HB ALA 35 -3.167 4.364 6.278 125 HB2 ALA 35 2HB ALA 35 -4.209 3.632 5.048 126 HB3 ALA 35 3HB ALA 35 -2.455 3.575 4.860 127 H ILE 36 H ILE 36 -1.290 5.738 2.796 128 HA ILE 36 HA ILE 36 0.456 7.249 4.640 129 HB ILE 36 HB ILE 36 1.135 4.554 3.394 130 HG12 ILE 36 1HG1 ILE 36 -0.247 4.184 5.385 131 HG13 ILE 36 2HG1 ILE 36 1.383 3.592 5.544 132 HG21 ILE 36 1HG2 ILE 36 3.089 6.006 3.388 133 HG22 ILE 36 2HG2 ILE 36 2.857 6.401 5.096 134 HG23 ILE 36 3HG2 ILE 36 3.279 4.745 4.598 135 HD11 ILE 36 3HD1 ILE 36 0.427 6.177 6.813 136 HD12 ILE 36 1HD1 ILE 36 0.545 4.600 7.619 137 HD13 ILE 36 2HD1 ILE 36 2.012 5.409 7.034 138 H SER 37 H SER 37 0.350 8.968 3.237 139 HA SER 37 HA SER 37 0.856 10.311 1.553 140 HB2 SER 37 1HB SER 37 3.082 8.868 1.818 141 HB3 SER 37 2HB SER 37 2.705 8.430 0.145 142 HG SER 37 HG SER 37 4.003 10.370 0.404 143 HA PRO 38 HA PRO 38 -2.357 8.021 -1.016 144 HB2 PRO 38 1HB PRO 38 -4.229 10.055 -0.900 145 HB3 PRO 38 2HB PRO 38 -4.124 8.720 0.268 146 HG2 PRO 38 1HG PRO 38 -2.988 11.502 0.521 147 HG3 PRO 38 2HG PRO 38 -3.905 10.567 1.743 148 HD2 PRO 38 1HD PRO 38 -1.226 10.700 1.847 149 HD3 PRO 38 2HD PRO 38 -2.053 9.154 2.189 150 H GLU 39 H GLU 39 -1.075 11.363 -0.947 151 HA GLU 39 HA GLU 39 -1.957 12.068 -3.595 152 HB2 GLU 39 1HB GLU 39 0.329 13.451 -2.183 153 HB3 GLU 39 2HB GLU 39 -0.884 14.100 -3.273 154 HG2 GLU 39 1HG GLU 39 -2.633 13.730 -1.512 155 HG3 GLU 39 2HG GLU 39 -1.380 13.153 -0.412 156 H TRP 40 H TRP 40 1.107 10.836 -2.199 157 HA TRP 40 HA TRP 40 2.560 10.796 -4.665 158 HB2 TRP 40 1HB TRP 40 3.770 10.602 -2.593 159 HB3 TRP 40 2HB TRP 40 2.779 9.261 -2.057 160 HD1 TRP 40 HD TRP 40 5.754 10.010 -4.304 161 HE1 TRP 40 1HE TRP 40 6.846 7.875 -5.090 162 HE3 TRP 40 3HE TRP 40 2.298 6.723 -2.469 163 HZ2 TRP 40 2HZ TRP 40 6.403 5.000 -4.695 164 HZ3 TRP 40 3HZ TRP 40 2.625 4.302 -2.689 165 HH2 TRP 40 HH TRP 40 4.725 3.406 -3.763 166 H LEU 41 H LEU 41 0.367 8.426 -3.110 167 HA LEU 41 HA LEU 41 0.757 6.353 -5.055 168 HB2 LEU 41 1HB LEU 41 -0.285 5.942 -2.967 169 HB3 LEU 41 2HB LEU 41 -1.581 7.067 -3.261 170 HG LEU 41 HG LEU 41 -1.184 4.595 -4.984 171 HD11 LEU 41 1HD1 LEU 41 -2.857 3.493 -3.496 172 HD12 LEU 41 2HD1 LEU 41 -2.841 4.928 -2.438 173 HD13 LEU 41 3HD1 LEU 41 -1.398 3.952 -2.607 174 HD21 LEU 41 3HD2 LEU 41 -3.689 4.819 -5.260 175 HD22 LEU 41 1HD2 LEU 41 -2.744 6.071 -6.048 176 HD23 LEU 41 2HD2 LEU 41 -3.558 6.425 -4.505 177 H LYS 42 H LYS 42 -1.580 9.072 -4.928 178 HA LYS 42 HA LYS 42 -2.839 8.551 -7.396 179 HB2 LYS 42 1HB LYS 42 -2.529 11.046 -5.700 180 HB3 LYS 42 2HB LYS 42 -3.385 11.094 -7.242 181 HG2 LYS 42 1HG LYS 42 -4.972 9.435 -6.559 182 HG3 LYS 42 2HG LYS 42 -4.084 9.076 -5.070 183 HD2 LYS 42 1HD LYS 42 -4.603 11.237 -4.124 184 HD3 LYS 42 2HD LYS 42 -5.286 11.805 -5.673 185 HE2 LYS 42 1HE LYS 42 -7.013 10.054 -5.585 186 HE3 LYS 42 2HE LYS 42 -6.358 9.440 -4.061 187 HZ1 LYS 42 3HZ LYS 42 -8.288 10.852 -3.813 188 HZ2 LYS 42 1HZ LYS 42 -7.501 12.141 -4.434 189 HZ3 LYS 42 2HZ LYS 42 -7.010 11.445 -2.984 190 H GLN 43 H GLN 43 0.062 10.729 -6.834 191 HA GLN 43 HA GLN 43 0.066 11.746 -9.437 192 HB2 GLN 43 1HB GLN 43 2.383 12.375 -9.132 193 HB3 GLN 43 2HB GLN 43 1.340 12.834 -7.747 194 HG2 GLN 43 1HG GLN 43 2.478 11.795 -6.357 195 HG3 GLN 43 2HG GLN 43 2.286 10.312 -7.279 196 HE21 GLN 43 1HE2 GLN 43 4.097 10.809 -9.521 197 HE22 GLN 43 2HE2 GLN 43 5.683 10.780 -8.829 198 H ASN 44 H ASN 44 1.469 8.848 -8.172 199 HA ASN 44 HA ASN 44 2.880 8.102 -10.568 200 HB2 ASN 44 1HB ASN 44 2.256 6.652 -7.965 201 HB3 ASN 44 2HB ASN 44 3.118 5.889 -9.321 202 HD21 ASN 44 1HD2 ASN 44 3.615 8.037 -6.551 203 HD22 ASN 44 2HD2 ASN 44 5.186 8.547 -7.103 204 H ILE 45 H ILE 45 -0.224 6.862 -9.089 205 HA ILE 45 HA ILE 45 -0.774 5.079 -11.243 206 HB ILE 45 HB ILE 45 -2.574 6.553 -9.290 207 HG12 ILE 45 1HG1 ILE 45 -1.102 4.812 -8.289 208 HG13 ILE 45 2HG1 ILE 45 -2.799 4.478 -8.129 209 HG21 ILE 45 1HG2 ILE 45 -3.352 4.521 -11.412 210 HG22 ILE 45 2HG2 ILE 45 -4.321 4.815 -9.963 211 HG23 ILE 45 3HG2 ILE 45 -4.037 6.126 -11.103 212 HD11 ILE 45 3HD1 ILE 45 -2.655 2.817 -9.989 213 HD12 ILE 45 1HD1 ILE 45 -0.911 3.159 -10.131 214 HD13 ILE 45 2HD1 ILE 45 -1.574 2.444 -8.657 215 H ALA 46 H ALA 46 -1.268 8.634 -11.013 216 HA ALA 46 HA ALA 46 -3.077 8.907 -13.113 217 HB1 ALA 46 1HB ALA 46 -0.793 10.791 -12.429 218 HB2 ALA 46 2HB ALA 46 -2.265 11.196 -13.334 219 HB3 ALA 46 3HB ALA 46 -2.368 10.748 -11.624 220 H ALA 47 H ALA 47 0.451 8.497 -13.307 221 HA ALA 47 HA ALA 47 0.244 8.163 -16.261 222 HB1 ALA 47 1HB ALA 47 2.715 8.653 -16.223 223 HB2 ALA 47 2HB ALA 47 1.676 9.998 -15.774 224 HB3 ALA 47 3HB ALA 47 2.538 9.112 -14.512 225 H ASN 48 H ASN 48 -0.281 6.128 -13.979 226 HA ASN 48 HA ASN 48 0.036 3.945 -13.587 227 HB2 ASN 48 1HB ASN 48 -0.380 4.178 -16.182 228 HB3 ASN 48 2HB ASN 48 1.263 3.557 -16.306 229 HD21 ASN 48 1HD2 ASN 48 1.458 1.485 -14.556 230 HD22 ASN 48 2HD2 ASN 48 0.214 0.289 -14.938 231 H GLN 49 H GLN 49 2.479 5.786 -13.117 232 HA GLN 49 HA GLN 49 4.907 4.354 -13.761 233 HB2 GLN 49 1HB GLN 49 4.437 6.524 -11.680 234 HB3 GLN 49 2HB GLN 49 5.982 6.091 -12.396 235 HG2 GLN 49 1HG GLN 49 3.652 7.352 -13.888 236 HG3 GLN 49 2HG GLN 49 5.035 8.217 -13.239 237 HE21 GLN 49 1HE2 GLN 49 4.094 5.754 -15.716 238 HE22 GLN 49 2HE2 GLN 49 5.644 5.803 -16.552 239 H LEU 50 H LEU 50 2.657 3.418 -11.574 240 HA LEU 50 HA LEU 50 4.370 3.034 -9.177 241 HB2 LEU 50 1HB LEU 50 1.999 3.924 -8.930 242 HB3 LEU 50 2HB LEU 50 1.419 2.448 -9.686 243 HG LEU 50 HG LEU 50 2.734 1.214 -7.739 244 HD11 LEU 50 1HD1 LEU 50 3.919 3.301 -6.969 245 HD12 LEU 50 2HD1 LEU 50 2.993 2.476 -5.716 246 HD13 LEU 50 3HD1 LEU 50 2.350 3.959 -6.464 247 HD21 LEU 50 3HD2 LEU 50 0.230 2.795 -7.094 248 HD22 LEU 50 1HD2 LEU 50 0.839 1.336 -6.267 249 HD23 LEU 50 2HD2 LEU 50 0.303 1.225 -7.941 250 H VAL 51 H VAL 51 5.261 0.988 -8.779 251 HA VAL 51 HA VAL 51 4.181 -1.286 -10.359 252 HB VAL 51 HB VAL 51 6.947 -0.932 -9.187 253 HG11 VAL 51 1HG1 VAL 51 5.638 -3.317 -10.600 254 HG12 VAL 51 2HG1 VAL 51 7.393 -3.117 -10.402 255 HG13 VAL 51 3HG1 VAL 51 6.386 -3.278 -8.984 256 HG21 VAL 51 3HG2 VAL 51 7.589 -1.102 -11.636 257 HG22 VAL 51 1HG2 VAL 51 5.875 -1.020 -12.047 258 HG23 VAL 51 2HG2 VAL 51 6.674 0.353 -11.246 259 H TYR 52 H TYR 52 3.225 -2.840 -9.314 260 HA TYR 52 HA TYR 52 3.319 -3.139 -6.343 261 HB2 TYR 52 1HB TYR 52 1.060 -3.105 -7.164 262 HB3 TYR 52 2HB TYR 52 1.456 -4.068 -8.565 263 HD1 TYR 52 2HD TYR 52 1.763 -6.506 -8.433 264 HD2 TYR 52 1HD TYR 52 0.554 -4.219 -4.999 265 HE1 TYR 52 2HE TYR 52 0.974 -8.572 -7.360 266 HE2 TYR 52 1HE TYR 52 -0.317 -6.281 -3.932 267 HH TYR 52 HH TYR 52 0.215 -9.461 -5.305 268 H GLY 53 H GLY 53 5.052 -4.496 -5.827 269 HA2 GLY 53 1HA GLY 53 5.268 -7.012 -7.315 270 HA3 GLY 53 2HA GLY 53 6.741 -6.021 -7.161 271 H ILE 54 H ILE 54 6.773 -8.530 -6.120 272 HA ILE 54 HA ILE 54 6.155 -8.333 -3.201 273 HB ILE 54 HB ILE 54 6.696 -10.777 -4.936 274 HG12 ILE 54 1HG1 ILE 54 4.423 -9.806 -5.354 275 HG13 ILE 54 2HG1 ILE 54 4.430 -11.442 -4.725 276 HG21 ILE 54 1HG2 ILE 54 7.498 -11.187 -2.684 277 HG22 ILE 54 2HG2 ILE 54 6.017 -10.556 -1.966 278 HG23 ILE 54 3HG2 ILE 54 5.983 -12.063 -2.895 279 HD11 ILE 54 3HD1 ILE 54 3.928 -8.997 -2.992 280 HD12 ILE 54 1HD1 ILE 54 2.661 -10.021 -3.698 281 HD13 ILE 54 2HD1 ILE 54 3.802 -10.698 -2.494 282 H VAL 55 H VAL 55 7.813 -8.538 -1.779 283 HA VAL 55 HA VAL 55 10.463 -7.909 -2.387 284 HB VAL 55 HB VAL 55 9.065 -9.238 -0.049 285 HG11 VAL 55 1HG1 VAL 55 11.172 -10.077 0.440 286 HG12 VAL 55 2HG1 VAL 55 12.015 -8.750 -0.366 287 HG13 VAL 55 3HG1 VAL 55 11.255 -8.508 1.229 288 HG21 VAL 55 3HG2 VAL 55 8.517 -6.887 -0.471 289 HG22 VAL 55 1HG2 VAL 55 9.508 -7.013 0.982 290 HG23 VAL 55 2HG2 VAL 55 10.244 -6.482 -0.549 291 H LYS 56 H LYS 56 9.513 -11.191 -1.201 292 HA LYS 56 HA LYS 56 10.485 -13.139 -1.324 293 HB2 LYS 56 1HB LYS 56 10.991 -12.189 -4.166 294 HB3 LYS 56 2HB LYS 56 11.505 -13.770 -3.656 295 HG2 LYS 56 1HG LYS 56 8.628 -12.970 -3.083 296 HG3 LYS 56 2HG LYS 56 9.102 -13.235 -4.761 297 HD2 LYS 56 1HD LYS 56 8.300 -15.296 -4.106 298 HD3 LYS 56 2HD LYS 56 10.054 -15.470 -3.978 299 HE2 LYS 56 1HE LYS 56 9.849 -15.055 -1.490 300 HE3 LYS 56 2HE LYS 56 8.097 -15.016 -1.698 301 HZ1 LYS 56 3HZ LYS 56 9.909 -17.292 -2.209 302 HZ2 LYS 56 1HZ LYS 56 8.326 -17.269 -2.688 303 HZ3 LYS 56 2HZ LYS 56 8.694 -17.198 -1.089 304 HA PRO 57 HA PRO 57 14.960 -12.761 -0.733 305 HB2 PRO 57 1HB PRO 57 15.830 -15.290 -1.221 306 HB3 PRO 57 2HB PRO 57 15.052 -14.773 0.300 307 HG2 PRO 57 1HG PRO 57 13.820 -16.313 -1.965 308 HG3 PRO 57 2HG PRO 57 13.567 -16.505 -0.223 309 HD2 PRO 57 1HD PRO 57 11.880 -15.129 -1.937 310 HD3 PRO 57 2HD PRO 57 11.988 -14.790 -0.186 311 H SER 58 H SER 58 14.666 -11.358 -2.621 312 HA SER 58 HA SER 58 15.628 -12.492 -5.217 313 HB2 SER 58 1HB SER 58 13.110 -11.946 -4.858 314 HB3 SER 58 2HB SER 58 13.593 -10.252 -5.008 315 HG SER 58 HG SER 58 13.977 -10.558 -7.080 316 H ASP 59 H ASP 59 15.223 -9.343 -3.426 317 HA ASP 59 HA ASP 59 17.691 -8.372 -4.739 318 HB2 ASP 59 1HB ASP 59 14.910 -7.385 -4.986 319 HB3 ASP 59 2HB ASP 59 16.047 -6.132 -4.480 320 H THR 60 H THR 60 18.308 -6.195 -3.566 321 HA THR 60 HA THR 60 18.818 -6.649 -0.835 322 HB THR 60 HB THR 60 18.637 -4.065 -2.426 323 HG1 THR 60 1HG THR 60 20.929 -4.453 -2.571 324 HG21 THR 60 3HG2 THR 60 20.167 -3.123 -0.793 325 HG22 THR 60 1HG2 THR 60 20.233 -4.668 0.099 326 HG23 THR 60 2HG2 THR 60 18.741 -3.703 0.055 327 H VAL 61 H VAL 61 17.223 -6.866 0.708 328 HA VAL 61 HA VAL 61 15.272 -4.637 0.903 329 HB VAL 61 HB VAL 61 13.583 -6.316 1.692 330 HG11 VAL 61 1HG1 VAL 61 13.588 -5.187 -0.553 331 HG12 VAL 61 2HG1 VAL 61 14.333 -6.644 -1.226 332 HG13 VAL 61 3HG1 VAL 61 12.713 -6.706 -0.496 333 HG21 VAL 61 3HG2 VAL 61 13.746 -8.624 1.086 334 HG22 VAL 61 1HG2 VAL 61 15.308 -8.393 0.296 335 HG23 VAL 61 2HG2 VAL 61 15.164 -8.228 2.059 336 HA PRO 62 HA PRO 62 16.371 -4.860 5.242 337 HB2 PRO 62 1HB PRO 62 14.076 -3.854 6.403 338 HB3 PRO 62 2HB PRO 62 15.301 -2.853 5.553 339 HG2 PRO 62 1HG PRO 62 12.655 -3.897 4.546 340 HG3 PRO 62 2HG PRO 62 13.427 -2.289 4.264 341 HD2 PRO 62 1HD PRO 62 13.438 -4.341 2.462 342 HD3 PRO 62 2HD PRO 62 14.703 -3.092 2.536 343 H ALA 63 H ALA 63 15.384 -5.708 7.356 344 HA ALA 63 HA ALA 63 14.581 -8.462 7.019 345 HB1 ALA 63 1HB ALA 63 16.025 -7.556 8.870 346 HB2 ALA 63 2HB ALA 63 14.614 -6.707 9.529 347 HB3 ALA 63 3HB ALA 63 14.634 -8.483 9.470 348 H GLY 64 H GLY 64 12.640 -9.464 7.785 349 HA2 GLY 64 1HA GLY 64 10.559 -9.692 8.610 350 HA3 GLY 64 2HA GLY 64 10.575 -7.980 9.020 351 H VAL 65 H VAL 65 10.897 -9.121 5.659 352 HA VAL 65 HA VAL 65 8.112 -8.343 5.066 353 HB VAL 65 HB VAL 65 9.034 -6.912 3.160 354 HG11 VAL 65 1HG1 VAL 65 7.910 -5.935 5.056 355 HG12 VAL 65 2HG1 VAL 65 9.416 -5.932 5.982 356 HG13 VAL 65 3HG1 VAL 65 9.260 -4.914 4.534 357 HG21 VAL 65 3HG2 VAL 65 11.225 -5.913 3.342 358 HG22 VAL 65 1HG2 VAL 65 11.545 -6.702 4.893 359 HG23 VAL 65 2HG2 VAL 65 11.473 -7.660 3.402 360 H ASP 66 H ASP 66 9.415 -10.975 5.101 361 HA ASP 66 HA ASP 66 10.905 -11.525 2.881 362 HB2 ASP 66 1HB ASP 66 10.636 -12.713 5.136 363 HB3 ASP 66 2HB ASP 66 9.208 -13.497 4.465 364 H ASP 67 H ASP 67 7.656 -11.369 2.821 365 HA ASP 67 HA ASP 67 7.401 -12.006 -0.036 366 HB2 ASP 67 1HB ASP 67 7.073 -14.245 1.157 367 HB3 ASP 67 2HB ASP 67 5.594 -13.554 1.854 368 H TYR 68 H TYR 68 7.280 -9.722 1.717 369 HA TYR 68 HA TYR 68 4.484 -8.855 1.925 370 HB2 TYR 68 1HB TYR 68 7.122 -7.554 2.468 371 HB3 TYR 68 2HB TYR 68 5.687 -6.603 2.241 372 HD1 TYR 68 1HD TYR 68 5.769 -9.945 4.059 373 HD2 TYR 68 2HD TYR 68 5.264 -5.660 4.315 374 HE1 TYR 68 1HE TYR 68 5.059 -10.187 6.349 375 HE2 TYR 68 2HE TYR 68 4.433 -5.921 6.633 376 HH TYR 68 HH TYR 68 3.903 -9.085 8.138 377 H SER 69 H SER 69 3.552 -7.288 0.585 378 HA SER 69 HA SER 69 4.589 -7.061 -2.128 379 HB2 SER 69 1HB SER 69 2.324 -5.436 -1.541 380 HB3 SER 69 2HB SER 69 2.428 -6.848 -2.567 381 HG SER 69 HG SER 69 2.073 -8.137 -0.617 382 H TYR 70 H TYR 70 5.490 -5.082 -2.847 383 HA TYR 70 HA TYR 70 5.563 -2.857 -0.918 384 HB2 TYR 70 1HB TYR 70 7.809 -2.260 -1.419 385 HB3 TYR 70 2HB TYR 70 7.773 -3.910 -0.849 386 HD1 TYR 70 1HD TYR 70 7.958 -5.819 -2.551 387 HD2 TYR 70 2HD TYR 70 8.658 -1.703 -3.661 388 HE1 TYR 70 1HE TYR 70 9.093 -6.538 -4.622 389 HE2 TYR 70 2HE TYR 70 9.802 -2.480 -5.735 390 HH TYR 70 HH TYR 70 10.502 -5.927 -6.314 391 H LEU 71 H LEU 71 5.105 -0.978 -1.713 392 HA LEU 71 HA LEU 71 4.491 -0.675 -4.615 393 HB2 LEU 71 1HB LEU 71 3.694 1.116 -2.274 394 HB3 LEU 71 2HB LEU 71 3.252 1.304 -3.946 395 HG LEU 71 HG LEU 71 1.339 0.439 -3.260 396 HD11 LEU 71 1HD1 LEU 71 2.147 -1.203 -4.873 397 HD12 LEU 71 2HD1 LEU 71 0.966 -1.868 -3.733 398 HD13 LEU 71 3HD1 LEU 71 2.682 -2.240 -3.534 399 HD21 LEU 71 3HD2 LEU 71 0.928 -0.982 -1.343 400 HD22 LEU 71 1HD2 LEU 71 1.786 0.506 -0.954 401 HD23 LEU 71 2HD2 LEU 71 2.692 -1.034 -1.043 402 H VAL 72 H VAL 72 5.823 0.628 -5.763 403 HA VAL 72 HA VAL 72 7.204 2.855 -4.566 404 HB VAL 72 HB VAL 72 8.662 0.851 -4.202 405 HG11 VAL 72 1HG1 VAL 72 8.193 -0.412 -6.210 406 HG12 VAL 72 2HG1 VAL 72 9.020 0.807 -7.206 407 HG13 VAL 72 3HG1 VAL 72 9.927 -0.124 -5.993 408 HG21 VAL 72 3HG2 VAL 72 9.966 2.862 -6.085 409 HG22 VAL 72 1HG2 VAL 72 9.623 3.169 -4.378 410 HG23 VAL 72 2HG2 VAL 72 10.743 1.886 -4.829 411 H ALA 73 H ALA 73 8.231 4.074 -6.628 412 HA ALA 73 HA ALA 73 6.530 3.536 -9.016 413 HB1 ALA 73 1HB ALA 73 6.900 5.723 -9.760 414 HB2 ALA 73 2HB ALA 73 6.593 5.944 -8.024 415 HB3 ALA 73 3HB ALA 73 8.249 5.997 -8.678 416 H ALA 74 H ALA 74 7.722 3.389 -11.030 417 HA ALA 74 HA ALA 74 10.110 1.873 -10.828 418 HB1 ALA 74 1HB ALA 74 10.208 2.103 -13.294 419 HB2 ALA 74 2HB ALA 74 8.566 1.707 -12.742 420 HB3 ALA 74 3HB ALA 74 8.972 3.370 -13.216 421 H ASP 75 H ASP 75 9.727 5.244 -10.693 422 HA ASP 75 HA ASP 75 12.630 5.715 -11.221 423 HB2 ASP 75 1HB ASP 75 10.495 7.858 -11.124 424 HB3 ASP 75 2HB ASP 75 12.159 8.003 -11.694 425 H ASP 76 H ASP 76 10.616 5.204 -8.607 426 HA ASP 76 HA ASP 76 11.784 7.394 -6.916 427 HB2 ASP 76 1HB ASP 76 9.160 5.879 -6.623 428 HB3 ASP 76 2HB ASP 76 9.825 6.899 -5.381 429 H GLN 77 H GLN 77 12.936 4.709 -7.643 430 HA GLN 77 HA GLN 77 12.722 2.739 -5.752 431 HB2 GLN 77 1HB GLN 77 15.240 3.709 -7.140 432 HB3 GLN 77 2HB GLN 77 15.212 2.310 -6.075 433 HG2 GLN 77 1HG GLN 77 13.382 1.350 -7.588 434 HG3 GLN 77 2HG GLN 77 13.817 2.610 -8.752 435 HE21 GLN 77 1HE2 GLN 77 14.069 -0.211 -9.257 436 HE22 GLN 77 2HE2 GLN 77 15.761 -0.586 -9.463 437 H ASP 78 H ASP 78 15.149 5.389 -5.435 438 HA ASP 78 HA ASP 78 15.547 4.674 -2.571 439 HB2 ASP 78 1HB ASP 78 17.068 6.395 -4.533 440 HB3 ASP 78 2HB ASP 78 17.165 6.739 -2.815 441 H GLY 79 H GLY 79 13.712 6.822 -4.520 442 HA2 GLY 79 1HA GLY 79 13.206 9.061 -3.003 443 HA3 GLY 79 2HA GLY 79 12.062 8.283 -4.092 444 H THR 80 H THR 80 10.697 6.447 -3.120 445 HA THR 80 HA THR 80 10.322 6.631 -0.208 446 HB THR 80 HB THR 80 7.872 7.112 -1.894 447 HG1 THR 80 1HG THR 80 9.097 8.839 -2.567 448 HG21 THR 80 3HG2 THR 80 8.699 8.160 0.857 449 HG22 THR 80 1HG2 THR 80 7.717 6.703 0.576 450 HG23 THR 80 2HG2 THR 80 7.095 8.296 0.097 451 H ILE 81 H ILE 81 9.075 4.734 0.575 452 HA ILE 81 HA ILE 81 8.051 2.963 -1.533 453 HB ILE 81 HB ILE 81 10.610 2.687 -1.189 454 HG12 ILE 81 1HG1 ILE 81 8.635 0.405 -1.208 455 HG13 ILE 81 2HG1 ILE 81 9.526 1.211 -2.444 456 HG21 ILE 81 1HG2 ILE 81 11.459 1.428 0.663 457 HG22 ILE 81 2HG2 ILE 81 10.611 2.842 1.272 458 HG23 ILE 81 3HG2 ILE 81 9.827 1.247 1.362 459 HD11 ILE 81 3HD1 ILE 81 10.787 -0.638 -0.442 460 HD12 ILE 81 1HD1 ILE 81 10.479 -0.956 -2.158 461 HD13 ILE 81 2HD1 ILE 81 11.653 0.289 -1.694 462 H ILE 82 H ILE 82 6.542 1.417 -0.691 463 HA ILE 82 HA ILE 82 5.983 1.505 2.243 464 HB ILE 82 HB ILE 82 3.868 1.622 0.071 465 HG12 ILE 82 1HG1 ILE 82 4.635 3.872 1.977 466 HG13 ILE 82 2HG1 ILE 82 5.119 3.793 0.282 467 HG21 ILE 82 1HG2 ILE 82 3.587 1.831 3.115 468 HG22 ILE 82 2HG2 ILE 82 2.272 1.893 1.931 469 HG23 ILE 82 3HG2 ILE 82 3.181 0.408 2.140 470 HD11 ILE 82 3HD1 ILE 82 2.283 4.040 1.282 471 HD12 ILE 82 1HD1 ILE 82 3.230 5.208 0.354 472 HD13 ILE 82 2HD1 ILE 82 2.730 3.689 -0.408 473 H PHE 83 H PHE 83 6.345 -0.533 2.924 474 HA PHE 83 HA PHE 83 5.752 -2.879 1.205 475 HB2 PHE 83 1HB PHE 83 7.007 -2.565 3.953 476 HB3 PHE 83 2HB PHE 83 6.724 -4.091 3.228 477 HD1 PHE 83 2HD PHE 83 8.606 -0.860 2.834 478 HD2 PHE 83 1HD PHE 83 8.363 -5.011 1.673 479 HE1 PHE 83 2HE PHE 83 10.952 -0.784 2.041 480 HE2 PHE 83 1HE PHE 83 10.731 -4.893 0.883 481 HZ PHE 83 HZ PHE 83 12.014 -2.807 1.088 482 H PHE 84 H PHE 84 3.958 -4.330 1.821 483 HA PHE 84 HA PHE 84 2.719 -3.934 4.403 484 HB2 PHE 84 1HB PHE 84 0.472 -3.571 3.705 485 HB3 PHE 84 2HB PHE 84 1.436 -2.323 2.930 486 HD1 PHE 84 2HD PHE 84 1.988 -2.586 0.379 487 HD2 PHE 84 1HD PHE 84 -0.895 -5.072 2.461 488 HE1 PHE 84 2HE PHE 84 1.076 -3.374 -1.770 489 HE2 PHE 84 1HE PHE 84 -1.834 -5.768 0.286 490 HZ PHE 84 HZ PHE 84 -0.805 -4.977 -1.835 491 H LYS 85 H LYS 85 1.174 -5.714 4.872 492 HA LYS 85 HA LYS 85 0.841 -7.843 2.944 493 HB2 LYS 85 1HB LYS 85 3.031 -8.087 4.620 494 HB3 LYS 85 2HB LYS 85 1.847 -9.006 5.494 495 HG2 LYS 85 1HG LYS 85 2.594 -9.426 2.560 496 HG3 LYS 85 2HG LYS 85 3.303 -10.303 3.915 497 HD2 LYS 85 1HD LYS 85 1.786 -11.835 3.352 498 HD3 LYS 85 2HD LYS 85 0.793 -10.891 4.456 499 HE2 LYS 85 1HE LYS 85 -0.082 -9.626 2.474 500 HE3 LYS 85 2HE LYS 85 0.943 -10.574 1.403 501 HZ1 LYS 85 3HZ LYS 85 -1.294 -11.610 3.017 502 HZ2 LYS 85 1HZ LYS 85 -0.344 -12.520 1.994 503 HZ3 LYS 85 2HZ LYS 85 -1.291 -11.306 1.392 504 H ALA 86 H ALA 86 -1.304 -8.267 3.238 505 HA ALA 86 HA ALA 86 -2.631 -7.982 5.848 506 HB1 ALA 86 1HB ALA 86 -3.546 -9.191 3.197 507 HB2 ALA 86 2HB ALA 86 -4.552 -8.959 4.647 508 HB3 ALA 86 3HB ALA 86 -3.887 -7.552 3.794 509 H GLU 87 H GLU 87 -2.561 -9.585 7.358 510 HA GLU 87 HA GLU 87 -2.414 -12.421 6.476 511 HB2 GLU 87 1HB GLU 87 -0.759 -10.998 8.547 512 HB3 GLU 87 2HB GLU 87 -1.384 -12.568 8.996 513 HG2 GLU 87 1HG GLU 87 0.083 -12.142 6.366 514 HG3 GLU 87 2HG GLU 87 0.941 -12.406 7.870 515 H GLY 88 H GLY 88 -4.420 -13.136 6.827 516 HA2 GLY 88 1HA GLY 88 -6.351 -13.670 7.915 517 HA3 GLY 88 2HA GLY 88 -5.620 -12.991 9.380 518 H GLN 89 H GLN 89 -6.099 -10.930 10.029 519 HA GLN 89 HA GLN 89 -8.018 -9.248 8.522 520 HB2 GLN 89 1HB GLN 89 -8.556 -10.543 11.198 521 HB3 GLN 89 2HB GLN 89 -9.303 -9.017 10.756 522 HG2 GLN 89 1HG GLN 89 -9.591 -11.603 9.187 523 HG3 GLN 89 2HG GLN 89 -10.781 -10.898 10.265 524 HE21 GLN 89 1HE2 GLN 89 -10.448 -11.370 7.097 525 HE22 GLN 89 2HE2 GLN 89 -11.122 -9.871 6.489 526 H THR 90 H THR 90 -5.081 -9.188 9.293 527 HA THR 90 HA THR 90 -5.133 -6.481 10.441 528 HB THR 90 HB THR 90 -2.866 -8.409 10.980 529 HG1 THR 90 1HG THR 90 -4.553 -9.388 12.019 530 HG21 THR 90 3HG2 THR 90 -2.358 -6.866 12.823 531 HG22 THR 90 1HG2 THR 90 -3.813 -5.921 12.466 532 HG23 THR 90 2HG2 THR 90 -2.462 -5.962 11.312 533 H VAL 91 H VAL 91 -3.595 -5.096 9.419 534 HA VAL 91 HA VAL 91 -1.928 -6.257 7.249 535 HB VAL 91 HB VAL 91 -3.264 -3.521 7.190 536 HG11 VAL 91 1HG1 VAL 91 -2.285 -3.326 4.918 537 HG12 VAL 91 2HG1 VAL 91 -1.022 -3.480 6.136 538 HG13 VAL 91 3HG1 VAL 91 -1.455 -4.883 5.137 539 HG21 VAL 91 3HG2 VAL 91 -4.394 -4.368 5.141 540 HG22 VAL 91 1HG2 VAL 91 -3.736 -5.979 5.471 541 HG23 VAL 91 2HG2 VAL 91 -4.889 -5.231 6.611 542 H ILE 92 H ILE 92 0.176 -5.919 7.706 543 HA ILE 92 HA ILE 92 0.892 -3.848 9.695 544 HB ILE 92 HB ILE 92 2.529 -6.177 8.643 545 HG12 ILE 92 1HG1 ILE 92 2.181 -7.309 10.761 546 HG13 ILE 92 2HG1 ILE 92 0.989 -6.122 11.290 547 HG21 ILE 92 1HG2 ILE 92 2.782 -4.424 11.135 548 HG22 ILE 92 2HG2 ILE 92 3.889 -5.720 10.646 549 HG23 ILE 92 3HG2 ILE 92 3.742 -4.254 9.656 550 HD11 ILE 92 3HD1 ILE 92 -0.648 -7.058 9.825 551 HD12 ILE 92 1HD1 ILE 92 0.592 -7.926 8.865 552 HD13 ILE 92 2HD1 ILE 92 0.193 -8.428 10.519 553 H ILE 93 H ILE 93 0.969 -2.035 8.466 554 HA ILE 93 HA ILE 93 2.188 -1.954 5.794 555 HB ILE 93 HB ILE 93 1.351 0.478 7.410 556 HG12 ILE 93 1HG1 ILE 93 -0.595 -1.060 5.643 557 HG13 ILE 93 2HG1 ILE 93 -0.642 -1.094 7.411 558 HG21 ILE 93 1HG2 ILE 93 2.651 0.751 5.294 559 HG22 ILE 93 2HG2 ILE 93 1.423 -0.167 4.413 560 HG23 ILE 93 3HG2 ILE 93 1.029 1.403 5.106 561 HD11 ILE 93 3HD1 ILE 93 -1.120 1.335 5.658 562 HD12 ILE 93 1HD1 ILE 93 -2.265 0.466 6.686 563 HD13 ILE 93 2HD1 ILE 93 -0.945 1.380 7.431 564 H LYS 94 H LYS 94 4.312 -1.414 5.523 565 HA LYS 94 HA LYS 94 5.905 -0.459 7.838 566 HB2 LYS 94 1HB LYS 94 6.382 -2.793 5.972 567 HB3 LYS 94 2HB LYS 94 7.674 -2.125 6.877 568 HG2 LYS 94 1HG LYS 94 6.558 -2.659 9.004 569 HG3 LYS 94 2HG LYS 94 5.145 -3.269 8.120 570 HD2 LYS 94 1HD LYS 94 6.491 -5.043 7.102 571 HD3 LYS 94 2HD LYS 94 7.953 -4.444 7.883 572 HE2 LYS 94 1HE LYS 94 7.302 -5.118 10.012 573 HE3 LYS 94 2HE LYS 94 5.595 -5.100 9.631 574 HZ1 LYS 94 3HZ LYS 94 5.805 -7.145 8.482 575 HZ2 LYS 94 1HZ LYS 94 6.466 -7.309 9.931 576 HZ3 LYS 94 2HZ LYS 94 7.451 -7.161 8.609 577 H TYR 95 H TYR 95 6.298 1.678 7.099 578 HA TYR 95 HA TYR 95 7.087 2.031 4.230 579 HB2 TYR 95 1HB TYR 95 5.850 4.161 4.364 580 HB3 TYR 95 2HB TYR 95 4.816 2.767 4.599 581 HD1 TYR 95 1HD TYR 95 6.268 5.733 6.260 582 HD2 TYR 95 2HD TYR 95 3.789 2.241 6.728 583 HE1 TYR 95 1HE TYR 95 5.599 6.525 8.513 584 HE2 TYR 95 2HE TYR 95 3.181 2.990 9.042 585 HH TYR 95 HH TYR 95 3.195 5.427 10.421 586 H THR 96 H THR 96 8.344 4.141 3.858 587 HA THR 96 HA THR 96 9.515 5.377 6.170 588 HB THR 96 HB THR 96 10.920 3.346 6.023 589 HG1 THR 96 1HG THR 96 12.853 4.438 6.029 590 HG21 THR 96 3HG2 THR 96 11.785 4.367 3.280 591 HG22 THR 96 1HG2 THR 96 10.828 2.901 3.590 592 HG23 THR 96 2HG2 THR 96 12.494 3.016 4.180 593 H SER 97 H SER 97 10.832 7.210 5.559 594 HA SER 97 HA SER 97 10.373 8.266 2.823 595 HB2 SER 97 1HB SER 97 10.732 10.482 4.004 596 HB3 SER 97 2HB SER 97 9.227 9.641 4.371 597 HG SER 97 HG SER 97 10.541 10.559 6.164 598 H GLN 98 H GLN 98 12.603 6.545 4.370 599 HA GLN 98 HA GLN 98 14.886 7.651 2.935 600 HB2 GLN 98 1HB GLN 98 16.230 7.107 5.200 601 HB3 GLN 98 2HB GLN 98 15.742 8.710 4.737 602 HG2 GLN 98 1HG GLN 98 13.720 8.546 6.028 603 HG3 GLN 98 2HG GLN 98 14.039 6.826 6.306 604 HE21 GLN 98 1HE2 GLN 98 13.431 8.120 8.485 605 HE22 GLN 98 2HE2 GLN 98 14.772 8.622 9.496 606 H ARG 99 H ARG 99 15.021 6.188 1.994 607 HA ARG 99 HA ARG 99 14.514 3.417 1.845 608 HB2 ARG 99 1HB ARG 99 15.224 4.832 -0.086 609 HB3 ARG 99 2HB ARG 99 16.823 4.964 0.618 610 HG2 ARG 99 1HG ARG 99 17.219 3.476 -0.989 611 HG3 ARG 99 2HG ARG 99 16.975 2.364 0.339 612 HD2 ARG 99 1HD ARG 99 15.027 1.492 -0.586 613 HD3 ARG 99 2HD ARG 99 14.557 3.030 -1.323 614 HE ARG 99 HE ARG 99 16.765 2.452 -2.742 615 HH11 ARG 99 1HH1 ARG 99 13.575 1.190 -2.655 616 HH12 ARG 99 2HH1 ARG 99 13.820 -0.127 -3.774 617 HH21 ARG 99 1HH2 ARG 99 17.168 0.985 -4.473 618 HH22 ARG 99 2HH2 ARG 99 15.908 -0.054 -5.009 619 H ASN 100 H ASN 100 17.485 4.969 2.760 620 HA ASN 100 HA ASN 100 18.761 2.460 3.514 621 HB2 ASN 100 1HB ASN 100 20.750 3.692 4.120 622 HB3 ASN 100 2HB ASN 100 20.179 4.095 2.519 623 HD21 ASN 100 1HD2 ASN 100 19.140 5.348 5.668 624 HD22 ASN 100 2HD2 ASN 100 19.552 7.035 5.336 625 H THR 101 H THR 101 16.496 3.917 5.145 626 HA THR 101 HA THR 101 17.650 2.697 7.634 627 HB THR 101 HB THR 101 16.530 4.264 9.006 628 HG1 THR 101 1HG THR 101 15.289 5.031 6.614 629 HG21 THR 101 3HG2 THR 101 17.700 5.983 6.808 630 HG22 THR 101 1HG2 THR 101 18.721 4.977 7.854 631 HG23 THR 101 2HG2 THR 101 17.721 6.261 8.559 632 H LYS 102 H LYS 102 16.016 1.832 9.137 633 HA LYS 102 HA LYS 102 14.478 -0.063 7.683 634 HB2 LYS 102 1HB LYS 102 13.867 -1.025 9.708 635 HB3 LYS 102 2HB LYS 102 15.482 -0.380 9.979 636 HG2 LYS 102 1HG LYS 102 14.712 1.383 11.343 637 HG3 LYS 102 2HG LYS 102 13.035 1.217 10.838 638 HD2 LYS 102 1HD LYS 102 14.541 -0.869 12.458 639 HD3 LYS 102 2HD LYS 102 13.448 0.362 13.092 640 HE2 LYS 102 1HE LYS 102 11.718 -0.746 11.302 641 HE3 LYS 102 2HE LYS 102 12.801 -2.105 11.461 642 HZ1 LYS 102 3HZ LYS 102 11.469 -0.739 13.718 643 HZ2 LYS 102 1HZ LYS 102 12.473 -2.026 13.881 644 HZ3 LYS 102 2HZ LYS 102 11.033 -2.209 13.121 645 H LEU 103 H LEU 103 12.147 -0.528 8.434 646 HA LEU 103 HA LEU 103 10.495 1.673 7.422 647 HB2 LEU 103 1HB LEU 103 10.002 -1.199 8.271 648 HB3 LEU 103 2HB LEU 103 8.718 -0.182 7.601 649 HG LEU 103 HG LEU 103 9.329 -1.427 5.764 650 HD11 LEU 103 1HD1 LEU 103 11.005 1.077 5.390 651 HD12 LEU 103 2HD1 LEU 103 9.237 0.957 5.172 652 HD13 LEU 103 3HD1 LEU 103 10.341 0.058 4.134 653 HD21 LEU 103 3HD2 LEU 103 11.339 -2.101 5.025 654 HD22 LEU 103 1HD2 LEU 103 11.534 -2.262 6.777 655 HD23 LEU 103 2HD2 LEU 103 12.278 -0.890 5.929 656 H LYS 104 H LYS 104 8.741 2.489 8.495 657 HA LYS 104 HA LYS 104 8.518 2.361 11.424 658 HB2 LYS 104 1HB LYS 104 6.859 3.548 9.145 659 HB3 LYS 104 2HB LYS 104 6.256 3.492 10.779 660 HG2 LYS 104 1HG LYS 104 7.113 5.599 10.757 661 HG3 LYS 104 2HG LYS 104 8.467 4.713 11.456 662 HD2 LYS 104 1HD LYS 104 9.566 4.686 9.185 663 HD3 LYS 104 2HD LYS 104 8.145 5.500 8.530 664 HE2 LYS 104 1HE LYS 104 9.681 7.230 8.846 665 HE3 LYS 104 2HE LYS 104 8.592 7.385 10.229 666 HZ1 LYS 104 3HZ LYS 104 11.242 6.069 10.237 667 HZ2 LYS 104 1HZ LYS 104 10.308 6.246 11.566 668 HZ3 LYS 104 2HZ LYS 104 10.947 7.575 10.801 669 H ALA 105 H ALA 105 6.092 1.752 12.096 670 HA ALA 105 HA ALA 105 5.005 -0.485 10.509 671 HB1 ALA 105 1HB ALA 105 6.326 -1.619 12.233 672 HB2 ALA 105 2HB ALA 105 5.550 -0.640 13.504 673 HB3 ALA 105 3HB ALA 105 4.597 -1.802 12.558 674 H LYS 106 H LYS 106 2.983 0.078 10.071 675 HA LYS 106 HA LYS 106 1.274 1.143 12.268 676 HB2 LYS 106 1HB LYS 106 1.290 1.884 9.340 677 HB3 LYS 106 2HB LYS 106 -0.243 1.381 9.997 678 HG2 LYS 106 1HG LYS 106 0.484 3.166 11.946 679 HG3 LYS 106 2HG LYS 106 1.247 3.885 10.505 680 HD2 LYS 106 1HD LYS 106 -1.112 3.346 9.414 681 HD3 LYS 106 2HD LYS 106 -1.659 3.245 11.078 682 HE2 LYS 106 1HE LYS 106 -0.344 5.653 9.697 683 HE3 LYS 106 2HE LYS 106 -2.074 5.452 9.961 684 HZ1 LYS 106 3HZ LYS 106 -0.025 5.780 12.054 685 HZ2 LYS 106 1HZ LYS 106 -1.644 5.524 12.345 686 HZ3 LYS 106 2HZ LYS 106 -1.145 6.885 11.590 687 H ALA 107 H ALA 107 0.570 -0.775 13.090 688 HA ALA 107 HA ALA 107 -0.465 -2.846 11.227 689 HB1 ALA 107 1HB ALA 107 -0.490 -2.654 14.255 690 HB2 ALA 107 2HB ALA 107 -1.108 -4.020 13.286 691 HB3 ALA 107 3HB ALA 107 0.631 -3.651 13.273 692 H LEU 108 H LEU 108 -2.625 -2.875 10.738 693 HA LEU 108 HA LEU 108 -4.597 -1.382 12.386 694 HB2 LEU 108 1HB LEU 108 -4.432 -1.385 9.311 695 HB3 LEU 108 2HB LEU 108 -5.850 -0.932 10.224 696 HG LEU 108 HG LEU 108 -4.932 1.009 9.457 697 HD11 LEU 108 1HD1 LEU 108 -4.437 2.358 11.403 698 HD12 LEU 108 2HD1 LEU 108 -4.044 0.919 12.353 699 HD13 LEU 108 3HD1 LEU 108 -5.707 1.177 11.783 700 HD21 LEU 108 3HD2 LEU 108 -2.604 0.034 9.071 701 HD22 LEU 108 1HD2 LEU 108 -2.242 0.591 10.718 702 HD23 LEU 108 2HD2 LEU 108 -2.758 1.749 9.464 703 H THR 109 H THR 109 -6.755 -2.471 12.158 704 HA THR 109 HA THR 109 -6.597 -5.240 11.229 705 HB THR 109 HB THR 109 -9.184 -4.988 11.415 706 HG1 THR 109 1HG THR 109 -8.608 -3.120 13.373 707 HG21 THR 109 3HG2 THR 109 -7.411 -4.903 13.868 708 HG22 THR 109 1HG2 THR 109 -7.722 -6.332 12.873 709 HG23 THR 109 2HG2 THR 109 -9.059 -5.572 13.779 710 H LEU 110 H LEU 110 -7.709 -6.053 9.368 711 HA LEU 110 HA LEU 110 -7.642 -4.402 7.029 712 HB2 LEU 110 1HB LEU 110 -8.806 -7.095 7.759 713 HB3 LEU 110 2HB LEU 110 -9.421 -6.344 6.308 714 HG LEU 110 HG LEU 110 -6.484 -6.911 6.818 715 HD11 LEU 110 1HD1 LEU 110 -6.741 -8.704 5.187 716 HD12 LEU 110 2HD1 LEU 110 -8.442 -8.287 4.925 717 HD13 LEU 110 3HD1 LEU 110 -7.914 -8.960 6.474 718 HD21 LEU 110 3HD2 LEU 110 -7.915 -6.093 4.226 719 HD22 LEU 110 1HD2 LEU 110 -6.178 -6.405 4.435 720 HD23 LEU 110 2HD2 LEU 110 -6.893 -4.994 5.183 721 H SER 111 H SER 111 -10.225 -4.970 9.406 722 HA SER 111 HA SER 111 -12.239 -3.579 7.987 723 HB2 SER 111 1HB SER 111 -12.502 -4.980 10.106 724 HB3 SER 111 2HB SER 111 -12.008 -3.534 11.003 725 HG SER 111 HG SER 111 -13.790 -2.469 10.258 726 H GLN 112 H GLN 112 -9.685 -2.230 10.233 727 HA GLN 112 HA GLN 112 -10.657 0.363 10.393 728 HB2 GLN 112 1HB GLN 112 -8.087 -1.003 10.833 729 HB3 GLN 112 2HB GLN 112 -7.823 0.582 10.135 730 HG2 GLN 112 1HG GLN 112 -8.022 1.503 12.127 731 HG3 GLN 112 2HG GLN 112 -9.723 1.031 12.180 732 HE21 GLN 112 1HE2 GLN 112 -10.314 -0.277 13.863 733 HE22 GLN 112 2HE2 GLN 112 -9.187 -1.344 14.722 734 H LEU 113 H LEU 113 -8.289 -0.894 8.069 735 HA LEU 113 HA LEU 113 -8.059 1.345 6.374 736 HB2 LEU 113 1HB LEU 113 -7.749 -1.675 6.010 737 HB3 LEU 113 2HB LEU 113 -7.442 -0.588 4.671 738 HG LEU 113 HG LEU 113 -6.053 -0.121 7.326 739 HD11 LEU 113 1HD1 LEU 113 -5.142 -2.028 5.129 740 HD12 LEU 113 2HD1 LEU 113 -5.601 -2.452 6.804 741 HD13 LEU 113 3HD1 LEU 113 -4.162 -1.471 6.504 742 HD21 LEU 113 3HD2 LEU 113 -5.088 0.345 4.453 743 HD22 LEU 113 1HD2 LEU 113 -4.404 0.995 5.954 744 HD23 LEU 113 2HD2 LEU 113 -5.961 1.574 5.390 745 H LYS 114 H LYS 114 -10.341 -1.420 6.150 746 HA LYS 114 HA LYS 114 -11.583 -0.628 3.685 747 HB2 LYS 114 1HB LYS 114 -11.772 -2.858 4.638 748 HB3 LYS 114 2HB LYS 114 -12.598 -2.219 6.066 749 HG2 LYS 114 1HG LYS 114 -14.436 -1.429 4.461 750 HG3 LYS 114 2HG LYS 114 -13.658 -2.402 3.213 751 HD2 LYS 114 1HD LYS 114 -13.934 -4.379 4.821 752 HD3 LYS 114 2HD LYS 114 -14.728 -3.251 5.966 753 HE2 LYS 114 1HE LYS 114 -16.404 -2.736 4.124 754 HE3 LYS 114 2HE LYS 114 -15.699 -4.056 3.176 755 HZ1 LYS 114 3HZ LYS 114 -16.291 -5.565 5.008 756 HZ2 LYS 114 1HZ LYS 114 -17.625 -4.771 4.438 757 HZ3 LYS 114 2HZ LYS 114 -16.923 -4.315 5.850 758 H LYS 115 H LYS 115 -12.204 0.318 7.129 759 HA LYS 115 HA LYS 115 -14.646 1.701 6.304 760 HB2 LYS 115 1HB LYS 115 -14.064 0.424 8.534 761 HB3 LYS 115 2HB LYS 115 -13.490 2.018 9.019 762 HG2 LYS 115 1HG LYS 115 -15.618 2.949 8.970 763 HG3 LYS 115 2HG LYS 115 -16.212 1.871 7.702 764 HD2 LYS 115 1HD LYS 115 -15.676 0.934 10.536 765 HD3 LYS 115 2HD LYS 115 -17.236 1.514 9.958 766 HE2 LYS 115 1HE LYS 115 -17.278 -0.284 8.237 767 HE3 LYS 115 2HE LYS 115 -15.735 -0.902 8.842 768 HZ1 LYS 115 3HZ LYS 115 -18.196 -0.677 10.491 769 HZ2 LYS 115 1HZ LYS 115 -16.781 -1.356 10.952 770 HZ3 LYS 115 2HZ LYS 115 -17.674 -2.066 9.793 771 H GLU 116 H GLU 116 -11.281 2.552 6.658 772 HA GLU 116 HA GLU 116 -11.745 5.416 6.551 773 HB2 GLU 116 1HB GLU 116 -9.351 3.579 6.204 774 HB3 GLU 116 2HB GLU 116 -9.242 5.325 5.917 775 HG2 GLU 116 1HG GLU 116 -9.966 5.819 8.181 776 HG3 GLU 116 2HG GLU 116 -10.325 4.127 8.479 777 H PHE 117 H PHE 117 -10.641 2.977 4.093 778 HA PHE 117 HA PHE 117 -11.166 5.013 1.996 779 HB2 PHE 117 1HB PHE 117 -9.167 2.772 1.937 780 HB3 PHE 117 2HB PHE 117 -9.269 4.150 0.868 781 HD1 PHE 117 2HD PHE 117 -9.058 6.522 2.040 782 HD2 PHE 117 1HD PHE 117 -7.704 2.818 3.794 783 HE1 PHE 117 2HE PHE 117 -7.611 7.785 3.602 784 HE2 PHE 117 1HE PHE 117 -6.325 4.094 5.405 785 HZ PHE 117 HZ PHE 117 -6.258 6.565 5.312 786 H TYR 118 H TYR 118 -12.965 2.622 3.023 787 HA TYR 118 HA TYR 118 -13.911 2.119 0.290 788 HB2 TYR 118 1HB TYR 118 -12.237 0.273 1.232 789 HB3 TYR 118 2HB TYR 118 -13.647 -0.273 2.108 790 HD1 TYR 118 1HD TYR 118 -12.827 0.831 -1.436 791 HD2 TYR 118 2HD TYR 118 -14.654 -2.121 1.128 792 HE1 TYR 118 1HE TYR 118 -13.075 -0.708 -3.387 793 HE2 TYR 118 2HE TYR 118 -14.946 -3.631 -0.808 794 HH TYR 118 HH TYR 118 -14.038 -2.786 -4.146 795 H GLN 119 H GLN 119 -14.850 3.792 2.578 796 HA GLN 119 HA GLN 119 -16.878 2.562 3.999 797 HB2 GLN 119 1HB GLN 119 -17.451 5.372 3.401 798 HB3 GLN 119 2HB GLN 119 -17.181 4.486 4.854 799 HG2 GLN 119 1HG GLN 119 -15.549 5.871 5.242 800 HG3 GLN 119 2HG GLN 119 -14.611 4.768 4.227 801 HE21 GLN 119 1HE2 GLN 119 -13.297 6.136 3.016 802 HE22 GLN 119 2HE2 GLN 119 -13.884 7.435 2.008 803 H THR 120 H THR 120 -17.144 4.827 1.241 804 HA THR 120 HA THR 120 -19.943 4.302 0.920 805 HB THR 120 HB THR 120 -19.983 6.040 -0.647 806 HG1 THR 120 1HG THR 120 -18.205 6.742 -1.785 807 HG21 THR 120 3HG2 THR 120 -17.459 6.804 0.872 808 HG22 THR 120 1HG2 THR 120 -19.067 6.811 1.622 809 HG23 THR 120 2HG2 THR 120 -18.731 7.866 0.253 810 H ARG 121 H ARG 121 -20.830 4.024 -1.539 811 HA ARG 121 HA ARG 121 -19.698 1.463 -2.515 812 HB2 ARG 121 1HB ARG 121 -22.247 2.067 -2.115 813 HB3 ARG 121 2HB ARG 121 -22.113 2.902 -3.659 814 HG2 ARG 121 1HG ARG 121 -21.421 -0.039 -3.240 815 HG3 ARG 121 2HG ARG 121 -23.035 0.552 -3.649 816 HD2 ARG 121 1HD ARG 121 -21.963 1.601 -5.723 817 HD3 ARG 121 2HD ARG 121 -20.544 0.580 -5.378 818 HE ARG 121 HE ARG 121 -22.375 -1.301 -5.257 819 HH11 ARG 121 1HH1 ARG 121 -22.228 1.210 -7.769 820 HH12 ARG 121 2HH1 ARG 121 -23.610 0.636 -8.620 821 HH21 ARG 121 1HH2 ARG 121 -24.026 -2.152 -6.365 822 HH22 ARG 121 2HH2 ARG 121 -24.693 -1.446 -7.799 823 H SER 122 H SER 122 -20.351 4.845 -3.648 824 HA SER 122 HA SER 122 -19.406 4.456 -6.286 825 HB2 SER 122 1HB SER 122 -19.159 6.865 -4.463 826 HB3 SER 122 2HB SER 122 -18.942 6.902 -6.227 827 HG SER 122 HG SER 122 -20.956 7.599 -5.663 828 H GLN 123 H GLN 123 -17.546 5.105 -3.302 829 HA GLN 123 HA GLN 123 -15.029 5.652 -4.466 830 HB2 GLN 123 1HB GLN 123 -15.491 6.081 -2.162 831 HB3 GLN 123 2HB GLN 123 -15.955 4.393 -1.878 832 HG2 GLN 123 1HG GLN 123 -13.667 3.632 -1.969 833 HG3 GLN 123 2HG GLN 123 -13.114 5.238 -2.527 834 HE21 GLN 123 1HE2 GLN 123 -15.590 4.698 -0.060 835 HE22 GLN 123 2HE2 GLN 123 -14.597 5.452 1.221 836 H LYS 124 H LYS 124 -16.751 2.606 -4.202 837 HA LYS 124 HA LYS 124 -14.473 0.874 -4.203 838 HB2 LYS 124 1HB LYS 124 -17.279 0.342 -5.250 839 HB3 LYS 124 2HB LYS 124 -16.084 -0.857 -4.799 840 HG2 LYS 124 1HG LYS 124 -16.150 0.006 -2.414 841 HG3 LYS 124 2HG LYS 124 -17.424 1.118 -2.898 842 HD2 LYS 124 1HD LYS 124 -18.585 -0.749 -1.996 843 HD3 LYS 124 2HD LYS 124 -18.729 -0.913 -3.755 844 HE2 LYS 124 1HE LYS 124 -16.311 -2.165 -3.234 845 HE3 LYS 124 2HE LYS 124 -17.211 -2.534 -1.755 846 HZ1 LYS 124 3HZ LYS 124 -17.997 -3.111 -4.540 847 HZ2 LYS 124 1HZ LYS 124 -18.963 -3.391 -3.268 848 HZ3 LYS 124 2HZ LYS 124 -17.517 -4.226 -3.441 849 H ARG 125 H ARG 125 -15.926 2.807 -6.691 850 HA ARG 125 HA ARG 125 -14.748 1.393 -8.971 851 HB2 ARG 125 1HB ARG 125 -16.017 4.114 -8.496 852 HB3 ARG 125 2HB ARG 125 -14.914 3.932 -9.845 853 HG2 ARG 125 1HG ARG 125 -17.282 3.614 -10.401 854 HG3 ARG 125 2HG ARG 125 -16.200 2.288 -10.880 855 HD2 ARG 125 1HD ARG 125 -16.992 0.914 -9.024 856 HD3 ARG 125 2HD ARG 125 -17.949 2.235 -8.376 857 HE ARG 125 HE ARG 125 -19.042 2.091 -10.780 858 HH11 ARG 125 1HH1 ARG 125 -17.971 -0.813 -9.120 859 HH12 ARG 125 2HH1 ARG 125 -19.413 -1.713 -9.362 860 HH21 ARG 125 1HH2 ARG 125 -20.820 0.845 -11.439 861 HH22 ARG 125 2HH2 ARG 125 -21.071 -0.741 -10.762 862 H GLU 126 H GLU 126 -13.924 4.439 -7.251 863 HA GLU 126 HA GLU 126 -11.613 4.846 -8.631 864 HB2 GLU 126 1HB GLU 126 -12.834 5.775 -6.056 865 HB3 GLU 126 2HB GLU 126 -11.094 5.974 -6.095 866 HG2 GLU 126 1HG GLU 126 -11.134 7.625 -7.495 867 HG3 GLU 126 2HG GLU 126 -12.256 6.875 -8.631 868 H VAL 127 H VAL 127 -11.902 3.358 -5.453 869 HA VAL 127 HA VAL 127 -9.191 2.787 -4.980 870 HB VAL 127 HB VAL 127 -11.664 1.221 -4.154 871 HG11 VAL 127 1HG1 VAL 127 -10.402 0.248 -2.354 872 HG12 VAL 127 2HG1 VAL 127 -9.539 -0.135 -3.846 873 HG13 VAL 127 3HG1 VAL 127 -8.937 1.151 -2.798 874 HG21 VAL 127 3HG2 VAL 127 -10.014 3.294 -2.621 875 HG22 VAL 127 1HG2 VAL 127 -11.540 3.658 -3.439 876 HG23 VAL 127 2HG2 VAL 127 -11.517 2.513 -2.108 877 H ASP 128 H ASP 128 -11.608 0.631 -6.563 878 HA ASP 128 HA ASP 128 -9.706 -1.395 -7.305 879 HB2 ASP 128 1HB ASP 128 -12.182 -1.622 -6.997 880 HB3 ASP 128 2HB ASP 128 -12.416 -0.733 -8.510 881 H ASP 129 H ASP 129 -10.457 1.701 -8.692 882 HA ASP 129 HA ASP 129 -9.506 1.179 -11.376 883 HB2 ASP 129 1HB ASP 129 -11.078 3.060 -10.652 884 HB3 ASP 129 2HB ASP 129 -9.670 3.877 -9.976 885 H TYR 130 H TYR 130 -8.147 2.690 -8.410 886 HA TYR 130 HA TYR 130 -5.474 3.066 -9.351 887 HB2 TYR 130 1HB TYR 130 -6.313 2.362 -6.548 888 HB3 TYR 130 2HB TYR 130 -4.854 3.186 -7.043 889 HD1 TYR 130 1HD TYR 130 -6.165 5.274 -8.983 890 HD2 TYR 130 2HD TYR 130 -7.247 3.936 -5.033 891 HE1 TYR 130 1HE TYR 130 -7.184 7.465 -8.509 892 HE2 TYR 130 2HE TYR 130 -8.309 6.088 -4.572 893 HH TYR 130 HH TYR 130 -8.944 8.203 -5.486 894 H VAL 131 H VAL 131 -7.154 0.116 -8.199 895 HA VAL 131 HA VAL 131 -4.741 -1.533 -8.222 896 HB VAL 131 HB VAL 131 -7.664 -2.414 -8.506 897 HG11 VAL 131 1HG1 VAL 131 -5.149 -3.907 -7.728 898 HG12 VAL 131 2HG1 VAL 131 -6.780 -4.543 -7.413 899 HG13 VAL 131 3HG1 VAL 131 -6.257 -4.270 -9.074 900 HG21 VAL 131 3HG2 VAL 131 -6.046 -2.270 -5.935 901 HG22 VAL 131 1HG2 VAL 131 -7.360 -1.172 -6.375 902 HG23 VAL 131 2HG2 VAL 131 -7.718 -2.858 -6.133 903 H ALA 132 H ALA 132 -6.724 -0.243 -10.763 904 HA ALA 132 HA ALA 132 -5.668 -2.253 -12.680 905 HB1 ALA 132 1HB ALA 132 -7.763 -1.889 -13.936 906 HB2 ALA 132 2HB ALA 132 -8.058 -2.492 -12.307 907 HB3 ALA 132 3HB ALA 132 -8.319 -0.771 -12.663 908 H GLY 133 H GLY 133 -4.657 0.453 -11.686 909 HA2 GLY 133 1HA GLY 133 -3.785 1.387 -14.365 910 HA3 GLY 133 2HA GLY 133 -4.264 2.564 -13.122 911 H LEU 134 H LEU 134 -2.794 -0.399 -11.999 912 HA LEU 134 HA LEU 134 -0.218 0.978 -11.455 913 HB2 LEU 134 1HB LEU 134 0.252 -0.880 -9.917 914 HB3 LEU 134 2HB LEU 134 -1.206 0.014 -9.517 915 HG LEU 134 HG LEU 134 -2.519 -1.871 -10.705 916 HD11 LEU 134 1HD1 LEU 134 0.106 -3.320 -10.250 917 HD12 LEU 134 2HD1 LEU 134 -0.733 -3.137 -11.807 918 HD13 LEU 134 3HD1 LEU 134 -1.432 -4.123 -10.528 919 HD21 LEU 134 3HD2 LEU 134 -2.530 -3.240 -8.661 920 HD22 LEU 134 1HD2 LEU 134 -2.512 -1.521 -8.279 921 HD23 LEU 134 2HD2 LEU 134 -1.020 -2.477 -8.128 922 H ARG 135 H ARG 135 1.746 -0.376 -11.782 923 HA ARG 135 HA ARG 135 1.591 -2.273 -14.068 924 HB2 ARG 135 1HB ARG 135 3.516 -0.122 -13.336 925 HB3 ARG 135 2HB ARG 135 4.293 -1.670 -13.565 926 HG2 ARG 135 1HG ARG 135 3.961 -1.722 -15.791 927 HG3 ARG 135 2HG ARG 135 2.361 -0.974 -15.715 928 HD2 ARG 135 1HD ARG 135 3.220 1.203 -15.586 929 HD3 ARG 135 2HD ARG 135 4.833 0.685 -15.165 930 HE ARG 135 HE ARG 135 3.447 0.294 -17.795 931 HH11 ARG 135 1HH1 ARG 135 6.524 0.654 -16.037 932 HH12 ARG 135 2HH1 ARG 135 7.447 1.072 -17.440 933 HH21 ARG 135 1HH2 ARG 135 4.803 0.696 -19.734 934 HH22 ARG 135 2HH2 ARG 135 6.441 1.238 -19.475 935 H THR 136 H THR 136 3.070 -4.089 -13.747 936 HA THR 136 HA THR 136 3.199 -4.994 -10.931 937 HB THR 136 HB THR 136 2.576 -7.152 -12.588 938 HG1 THR 136 1HG THR 136 1.214 -6.614 -14.055 939 HG21 THR 136 3HG2 THR 136 0.233 -6.929 -11.601 940 HG22 THR 136 1HG2 THR 136 0.826 -5.433 -10.833 941 HG23 THR 136 2HG2 THR 136 1.602 -6.989 -10.483 942 H GLU 137 H GLU 137 5.016 -4.288 -13.430 943 HA GLU 137 HA GLU 137 7.351 -5.625 -13.072 944 HB2 GLU 137 1HB GLU 137 5.805 -7.628 -13.985 945 HB3 GLU 137 2HB GLU 137 5.918 -6.797 -15.515 946 HG2 GLU 137 1HG GLU 137 7.697 -8.272 -15.674 947 HG3 GLU 137 2HG GLU 137 8.548 -6.893 -14.984 Start of MODEL 2 1 H1 GLY 19 H GLY 19 -16.207 -16.087 -7.320 2 HA2 GLY 19 1HA GLY 19 -14.553 -14.689 -9.336 3 HA3 GLY 19 2HA GLY 19 -16.301 -14.935 -9.465 4 H HIS 20 H HIS 20 -13.885 -12.814 -8.514 5 HA HIS 20 HA HIS 20 -13.742 -10.930 -7.365 6 HB2 HIS 20 1HB HIS 20 -15.226 -10.694 -9.583 7 HB3 HIS 20 2HB HIS 20 -16.388 -10.034 -8.450 8 HD1 HIS 20 1HD HIS 20 -14.457 -8.427 -10.738 9 HD2 HIS 20 2HD HIS 20 -14.196 -8.516 -6.527 10 HE1 HIS 20 1HE HIS 20 -12.975 -6.491 -10.077 11 H MET 21 H MET 21 -14.091 -12.303 -5.302 12 HA MET 21 HA MET 21 -15.857 -10.776 -3.609 13 HB2 MET 21 1HB MET 21 -17.190 -12.840 -4.605 14 HB3 MET 21 2HB MET 21 -16.257 -13.787 -3.447 15 HG2 MET 21 1HG MET 21 -17.943 -11.336 -2.756 16 HG3 MET 21 2HG MET 21 -18.557 -12.973 -2.741 17 HE1 MET 21 3HE MET 21 -18.991 -11.126 -0.330 18 HE2 MET 21 1HE MET 21 -19.488 -12.830 -0.366 19 HE3 MET 21 2HE MET 21 -18.587 -12.200 1.028 20 H LYS 22 H LYS 22 -15.054 -10.803 -1.506 21 HA LYS 22 HA LYS 22 -13.464 -10.689 0.010 22 HB2 LYS 22 1HB LYS 22 -13.194 -13.430 -0.601 23 HB3 LYS 22 2HB LYS 22 -11.565 -12.771 -0.815 24 HG2 LYS 22 1HG LYS 22 -11.749 -11.730 1.448 25 HG3 LYS 22 2HG LYS 22 -13.342 -12.463 1.649 26 HD2 LYS 22 1HD LYS 22 -10.670 -13.925 1.445 27 HD3 LYS 22 2HD LYS 22 -11.661 -13.700 2.871 28 HE2 LYS 22 1HE LYS 22 -12.568 -15.681 2.468 29 HE3 LYS 22 2HE LYS 22 -13.464 -14.911 1.158 30 HZ1 LYS 22 3HZ LYS 22 -11.555 -15.559 -0.308 31 HZ2 LYS 22 1HZ LYS 22 -12.360 -16.833 0.328 32 HZ3 LYS 22 2HZ LYS 22 -10.907 -16.387 0.945 33 H PHE 23 H PHE 23 -10.848 -10.334 -0.019 34 HA PHE 23 HA PHE 23 -10.594 -8.283 -2.108 35 HB2 PHE 23 1HB PHE 23 -9.231 -8.926 0.518 36 HB3 PHE 23 2HB PHE 23 -8.384 -7.993 -0.690 37 HD1 PHE 23 1HD PHE 23 -10.168 -6.099 -1.849 38 HD2 PHE 23 2HD PHE 23 -9.899 -7.432 2.254 39 HE1 PHE 23 1HE PHE 23 -10.995 -3.918 -1.085 40 HE2 PHE 23 2HE PHE 23 -10.752 -5.208 2.998 41 HZ PHE 23 HZ PHE 23 -11.331 -3.477 1.333 42 H THR 24 H THR 24 -8.283 -8.121 -2.994 43 HA THR 24 HA THR 24 -6.900 -10.671 -3.231 44 HB THR 24 HB THR 24 -6.155 -9.888 -5.569 45 HG1 THR 24 1HG THR 24 -7.344 -8.507 -6.629 46 HG21 THR 24 3HG2 THR 24 -8.109 -11.022 -6.582 47 HG22 THR 24 1HG2 THR 24 -9.048 -10.758 -5.081 48 HG23 THR 24 2HG2 THR 24 -7.644 -11.806 -5.065 49 H ASP 25 H ASP 25 -4.555 -10.210 -3.653 50 HA ASP 25 HA ASP 25 -3.805 -8.831 -1.346 51 HB2 ASP 25 1HB ASP 25 -2.710 -10.732 -2.960 52 HB3 ASP 25 2HB ASP 25 -1.778 -9.361 -3.537 53 H GLN 26 H GLN 26 -3.799 -7.852 -4.699 54 HA GLN 26 HA GLN 26 -2.295 -5.421 -4.509 55 HB2 GLN 26 1HB GLN 26 -4.565 -5.744 -6.452 56 HB3 GLN 26 2HB GLN 26 -3.034 -4.895 -6.631 57 HG2 GLN 26 1HG GLN 26 -2.585 -6.731 -7.912 58 HG3 GLN 26 2HG GLN 26 -2.035 -7.363 -6.378 59 HE21 GLN 26 1HE2 GLN 26 -5.022 -7.129 -8.435 60 HE22 GLN 26 2HE2 GLN 26 -5.513 -8.786 -8.117 61 H GLN 27 H GLN 27 -5.763 -6.200 -4.125 62 HA GLN 27 HA GLN 27 -6.783 -3.537 -4.079 63 HB2 GLN 27 1HB GLN 27 -7.882 -5.987 -2.672 64 HB3 GLN 27 2HB GLN 27 -8.781 -4.555 -3.044 65 HG2 GLN 27 1HG GLN 27 -7.548 -6.098 -5.326 66 HG3 GLN 27 2HG GLN 27 -8.941 -6.765 -4.484 67 HE21 GLN 27 1HE2 GLN 27 -8.545 -5.645 -7.380 68 HE22 GLN 27 2HE2 GLN 27 -9.855 -4.514 -7.505 69 H ILE 28 H ILE 28 -5.713 -5.754 -1.482 70 HA ILE 28 HA ILE 28 -6.195 -3.918 0.669 71 HB ILE 28 HB ILE 28 -4.389 -6.368 0.460 72 HG12 ILE 28 1HG1 ILE 28 -7.178 -5.969 1.650 73 HG13 ILE 28 2HG1 ILE 28 -6.835 -6.733 0.104 74 HG21 ILE 28 1HG2 ILE 28 -3.679 -4.865 2.341 75 HG22 ILE 28 2HG2 ILE 28 -5.355 -4.903 2.961 76 HG23 ILE 28 3HG2 ILE 28 -4.345 -6.365 2.921 77 HD11 ILE 28 3HD1 ILE 28 -5.618 -8.535 1.219 78 HD12 ILE 28 1HD1 ILE 28 -5.992 -7.835 2.809 79 HD13 ILE 28 2HD1 ILE 28 -7.295 -8.426 1.774 80 H GLY 29 H GLY 29 -3.284 -4.641 -1.329 81 HA2 GLY 29 1HA GLY 29 -1.424 -3.027 -0.027 82 HA3 GLY 29 2HA GLY 29 -1.443 -3.371 -1.770 83 H VAL 30 H VAL 30 -3.777 -2.091 -2.568 84 HA VAL 30 HA VAL 30 -2.975 0.648 -2.755 85 HB VAL 30 HB VAL 30 -5.493 -0.894 -3.466 86 HG11 VAL 30 1HG1 VAL 30 -6.404 1.029 -4.592 87 HG12 VAL 30 2HG1 VAL 30 -6.233 1.427 -2.891 88 HG13 VAL 30 3HG1 VAL 30 -5.048 2.062 -4.054 89 HG21 VAL 30 3HG2 VAL 30 -3.517 -1.249 -4.898 90 HG22 VAL 30 1HG2 VAL 30 -4.704 -0.281 -5.786 91 HG23 VAL 30 2HG2 VAL 30 -3.291 0.503 -5.074 92 H LEU 31 H LEU 31 -5.569 -0.925 -0.770 93 HA LEU 31 HA LEU 31 -6.396 1.555 0.394 94 HB2 LEU 31 1HB LEU 31 -6.585 -1.259 1.544 95 HB3 LEU 31 2HB LEU 31 -7.446 0.154 2.169 96 HG LEU 31 HG LEU 31 -7.780 -1.098 -0.572 97 HD11 LEU 31 1HD1 LEU 31 -10.011 -1.709 0.211 98 HD12 LEU 31 2HD1 LEU 31 -9.643 -1.044 1.824 99 HD13 LEU 31 3HD1 LEU 31 -8.745 -2.459 1.178 100 HD21 LEU 31 3HD2 LEU 31 -9.009 1.368 0.617 101 HD22 LEU 31 1HD2 LEU 31 -9.787 0.482 -0.696 102 HD23 LEU 31 2HD2 LEU 31 -8.174 1.174 -0.932 103 H ALA 32 H ALA 32 -3.844 -0.636 1.284 104 HA ALA 32 HA ALA 32 -3.196 0.630 3.838 105 HB1 ALA 32 1HB ALA 32 -1.654 -1.197 1.952 106 HB2 ALA 32 2HB ALA 32 -0.933 -0.515 3.420 107 HB3 ALA 32 3HB ALA 32 -2.352 -1.578 3.534 108 H GLY 33 H GLY 33 -2.146 1.096 0.441 109 HA2 GLY 33 1HA GLY 33 -0.432 3.361 1.089 110 HA3 GLY 33 2HA GLY 33 -0.845 2.748 -0.501 111 H LEU 34 H LEU 34 -3.778 3.146 1.236 112 HA LEU 34 HA LEU 34 -4.056 6.034 0.608 113 HB2 LEU 34 1HB LEU 34 -6.194 4.006 1.276 114 HB3 LEU 34 2HB LEU 34 -6.434 5.733 1.032 115 HG LEU 34 HG LEU 34 -5.436 3.813 -1.107 116 HD11 LEU 34 1HD1 LEU 34 -7.665 4.190 -2.109 117 HD12 LEU 34 2HD1 LEU 34 -8.137 5.138 -0.676 118 HD13 LEU 34 3HD1 LEU 34 -7.761 3.421 -0.511 119 HD21 LEU 34 3HD2 LEU 34 -5.849 5.715 -2.661 120 HD22 LEU 34 1HD2 LEU 34 -4.527 6.018 -1.540 121 HD23 LEU 34 2HD2 LEU 34 -6.113 6.778 -1.257 122 H ALA 35 H ALA 35 -3.241 3.965 3.175 123 HA ALA 35 HA ALA 35 -4.208 5.870 5.248 124 HB1 ALA 35 1HB ALA 35 -3.670 4.132 6.833 125 HB2 ALA 35 2HB ALA 35 -4.573 3.372 5.507 126 HB3 ALA 35 3HB ALA 35 -2.816 3.183 5.593 127 H ILE 36 H ILE 36 -1.497 5.487 3.305 128 HA ILE 36 HA ILE 36 0.464 6.709 5.115 129 HB ILE 36 HB ILE 36 0.854 4.059 3.694 130 HG12 ILE 36 1HG1 ILE 36 -0.157 3.691 5.859 131 HG13 ILE 36 2HG1 ILE 36 1.526 3.220 5.920 132 HG21 ILE 36 1HG2 ILE 36 3.166 4.048 4.388 133 HG22 ILE 36 2HG2 ILE 36 2.896 5.471 3.407 134 HG23 ILE 36 3HG2 ILE 36 3.022 5.647 5.152 135 HD11 ILE 36 3HD1 ILE 36 2.053 5.423 7.069 136 HD12 ILE 36 1HD1 ILE 36 0.329 5.688 7.214 137 HD13 ILE 36 2HD1 ILE 36 1.056 4.271 7.962 138 H SER 37 H SER 37 0.138 8.568 3.779 139 HA SER 37 HA SER 37 0.717 9.989 2.107 140 HB2 SER 37 1HB SER 37 2.829 8.008 2.119 141 HB3 SER 37 2HB SER 37 2.596 8.572 0.481 142 HG SER 37 HG SER 37 2.922 10.203 2.806 143 HA PRO 38 HA PRO 38 -2.222 7.818 -0.723 144 HB2 PRO 38 1HB PRO 38 -4.356 9.505 -0.582 145 HB3 PRO 38 2HB PRO 38 -3.989 8.333 0.721 146 HG2 PRO 38 1HG PRO 38 -3.255 11.270 0.594 147 HG3 PRO 38 2HG PRO 38 -4.011 10.373 1.955 148 HD2 PRO 38 1HD PRO 38 -1.333 10.897 1.841 149 HD3 PRO 38 2HD PRO 38 -1.970 9.387 2.562 150 H GLU 39 H GLU 39 -1.214 11.274 -0.652 151 HA GLU 39 HA GLU 39 -2.247 12.058 -3.121 152 HB2 GLU 39 1HB GLU 39 -1.609 13.408 -1.086 153 HB3 GLU 39 2HB GLU 39 0.087 13.048 -1.427 154 HG2 GLU 39 1HG GLU 39 -0.124 14.131 -3.616 155 HG3 GLU 39 2HG GLU 39 -1.835 14.463 -3.249 156 H TRP 40 H TRP 40 0.941 10.799 -2.052 157 HA TRP 40 HA TRP 40 2.296 10.674 -4.547 158 HB2 TRP 40 1HB TRP 40 3.432 10.328 -2.452 159 HB3 TRP 40 2HB TRP 40 2.410 8.964 -2.052 160 HD1 TRP 40 HD TRP 40 5.127 9.882 -4.658 161 HE1 TRP 40 1HE TRP 40 6.572 7.771 -5.088 162 HE3 TRP 40 3HE TRP 40 2.261 6.443 -2.190 163 HZ2 TRP 40 2HZ TRP 40 6.308 4.920 -4.647 164 HZ3 TRP 40 3HZ TRP 40 2.824 4.034 -2.298 165 HH2 TRP 40 HH TRP 40 4.906 3.279 -3.455 166 H LEU 41 H LEU 41 0.420 8.004 -2.971 167 HA LEU 41 HA LEU 41 0.638 6.281 -5.131 168 HB2 LEU 41 1HB LEU 41 -0.090 5.622 -2.930 169 HB3 LEU 41 2HB LEU 41 -1.613 6.475 -3.094 170 HG LEU 41 HG LEU 41 -0.886 4.396 -5.184 171 HD11 LEU 41 1HD1 LEU 41 -2.018 3.647 -2.459 172 HD12 LEU 41 2HD1 LEU 41 -0.360 3.302 -3.019 173 HD13 LEU 41 3HD1 LEU 41 -1.736 2.561 -3.841 174 HD21 LEU 41 3HD2 LEU 41 -3.510 5.139 -3.832 175 HD22 LEU 41 1HD2 LEU 41 -3.308 3.894 -5.085 176 HD23 LEU 41 2HD2 LEU 41 -3.015 5.580 -5.482 177 H LYS 42 H LYS 42 -2.061 8.562 -4.572 178 HA LYS 42 HA LYS 42 -3.478 7.949 -6.978 179 HB2 LYS 42 1HB LYS 42 -3.312 10.447 -5.237 180 HB3 LYS 42 2HB LYS 42 -4.417 10.305 -6.611 181 HG2 LYS 42 1HG LYS 42 -5.690 8.603 -5.627 182 HG3 LYS 42 2HG LYS 42 -4.470 8.232 -4.400 183 HD2 LYS 42 1HD LYS 42 -4.878 10.236 -3.192 184 HD3 LYS 42 2HD LYS 42 -5.842 10.958 -4.489 185 HE2 LYS 42 1HE LYS 42 -6.691 8.325 -3.256 186 HE3 LYS 42 2HE LYS 42 -7.012 9.824 -2.372 187 HZ1 LYS 42 3HZ LYS 42 -8.736 8.899 -4.046 188 HZ2 LYS 42 1HZ LYS 42 -7.828 9.654 -5.182 189 HZ3 LYS 42 2HZ LYS 42 -8.522 10.509 -3.949 190 H GLN 43 H GLN 43 -0.795 10.379 -6.441 191 HA GLN 43 HA GLN 43 -0.993 11.442 -9.118 192 HB2 GLN 43 1HB GLN 43 1.273 11.401 -7.066 193 HB3 GLN 43 2HB GLN 43 1.463 12.004 -8.703 194 HG2 GLN 43 1HG GLN 43 -0.695 13.443 -8.094 195 HG3 GLN 43 2HG GLN 43 -0.060 13.251 -6.460 196 HE21 GLN 43 1HE2 GLN 43 2.676 13.543 -6.546 197 HE22 GLN 43 2HE2 GLN 43 3.103 14.941 -7.523 198 H ASN 44 H ASN 44 0.958 8.797 -7.649 199 HA ASN 44 HA ASN 44 2.485 8.206 -9.937 200 HB2 ASN 44 1HB ASN 44 1.379 6.059 -8.136 201 HB3 ASN 44 2HB ASN 44 2.879 6.008 -9.061 202 HD21 ASN 44 1HD2 ASN 44 4.151 8.583 -7.957 203 HD22 ASN 44 2HD2 ASN 44 4.296 8.149 -6.265 204 H ILE 45 H ILE 45 -0.797 7.004 -8.971 205 HA ILE 45 HA ILE 45 -1.132 5.297 -11.261 206 HB ILE 45 HB ILE 45 -3.174 6.609 -9.424 207 HG12 ILE 45 1HG1 ILE 45 -1.667 4.961 -8.328 208 HG13 ILE 45 2HG1 ILE 45 -3.348 4.515 -8.302 209 HG21 ILE 45 1HG2 ILE 45 -3.511 4.615 -11.690 210 HG22 ILE 45 2HG2 ILE 45 -4.702 4.750 -10.392 211 HG23 ILE 45 3HG2 ILE 45 -4.368 6.126 -11.415 212 HD11 ILE 45 3HD1 ILE 45 -2.950 2.904 -10.185 213 HD12 ILE 45 1HD1 ILE 45 -1.222 3.320 -10.128 214 HD13 ILE 45 2HD1 ILE 45 -2.013 2.544 -8.744 215 H ALA 46 H ALA 46 -2.123 8.753 -10.664 216 HA ALA 46 HA ALA 46 -3.318 9.147 -13.204 217 HB1 ALA 46 1HB ALA 46 -2.999 11.527 -12.754 218 HB2 ALA 46 2HB ALA 46 -3.527 10.701 -11.272 219 HB3 ALA 46 3HB ALA 46 -1.823 11.163 -11.478 220 H ALA 47 H ALA 47 0.055 8.830 -12.378 221 HA ALA 47 HA ALA 47 0.911 9.716 -15.083 222 HB1 ALA 47 1HB ALA 47 2.507 9.053 -12.585 223 HB2 ALA 47 2HB ALA 47 3.140 9.720 -14.108 224 HB3 ALA 47 3HB ALA 47 2.042 10.686 -13.125 225 H ASN 48 H ASN 48 -0.312 6.940 -13.863 226 HA ASN 48 HA ASN 48 0.011 4.738 -13.883 227 HB2 ASN 48 1HB ASN 48 -0.609 5.512 -16.286 228 HB3 ASN 48 2HB ASN 48 0.997 4.983 -16.726 229 HD21 ASN 48 1HD2 ASN 48 1.475 2.597 -15.784 230 HD22 ASN 48 2HD2 ASN 48 0.105 1.467 -15.929 231 H GLN 49 H GLN 49 2.197 6.069 -12.729 232 HA GLN 49 HA GLN 49 4.758 4.980 -13.735 233 HB2 GLN 49 1HB GLN 49 3.933 6.872 -11.480 234 HB3 GLN 49 2HB GLN 49 5.579 6.314 -11.653 235 HG2 GLN 49 1HG GLN 49 4.244 7.714 -13.943 236 HG3 GLN 49 2HG GLN 49 4.983 8.599 -12.610 237 HE21 GLN 49 1HE2 GLN 49 5.691 6.019 -15.008 238 HE22 GLN 49 2HE2 GLN 49 7.369 6.464 -15.240 239 H LEU 50 H LEU 50 2.404 4.088 -11.568 240 HA LEU 50 HA LEU 50 4.003 3.350 -9.283 241 HB2 LEU 50 1HB LEU 50 1.397 4.067 -9.628 242 HB3 LEU 50 2HB LEU 50 1.189 2.349 -9.678 243 HG LEU 50 HG LEU 50 2.025 4.152 -7.425 244 HD11 LEU 50 1HD1 LEU 50 -0.273 3.591 -7.480 245 HD12 LEU 50 2HD1 LEU 50 0.402 2.622 -6.180 246 HD13 LEU 50 3HD1 LEU 50 0.060 1.862 -7.734 247 HD21 LEU 50 3HD2 LEU 50 2.672 1.254 -7.353 248 HD22 LEU 50 1HD2 LEU 50 2.663 2.363 -5.966 249 HD23 LEU 50 2HD2 LEU 50 3.834 2.613 -7.242 250 H VAL 51 H VAL 51 4.942 1.279 -8.816 251 HA VAL 51 HA VAL 51 4.078 -1.015 -10.515 252 HB VAL 51 HB VAL 51 6.776 -0.319 -9.319 253 HG11 VAL 51 1HG1 VAL 51 6.512 -2.724 -8.915 254 HG12 VAL 51 2HG1 VAL 51 5.959 -2.977 -10.590 255 HG13 VAL 51 3HG1 VAL 51 7.626 -2.464 -10.247 256 HG21 VAL 51 3HG2 VAL 51 6.166 0.602 -11.609 257 HG22 VAL 51 1HG2 VAL 51 7.557 -0.491 -11.620 258 HG23 VAL 51 2HG2 VAL 51 5.994 -1.082 -12.178 259 H TYR 52 H TYR 52 3.955 -3.044 -9.374 260 HA TYR 52 HA TYR 52 3.507 -2.972 -6.446 261 HB2 TYR 52 1HB TYR 52 1.293 -3.068 -7.331 262 HB3 TYR 52 2HB TYR 52 1.790 -3.965 -8.736 263 HD1 TYR 52 2HD TYR 52 2.082 -4.633 -5.014 264 HD2 TYR 52 1HD TYR 52 0.765 -6.011 -8.902 265 HE1 TYR 52 2HE TYR 52 1.425 -6.814 -4.045 266 HE2 TYR 52 1HE TYR 52 0.146 -8.172 -7.937 267 HH TYR 52 HH TYR 52 -0.202 -9.354 -5.969 268 H GLY 53 H GLY 53 4.585 -4.752 -5.445 269 HA2 GLY 53 1HA GLY 53 5.242 -7.054 -7.052 270 HA3 GLY 53 2HA GLY 53 6.657 -6.052 -6.662 271 H ILE 54 H ILE 54 7.005 -8.308 -5.820 272 HA ILE 54 HA ILE 54 6.172 -8.712 -3.012 273 HB ILE 54 HB ILE 54 6.635 -10.564 -5.410 274 HG12 ILE 54 1HG1 ILE 54 4.323 -9.488 -5.049 275 HG13 ILE 54 2HG1 ILE 54 4.392 -11.210 -5.304 276 HG21 ILE 54 1HG2 ILE 54 7.754 -11.681 -3.626 277 HG22 ILE 54 2HG2 ILE 54 6.431 -11.381 -2.511 278 HG23 ILE 54 3HG2 ILE 54 6.204 -12.502 -3.847 279 HD11 ILE 54 3HD1 ILE 54 3.999 -11.695 -2.997 280 HD12 ILE 54 1HD1 ILE 54 4.252 -10.012 -2.521 281 HD13 ILE 54 2HD1 ILE 54 2.833 -10.451 -3.482 282 H VAL 55 H VAL 55 7.903 -9.030 -1.660 283 HA VAL 55 HA VAL 55 10.339 -7.859 -2.213 284 HB VAL 55 HB VAL 55 9.363 -9.798 -0.090 285 HG11 VAL 55 1HG1 VAL 55 12.212 -8.894 -0.571 286 HG12 VAL 55 2HG1 VAL 55 11.602 -9.014 1.090 287 HG13 VAL 55 3HG1 VAL 55 11.621 -10.443 0.044 288 HG21 VAL 55 3HG2 VAL 55 9.406 -7.849 1.253 289 HG22 VAL 55 1HG2 VAL 55 10.492 -6.996 0.130 290 HG23 VAL 55 2HG2 VAL 55 8.816 -7.271 -0.326 291 H LYS 56 H LYS 56 9.803 -11.341 -2.224 292 HA LYS 56 HA LYS 56 10.748 -13.099 -3.139 293 HB2 LYS 56 1HB LYS 56 12.053 -11.065 -4.925 294 HB3 LYS 56 2HB LYS 56 12.343 -12.761 -5.153 295 HG2 LYS 56 1HG LYS 56 9.465 -11.947 -4.979 296 HG3 LYS 56 2HG LYS 56 10.334 -11.295 -6.333 297 HD2 LYS 56 1HD LYS 56 10.969 -13.583 -7.059 298 HD3 LYS 56 2HD LYS 56 10.176 -14.256 -5.615 299 HE2 LYS 56 1HE LYS 56 8.040 -13.096 -6.381 300 HE3 LYS 56 2HE LYS 56 8.851 -12.723 -7.903 301 HZ1 LYS 56 3HZ LYS 56 8.506 -15.460 -6.857 302 HZ2 LYS 56 1HZ LYS 56 9.018 -15.020 -8.380 303 HZ3 LYS 56 2HZ LYS 56 7.462 -14.769 -7.909 304 HA PRO 57 HA PRO 57 14.204 -13.771 -0.617 305 HB2 PRO 57 1HB PRO 57 15.501 -15.928 -1.734 306 HB3 PRO 57 2HB PRO 57 13.903 -16.010 -0.948 307 HG2 PRO 57 1HG PRO 57 14.482 -15.693 -3.902 308 HG3 PRO 57 2HG PRO 57 13.403 -16.882 -3.121 309 HD2 PRO 57 1HD PRO 57 12.402 -14.636 -4.152 310 HD3 PRO 57 2HD PRO 57 11.808 -15.196 -2.583 311 H SER 58 H SER 58 14.751 -12.255 -3.537 312 HA SER 58 HA SER 58 17.717 -12.448 -3.383 313 HB2 SER 58 1HB SER 58 16.122 -11.977 -5.900 314 HB3 SER 58 2HB SER 58 17.780 -12.563 -5.722 315 HG SER 58 HG SER 58 16.839 -14.482 -4.728 316 H ASP 59 H ASP 59 15.353 -10.100 -2.744 317 HA ASP 59 HA ASP 59 16.634 -8.057 -4.405 318 HB2 ASP 59 1HB ASP 59 14.179 -8.274 -4.243 319 HB3 ASP 59 2HB ASP 59 14.265 -7.754 -2.555 320 H THR 60 H THR 60 16.884 -5.812 -3.364 321 HA THR 60 HA THR 60 18.877 -5.847 -1.316 322 HB THR 60 HB THR 60 18.936 -4.585 -3.440 323 HG1 THR 60 1HG THR 60 20.097 -3.094 -2.701 324 HG21 THR 60 3HG2 THR 60 17.706 -2.544 -3.772 325 HG22 THR 60 1HG2 THR 60 16.933 -2.698 -2.169 326 HG23 THR 60 2HG2 THR 60 16.549 -3.858 -3.451 327 H VAL 61 H VAL 61 16.564 -6.790 -0.199 328 HA VAL 61 HA VAL 61 15.090 -4.553 0.954 329 HB VAL 61 HB VAL 61 13.645 -6.483 1.846 330 HG11 VAL 61 1HG1 VAL 61 12.966 -5.050 0.039 331 HG12 VAL 61 2HG1 VAL 61 14.030 -5.885 -1.102 332 HG13 VAL 61 3HG1 VAL 61 12.617 -6.714 -0.457 333 HG21 VAL 61 3HG2 VAL 61 15.512 -8.255 1.376 334 HG22 VAL 61 1HG2 VAL 61 13.889 -8.669 0.833 335 HG23 VAL 61 2HG2 VAL 61 15.078 -8.092 -0.334 336 HA PRO 62 HA PRO 62 16.689 -4.722 5.070 337 HB2 PRO 62 1HB PRO 62 14.569 -3.760 6.520 338 HB3 PRO 62 2HB PRO 62 15.562 -2.739 5.438 339 HG2 PRO 62 1HG PRO 62 12.866 -3.965 4.887 340 HG3 PRO 62 2HG PRO 62 13.452 -2.328 4.481 341 HD2 PRO 62 1HD PRO 62 13.369 -4.466 2.736 342 HD3 PRO 62 2HD PRO 62 14.535 -3.144 2.568 343 H ALA 63 H ALA 63 16.435 -5.878 7.107 344 HA ALA 63 HA ALA 63 15.498 -8.574 6.765 345 HB1 ALA 63 1HB ALA 63 17.412 -7.880 8.248 346 HB2 ALA 63 2HB ALA 63 16.249 -7.079 9.325 347 HB3 ALA 63 3HB ALA 63 16.178 -8.833 9.102 348 H GLY 64 H GLY 64 13.572 -9.595 7.642 349 HA2 GLY 64 1HA GLY 64 11.643 -9.694 8.988 350 HA3 GLY 64 2HA GLY 64 11.830 -8.006 9.429 351 H VAL 65 H VAL 65 11.920 -8.974 6.057 352 HA VAL 65 HA VAL 65 9.114 -8.789 5.623 353 HB VAL 65 HB VAL 65 9.313 -7.249 3.655 354 HG11 VAL 65 1HG1 VAL 65 9.718 -5.850 6.324 355 HG12 VAL 65 2HG1 VAL 65 8.836 -5.247 4.906 356 HG13 VAL 65 3HG1 VAL 65 8.217 -6.636 5.822 357 HG21 VAL 65 3HG2 VAL 65 10.950 -5.389 3.728 358 HG22 VAL 65 1HG2 VAL 65 11.867 -6.281 4.958 359 HG23 VAL 65 2HG2 VAL 65 11.683 -6.930 3.326 360 H ASP 66 H ASP 66 9.585 -10.967 5.346 361 HA ASP 66 HA ASP 66 11.272 -11.744 3.043 362 HB2 ASP 66 1HB ASP 66 9.802 -13.207 5.230 363 HB3 ASP 66 2HB ASP 66 10.098 -14.078 3.727 364 H ASP 67 H ASP 67 8.156 -10.915 3.523 365 HA ASP 67 HA ASP 67 7.303 -11.265 0.810 366 HB2 ASP 67 1HB ASP 67 7.109 -13.651 1.521 367 HB3 ASP 67 2HB ASP 67 5.941 -13.166 2.760 368 H TYR 68 H TYR 68 7.359 -9.055 2.194 369 HA TYR 68 HA TYR 68 4.519 -8.300 2.755 370 HB2 TYR 68 1HB TYR 68 7.179 -7.011 3.406 371 HB3 TYR 68 2HB TYR 68 5.735 -6.056 3.168 372 HD1 TYR 68 1HD TYR 68 6.190 -9.296 5.136 373 HD2 TYR 68 2HD TYR 68 4.987 -5.147 5.100 374 HE1 TYR 68 1HE TYR 68 5.554 -9.468 7.498 375 HE2 TYR 68 2HE TYR 68 4.248 -5.346 7.435 376 HH TYR 68 HH TYR 68 4.582 -8.394 9.299 377 H SER 69 H SER 69 3.634 -7.774 0.693 378 HA SER 69 HA SER 69 5.214 -7.226 -1.585 379 HB2 SER 69 1HB SER 69 2.363 -6.977 -0.710 380 HB3 SER 69 2HB SER 69 2.870 -5.875 -1.993 381 HG SER 69 HG SER 69 3.660 -7.624 -3.153 382 H TYR 70 H TYR 70 5.489 -5.170 -2.685 383 HA TYR 70 HA TYR 70 5.520 -2.816 -0.891 384 HB2 TYR 70 1HB TYR 70 7.717 -2.186 -1.555 385 HB3 TYR 70 2HB TYR 70 7.791 -3.813 -0.916 386 HD1 TYR 70 2HD TYR 70 8.012 -5.794 -2.482 387 HD2 TYR 70 1HD TYR 70 8.459 -1.705 -3.819 388 HE1 TYR 70 2HE TYR 70 9.185 -6.573 -4.529 389 HE2 TYR 70 1HE TYR 70 9.655 -2.513 -5.850 390 HH TYR 70 HH TYR 70 10.541 -5.901 -6.320 391 H LEU 71 H LEU 71 5.439 -0.798 -1.917 392 HA LEU 71 HA LEU 71 4.716 -0.729 -4.793 393 HB2 LEU 71 1HB LEU 71 3.884 1.223 -2.601 394 HB3 LEU 71 2HB LEU 71 3.412 1.218 -4.276 395 HG LEU 71 HG LEU 71 1.536 0.512 -3.270 396 HD11 LEU 71 1HD1 LEU 71 2.344 -1.223 -4.974 397 HD12 LEU 71 2HD1 LEU 71 1.006 -1.692 -3.888 398 HD13 LEU 71 3HD1 LEU 71 2.661 -2.265 -3.595 399 HD21 LEU 71 3HD2 LEU 71 2.289 0.459 -1.037 400 HD22 LEU 71 1HD2 LEU 71 3.016 -1.150 -1.272 401 HD23 LEU 71 2HD2 LEU 71 1.247 -0.927 -1.396 402 H VAL 72 H VAL 72 6.033 0.617 -5.941 403 HA VAL 72 HA VAL 72 7.420 2.850 -4.737 404 HB VAL 72 HB VAL 72 8.942 0.898 -4.450 405 HG11 VAL 72 1HG1 VAL 72 8.256 -0.407 -6.471 406 HG12 VAL 72 2HG1 VAL 72 9.113 0.772 -7.485 407 HG13 VAL 72 3HG1 VAL 72 10.001 -0.223 -6.299 408 HG21 VAL 72 3HG2 VAL 72 10.059 2.961 -4.561 409 HG22 VAL 72 1HG2 VAL 72 10.987 1.829 -5.521 410 HG23 VAL 72 2HG2 VAL 72 9.974 3.027 -6.340 411 H ALA 73 H ALA 73 8.144 4.300 -6.754 412 HA ALA 73 HA ALA 73 6.333 3.678 -9.029 413 HB1 ALA 73 1HB ALA 73 6.591 5.877 -9.759 414 HB2 ALA 73 2HB ALA 73 6.361 6.024 -8.001 415 HB3 ALA 73 3HB ALA 73 7.971 6.192 -8.740 416 H ALA 74 H ALA 74 7.376 3.873 -11.152 417 HA ALA 74 HA ALA 74 9.759 2.217 -11.240 418 HB1 ALA 74 1HB ALA 74 7.873 2.016 -12.811 419 HB2 ALA 74 2HB ALA 74 8.231 3.656 -13.456 420 HB3 ALA 74 3HB ALA 74 9.382 2.324 -13.663 421 H ASP 75 H ASP 75 9.603 5.494 -10.642 422 HA ASP 75 HA ASP 75 12.110 6.034 -12.168 423 HB2 ASP 75 1HB ASP 75 9.989 6.753 -13.383 424 HB3 ASP 75 2HB ASP 75 9.774 7.950 -12.103 425 H ASP 76 H ASP 76 10.903 5.871 -9.149 426 HA ASP 76 HA ASP 76 12.558 8.091 -8.095 427 HB2 ASP 76 1HB ASP 76 10.924 8.659 -6.546 428 HB3 ASP 76 2HB ASP 76 10.019 8.505 -8.045 429 H GLN 77 H GLN 77 13.302 5.424 -8.678 430 HA GLN 77 HA GLN 77 12.727 3.471 -6.869 431 HB2 GLN 77 1HB GLN 77 15.344 3.796 -8.411 432 HB3 GLN 77 2HB GLN 77 14.803 2.312 -7.610 433 HG2 GLN 77 1HG GLN 77 12.683 2.436 -9.080 434 HG3 GLN 77 2HG GLN 77 13.532 3.676 -10.017 435 HE21 GLN 77 1HE2 GLN 77 13.898 0.309 -8.766 436 HE22 GLN 77 2HE2 GLN 77 14.966 -0.255 -10.041 437 H ASP 78 H ASP 78 14.745 6.123 -5.912 438 HA ASP 78 HA ASP 78 15.434 4.569 -3.451 439 HB2 ASP 78 1HB ASP 78 17.335 5.951 -5.252 440 HB3 ASP 78 2HB ASP 78 17.492 6.397 -3.557 441 H GLY 79 H GLY 79 13.456 6.765 -4.588 442 HA2 GLY 79 1HA GLY 79 13.791 8.973 -2.728 443 HA3 GLY 79 2HA GLY 79 12.510 8.711 -3.929 444 H THR 80 H THR 80 10.952 6.830 -3.404 445 HA THR 80 HA THR 80 10.446 6.699 -0.464 446 HB THR 80 HB THR 80 8.309 6.857 -2.631 447 HG1 THR 80 1HG THR 80 9.212 8.812 -2.706 448 HG21 THR 80 3HG2 THR 80 6.920 7.649 -0.709 449 HG22 THR 80 1HG2 THR 80 8.277 7.264 0.392 450 HG23 THR 80 2HG2 THR 80 7.433 5.976 -0.509 451 H ILE 81 H ILE 81 8.983 4.717 0.091 452 HA ILE 81 HA ILE 81 8.304 2.830 -1.770 453 HB ILE 81 HB ILE 81 10.634 2.010 -1.752 454 HG12 ILE 81 1HG1 ILE 81 9.156 -0.047 -0.099 455 HG13 ILE 81 2HG1 ILE 81 8.546 0.402 -1.674 456 HG21 ILE 81 1HG2 ILE 81 11.331 2.788 0.515 457 HG22 ILE 81 2HG2 ILE 81 10.305 1.518 1.232 458 HG23 ILE 81 3HG2 ILE 81 11.710 1.078 0.245 459 HD11 ILE 81 3HD1 ILE 81 10.693 -0.227 -2.741 460 HD12 ILE 81 1HD1 ILE 81 11.375 -0.644 -1.151 461 HD13 ILE 81 2HD1 ILE 81 10.029 -1.581 -1.800 462 H ILE 82 H ILE 82 6.730 1.439 -0.818 463 HA ILE 82 HA ILE 82 6.430 1.587 2.122 464 HB ILE 82 HB ILE 82 4.211 1.994 0.078 465 HG12 ILE 82 1HG1 ILE 82 5.007 3.929 2.313 466 HG13 ILE 82 2HG1 ILE 82 5.649 4.036 0.676 467 HG21 ILE 82 1HG2 ILE 82 3.974 1.705 3.113 468 HG22 ILE 82 2HG2 ILE 82 2.651 2.158 2.026 469 HG23 ILE 82 3HG2 ILE 82 3.370 0.572 1.896 470 HD11 ILE 82 3HD1 ILE 82 3.833 5.562 0.859 471 HD12 ILE 82 1HD1 ILE 82 3.385 4.232 -0.221 472 HD13 ILE 82 2HD1 ILE 82 2.727 4.283 1.415 473 H PHE 83 H PHE 83 6.103 -0.414 3.013 474 HA PHE 83 HA PHE 83 5.564 -2.700 1.226 475 HB2 PHE 83 1HB PHE 83 6.914 -2.562 3.947 476 HB3 PHE 83 2HB PHE 83 6.544 -4.020 3.127 477 HD1 PHE 83 2HD PHE 83 8.620 -0.930 2.962 478 HD2 PHE 83 1HD PHE 83 8.032 -4.927 1.448 479 HE1 PHE 83 2HE PHE 83 10.909 -0.902 1.974 480 HE2 PHE 83 1HE PHE 83 10.298 -4.863 0.450 481 HZ PHE 83 HZ PHE 83 11.742 -2.880 0.740 482 H PHE 84 H PHE 84 3.912 -4.200 1.985 483 HA PHE 84 HA PHE 84 2.540 -3.601 4.500 484 HB2 PHE 84 1HB PHE 84 0.304 -3.721 3.508 485 HB3 PHE 84 2HB PHE 84 1.186 -2.347 2.857 486 HD1 PHE 84 1HD PHE 84 2.039 -2.432 0.443 487 HD2 PHE 84 2HD PHE 84 -0.378 -5.605 2.116 488 HE1 PHE 84 1HE PHE 84 1.701 -3.389 -1.811 489 HE2 PHE 84 2HE PHE 84 -0.734 -6.513 -0.162 490 HZ PHE 84 HZ PHE 84 0.299 -5.429 -2.114 491 H LYS 85 H LYS 85 1.430 -5.506 5.304 492 HA LYS 85 HA LYS 85 1.199 -7.793 3.484 493 HB2 LYS 85 1HB LYS 85 3.333 -8.091 4.844 494 HB3 LYS 85 2HB LYS 85 2.270 -8.332 6.228 495 HG2 LYS 85 1HG LYS 85 1.096 -9.950 4.273 496 HG3 LYS 85 2HG LYS 85 2.786 -10.037 3.797 497 HD2 LYS 85 1HD LYS 85 3.403 -10.907 5.989 498 HD3 LYS 85 2HD LYS 85 1.782 -10.467 6.588 499 HE2 LYS 85 1HE LYS 85 0.780 -12.092 4.947 500 HE3 LYS 85 2HE LYS 85 2.406 -12.616 4.510 501 HZ1 LYS 85 3HZ LYS 85 2.685 -13.314 6.847 502 HZ2 LYS 85 1HZ LYS 85 1.401 -14.081 6.137 503 HZ3 LYS 85 2HZ LYS 85 1.186 -12.847 7.206 504 H ALA 86 H ALA 86 -0.786 -8.707 3.779 505 HA ALA 86 HA ALA 86 -2.493 -7.920 6.048 506 HB1 ALA 86 1HB ALA 86 -2.848 -10.047 3.890 507 HB2 ALA 86 2HB ALA 86 -4.033 -9.635 5.148 508 HB3 ALA 86 3HB ALA 86 -3.604 -8.430 3.927 509 H GLU 87 H GLU 87 -2.224 -8.879 7.959 510 HA GLU 87 HA GLU 87 -1.008 -11.601 8.131 511 HB2 GLU 87 1HB GLU 87 -1.211 -9.348 10.171 512 HB3 GLU 87 2HB GLU 87 -0.831 -11.010 10.640 513 HG2 GLU 87 1HG GLU 87 0.859 -9.444 8.650 514 HG3 GLU 87 2HG GLU 87 1.142 -9.464 10.387 515 H GLY 88 H GLY 88 -3.682 -10.702 7.222 516 HA2 GLY 88 1HA GLY 88 -5.728 -11.708 7.183 517 HA3 GLY 88 2HA GLY 88 -5.205 -12.780 8.481 518 H GLN 89 H GLN 89 -7.380 -10.388 7.723 519 HA GLN 89 HA GLN 89 -8.729 -8.938 8.794 520 HB2 GLN 89 1HB GLN 89 -8.081 -10.443 11.336 521 HB3 GLN 89 2HB GLN 89 -9.415 -9.338 11.085 522 HG2 GLN 89 1HG GLN 89 -9.125 -11.910 9.489 523 HG3 GLN 89 2HG GLN 89 -10.029 -11.760 10.982 524 HE21 GLN 89 1HE2 GLN 89 -10.017 -10.920 7.583 525 HE22 GLN 89 2HE2 GLN 89 -11.597 -10.138 7.528 526 H THR 90 H THR 90 -5.490 -8.783 9.218 527 HA THR 90 HA THR 90 -5.585 -6.062 10.239 528 HB THR 90 HB THR 90 -3.278 -7.765 11.115 529 HG1 THR 90 1HG THR 90 -4.413 -9.106 12.101 530 HG21 THR 90 3HG2 THR 90 -4.902 -5.614 12.544 531 HG22 THR 90 1HG2 THR 90 -3.365 -5.364 11.676 532 HG23 THR 90 2HG2 THR 90 -3.410 -6.362 13.139 533 H VAL 91 H VAL 91 -3.884 -4.812 9.302 534 HA VAL 91 HA VAL 91 -2.125 -6.160 7.341 535 HB VAL 91 HB VAL 91 -3.511 -3.474 6.988 536 HG11 VAL 91 1HG1 VAL 91 -1.236 -3.451 6.015 537 HG12 VAL 91 2HG1 VAL 91 -1.577 -4.961 5.151 538 HG13 VAL 91 3HG1 VAL 91 -2.461 -3.486 4.736 539 HG21 VAL 91 3HG2 VAL 91 -4.626 -4.479 5.078 540 HG22 VAL 91 1HG2 VAL 91 -3.815 -6.033 5.361 541 HG23 VAL 91 2HG2 VAL 91 -5.025 -5.413 6.518 542 H ILE 92 H ILE 92 -0.046 -5.699 7.726 543 HA ILE 92 HA ILE 92 0.658 -3.621 9.734 544 HB ILE 92 HB ILE 92 2.371 -5.879 8.648 545 HG12 ILE 92 1HG1 ILE 92 0.569 -7.038 9.697 546 HG13 ILE 92 2HG1 ILE 92 1.976 -7.118 10.732 547 HG21 ILE 92 1HG2 ILE 92 2.610 -4.105 11.130 548 HG22 ILE 92 2HG2 ILE 92 3.720 -5.421 10.687 549 HG23 ILE 92 3HG2 ILE 92 3.587 -3.987 9.657 550 HD11 ILE 92 3HD1 ILE 92 -0.427 -5.287 11.171 551 HD12 ILE 92 1HD1 ILE 92 -0.071 -6.788 12.033 552 HD13 ILE 92 2HD1 ILE 92 1.003 -5.389 12.225 553 H ILE 93 H ILE 93 1.250 -1.743 8.764 554 HA ILE 93 HA ILE 93 2.189 -1.834 5.935 555 HB ILE 93 HB ILE 93 1.199 0.668 7.305 556 HG12 ILE 93 1HG1 ILE 93 -0.519 -1.195 5.628 557 HG13 ILE 93 2HG1 ILE 93 -0.707 -0.956 7.377 558 HG21 ILE 93 1HG2 ILE 93 1.623 -0.212 4.410 559 HG22 ILE 93 2HG2 ILE 93 0.972 1.354 4.872 560 HG23 ILE 93 3HG2 ILE 93 2.616 0.939 5.335 561 HD11 ILE 93 3HD1 ILE 93 -2.352 0.315 6.180 562 HD12 ILE 93 1HD1 ILE 93 -1.250 1.370 7.102 563 HD13 ILE 93 2HD1 ILE 93 -1.113 1.231 5.333 564 H LYS 94 H LYS 94 4.294 -1.537 5.701 565 HA LYS 94 HA LYS 94 5.983 -0.497 7.949 566 HB2 LYS 94 1HB LYS 94 6.238 -2.856 6.057 567 HB3 LYS 94 2HB LYS 94 7.638 -2.122 6.763 568 HG2 LYS 94 1HG LYS 94 6.618 -2.521 9.059 569 HG3 LYS 94 2HG LYS 94 5.368 -3.472 8.247 570 HD2 LYS 94 1HD LYS 94 7.137 -4.973 7.310 571 HD3 LYS 94 2HD LYS 94 8.371 -3.957 8.051 572 HE2 LYS 94 1HE LYS 94 7.232 -4.473 10.305 573 HE3 LYS 94 2HE LYS 94 6.346 -5.753 9.449 574 HZ1 LYS 94 3HZ LYS 94 9.301 -5.533 9.636 575 HZ2 LYS 94 1HZ LYS 94 8.484 -6.779 8.920 576 HZ3 LYS 94 2HZ LYS 94 8.361 -6.550 10.520 577 H TYR 95 H TYR 95 6.532 1.640 7.194 578 HA TYR 95 HA TYR 95 7.454 1.817 4.341 579 HB2 TYR 95 1HB TYR 95 6.467 4.030 4.200 580 HB3 TYR 95 2HB TYR 95 5.243 2.815 4.537 581 HD1 TYR 95 2HD TYR 95 7.250 5.585 6.033 582 HD2 TYR 95 1HD TYR 95 3.944 2.866 6.541 583 HE1 TYR 95 2HE TYR 95 6.625 6.768 8.081 584 HE2 TYR 95 1HE TYR 95 3.319 4.019 8.653 585 HH TYR 95 HH TYR 95 4.974 7.040 9.635 586 H THR 96 H THR 96 8.787 3.872 3.980 587 HA THR 96 HA THR 96 10.285 4.846 6.260 588 HB THR 96 HB THR 96 11.482 2.792 5.861 589 HG1 THR 96 1HG THR 96 13.500 3.749 5.122 590 HG21 THR 96 3HG2 THR 96 12.503 2.208 3.716 591 HG22 THR 96 1HG2 THR 96 11.810 3.652 2.943 592 HG23 THR 96 2HG2 THR 96 10.765 2.330 3.492 593 H SER 97 H SER 97 11.857 6.483 5.435 594 HA SER 97 HA SER 97 10.843 7.977 3.126 595 HB2 SER 97 1HB SER 97 12.441 9.692 3.936 596 HB3 SER 97 2HB SER 97 11.157 9.311 5.091 597 HG SER 97 HG SER 97 13.516 9.384 5.810 598 H GLN 98 H GLN 98 13.117 5.628 3.772 599 HA GLN 98 HA GLN 98 14.592 6.189 1.263 600 HB2 GLN 98 1HB GLN 98 16.016 6.004 3.953 601 HB3 GLN 98 2HB GLN 98 16.796 5.953 2.376 602 HG2 GLN 98 1HG GLN 98 15.992 8.244 1.900 603 HG3 GLN 98 2HG GLN 98 15.248 8.318 3.508 604 HE21 GLN 98 1HE2 GLN 98 18.413 7.917 1.832 605 HE22 GLN 98 2HE2 GLN 98 19.379 8.365 3.208 606 H ARG 99 H ARG 99 15.207 4.370 0.286 607 HA ARG 99 HA ARG 99 14.174 1.881 1.000 608 HB2 ARG 99 1HB ARG 99 14.872 2.882 -1.242 609 HB3 ARG 99 2HB ARG 99 16.497 2.283 -0.910 610 HG2 ARG 99 1HG ARG 99 15.772 -0.005 -0.998 611 HG3 ARG 99 2HG ARG 99 14.064 0.455 -0.763 612 HD2 ARG 99 1HD ARG 99 14.087 1.657 -2.914 613 HD3 ARG 99 2HD ARG 99 15.741 1.082 -3.224 614 HE ARG 99 HE ARG 99 14.348 -1.259 -2.818 615 HH11 ARG 99 1HH1 ARG 99 13.912 1.469 -5.082 616 HH12 ARG 99 2HH1 ARG 99 13.059 0.494 -6.237 617 HH21 ARG 99 1HH2 ARG 99 13.291 -2.485 -4.364 618 HH22 ARG 99 2HH2 ARG 99 12.823 -1.803 -5.877 619 H ASN 100 H ASN 100 17.094 3.373 2.053 620 HA ASN 100 HA ASN 100 18.308 0.870 2.884 621 HB2 ASN 100 1HB ASN 100 20.350 2.189 3.478 622 HB3 ASN 100 2HB ASN 100 19.918 2.207 1.785 623 HD21 ASN 100 1HD2 ASN 100 18.809 3.936 1.002 624 HD22 ASN 100 2HD2 ASN 100 19.127 5.594 1.527 625 H THR 101 H THR 101 16.086 2.588 4.320 626 HA THR 101 HA THR 101 17.369 2.318 7.023 627 HB THR 101 HB THR 101 16.323 4.313 7.835 628 HG1 THR 101 1HG THR 101 15.524 5.776 6.221 629 HG21 THR 101 3HG2 THR 101 18.573 4.381 6.721 630 HG22 THR 101 1HG2 THR 101 17.702 5.935 6.680 631 HG23 THR 101 2HG2 THR 101 17.788 4.917 5.230 632 H LYS 102 H LYS 102 16.063 2.051 8.870 633 HA LYS 102 HA LYS 102 14.556 -0.263 8.499 634 HB2 LYS 102 1HB LYS 102 15.967 0.648 10.526 635 HB3 LYS 102 2HB LYS 102 14.450 1.334 11.098 636 HG2 LYS 102 1HG LYS 102 14.663 -1.594 10.295 637 HG3 LYS 102 2HG LYS 102 15.294 -1.071 11.844 638 HD2 LYS 102 1HD LYS 102 13.247 -0.666 12.787 639 HD3 LYS 102 2HD LYS 102 12.489 -0.296 11.241 640 HE2 LYS 102 1HE LYS 102 12.499 -2.622 10.566 641 HE3 LYS 102 2HE LYS 102 13.438 -3.090 11.989 642 HZ1 LYS 102 3HZ LYS 102 10.631 -2.146 11.948 643 HZ2 LYS 102 1HZ LYS 102 11.475 -2.508 13.323 644 HZ3 LYS 102 2HZ LYS 102 11.188 -3.675 12.220 645 H LEU 103 H LEU 103 12.424 -0.741 8.463 646 HA LEU 103 HA LEU 103 10.629 1.339 7.639 647 HB2 LEU 103 1HB LEU 103 10.192 -1.597 8.303 648 HB3 LEU 103 2HB LEU 103 8.982 -0.577 7.514 649 HG LEU 103 HG LEU 103 11.747 -1.167 6.343 650 HD11 LEU 103 1HD1 LEU 103 9.170 -2.366 5.298 651 HD12 LEU 103 2HD1 LEU 103 10.191 -3.195 6.499 652 HD13 LEU 103 3HD1 LEU 103 10.832 -2.769 4.901 653 HD21 LEU 103 3HD2 LEU 103 10.736 0.914 5.523 654 HD22 LEU 103 1HD2 LEU 103 9.272 0.039 5.042 655 HD23 LEU 103 2HD2 LEU 103 10.834 -0.299 4.258 656 H LYS 104 H LYS 104 8.793 2.186 8.691 657 HA LYS 104 HA LYS 104 8.681 2.156 11.594 658 HB2 LYS 104 1HB LYS 104 7.198 3.470 9.287 659 HB3 LYS 104 2HB LYS 104 6.511 3.463 10.883 660 HG2 LYS 104 1HG LYS 104 7.580 5.488 10.829 661 HG3 LYS 104 2HG LYS 104 8.700 4.479 11.748 662 HD2 LYS 104 1HD LYS 104 10.066 4.164 9.682 663 HD3 LYS 104 2HD LYS 104 8.905 5.162 8.778 664 HE2 LYS 104 1HE LYS 104 9.366 6.995 10.540 665 HE3 LYS 104 2HE LYS 104 10.746 6.006 11.058 666 HZ1 LYS 104 3HZ LYS 104 11.613 6.216 8.760 667 HZ2 LYS 104 1HZ LYS 104 11.405 7.673 9.436 668 HZ3 LYS 104 2HZ LYS 104 10.312 7.116 8.345 669 H ALA 105 H ALA 105 5.979 1.955 12.186 670 HA ALA 105 HA ALA 105 4.899 -0.423 10.875 671 HB1 ALA 105 1HB ALA 105 6.176 -1.487 12.672 672 HB2 ALA 105 2HB ALA 105 5.429 -0.422 13.881 673 HB3 ALA 105 3HB ALA 105 4.438 -1.608 13.002 674 H LYS 106 H LYS 106 3.086 0.569 10.191 675 HA LYS 106 HA LYS 106 1.163 1.473 12.297 676 HB2 LYS 106 1HB LYS 106 1.123 1.727 9.282 677 HB3 LYS 106 2HB LYS 106 -0.365 1.308 10.120 678 HG2 LYS 106 1HG LYS 106 0.311 3.397 11.664 679 HG3 LYS 106 2HG LYS 106 1.181 3.877 10.209 680 HD2 LYS 106 1HD LYS 106 -1.010 3.508 8.923 681 HD3 LYS 106 2HD LYS 106 -1.774 3.192 10.497 682 HE2 LYS 106 1HE LYS 106 -1.217 5.471 11.256 683 HE3 LYS 106 2HE LYS 106 -0.374 5.794 9.736 684 HZ1 LYS 106 3HZ LYS 106 -3.297 5.498 10.121 685 HZ2 LYS 106 1HZ LYS 106 -2.572 5.516 8.608 686 HZ3 LYS 106 2HZ LYS 106 -2.444 6.777 9.609 687 H ALA 107 H ALA 107 -0.458 -0.002 12.759 688 HA ALA 107 HA ALA 107 -0.658 -2.497 11.223 689 HB1 ALA 107 1HB ALA 107 -0.469 -2.317 14.273 690 HB2 ALA 107 2HB ALA 107 -0.910 -3.773 13.357 691 HB3 ALA 107 3HB ALA 107 0.726 -3.087 13.202 692 H LEU 108 H LEU 108 -2.808 -2.764 10.735 693 HA LEU 108 HA LEU 108 -4.847 -1.152 12.196 694 HB2 LEU 108 1HB LEU 108 -4.263 -1.226 9.209 695 HB3 LEU 108 2HB LEU 108 -5.655 -0.426 9.934 696 HG LEU 108 HG LEU 108 -2.753 0.377 10.488 697 HD11 LEU 108 1HD1 LEU 108 -3.173 2.218 8.907 698 HD12 LEU 108 2HD1 LEU 108 -4.763 1.539 8.533 699 HD13 LEU 108 3HD1 LEU 108 -3.280 0.624 8.144 700 HD21 LEU 108 3HD2 LEU 108 -5.395 1.778 11.022 701 HD22 LEU 108 1HD2 LEU 108 -3.796 2.470 11.334 702 HD23 LEU 108 2HD2 LEU 108 -4.345 1.070 12.260 703 H THR 109 H THR 109 -6.913 -2.218 12.201 704 HA THR 109 HA THR 109 -6.918 -4.955 11.216 705 HB THR 109 HB THR 109 -9.394 -4.806 11.782 706 HG1 THR 109 1HG THR 109 -9.000 -2.762 13.505 707 HG21 THR 109 3HG2 THR 109 -7.671 -5.864 13.203 708 HG22 THR 109 1HG2 THR 109 -8.906 -5.056 14.186 709 HG23 THR 109 2HG2 THR 109 -7.306 -4.311 13.949 710 H LEU 110 H LEU 110 -8.263 -5.809 9.473 711 HA LEU 110 HA LEU 110 -8.531 -4.147 7.146 712 HB2 LEU 110 1HB LEU 110 -9.745 -6.800 8.022 713 HB3 LEU 110 2HB LEU 110 -10.243 -6.010 6.547 714 HG LEU 110 HG LEU 110 -7.410 -6.942 7.147 715 HD11 LEU 110 1HD1 LEU 110 -9.090 -8.760 6.662 716 HD12 LEU 110 2HD1 LEU 110 -7.836 -8.626 5.423 717 HD13 LEU 110 3HD1 LEU 110 -9.461 -7.973 5.125 718 HD21 LEU 110 3HD2 LEU 110 -8.599 -5.618 4.655 719 HD22 LEU 110 1HD2 LEU 110 -7.021 -6.437 4.700 720 HD23 LEU 110 2HD2 LEU 110 -7.294 -4.992 5.663 721 H SER 111 H SER 111 -10.562 -4.615 10.000 722 HA SER 111 HA SER 111 -12.915 -3.541 8.769 723 HB2 SER 111 1HB SER 111 -12.389 -4.906 11.096 724 HB3 SER 111 2HB SER 111 -12.641 -3.257 11.707 725 HG SER 111 HG SER 111 -14.630 -4.251 11.587 726 H GLN 112 H GLN 112 -10.023 -1.915 10.283 727 HA GLN 112 HA GLN 112 -11.290 0.598 10.707 728 HB2 GLN 112 1HB GLN 112 -9.480 -0.193 12.061 729 HB3 GLN 112 2HB GLN 112 -8.530 -0.723 10.688 730 HG2 GLN 112 1HG GLN 112 -7.598 1.324 11.559 731 HG3 GLN 112 2HG GLN 112 -8.268 1.479 9.922 732 HE21 GLN 112 1HE2 GLN 112 -9.288 1.852 13.388 733 HE22 GLN 112 2HE2 GLN 112 -10.456 3.122 13.061 734 H LEU 113 H LEU 113 -8.922 -0.828 8.425 735 HA LEU 113 HA LEU 113 -8.786 1.285 6.592 736 HB2 LEU 113 1HB LEU 113 -8.341 -1.709 6.344 737 HB3 LEU 113 2HB LEU 113 -8.028 -0.627 4.993 738 HG LEU 113 HG LEU 113 -6.754 0.026 7.662 739 HD11 LEU 113 1HD1 LEU 113 -6.178 -2.284 7.498 740 HD12 LEU 113 2HD1 LEU 113 -4.771 -1.370 6.942 741 HD13 LEU 113 3HD1 LEU 113 -5.837 -2.163 5.766 742 HD21 LEU 113 3HD2 LEU 113 -5.874 0.359 4.755 743 HD22 LEU 113 1HD2 LEU 113 -4.974 0.913 6.177 744 HD23 LEU 113 2HD2 LEU 113 -6.550 1.622 5.797 745 H LYS 114 H LYS 114 -11.206 -1.382 6.628 746 HA LYS 114 HA LYS 114 -12.096 -0.855 3.924 747 HB2 LYS 114 1HB LYS 114 -12.361 -3.042 5.054 748 HB3 LYS 114 2HB LYS 114 -13.491 -2.326 6.208 749 HG2 LYS 114 1HG LYS 114 -15.041 -1.771 4.344 750 HG3 LYS 114 2HG LYS 114 -13.879 -2.386 3.166 751 HD2 LYS 114 1HD LYS 114 -15.227 -4.011 5.352 752 HD3 LYS 114 2HD LYS 114 -15.774 -3.914 3.661 753 HE2 LYS 114 1HE LYS 114 -13.305 -4.655 3.070 754 HE3 LYS 114 2HE LYS 114 -13.267 -5.208 4.753 755 HZ1 LYS 114 3HZ LYS 114 -15.050 -6.170 2.589 756 HZ2 LYS 114 1HZ LYS 114 -15.330 -6.491 4.181 757 HZ3 LYS 114 2HZ LYS 114 -13.967 -7.018 3.464 758 H LYS 115 H LYS 115 -12.839 0.481 7.134 759 HA LYS 115 HA LYS 115 -15.317 1.782 6.317 760 HB2 LYS 115 1HB LYS 115 -13.743 1.339 8.774 761 HB3 LYS 115 2HB LYS 115 -14.051 3.018 8.555 762 HG2 LYS 115 1HG LYS 115 -15.840 2.209 9.841 763 HG3 LYS 115 2HG LYS 115 -16.548 2.417 8.245 764 HD2 LYS 115 1HD LYS 115 -15.424 -0.269 9.123 765 HD3 LYS 115 2HD LYS 115 -16.998 0.254 9.689 766 HE2 LYS 115 1HE LYS 115 -16.556 0.347 6.735 767 HE3 LYS 115 2HE LYS 115 -16.673 -1.254 7.474 768 HZ1 LYS 115 3HZ LYS 115 -18.680 0.881 7.896 769 HZ2 LYS 115 1HZ LYS 115 -18.838 -0.699 8.326 770 HZ3 LYS 115 2HZ LYS 115 -18.849 -0.250 6.746 771 H GLU 116 H GLU 116 -12.015 2.910 7.165 772 HA GLU 116 HA GLU 116 -12.171 5.522 6.427 773 HB2 GLU 116 1HB GLU 116 -9.885 3.548 6.039 774 HB3 GLU 116 2HB GLU 116 -9.691 5.298 5.903 775 HG2 GLU 116 1HG GLU 116 -10.823 4.075 8.419 776 HG3 GLU 116 2HG GLU 116 -9.093 4.084 8.114 777 H PHE 117 H PHE 117 -11.095 2.929 4.166 778 HA PHE 117 HA PHE 117 -11.299 4.926 1.978 779 HB2 PHE 117 1HB PHE 117 -9.521 2.507 2.351 780 HB3 PHE 117 2HB PHE 117 -9.406 3.716 1.052 781 HD1 PHE 117 2HD PHE 117 -9.351 6.275 2.077 782 HD2 PHE 117 1HD PHE 117 -7.945 2.714 4.064 783 HE1 PHE 117 2HE PHE 117 -8.043 7.670 3.649 784 HE2 PHE 117 1HE PHE 117 -6.652 4.129 5.652 785 HZ PHE 117 HZ PHE 117 -6.703 6.600 5.445 786 H TYR 118 H TYR 118 -13.345 2.638 2.977 787 HA TYR 118 HA TYR 118 -14.093 2.078 0.215 788 HB2 TYR 118 1HB TYR 118 -12.451 0.277 1.220 789 HB3 TYR 118 2HB TYR 118 -13.906 -0.347 1.952 790 HD1 TYR 118 1HD TYR 118 -12.923 1.049 -1.458 791 HD2 TYR 118 2HD TYR 118 -14.752 -2.161 0.786 792 HE1 TYR 118 1HE TYR 118 -12.999 -0.378 -3.527 793 HE2 TYR 118 2HE TYR 118 -15.004 -3.481 -1.289 794 HH TYR 118 HH TYR 118 -13.362 -2.633 -4.253 795 H GLN 119 H GLN 119 -15.377 3.709 2.240 796 HA GLN 119 HA GLN 119 -17.563 2.178 3.310 797 HB2 GLN 119 1HB GLN 119 -18.335 4.093 4.370 798 HB3 GLN 119 2HB GLN 119 -16.625 3.988 4.616 799 HG2 GLN 119 1HG GLN 119 -18.091 5.910 2.794 800 HG3 GLN 119 2HG GLN 119 -17.372 6.282 4.347 801 HE21 GLN 119 1HE2 GLN 119 -14.838 4.784 3.763 802 HE22 GLN 119 2HE2 GLN 119 -13.955 5.973 2.911 803 H THR 120 H THR 120 -17.369 4.512 0.507 804 HA THR 120 HA THR 120 -20.301 4.245 0.262 805 HB THR 120 HB THR 120 -20.258 5.951 -1.319 806 HG1 THR 120 1HG THR 120 -18.345 6.816 -2.093 807 HG21 THR 120 3HG2 THR 120 -19.790 6.623 1.073 808 HG22 THR 120 1HG2 THR 120 -19.251 7.780 -0.153 809 HG23 THR 120 2HG2 THR 120 -18.075 6.717 0.625 810 H ARG 121 H ARG 121 -20.932 4.099 -2.386 811 HA ARG 121 HA ARG 121 -19.771 1.473 -3.192 812 HB2 ARG 121 1HB ARG 121 -22.350 1.838 -3.168 813 HB3 ARG 121 2HB ARG 121 -22.082 2.920 -4.545 814 HG2 ARG 121 1HG ARG 121 -20.679 0.810 -5.445 815 HG3 ARG 121 2HG ARG 121 -21.675 -0.090 -4.331 816 HD2 ARG 121 1HD ARG 121 -22.989 1.817 -6.291 817 HD3 ARG 121 2HD ARG 121 -22.241 0.343 -6.900 818 HE ARG 121 HE ARG 121 -24.090 -0.137 -4.697 819 HH11 ARG 121 1HH1 ARG 121 -23.762 0.251 -8.213 820 HH12 ARG 121 2HH1 ARG 121 -24.942 -0.901 -8.656 821 HH21 ARG 121 1HH2 ARG 121 -25.999 -1.340 -5.228 822 HH22 ARG 121 2HH2 ARG 121 -26.331 -1.775 -6.878 823 H SER 122 H SER 122 -20.269 4.881 -4.389 824 HA SER 122 HA SER 122 -18.971 4.283 -6.852 825 HB2 SER 122 1HB SER 122 -19.101 6.565 -7.334 826 HB3 SER 122 2HB SER 122 -20.546 6.178 -6.379 827 HG SER 122 HG SER 122 -18.277 7.669 -5.817 828 H GLN 123 H GLN 123 -17.620 5.175 -3.680 829 HA GLN 123 HA GLN 123 -15.009 5.894 -4.600 830 HB2 GLN 123 1HB GLN 123 -15.461 6.334 -2.293 831 HB3 GLN 123 2HB GLN 123 -15.971 4.706 -1.968 832 HG2 GLN 123 1HG GLN 123 -13.652 3.858 -2.147 833 HG3 GLN 123 2HG GLN 123 -13.116 5.493 -2.654 834 HE21 GLN 123 1HE2 GLN 123 -15.202 4.073 -0.169 835 HE22 GLN 123 2HE2 GLN 123 -14.595 5.129 1.158 836 H LYS 124 H LYS 124 -16.564 2.739 -4.351 837 HA LYS 124 HA LYS 124 -14.194 1.147 -4.390 838 HB2 LYS 124 1HB LYS 124 -16.818 0.443 -5.747 839 HB3 LYS 124 2HB LYS 124 -15.559 -0.644 -5.180 840 HG2 LYS 124 1HG LYS 124 -16.120 -0.214 -2.847 841 HG3 LYS 124 2HG LYS 124 -17.267 1.034 -3.327 842 HD2 LYS 124 1HD LYS 124 -18.538 -0.881 -2.830 843 HD3 LYS 124 2HD LYS 124 -18.605 -0.688 -4.576 844 HE2 LYS 124 1HE LYS 124 -16.711 -2.605 -3.137 845 HE3 LYS 124 2HE LYS 124 -18.354 -3.026 -3.631 846 HZ1 LYS 124 3HZ LYS 124 -16.111 -2.399 -5.466 847 HZ2 LYS 124 1HZ LYS 124 -17.671 -2.530 -5.952 848 HZ3 LYS 124 2HZ LYS 124 -16.883 -3.806 -5.279 849 H ARG 125 H ARG 125 -15.732 3.048 -6.870 850 HA ARG 125 HA ARG 125 -14.747 1.614 -9.169 851 HB2 ARG 125 1HB ARG 125 -16.750 3.373 -8.743 852 HB3 ARG 125 2HB ARG 125 -15.513 4.537 -9.154 853 HG2 ARG 125 1HG ARG 125 -16.827 4.088 -11.028 854 HG3 ARG 125 2HG ARG 125 -15.257 3.390 -11.370 855 HD2 ARG 125 1HD ARG 125 -17.590 1.738 -10.305 856 HD3 ARG 125 2HD ARG 125 -17.450 2.119 -12.011 857 HE ARG 125 HE ARG 125 -15.749 0.288 -10.454 858 HH11 ARG 125 1HH1 ARG 125 -16.049 2.035 -13.604 859 HH12 ARG 125 2HH1 ARG 125 -15.021 0.905 -14.399 860 HH21 ARG 125 1HH2 ARG 125 -14.389 -1.169 -11.634 861 HH22 ARG 125 2HH2 ARG 125 -13.986 -0.803 -13.255 862 H GLU 126 H GLU 126 -13.782 4.611 -7.438 863 HA GLU 126 HA GLU 126 -11.373 5.051 -8.911 864 HB2 GLU 126 1HB GLU 126 -12.249 5.809 -6.065 865 HB3 GLU 126 2HB GLU 126 -10.663 6.207 -6.709 866 HG2 GLU 126 1HG GLU 126 -11.791 8.084 -7.139 867 HG3 GLU 126 2HG GLU 126 -11.841 7.282 -8.705 868 H VAL 127 H VAL 127 -11.932 3.495 -5.798 869 HA VAL 127 HA VAL 127 -9.299 2.815 -5.163 870 HB VAL 127 HB VAL 127 -11.872 1.343 -4.559 871 HG11 VAL 127 1HG1 VAL 127 -10.687 0.217 -2.709 872 HG12 VAL 127 2HG1 VAL 127 -10.061 -0.279 -4.281 873 HG13 VAL 127 3HG1 VAL 127 -9.134 0.881 -3.299 874 HG21 VAL 127 3HG2 VAL 127 -11.602 2.502 -2.347 875 HG22 VAL 127 1HG2 VAL 127 -10.042 3.150 -2.850 876 HG23 VAL 127 2HG2 VAL 127 -11.520 3.714 -3.625 877 H ASP 128 H ASP 128 -11.647 0.695 -6.875 878 HA ASP 128 HA ASP 128 -9.714 -1.267 -7.590 879 HB2 ASP 128 1HB ASP 128 -12.257 -1.356 -7.598 880 HB3 ASP 128 2HB ASP 128 -12.197 -0.586 -9.190 881 H ASP 129 H ASP 129 -10.378 1.890 -9.084 882 HA ASP 129 HA ASP 129 -9.043 1.331 -11.580 883 HB2 ASP 129 1HB ASP 129 -10.148 3.758 -10.255 884 HB3 ASP 129 2HB ASP 129 -8.633 4.048 -11.076 885 H TYR 130 H TYR 130 -7.890 2.600 -8.402 886 HA TYR 130 HA TYR 130 -5.180 2.883 -9.264 887 HB2 TYR 130 1HB TYR 130 -6.011 1.941 -6.522 888 HB3 TYR 130 2HB TYR 130 -4.541 2.798 -6.943 889 HD1 TYR 130 1HD TYR 130 -5.513 5.121 -8.513 890 HD2 TYR 130 2HD TYR 130 -7.205 3.269 -5.018 891 HE1 TYR 130 1HE TYR 130 -6.727 7.187 -8.028 892 HE2 TYR 130 2HE TYR 130 -8.501 5.335 -4.554 893 HH TYR 130 HH TYR 130 -9.125 7.382 -5.396 894 H VAL 131 H VAL 131 -7.015 0.044 -8.197 895 HA VAL 131 HA VAL 131 -4.731 -1.728 -8.131 896 HB VAL 131 HB VAL 131 -7.698 -2.406 -8.271 897 HG11 VAL 131 1HG1 VAL 131 -6.724 -4.458 -6.917 898 HG12 VAL 131 2HG1 VAL 131 -6.550 -4.413 -8.672 899 HG13 VAL 131 3HG1 VAL 131 -5.187 -3.957 -7.643 900 HG21 VAL 131 3HG2 VAL 131 -7.710 -2.554 -5.876 901 HG22 VAL 131 1HG2 VAL 131 -5.954 -2.253 -5.779 902 HG23 VAL 131 2HG2 VAL 131 -7.065 -0.964 -6.245 903 H ALA 132 H ALA 132 -6.406 -0.318 -10.745 904 HA ALA 132 HA ALA 132 -5.448 -2.445 -12.601 905 HB1 ALA 132 1HB ALA 132 -7.903 -2.133 -12.536 906 HB2 ALA 132 2HB ALA 132 -7.686 -0.428 -12.996 907 HB3 ALA 132 3HB ALA 132 -7.198 -1.721 -14.110 908 H GLY 133 H GLY 133 -5.014 0.913 -11.723 909 HA2 GLY 133 1HA GLY 133 -3.579 1.601 -14.215 910 HA3 GLY 133 2HA GLY 133 -3.958 2.643 -12.847 911 H LEU 134 H LEU 134 -2.816 0.066 -11.299 912 HA LEU 134 HA LEU 134 -0.050 0.936 -11.082 913 HB2 LEU 134 1HB LEU 134 0.226 -1.000 -9.609 914 HB3 LEU 134 2HB LEU 134 -1.133 0.011 -9.165 915 HG LEU 134 HG LEU 134 -2.657 -1.701 -10.326 916 HD11 LEU 134 1HD1 LEU 134 -1.749 -4.047 -10.364 917 HD12 LEU 134 2HD1 LEU 134 -0.115 -3.381 -10.185 918 HD13 LEU 134 3HD1 LEU 134 -1.090 -3.039 -11.635 919 HD21 LEU 134 3HD2 LEU 134 -2.411 -1.464 -7.879 920 HD22 LEU 134 1HD2 LEU 134 -1.043 -2.594 -7.903 921 HD23 LEU 134 2HD2 LEU 134 -2.673 -3.150 -8.355 922 H ARG 135 H ARG 135 1.689 -0.730 -11.393 923 HA ARG 135 HA ARG 135 1.347 -2.478 -13.788 924 HB2 ARG 135 1HB ARG 135 3.743 -0.752 -13.010 925 HB3 ARG 135 2HB ARG 135 3.665 -1.879 -14.357 926 HG2 ARG 135 1HG ARG 135 1.987 -0.491 -15.502 927 HG3 ARG 135 2HG ARG 135 1.940 0.603 -14.105 928 HD2 ARG 135 1HD ARG 135 3.428 1.773 -15.288 929 HD3 ARG 135 2HD ARG 135 4.574 0.689 -14.510 930 HE ARG 135 HE ARG 135 3.884 -0.569 -16.890 931 HH11 ARG 135 1HH1 ARG 135 5.179 2.618 -16.005 932 HH12 ARG 135 2HH1 ARG 135 5.977 2.929 -17.492 933 HH21 ARG 135 1HH2 ARG 135 5.318 -0.347 -18.765 934 HH22 ARG 135 2HH2 ARG 135 6.012 1.184 -19.117 935 H THR 136 H THR 136 3.356 -4.137 -13.689 936 HA THR 136 HA THR 136 3.941 -4.809 -10.846 937 HB THR 136 HB THR 136 2.607 -6.763 -12.691 938 HG1 THR 136 1HG THR 136 1.415 -4.883 -10.971 939 HG21 THR 136 3HG2 THR 136 3.561 -7.867 -10.724 940 HG22 THR 136 1HG2 THR 136 1.828 -7.745 -10.438 941 HG23 THR 136 2HG2 THR 136 2.924 -6.599 -9.663 942 H GLU 137 H GLU 137 5.407 -4.198 -13.469 943 HA GLU 137 HA GLU 137 7.229 -4.801 -14.657 944 HB2 GLU 137 1HB GLU 137 7.821 -6.151 -12.035 945 HB3 GLU 137 2HB GLU 137 8.876 -6.471 -13.401 946 HG2 GLU 137 1HG GLU 137 8.215 -3.587 -12.774 947 HG3 GLU 137 2HG GLU 137 9.329 -4.465 -11.719 Start of MODEL 3 1 H1 GLY 19 H GLY 19 -11.973 -19.182 -6.099 2 HA2 GLY 19 1HA GLY 19 -13.911 -17.766 -5.493 3 HA3 GLY 19 2HA GLY 19 -14.706 -19.262 -4.954 4 H HIS 20 H HIS 20 -14.878 -18.208 -2.895 5 HA HIS 20 HA HIS 20 -14.376 -17.620 -0.831 6 HB2 HIS 20 1HB HIS 20 -14.537 -20.092 -0.931 7 HB3 HIS 20 2HB HIS 20 -12.768 -20.175 -0.910 8 HD1 HIS 20 1HD HIS 20 -11.605 -19.666 1.451 9 HD2 HIS 20 2HD HIS 20 -15.795 -19.155 1.301 10 HE1 HIS 20 1HE HIS 20 -12.369 -19.134 3.835 11 H MET 21 H MET 21 -13.313 -15.702 -0.617 12 HA MET 21 HA MET 21 -10.682 -15.937 0.558 13 HB2 MET 21 1HB MET 21 -9.600 -14.231 -0.838 14 HB3 MET 21 2HB MET 21 -10.026 -15.648 -1.792 15 HG2 MET 21 1HG MET 21 -11.974 -14.496 -2.717 16 HG3 MET 21 2HG MET 21 -11.669 -13.091 -1.679 17 HE1 MET 21 3HE MET 21 -10.794 -11.513 -5.038 18 HE2 MET 21 1HE MET 21 -12.068 -12.726 -4.791 19 HE3 MET 21 2HE MET 21 -11.778 -11.472 -3.559 20 H LYS 22 H LYS 22 -9.941 -13.536 1.211 21 HA LYS 22 HA LYS 22 -12.197 -11.760 1.857 22 HB2 LYS 22 1HB LYS 22 -10.941 -13.419 3.807 23 HB3 LYS 22 2HB LYS 22 -10.289 -11.821 4.050 24 HG2 LYS 22 1HG LYS 22 -12.196 -12.175 5.451 25 HG3 LYS 22 2HG LYS 22 -12.564 -10.901 4.291 26 HD2 LYS 22 1HD LYS 22 -13.982 -12.391 2.997 27 HD3 LYS 22 2HD LYS 22 -13.417 -13.797 3.932 28 HE2 LYS 22 1HE LYS 22 -14.371 -12.784 5.996 29 HE3 LYS 22 2HE LYS 22 -14.994 -11.434 5.036 30 HZ1 LYS 22 3HZ LYS 22 -15.755 -14.286 4.683 31 HZ2 LYS 22 1HZ LYS 22 -16.372 -13.052 3.814 32 HZ3 LYS 22 2HZ LYS 22 -16.667 -13.165 5.425 33 H PHE 23 H PHE 23 -11.571 -10.462 0.250 34 HA PHE 23 HA PHE 23 -10.431 -9.047 -1.033 35 HB2 PHE 23 1HB PHE 23 -8.901 -8.493 1.496 36 HB3 PHE 23 2HB PHE 23 -8.693 -7.565 0.017 37 HD1 PHE 23 1HD PHE 23 -12.160 -8.204 -0.005 38 HD2 PHE 23 2HD PHE 23 -9.113 -5.850 1.959 39 HE1 PHE 23 1HE PHE 23 -13.837 -6.681 0.739 40 HE2 PHE 23 2HE PHE 23 -10.857 -4.287 2.757 41 HZ PHE 23 HZ PHE 23 -13.257 -4.699 2.189 42 H THR 24 H THR 24 -7.734 -8.409 -1.377 43 HA THR 24 HA THR 24 -6.115 -10.808 -1.625 44 HB THR 24 HB THR 24 -5.652 -9.544 -4.032 45 HG1 THR 24 1HG THR 24 -8.393 -9.136 -3.465 46 HG21 THR 24 3HG2 THR 24 -6.257 -11.930 -3.719 47 HG22 THR 24 1HG2 THR 24 -7.298 -11.203 -4.968 48 HG23 THR 24 2HG2 THR 24 -7.927 -11.442 -3.334 49 H ASP 25 H ASP 25 -3.878 -10.246 -1.600 50 HA ASP 25 HA ASP 25 -3.078 -8.148 0.013 51 HB2 ASP 25 1HB ASP 25 -1.586 -9.764 -2.059 52 HB3 ASP 25 2HB ASP 25 -0.790 -8.384 -1.313 53 H GLN 26 H GLN 26 -3.300 -8.131 -3.534 54 HA GLN 26 HA GLN 26 -2.319 -5.577 -4.183 55 HB2 GLN 26 1HB GLN 26 -4.631 -7.238 -5.283 56 HB3 GLN 26 2HB GLN 26 -4.051 -5.758 -6.065 57 HG2 GLN 26 1HG GLN 26 -1.965 -6.683 -6.578 58 HG3 GLN 26 2HG GLN 26 -2.106 -7.981 -5.420 59 HE21 GLN 26 1HE2 GLN 26 -4.431 -6.883 -8.096 60 HE22 GLN 26 2HE2 GLN 26 -4.310 -8.425 -8.892 61 H GLN 27 H GLN 27 -5.695 -6.453 -3.496 62 HA GLN 27 HA GLN 27 -6.804 -3.829 -3.754 63 HB2 GLN 27 1HB GLN 27 -7.728 -6.433 -2.456 64 HB3 GLN 27 2HB GLN 27 -8.767 -5.037 -2.615 65 HG2 GLN 27 1HG GLN 27 -7.438 -6.394 -5.001 66 HG3 GLN 27 2HG GLN 27 -9.013 -6.839 -4.398 67 HE21 GLN 27 1HE2 GLN 27 -8.274 -5.725 -7.110 68 HE22 GLN 27 2HE2 GLN 27 -9.295 -4.301 -7.228 69 H ILE 28 H ILE 28 -5.360 -5.573 -1.087 70 HA ILE 28 HA ILE 28 -6.190 -3.729 0.999 71 HB ILE 28 HB ILE 28 -4.160 -5.989 0.778 72 HG12 ILE 28 1HG1 ILE 28 -6.791 -5.849 2.295 73 HG13 ILE 28 2HG1 ILE 28 -6.678 -6.488 0.672 74 HG21 ILE 28 1HG2 ILE 28 -3.957 -5.900 3.208 75 HG22 ILE 28 2HG2 ILE 28 -3.355 -4.427 2.487 76 HG23 ILE 28 3HG2 ILE 28 -4.959 -4.423 3.260 77 HD11 ILE 28 3HD1 ILE 28 -6.628 -8.371 2.097 78 HD12 ILE 28 1HD1 ILE 28 -4.979 -8.181 1.484 79 HD13 ILE 28 2HD1 ILE 28 -5.395 -7.666 3.139 80 H GLY 29 H GLY 29 -3.273 -4.217 -1.058 81 HA2 GLY 29 1HA GLY 29 -1.471 -2.549 0.212 82 HA3 GLY 29 2HA GLY 29 -1.510 -2.888 -1.529 83 H VAL 30 H VAL 30 -3.962 -1.669 -2.204 84 HA VAL 30 HA VAL 30 -3.147 1.090 -2.414 85 HB VAL 30 HB VAL 30 -5.736 -0.350 -3.114 86 HG11 VAL 30 1HG1 VAL 30 -6.360 1.628 -4.402 87 HG12 VAL 30 2HG1 VAL 30 -6.231 2.054 -2.704 88 HG13 VAL 30 3HG1 VAL 30 -4.920 2.506 -3.820 89 HG21 VAL 30 3HG2 VAL 30 -3.802 -1.025 -4.495 90 HG22 VAL 30 1HG2 VAL 30 -4.875 -0.008 -5.462 91 HG23 VAL 30 2HG2 VAL 30 -3.388 0.673 -4.797 92 H LEU 31 H LEU 31 -5.684 -0.571 -0.441 93 HA LEU 31 HA LEU 31 -6.666 1.745 0.903 94 HB2 LEU 31 1HB LEU 31 -6.664 -1.211 1.348 95 HB3 LEU 31 2HB LEU 31 -6.756 -0.247 2.815 96 HG LEU 31 HG LEU 31 -8.800 0.734 2.265 97 HD11 LEU 31 1HD1 LEU 31 -10.021 0.355 0.142 98 HD12 LEU 31 2HD1 LEU 31 -8.579 -0.451 -0.533 99 HD13 LEU 31 3HD1 LEU 31 -8.549 1.279 -0.113 100 HD21 LEU 31 3HD2 LEU 31 -8.882 -1.638 3.017 101 HD22 LEU 31 1HD2 LEU 31 -8.861 -2.163 1.331 102 HD23 LEU 31 2HD2 LEU 31 -10.251 -1.243 1.954 103 H ALA 32 H ALA 32 -4.001 -0.466 1.794 104 HA ALA 32 HA ALA 32 -3.282 0.907 4.188 105 HB1 ALA 32 1HB ALA 32 -1.632 -0.834 2.306 106 HB2 ALA 32 2HB ALA 32 -1.158 -0.367 3.948 107 HB3 ALA 32 3HB ALA 32 -2.582 -1.401 3.695 108 H GLY 33 H GLY 33 -2.264 1.400 0.777 109 HA2 GLY 33 1HA GLY 33 -0.259 3.381 1.370 110 HA3 GLY 33 2HA GLY 33 -1.035 3.085 -0.193 111 H LEU 34 H LEU 34 -3.812 3.545 0.774 112 HA LEU 34 HA LEU 34 -3.818 6.379 0.576 113 HB2 LEU 34 1HB LEU 34 -6.007 4.480 1.457 114 HB3 LEU 34 2HB LEU 34 -6.251 6.213 1.261 115 HG LEU 34 HG LEU 34 -5.364 4.345 -0.985 116 HD11 LEU 34 1HD1 LEU 34 -7.682 4.734 -1.824 117 HD12 LEU 34 2HD1 LEU 34 -8.047 5.546 -0.269 118 HD13 LEU 34 3HD1 LEU 34 -7.616 3.831 -0.296 119 HD21 LEU 34 3HD2 LEU 34 -6.117 7.292 -1.017 120 HD22 LEU 34 1HD2 LEU 34 -5.950 6.258 -2.466 121 HD23 LEU 34 2HD2 LEU 34 -4.551 6.562 -1.453 122 H ALA 35 H ALA 35 -3.453 4.347 3.378 123 HA ALA 35 HA ALA 35 -3.958 6.558 5.258 124 HB1 ALA 35 1HB ALA 35 -2.753 3.782 5.653 125 HB2 ALA 35 2HB ALA 35 -3.062 4.957 6.939 126 HB3 ALA 35 3HB ALA 35 -4.414 4.292 6.026 127 H ILE 36 H ILE 36 -1.288 5.682 3.204 128 HA ILE 36 HA ILE 36 0.589 7.292 4.802 129 HB ILE 36 HB ILE 36 1.084 4.458 3.793 130 HG12 ILE 36 1HG1 ILE 36 2.182 4.327 6.124 131 HG13 ILE 36 2HG1 ILE 36 1.390 5.843 6.519 132 HG21 ILE 36 1HG2 ILE 36 3.469 4.805 4.388 133 HG22 ILE 36 2HG2 ILE 36 3.021 5.860 3.081 134 HG23 ILE 36 3HG2 ILE 36 3.162 6.526 4.702 135 HD11 ILE 36 3HD1 ILE 36 -0.251 3.501 5.586 136 HD12 ILE 36 1HD1 ILE 36 0.416 3.520 7.232 137 HD13 ILE 36 2HD1 ILE 36 -0.666 4.807 6.725 138 H SER 37 H SER 37 0.464 8.966 3.400 139 HA SER 37 HA SER 37 1.010 10.237 1.625 140 HB2 SER 37 1HB SER 37 3.071 8.540 1.951 141 HB3 SER 37 2HB SER 37 2.633 8.056 0.316 142 HG SER 37 HG SER 37 3.114 10.089 -0.367 143 HA PRO 38 HA PRO 38 -2.300 7.714 -0.756 144 HB2 PRO 38 1HB PRO 38 -4.239 9.763 -0.674 145 HB3 PRO 38 2HB PRO 38 -4.170 8.391 0.446 146 HG2 PRO 38 1HG PRO 38 -3.117 11.176 0.844 147 HG3 PRO 38 2HG PRO 38 -3.967 10.114 2.016 148 HD2 PRO 38 1HD PRO 38 -1.283 10.413 2.098 149 HD3 PRO 38 2HD PRO 38 -2.025 8.809 2.378 150 H GLU 39 H GLU 39 -1.464 11.176 -0.793 151 HA GLU 39 HA GLU 39 -2.237 11.763 -3.416 152 HB2 GLU 39 1HB GLU 39 -1.648 13.171 -1.271 153 HB3 GLU 39 2HB GLU 39 0.009 13.122 -1.875 154 HG2 GLU 39 1HG GLU 39 -0.796 14.106 -4.024 155 HG3 GLU 39 2HG GLU 39 -2.459 14.072 -3.391 156 H TRP 40 H TRP 40 0.794 10.436 -2.143 157 HA TRP 40 HA TRP 40 2.376 10.799 -4.554 158 HB2 TRP 40 1HB TRP 40 3.612 10.496 -2.565 159 HB3 TRP 40 2HB TRP 40 2.642 9.128 -2.055 160 HD1 TRP 40 HD TRP 40 5.396 9.943 -4.630 161 HE1 TRP 40 1HE TRP 40 6.547 7.820 -5.314 162 HE3 TRP 40 3HE TRP 40 2.350 6.623 -2.214 163 HZ2 TRP 40 2HZ TRP 40 6.254 4.940 -4.771 164 HZ3 TRP 40 3HZ TRP 40 2.753 4.170 -2.406 165 HH2 TRP 40 HH TRP 40 4.723 3.331 -3.644 166 H LEU 41 H LEU 41 0.573 8.016 -3.086 167 HA LEU 41 HA LEU 41 0.862 6.219 -5.204 168 HB2 LEU 41 1HB LEU 41 0.014 5.594 -3.079 169 HB3 LEU 41 2HB LEU 41 -1.420 6.582 -3.237 170 HG LEU 41 HG LEU 41 -0.943 4.486 -5.344 171 HD11 LEU 41 1HD1 LEU 41 -1.917 2.711 -3.946 172 HD12 LEU 41 2HD1 LEU 41 -1.923 3.814 -2.541 173 HD13 LEU 41 3HD1 LEU 41 -0.387 3.296 -3.260 174 HD21 LEU 41 3HD2 LEU 41 -3.436 5.399 -3.821 175 HD22 LEU 41 1HD2 LEU 41 -3.416 4.216 -5.146 176 HD23 LEU 41 2HD2 LEU 41 -2.994 5.893 -5.467 177 H LYS 42 H LYS 42 -1.689 8.666 -4.768 178 HA LYS 42 HA LYS 42 -3.038 8.231 -7.243 179 HB2 LYS 42 1HB LYS 42 -2.783 10.662 -5.427 180 HB3 LYS 42 2HB LYS 42 -3.798 10.645 -6.858 181 HG2 LYS 42 1HG LYS 42 -5.180 8.862 -5.997 182 HG3 LYS 42 2HG LYS 42 -4.119 8.605 -4.615 183 HD2 LYS 42 1HD LYS 42 -4.602 10.880 -3.786 184 HD3 LYS 42 2HD LYS 42 -5.694 11.167 -5.149 185 HE2 LYS 42 1HE LYS 42 -6.193 8.772 -3.380 186 HE3 LYS 42 2HE LYS 42 -6.544 10.374 -2.719 187 HZ1 LYS 42 3HZ LYS 42 -7.692 9.350 -5.235 188 HZ2 LYS 42 1HZ LYS 42 -8.073 10.781 -4.512 189 HZ3 LYS 42 2HZ LYS 42 -8.470 9.336 -3.827 190 H GLN 43 H GLN 43 -0.238 10.491 -6.543 191 HA GLN 43 HA GLN 43 -0.109 11.549 -9.201 192 HB2 GLN 43 1HB GLN 43 1.886 11.338 -6.912 193 HB3 GLN 43 2HB GLN 43 2.406 11.828 -8.527 194 HG2 GLN 43 1HG GLN 43 0.747 13.657 -8.554 195 HG3 GLN 43 2HG GLN 43 0.235 13.216 -6.933 196 HE21 GLN 43 1HE2 GLN 43 3.802 13.179 -7.760 197 HE22 GLN 43 2HE2 GLN 43 4.114 14.688 -7.011 198 H ASN 44 H ASN 44 1.397 8.639 -7.759 199 HA ASN 44 HA ASN 44 3.040 8.026 -10.005 200 HB2 ASN 44 1HB ASN 44 1.739 5.898 -8.282 201 HB3 ASN 44 2HB ASN 44 3.302 5.844 -9.083 202 HD21 ASN 44 1HD2 ASN 44 4.293 8.578 -7.849 203 HD22 ASN 44 2HD2 ASN 44 4.446 8.061 -6.190 204 H ILE 45 H ILE 45 -0.267 6.981 -9.101 205 HA ILE 45 HA ILE 45 -0.618 5.294 -11.416 206 HB ILE 45 HB ILE 45 -2.579 6.425 -9.388 207 HG12 ILE 45 1HG1 ILE 45 -1.344 3.645 -9.785 208 HG13 ILE 45 2HG1 ILE 45 -0.790 4.815 -8.595 209 HG21 ILE 45 1HG2 ILE 45 -4.064 4.530 -10.335 210 HG22 ILE 45 2HG2 ILE 45 -3.885 5.958 -11.342 211 HG23 ILE 45 3HG2 ILE 45 -2.964 4.485 -11.713 212 HD11 ILE 45 3HD1 ILE 45 -2.131 3.562 -7.273 213 HD12 ILE 45 1HD1 ILE 45 -3.267 4.812 -7.770 214 HD13 ILE 45 2HD1 ILE 45 -3.238 3.214 -8.587 215 H ALA 46 H ALA 46 -1.318 8.728 -10.684 216 HA ALA 46 HA ALA 46 -2.654 9.209 -13.190 217 HB1 ALA 46 1HB ALA 46 -1.290 11.214 -11.367 218 HB2 ALA 46 2HB ALA 46 -2.595 11.503 -12.555 219 HB3 ALA 46 3HB ALA 46 -2.936 10.572 -11.099 220 H ALA 47 H ALA 47 0.618 8.496 -12.573 221 HA ALA 47 HA ALA 47 1.442 9.712 -15.161 222 HB1 ALA 47 1HB ALA 47 3.017 7.973 -13.204 223 HB2 ALA 47 2HB ALA 47 3.626 8.717 -14.696 224 HB3 ALA 47 3HB ALA 47 3.113 9.742 -13.338 225 H ASN 48 H ASN 48 0.068 6.877 -13.790 226 HA ASN 48 HA ASN 48 -0.590 4.908 -14.499 227 HB2 ASN 48 1HB ASN 48 -0.962 6.156 -16.781 228 HB3 ASN 48 2HB ASN 48 0.449 5.238 -17.300 229 HD21 ASN 48 1HD2 ASN 48 0.269 2.776 -16.634 230 HD22 ASN 48 2HD2 ASN 48 -1.296 2.029 -16.889 231 H GLN 49 H GLN 49 1.991 5.600 -13.322 232 HA GLN 49 HA GLN 49 3.812 3.518 -14.474 233 HB2 GLN 49 1HB GLN 49 4.113 5.734 -12.417 234 HB3 GLN 49 2HB GLN 49 5.352 4.521 -12.655 235 HG2 GLN 49 1HG GLN 49 4.411 6.102 -15.057 236 HG3 GLN 49 2HG GLN 49 5.477 6.858 -13.875 237 HE21 GLN 49 1HE2 GLN 49 5.219 3.939 -15.954 238 HE22 GLN 49 2HE2 GLN 49 6.921 3.484 -15.822 239 H LEU 50 H LEU 50 3.420 4.364 -11.195 240 HA LEU 50 HA LEU 50 3.642 3.064 -9.266 241 HB2 LEU 50 1HB LEU 50 1.318 3.908 -9.369 242 HB3 LEU 50 2HB LEU 50 0.841 2.348 -10.034 243 HG LEU 50 HG LEU 50 2.059 1.305 -7.939 244 HD11 LEU 50 1HD1 LEU 50 1.612 4.089 -6.820 245 HD12 LEU 50 2HD1 LEU 50 3.210 3.411 -7.198 246 HD13 LEU 50 3HD1 LEU 50 2.212 2.675 -5.947 247 HD21 LEU 50 3HD2 LEU 50 0.100 0.933 -7.047 248 HD22 LEU 50 1HD2 LEU 50 -0.588 1.942 -8.320 249 HD23 LEU 50 2HD2 LEU 50 -0.222 2.640 -6.720 250 H VAL 51 H VAL 51 4.978 1.326 -8.858 251 HA VAL 51 HA VAL 51 4.415 -1.140 -10.442 252 HB VAL 51 HB VAL 51 7.011 -0.246 -9.159 253 HG11 VAL 51 1HG1 VAL 51 6.880 -2.695 -9.111 254 HG12 VAL 51 2HG1 VAL 51 6.331 -2.745 -10.799 255 HG13 VAL 51 3HG1 VAL 51 7.980 -2.202 -10.391 256 HG21 VAL 51 3HG2 VAL 51 7.776 -0.127 -11.545 257 HG22 VAL 51 1HG2 VAL 51 6.121 -0.446 -12.077 258 HG23 VAL 51 2HG2 VAL 51 6.505 1.046 -11.190 259 H TYR 52 H TYR 52 4.104 -3.038 -9.378 260 HA TYR 52 HA TYR 52 3.955 -3.149 -6.412 261 HB2 TYR 52 1HB TYR 52 1.728 -3.244 -7.390 262 HB3 TYR 52 2HB TYR 52 2.242 -4.389 -8.608 263 HD1 TYR 52 1HD TYR 52 2.856 -6.782 -7.955 264 HD2 TYR 52 2HD TYR 52 0.886 -4.041 -5.265 265 HE1 TYR 52 1HE TYR 52 2.147 -8.684 -6.537 266 HE2 TYR 52 2HE TYR 52 0.225 -5.963 -3.809 267 HH TYR 52 HH TYR 52 0.448 -9.237 -4.952 268 H GLY 53 H GLY 53 5.127 -4.837 -5.514 269 HA2 GLY 53 1HA GLY 53 5.903 -7.170 -7.099 270 HA3 GLY 53 2HA GLY 53 7.205 -6.127 -6.484 271 H ILE 54 H ILE 54 7.279 -8.563 -5.602 272 HA ILE 54 HA ILE 54 6.404 -8.451 -2.763 273 HB ILE 54 HB ILE 54 6.732 -10.782 -4.691 274 HG12 ILE 54 1HG1 ILE 54 4.500 -9.506 -4.510 275 HG13 ILE 54 2HG1 ILE 54 4.468 -11.235 -4.384 276 HG21 ILE 54 1HG2 ILE 54 6.292 -12.327 -2.780 277 HG22 ILE 54 2HG2 ILE 54 7.859 -11.524 -2.691 278 HG23 ILE 54 3HG2 ILE 54 6.534 -10.976 -1.657 279 HD11 ILE 54 3HD1 ILE 54 3.002 -10.078 -2.756 280 HD12 ILE 54 1HD1 ILE 54 4.192 -11.163 -1.970 281 HD13 ILE 54 2HD1 ILE 54 4.463 -9.423 -1.969 282 H VAL 55 H VAL 55 8.106 -8.798 -1.327 283 HA VAL 55 HA VAL 55 10.685 -8.070 -1.937 284 HB VAL 55 HB VAL 55 9.341 -9.551 0.333 285 HG11 VAL 55 1HG1 VAL 55 11.633 -10.363 0.538 286 HG12 VAL 55 2HG1 VAL 55 12.258 -8.732 0.266 287 HG13 VAL 55 3HG1 VAL 55 11.364 -9.118 1.741 288 HG21 VAL 55 3HG2 VAL 55 10.589 -6.784 -0.032 289 HG22 VAL 55 1HG2 VAL 55 8.857 -7.132 -0.054 290 HG23 VAL 55 2HG2 VAL 55 9.763 -7.337 1.438 291 H LYS 56 H LYS 56 10.009 -11.541 -1.072 292 HA LYS 56 HA LYS 56 11.167 -13.392 -1.450 293 HB2 LYS 56 1HB LYS 56 11.759 -12.096 -4.102 294 HB3 LYS 56 2HB LYS 56 11.982 -13.801 -3.780 295 HG2 LYS 56 1HG LYS 56 9.308 -13.266 -3.047 296 HG3 LYS 56 2HG LYS 56 9.564 -12.265 -4.468 297 HD2 LYS 56 1HD LYS 56 10.317 -14.262 -5.732 298 HD3 LYS 56 2HD LYS 56 10.078 -15.264 -4.282 299 HE2 LYS 56 1HE LYS 56 7.709 -14.842 -4.251 300 HE3 LYS 56 2HE LYS 56 7.855 -13.583 -5.492 301 HZ1 LYS 56 3HZ LYS 56 7.059 -15.457 -6.547 302 HZ2 LYS 56 1HZ LYS 56 8.191 -16.484 -5.906 303 HZ3 LYS 56 2HZ LYS 56 8.611 -15.332 -7.017 304 HA PRO 57 HA PRO 57 15.250 -12.564 -0.178 305 HB2 PRO 57 1HB PRO 57 16.806 -14.674 -0.914 306 HB3 PRO 57 2HB PRO 57 15.531 -14.775 0.350 307 HG2 PRO 57 1HG PRO 57 15.379 -15.605 -2.543 308 HG3 PRO 57 2HG PRO 57 14.812 -16.499 -1.095 309 HD2 PRO 57 1HD PRO 57 13.132 -15.039 -2.646 310 HD3 PRO 57 2HD PRO 57 12.902 -15.109 -0.886 311 H SER 58 H SER 58 15.127 -13.417 -3.630 312 HA SER 58 HA SER 58 17.744 -12.299 -4.247 313 HB2 SER 58 1HB SER 58 16.909 -14.286 -5.364 314 HB3 SER 58 2HB SER 58 15.490 -13.422 -5.952 315 HG SER 58 HG SER 58 18.211 -13.035 -6.736 316 H ASP 59 H ASP 59 16.947 -10.288 -3.052 317 HA ASP 59 HA ASP 59 17.186 -8.364 -5.104 318 HB2 ASP 59 1HB ASP 59 14.508 -8.617 -4.390 319 HB3 ASP 59 2HB ASP 59 15.096 -7.385 -3.246 320 H THR 60 H THR 60 17.109 -5.976 -3.431 321 HA THR 60 HA THR 60 18.938 -6.746 -1.207 322 HB THR 60 HB THR 60 18.691 -4.082 -2.669 323 HG1 THR 60 1HG THR 60 20.390 -4.662 -3.850 324 HG21 THR 60 3HG2 THR 60 19.636 -3.950 -0.378 325 HG22 THR 60 1HG2 THR 60 20.883 -3.639 -1.593 326 HG23 THR 60 2HG2 THR 60 20.799 -5.223 -0.777 327 H VAL 61 H VAL 61 17.573 -6.882 0.630 328 HA VAL 61 HA VAL 61 15.639 -4.668 1.041 329 HB VAL 61 HB VAL 61 14.115 -6.566 1.947 330 HG11 VAL 61 1HG1 VAL 61 13.625 -5.069 0.048 331 HG12 VAL 61 2HG1 VAL 61 14.450 -6.193 -1.039 332 HG13 VAL 61 3HG1 VAL 61 12.969 -6.687 -0.180 333 HG21 VAL 61 3HG2 VAL 61 15.865 -8.374 1.692 334 HG22 VAL 61 1HG2 VAL 61 14.304 -8.743 0.988 335 HG23 VAL 61 2HG2 VAL 61 15.649 -8.257 -0.069 336 HA PRO 62 HA PRO 62 16.847 -4.868 5.298 337 HB2 PRO 62 1HB PRO 62 14.553 -4.064 6.571 338 HB3 PRO 62 2HB PRO 62 15.533 -2.939 5.576 339 HG2 PRO 62 1HG PRO 62 13.057 -4.505 4.801 340 HG3 PRO 62 2HG PRO 62 13.384 -2.775 4.524 341 HD2 PRO 62 1HD PRO 62 13.779 -4.600 2.596 342 HD3 PRO 62 2HD PRO 62 14.886 -3.228 2.778 343 H ALA 63 H ALA 63 16.389 -5.971 7.305 344 HA ALA 63 HA ALA 63 15.356 -8.602 7.168 345 HB1 ALA 63 1HB ALA 63 15.700 -8.519 9.599 346 HB2 ALA 63 2HB ALA 63 17.071 -7.739 8.773 347 HB3 ALA 63 3HB ALA 63 15.818 -6.746 9.552 348 H GLY 64 H GLY 64 13.339 -9.436 7.601 349 HA2 GLY 64 1HA GLY 64 11.366 -9.643 8.762 350 HA3 GLY 64 2HA GLY 64 11.542 -7.996 9.370 351 H VAL 65 H VAL 65 11.548 -8.792 5.890 352 HA VAL 65 HA VAL 65 8.662 -8.151 5.661 353 HB VAL 65 HB VAL 65 9.120 -6.725 3.651 354 HG11 VAL 65 1HG1 VAL 65 9.523 -4.679 4.847 355 HG12 VAL 65 2HG1 VAL 65 8.474 -5.751 5.796 356 HG13 VAL 65 3HG1 VAL 65 10.186 -5.574 6.230 357 HG21 VAL 65 3HG2 VAL 65 11.974 -6.524 4.746 358 HG22 VAL 65 1HG2 VAL 65 11.526 -7.364 3.261 359 HG23 VAL 65 2HG2 VAL 65 11.291 -5.621 3.375 360 H ASP 66 H ASP 66 10.352 -10.582 5.564 361 HA ASP 66 HA ASP 66 11.528 -11.013 3.174 362 HB2 ASP 66 1HB ASP 66 10.499 -13.111 5.135 363 HB3 ASP 66 2HB ASP 66 11.748 -13.361 3.940 364 H ASP 67 H ASP 67 8.309 -11.278 3.458 365 HA ASP 67 HA ASP 67 7.895 -12.239 0.664 366 HB2 ASP 67 1HB ASP 67 7.738 -14.269 2.230 367 HB3 ASP 67 2HB ASP 67 6.297 -13.546 2.903 368 H TYR 68 H TYR 68 7.674 -9.712 2.181 369 HA TYR 68 HA TYR 68 4.802 -9.075 2.294 370 HB2 TYR 68 1HB TYR 68 7.341 -7.496 2.716 371 HB3 TYR 68 2HB TYR 68 5.793 -6.737 2.569 372 HD1 TYR 68 1HD TYR 68 6.171 -10.009 4.452 373 HD2 TYR 68 2HD TYR 68 5.583 -5.727 4.640 374 HE1 TYR 68 1HE TYR 68 5.565 -10.207 6.765 375 HE2 TYR 68 2HE TYR 68 4.911 -5.937 7.008 376 HH TYR 68 HH TYR 68 4.617 -9.145 8.594 377 H SER 69 H SER 69 3.783 -7.505 0.813 378 HA SER 69 HA SER 69 4.857 -7.317 -1.842 379 HB2 SER 69 1HB SER 69 2.516 -6.039 -0.381 380 HB3 SER 69 2HB SER 69 2.750 -6.149 -2.115 381 HG SER 69 HG SER 69 1.900 -8.054 -2.110 382 H TYR 70 H TYR 70 5.530 -5.247 -2.707 383 HA TYR 70 HA TYR 70 5.629 -2.976 -0.864 384 HB2 TYR 70 1HB TYR 70 7.804 -2.247 -1.474 385 HB3 TYR 70 2HB TYR 70 7.950 -3.841 -0.811 386 HD1 TYR 70 1HD TYR 70 8.337 -5.834 -2.412 387 HD2 TYR 70 2HD TYR 70 8.568 -1.708 -3.688 388 HE1 TYR 70 1HE TYR 70 9.692 -6.506 -4.385 389 HE2 TYR 70 2HE TYR 70 9.932 -2.381 -5.622 390 HH TYR 70 HH TYR 70 10.983 -5.747 -6.196 391 H LEU 71 H LEU 71 5.473 -0.976 -1.850 392 HA LEU 71 HA LEU 71 4.617 -0.915 -4.709 393 HB2 LEU 71 1HB LEU 71 3.423 0.450 -2.259 394 HB3 LEU 71 2HB LEU 71 3.280 1.173 -3.854 395 HG LEU 71 HG LEU 71 2.358 -1.674 -3.369 396 HD11 LEU 71 1HD1 LEU 71 0.058 -0.746 -3.090 397 HD12 LEU 71 2HD1 LEU 71 0.758 0.892 -2.995 398 HD13 LEU 71 3HD1 LEU 71 1.148 -0.326 -1.769 399 HD21 LEU 71 3HD2 LEU 71 2.587 -1.086 -5.713 400 HD22 LEU 71 1HD2 LEU 71 1.668 0.400 -5.466 401 HD23 LEU 71 2HD2 LEU 71 0.874 -1.185 -5.307 402 H VAL 72 H VAL 72 5.589 0.645 -5.849 403 HA VAL 72 HA VAL 72 7.150 2.792 -4.671 404 HB VAL 72 HB VAL 72 8.627 0.775 -4.626 405 HG11 VAL 72 1HG1 VAL 72 7.592 -0.399 -6.571 406 HG12 VAL 72 2HG1 VAL 72 8.435 0.736 -7.649 407 HG13 VAL 72 3HG1 VAL 72 9.366 -0.347 -6.599 408 HG21 VAL 72 3HG2 VAL 72 9.926 2.726 -4.874 409 HG22 VAL 72 1HG2 VAL 72 10.560 1.571 -6.022 410 HG23 VAL 72 2HG2 VAL 72 9.528 2.874 -6.610 411 H ALA 73 H ALA 73 7.826 4.198 -6.734 412 HA ALA 73 HA ALA 73 5.937 3.655 -9.007 413 HB1 ALA 73 1HB ALA 73 5.745 5.922 -9.444 414 HB2 ALA 73 2HB ALA 73 5.689 5.864 -7.667 415 HB3 ALA 73 3HB ALA 73 7.167 6.362 -8.507 416 H ALA 74 H ALA 74 6.872 3.918 -11.149 417 HA ALA 74 HA ALA 74 9.658 3.094 -11.217 418 HB1 ALA 74 1HB ALA 74 9.151 3.330 -13.753 419 HB2 ALA 74 2HB ALA 74 8.399 1.998 -12.837 420 HB3 ALA 74 3HB ALA 74 7.457 3.455 -13.242 421 H ASP 75 H ASP 75 8.448 6.137 -10.739 422 HA ASP 75 HA ASP 75 10.953 7.142 -11.946 423 HB2 ASP 75 1HB ASP 75 8.758 8.452 -12.385 424 HB3 ASP 75 2HB ASP 75 8.923 9.010 -10.700 425 H ASP 76 H ASP 76 9.037 7.018 -8.984 426 HA ASP 76 HA ASP 76 11.066 8.152 -7.274 427 HB2 ASP 76 1HB ASP 76 8.437 6.719 -6.703 428 HB3 ASP 76 2HB ASP 76 9.453 7.415 -5.436 429 H GLN 77 H GLN 77 11.942 5.653 -8.688 430 HA GLN 77 HA GLN 77 11.462 3.265 -7.326 431 HB2 GLN 77 1HB GLN 77 13.961 3.924 -8.861 432 HB3 GLN 77 2HB GLN 77 13.390 2.308 -8.479 433 HG2 GLN 77 1HG GLN 77 11.964 2.245 -10.221 434 HG3 GLN 77 2HG GLN 77 11.344 3.865 -9.911 435 HE21 GLN 77 1HE2 GLN 77 12.995 5.731 -10.351 436 HE22 GLN 77 2HE2 GLN 77 13.831 5.572 -11.882 437 H ASP 78 H ASP 78 13.902 5.647 -6.632 438 HA ASP 78 HA ASP 78 14.636 4.245 -4.099 439 HB2 ASP 78 1HB ASP 78 16.947 5.178 -4.319 440 HB3 ASP 78 2HB ASP 78 16.532 3.930 -5.473 441 H GLY 79 H GLY 79 12.779 6.525 -5.095 442 HA2 GLY 79 1HA GLY 79 13.666 8.781 -3.406 443 HA3 GLY 79 2HA GLY 79 12.270 8.734 -4.490 444 H THR 80 H THR 80 10.784 6.600 -3.725 445 HA THR 80 HA THR 80 10.315 6.820 -0.796 446 HB THR 80 HB THR 80 8.178 6.939 -2.940 447 HG1 THR 80 1HG THR 80 9.343 8.949 -2.684 448 HG21 THR 80 3HG2 THR 80 7.242 5.907 -0.950 449 HG22 THR 80 1HG2 THR 80 6.686 7.579 -1.039 450 HG23 THR 80 2HG2 THR 80 7.993 7.148 0.085 451 H ILE 81 H ILE 81 9.171 4.743 0.034 452 HA ILE 81 HA ILE 81 8.257 2.898 -1.924 453 HB ILE 81 HB ILE 81 10.624 2.141 -1.872 454 HG12 ILE 81 1HG1 ILE 81 9.133 0.055 -0.237 455 HG13 ILE 81 2HG1 ILE 81 8.595 0.461 -1.843 456 HG21 ILE 81 1HG2 ILE 81 11.246 2.957 0.411 457 HG22 ILE 81 2HG2 ILE 81 10.260 1.655 1.108 458 HG23 ILE 81 3HG2 ILE 81 11.694 1.247 0.166 459 HD11 ILE 81 3HD1 ILE 81 11.424 -0.487 -1.187 460 HD12 ILE 81 1HD1 ILE 81 10.126 -1.500 -1.804 461 HD13 ILE 81 2HD1 ILE 81 10.759 -0.180 -2.807 462 H ILE 82 H ILE 82 6.797 1.341 -0.873 463 HA ILE 82 HA ILE 82 6.584 1.518 2.048 464 HB ILE 82 HB ILE 82 4.248 1.800 0.104 465 HG12 ILE 82 1HG1 ILE 82 5.052 3.792 2.276 466 HG13 ILE 82 2HG1 ILE 82 5.603 3.933 0.612 467 HG21 ILE 82 1HG2 ILE 82 2.845 2.007 2.229 468 HG22 ILE 82 2HG2 ILE 82 3.492 0.413 1.888 469 HG23 ILE 82 3HG2 ILE 82 4.255 1.419 3.137 470 HD11 ILE 82 3HD1 ILE 82 3.755 5.369 0.821 471 HD12 ILE 82 1HD1 ILE 82 3.317 3.998 -0.216 472 HD13 ILE 82 2HD1 ILE 82 2.717 4.084 1.460 473 H PHE 83 H PHE 83 5.782 -0.451 2.978 474 HA PHE 83 HA PHE 83 5.601 -2.806 1.197 475 HB2 PHE 83 1HB PHE 83 6.876 -2.625 3.952 476 HB3 PHE 83 2HB PHE 83 6.623 -4.094 3.069 477 HD1 PHE 83 2HD PHE 83 8.439 -0.818 2.914 478 HD2 PHE 83 1HD PHE 83 8.304 -4.915 1.589 479 HE1 PHE 83 2HE PHE 83 10.696 -0.576 1.912 480 HE2 PHE 83 1HE PHE 83 10.579 -4.658 0.620 481 HZ PHE 83 HZ PHE 83 11.754 -2.501 0.769 482 H PHE 84 H PHE 84 4.210 -4.544 2.110 483 HA PHE 84 HA PHE 84 2.866 -4.136 4.602 484 HB2 PHE 84 1HB PHE 84 0.532 -4.172 3.629 485 HB3 PHE 84 2HB PHE 84 1.396 -2.666 3.422 486 HD1 PHE 84 1HD PHE 84 2.374 -2.078 1.029 487 HD2 PHE 84 2HD PHE 84 -0.013 -5.583 1.788 488 HE1 PHE 84 1HE PHE 84 2.057 -2.385 -1.354 489 HE2 PHE 84 2HE PHE 84 -0.363 -5.860 -0.651 490 HZ PHE 84 HZ PHE 84 0.647 -4.225 -2.231 491 H LYS 85 H LYS 85 1.434 -6.013 5.109 492 HA LYS 85 HA LYS 85 1.309 -8.193 3.203 493 HB2 LYS 85 1HB LYS 85 3.527 -8.339 4.535 494 HB3 LYS 85 2HB LYS 85 2.571 -8.788 5.915 495 HG2 LYS 85 1HG LYS 85 1.888 -10.330 3.468 496 HG3 LYS 85 2HG LYS 85 3.591 -10.434 3.845 497 HD2 LYS 85 1HD LYS 85 1.839 -10.874 6.215 498 HD3 LYS 85 2HD LYS 85 1.576 -11.986 4.874 499 HE2 LYS 85 1HE LYS 85 3.977 -12.506 4.796 500 HE3 LYS 85 2HE LYS 85 4.223 -11.527 6.255 501 HZ1 LYS 85 3HZ LYS 85 2.405 -13.846 6.093 502 HZ2 LYS 85 1HZ LYS 85 2.849 -13.046 7.476 503 HZ3 LYS 85 2HZ LYS 85 3.945 -13.943 6.622 504 H ALA 86 H ALA 86 -0.749 -9.085 3.506 505 HA ALA 86 HA ALA 86 -2.251 -8.430 5.951 506 HB1 ALA 86 1HB ALA 86 -4.108 -9.562 4.793 507 HB2 ALA 86 2HB ALA 86 -3.361 -8.358 3.732 508 HB3 ALA 86 3HB ALA 86 -3.015 -10.076 3.493 509 H GLU 87 H GLU 87 -2.913 -9.919 7.416 510 HA GLU 87 HA GLU 87 -1.844 -12.709 7.305 511 HB2 GLU 87 1HB GLU 87 -2.366 -10.703 9.510 512 HB3 GLU 87 2HB GLU 87 -2.267 -12.408 9.891 513 HG2 GLU 87 1HG GLU 87 -0.013 -11.378 8.196 514 HG3 GLU 87 2HG GLU 87 -0.136 -10.656 9.785 515 H GLY 88 H GLY 88 -4.665 -11.004 6.771 516 HA2 GLY 88 1HA GLY 88 -6.469 -12.683 6.141 517 HA3 GLY 88 2HA GLY 88 -6.451 -13.125 7.854 518 H GLN 89 H GLN 89 -6.056 -10.552 8.938 519 HA GLN 89 HA GLN 89 -8.249 -8.848 7.938 520 HB2 GLN 89 1HB GLN 89 -7.947 -9.742 10.816 521 HB3 GLN 89 2HB GLN 89 -8.509 -8.127 10.434 522 HG2 GLN 89 1HG GLN 89 -10.512 -9.119 10.613 523 HG3 GLN 89 2HG GLN 89 -10.269 -9.338 8.885 524 HE21 GLN 89 1HE2 GLN 89 -9.587 -11.480 8.162 525 HE22 GLN 89 2HE2 GLN 89 -9.694 -12.911 9.161 526 H THR 90 H THR 90 -5.738 -9.063 10.377 527 HA THR 90 HA THR 90 -5.079 -6.340 10.068 528 HB THR 90 HB THR 90 -3.507 -8.483 11.576 529 HG1 THR 90 1HG THR 90 -4.828 -7.519 13.345 530 HG21 THR 90 3HG2 THR 90 -2.768 -6.608 13.047 531 HG22 THR 90 1HG2 THR 90 -3.524 -5.451 11.925 532 HG23 THR 90 2HG2 THR 90 -2.152 -6.460 11.402 533 H VAL 91 H VAL 91 -3.417 -5.263 9.265 534 HA VAL 91 HA VAL 91 -1.662 -6.639 7.309 535 HB VAL 91 HB VAL 91 -3.370 -4.163 7.017 536 HG11 VAL 91 1HG1 VAL 91 -1.382 -5.320 5.001 537 HG12 VAL 91 2HG1 VAL 91 -2.480 -3.958 4.715 538 HG13 VAL 91 3HG1 VAL 91 -1.174 -3.791 5.892 539 HG21 VAL 91 3HG2 VAL 91 -4.562 -5.303 5.315 540 HG22 VAL 91 1HG2 VAL 91 -3.393 -6.643 5.287 541 HG23 VAL 91 2HG2 VAL 91 -4.504 -6.432 6.646 542 H ILE 92 H ILE 92 0.350 -6.284 7.960 543 HA ILE 92 HA ILE 92 1.075 -4.093 9.741 544 HB ILE 92 HB ILE 92 2.505 -6.445 8.501 545 HG12 ILE 92 1HG1 ILE 92 2.597 -7.018 11.071 546 HG13 ILE 92 2HG1 ILE 92 1.342 -5.837 11.278 547 HG21 ILE 92 1HG2 ILE 92 4.416 -6.049 9.905 548 HG22 ILE 92 2HG2 ILE 92 4.110 -4.585 8.974 549 HG23 ILE 92 3HG2 ILE 92 3.638 -4.661 10.686 550 HD11 ILE 92 3HD1 ILE 92 0.636 -8.268 11.159 551 HD12 ILE 92 1HD1 ILE 92 -0.215 -7.217 10.031 552 HD13 ILE 92 2HD1 ILE 92 1.109 -8.262 9.443 553 H ILE 93 H ILE 93 0.955 -2.278 8.635 554 HA ILE 93 HA ILE 93 2.012 -1.896 5.916 555 HB ILE 93 HB ILE 93 1.369 0.366 7.845 556 HG12 ILE 93 1HG1 ILE 93 -0.660 -1.157 6.164 557 HG13 ILE 93 2HG1 ILE 93 -0.738 -0.849 7.908 558 HG21 ILE 93 1HG2 ILE 93 1.016 0.284 4.848 559 HG22 ILE 93 2HG2 ILE 93 1.282 1.676 5.879 560 HG23 ILE 93 3HG2 ILE 93 2.616 0.568 5.527 561 HD11 ILE 93 3HD1 ILE 93 -1.047 1.546 7.530 562 HD12 ILE 93 1HD1 ILE 93 -1.027 1.278 5.763 563 HD13 ILE 93 2HD1 ILE 93 -2.303 0.578 6.731 564 H LYS 94 H LYS 94 4.184 -1.553 5.587 565 HA LYS 94 HA LYS 94 5.809 -0.509 7.848 566 HB2 LYS 94 1HB LYS 94 6.199 -2.926 6.125 567 HB3 LYS 94 2HB LYS 94 7.615 -2.032 6.530 568 HG2 LYS 94 1HG LYS 94 7.130 -2.204 8.930 569 HG3 LYS 94 2HG LYS 94 5.642 -3.102 8.573 570 HD2 LYS 94 1HD LYS 94 7.036 -4.893 7.502 571 HD3 LYS 94 2HD LYS 94 8.492 -3.939 7.872 572 HE2 LYS 94 1HE LYS 94 7.651 -3.977 10.322 573 HE3 LYS 94 2HE LYS 94 6.567 -5.284 9.808 574 HZ1 LYS 94 3HZ LYS 94 8.625 -6.143 10.677 575 HZ2 LYS 94 1HZ LYS 94 9.518 -5.337 9.531 576 HZ3 LYS 94 2HZ LYS 94 8.497 -6.540 9.113 577 H TYR 95 H TYR 95 6.349 1.578 7.193 578 HA TYR 95 HA TYR 95 6.996 2.025 4.309 579 HB2 TYR 95 1HB TYR 95 5.840 4.219 4.587 580 HB3 TYR 95 2HB TYR 95 4.771 2.824 4.660 581 HD1 TYR 95 1HD TYR 95 3.813 2.017 6.732 582 HD2 TYR 95 2HD TYR 95 6.126 5.640 6.611 583 HE1 TYR 95 1HE TYR 95 2.913 2.630 8.928 584 HE2 TYR 95 2HE TYR 95 5.231 6.301 8.819 585 HH TYR 95 HH TYR 95 3.340 5.838 10.409 586 H THR 96 H THR 96 8.125 4.221 4.030 587 HA THR 96 HA THR 96 9.769 5.068 6.251 588 HB THR 96 HB THR 96 10.880 3.014 5.533 589 HG1 THR 96 1HG THR 96 12.862 4.113 4.770 590 HG21 THR 96 3HG2 THR 96 10.134 2.877 3.163 591 HG22 THR 96 1HG2 THR 96 11.884 2.742 3.312 592 HG23 THR 96 2HG2 THR 96 11.162 4.267 2.760 593 H SER 97 H SER 97 11.271 6.866 5.389 594 HA SER 97 HA SER 97 10.189 8.190 2.971 595 HB2 SER 97 1HB SER 97 11.475 10.179 3.828 596 HB3 SER 97 2HB SER 97 10.102 9.702 4.828 597 HG SER 97 HG SER 97 12.795 9.681 5.406 598 H GLN 98 H GLN 98 12.632 6.207 4.074 599 HA GLN 98 HA GLN 98 14.349 6.861 1.738 600 HB2 GLN 98 1HB GLN 98 15.120 7.086 4.602 601 HB3 GLN 98 2HB GLN 98 16.250 6.189 3.587 602 HG2 GLN 98 1HG GLN 98 15.180 8.928 2.834 603 HG3 GLN 98 2HG GLN 98 16.671 8.636 3.739 604 HE21 GLN 98 1HE2 GLN 98 15.611 9.268 0.573 605 HE22 GLN 98 2HE2 GLN 98 16.866 8.383 -0.252 606 H ARG 99 H ARG 99 14.805 5.250 0.587 607 HA ARG 99 HA ARG 99 13.740 2.714 0.828 608 HB2 ARG 99 1HB ARG 99 14.375 3.736 -1.253 609 HB3 ARG 99 2HB ARG 99 16.095 3.618 -0.871 610 HG2 ARG 99 1HG ARG 99 16.081 1.226 -1.034 611 HG3 ARG 99 2HG ARG 99 14.300 1.152 -0.941 612 HD2 ARG 99 1HD ARG 99 14.088 2.263 -3.062 613 HD3 ARG 99 2HD ARG 99 15.848 2.440 -3.220 614 HE ARG 99 HE ARG 99 14.194 0.022 -3.567 615 HH11 ARG 99 1HH1 ARG 99 17.591 1.355 -3.731 616 HH12 ARG 99 2HH1 ARG 99 18.078 -0.098 -4.550 617 HH21 ARG 99 1HH2 ARG 99 15.127 -1.858 -4.440 618 HH22 ARG 99 2HH2 ARG 99 16.816 -1.854 -4.875 619 H ASN 100 H ASN 100 16.826 3.797 1.965 620 HA ASN 100 HA ASN 100 17.439 1.075 3.034 621 HB2 ASN 100 1HB ASN 100 19.828 1.628 2.861 622 HB3 ASN 100 2HB ASN 100 18.981 1.425 1.343 623 HD21 ASN 100 1HD2 ASN 100 19.406 4.074 3.574 624 HD22 ASN 100 2HD2 ASN 100 19.868 5.322 2.386 625 H THR 101 H THR 101 15.687 2.436 4.450 626 HA THR 101 HA THR 101 17.250 2.610 6.921 627 HB THR 101 HB THR 101 15.792 4.392 7.833 628 HG1 THR 101 1HG THR 101 14.891 4.521 5.155 629 HG21 THR 101 3HG2 THR 101 16.649 6.353 6.530 630 HG22 THR 101 1HG2 THR 101 17.362 5.239 5.357 631 HG23 THR 101 2HG2 THR 101 17.903 5.217 7.038 632 H LYS 102 H LYS 102 15.989 1.749 8.740 633 HA LYS 102 HA LYS 102 14.224 -0.310 8.072 634 HB2 LYS 102 1HB LYS 102 15.624 -0.081 10.145 635 HB3 LYS 102 2HB LYS 102 14.442 1.052 10.795 636 HG2 LYS 102 1HG LYS 102 13.175 -1.449 9.835 637 HG3 LYS 102 2HG LYS 102 14.462 -1.784 10.979 638 HD2 LYS 102 1HD LYS 102 13.433 -0.555 12.724 639 HD3 LYS 102 2HD LYS 102 12.332 0.259 11.602 640 HE2 LYS 102 1HE LYS 102 11.172 -1.465 12.911 641 HE3 LYS 102 2HE LYS 102 11.085 -1.748 11.169 642 HZ1 LYS 102 3HZ LYS 102 11.586 -3.767 12.453 643 HZ2 LYS 102 1HZ LYS 102 12.992 -3.136 12.991 644 HZ3 LYS 102 2HZ LYS 102 12.798 -3.443 11.404 645 H LEU 103 H LEU 103 11.977 -0.651 8.428 646 HA LEU 103 HA LEU 103 10.344 1.636 7.618 647 HB2 LEU 103 1HB LEU 103 9.643 -1.295 8.136 648 HB3 LEU 103 2HB LEU 103 8.587 -0.151 7.364 649 HG LEU 103 HG LEU 103 9.317 -1.295 5.545 650 HD11 LEU 103 1HD1 LEU 103 10.890 -0.032 4.216 651 HD12 LEU 103 2HD1 LEU 103 11.477 0.818 5.643 652 HD13 LEU 103 3HD1 LEU 103 9.790 1.048 5.091 653 HD21 LEU 103 3HD2 LEU 103 12.203 -1.468 6.427 654 HD22 LEU 103 1HD2 LEU 103 11.337 -2.350 5.157 655 HD23 LEU 103 2HD2 LEU 103 10.960 -2.682 6.846 656 H LYS 104 H LYS 104 8.388 2.272 8.625 657 HA LYS 104 HA LYS 104 8.298 2.314 11.511 658 HB2 LYS 104 1HB LYS 104 6.628 3.289 9.161 659 HB3 LYS 104 2HB LYS 104 5.863 3.206 10.716 660 HG2 LYS 104 1HG LYS 104 6.630 5.434 10.475 661 HG3 LYS 104 2HG LYS 104 7.623 4.655 11.698 662 HD2 LYS 104 1HD LYS 104 9.409 4.301 10.145 663 HD3 LYS 104 2HD LYS 104 8.474 4.946 8.820 664 HE2 LYS 104 1HE LYS 104 8.409 7.168 9.917 665 HE3 LYS 104 2HE LYS 104 9.125 6.478 11.379 666 HZ1 LYS 104 3HZ LYS 104 10.452 6.955 8.801 667 HZ2 LYS 104 1HZ LYS 104 11.106 5.957 9.975 668 HZ3 LYS 104 2HZ LYS 104 10.837 7.544 10.262 669 H ALA 105 H ALA 105 6.192 1.806 12.577 670 HA ALA 105 HA ALA 105 4.879 -0.672 11.590 671 HB1 ALA 105 1HB ALA 105 5.459 0.218 14.446 672 HB2 ALA 105 2HB ALA 105 4.328 -1.077 14.024 673 HB3 ALA 105 3HB ALA 105 6.055 -1.243 13.624 674 H LYS 106 H LYS 106 2.913 -0.082 10.800 675 HA LYS 106 HA LYS 106 1.136 1.141 12.725 676 HB2 LYS 106 1HB LYS 106 1.802 2.797 10.689 677 HB3 LYS 106 2HB LYS 106 0.477 1.928 9.905 678 HG2 LYS 106 1HG LYS 106 -0.265 2.848 12.589 679 HG3 LYS 106 2HG LYS 106 0.439 4.181 11.694 680 HD2 LYS 106 1HD LYS 106 -1.706 2.428 10.528 681 HD3 LYS 106 2HD LYS 106 -2.139 3.768 11.578 682 HE2 LYS 106 1HE LYS 106 -0.413 4.226 9.109 683 HE3 LYS 106 2HE LYS 106 -2.180 4.123 9.001 684 HZ1 LYS 106 3HZ LYS 106 -0.759 6.109 10.671 685 HZ2 LYS 106 1HZ LYS 106 -2.370 5.939 10.519 686 HZ3 LYS 106 2HZ LYS 106 -1.504 6.412 9.237 687 H ALA 107 H ALA 107 -0.342 -0.514 13.062 688 HA ALA 107 HA ALA 107 -0.570 -2.682 10.978 689 HB1 ALA 107 1HB ALA 107 -0.176 -3.023 13.971 690 HB2 ALA 107 2HB ALA 107 -0.673 -4.300 12.831 691 HB3 ALA 107 3HB ALA 107 0.922 -3.536 12.659 692 H LEU 108 H LEU 108 -2.715 -2.911 10.454 693 HA LEU 108 HA LEU 108 -4.820 -1.795 12.250 694 HB2 LEU 108 1HB LEU 108 -4.275 -1.227 9.321 695 HB3 LEU 108 2HB LEU 108 -5.752 -0.742 10.158 696 HG LEU 108 HG LEU 108 -3.023 0.268 11.034 697 HD11 LEU 108 1HD1 LEU 108 -3.650 2.326 9.673 698 HD12 LEU 108 2HD1 LEU 108 -4.878 1.377 8.910 699 HD13 LEU 108 3HD1 LEU 108 -3.160 0.878 8.756 700 HD21 LEU 108 3HD2 LEU 108 -4.885 0.556 12.642 701 HD22 LEU 108 1HD2 LEU 108 -5.821 1.424 11.404 702 HD23 LEU 108 2HD2 LEU 108 -4.282 2.099 12.016 703 H THR 109 H THR 109 -6.912 -2.837 11.909 704 HA THR 109 HA THR 109 -6.796 -5.428 10.572 705 HB THR 109 HB THR 109 -9.205 -5.507 11.360 706 HG1 THR 109 1HG THR 109 -9.733 -4.036 12.989 707 HG21 THR 109 3HG2 THR 109 -7.455 -6.607 12.613 708 HG22 THR 109 1HG2 THR 109 -8.542 -5.834 13.747 709 HG23 THR 109 2HG2 THR 109 -6.986 -5.088 13.405 710 H LEU 110 H LEU 110 -7.937 -6.022 8.706 711 HA LEU 110 HA LEU 110 -8.435 -4.369 6.616 712 HB2 LEU 110 1HB LEU 110 -9.908 -6.858 7.604 713 HB3 LEU 110 2HB LEU 110 -10.400 -6.038 6.154 714 HG LEU 110 HG LEU 110 -7.780 -7.471 6.554 715 HD11 LEU 110 1HD1 LEU 110 -8.668 -8.935 4.855 716 HD12 LEU 110 2HD1 LEU 110 -10.103 -7.896 4.675 717 HD13 LEU 110 3HD1 LEU 110 -9.831 -8.822 6.169 718 HD21 LEU 110 3HD2 LEU 110 -7.339 -7.021 4.228 719 HD22 LEU 110 1HD2 LEU 110 -7.172 -5.624 5.280 720 HD23 LEU 110 2HD2 LEU 110 -8.619 -5.760 4.234 721 H SER 111 H SER 111 -10.628 -5.094 9.231 722 HA SER 111 HA SER 111 -13.003 -4.008 8.241 723 HB2 SER 111 1HB SER 111 -12.221 -5.435 10.423 724 HB3 SER 111 2HB SER 111 -12.399 -3.855 11.195 725 HG SER 111 HG SER 111 -14.358 -4.907 11.234 726 H GLN 112 H GLN 112 -10.253 -2.442 9.872 727 HA GLN 112 HA GLN 112 -11.412 0.085 10.375 728 HB2 GLN 112 1HB GLN 112 -9.130 -1.311 11.103 729 HB3 GLN 112 2HB GLN 112 -8.467 -0.173 9.939 730 HG2 GLN 112 1HG GLN 112 -10.214 0.499 12.303 731 HG3 GLN 112 2HG GLN 112 -8.456 0.594 12.308 732 HE21 GLN 112 1HE2 GLN 112 -11.366 2.380 11.438 733 HE22 GLN 112 2HE2 GLN 112 -10.499 3.694 10.647 734 H LEU 113 H LEU 113 -8.960 -0.891 7.916 735 HA LEU 113 HA LEU 113 -8.989 1.485 6.439 736 HB2 LEU 113 1HB LEU 113 -8.394 -1.391 5.616 737 HB3 LEU 113 2HB LEU 113 -8.226 -0.029 4.522 738 HG LEU 113 HG LEU 113 -6.109 -0.771 5.480 739 HD11 LEU 113 1HD1 LEU 113 -6.349 1.533 4.668 740 HD12 LEU 113 2HD1 LEU 113 -5.189 1.423 5.995 741 HD13 LEU 113 3HD1 LEU 113 -6.813 2.073 6.297 742 HD21 LEU 113 3HD2 LEU 113 -6.983 -1.304 7.788 743 HD22 LEU 113 1HD2 LEU 113 -7.006 0.445 8.118 744 HD23 LEU 113 2HD2 LEU 113 -5.480 -0.394 7.705 745 H LYS 114 H LYS 114 -11.030 -1.391 6.039 746 HA LYS 114 HA LYS 114 -12.325 -0.625 3.628 747 HB2 LYS 114 1HB LYS 114 -12.440 -2.872 4.571 748 HB3 LYS 114 2HB LYS 114 -13.217 -2.262 6.043 749 HG2 LYS 114 1HG LYS 114 -15.167 -1.542 4.689 750 HG3 LYS 114 2HG LYS 114 -14.429 -2.235 3.236 751 HD2 LYS 114 1HD LYS 114 -14.380 -4.428 4.675 752 HD3 LYS 114 2HD LYS 114 -15.356 -3.507 5.864 753 HE2 LYS 114 1HE LYS 114 -16.119 -3.873 2.942 754 HE3 LYS 114 2HE LYS 114 -16.650 -4.970 4.223 755 HZ1 LYS 114 3HZ LYS 114 -17.204 -2.055 4.195 756 HZ2 LYS 114 1HZ LYS 114 -17.794 -3.160 5.282 757 HZ3 LYS 114 2HZ LYS 114 -18.251 -3.198 3.696 758 H LYS 115 H LYS 115 -12.951 0.491 7.041 759 HA LYS 115 HA LYS 115 -15.414 1.776 6.274 760 HB2 LYS 115 1HB LYS 115 -14.301 0.933 8.641 761 HB3 LYS 115 2HB LYS 115 -13.821 2.621 8.635 762 HG2 LYS 115 1HG LYS 115 -15.851 2.203 9.823 763 HG3 LYS 115 2HG LYS 115 -16.099 3.355 8.527 764 HD2 LYS 115 1HD LYS 115 -18.020 1.901 8.674 765 HD3 LYS 115 2HD LYS 115 -17.219 1.509 7.180 766 HE2 LYS 115 1HE LYS 115 -16.859 -0.677 7.833 767 HE3 LYS 115 2HE LYS 115 -16.088 -0.105 9.316 768 HZ1 LYS 115 3HZ LYS 115 -17.959 -1.308 10.007 769 HZ2 LYS 115 1HZ LYS 115 -18.978 -0.581 8.945 770 HZ3 LYS 115 2HZ LYS 115 -18.389 0.262 10.207 771 H GLU 116 H GLU 116 -12.143 2.834 7.094 772 HA GLU 116 HA GLU 116 -12.234 5.494 6.651 773 HB2 GLU 116 1HB GLU 116 -9.973 3.696 5.757 774 HB3 GLU 116 2HB GLU 116 -9.802 5.370 6.194 775 HG2 GLU 116 1HG GLU 116 -10.859 3.409 8.231 776 HG3 GLU 116 2HG GLU 116 -9.175 3.353 7.794 777 H PHE 117 H PHE 117 -11.271 3.129 4.169 778 HA PHE 117 HA PHE 117 -11.572 5.173 2.073 779 HB2 PHE 117 1HB PHE 117 -9.785 2.751 2.126 780 HB3 PHE 117 2HB PHE 117 -9.755 4.069 0.982 781 HD1 PHE 117 1HD PHE 117 -9.654 6.530 2.349 782 HD2 PHE 117 2HD PHE 117 -7.930 2.744 3.556 783 HE1 PHE 117 1HE PHE 117 -7.954 7.716 3.671 784 HE2 PHE 117 2HE PHE 117 -6.229 3.970 4.867 785 HZ PHE 117 HZ PHE 117 -6.243 6.456 4.941 786 H TYR 118 H TYR 118 -13.553 2.762 3.043 787 HA TYR 118 HA TYR 118 -14.271 2.240 0.230 788 HB2 TYR 118 1HB TYR 118 -12.550 0.494 1.141 789 HB3 TYR 118 2HB TYR 118 -13.950 -0.197 1.943 790 HD1 TYR 118 1HD TYR 118 -12.793 1.052 -1.451 791 HD2 TYR 118 2HD TYR 118 -15.414 -1.575 0.756 792 HE1 TYR 118 1HE TYR 118 -13.187 -0.262 -3.547 793 HE2 TYR 118 2HE TYR 118 -16.028 -2.722 -1.333 794 HH TYR 118 HH TYR 118 -14.529 -2.151 -4.468 795 H GLN 119 H GLN 119 -15.594 3.739 2.377 796 HA GLN 119 HA GLN 119 -17.847 2.147 3.196 797 HB2 GLN 119 1HB GLN 119 -18.718 4.015 4.198 798 HB3 GLN 119 2HB GLN 119 -16.989 4.039 4.430 799 HG2 GLN 119 1HG GLN 119 -18.394 5.881 2.524 800 HG3 GLN 119 2HG GLN 119 -18.108 6.222 4.190 801 HE21 GLN 119 1HE2 GLN 119 -15.247 4.853 3.922 802 HE22 GLN 119 2HE2 GLN 119 -14.336 6.175 3.347 803 H THR 120 H THR 120 -17.602 4.750 0.781 804 HA THR 120 HA THR 120 -20.328 4.187 -0.109 805 HB THR 120 HB THR 120 -19.712 6.364 0.748 806 HG1 THR 120 1HG THR 120 -20.687 7.479 -0.640 807 HG21 THR 120 3HG2 THR 120 -18.132 7.831 -0.549 808 HG22 THR 120 1HG2 THR 120 -17.614 6.418 -1.467 809 HG23 THR 120 2HG2 THR 120 -17.363 6.491 0.290 810 H ARG 121 H ARG 121 -20.764 4.542 -2.519 811 HA ARG 121 HA ARG 121 -19.334 2.357 -3.788 812 HB2 ARG 121 1HB ARG 121 -21.836 3.945 -4.263 813 HB3 ARG 121 2HB ARG 121 -21.196 2.943 -5.564 814 HG2 ARG 121 1HG ARG 121 -21.300 0.943 -4.245 815 HG3 ARG 121 2HG ARG 121 -21.463 1.861 -2.740 816 HD2 ARG 121 1HD ARG 121 -23.684 2.681 -3.545 817 HD3 ARG 121 2HD ARG 121 -23.562 1.570 -4.906 818 HE ARG 121 HE ARG 121 -23.759 0.962 -1.995 819 HH11 ARG 121 1HH1 ARG 121 -23.950 -0.271 -5.356 820 HH12 ARG 121 2HH1 ARG 121 -24.143 -1.913 -4.898 821 HH21 ARG 121 1HH2 ARG 121 -24.307 -1.193 -1.395 822 HH22 ARG 121 2HH2 ARG 121 -24.639 -2.370 -2.626 823 H SER 122 H SER 122 -19.718 5.837 -4.551 824 HA SER 122 HA SER 122 -18.322 5.832 -6.993 825 HB2 SER 122 1HB SER 122 -19.657 7.640 -5.832 826 HB3 SER 122 2HB SER 122 -18.233 7.963 -4.840 827 HG SER 122 HG SER 122 -17.106 8.609 -6.639 828 H GLN 123 H GLN 123 -17.054 5.841 -3.635 829 HA GLN 123 HA GLN 123 -14.305 6.109 -4.315 830 HB2 GLN 123 1HB GLN 123 -15.165 6.479 -2.061 831 HB3 GLN 123 2HB GLN 123 -15.747 4.837 -1.945 832 HG2 GLN 123 1HG GLN 123 -13.529 3.930 -1.761 833 HG3 GLN 123 2HG GLN 123 -12.796 5.503 -2.240 834 HE21 GLN 123 1HE2 GLN 123 -15.472 4.667 -0.014 835 HE22 GLN 123 2HE2 GLN 123 -14.788 5.523 1.387 836 H LYS 124 H LYS 124 -16.455 3.334 -4.640 837 HA LYS 124 HA LYS 124 -14.315 1.371 -4.615 838 HB2 LYS 124 1HB LYS 124 -17.084 1.077 -5.837 839 HB3 LYS 124 2HB LYS 124 -15.954 -0.202 -5.428 840 HG2 LYS 124 1HG LYS 124 -16.146 0.486 -2.990 841 HG3 LYS 124 2HG LYS 124 -17.411 1.601 -3.463 842 HD2 LYS 124 1HD LYS 124 -18.791 -0.202 -4.353 843 HD3 LYS 124 2HD LYS 124 -17.485 -1.364 -4.098 844 HE2 LYS 124 1HE LYS 124 -17.624 -0.760 -1.599 845 HE3 LYS 124 2HE LYS 124 -19.136 0.075 -1.993 846 HZ1 LYS 124 3HZ LYS 124 -19.838 -2.098 -3.013 847 HZ2 LYS 124 1HZ LYS 124 -19.697 -2.126 -1.359 848 HZ3 LYS 124 2HZ LYS 124 -18.546 -2.811 -2.304 849 H ARG 125 H ARG 125 -15.248 3.758 -6.905 850 HA ARG 125 HA ARG 125 -14.043 2.316 -9.192 851 HB2 ARG 125 1HB ARG 125 -15.314 4.992 -8.792 852 HB3 ARG 125 2HB ARG 125 -13.917 4.942 -9.865 853 HG2 ARG 125 1HG ARG 125 -16.161 4.684 -10.963 854 HG3 ARG 125 2HG ARG 125 -14.973 3.428 -11.358 855 HD2 ARG 125 1HD ARG 125 -16.030 1.822 -9.976 856 HD3 ARG 125 2HD ARG 125 -16.962 3.056 -9.101 857 HE ARG 125 HE ARG 125 -17.785 3.180 -11.774 858 HH11 ARG 125 1HH1 ARG 125 -17.643 0.611 -9.348 859 HH12 ARG 125 2HH1 ARG 125 -19.301 0.122 -9.530 860 HH21 ARG 125 1HH2 ARG 125 -19.962 2.409 -12.166 861 HH22 ARG 125 2HH2 ARG 125 -20.635 1.163 -11.167 862 H GLU 126 H GLU 126 -13.065 5.338 -7.365 863 HA GLU 126 HA GLU 126 -10.595 5.372 -8.398 864 HB2 GLU 126 1HB GLU 126 -11.514 6.144 -5.594 865 HB3 GLU 126 2HB GLU 126 -9.852 6.305 -6.076 866 HG2 GLU 126 1HG GLU 126 -10.487 8.345 -6.588 867 HG3 GLU 126 2HG GLU 126 -10.699 7.591 -8.161 868 H VAL 127 H VAL 127 -11.275 3.817 -5.295 869 HA VAL 127 HA VAL 127 -8.722 2.898 -4.712 870 HB VAL 127 HB VAL 127 -11.436 1.634 -4.115 871 HG11 VAL 127 1HG1 VAL 127 -8.836 1.121 -2.618 872 HG12 VAL 127 2HG1 VAL 127 -10.461 0.496 -2.218 873 HG13 VAL 127 3HG1 VAL 127 -9.640 -0.045 -3.672 874 HG21 VAL 127 3HG2 VAL 127 -9.628 3.462 -2.443 875 HG22 VAL 127 1HG2 VAL 127 -11.096 3.995 -3.268 876 HG23 VAL 127 2HG2 VAL 127 -11.207 2.825 -1.957 877 H ASP 128 H ASP 128 -11.276 1.058 -6.519 878 HA ASP 128 HA ASP 128 -9.513 -1.158 -7.152 879 HB2 ASP 128 1HB ASP 128 -12.113 -0.913 -7.221 880 HB3 ASP 128 2HB ASP 128 -11.883 -0.324 -8.835 881 H ASP 129 H ASP 129 -10.296 1.858 -8.774 882 HA ASP 129 HA ASP 129 -9.234 1.272 -11.350 883 HB2 ASP 129 1HB ASP 129 -9.715 3.917 -9.892 884 HB3 ASP 129 2HB ASP 129 -9.073 3.792 -11.514 885 H TYR 130 H TYR 130 -7.830 2.460 -8.323 886 HA TYR 130 HA TYR 130 -5.164 2.892 -9.289 887 HB2 TYR 130 1HB TYR 130 -6.235 2.180 -6.546 888 HB3 TYR 130 2HB TYR 130 -4.616 2.738 -6.831 889 HD1 TYR 130 1HD TYR 130 -5.698 4.916 -9.044 890 HD2 TYR 130 2HD TYR 130 -6.714 3.958 -4.954 891 HE1 TYR 130 1HE TYR 130 -6.527 7.165 -8.747 892 HE2 TYR 130 2HE TYR 130 -7.668 6.197 -4.680 893 HH TYR 130 HH TYR 130 -7.390 8.693 -7.315 894 H VAL 131 H VAL 131 -6.810 -0.048 -7.966 895 HA VAL 131 HA VAL 131 -4.393 -1.627 -8.168 896 HB VAL 131 HB VAL 131 -7.267 -2.636 -8.223 897 HG11 VAL 131 1HG1 VAL 131 -4.599 -3.987 -7.591 898 HG12 VAL 131 2HG1 VAL 131 -6.188 -4.728 -7.316 899 HG13 VAL 131 3HG1 VAL 131 -5.669 -4.348 -8.960 900 HG21 VAL 131 3HG2 VAL 131 -6.806 -1.310 -6.150 901 HG22 VAL 131 1HG2 VAL 131 -7.028 -3.016 -5.826 902 HG23 VAL 131 2HG2 VAL 131 -5.389 -2.341 -5.838 903 H ALA 132 H ALA 132 -7.036 -0.750 -10.418 904 HA ALA 132 HA ALA 132 -5.920 -2.323 -12.618 905 HB1 ALA 132 1HB ALA 132 -7.722 -1.349 -13.926 906 HB2 ALA 132 2HB ALA 132 -8.380 -1.893 -12.384 907 HB3 ALA 132 3HB ALA 132 -8.074 -0.163 -12.638 908 H GLY 133 H GLY 133 -4.528 0.137 -11.154 909 HA2 GLY 133 1HA GLY 133 -3.687 1.633 -13.600 910 HA3 GLY 133 2HA GLY 133 -4.070 2.396 -12.051 911 H LEU 134 H LEU 134 -2.669 -0.414 -11.114 912 HA LEU 134 HA LEU 134 0.067 0.667 -11.060 913 HB2 LEU 134 1HB LEU 134 0.576 -1.041 -9.431 914 HB3 LEU 134 2HB LEU 134 -0.845 -0.129 -8.971 915 HG LEU 134 HG LEU 134 -2.253 -2.030 -9.822 916 HD11 LEU 134 1HD1 LEU 134 0.409 -3.506 -9.770 917 HD12 LEU 134 2HD1 LEU 134 -0.731 -3.384 -11.135 918 HD13 LEU 134 3HD1 LEU 134 -1.189 -4.294 -9.716 919 HD21 LEU 134 3HD2 LEU 134 -1.938 -1.532 -7.466 920 HD22 LEU 134 1HD2 LEU 134 -0.422 -2.456 -7.441 921 HD23 LEU 134 2HD2 LEU 134 -1.974 -3.283 -7.713 922 H ARG 135 H ARG 135 1.704 -1.166 -11.281 923 HA ARG 135 HA ARG 135 1.308 -2.862 -13.683 924 HB2 ARG 135 1HB ARG 135 3.391 -0.688 -13.079 925 HB3 ARG 135 2HB ARG 135 3.701 -1.958 -14.240 926 HG2 ARG 135 1HG ARG 135 1.743 -1.251 -15.604 927 HG3 ARG 135 2HG ARG 135 1.315 -0.076 -14.366 928 HD2 ARG 135 1HD ARG 135 2.318 1.341 -15.678 929 HD3 ARG 135 2HD ARG 135 3.747 0.897 -14.815 930 HE ARG 135 HE ARG 135 2.841 0.022 -17.530 931 HH11 ARG 135 1HH1 ARG 135 5.578 -0.282 -15.348 932 HH12 ARG 135 2HH1 ARG 135 6.749 0.444 -16.383 933 HH21 ARG 135 1HH2 ARG 135 4.432 0.411 -19.160 934 HH22 ARG 135 2HH2 ARG 135 6.122 0.366 -18.758 935 H THR 136 H THR 136 3.138 -4.553 -13.655 936 HA THR 136 HA THR 136 4.052 -4.980 -10.823 937 HB THR 136 HB THR 136 4.360 -7.398 -11.946 938 HG1 THR 136 1HG THR 136 3.351 -7.006 -13.908 939 HG21 THR 136 3HG2 THR 136 2.196 -7.986 -10.908 940 HG22 THR 136 1HG2 THR 136 1.827 -6.250 -10.772 941 HG23 THR 136 2HG2 THR 136 3.239 -6.940 -9.935 942 H GLU 137 H GLU 137 5.017 -3.997 -13.682 943 HA GLU 137 HA GLU 137 7.890 -4.120 -13.224 944 HB2 GLU 137 1HB GLU 137 7.214 -6.290 -14.469 945 HB3 GLU 137 2HB GLU 137 6.577 -5.254 -15.754 946 HG2 GLU 137 1HG GLU 137 8.984 -4.207 -15.773 947 HG3 GLU 137 2HG GLU 137 9.452 -5.648 -14.858 Start of MODEL 4 1 H1 GLY 19 H GLY 19 -21.221 -10.778 6.569 2 HA2 GLY 19 1HA GLY 19 -19.960 -12.761 5.852 3 HA3 GLY 19 2HA GLY 19 -19.885 -11.450 4.656 4 H HIS 20 H HIS 20 -17.928 -13.716 5.918 5 HA HIS 20 HA HIS 20 -15.500 -12.086 6.121 6 HB2 HIS 20 1HB HIS 20 -16.029 -15.043 5.684 7 HB3 HIS 20 2HB HIS 20 -14.435 -14.321 5.422 8 HD1 HIS 20 1HD HIS 20 -16.728 -15.309 8.329 9 HD2 HIS 20 2HD HIS 20 -13.212 -13.113 7.530 10 HE1 HIS 20 1HE HIS 20 -15.634 -14.876 10.564 11 H MET 21 H MET 21 -14.235 -11.445 4.387 12 HA MET 21 HA MET 21 -15.538 -11.584 1.722 13 HB2 MET 21 1HB MET 21 -15.876 -9.511 3.573 14 HB3 MET 21 2HB MET 21 -14.538 -8.927 2.603 15 HG2 MET 21 1HG MET 21 -17.203 -9.869 1.477 16 HG3 MET 21 2HG MET 21 -16.806 -8.213 1.895 17 HE1 MET 21 3HE MET 21 -15.677 -10.340 -1.981 18 HE2 MET 21 1HE MET 21 -15.361 -11.207 -0.471 19 HE3 MET 21 2HE MET 21 -17.021 -10.712 -0.881 20 H LYS 22 H LYS 22 -13.958 -12.629 0.637 21 HA LYS 22 HA LYS 22 -11.187 -12.639 1.284 22 HB2 LYS 22 1HB LYS 22 -12.800 -13.294 -1.208 23 HB3 LYS 22 2HB LYS 22 -11.061 -13.462 -1.181 24 HG2 LYS 22 1HG LYS 22 -12.495 -14.778 1.115 25 HG3 LYS 22 2HG LYS 22 -12.818 -15.455 -0.480 26 HD2 LYS 22 1HD LYS 22 -10.393 -15.674 -0.906 27 HD3 LYS 22 2HD LYS 22 -10.060 -15.035 0.723 28 HE2 LYS 22 1HE LYS 22 -10.973 -16.931 1.796 29 HE3 LYS 22 2HE LYS 22 -11.774 -17.492 0.314 30 HZ1 LYS 22 3HZ LYS 22 -9.731 -18.069 -0.622 31 HZ2 LYS 22 1HZ LYS 22 -9.675 -18.681 0.910 32 HZ3 LYS 22 2HZ LYS 22 -8.844 -17.310 0.512 33 H PHE 23 H PHE 23 -9.709 -11.097 0.999 34 HA PHE 23 HA PHE 23 -10.151 -8.937 -1.016 35 HB2 PHE 23 1HB PHE 23 -8.985 -8.860 1.769 36 HB3 PHE 23 2HB PHE 23 -8.406 -7.774 0.527 37 HD1 PHE 23 1HD PHE 23 -12.035 -8.720 0.729 38 HD2 PHE 23 2HD PHE 23 -9.029 -5.708 1.436 39 HE1 PHE 23 1HE PHE 23 -13.759 -7.098 1.100 40 HE2 PHE 23 2HE PHE 23 -10.804 -4.073 1.911 41 HZ PHE 23 HZ PHE 23 -13.177 -4.722 1.702 42 H THR 24 H THR 24 -7.826 -8.132 -1.800 43 HA THR 24 HA THR 24 -5.870 -10.360 -1.889 44 HB THR 24 HB THR 24 -5.567 -9.116 -4.306 45 HG1 THR 24 1HG THR 24 -7.961 -9.100 -4.944 46 HG21 THR 24 3HG2 THR 24 -5.911 -11.532 -3.915 47 HG22 THR 24 1HG2 THR 24 -6.953 -10.911 -5.218 48 HG23 THR 24 2HG2 THR 24 -7.642 -11.234 -3.604 49 H ASP 25 H ASP 25 -3.676 -9.749 -1.930 50 HA ASP 25 HA ASP 25 -2.685 -7.560 -0.671 51 HB2 ASP 25 1HB ASP 25 -1.542 -8.974 -3.105 52 HB3 ASP 25 2HB ASP 25 -0.625 -7.849 -2.114 53 H GLN 26 H GLN 26 -3.471 -7.845 -4.071 54 HA GLN 26 HA GLN 26 -2.721 -5.429 -5.215 55 HB2 GLN 26 1HB GLN 26 -5.302 -6.974 -5.710 56 HB3 GLN 26 2HB GLN 26 -4.467 -5.951 -6.859 57 HG2 GLN 26 1HG GLN 26 -2.875 -7.572 -7.357 58 HG3 GLN 26 2HG GLN 26 -3.077 -8.428 -5.829 59 HE21 GLN 26 1HE2 GLN 26 -5.284 -7.385 -8.558 60 HE22 GLN 26 2HE2 GLN 26 -6.026 -8.961 -8.695 61 H GLN 27 H GLN 27 -5.937 -6.233 -3.923 62 HA GLN 27 HA GLN 27 -7.070 -3.625 -4.220 63 HB2 GLN 27 1HB GLN 27 -7.878 -6.185 -2.773 64 HB3 GLN 27 2HB GLN 27 -8.952 -4.819 -2.948 65 HG2 GLN 27 1HG GLN 27 -7.712 -6.232 -5.357 66 HG3 GLN 27 2HG GLN 27 -9.196 -6.763 -4.607 67 HE21 GLN 27 1HE2 GLN 27 -8.836 -5.809 -7.385 68 HE22 GLN 27 2HE2 GLN 27 -9.853 -4.394 -7.525 69 H ILE 28 H ILE 28 -5.600 -5.370 -1.516 70 HA ILE 28 HA ILE 28 -6.293 -3.441 0.532 71 HB ILE 28 HB ILE 28 -4.214 -5.667 0.283 72 HG12 ILE 28 1HG1 ILE 28 -6.757 -5.543 1.969 73 HG13 ILE 28 2HG1 ILE 28 -6.737 -6.203 0.347 74 HG21 ILE 28 1HG2 ILE 28 -4.903 -3.934 2.692 75 HG22 ILE 28 2HG2 ILE 28 -3.972 -5.447 2.769 76 HG23 ILE 28 3HG2 ILE 28 -3.324 -4.074 1.894 77 HD11 ILE 28 3HD1 ILE 28 -4.933 -7.826 1.096 78 HD12 ILE 28 1HD1 ILE 28 -5.287 -7.280 2.752 79 HD13 ILE 28 2HD1 ILE 28 -6.542 -8.067 1.809 80 H GLY 29 H GLY 29 -3.638 -3.875 -1.817 81 HA2 GLY 29 1HA GLY 29 -1.655 -2.342 -0.764 82 HA3 GLY 29 2HA GLY 29 -1.974 -2.516 -2.503 83 H VAL 30 H VAL 30 -4.393 -1.229 -2.772 84 HA VAL 30 HA VAL 30 -3.566 1.522 -2.832 85 HB VAL 30 HB VAL 30 -6.258 0.212 -3.406 86 HG11 VAL 30 1HG1 VAL 30 -6.480 2.678 -3.005 87 HG12 VAL 30 2HG1 VAL 30 -5.246 2.969 -4.246 88 HG13 VAL 30 3HG1 VAL 30 -6.797 2.218 -4.681 89 HG21 VAL 30 3HG2 VAL 30 -4.435 -0.599 -4.903 90 HG22 VAL 30 1HG2 VAL 30 -5.551 0.445 -5.780 91 HG23 VAL 30 2HG2 VAL 30 -3.981 1.079 -5.268 92 H LEU 31 H LEU 31 -5.906 -0.293 -0.798 93 HA LEU 31 HA LEU 31 -6.868 1.950 0.687 94 HB2 LEU 31 1HB LEU 31 -6.897 -1.030 0.926 95 HB3 LEU 31 2HB LEU 31 -6.963 -0.175 2.458 96 HG LEU 31 HG LEU 31 -8.977 0.931 1.958 97 HD11 LEU 31 1HD1 LEU 31 -8.753 -0.130 -0.900 98 HD12 LEU 31 2HD1 LEU 31 -8.690 1.571 -0.389 99 HD13 LEU 31 3HD1 LEU 31 -10.186 0.667 -0.216 100 HD21 LEU 31 3HD2 LEU 31 -9.133 -1.918 0.925 101 HD22 LEU 31 1HD2 LEU 31 -10.520 -0.947 1.459 102 HD23 LEU 31 2HD2 LEU 31 -9.267 -1.403 2.624 103 H ALA 32 H ALA 32 -4.200 -0.317 1.471 104 HA ALA 32 HA ALA 32 -3.541 1.024 3.931 105 HB1 ALA 32 1HB ALA 32 -2.814 -1.189 3.845 106 HB2 ALA 32 2HB ALA 32 -2.217 -1.048 2.186 107 HB3 ALA 32 3HB ALA 32 -1.311 -0.290 3.507 108 H GLY 33 H GLY 33 -2.401 1.472 0.532 109 HA2 GLY 33 1HA GLY 33 -0.345 3.357 1.254 110 HA3 GLY 33 2HA GLY 33 -1.045 3.102 -0.340 111 H LEU 34 H LEU 34 -3.883 3.673 0.616 112 HA LEU 34 HA LEU 34 -3.827 6.494 0.404 113 HB2 LEU 34 1HB LEU 34 -5.865 4.390 0.674 114 HB3 LEU 34 2HB LEU 34 -6.275 5.820 1.609 115 HG LEU 34 HG LEU 34 -5.969 7.258 -0.335 116 HD11 LEU 34 1HD1 LEU 34 -5.549 4.691 -1.937 117 HD12 LEU 34 2HD1 LEU 34 -4.344 5.963 -1.690 118 HD13 LEU 34 3HD1 LEU 34 -5.804 6.308 -2.625 119 HD21 LEU 34 3HD2 LEU 34 -8.155 6.365 0.209 120 HD22 LEU 34 1HD2 LEU 34 -7.838 4.904 -0.778 121 HD23 LEU 34 2HD2 LEU 34 -7.968 6.503 -1.557 122 H ALA 35 H ALA 35 -3.565 4.477 3.204 123 HA ALA 35 HA ALA 35 -3.995 6.681 5.096 124 HB1 ALA 35 1HB ALA 35 -4.486 4.429 5.841 125 HB2 ALA 35 2HB ALA 35 -2.839 3.888 5.475 126 HB3 ALA 35 3HB ALA 35 -3.139 5.065 6.780 127 H ILE 36 H ILE 36 -1.293 5.605 3.120 128 HA ILE 36 HA ILE 36 0.611 7.225 4.707 129 HB ILE 36 HB ILE 36 1.040 4.394 3.676 130 HG12 ILE 36 1HG1 ILE 36 1.990 4.070 5.989 131 HG13 ILE 36 2HG1 ILE 36 1.330 5.629 6.479 132 HG21 ILE 36 1HG2 ILE 36 3.406 4.625 4.376 133 HG22 ILE 36 2HG2 ILE 36 3.054 5.762 3.102 134 HG23 ILE 36 3HG2 ILE 36 3.145 6.340 4.759 135 HD11 ILE 36 3HD1 ILE 36 0.153 3.414 7.078 136 HD12 ILE 36 1HD1 ILE 36 -0.813 4.780 6.529 137 HD13 ILE 36 2HD1 ILE 36 -0.439 3.440 5.406 138 H SER 37 H SER 37 0.369 8.917 3.232 139 HA SER 37 HA SER 37 0.827 10.162 1.448 140 HB2 SER 37 1HB SER 37 3.029 8.667 1.699 141 HB3 SER 37 2HB SER 37 2.561 8.152 0.076 142 HG SER 37 HG SER 37 2.999 10.803 1.057 143 HA PRO 38 HA PRO 38 -2.473 7.836 -0.959 144 HB2 PRO 38 1HB PRO 38 -4.319 9.912 -0.818 145 HB3 PRO 38 2HB PRO 38 -4.239 8.563 0.338 146 HG2 PRO 38 1HG PRO 38 -3.078 11.325 0.636 147 HG3 PRO 38 2HG PRO 38 -3.977 10.341 1.832 148 HD2 PRO 38 1HD PRO 38 -1.280 10.506 1.879 149 HD3 PRO 38 2HD PRO 38 -2.103 8.961 2.251 150 H GLU 39 H GLU 39 -1.253 11.189 -0.879 151 HA GLU 39 HA GLU 39 -2.084 11.836 -3.533 152 HB2 GLU 39 1HB GLU 39 -0.007 13.161 -1.747 153 HB3 GLU 39 2HB GLU 39 -0.656 13.820 -3.282 154 HG2 GLU 39 1HG GLU 39 -2.984 13.493 -2.264 155 HG3 GLU 39 2HG GLU 39 -2.181 13.199 -0.722 156 H TRP 40 H TRP 40 1.184 10.866 -2.284 157 HA TRP 40 HA TRP 40 2.520 10.737 -4.757 158 HB2 TRP 40 1HB TRP 40 3.726 10.430 -2.698 159 HB3 TRP 40 2HB TRP 40 2.716 9.071 -2.223 160 HD1 TRP 40 HD TRP 40 5.478 9.925 -4.744 161 HE1 TRP 40 1HE TRP 40 6.683 7.851 -5.485 162 HE3 TRP 40 3HE TRP 40 2.416 6.519 -2.488 163 HZ2 TRP 40 2HZ TRP 40 6.497 4.934 -4.872 164 HZ3 TRP 40 3HZ TRP 40 2.889 4.097 -2.662 165 HH2 TRP 40 HH TRP 40 4.940 3.287 -3.802 166 H LEU 41 H LEU 41 0.549 8.217 -3.109 167 HA LEU 41 HA LEU 41 0.814 6.212 -5.059 168 HB2 LEU 41 1HB LEU 41 -0.075 5.843 -2.848 169 HB3 LEU 41 2HB LEU 41 -1.491 6.824 -3.151 170 HG LEU 41 HG LEU 41 -0.888 4.383 -4.864 171 HD11 LEU 41 1HD1 LEU 41 -0.811 3.719 -2.464 172 HD12 LEU 41 2HD1 LEU 41 -2.149 2.996 -3.345 173 HD13 LEU 41 3HD1 LEU 41 -2.454 4.362 -2.247 174 HD21 LEU 41 3HD2 LEU 41 -2.766 5.688 -5.731 175 HD22 LEU 41 1HD2 LEU 41 -3.519 5.747 -4.123 176 HD23 LEU 41 2HD2 LEU 41 -3.374 4.218 -5.017 177 H LYS 42 H LYS 42 -1.874 8.598 -4.750 178 HA LYS 42 HA LYS 42 -3.133 7.789 -7.171 179 HB2 LYS 42 1HB LYS 42 -3.291 10.341 -5.536 180 HB3 LYS 42 2HB LYS 42 -4.284 10.037 -6.960 181 HG2 LYS 42 1HG LYS 42 -5.223 7.988 -5.905 182 HG3 LYS 42 2HG LYS 42 -4.233 8.266 -4.474 183 HD2 LYS 42 1HD LYS 42 -6.394 9.101 -3.928 184 HD3 LYS 42 2HD LYS 42 -5.376 10.525 -4.218 185 HE2 LYS 42 1HE LYS 42 -6.404 9.883 -6.759 186 HE3 LYS 42 2HE LYS 42 -7.741 9.470 -5.701 187 HZ1 LYS 42 3HZ LYS 42 -6.404 12.118 -5.732 188 HZ2 LYS 42 1HZ LYS 42 -7.840 11.733 -4.968 189 HZ3 LYS 42 2HZ LYS 42 -7.760 11.732 -6.575 190 H GLN 43 H GLN 43 -0.429 10.144 -6.716 191 HA GLN 43 HA GLN 43 -0.759 11.315 -9.357 192 HB2 GLN 43 1HB GLN 43 1.618 11.132 -7.449 193 HB3 GLN 43 2HB GLN 43 1.705 11.854 -9.061 194 HG2 GLN 43 1HG GLN 43 -0.218 13.367 -8.391 195 HG3 GLN 43 2HG GLN 43 0.009 12.831 -6.731 196 HE21 GLN 43 1HE2 GLN 43 3.178 12.792 -7.636 197 HE22 GLN 43 2HE2 GLN 43 3.538 14.483 -7.707 198 H ASN 44 H ASN 44 1.210 8.643 -8.007 199 HA ASN 44 HA ASN 44 2.441 8.011 -10.503 200 HB2 ASN 44 1HB ASN 44 2.013 6.413 -7.964 201 HB3 ASN 44 2HB ASN 44 2.810 5.753 -9.410 202 HD21 ASN 44 1HD2 ASN 44 3.135 8.121 -6.806 203 HD22 ASN 44 2HD2 ASN 44 4.839 8.326 -7.038 204 H ILE 45 H ILE 45 -0.660 6.811 -9.040 205 HA ILE 45 HA ILE 45 -1.197 4.928 -11.131 206 HB ILE 45 HB ILE 45 -3.077 6.567 -9.383 207 HG12 ILE 45 1HG1 ILE 45 -1.712 5.014 -8.053 208 HG13 ILE 45 2HG1 ILE 45 -3.386 4.605 -8.047 209 HG21 ILE 45 1HG2 ILE 45 -4.479 5.948 -11.116 210 HG22 ILE 45 2HG2 ILE 45 -3.608 4.431 -11.447 211 HG23 ILE 45 3HG2 ILE 45 -4.641 4.586 -10.023 212 HD11 ILE 45 3HD1 ILE 45 -1.193 3.208 -9.644 213 HD12 ILE 45 1HD1 ILE 45 -2.008 2.597 -8.194 214 HD13 ILE 45 2HD1 ILE 45 -2.921 2.780 -9.698 215 H ALA 46 H ALA 46 -2.093 8.441 -10.781 216 HA ALA 46 HA ALA 46 -3.261 8.670 -13.364 217 HB1 ALA 46 1HB ALA 46 -1.987 10.832 -11.676 218 HB2 ALA 46 2HB ALA 46 -3.259 11.002 -12.921 219 HB3 ALA 46 3HB ALA 46 -3.621 10.172 -11.408 220 H ALA 47 H ALA 47 -0.030 8.131 -12.644 221 HA ALA 47 HA ALA 47 0.888 9.149 -15.272 222 HB1 ALA 47 1HB ALA 47 2.071 9.990 -13.242 223 HB2 ALA 47 2HB ALA 47 2.539 8.318 -12.871 224 HB3 ALA 47 3HB ALA 47 3.109 9.098 -14.372 225 H ASN 48 H ASN 48 -0.249 6.360 -13.860 226 HA ASN 48 HA ASN 48 0.120 4.174 -13.900 227 HB2 ASN 48 1HB ASN 48 -0.774 4.785 -16.262 228 HB3 ASN 48 2HB ASN 48 0.825 4.303 -16.815 229 HD21 ASN 48 1HD2 ASN 48 1.446 2.058 -16.477 230 HD22 ASN 48 2HD2 ASN 48 0.262 0.795 -16.149 231 H GLN 49 H GLN 49 2.260 5.520 -12.903 232 HA GLN 49 HA GLN 49 4.749 4.224 -13.992 233 HB2 GLN 49 1HB GLN 49 4.224 6.735 -12.353 234 HB3 GLN 49 2HB GLN 49 5.828 6.042 -12.427 235 HG2 GLN 49 1HG GLN 49 4.439 6.590 -15.041 236 HG3 GLN 49 2HG GLN 49 5.067 7.935 -14.100 237 HE21 GLN 49 1HE2 GLN 49 6.504 4.565 -14.761 238 HE22 GLN 49 2HE2 GLN 49 7.983 5.312 -15.311 239 H LEU 50 H LEU 50 2.492 3.647 -11.721 240 HA LEU 50 HA LEU 50 4.228 3.259 -9.359 241 HB2 LEU 50 1HB LEU 50 1.531 3.913 -9.703 242 HB3 LEU 50 2HB LEU 50 1.423 2.224 -9.348 243 HG LEU 50 HG LEU 50 2.975 4.271 -7.673 244 HD11 LEU 50 1HD1 LEU 50 0.231 3.086 -7.120 245 HD12 LEU 50 2HD1 LEU 50 0.514 4.689 -7.801 246 HD13 LEU 50 3HD1 LEU 50 1.095 4.337 -6.177 247 HD21 LEU 50 3HD2 LEU 50 3.067 2.763 -5.878 248 HD22 LEU 50 1HD2 LEU 50 3.690 1.924 -7.270 249 HD23 LEU 50 2HD2 LEU 50 2.060 1.535 -6.742 250 H VAL 51 H VAL 51 4.894 1.192 -8.698 251 HA VAL 51 HA VAL 51 4.129 -1.149 -10.343 252 HB VAL 51 HB VAL 51 6.840 -0.443 -9.145 253 HG11 VAL 51 1HG1 VAL 51 7.671 -2.541 -10.219 254 HG12 VAL 51 2HG1 VAL 51 6.544 -2.861 -8.917 255 HG13 VAL 51 3HG1 VAL 51 5.993 -3.003 -10.603 256 HG21 VAL 51 3HG2 VAL 51 6.364 0.696 -11.315 257 HG22 VAL 51 1HG2 VAL 51 7.664 -0.484 -11.446 258 HG23 VAL 51 2HG2 VAL 51 6.057 -0.894 -12.059 259 H TYR 52 H TYR 52 3.865 -3.023 -9.173 260 HA TYR 52 HA TYR 52 3.738 -2.992 -6.219 261 HB2 TYR 52 1HB TYR 52 1.445 -2.972 -7.009 262 HB3 TYR 52 2HB TYR 52 1.846 -3.965 -8.385 263 HD1 TYR 52 2HD TYR 52 1.842 -4.300 -4.600 264 HD2 TYR 52 1HD TYR 52 1.258 -6.146 -8.450 265 HE1 TYR 52 2HE TYR 52 1.134 -6.433 -3.502 266 HE2 TYR 52 1HE TYR 52 0.678 -8.277 -7.373 267 HH TYR 52 HH TYR 52 -0.005 -9.241 -5.373 268 H GLY 53 H GLY 53 4.624 -4.963 -5.338 269 HA2 GLY 53 1HA GLY 53 5.276 -7.183 -7.032 270 HA3 GLY 53 2HA GLY 53 6.714 -6.188 -6.712 271 H ILE 54 H ILE 54 7.150 -8.484 -5.809 272 HA ILE 54 HA ILE 54 6.340 -8.715 -2.956 273 HB ILE 54 HB ILE 54 7.008 -10.835 -5.053 274 HG12 ILE 54 1HG1 ILE 54 4.703 -9.912 -5.303 275 HG13 ILE 54 2HG1 ILE 54 4.757 -11.620 -4.902 276 HG21 ILE 54 1HG2 ILE 54 6.439 -11.145 -2.082 277 HG22 ILE 54 2HG2 ILE 54 6.357 -12.471 -3.255 278 HG23 ILE 54 3HG2 ILE 54 7.889 -11.644 -2.980 279 HD11 ILE 54 3HD1 ILE 54 4.282 -9.477 -2.799 280 HD12 ILE 54 1HD1 ILE 54 3.006 -10.339 -3.662 281 HD13 ILE 54 2HD1 ILE 54 4.153 -11.233 -2.619 282 H VAL 55 H VAL 55 7.992 -8.818 -1.561 283 HA VAL 55 HA VAL 55 10.579 -8.030 -2.054 284 HB VAL 55 HB VAL 55 9.259 -9.688 0.100 285 HG11 VAL 55 1HG1 VAL 55 12.204 -9.125 -0.202 286 HG12 VAL 55 2HG1 VAL 55 11.479 -9.063 1.421 287 HG13 VAL 55 3HG1 VAL 55 11.400 -10.537 0.465 288 HG21 VAL 55 3HG2 VAL 55 10.626 -6.978 0.274 289 HG22 VAL 55 1HG2 VAL 55 8.980 -7.104 -0.353 290 HG23 VAL 55 2HG2 VAL 55 9.335 -7.624 1.287 291 H LYS 56 H LYS 56 9.904 -11.555 -1.530 292 HA LYS 56 HA LYS 56 11.146 -13.352 -1.873 293 HB2 LYS 56 1HB LYS 56 11.872 -11.890 -4.436 294 HB3 LYS 56 2HB LYS 56 12.257 -13.563 -4.131 295 HG2 LYS 56 1HG LYS 56 9.596 -13.674 -3.603 296 HG3 LYS 56 2HG LYS 56 9.607 -12.277 -4.709 297 HD2 LYS 56 1HD LYS 56 11.013 -13.718 -6.271 298 HD3 LYS 56 2HD LYS 56 10.698 -15.064 -5.172 299 HE2 LYS 56 1HE LYS 56 8.345 -15.050 -5.618 300 HE3 LYS 56 2HE LYS 56 8.453 -13.497 -6.475 301 HZ1 LYS 56 3HZ LYS 56 9.705 -14.522 -8.180 302 HZ2 LYS 56 1HZ LYS 56 8.329 -15.354 -8.010 303 HZ3 LYS 56 2HZ LYS 56 9.736 -15.993 -7.423 304 HA PRO 57 HA PRO 57 15.269 -12.518 -0.454 305 HB2 PRO 57 1HB PRO 57 16.689 -14.768 -0.958 306 HB3 PRO 57 2HB PRO 57 15.325 -14.746 0.205 307 HG2 PRO 57 1HG PRO 57 15.296 -15.610 -2.690 308 HG3 PRO 57 2HG PRO 57 14.659 -16.508 -1.284 309 HD2 PRO 57 1HD PRO 57 13.077 -14.981 -2.893 310 HD3 PRO 57 2HD PRO 57 12.758 -15.070 -1.156 311 H SER 58 H SER 58 14.775 -13.368 -3.825 312 HA SER 58 HA SER 58 17.423 -12.940 -4.765 313 HB2 SER 58 1HB SER 58 14.795 -13.033 -6.293 314 HB3 SER 58 2HB SER 58 16.418 -13.377 -6.925 315 HG SER 58 HG SER 58 15.177 -15.250 -6.388 316 H ASP 59 H ASP 59 16.079 -10.525 -3.378 317 HA ASP 59 HA ASP 59 16.811 -8.541 -5.418 318 HB2 ASP 59 1HB ASP 59 14.166 -8.909 -5.033 319 HB3 ASP 59 2HB ASP 59 14.481 -7.828 -3.672 320 H THR 60 H THR 60 16.877 -6.263 -4.039 321 HA THR 60 HA THR 60 18.547 -6.786 -1.637 322 HB THR 60 HB THR 60 18.007 -4.148 -3.078 323 HG1 THR 60 1HG THR 60 19.830 -4.497 -4.201 324 HG21 THR 60 3HG2 THR 60 20.172 -3.513 -1.991 325 HG22 THR 60 1HG2 THR 60 20.210 -5.089 -1.178 326 HG23 THR 60 2HG2 THR 60 18.923 -3.922 -0.799 327 H VAL 61 H VAL 61 17.328 -6.895 0.263 328 HA VAL 61 HA VAL 61 15.266 -4.860 0.712 329 HB VAL 61 HB VAL 61 13.762 -6.725 1.595 330 HG11 VAL 61 1HG1 VAL 61 12.695 -7.063 -0.530 331 HG12 VAL 61 2HG1 VAL 61 13.406 -5.454 -0.540 332 HG13 VAL 61 3HG1 VAL 61 14.186 -6.787 -1.419 333 HG21 VAL 61 3HG2 VAL 61 15.270 -8.599 -0.237 334 HG22 VAL 61 1HG2 VAL 61 15.647 -8.492 1.503 335 HG23 VAL 61 2HG2 VAL 61 14.043 -8.979 0.987 336 HA PRO 62 HA PRO 62 16.887 -5.251 4.884 337 HB2 PRO 62 1HB PRO 62 14.758 -4.494 6.460 338 HB3 PRO 62 2HB PRO 62 15.662 -3.374 5.429 339 HG2 PRO 62 1HG PRO 62 13.055 -4.755 4.850 340 HG3 PRO 62 2HG PRO 62 13.489 -3.031 4.609 341 HD2 PRO 62 1HD PRO 62 13.533 -4.860 2.580 342 HD3 PRO 62 2HD PRO 62 14.657 -3.490 2.636 343 H ALA 63 H ALA 63 15.923 -6.094 7.158 344 HA ALA 63 HA ALA 63 15.350 -8.940 6.985 345 HB1 ALA 63 1HB ALA 63 15.112 -7.015 9.332 346 HB2 ALA 63 2HB ALA 63 15.380 -8.756 9.410 347 HB3 ALA 63 3HB ALA 63 16.668 -7.678 8.818 348 H GLY 64 H GLY 64 13.436 -9.882 7.900 349 HA2 GLY 64 1HA GLY 64 11.360 -10.063 8.786 350 HA3 GLY 64 2HA GLY 64 11.494 -8.376 9.259 351 H VAL 65 H VAL 65 11.544 -9.542 5.865 352 HA VAL 65 HA VAL 65 8.769 -8.643 5.457 353 HB VAL 65 HB VAL 65 9.539 -7.174 3.546 354 HG11 VAL 65 1HG1 VAL 65 10.475 -6.152 6.214 355 HG12 VAL 65 2HG1 VAL 65 9.789 -5.241 4.856 356 HG13 VAL 65 3HG1 VAL 65 8.767 -6.353 5.762 357 HG21 VAL 65 3HG2 VAL 65 11.687 -6.332 3.329 358 HG22 VAL 65 1HG2 VAL 65 12.268 -7.101 4.832 359 HG23 VAL 65 2HG2 VAL 65 11.895 -8.080 3.409 360 H ASP 66 H ASP 66 10.172 -11.293 5.319 361 HA ASP 66 HA ASP 66 11.138 -11.995 2.866 362 HB2 ASP 66 1HB ASP 66 9.422 -13.690 4.761 363 HB3 ASP 66 2HB ASP 66 10.321 -14.379 3.424 364 H ASP 67 H ASP 67 7.986 -11.405 3.424 365 HA ASP 67 HA ASP 67 7.048 -12.293 0.776 366 HB2 ASP 67 1HB ASP 67 5.181 -13.510 1.798 367 HB3 ASP 67 2HB ASP 67 6.688 -14.150 2.462 368 H TYR 68 H TYR 68 7.538 -9.679 2.376 369 HA TYR 68 HA TYR 68 4.811 -8.590 2.624 370 HB2 TYR 68 1HB TYR 68 7.539 -7.426 3.013 371 HB3 TYR 68 2HB TYR 68 6.142 -6.408 2.818 372 HD1 TYR 68 1HD TYR 68 6.117 -9.723 4.696 373 HD2 TYR 68 2HD TYR 68 5.881 -5.404 4.940 374 HE1 TYR 68 1HE TYR 68 5.386 -9.911 6.950 375 HE2 TYR 68 2HE TYR 68 5.119 -5.629 7.287 376 HH TYR 68 HH TYR 68 4.621 -8.820 8.829 377 H SER 69 H SER 69 3.727 -7.553 1.117 378 HA SER 69 HA SER 69 4.581 -7.430 -1.623 379 HB2 SER 69 1HB SER 69 2.208 -6.412 0.054 380 HB3 SER 69 2HB SER 69 2.292 -6.363 -1.704 381 HG SER 69 HG SER 69 1.218 -8.335 -0.599 382 H TYR 70 H TYR 70 5.053 -5.364 -2.661 383 HA TYR 70 HA TYR 70 5.221 -3.012 -0.905 384 HB2 TYR 70 1HB TYR 70 7.399 -2.365 -1.518 385 HB3 TYR 70 2HB TYR 70 7.487 -3.983 -0.892 386 HD1 TYR 70 1HD TYR 70 7.708 -5.951 -2.579 387 HD2 TYR 70 2HD TYR 70 8.355 -1.813 -3.642 388 HE1 TYR 70 1HE TYR 70 9.168 -6.638 -4.489 389 HE2 TYR 70 2HE TYR 70 9.814 -2.516 -5.500 390 HH TYR 70 HH TYR 70 11.164 -4.371 -6.264 391 H LEU 71 H LEU 71 5.597 -1.036 -2.111 392 HA LEU 71 HA LEU 71 4.519 -0.980 -4.843 393 HB2 LEU 71 1HB LEU 71 3.438 0.506 -2.404 394 HB3 LEU 71 2HB LEU 71 3.075 0.976 -4.058 395 HG LEU 71 HG LEU 71 2.468 -1.859 -3.170 396 HD11 LEU 71 1HD1 LEU 71 1.430 -0.567 -1.457 397 HD12 LEU 71 2HD1 LEU 71 0.201 -1.213 -2.547 398 HD13 LEU 71 3HD1 LEU 71 0.640 0.500 -2.655 399 HD21 LEU 71 3HD2 LEU 71 1.090 -0.039 -5.176 400 HD22 LEU 71 1HD2 LEU 71 0.756 -1.762 -4.888 401 HD23 LEU 71 2HD2 LEU 71 2.307 -1.253 -5.574 402 H VAL 72 H VAL 72 5.607 0.584 -6.001 403 HA VAL 72 HA VAL 72 7.184 2.693 -4.708 404 HB VAL 72 HB VAL 72 8.466 0.555 -4.583 405 HG11 VAL 72 1HG1 VAL 72 9.370 -0.548 -6.451 406 HG12 VAL 72 2HG1 VAL 72 7.631 -0.448 -6.685 407 HG13 VAL 72 3HG1 VAL 72 8.690 0.636 -7.600 408 HG21 VAL 72 3HG2 VAL 72 10.606 1.418 -5.339 409 HG22 VAL 72 1HG2 VAL 72 9.846 2.526 -6.479 410 HG23 VAL 72 2HG2 VAL 72 9.667 2.792 -4.740 411 H ALA 73 H ALA 73 8.068 4.152 -6.542 412 HA ALA 73 HA ALA 73 6.311 3.983 -8.950 413 HB1 ALA 73 1HB ALA 73 8.417 5.993 -8.205 414 HB2 ALA 73 2HB ALA 73 7.241 6.143 -9.510 415 HB3 ALA 73 3HB ALA 73 6.707 6.195 -7.806 416 H ALA 74 H ALA 74 7.308 3.726 -11.018 417 HA ALA 74 HA ALA 74 9.712 2.193 -11.008 418 HB1 ALA 74 1HB ALA 74 8.278 3.564 -13.331 419 HB2 ALA 74 2HB ALA 74 9.505 2.290 -13.501 420 HB3 ALA 74 3HB ALA 74 7.939 1.909 -12.757 421 H ASP 75 H ASP 75 9.278 5.555 -10.975 422 HA ASP 75 HA ASP 75 12.135 5.895 -11.766 423 HB2 ASP 75 1HB ASP 75 9.773 7.724 -11.930 424 HB3 ASP 75 2HB ASP 75 11.320 8.444 -11.490 425 H ASP 76 H ASP 76 9.868 6.349 -9.142 426 HA ASP 76 HA ASP 76 11.742 7.946 -7.568 427 HB2 ASP 76 1HB ASP 76 9.249 6.768 -6.334 428 HB3 ASP 76 2HB ASP 76 10.150 8.186 -5.858 429 H GLN 77 H GLN 77 12.598 5.279 -8.219 430 HA GLN 77 HA GLN 77 12.123 3.194 -6.460 431 HB2 GLN 77 1HB GLN 77 14.691 3.904 -7.933 432 HB3 GLN 77 2HB GLN 77 14.406 2.350 -7.163 433 HG2 GLN 77 1HG GLN 77 13.012 1.603 -8.791 434 HG3 GLN 77 2HG GLN 77 12.195 3.144 -8.993 435 HE21 GLN 77 1HE2 GLN 77 13.733 4.919 -9.996 436 HE22 GLN 77 2HE2 GLN 77 14.324 4.415 -11.545 437 H ASP 78 H ASP 78 14.818 5.573 -6.145 438 HA ASP 78 HA ASP 78 15.280 4.746 -3.349 439 HB2 ASP 78 1HB ASP 78 17.306 5.966 -3.502 440 HB3 ASP 78 2HB ASP 78 17.179 4.979 -4.950 441 H GLY 79 H GLY 79 12.996 6.608 -4.620 442 HA2 GLY 79 1HA GLY 79 13.400 9.101 -3.085 443 HA3 GLY 79 2HA GLY 79 12.210 8.803 -4.353 444 H THR 80 H THR 80 10.559 6.877 -3.710 445 HA THR 80 HA THR 80 10.056 6.842 -0.799 446 HB THR 80 HB THR 80 7.699 7.193 -2.638 447 HG1 THR 80 1HG THR 80 9.131 9.049 -2.756 448 HG21 THR 80 3HG2 THR 80 7.248 6.369 -0.347 449 HG22 THR 80 1HG2 THR 80 6.646 8.024 -0.511 450 HG23 THR 80 2HG2 THR 80 8.176 7.711 0.337 451 H ILE 81 H ILE 81 9.218 4.859 -0.106 452 HA ILE 81 HA ILE 81 8.113 3.077 -2.124 453 HB ILE 81 HB ILE 81 10.703 2.724 -1.817 454 HG12 ILE 81 1HG1 ILE 81 8.693 0.441 -1.567 455 HG13 ILE 81 2HG1 ILE 81 9.278 1.291 -2.943 456 HG21 ILE 81 1HG2 ILE 81 10.602 2.846 0.754 457 HG22 ILE 81 2HG2 ILE 81 9.908 1.205 0.669 458 HG23 ILE 81 3HG2 ILE 81 11.536 1.519 0.050 459 HD11 ILE 81 3HD1 ILE 81 11.529 0.454 -2.665 460 HD12 ILE 81 1HD1 ILE 81 11.059 -0.383 -1.169 461 HD13 ILE 81 2HD1 ILE 81 10.368 -0.890 -2.716 462 H ILE 82 H ILE 82 6.764 1.381 -1.021 463 HA ILE 82 HA ILE 82 6.424 1.728 1.902 464 HB ILE 82 HB ILE 82 4.014 1.644 0.084 465 HG12 ILE 82 1HG1 ILE 82 5.358 4.188 1.138 466 HG13 ILE 82 2HG1 ILE 82 5.194 3.728 -0.564 467 HG21 ILE 82 1HG2 ILE 82 2.844 2.304 2.088 468 HG22 ILE 82 2HG2 ILE 82 3.979 1.064 2.613 469 HG23 ILE 82 3HG2 ILE 82 4.349 2.781 2.892 470 HD11 ILE 82 3HD1 ILE 82 2.895 4.443 1.267 471 HD12 ILE 82 1HD1 ILE 82 3.609 5.440 -0.011 472 HD13 ILE 82 2HD1 ILE 82 2.770 3.940 -0.427 473 H PHE 83 H PHE 83 5.968 -0.251 2.913 474 HA PHE 83 HA PHE 83 5.632 -2.655 1.161 475 HB2 PHE 83 1HB PHE 83 7.228 -2.328 3.728 476 HB3 PHE 83 2HB PHE 83 6.795 -3.879 3.059 477 HD1 PHE 83 2HD PHE 83 8.752 -0.765 2.387 478 HD2 PHE 83 1HD PHE 83 8.211 -4.938 1.393 479 HE1 PHE 83 2HE PHE 83 10.916 -0.776 1.166 480 HE2 PHE 83 1HE PHE 83 10.258 -4.837 -0.001 481 HZ PHE 83 HZ PHE 83 11.639 -2.805 -0.061 482 H PHE 84 H PHE 84 4.248 -4.363 2.134 483 HA PHE 84 HA PHE 84 3.012 -3.898 4.678 484 HB2 PHE 84 1HB PHE 84 0.701 -3.736 3.937 485 HB3 PHE 84 2HB PHE 84 1.599 -2.387 3.289 486 HD1 PHE 84 1HD PHE 84 2.572 -2.713 0.797 487 HD2 PHE 84 2HD PHE 84 -0.685 -4.999 2.491 488 HE1 PHE 84 1HE PHE 84 1.815 -3.321 -1.469 489 HE2 PHE 84 2HE PHE 84 -1.454 -5.566 0.208 490 HZ PHE 84 HZ PHE 84 -0.213 -4.742 -1.772 491 H LYS 85 H LYS 85 1.794 -5.787 5.392 492 HA LYS 85 HA LYS 85 1.338 -7.909 3.407 493 HB2 LYS 85 1HB LYS 85 3.525 -8.066 5.068 494 HB3 LYS 85 2HB LYS 85 2.371 -9.006 5.980 495 HG2 LYS 85 1HG LYS 85 2.995 -9.486 3.033 496 HG3 LYS 85 2HG LYS 85 3.885 -10.227 4.339 497 HD2 LYS 85 1HD LYS 85 2.494 -11.907 3.806 498 HD3 LYS 85 2HD LYS 85 1.628 -11.131 5.146 499 HE2 LYS 85 1HE LYS 85 0.224 -9.892 3.413 500 HE3 LYS 85 2HE LYS 85 1.208 -10.653 2.141 501 HZ1 LYS 85 3HZ LYS 85 -0.825 -11.886 3.832 502 HZ2 LYS 85 1HZ LYS 85 0.361 -12.814 3.110 503 HZ3 LYS 85 2HZ LYS 85 -0.601 -11.925 2.184 504 H ALA 86 H ALA 86 -0.856 -8.087 3.590 505 HA ALA 86 HA ALA 86 -2.188 -7.595 6.172 506 HB1 ALA 86 1HB ALA 86 -4.237 -8.032 4.857 507 HB2 ALA 86 2HB ALA 86 -3.305 -6.601 4.418 508 HB3 ALA 86 3HB ALA 86 -3.221 -8.083 3.388 509 H GLU 87 H GLU 87 -2.546 -9.260 7.511 510 HA GLU 87 HA GLU 87 -3.023 -12.008 6.626 511 HB2 GLU 87 1HB GLU 87 -0.535 -10.869 7.835 512 HB3 GLU 87 2HB GLU 87 -1.190 -12.188 8.787 513 HG2 GLU 87 1HG GLU 87 -0.890 -12.460 5.764 514 HG3 GLU 87 2HG GLU 87 0.440 -12.654 6.888 515 H GLY 88 H GLY 88 -3.949 -13.259 8.327 516 HA2 GLY 88 1HA GLY 88 -5.564 -13.570 10.005 517 HA3 GLY 88 2HA GLY 88 -4.248 -12.854 10.933 518 H GLN 89 H GLN 89 -6.712 -11.535 8.704 519 HA GLN 89 HA GLN 89 -8.019 -9.695 8.728 520 HB2 GLN 89 1HB GLN 89 -8.290 -10.225 11.692 521 HB3 GLN 89 2HB GLN 89 -9.252 -9.056 10.798 522 HG2 GLN 89 1HG GLN 89 -9.321 -12.041 10.479 523 HG3 GLN 89 2HG GLN 89 -10.551 -11.000 11.147 524 HE21 GLN 89 1HE2 GLN 89 -9.205 -12.302 8.232 525 HE22 GLN 89 2HE2 GLN 89 -10.410 -11.642 7.134 526 H THR 90 H THR 90 -5.005 -9.285 9.421 527 HA THR 90 HA THR 90 -5.126 -6.570 10.538 528 HB THR 90 HB THR 90 -2.887 -8.544 11.065 529 HG1 THR 90 1HG THR 90 -4.700 -9.527 11.852 530 HG21 THR 90 3HG2 THR 90 -3.916 -6.090 12.569 531 HG22 THR 90 1HG2 THR 90 -2.371 -6.226 11.690 532 HG23 THR 90 2HG2 THR 90 -2.639 -7.182 13.146 533 H VAL 91 H VAL 91 -3.049 -5.321 9.862 534 HA VAL 91 HA VAL 91 -1.465 -6.507 7.723 535 HB VAL 91 HB VAL 91 -3.311 -5.641 6.621 536 HG11 VAL 91 1HG1 VAL 91 -4.363 -4.084 7.662 537 HG12 VAL 91 2HG1 VAL 91 -2.977 -2.931 7.611 538 HG13 VAL 91 3HG1 VAL 91 -3.837 -3.393 6.123 539 HG21 VAL 91 3HG2 VAL 91 -1.044 -3.717 5.975 540 HG22 VAL 91 1HG2 VAL 91 -0.981 -5.430 5.541 541 HG23 VAL 91 2HG2 VAL 91 -2.207 -4.389 4.809 542 H ILE 92 H ILE 92 0.526 -6.233 8.351 543 HA ILE 92 HA ILE 92 1.379 -3.863 9.840 544 HB ILE 92 HB ILE 92 3.163 -6.037 8.749 545 HG12 ILE 92 1HG1 ILE 92 3.107 -7.021 11.093 546 HG13 ILE 92 2HG1 ILE 92 1.588 -6.174 11.352 547 HG21 ILE 92 1HG2 ILE 92 3.409 -4.235 11.198 548 HG22 ILE 92 2HG2 ILE 92 4.641 -5.344 10.561 549 HG23 ILE 92 3HG2 ILE 92 4.174 -3.922 9.625 550 HD11 ILE 92 3HD1 ILE 92 1.954 -8.054 8.981 551 HD12 ILE 92 1HD1 ILE 92 1.591 -8.678 10.595 552 HD13 ILE 92 2HD1 ILE 92 0.450 -7.581 9.818 553 H ILE 93 H ILE 93 1.160 -2.165 8.468 554 HA ILE 93 HA ILE 93 2.393 -2.092 5.794 555 HB ILE 93 HB ILE 93 1.383 0.252 7.444 556 HG12 ILE 93 1HG1 ILE 93 -0.255 -1.368 5.440 557 HG13 ILE 93 2HG1 ILE 93 -0.502 -1.367 7.202 558 HG21 ILE 93 1HG2 ILE 93 1.637 -0.084 4.421 559 HG22 ILE 93 2HG2 ILE 93 1.328 1.417 5.304 560 HG23 ILE 93 3HG2 ILE 93 2.900 0.636 5.419 561 HD11 ILE 93 3HD1 ILE 93 -0.872 1.059 5.424 562 HD12 ILE 93 1HD1 ILE 93 -2.121 0.071 6.181 563 HD13 ILE 93 2HD1 ILE 93 -1.017 1.014 7.198 564 H LYS 94 H LYS 94 4.512 -1.564 5.581 565 HA LYS 94 HA LYS 94 6.104 -0.593 7.928 566 HB2 LYS 94 1HB LYS 94 6.661 -2.755 5.869 567 HB3 LYS 94 2HB LYS 94 7.966 -1.869 6.595 568 HG2 LYS 94 1HG LYS 94 7.082 -2.480 8.866 569 HG3 LYS 94 2HG LYS 94 5.887 -3.526 8.079 570 HD2 LYS 94 1HD LYS 94 7.705 -4.883 7.102 571 HD3 LYS 94 2HD LYS 94 8.911 -3.765 7.774 572 HE2 LYS 94 1HE LYS 94 7.943 -4.306 10.071 573 HE3 LYS 94 2HE LYS 94 7.072 -5.646 9.321 574 HZ1 LYS 94 3HZ LYS 94 9.313 -6.157 10.325 575 HZ2 LYS 94 1HZ LYS 94 10.005 -5.302 9.119 576 HZ3 LYS 94 2HZ LYS 94 9.135 -6.665 8.768 577 H TYR 95 H TYR 95 6.424 1.617 7.429 578 HA TYR 95 HA TYR 95 7.248 2.190 4.622 579 HB2 TYR 95 1HB TYR 95 6.101 4.325 4.775 580 HB3 TYR 95 2HB TYR 95 5.051 2.933 4.892 581 HD1 TYR 95 1HD TYR 95 6.642 5.595 7.053 582 HD2 TYR 95 2HD TYR 95 3.686 2.495 6.665 583 HE1 TYR 95 1HE TYR 95 5.626 6.309 9.188 584 HE2 TYR 95 2HE TYR 95 2.641 3.225 8.787 585 HH TYR 95 HH TYR 95 3.454 6.226 10.379 586 H THR 96 H THR 96 8.492 4.293 4.342 587 HA THR 96 HA THR 96 10.094 5.174 6.619 588 HB THR 96 HB THR 96 11.196 3.106 5.713 589 HG1 THR 96 1HG THR 96 13.217 4.432 5.270 590 HG21 THR 96 3HG2 THR 96 10.583 3.430 3.285 591 HG22 THR 96 1HG2 THR 96 12.288 3.100 3.570 592 HG23 THR 96 2HG2 THR 96 11.736 4.753 3.206 593 H SER 97 H SER 97 11.558 6.955 5.803 594 HA SER 97 HA SER 97 10.476 8.393 3.455 595 HB2 SER 97 1HB SER 97 11.375 10.446 4.619 596 HB3 SER 97 2HB SER 97 9.913 9.745 5.285 597 HG SER 97 HG SER 97 12.513 9.678 6.339 598 H GLN 98 H GLN 98 12.992 6.489 4.435 599 HA GLN 98 HA GLN 98 14.261 7.321 1.983 600 HB2 GLN 98 1HB GLN 98 15.962 7.193 4.504 601 HB3 GLN 98 2HB GLN 98 16.562 6.975 2.855 602 HG2 GLN 98 1HG GLN 98 15.598 9.238 2.270 603 HG3 GLN 98 2HG GLN 98 15.331 9.493 4.000 604 HE21 GLN 98 1HE2 GLN 98 16.972 11.030 4.570 605 HE22 GLN 98 2HE2 GLN 98 18.647 10.820 4.116 606 H ARG 99 H ARG 99 14.961 5.547 0.863 607 HA ARG 99 HA ARG 99 14.218 2.936 1.650 608 HB2 ARG 99 1HB ARG 99 16.083 4.044 -0.482 609 HB3 ARG 99 2HB ARG 99 15.958 2.310 -0.229 610 HG2 ARG 99 1HG ARG 99 13.279 3.197 -0.322 611 HG3 ARG 99 2HG ARG 99 14.089 4.113 -1.583 612 HD2 ARG 99 1HD ARG 99 14.155 1.078 -1.221 613 HD3 ARG 99 2HD ARG 99 13.146 1.957 -2.376 614 HE ARG 99 HE ARG 99 15.715 2.761 -2.988 615 HH11 ARG 99 1HH1 ARG 99 13.855 -0.311 -3.007 616 HH12 ARG 99 2HH1 ARG 99 14.766 -0.942 -4.321 617 HH21 ARG 99 1HH2 ARG 99 16.882 1.777 -4.809 618 HH22 ARG 99 2HH2 ARG 99 16.346 0.218 -5.351 619 H ASN 100 H ASN 100 16.882 4.651 2.906 620 HA ASN 100 HA ASN 100 18.212 2.140 3.562 621 HB2 ASN 100 1HB ASN 100 20.216 3.319 4.237 622 HB3 ASN 100 2HB ASN 100 19.782 3.599 2.557 623 HD21 ASN 100 1HD2 ASN 100 18.725 5.409 2.054 624 HD22 ASN 100 2HD2 ASN 100 18.903 6.977 2.880 625 H THR 101 H THR 101 15.910 3.791 4.950 626 HA THR 101 HA THR 101 17.059 3.492 7.703 627 HB THR 101 HB THR 101 15.446 5.241 8.444 628 HG1 THR 101 1HG THR 101 14.908 6.754 6.804 629 HG21 THR 101 3HG2 THR 101 17.882 5.622 8.184 630 HG22 THR 101 1HG2 THR 101 16.917 7.062 7.862 631 HG23 THR 101 2HG2 THR 101 17.608 6.148 6.503 632 H LYS 102 H LYS 102 15.834 2.899 9.392 633 HA LYS 102 HA LYS 102 14.590 0.507 8.994 634 HB2 LYS 102 1HB LYS 102 15.834 1.394 11.015 635 HB3 LYS 102 2HB LYS 102 14.368 2.221 11.531 636 HG2 LYS 102 1HG LYS 102 14.326 -0.745 10.900 637 HG3 LYS 102 2HG LYS 102 15.051 -0.213 12.399 638 HD2 LYS 102 1HD LYS 102 13.100 0.435 13.374 639 HD3 LYS 102 2HD LYS 102 12.306 0.847 11.851 640 HE2 LYS 102 1HE LYS 102 12.057 -1.493 11.245 641 HE3 LYS 102 2HE LYS 102 13.019 -2.008 12.644 642 HZ1 LYS 102 3HZ LYS 102 11.280 -1.186 14.082 643 HZ2 LYS 102 1HZ LYS 102 10.651 -2.251 13.029 644 HZ3 LYS 102 2HZ LYS 102 10.416 -0.610 12.814 645 H LEU 103 H LEU 103 12.482 -0.263 8.839 646 HA LEU 103 HA LEU 103 10.543 1.722 7.980 647 HB2 LEU 103 1HB LEU 103 10.441 -1.287 8.287 648 HB3 LEU 103 2HB LEU 103 9.133 -0.347 7.581 649 HG LEU 103 HG LEU 103 11.910 -0.008 6.415 650 HD11 LEU 103 1HD1 LEU 103 11.564 -1.897 4.945 651 HD12 LEU 103 2HD1 LEU 103 10.122 -2.391 5.866 652 HD13 LEU 103 3HD1 LEU 103 11.734 -2.397 6.632 653 HD21 LEU 103 3HD2 LEU 103 10.727 0.331 4.356 654 HD22 LEU 103 1HD2 LEU 103 9.950 1.321 5.593 655 HD23 LEU 103 2HD2 LEU 103 9.191 -0.195 5.071 656 H LYS 104 H LYS 104 8.641 2.239 8.954 657 HA LYS 104 HA LYS 104 8.460 2.054 11.848 658 HB2 LYS 104 1HB LYS 104 7.053 3.489 9.634 659 HB3 LYS 104 2HB LYS 104 6.028 3.070 10.967 660 HG2 LYS 104 1HG LYS 104 6.786 5.220 11.467 661 HG3 LYS 104 2HG LYS 104 7.681 4.146 12.553 662 HD2 LYS 104 1HD LYS 104 9.593 4.232 10.875 663 HD3 LYS 104 2HD LYS 104 8.698 5.457 9.986 664 HE2 LYS 104 1HE LYS 104 9.699 5.661 12.876 665 HE3 LYS 104 2HE LYS 104 10.420 6.434 11.467 666 HZ1 LYS 104 3HZ LYS 104 8.174 7.583 11.238 667 HZ2 LYS 104 1HZ LYS 104 9.212 8.078 12.395 668 HZ3 LYS 104 2HZ LYS 104 7.958 7.171 12.849 669 H ALA 105 H ALA 105 5.820 1.648 12.452 670 HA ALA 105 HA ALA 105 5.088 -1.042 11.496 671 HB1 ALA 105 1HB ALA 105 4.885 -1.921 13.769 672 HB2 ALA 105 2HB ALA 105 6.559 -1.425 13.483 673 HB3 ALA 105 3HB ALA 105 5.490 -0.400 14.458 674 H LYS 106 H LYS 106 3.156 -0.368 10.582 675 HA LYS 106 HA LYS 106 1.145 0.867 12.405 676 HB2 LYS 106 1HB LYS 106 1.921 2.424 10.657 677 HB3 LYS 106 2HB LYS 106 1.650 1.202 9.421 678 HG2 LYS 106 1HG LYS 106 -0.242 2.364 9.063 679 HG3 LYS 106 2HG LYS 106 -0.872 1.356 10.376 680 HD2 LYS 106 1HD LYS 106 -0.389 3.128 11.975 681 HD3 LYS 106 2HD LYS 106 0.352 4.142 10.732 682 HE2 LYS 106 1HE LYS 106 -1.701 4.481 9.575 683 HE3 LYS 106 2HE LYS 106 -2.535 3.220 10.499 684 HZ1 LYS 106 3HZ LYS 106 -1.568 5.763 11.628 685 HZ2 LYS 106 1HZ LYS 106 -2.391 4.584 12.466 686 HZ3 LYS 106 2HZ LYS 106 -3.136 5.408 11.286 687 H ALA 107 H ALA 107 -0.369 -0.779 12.803 688 HA ALA 107 HA ALA 107 -0.347 -3.149 10.982 689 HB1 ALA 107 1HB ALA 107 -0.325 -4.617 12.936 690 HB2 ALA 107 2HB ALA 107 1.172 -3.670 12.793 691 HB3 ALA 107 3HB ALA 107 -0.062 -3.217 13.995 692 H LEU 108 H LEU 108 -2.665 -3.284 10.169 693 HA LEU 108 HA LEU 108 -4.538 -1.961 12.126 694 HB2 LEU 108 1HB LEU 108 -4.205 -1.628 9.125 695 HB3 LEU 108 2HB LEU 108 -5.482 -0.881 10.088 696 HG LEU 108 HG LEU 108 -2.526 -0.299 10.606 697 HD11 LEU 108 1HD1 LEU 108 -2.860 1.708 9.144 698 HD12 LEU 108 2HD1 LEU 108 -4.423 1.056 8.643 699 HD13 LEU 108 3HD1 LEU 108 -2.940 0.164 8.296 700 HD21 LEU 108 3HD2 LEU 108 -4.126 0.326 12.373 701 HD22 LEU 108 1HD2 LEU 108 -5.078 1.268 11.212 702 HD23 LEU 108 2HD2 LEU 108 -3.408 1.749 11.637 703 H THR 109 H THR 109 -6.884 -2.707 11.777 704 HA THR 109 HA THR 109 -6.789 -5.404 10.740 705 HB THR 109 HB THR 109 -9.292 -5.414 11.202 706 HG1 THR 109 1HG THR 109 -9.833 -3.840 12.782 707 HG21 THR 109 3HG2 THR 109 -7.369 -4.815 13.480 708 HG22 THR 109 1HG2 THR 109 -7.491 -6.370 12.698 709 HG23 THR 109 2HG2 THR 109 -8.841 -5.739 13.598 710 H LEU 110 H LEU 110 -7.740 -6.299 8.819 711 HA LEU 110 HA LEU 110 -7.954 -4.846 6.422 712 HB2 LEU 110 1HB LEU 110 -9.566 -7.209 7.537 713 HB3 LEU 110 2HB LEU 110 -9.708 -6.636 5.894 714 HG LEU 110 HG LEU 110 -7.186 -7.821 7.100 715 HD11 LEU 110 1HD1 LEU 110 -9.175 -8.932 5.060 716 HD12 LEU 110 2HD1 LEU 110 -9.029 -9.449 6.754 717 HD13 LEU 110 3HD1 LEU 110 -7.683 -9.729 5.618 718 HD21 LEU 110 3HD2 LEU 110 -7.848 -6.865 4.296 719 HD22 LEU 110 1HD2 LEU 110 -6.514 -7.962 4.690 720 HD23 LEU 110 2HD2 LEU 110 -6.527 -6.306 5.347 721 H SER 111 H SER 111 -10.451 -5.472 8.860 722 HA SER 111 HA SER 111 -12.536 -4.181 7.424 723 HB2 SER 111 1HB SER 111 -12.310 -5.955 9.450 724 HB3 SER 111 2HB SER 111 -12.655 -4.540 10.413 725 HG SER 111 HG SER 111 -14.575 -4.260 9.348 726 H GLN 112 H GLN 112 -9.916 -2.756 9.360 727 HA GLN 112 HA GLN 112 -11.346 -0.346 10.066 728 HB2 GLN 112 1HB GLN 112 -9.730 -1.205 11.589 729 HB3 GLN 112 2HB GLN 112 -8.587 -1.486 10.326 730 HG2 GLN 112 1HG GLN 112 -7.901 0.504 11.444 731 HG3 GLN 112 2HG GLN 112 -8.431 0.760 9.793 732 HE21 GLN 112 1HE2 GLN 112 -10.098 0.495 13.007 733 HE22 GLN 112 2HE2 GLN 112 -11.120 1.906 12.750 734 H LEU 113 H LEU 113 -8.739 -1.338 7.736 735 HA LEU 113 HA LEU 113 -8.682 1.120 6.323 736 HB2 LEU 113 1HB LEU 113 -8.171 -1.776 5.455 737 HB3 LEU 113 2HB LEU 113 -8.067 -0.441 4.315 738 HG LEU 113 HG LEU 113 -5.892 -1.026 4.999 739 HD11 LEU 113 1HD1 LEU 113 -6.300 1.387 4.618 740 HD12 LEU 113 2HD1 LEU 113 -4.978 1.094 5.755 741 HD13 LEU 113 3HD1 LEU 113 -6.550 1.616 6.363 742 HD21 LEU 113 3HD2 LEU 113 -6.465 -2.019 7.197 743 HD22 LEU 113 1HD2 LEU 113 -6.600 -0.388 7.870 744 HD23 LEU 113 2HD2 LEU 113 -5.046 -0.954 7.222 745 H LYS 114 H LYS 114 -10.900 -1.640 5.863 746 HA LYS 114 HA LYS 114 -12.226 -0.602 3.533 747 HB2 LYS 114 1HB LYS 114 -12.636 -2.888 4.360 748 HB3 LYS 114 2HB LYS 114 -13.354 -2.246 5.844 749 HG2 LYS 114 1HG LYS 114 -15.117 -1.095 4.459 750 HG3 LYS 114 2HG LYS 114 -14.419 -1.825 3.004 751 HD2 LYS 114 1HD LYS 114 -15.340 -3.603 5.267 752 HD3 LYS 114 2HD LYS 114 -16.549 -2.759 4.292 753 HE2 LYS 114 1HE LYS 114 -15.291 -3.653 2.221 754 HE3 LYS 114 2HE LYS 114 -14.506 -4.786 3.335 755 HZ1 LYS 114 3HZ LYS 114 -17.432 -4.511 3.025 756 HZ2 LYS 114 1HZ LYS 114 -16.630 -5.676 3.883 757 HZ3 LYS 114 2HZ LYS 114 -16.498 -5.607 2.222 758 H LYS 115 H LYS 115 -12.681 0.115 7.015 759 HA LYS 115 HA LYS 115 -15.079 1.691 6.583 760 HB2 LYS 115 1HB LYS 115 -13.949 0.368 8.764 761 HB3 LYS 115 2HB LYS 115 -13.529 2.016 9.062 762 HG2 LYS 115 1HG LYS 115 -15.616 2.277 9.951 763 HG3 LYS 115 2HG LYS 115 -16.259 2.168 8.321 764 HD2 LYS 115 1HD LYS 115 -15.767 -0.221 10.129 765 HD3 LYS 115 2HD LYS 115 -17.307 0.589 9.953 766 HE2 LYS 115 1HE LYS 115 -17.336 0.087 7.531 767 HE3 LYS 115 2HE LYS 115 -15.785 -0.765 7.684 768 HZ1 LYS 115 3HZ LYS 115 -18.302 -1.536 9.055 769 HZ2 LYS 115 1HZ LYS 115 -16.855 -2.305 9.173 770 HZ3 LYS 115 2HZ LYS 115 -17.664 -2.301 7.750 771 H GLU 116 H GLU 116 -11.632 2.307 6.600 772 HA GLU 116 HA GLU 116 -11.941 5.210 6.773 773 HB2 GLU 116 1HB GLU 116 -9.571 3.475 5.976 774 HB3 GLU 116 2HB GLU 116 -9.518 5.220 6.245 775 HG2 GLU 116 1HG GLU 116 -10.748 4.362 8.572 776 HG3 GLU 116 2HG GLU 116 -9.693 2.974 8.171 777 H PHE 117 H PHE 117 -10.919 3.056 4.070 778 HA PHE 117 HA PHE 117 -11.388 5.386 2.279 779 HB2 PHE 117 1HB PHE 117 -9.566 3.024 1.858 780 HB3 PHE 117 2HB PHE 117 -9.598 4.539 0.963 781 HD1 PHE 117 2HD PHE 117 -9.357 6.749 2.548 782 HD2 PHE 117 1HD PHE 117 -7.934 2.776 3.549 783 HE1 PHE 117 2HE PHE 117 -7.813 7.711 4.227 784 HE2 PHE 117 1HE PHE 117 -6.429 3.765 5.228 785 HZ PHE 117 HZ PHE 117 -6.361 6.221 5.582 786 H TYR 118 H TYR 118 -13.060 2.595 2.952 787 HA TYR 118 HA TYR 118 -14.075 2.446 0.181 788 HB2 TYR 118 1HB TYR 118 -12.254 0.666 0.939 789 HB3 TYR 118 2HB TYR 118 -13.662 -0.134 1.606 790 HD1 TYR 118 1HD TYR 118 -12.361 1.486 -1.549 791 HD2 TYR 118 2HD TYR 118 -15.046 -1.434 0.135 792 HE1 TYR 118 1HE TYR 118 -12.673 0.468 -3.825 793 HE2 TYR 118 2HE TYR 118 -15.400 -2.391 -2.124 794 HH TYR 118 HH TYR 118 -13.534 -1.685 -4.966 795 H GLN 119 H GLN 119 -15.173 3.626 2.709 796 HA GLN 119 HA GLN 119 -17.502 1.963 3.200 797 HB2 GLN 119 1HB GLN 119 -18.267 3.675 4.605 798 HB3 GLN 119 2HB GLN 119 -16.542 3.418 4.889 799 HG2 GLN 119 1HG GLN 119 -17.466 5.725 3.134 800 HG3 GLN 119 2HG GLN 119 -17.600 5.800 4.873 801 HE21 GLN 119 1HE2 GLN 119 -15.085 5.801 2.216 802 HE22 GLN 119 2HE2 GLN 119 -13.816 6.015 3.410 803 H THR 120 H THR 120 -16.812 4.495 0.789 804 HA THR 120 HA THR 120 -19.584 5.281 0.599 805 HB THR 120 HB THR 120 -18.792 6.897 -1.014 806 HG1 THR 120 1HG THR 120 -16.577 6.953 -1.489 807 HG21 THR 120 3HG2 THR 120 -18.410 7.279 1.493 808 HG22 THR 120 1HG2 THR 120 -17.335 8.174 0.417 809 HG23 THR 120 2HG2 THR 120 -16.731 6.742 1.230 810 H ARG 121 H ARG 121 -19.911 5.658 -2.147 811 HA ARG 121 HA ARG 121 -20.053 2.888 -3.235 812 HB2 ARG 121 1HB ARG 121 -22.313 3.503 -2.738 813 HB3 ARG 121 2HB ARG 121 -22.100 5.134 -3.404 814 HG2 ARG 121 1HG ARG 121 -22.048 4.360 -5.630 815 HG3 ARG 121 2HG ARG 121 -21.843 2.672 -5.159 816 HD2 ARG 121 1HD ARG 121 -24.333 4.185 -4.340 817 HD3 ARG 121 2HD ARG 121 -24.186 3.614 -5.990 818 HE ARG 121 HE ARG 121 -24.734 2.008 -3.659 819 HH11 ARG 121 1HH1 ARG 121 -23.679 1.940 -7.051 820 HH12 ARG 121 2HH1 ARG 121 -23.717 0.239 -7.202 821 HH21 ARG 121 1HH2 ARG 121 -24.914 -0.342 -3.890 822 HH22 ARG 121 2HH2 ARG 121 -24.406 -1.039 -5.404 823 H SER 122 H SER 122 -19.344 6.311 -3.864 824 HA SER 122 HA SER 122 -18.745 6.164 -6.650 825 HB2 SER 122 1HB SER 122 -17.400 8.255 -5.772 826 HB3 SER 122 2HB SER 122 -19.173 8.276 -5.690 827 HG SER 122 HG SER 122 -17.901 8.936 -3.777 828 H GLN 123 H GLN 123 -16.789 5.659 -3.652 829 HA GLN 123 HA GLN 123 -14.294 5.825 -4.992 830 HB2 GLN 123 1HB GLN 123 -13.349 5.263 -2.999 831 HB3 GLN 123 2HB GLN 123 -14.887 5.831 -2.436 832 HG2 GLN 123 1HG GLN 123 -13.994 2.934 -2.742 833 HG3 GLN 123 2HG GLN 123 -14.156 3.845 -1.269 834 HE21 GLN 123 1HE2 GLN 123 -15.540 1.710 -0.754 835 HE22 GLN 123 2HE2 GLN 123 -17.242 2.097 -1.001 836 H LYS 124 H LYS 124 -16.520 3.188 -4.791 837 HA LYS 124 HA LYS 124 -14.755 1.004 -5.523 838 HB2 LYS 124 1HB LYS 124 -17.754 1.460 -5.771 839 HB3 LYS 124 2HB LYS 124 -16.989 -0.038 -6.278 840 HG2 LYS 124 1HG LYS 124 -16.708 -0.830 -4.228 841 HG3 LYS 124 2HG LYS 124 -16.172 0.718 -3.551 842 HD2 LYS 124 1HD LYS 124 -18.436 1.490 -3.336 843 HD3 LYS 124 2HD LYS 124 -19.064 0.071 -4.193 844 HE2 LYS 124 1HE LYS 124 -17.556 -0.043 -1.541 845 HE3 LYS 124 2HE LYS 124 -19.318 0.010 -1.684 846 HZ1 LYS 124 3HZ LYS 124 -19.154 -2.027 -3.048 847 HZ2 LYS 124 1HZ LYS 124 -18.700 -2.261 -1.514 848 HZ3 LYS 124 2HZ LYS 124 -17.554 -2.148 -2.700 849 H ARG 125 H ARG 125 -15.567 3.706 -7.322 850 HA ARG 125 HA ARG 125 -14.773 2.420 -9.879 851 HB2 ARG 125 1HB ARG 125 -15.552 5.242 -8.989 852 HB3 ARG 125 2HB ARG 125 -14.557 4.970 -10.419 853 HG2 ARG 125 1HG ARG 125 -16.919 5.297 -10.911 854 HG3 ARG 125 2HG ARG 125 -16.274 3.752 -11.500 855 HD2 ARG 125 1HD ARG 125 -17.364 2.637 -9.517 856 HD3 ARG 125 2HD ARG 125 -18.062 4.199 -9.067 857 HE ARG 125 HE ARG 125 -19.318 4.202 -11.141 858 HH11 ARG 125 1HH1 ARG 125 -17.896 1.059 -10.319 859 HH12 ARG 125 2HH1 ARG 125 -18.983 0.132 -11.265 860 HH21 ARG 125 1HH2 ARG 125 -20.430 3.099 -12.689 861 HH22 ARG 125 2HH2 ARG 125 -20.371 1.387 -12.878 862 H GLU 126 H GLU 126 -13.575 5.290 -8.153 863 HA GLU 126 HA GLU 126 -11.150 5.143 -9.296 864 HB2 GLU 126 1HB GLU 126 -12.035 6.381 -6.643 865 HB3 GLU 126 2HB GLU 126 -10.404 6.611 -7.273 866 HG2 GLU 126 1HG GLU 126 -11.687 8.466 -7.952 867 HG3 GLU 126 2HG GLU 126 -11.281 7.488 -9.360 868 H VAL 127 H VAL 127 -11.708 4.128 -5.968 869 HA VAL 127 HA VAL 127 -9.005 3.394 -5.396 870 HB VAL 127 HB VAL 127 -11.610 2.445 -4.113 871 HG11 VAL 127 1HG1 VAL 127 -10.248 2.203 -2.023 872 HG12 VAL 127 2HG1 VAL 127 -9.845 1.014 -3.263 873 HG13 VAL 127 3HG1 VAL 127 -8.781 2.406 -2.993 874 HG21 VAL 127 3HG2 VAL 127 -11.344 4.936 -4.064 875 HG22 VAL 127 1HG2 VAL 127 -11.226 4.216 -2.458 876 HG23 VAL 127 2HG2 VAL 127 -9.757 4.733 -3.310 877 H ASP 128 H ASP 128 -11.481 1.708 -7.160 878 HA ASP 128 HA ASP 128 -10.265 -0.991 -6.936 879 HB2 ASP 128 1HB ASP 128 -12.834 -0.160 -6.981 880 HB3 ASP 128 2HB ASP 128 -12.600 -0.279 -8.722 881 H ASP 129 H ASP 129 -10.890 1.632 -9.255 882 HA ASP 129 HA ASP 129 -9.678 0.635 -11.588 883 HB2 ASP 129 1HB ASP 129 -10.056 3.442 -10.459 884 HB3 ASP 129 2HB ASP 129 -9.131 3.174 -11.916 885 H TYR 130 H TYR 130 -8.271 2.390 -8.819 886 HA TYR 130 HA TYR 130 -5.603 2.709 -9.744 887 HB2 TYR 130 1HB TYR 130 -6.654 2.296 -6.949 888 HB3 TYR 130 2HB TYR 130 -5.057 2.916 -7.357 889 HD1 TYR 130 2HD TYR 130 -6.797 4.542 -9.860 890 HD2 TYR 130 1HD TYR 130 -6.759 4.402 -5.533 891 HE1 TYR 130 2HE TYR 130 -7.614 6.804 -9.803 892 HE2 TYR 130 1HE TYR 130 -7.750 6.638 -5.469 893 HH TYR 130 HH TYR 130 -7.951 8.637 -8.456 894 H VAL 131 H VAL 131 -7.206 -0.140 -8.363 895 HA VAL 131 HA VAL 131 -4.758 -1.637 -8.000 896 HB VAL 131 HB VAL 131 -7.617 -2.641 -8.299 897 HG11 VAL 131 1HG1 VAL 131 -6.703 -4.528 -6.850 898 HG12 VAL 131 2HG1 VAL 131 -6.064 -4.474 -8.497 899 HG13 VAL 131 3HG1 VAL 131 -5.090 -3.845 -7.153 900 HG21 VAL 131 3HG2 VAL 131 -7.394 -0.975 -6.428 901 HG22 VAL 131 1HG2 VAL 131 -7.843 -2.584 -5.927 902 HG23 VAL 131 2HG2 VAL 131 -6.163 -2.030 -5.711 903 H ALA 132 H ALA 132 -6.518 -0.675 -10.822 904 HA ALA 132 HA ALA 132 -4.989 -2.633 -12.438 905 HB1 ALA 132 1HB ALA 132 -7.390 -3.015 -12.685 906 HB2 ALA 132 2HB ALA 132 -7.658 -1.292 -13.071 907 HB3 ALA 132 3HB ALA 132 -6.732 -2.340 -14.180 908 H GLY 133 H GLY 133 -4.421 0.190 -11.256 909 HA2 GLY 133 1HA GLY 133 -3.520 1.563 -13.768 910 HA3 GLY 133 2HA GLY 133 -4.111 2.412 -12.338 911 H LEU 134 H LEU 134 -2.661 0.016 -10.865 912 HA LEU 134 HA LEU 134 0.100 0.999 -10.784 913 HB2 LEU 134 1HB LEU 134 0.427 -0.903 -9.208 914 HB3 LEU 134 2HB LEU 134 -0.819 0.228 -8.712 915 HG LEU 134 HG LEU 134 -2.513 -1.479 -9.775 916 HD11 LEU 134 1HD1 LEU 134 -0.857 -3.011 -10.866 917 HD12 LEU 134 2HD1 LEU 134 -1.875 -3.809 -9.707 918 HD13 LEU 134 3HD1 LEU 134 -0.188 -3.393 -9.279 919 HD21 LEU 134 3HD2 LEU 134 -0.998 -2.102 -7.212 920 HD22 LEU 134 1HD2 LEU 134 -2.620 -2.693 -7.640 921 HD23 LEU 134 2HD2 LEU 134 -2.353 -0.962 -7.397 922 H ARG 135 H ARG 135 1.794 -0.594 -11.261 923 HA ARG 135 HA ARG 135 1.239 -2.426 -13.554 924 HB2 ARG 135 1HB ARG 135 3.750 -0.953 -12.598 925 HB3 ARG 135 2HB ARG 135 3.732 -2.066 -13.924 926 HG2 ARG 135 1HG ARG 135 2.257 -0.610 -15.232 927 HG3 ARG 135 2HG ARG 135 2.077 0.502 -13.870 928 HD2 ARG 135 1HD ARG 135 3.965 1.574 -14.339 929 HD3 ARG 135 2HD ARG 135 4.906 0.114 -14.333 930 HE ARG 135 HE ARG 135 3.969 1.610 -16.583 931 HH11 ARG 135 1HH1 ARG 135 4.458 -1.807 -15.672 932 HH12 ARG 135 2HH1 ARG 135 4.858 -2.304 -17.276 933 HH21 ARG 135 1HH2 ARG 135 4.694 0.887 -18.716 934 HH22 ARG 135 2HH2 ARG 135 4.860 -0.814 -19.020 935 H THR 136 H THR 136 2.561 -4.433 -13.436 936 HA THR 136 HA THR 136 3.501 -5.115 -10.690 937 HB THR 136 HB THR 136 1.889 -6.993 -12.408 938 HG1 THR 136 1HG THR 136 0.198 -6.553 -10.891 939 HG21 THR 136 3HG2 THR 136 3.102 -8.279 -10.824 940 HG22 THR 136 1HG2 THR 136 1.564 -8.041 -10.008 941 HG23 THR 136 2HG2 THR 136 2.971 -7.046 -9.563 942 H GLU 137 H GLU 137 4.561 -4.422 -13.481 943 HA GLU 137 HA GLU 137 6.503 -4.672 -14.579 944 HB2 GLU 137 1HB GLU 137 7.506 -5.769 -12.495 945 HB3 GLU 137 2HB GLU 137 7.135 -7.324 -13.237 946 HG2 GLU 137 1HG GLU 137 8.417 -6.580 -15.274 947 HG3 GLU 137 2HG GLU 137 8.852 -5.096 -14.400 Start of MODEL 5 1 H1 GLY 19 H GLY 19 -21.796 -10.150 -1.709 2 HA2 GLY 19 1HA GLY 19 -23.001 -9.811 0.443 3 HA3 GLY 19 2HA GLY 19 -22.809 -11.561 0.685 4 H HIS 20 H HIS 20 -21.148 -11.954 2.122 5 HA HIS 20 HA HIS 20 -19.397 -9.990 2.945 6 HB2 HIS 20 1HB HIS 20 -19.426 -12.971 3.286 7 HB3 HIS 20 2HB HIS 20 -18.048 -12.028 3.868 8 HD1 HIS 20 1HD HIS 20 -21.858 -12.314 4.539 9 HD2 HIS 20 2HD HIS 20 -18.332 -10.420 5.894 10 HE1 HIS 20 1HE HIS 20 -22.433 -11.164 6.749 11 H MET 21 H MET 21 -18.725 -12.355 0.369 12 HA MET 21 HA MET 21 -17.085 -12.407 -1.193 13 HB2 MET 21 1HB MET 21 -17.634 -9.585 -0.701 14 HB3 MET 21 2HB MET 21 -15.932 -9.766 -1.058 15 HG2 MET 21 1HG MET 21 -16.432 -10.850 -3.165 16 HG3 MET 21 2HG MET 21 -18.142 -10.995 -2.743 17 HE1 MET 21 3HE MET 21 -16.057 -6.946 -3.641 18 HE2 MET 21 1HE MET 21 -16.032 -7.648 -2.011 19 HE3 MET 21 2HE MET 21 -15.224 -8.488 -3.345 20 H LYS 22 H LYS 22 -14.493 -11.391 -1.392 21 HA LYS 22 HA LYS 22 -13.173 -11.597 1.207 22 HB2 LYS 22 1HB LYS 22 -12.442 -13.259 -1.254 23 HB3 LYS 22 2HB LYS 22 -11.260 -12.842 -0.008 24 HG2 LYS 22 1HG LYS 22 -12.690 -13.877 1.733 25 HG3 LYS 22 2HG LYS 22 -13.858 -14.334 0.481 26 HD2 LYS 22 1HD LYS 22 -12.544 -16.228 1.086 27 HD3 LYS 22 2HD LYS 22 -12.181 -15.773 -0.590 28 HE2 LYS 22 1HE LYS 22 -10.040 -15.043 -0.104 29 HE3 LYS 22 2HE LYS 22 -10.432 -14.630 1.561 30 HZ1 LYS 22 3HZ LYS 22 -10.301 -16.817 2.212 31 HZ2 LYS 22 1HZ LYS 22 -9.018 -16.620 1.216 32 HZ3 LYS 22 2HZ LYS 22 -10.343 -17.444 0.684 33 H PHE 23 H PHE 23 -10.850 -10.815 0.873 34 HA PHE 23 HA PHE 23 -10.831 -8.483 -0.970 35 HB2 PHE 23 1HB PHE 23 -9.662 -8.971 1.773 36 HB3 PHE 23 2HB PHE 23 -8.840 -7.907 0.654 37 HD1 PHE 23 1HD PHE 23 -12.577 -8.262 1.203 38 HD2 PHE 23 2HD PHE 23 -9.099 -5.708 1.379 39 HE1 PHE 23 1HE PHE 23 -14.002 -6.306 1.566 40 HE2 PHE 23 2HE PHE 23 -10.524 -3.818 1.960 41 HZ PHE 23 HZ PHE 23 -12.988 -4.061 2.013 42 H THR 24 H THR 24 -8.437 -8.009 -1.648 43 HA THR 24 HA THR 24 -6.882 -10.468 -2.152 44 HB THR 24 HB THR 24 -6.513 -9.411 -4.513 45 HG1 THR 24 1HG THR 24 -8.263 -8.295 -5.299 46 HG21 THR 24 3HG2 THR 24 -9.281 -10.560 -3.923 47 HG22 THR 24 1HG2 THR 24 -7.811 -11.513 -4.112 48 HG23 THR 24 2HG2 THR 24 -8.425 -10.585 -5.480 49 H ASP 25 H ASP 25 -4.628 -10.065 -2.366 50 HA ASP 25 HA ASP 25 -3.613 -8.193 -0.595 51 HB2 ASP 25 1HB ASP 25 -2.244 -9.619 -2.916 52 HB3 ASP 25 2HB ASP 25 -1.369 -8.644 -1.716 53 H GLN 26 H GLN 26 -3.941 -7.945 -4.066 54 HA GLN 26 HA GLN 26 -2.743 -5.547 -4.785 55 HB2 GLN 26 1HB GLN 26 -5.391 -6.843 -5.615 56 HB3 GLN 26 2HB GLN 26 -4.635 -5.497 -6.456 57 HG2 GLN 26 1HG GLN 26 -2.678 -6.920 -7.007 58 HG3 GLN 26 2HG GLN 26 -3.359 -8.228 -6.080 59 HE21 GLN 26 1HE2 GLN 26 -4.823 -5.935 -8.539 60 HE22 GLN 26 2HE2 GLN 26 -5.387 -7.181 -9.600 61 H GLN 27 H GLN 27 -6.122 -6.003 -3.761 62 HA GLN 27 HA GLN 27 -6.870 -3.238 -3.903 63 HB2 GLN 27 1HB GLN 27 -8.101 -5.699 -2.604 64 HB3 GLN 27 2HB GLN 27 -8.951 -4.181 -2.780 65 HG2 GLN 27 1HG GLN 27 -7.825 -5.687 -5.196 66 HG3 GLN 27 2HG GLN 27 -9.352 -6.129 -4.475 67 HE21 GLN 27 1HE2 GLN 27 -9.009 -5.294 -7.221 68 HE22 GLN 27 2HE2 GLN 27 -9.857 -3.803 -7.445 69 H ILE 28 H ILE 28 -5.926 -5.452 -1.251 70 HA ILE 28 HA ILE 28 -6.269 -3.572 0.882 71 HB ILE 28 HB ILE 28 -4.388 -5.955 0.605 72 HG12 ILE 28 1HG1 ILE 28 -6.969 -5.824 2.216 73 HG13 ILE 28 2HG1 ILE 28 -6.965 -6.331 0.530 74 HG21 ILE 28 1HG2 ILE 28 -5.040 -4.127 2.941 75 HG22 ILE 28 2HG2 ILE 28 -4.520 -5.782 3.216 76 HG23 ILE 28 3HG2 ILE 28 -3.451 -4.660 2.359 77 HD11 ILE 28 3HD1 ILE 28 -5.500 -7.717 2.802 78 HD12 ILE 28 1HD1 ILE 28 -6.890 -8.307 1.889 79 HD13 ILE 28 2HD1 ILE 28 -5.324 -8.129 1.080 80 H GLY 29 H GLY 29 -3.628 -4.175 -1.454 81 HA2 GLY 29 1HA GLY 29 -1.596 -2.645 -0.317 82 HA3 GLY 29 2HA GLY 29 -1.836 -2.900 -2.056 83 H VAL 30 H VAL 30 -4.153 -1.595 -2.644 84 HA VAL 30 HA VAL 30 -3.415 1.158 -2.731 85 HB VAL 30 HB VAL 30 -6.073 -0.210 -3.227 86 HG11 VAL 30 1HG1 VAL 30 -6.760 1.824 -4.411 87 HG12 VAL 30 2HG1 VAL 30 -6.459 2.208 -2.715 88 HG13 VAL 30 3HG1 VAL 30 -5.250 2.645 -3.947 89 HG21 VAL 30 3HG2 VAL 30 -5.412 0.203 -5.611 90 HG22 VAL 30 1HG2 VAL 30 -3.861 0.848 -5.059 91 HG23 VAL 30 2HG2 VAL 30 -4.258 -0.858 -4.781 92 H LEU 31 H LEU 31 -5.793 -0.551 -0.684 93 HA LEU 31 HA LEU 31 -6.682 1.663 0.828 94 HB2 LEU 31 1HB LEU 31 -6.711 -1.308 0.997 95 HB3 LEU 31 2HB LEU 31 -6.740 -0.534 2.561 96 HG LEU 31 HG LEU 31 -8.777 0.603 2.119 97 HD11 LEU 31 1HD1 LEU 31 -10.026 0.406 -0.029 98 HD12 LEU 31 2HD1 LEU 31 -8.600 -0.374 -0.769 99 HD13 LEU 31 3HD1 LEU 31 -8.537 1.316 -0.226 100 HD21 LEU 31 3HD2 LEU 31 -10.308 -1.276 1.657 101 HD22 LEU 31 1HD2 LEU 31 -8.970 -1.809 2.686 102 HD23 LEU 31 2HD2 LEU 31 -8.960 -2.208 0.962 103 H ALA 32 H ALA 32 -3.959 -0.546 1.614 104 HA ALA 32 HA ALA 32 -3.367 0.752 4.091 105 HB1 ALA 32 1HB ALA 32 -1.796 -1.094 2.272 106 HB2 ALA 32 2HB ALA 32 -1.136 -0.460 3.787 107 HB3 ALA 32 3HB ALA 32 -2.595 -1.474 3.803 108 H GLY 33 H GLY 33 -2.046 1.301 0.742 109 HA2 GLY 33 1HA GLY 33 -0.138 3.282 1.673 110 HA3 GLY 33 2HA GLY 33 -0.691 3.070 0.012 111 H LEU 34 H LEU 34 -3.619 3.425 0.801 112 HA LEU 34 HA LEU 34 -3.669 6.223 0.600 113 HB2 LEU 34 1HB LEU 34 -5.428 4.178 0.258 114 HB3 LEU 34 2HB LEU 34 -6.061 4.866 1.755 115 HG LEU 34 HG LEU 34 -6.222 7.078 0.541 116 HD11 LEU 34 1HD1 LEU 34 -6.056 7.030 -1.971 117 HD12 LEU 34 2HD1 LEU 34 -5.335 5.388 -1.851 118 HD13 LEU 34 3HD1 LEU 34 -4.493 6.792 -1.208 119 HD21 LEU 34 3HD2 LEU 34 -8.100 5.464 0.682 120 HD22 LEU 34 1HD2 LEU 34 -7.553 4.638 -0.794 121 HD23 LEU 34 2HD2 LEU 34 -8.137 6.330 -0.837 122 H ALA 35 H ALA 35 -3.440 4.218 3.426 123 HA ALA 35 HA ALA 35 -4.018 6.407 5.298 124 HB1 ALA 35 1HB ALA 35 -4.452 4.114 5.998 125 HB2 ALA 35 2HB ALA 35 -2.754 3.672 5.733 126 HB3 ALA 35 3HB ALA 35 -3.200 4.836 7.010 127 H ILE 36 H ILE 36 -1.195 5.493 3.378 128 HA ILE 36 HA ILE 36 0.562 7.169 5.038 129 HB ILE 36 HB ILE 36 1.089 4.280 4.222 130 HG12 ILE 36 1HG1 ILE 36 2.037 4.285 6.650 131 HG13 ILE 36 2HG1 ILE 36 1.199 5.811 6.903 132 HG21 ILE 36 1HG2 ILE 36 3.094 5.630 3.578 133 HG22 ILE 36 2HG2 ILE 36 3.115 6.382 5.181 134 HG23 ILE 36 3HG2 ILE 36 3.418 4.653 4.974 135 HD11 ILE 36 3HD1 ILE 36 -0.847 4.787 6.965 136 HD12 ILE 36 1HD1 ILE 36 -0.328 3.392 5.981 137 HD13 ILE 36 2HD1 ILE 36 0.185 3.554 7.682 138 H SER 37 H SER 37 0.651 8.736 3.490 139 HA SER 37 HA SER 37 1.340 9.858 1.624 140 HB2 SER 37 1HB SER 37 2.881 7.363 1.014 141 HB3 SER 37 2HB SER 37 3.126 8.864 0.176 142 HG SER 37 HG SER 37 3.343 8.495 3.005 143 HA PRO 38 HA PRO 38 -2.032 7.721 -0.858 144 HB2 PRO 38 1HB PRO 38 -3.933 9.746 -0.579 145 HB3 PRO 38 2HB PRO 38 -3.805 8.344 0.511 146 HG2 PRO 38 1HG PRO 38 -2.665 11.112 0.929 147 HG3 PRO 38 2HG PRO 38 -3.550 10.084 2.096 148 HD2 PRO 38 1HD PRO 38 -0.879 10.253 2.136 149 HD3 PRO 38 2HD PRO 38 -1.707 8.686 2.424 150 H GLU 39 H GLU 39 -1.158 11.257 -0.669 151 HA GLU 39 HA GLU 39 -1.891 12.029 -3.244 152 HB2 GLU 39 1HB GLU 39 0.458 12.922 -1.517 153 HB3 GLU 39 2HB GLU 39 0.013 13.729 -3.018 154 HG2 GLU 39 1HG GLU 39 -1.780 13.418 -0.582 155 HG3 GLU 39 2HG GLU 39 -0.846 14.860 -0.981 156 H TRP 40 H TRP 40 1.378 10.959 -2.254 157 HA TRP 40 HA TRP 40 2.592 10.754 -4.744 158 HB2 TRP 40 1HB TRP 40 3.850 10.517 -2.704 159 HB3 TRP 40 2HB TRP 40 2.890 9.134 -2.191 160 HD1 TRP 40 HD TRP 40 5.678 10.031 -4.652 161 HE1 TRP 40 1HE TRP 40 6.819 7.933 -5.496 162 HE3 TRP 40 3HE TRP 40 2.663 6.608 -2.366 163 HZ2 TRP 40 2HZ TRP 40 6.488 5.012 -5.132 164 HZ3 TRP 40 3HZ TRP 40 3.083 4.206 -2.611 165 HH2 TRP 40 HH TRP 40 4.958 3.364 -3.974 166 H LEU 41 H LEU 41 0.429 8.380 -3.130 167 HA LEU 41 HA LEU 41 1.036 6.277 -4.998 168 HB2 LEU 41 1HB LEU 41 -0.087 5.029 -3.536 169 HB3 LEU 41 2HB LEU 41 -0.234 6.433 -2.578 170 HG LEU 41 HG LEU 41 -2.573 6.798 -3.443 171 HD11 LEU 41 1HD1 LEU 41 -2.502 5.470 -5.583 172 HD12 LEU 41 2HD1 LEU 41 -3.707 4.852 -4.477 173 HD13 LEU 41 3HD1 LEU 41 -2.151 4.013 -4.640 174 HD21 LEU 41 3HD2 LEU 41 -2.274 5.757 -1.320 175 HD22 LEU 41 1HD2 LEU 41 -1.595 4.313 -2.016 176 HD23 LEU 41 2HD2 LEU 41 -3.317 4.611 -2.176 177 H LYS 42 H LYS 42 -1.707 8.560 -4.662 178 HA LYS 42 HA LYS 42 -3.137 7.767 -7.011 179 HB2 LYS 42 1HB LYS 42 -2.960 10.459 -5.551 180 HB3 LYS 42 2HB LYS 42 -4.077 10.102 -6.878 181 HG2 LYS 42 1HG LYS 42 -5.080 8.273 -5.544 182 HG3 LYS 42 2HG LYS 42 -4.046 8.680 -4.172 183 HD2 LYS 42 1HD LYS 42 -5.066 10.792 -3.848 184 HD3 LYS 42 2HD LYS 42 -5.761 10.811 -5.486 185 HE2 LYS 42 1HE LYS 42 -7.166 8.818 -4.808 186 HE3 LYS 42 2HE LYS 42 -6.641 9.102 -3.139 187 HZ1 LYS 42 3HZ LYS 42 -7.733 11.152 -3.132 188 HZ2 LYS 42 1HZ LYS 42 -8.773 10.106 -3.865 189 HZ3 LYS 42 2HZ LYS 42 -7.979 11.194 -4.776 190 H GLN 43 H GLN 43 -0.541 10.234 -6.551 191 HA GLN 43 HA GLN 43 -0.600 11.352 -9.151 192 HB2 GLN 43 1HB GLN 43 1.494 10.966 -6.986 193 HB3 GLN 43 2HB GLN 43 1.923 11.653 -8.538 194 HG2 GLN 43 1HG GLN 43 0.480 13.540 -8.264 195 HG3 GLN 43 2HG GLN 43 -0.299 12.824 -6.847 196 HE21 GLN 43 1HE2 GLN 43 3.256 12.924 -7.586 197 HE22 GLN 43 2HE2 GLN 43 3.663 13.912 -6.204 198 H ASN 44 H ASN 44 1.357 8.598 -7.860 199 HA ASN 44 HA ASN 44 2.544 8.199 -10.450 200 HB2 ASN 44 1HB ASN 44 2.601 6.555 -7.906 201 HB3 ASN 44 2HB ASN 44 3.371 6.016 -9.406 202 HD21 ASN 44 1HD2 ASN 44 3.429 8.543 -6.889 203 HD22 ASN 44 2HD2 ASN 44 4.882 9.333 -7.461 204 H ILE 45 H ILE 45 -0.465 6.917 -9.017 205 HA ILE 45 HA ILE 45 -0.828 5.000 -11.200 206 HB ILE 45 HB ILE 45 -2.865 6.346 -9.386 207 HG12 ILE 45 1HG1 ILE 45 -1.237 4.868 -8.166 208 HG13 ILE 45 2HG1 ILE 45 -2.910 4.408 -8.036 209 HG21 ILE 45 1HG2 ILE 45 -4.218 5.663 -11.092 210 HG22 ILE 45 2HG2 ILE 45 -3.086 4.426 -11.673 211 HG23 ILE 45 3HG2 ILE 45 -4.098 4.098 -10.304 212 HD11 ILE 45 3HD1 ILE 45 -0.765 3.101 -9.737 213 HD12 ILE 45 1HD1 ILE 45 -1.601 2.447 -8.304 214 HD13 ILE 45 2HD1 ILE 45 -2.471 2.650 -9.815 215 H ALA 46 H ALA 46 -1.692 8.482 -10.661 216 HA ALA 46 HA ALA 46 -3.290 8.765 -12.964 217 HB1 ALA 46 1HB ALA 46 -1.624 10.908 -11.618 218 HB2 ALA 46 2HB ALA 46 -3.111 11.106 -12.581 219 HB3 ALA 46 3HB ALA 46 -3.192 10.300 -11.001 220 H ALA 47 H ALA 47 0.045 8.181 -12.852 221 HA ALA 47 HA ALA 47 0.191 8.805 -15.734 222 HB1 ALA 47 1HB ALA 47 2.617 9.267 -15.480 223 HB2 ALA 47 2HB ALA 47 1.596 10.423 -14.604 224 HB3 ALA 47 3HB ALA 47 2.426 9.132 -13.705 225 H ASN 48 H ASN 48 -0.445 6.389 -13.925 226 HA ASN 48 HA ASN 48 -0.060 4.215 -13.625 227 HB2 ASN 48 1HB ASN 48 -0.980 4.674 -15.992 228 HB3 ASN 48 2HB ASN 48 0.596 4.142 -16.555 229 HD21 ASN 48 1HD2 ASN 48 1.234 1.881 -15.546 230 HD22 ASN 48 2HD2 ASN 48 -0.086 0.686 -15.619 231 H GLN 49 H GLN 49 2.271 5.767 -13.072 232 HA GLN 49 HA GLN 49 4.668 4.317 -13.987 233 HB2 GLN 49 1HB GLN 49 4.307 6.632 -12.008 234 HB3 GLN 49 2HB GLN 49 5.861 5.973 -12.531 235 HG2 GLN 49 1HG GLN 49 3.859 7.443 -14.255 236 HG3 GLN 49 2HG GLN 49 5.448 7.997 -13.754 237 HE21 GLN 49 1HE2 GLN 49 3.684 5.967 -15.988 238 HE22 GLN 49 2HE2 GLN 49 5.075 5.413 -16.920 239 H LEU 50 H LEU 50 2.384 3.738 -11.597 240 HA LEU 50 HA LEU 50 4.252 3.127 -9.415 241 HB2 LEU 50 1HB LEU 50 1.806 3.921 -9.215 242 HB3 LEU 50 2HB LEU 50 1.364 2.298 -9.716 243 HG LEU 50 HG LEU 50 2.898 1.530 -7.696 244 HD11 LEU 50 1HD1 LEU 50 3.158 3.116 -5.896 245 HD12 LEU 50 2HD1 LEU 50 2.266 4.377 -6.776 246 HD13 LEU 50 3HD1 LEU 50 3.868 3.854 -7.323 247 HD21 LEU 50 3HD2 LEU 50 1.103 1.698 -6.141 248 HD22 LEU 50 1HD2 LEU 50 0.444 1.329 -7.721 249 HD23 LEU 50 2HD2 LEU 50 0.313 2.994 -7.072 250 H VAL 51 H VAL 51 4.864 0.980 -8.682 251 HA VAL 51 HA VAL 51 4.067 -1.318 -10.378 252 HB VAL 51 HB VAL 51 6.844 -0.921 -9.196 253 HG11 VAL 51 1HG1 VAL 51 7.454 -2.924 -10.535 254 HG12 VAL 51 2HG1 VAL 51 6.272 -3.338 -9.330 255 HG13 VAL 51 3HG1 VAL 51 5.756 -3.133 -11.021 256 HG21 VAL 51 3HG2 VAL 51 7.589 -0.887 -11.579 257 HG22 VAL 51 1HG2 VAL 51 5.903 -0.840 -12.099 258 HG23 VAL 51 2HG2 VAL 51 6.609 0.516 -11.160 259 H TYR 52 H TYR 52 4.073 -3.323 -9.106 260 HA TYR 52 HA TYR 52 3.993 -3.165 -6.152 261 HB2 TYR 52 1HB TYR 52 1.676 -3.229 -6.895 262 HB3 TYR 52 2HB TYR 52 2.056 -4.371 -8.156 263 HD1 TYR 52 2HD TYR 52 2.127 -4.199 -4.374 264 HD2 TYR 52 1HD TYR 52 1.494 -6.597 -7.902 265 HE1 TYR 52 2HE TYR 52 1.412 -6.137 -2.975 266 HE2 TYR 52 1HE TYR 52 0.945 -8.520 -6.541 267 HH TYR 52 HH TYR 52 0.466 -9.282 -4.405 268 H GLY 53 H GLY 53 4.988 -5.060 -5.198 269 HA2 GLY 53 1HA GLY 53 5.464 -7.419 -6.797 270 HA3 GLY 53 2HA GLY 53 6.954 -6.513 -6.463 271 H ILE 54 H ILE 54 6.980 -8.956 -5.438 272 HA ILE 54 HA ILE 54 6.444 -8.636 -2.536 273 HB ILE 54 HB ILE 54 6.913 -11.167 -4.156 274 HG12 ILE 54 1HG1 ILE 54 4.614 -10.230 -4.473 275 HG13 ILE 54 2HG1 ILE 54 4.664 -11.831 -3.766 276 HG21 ILE 54 1HG2 ILE 54 6.413 -10.845 -1.163 277 HG22 ILE 54 2HG2 ILE 54 6.444 -12.394 -2.035 278 HG23 ILE 54 3HG2 ILE 54 7.892 -11.427 -1.932 279 HD11 ILE 54 3HD1 ILE 54 4.202 -9.251 -2.222 280 HD12 ILE 54 1HD1 ILE 54 2.949 -10.405 -2.724 281 HD13 ILE 54 2HD1 ILE 54 4.163 -10.892 -1.528 282 H VAL 55 H VAL 55 8.234 -8.906 -1.261 283 HA VAL 55 HA VAL 55 10.790 -8.117 -2.071 284 HB VAL 55 HB VAL 55 9.627 -9.616 0.296 285 HG11 VAL 55 1HG1 VAL 55 12.540 -9.073 -0.203 286 HG12 VAL 55 2HG1 VAL 55 11.888 -8.822 1.444 287 HG13 VAL 55 3HG1 VAL 55 11.765 -10.394 0.663 288 HG21 VAL 55 3HG2 VAL 55 10.776 -6.824 -0.066 289 HG22 VAL 55 1HG2 VAL 55 9.044 -7.215 -0.075 290 HG23 VAL 55 2HG2 VAL 55 9.978 -7.441 1.396 291 H LYS 56 H LYS 56 10.235 -11.452 -0.869 292 HA LYS 56 HA LYS 56 11.252 -13.347 -1.175 293 HB2 LYS 56 1HB LYS 56 11.406 -12.399 -4.056 294 HB3 LYS 56 2HB LYS 56 11.702 -14.036 -3.534 295 HG2 LYS 56 1HG LYS 56 9.316 -13.738 -2.349 296 HG3 LYS 56 2HG LYS 56 9.117 -12.488 -3.593 297 HD2 LYS 56 1HD LYS 56 9.919 -15.363 -4.139 298 HD3 LYS 56 2HD LYS 56 8.250 -14.783 -4.135 299 HE2 LYS 56 1HE LYS 56 8.768 -13.203 -5.953 300 HE3 LYS 56 2HE LYS 56 10.467 -13.727 -5.958 301 HZ1 LYS 56 3HZ LYS 56 8.166 -15.498 -6.480 302 HZ2 LYS 56 1HZ LYS 56 9.775 -15.893 -6.687 303 HZ3 LYS 56 2HZ LYS 56 9.017 -14.812 -7.658 304 HA PRO 57 HA PRO 57 15.659 -12.847 -0.960 305 HB2 PRO 57 1HB PRO 57 16.676 -15.309 -1.351 306 HB3 PRO 57 2HB PRO 57 15.778 -14.822 0.113 307 HG2 PRO 57 1HG PRO 57 14.795 -16.463 -2.198 308 HG3 PRO 57 2HG PRO 57 14.415 -16.586 -0.465 309 HD2 PRO 57 1HD PRO 57 12.871 -15.333 -2.448 310 HD3 PRO 57 2HD PRO 57 12.646 -15.062 -0.720 311 H SER 58 H SER 58 14.994 -11.656 -2.982 312 HA SER 58 HA SER 58 16.477 -12.521 -5.431 313 HB2 SER 58 1HB SER 58 13.738 -11.206 -5.255 314 HB3 SER 58 2HB SER 58 14.567 -11.720 -6.725 315 HG SER 58 HG SER 58 13.037 -13.163 -6.168 316 H ASP 59 H ASP 59 15.844 -9.884 -3.185 317 HA ASP 59 HA ASP 59 17.117 -7.951 -5.037 318 HB2 ASP 59 1HB ASP 59 14.496 -8.091 -5.129 319 HB3 ASP 59 2HB ASP 59 14.547 -7.330 -3.544 320 H THR 60 H THR 60 17.641 -5.869 -3.709 321 HA THR 60 HA THR 60 18.754 -6.634 -1.097 322 HB THR 60 HB THR 60 18.709 -3.935 -2.516 323 HG1 THR 60 1HG THR 60 21.083 -4.730 -2.471 324 HG21 THR 60 3HG2 THR 60 20.515 -3.384 -0.883 325 HG22 THR 60 1HG2 THR 60 20.227 -4.929 -0.055 326 HG23 THR 60 2HG2 THR 60 18.968 -3.671 -0.083 327 H VAL 61 H VAL 61 17.514 -6.634 0.687 328 HA VAL 61 HA VAL 61 15.405 -4.644 1.026 329 HB VAL 61 HB VAL 61 13.842 -6.393 1.822 330 HG11 VAL 61 1HG1 VAL 61 13.749 -5.414 -0.492 331 HG12 VAL 61 2HG1 VAL 61 14.619 -6.848 -1.093 332 HG13 VAL 61 3HG1 VAL 61 13.020 -7.002 -0.350 333 HG21 VAL 61 3HG2 VAL 61 15.779 -8.377 0.545 334 HG22 VAL 61 1HG2 VAL 61 15.533 -8.179 2.283 335 HG23 VAL 61 2HG2 VAL 61 14.224 -8.760 1.280 336 HA PRO 62 HA PRO 62 17.033 -4.952 5.192 337 HB2 PRO 62 1HB PRO 62 14.923 -4.178 6.758 338 HB3 PRO 62 2HB PRO 62 15.824 -3.036 5.721 339 HG2 PRO 62 1HG PRO 62 13.204 -4.450 5.159 340 HG3 PRO 62 2HG PRO 62 13.629 -2.717 4.890 341 HD2 PRO 62 1HD PRO 62 13.675 -4.575 2.892 342 HD3 PRO 62 2HD PRO 62 14.759 -3.183 2.931 343 H ALA 63 H ALA 63 16.170 -5.964 7.418 344 HA ALA 63 HA ALA 63 15.407 -8.729 6.909 345 HB1 ALA 63 1HB ALA 63 15.497 -8.807 9.390 346 HB2 ALA 63 2HB ALA 63 16.990 -8.170 8.660 347 HB3 ALA 63 3HB ALA 63 15.808 -7.081 9.436 348 H GLY 64 H GLY 64 13.539 -9.712 8.051 349 HA2 GLY 64 1HA GLY 64 11.477 -9.735 9.079 350 HA3 GLY 64 2HA GLY 64 11.566 -7.991 9.237 351 H VAL 65 H VAL 65 11.876 -9.217 5.959 352 HA VAL 65 HA VAL 65 9.024 -8.669 5.403 353 HB VAL 65 HB VAL 65 9.763 -7.076 3.584 354 HG11 VAL 65 1HG1 VAL 65 10.376 -6.151 6.380 355 HG12 VAL 65 2HG1 VAL 65 9.815 -5.175 5.012 356 HG13 VAL 65 3HG1 VAL 65 8.748 -6.386 5.721 357 HG21 VAL 65 3HG2 VAL 65 12.379 -6.840 5.108 358 HG22 VAL 65 1HG2 VAL 65 12.207 -7.754 3.591 359 HG23 VAL 65 2HG2 VAL 65 11.874 -6.023 3.613 360 H ASP 66 H ASP 66 10.817 -11.123 5.194 361 HA ASP 66 HA ASP 66 11.755 -11.628 2.641 362 HB2 ASP 66 1HB ASP 66 12.238 -12.756 4.807 363 HB3 ASP 66 2HB ASP 66 10.675 -13.552 4.716 364 H ASP 67 H ASP 67 8.594 -11.454 3.395 365 HA ASP 67 HA ASP 67 7.725 -12.430 0.726 366 HB2 ASP 67 1HB ASP 67 7.481 -14.419 2.207 367 HB3 ASP 67 2HB ASP 67 6.422 -13.491 3.272 368 H TYR 68 H TYR 68 7.923 -9.859 2.365 369 HA TYR 68 HA TYR 68 5.142 -8.962 2.659 370 HB2 TYR 68 1HB TYR 68 7.815 -7.659 3.000 371 HB3 TYR 68 2HB TYR 68 6.388 -6.685 2.771 372 HD1 TYR 68 2HD TYR 68 6.770 -9.872 4.816 373 HD2 TYR 68 1HD TYR 68 5.861 -5.654 4.762 374 HE1 TYR 68 2HE TYR 68 6.024 -10.017 7.143 375 HE2 TYR 68 1HE TYR 68 5.092 -5.794 7.114 376 HH TYR 68 HH TYR 68 5.185 -8.834 9.013 377 H SER 69 H SER 69 4.095 -7.499 1.263 378 HA SER 69 HA SER 69 4.912 -7.346 -1.502 379 HB2 SER 69 1HB SER 69 2.796 -6.043 0.282 380 HB3 SER 69 2HB SER 69 2.880 -5.900 -1.464 381 HG SER 69 HG SER 69 2.411 -8.111 -1.649 382 H TYR 70 H TYR 70 5.425 -5.276 -2.485 383 HA TYR 70 HA TYR 70 5.705 -2.967 -0.724 384 HB2 TYR 70 1HB TYR 70 7.778 -2.209 -1.663 385 HB3 TYR 70 2HB TYR 70 8.009 -3.769 -0.923 386 HD1 TYR 70 2HD TYR 70 8.177 -5.866 -2.419 387 HD2 TYR 70 1HD TYR 70 8.397 -1.830 -3.948 388 HE1 TYR 70 2HE TYR 70 9.369 -6.685 -4.435 389 HE2 TYR 70 1HE TYR 70 9.587 -2.664 -5.955 390 HH TYR 70 HH TYR 70 10.720 -5.965 -6.294 391 H LEU 71 H LEU 71 5.757 -0.944 -1.940 392 HA LEU 71 HA LEU 71 4.722 -1.015 -4.692 393 HB2 LEU 71 1HB LEU 71 3.540 0.625 -2.416 394 HB3 LEU 71 2HB LEU 71 3.213 0.916 -4.115 395 HG LEU 71 HG LEU 71 2.662 -1.840 -3.042 396 HD11 LEU 71 1HD1 LEU 71 1.658 -0.351 -1.377 397 HD12 LEU 71 2HD1 LEU 71 0.407 -1.190 -2.334 398 HD13 LEU 71 3HD1 LEU 71 0.800 0.514 -2.645 399 HD21 LEU 71 3HD2 LEU 71 1.159 -0.195 -5.073 400 HD22 LEU 71 1HD2 LEU 71 0.920 -1.910 -4.694 401 HD23 LEU 71 2HD2 LEU 71 2.427 -1.368 -5.464 402 H VAL 72 H VAL 72 5.721 0.530 -5.862 403 HA VAL 72 HA VAL 72 7.193 2.759 -4.734 404 HB VAL 72 HB VAL 72 8.650 0.807 -4.380 405 HG11 VAL 72 1HG1 VAL 72 9.768 -0.321 -6.208 406 HG12 VAL 72 2HG1 VAL 72 8.031 -0.628 -6.187 407 HG13 VAL 72 3HG1 VAL 72 8.712 0.487 -7.383 408 HG21 VAL 72 3HG2 VAL 72 9.862 2.657 -6.491 409 HG22 VAL 72 1HG2 VAL 72 9.676 3.053 -4.769 410 HG23 VAL 72 2HG2 VAL 72 10.720 1.717 -5.265 411 H ALA 73 H ALA 73 8.393 3.649 -7.108 412 HA ALA 73 HA ALA 73 6.490 3.059 -9.276 413 HB1 ALA 73 1HB ALA 73 5.641 5.089 -8.127 414 HB2 ALA 73 2HB ALA 73 7.203 5.878 -8.400 415 HB3 ALA 73 3HB ALA 73 6.182 5.406 -9.779 416 H ALA 74 H ALA 74 7.244 3.728 -11.304 417 HA ALA 74 HA ALA 74 9.640 2.332 -11.681 418 HB1 ALA 74 1HB ALA 74 7.780 3.815 -13.573 419 HB2 ALA 74 2HB ALA 74 9.154 2.891 -14.147 420 HB3 ALA 74 3HB ALA 74 7.865 2.058 -13.257 421 H ASP 75 H ASP 75 9.234 5.694 -11.410 422 HA ASP 75 HA ASP 75 12.031 6.068 -12.366 423 HB2 ASP 75 1HB ASP 75 9.617 7.606 -13.008 424 HB3 ASP 75 2HB ASP 75 10.911 8.612 -12.350 425 H ASP 76 H ASP 76 9.809 6.392 -9.704 426 HA ASP 76 HA ASP 76 11.601 8.154 -8.206 427 HB2 ASP 76 1HB ASP 76 9.081 6.654 -7.432 428 HB3 ASP 76 2HB ASP 76 9.938 7.771 -6.375 429 H GLN 77 H GLN 77 12.950 5.777 -9.016 430 HA GLN 77 HA GLN 77 12.657 3.543 -7.433 431 HB2 GLN 77 1HB GLN 77 14.900 4.589 -9.114 432 HB3 GLN 77 2HB GLN 77 15.356 3.422 -7.881 433 HG2 GLN 77 1HG GLN 77 13.456 1.944 -8.708 434 HG3 GLN 77 2HG GLN 77 13.361 2.998 -10.127 435 HE21 GLN 77 1HE2 GLN 77 13.928 0.201 -10.150 436 HE22 GLN 77 2HE2 GLN 77 15.592 -0.070 -10.647 437 H ASP 78 H ASP 78 14.980 6.182 -6.666 438 HA ASP 78 HA ASP 78 15.332 5.003 -3.943 439 HB2 ASP 78 1HB ASP 78 16.886 7.016 -5.558 440 HB3 ASP 78 2HB ASP 78 17.033 6.993 -3.823 441 H GLY 79 H GLY 79 13.052 6.885 -5.266 442 HA2 GLY 79 1HA GLY 79 13.216 9.347 -3.806 443 HA3 GLY 79 2HA GLY 79 11.867 8.780 -4.792 444 H THR 80 H THR 80 10.638 6.785 -3.666 445 HA THR 80 HA THR 80 10.499 7.014 -0.746 446 HB THR 80 HB THR 80 7.930 7.222 -2.319 447 HG1 THR 80 1HG THR 80 8.830 9.136 -2.956 448 HG21 THR 80 3HG2 THR 80 7.083 8.272 -0.264 449 HG22 THR 80 1HG2 THR 80 8.717 8.239 0.462 450 HG23 THR 80 2HG2 THR 80 7.847 6.719 0.143 451 H ILE 81 H ILE 81 9.319 4.996 0.149 452 HA ILE 81 HA ILE 81 8.372 3.112 -1.825 453 HB ILE 81 HB ILE 81 10.950 2.880 -1.678 454 HG12 ILE 81 1HG1 ILE 81 9.070 0.511 -1.397 455 HG13 ILE 81 2HG1 ILE 81 9.648 1.374 -2.757 456 HG21 ILE 81 1HG2 ILE 81 10.358 1.451 0.936 457 HG22 ILE 81 2HG2 ILE 81 11.933 1.615 0.135 458 HG23 ILE 81 3HG2 ILE 81 11.141 3.040 0.809 459 HD11 ILE 81 3HD1 ILE 81 10.807 -0.733 -2.649 460 HD12 ILE 81 1HD1 ILE 81 11.951 0.608 -2.438 461 HD13 ILE 81 2HD1 ILE 81 11.430 -0.349 -1.036 462 H ILE 82 H ILE 82 6.883 1.596 -0.723 463 HA ILE 82 HA ILE 82 6.913 1.571 2.237 464 HB ILE 82 HB ILE 82 4.388 1.792 0.552 465 HG12 ILE 82 1HG1 ILE 82 5.467 3.967 2.374 466 HG13 ILE 82 2HG1 ILE 82 5.766 4.008 0.658 467 HG21 ILE 82 1HG2 ILE 82 4.962 1.541 3.542 468 HG22 ILE 82 2HG2 ILE 82 3.461 2.271 3.005 469 HG23 ILE 82 3HG2 ILE 82 3.859 0.620 2.542 470 HD11 ILE 82 3HD1 ILE 82 3.887 5.395 1.164 471 HD12 ILE 82 1HD1 ILE 82 3.516 4.091 0.029 472 HD13 ILE 82 2HD1 ILE 82 2.955 3.988 1.722 473 H PHE 83 H PHE 83 6.147 -0.417 3.137 474 HA PHE 83 HA PHE 83 5.872 -2.724 1.295 475 HB2 PHE 83 1HB PHE 83 7.448 -2.487 3.888 476 HB3 PHE 83 2HB PHE 83 7.067 -3.995 3.140 477 HD1 PHE 83 2HD PHE 83 8.890 -0.734 2.535 478 HD2 PHE 83 1HD PHE 83 8.450 -4.905 1.427 479 HE1 PHE 83 2HE PHE 83 11.038 -0.655 1.313 480 HE2 PHE 83 1HE PHE 83 10.546 -4.732 0.106 481 HZ PHE 83 HZ PHE 83 11.846 -2.656 0.073 482 H PHE 84 H PHE 84 4.633 -4.575 2.358 483 HA PHE 84 HA PHE 84 3.289 -4.066 4.842 484 HB2 PHE 84 1HB PHE 84 0.974 -4.260 3.930 485 HB3 PHE 84 2HB PHE 84 1.755 -2.756 3.596 486 HD1 PHE 84 1HD PHE 84 2.907 -2.520 1.157 487 HD2 PHE 84 2HD PHE 84 -0.133 -5.430 2.177 488 HE1 PHE 84 1HE PHE 84 2.369 -2.792 -1.193 489 HE2 PHE 84 2HE PHE 84 -0.735 -5.600 -0.211 490 HZ PHE 84 HZ PHE 84 0.490 -4.276 -1.913 491 H LYS 85 H LYS 85 2.027 -5.912 5.575 492 HA LYS 85 HA LYS 85 1.719 -8.118 3.701 493 HB2 LYS 85 1HB LYS 85 3.814 -8.558 5.135 494 HB3 LYS 85 2HB LYS 85 2.713 -8.773 6.498 495 HG2 LYS 85 1HG LYS 85 3.071 -10.940 5.629 496 HG3 LYS 85 2HG LYS 85 1.492 -10.487 4.983 497 HD2 LYS 85 1HD LYS 85 3.190 -9.530 3.032 498 HD3 LYS 85 2HD LYS 85 4.117 -10.904 3.621 499 HE2 LYS 85 1HE LYS 85 1.197 -11.107 2.779 500 HE3 LYS 85 2HE LYS 85 2.505 -11.175 1.593 501 HZ1 LYS 85 3HZ LYS 85 1.699 -13.357 2.469 502 HZ2 LYS 85 1HZ LYS 85 2.447 -13.017 3.895 503 HZ3 LYS 85 2HZ LYS 85 3.320 -13.135 2.509 504 H ALA 86 H ALA 86 -0.474 -8.347 3.662 505 HA ALA 86 HA ALA 86 -2.019 -7.698 6.100 506 HB1 ALA 86 1HB ALA 86 -2.861 -6.837 4.046 507 HB2 ALA 86 2HB ALA 86 -3.073 -8.490 3.402 508 HB3 ALA 86 3HB ALA 86 -3.991 -7.949 4.815 509 H GLU 87 H GLU 87 -1.989 -9.135 7.523 510 HA GLU 87 HA GLU 87 -1.707 -12.077 6.987 511 HB2 GLU 87 1HB GLU 87 -0.868 -10.239 9.270 512 HB3 GLU 87 2HB GLU 87 -1.194 -11.947 9.569 513 HG2 GLU 87 1HG GLU 87 0.827 -11.011 7.499 514 HG3 GLU 87 2HG GLU 87 1.226 -11.335 9.181 515 H GLY 88 H GLY 88 -3.959 -12.306 6.475 516 HA2 GLY 88 1HA GLY 88 -6.126 -12.769 7.048 517 HA3 GLY 88 2HA GLY 88 -5.604 -12.756 8.745 518 H GLN 89 H GLN 89 -7.185 -11.601 9.663 519 HA GLN 89 HA GLN 89 -8.463 -9.317 8.651 520 HB2 GLN 89 1HB GLN 89 -8.244 -10.498 11.390 521 HB3 GLN 89 2HB GLN 89 -9.112 -9.034 11.168 522 HG2 GLN 89 1HG GLN 89 -10.083 -10.763 9.115 523 HG3 GLN 89 2HG GLN 89 -9.946 -11.751 10.550 524 HE21 GLN 89 1HE2 GLN 89 -10.828 -8.243 10.602 525 HE22 GLN 89 2HE2 GLN 89 -12.450 -8.536 11.188 526 H THR 90 H THR 90 -5.280 -9.062 9.097 527 HA THR 90 HA THR 90 -5.420 -6.318 9.970 528 HB THR 90 HB THR 90 -3.363 -7.986 11.393 529 HG1 THR 90 1HG THR 90 -5.037 -9.039 12.101 530 HG21 THR 90 3HG2 THR 90 -3.567 -6.248 13.115 531 HG22 THR 90 1HG2 THR 90 -4.902 -5.483 12.224 532 HG23 THR 90 2HG2 THR 90 -3.258 -5.496 11.548 533 H VAL 91 H VAL 91 -3.546 -5.091 9.237 534 HA VAL 91 HA VAL 91 -1.471 -6.609 7.728 535 HB VAL 91 HB VAL 91 -3.122 -5.740 6.351 536 HG11 VAL 91 1HG1 VAL 91 -2.703 -2.945 7.103 537 HG12 VAL 91 2HG1 VAL 91 -3.597 -3.586 5.702 538 HG13 VAL 91 3HG1 VAL 91 -4.136 -3.988 7.318 539 HG21 VAL 91 3HG2 VAL 91 -0.723 -3.897 5.905 540 HG22 VAL 91 1HG2 VAL 91 -0.663 -5.611 5.527 541 HG23 VAL 91 2HG2 VAL 91 -1.773 -4.578 4.640 542 H ILE 92 H ILE 92 0.500 -6.336 8.336 543 HA ILE 92 HA ILE 92 1.284 -4.006 9.961 544 HB ILE 92 HB ILE 92 3.075 -6.196 8.892 545 HG12 ILE 92 1HG1 ILE 92 1.470 -7.470 10.085 546 HG13 ILE 92 2HG1 ILE 92 2.907 -7.308 11.084 547 HG21 ILE 92 1HG2 ILE 92 3.346 -4.328 11.283 548 HG22 ILE 92 2HG2 ILE 92 4.516 -5.571 10.763 549 HG23 ILE 92 3HG2 ILE 92 4.189 -4.169 9.732 550 HD11 ILE 92 3HD1 ILE 92 1.789 -5.553 12.445 551 HD12 ILE 92 1HD1 ILE 92 0.313 -5.808 11.480 552 HD13 ILE 92 2HD1 ILE 92 0.962 -7.113 12.469 553 H ILE 93 H ILE 93 1.072 -2.285 8.637 554 HA ILE 93 HA ILE 93 2.242 -1.986 5.976 555 HB ILE 93 HB ILE 93 1.310 0.041 8.070 556 HG12 ILE 93 1HG1 ILE 93 -0.177 -1.231 5.739 557 HG13 ILE 93 2HG1 ILE 93 -0.579 -1.331 7.449 558 HG21 ILE 93 1HG2 ILE 93 1.533 1.742 6.521 559 HG22 ILE 93 2HG2 ILE 93 2.940 0.756 6.090 560 HG23 ILE 93 3HG2 ILE 93 1.469 0.670 5.135 561 HD11 ILE 93 3HD1 ILE 93 -0.837 1.102 5.658 562 HD12 ILE 93 1HD1 ILE 93 -2.114 0.214 6.492 563 HD13 ILE 93 2HD1 ILE 93 -0.945 1.186 7.425 564 H LYS 94 H LYS 94 4.383 -1.657 5.703 565 HA LYS 94 HA LYS 94 6.019 -0.762 8.021 566 HB2 LYS 94 1HB LYS 94 6.567 -3.017 6.033 567 HB3 LYS 94 2HB LYS 94 7.868 -2.135 6.759 568 HG2 LYS 94 1HG LYS 94 6.910 -2.673 9.065 569 HG3 LYS 94 2HG LYS 94 5.816 -3.809 8.232 570 HD2 LYS 94 1HD LYS 94 7.735 -5.059 7.349 571 HD3 LYS 94 2HD LYS 94 8.854 -3.832 7.961 572 HE2 LYS 94 1HE LYS 94 8.085 -4.388 10.305 573 HE3 LYS 94 2HE LYS 94 7.174 -5.751 9.624 574 HZ1 LYS 94 3HZ LYS 94 9.194 -6.711 8.863 575 HZ2 LYS 94 1HZ LYS 94 9.406 -6.373 10.445 576 HZ3 LYS 94 2HZ LYS 94 10.109 -5.401 9.293 577 H TYR 95 H TYR 95 6.138 1.442 7.392 578 HA TYR 95 HA TYR 95 6.928 1.994 4.563 579 HB2 TYR 95 1HB TYR 95 5.927 4.190 4.862 580 HB3 TYR 95 2HB TYR 95 4.761 2.913 5.117 581 HD1 TYR 95 2HD TYR 95 3.847 2.400 7.211 582 HD2 TYR 95 1HD TYR 95 6.544 5.699 6.752 583 HE1 TYR 95 2HE TYR 95 3.122 3.292 9.463 584 HE2 TYR 95 1HE TYR 95 5.864 6.592 8.968 585 HH TYR 95 HH TYR 95 3.802 4.865 11.245 586 H THR 96 H THR 96 8.266 3.944 4.218 587 HA THR 96 HA THR 96 9.705 4.987 6.481 588 HB THR 96 HB THR 96 11.059 3.016 5.905 589 HG1 THR 96 1HG THR 96 12.965 4.428 5.139 590 HG21 THR 96 3HG2 THR 96 12.206 2.784 3.757 591 HG22 THR 96 1HG2 THR 96 11.359 4.205 3.113 592 HG23 THR 96 2HG2 THR 96 10.466 2.732 3.508 593 H SER 97 H SER 97 10.995 6.890 5.659 594 HA SER 97 HA SER 97 9.717 8.215 3.348 595 HB2 SER 97 1HB SER 97 11.085 10.200 4.469 596 HB3 SER 97 2HB SER 97 9.527 9.702 5.112 597 HG SER 97 HG SER 97 12.105 9.097 6.107 598 H GLN 98 H GLN 98 12.400 6.428 4.187 599 HA GLN 98 HA GLN 98 13.869 7.397 1.829 600 HB2 GLN 98 1HB GLN 98 15.296 7.047 4.483 601 HB3 GLN 98 2HB GLN 98 15.999 7.375 2.901 602 HG2 GLN 98 1HG GLN 98 15.997 9.459 3.871 603 HG3 GLN 98 2HG GLN 98 14.577 9.478 2.823 604 HE21 GLN 98 1HE2 GLN 98 13.851 11.263 4.099 605 HE22 GLN 98 2HE2 GLN 98 13.172 11.116 5.705 606 H ARG 99 H ARG 99 14.488 5.764 0.676 607 HA ARG 99 HA ARG 99 13.951 3.058 1.122 608 HB2 ARG 99 1HB ARG 99 14.383 4.174 -1.026 609 HB3 ARG 99 2HB ARG 99 16.117 4.230 -0.660 610 HG2 ARG 99 1HG ARG 99 16.328 1.848 -0.807 611 HG3 ARG 99 2HG ARG 99 14.559 1.601 -0.643 612 HD2 ARG 99 1HD ARG 99 14.163 2.647 -2.791 613 HD3 ARG 99 2HD ARG 99 15.905 2.915 -3.023 614 HE ARG 99 HE ARG 99 16.118 0.387 -2.795 615 HH11 ARG 99 1HH1 ARG 99 13.665 2.006 -4.781 616 HH12 ARG 99 2HH1 ARG 99 13.261 0.525 -5.592 617 HH21 ARG 99 1HH2 ARG 99 15.587 -1.498 -4.030 618 HH22 ARG 99 2HH2 ARG 99 14.372 -1.336 -5.223 619 H ASN 100 H ASN 100 16.749 4.826 2.111 620 HA ASN 100 HA ASN 100 18.156 2.495 2.927 621 HB2 ASN 100 1HB ASN 100 20.047 3.703 3.411 622 HB3 ASN 100 2HB ASN 100 19.276 4.707 2.181 623 HD21 ASN 100 1HD2 ASN 100 17.468 6.033 3.382 624 HD22 ASN 100 2HD2 ASN 100 18.059 7.120 4.652 625 H THR 101 H THR 101 15.750 3.660 4.608 626 HA THR 101 HA THR 101 17.050 3.000 7.255 627 HB THR 101 HB THR 101 15.185 4.550 8.217 628 HG1 THR 101 1HG THR 101 14.964 6.327 6.597 629 HG21 THR 101 3HG2 THR 101 16.671 6.489 7.990 630 HG22 THR 101 1HG2 THR 101 17.569 5.668 6.693 631 HG23 THR 101 2HG2 THR 101 17.577 5.018 8.355 632 H LYS 102 H LYS 102 15.742 2.253 9.057 633 HA LYS 102 HA LYS 102 14.345 -0.086 8.312 634 HB2 LYS 102 1HB LYS 102 15.601 0.513 10.544 635 HB3 LYS 102 2HB LYS 102 14.103 1.216 11.058 636 HG2 LYS 102 1HG LYS 102 13.729 -1.502 9.901 637 HG3 LYS 102 2HG LYS 102 14.865 -1.517 11.238 638 HD2 LYS 102 1HD LYS 102 13.278 -0.761 12.801 639 HD3 LYS 102 2HD LYS 102 12.250 -0.059 11.552 640 HE2 LYS 102 1HE LYS 102 11.774 -2.435 10.728 641 HE3 LYS 102 2HE LYS 102 12.587 -3.020 12.189 642 HZ1 LYS 102 3HZ LYS 102 10.192 -2.834 12.545 643 HZ2 LYS 102 1HZ LYS 102 10.228 -1.240 12.094 644 HZ3 LYS 102 2HZ LYS 102 10.957 -1.748 13.486 645 H LEU 103 H LEU 103 12.111 -0.629 8.709 646 HA LEU 103 HA LEU 103 10.392 1.551 7.867 647 HB2 LEU 103 1HB LEU 103 9.649 -1.344 8.357 648 HB3 LEU 103 2HB LEU 103 8.730 -0.150 7.480 649 HG LEU 103 HG LEU 103 9.669 -1.590 5.861 650 HD11 LEU 103 1HD1 LEU 103 11.479 0.839 5.809 651 HD12 LEU 103 2HD1 LEU 103 9.788 0.785 5.219 652 HD13 LEU 103 3HD1 LEU 103 11.042 -0.214 4.455 653 HD21 LEU 103 3HD2 LEU 103 12.537 -1.206 6.519 654 HD22 LEU 103 1HD2 LEU 103 11.633 -2.597 5.900 655 HD23 LEU 103 2HD2 LEU 103 11.590 -2.241 7.614 656 H LYS 104 H LYS 104 8.707 2.375 8.949 657 HA LYS 104 HA LYS 104 8.326 2.095 11.829 658 HB2 LYS 104 1HB LYS 104 6.776 3.395 9.549 659 HB3 LYS 104 2HB LYS 104 6.133 3.318 11.176 660 HG2 LYS 104 1HG LYS 104 7.062 5.405 11.158 661 HG3 LYS 104 2HG LYS 104 8.292 4.443 11.972 662 HD2 LYS 104 1HD LYS 104 9.665 4.412 9.946 663 HD3 LYS 104 2HD LYS 104 8.361 5.198 9.027 664 HE2 LYS 104 1HE LYS 104 8.516 7.171 10.571 665 HE3 LYS 104 2HE LYS 104 9.830 6.375 11.433 666 HZ1 LYS 104 3HZ LYS 104 11.066 6.413 9.277 667 HZ2 LYS 104 1HZ LYS 104 10.754 7.910 9.902 668 HZ3 LYS 104 2HZ LYS 104 9.850 7.342 8.662 669 H ALA 105 H ALA 105 5.949 1.549 12.504 670 HA ALA 105 HA ALA 105 4.894 -0.786 10.972 671 HB1 ALA 105 1HB ALA 105 4.523 -2.029 13.059 672 HB2 ALA 105 2HB ALA 105 6.253 -1.731 12.798 673 HB3 ALA 105 3HB ALA 105 5.352 -0.767 13.988 674 H LYS 106 H LYS 106 2.810 -0.412 10.524 675 HA LYS 106 HA LYS 106 1.036 0.664 12.650 676 HB2 LYS 106 1HB LYS 106 1.404 1.909 10.021 677 HB3 LYS 106 2HB LYS 106 -0.158 1.156 10.105 678 HG2 LYS 106 1HG LYS 106 -0.123 2.422 12.540 679 HG3 LYS 106 2HG LYS 106 0.885 3.512 11.591 680 HD2 LYS 106 1HD LYS 106 -1.041 3.349 9.848 681 HD3 LYS 106 2HD LYS 106 -1.989 2.681 11.165 682 HE2 LYS 106 1HE LYS 106 -0.547 5.299 11.449 683 HE3 LYS 106 2HE LYS 106 -2.046 5.258 10.556 684 HZ1 LYS 106 3HZ LYS 106 -2.228 5.855 12.969 685 HZ2 LYS 106 1HZ LYS 106 -1.882 4.303 13.351 686 HZ3 LYS 106 2HZ LYS 106 -3.251 4.726 12.490 687 H ALA 107 H ALA 107 -0.396 -1.042 13.082 688 HA ALA 107 HA ALA 107 -0.575 -3.232 11.077 689 HB1 ALA 107 1HB ALA 107 0.158 -3.997 13.232 690 HB2 ALA 107 2HB ALA 107 -1.253 -3.238 14.009 691 HB3 ALA 107 3HB ALA 107 -1.474 -4.591 12.878 692 H LEU 108 H LEU 108 -2.801 -3.196 9.813 693 HA LEU 108 HA LEU 108 -4.833 -1.556 11.363 694 HB2 LEU 108 1HB LEU 108 -4.225 -1.529 8.384 695 HB3 LEU 108 2HB LEU 108 -5.754 -1.023 9.068 696 HG LEU 108 HG LEU 108 -4.468 0.908 8.575 697 HD11 LEU 108 1HD1 LEU 108 -4.414 0.591 11.599 698 HD12 LEU 108 2HD1 LEU 108 -5.882 0.932 10.631 699 HD13 LEU 108 3HD1 LEU 108 -4.540 2.096 10.647 700 HD21 LEU 108 3HD2 LEU 108 -2.207 -0.334 8.912 701 HD22 LEU 108 1HD2 LEU 108 -2.334 0.246 10.578 702 HD23 LEU 108 2HD2 LEU 108 -2.350 1.404 9.231 703 H THR 109 H THR 109 -6.814 -2.503 11.555 704 HA THR 109 HA THR 109 -7.021 -5.220 10.684 705 HB THR 109 HB THR 109 -9.488 -4.930 11.258 706 HG1 THR 109 1HG THR 109 -8.479 -2.500 12.363 707 HG21 THR 109 3HG2 THR 109 -9.012 -5.057 13.653 708 HG22 THR 109 1HG2 THR 109 -7.385 -4.379 13.399 709 HG23 THR 109 2HG2 THR 109 -7.809 -5.968 12.729 710 H LEU 110 H LEU 110 -8.176 -6.174 8.893 711 HA LEU 110 HA LEU 110 -8.559 -4.824 6.468 712 HB2 LEU 110 1HB LEU 110 -10.140 -7.074 7.849 713 HB3 LEU 110 2HB LEU 110 -10.478 -6.542 6.221 714 HG LEU 110 HG LEU 110 -7.869 -7.792 7.081 715 HD11 LEU 110 1HD1 LEU 110 -8.650 -9.780 5.908 716 HD12 LEU 110 2HD1 LEU 110 -10.118 -8.958 5.361 717 HD13 LEU 110 3HD1 LEU 110 -9.911 -9.345 7.067 718 HD21 LEU 110 3HD2 LEU 110 -8.929 -7.257 4.269 719 HD22 LEU 110 1HD2 LEU 110 -7.325 -7.910 4.742 720 HD23 LEU 110 2HD2 LEU 110 -7.761 -6.245 5.103 721 H SER 111 H SER 111 -10.694 -5.106 9.288 722 HA SER 111 HA SER 111 -12.986 -3.976 8.092 723 HB2 SER 111 1HB SER 111 -12.891 -5.357 10.185 724 HB3 SER 111 2HB SER 111 -12.183 -3.969 11.029 725 HG SER 111 HG SER 111 -14.063 -3.232 11.273 726 H GLN 112 H GLN 112 -10.314 -2.422 10.030 727 HA GLN 112 HA GLN 112 -11.338 0.201 10.000 728 HB2 GLN 112 1HB GLN 112 -8.619 -1.030 10.344 729 HB3 GLN 112 2HB GLN 112 -8.629 0.611 9.731 730 HG2 GLN 112 1HG GLN 112 -9.879 -0.322 12.325 731 HG3 GLN 112 2HG GLN 112 -8.473 0.733 12.109 732 HE21 GLN 112 1HE2 GLN 112 -8.955 2.754 10.674 733 HE22 GLN 112 2HE2 GLN 112 -10.449 3.601 11.059 734 H LEU 113 H LEU 113 -9.043 -1.244 7.650 735 HA LEU 113 HA LEU 113 -8.977 1.110 6.073 736 HB2 LEU 113 1HB LEU 113 -8.460 -1.800 5.392 737 HB3 LEU 113 2HB LEU 113 -8.074 -0.470 4.314 738 HG LEU 113 HG LEU 113 -6.934 -0.681 7.125 739 HD11 LEU 113 1HD1 LEU 113 -5.774 -1.616 4.479 740 HD12 LEU 113 2HD1 LEU 113 -6.260 -2.608 5.879 741 HD13 LEU 113 3HD1 LEU 113 -4.880 -1.501 6.008 742 HD21 LEU 113 3HD2 LEU 113 -6.131 1.001 4.713 743 HD22 LEU 113 1HD2 LEU 113 -5.205 0.885 6.220 744 HD23 LEU 113 2HD2 LEU 113 -6.818 1.600 6.237 745 H LYS 114 H LYS 114 -11.265 -1.582 6.002 746 HA LYS 114 HA LYS 114 -12.518 -0.802 3.494 747 HB2 LYS 114 1HB LYS 114 -12.760 -3.069 4.370 748 HB3 LYS 114 2HB LYS 114 -13.468 -2.460 5.869 749 HG2 LYS 114 1HG LYS 114 -15.394 -1.512 4.556 750 HG3 LYS 114 2HG LYS 114 -14.758 -2.245 3.084 751 HD2 LYS 114 1HD LYS 114 -15.640 -3.638 5.684 752 HD3 LYS 114 2HD LYS 114 -16.645 -3.448 4.248 753 HE2 LYS 114 1HE LYS 114 -15.169 -4.909 2.957 754 HE3 LYS 114 2HE LYS 114 -14.070 -5.073 4.339 755 HZ1 LYS 114 3HZ LYS 114 -15.683 -6.955 4.162 756 HZ2 LYS 114 1HZ LYS 114 -16.912 -5.888 4.396 757 HZ3 LYS 114 2HZ LYS 114 -15.822 -6.146 5.575 758 H LYS 115 H LYS 115 -13.010 0.081 6.978 759 HA LYS 115 HA LYS 115 -15.421 1.522 6.376 760 HB2 LYS 115 1HB LYS 115 -14.121 0.562 8.703 761 HB3 LYS 115 2HB LYS 115 -14.061 2.307 8.849 762 HG2 LYS 115 1HG LYS 115 -16.175 1.637 9.808 763 HG3 LYS 115 2HG LYS 115 -16.534 2.318 8.207 764 HD2 LYS 115 1HD LYS 115 -17.845 0.352 8.228 765 HD3 LYS 115 2HD LYS 115 -16.407 -0.157 7.334 766 HE2 LYS 115 1HE LYS 115 -16.512 -1.903 8.815 767 HE3 LYS 115 2HE LYS 115 -15.502 -0.803 9.761 768 HZ1 LYS 115 3HZ LYS 115 -17.199 -1.462 11.187 769 HZ2 LYS 115 1HZ LYS 115 -18.375 -1.357 10.036 770 HZ3 LYS 115 2HZ LYS 115 -17.712 0.014 10.693 771 H GLU 116 H GLU 116 -12.065 2.487 7.063 772 HA GLU 116 HA GLU 116 -12.276 5.278 6.797 773 HB2 GLU 116 1HB GLU 116 -10.014 3.427 5.937 774 HB3 GLU 116 2HB GLU 116 -9.878 5.159 6.211 775 HG2 GLU 116 1HG GLU 116 -10.791 3.365 8.471 776 HG3 GLU 116 2HG GLU 116 -9.110 3.347 7.979 777 H PHE 117 H PHE 117 -11.318 2.850 4.285 778 HA PHE 117 HA PHE 117 -11.618 4.976 2.286 779 HB2 PHE 117 1HB PHE 117 -9.885 2.525 2.217 780 HB3 PHE 117 2HB PHE 117 -9.803 3.922 1.156 781 HD1 PHE 117 1HD PHE 117 -9.888 6.237 3.045 782 HD2 PHE 117 2HD PHE 117 -7.799 2.461 3.305 783 HE1 PHE 117 1HE PHE 117 -8.238 7.245 4.565 784 HE2 PHE 117 2HE PHE 117 -6.106 3.507 4.737 785 HZ PHE 117 HZ PHE 117 -6.337 5.904 5.426 786 H TYR 118 H TYR 118 -13.705 2.703 3.064 787 HA TYR 118 HA TYR 118 -14.388 2.315 0.230 788 HB2 TYR 118 1HB TYR 118 -12.904 0.368 1.306 789 HB3 TYR 118 2HB TYR 118 -14.472 -0.207 1.846 790 HD1 TYR 118 2HD TYR 118 -12.822 1.217 -1.247 791 HD2 TYR 118 1HD TYR 118 -15.610 -1.666 0.367 792 HE1 TYR 118 2HE TYR 118 -13.020 0.155 -3.461 793 HE2 TYR 118 1HE TYR 118 -15.955 -2.602 -1.893 794 HH TYR 118 HH TYR 118 -13.863 -1.702 -4.592 795 H GLN 119 H GLN 119 -15.787 3.830 2.307 796 HA GLN 119 HA GLN 119 -18.182 2.244 2.780 797 HB2 GLN 119 1HB GLN 119 -18.983 3.903 4.162 798 HB3 GLN 119 2HB GLN 119 -17.294 3.655 4.542 799 HG2 GLN 119 1HG GLN 119 -18.488 5.997 3.042 800 HG3 GLN 119 2HG GLN 119 -18.000 5.997 4.718 801 HE21 GLN 119 1HE2 GLN 119 -15.333 4.584 4.199 802 HE22 GLN 119 2HE2 GLN 119 -14.377 5.874 3.611 803 H THR 120 H THR 120 -17.628 5.277 0.721 804 HA THR 120 HA THR 120 -20.387 5.062 -0.114 805 HB THR 120 HB THR 120 -20.057 7.140 -1.162 806 HG1 THR 120 1HG THR 120 -18.025 7.992 -1.573 807 HG21 THR 120 3HG2 THR 120 -19.807 7.253 1.359 808 HG22 THR 120 1HG2 THR 120 -18.967 8.562 0.506 809 HG23 THR 120 2HG2 THR 120 -18.037 7.219 1.109 810 H ARG 121 H ARG 121 -21.103 4.920 -2.407 811 HA ARG 121 HA ARG 121 -19.841 2.839 -3.865 812 HB2 ARG 121 1HB ARG 121 -21.982 4.902 -4.514 813 HB3 ARG 121 2HB ARG 121 -21.294 3.950 -5.829 814 HG2 ARG 121 1HG ARG 121 -21.873 1.842 -4.607 815 HG3 ARG 121 2HG ARG 121 -22.668 2.823 -3.377 816 HD2 ARG 121 1HD ARG 121 -24.434 2.210 -4.808 817 HD3 ARG 121 2HD ARG 121 -24.048 3.856 -5.285 818 HE ARG 121 HE ARG 121 -23.235 3.134 -7.316 819 HH11 ARG 121 1HH1 ARG 121 -24.180 0.267 -5.393 820 HH12 ARG 121 2HH1 ARG 121 -24.331 -0.712 -6.838 821 HH21 ARG 121 1HH2 ARG 121 -23.268 1.780 -9.060 822 HH22 ARG 121 2HH2 ARG 121 -23.789 0.127 -8.911 823 H SER 122 H SER 122 -19.522 6.431 -4.479 824 HA SER 122 HA SER 122 -18.094 5.993 -6.902 825 HB2 SER 122 1HB SER 122 -19.029 8.224 -5.916 826 HB3 SER 122 2HB SER 122 -17.457 8.337 -5.094 827 HG SER 122 HG SER 122 -16.450 8.237 -7.177 828 H GLN 123 H GLN 123 -17.061 6.109 -3.473 829 HA GLN 123 HA GLN 123 -14.286 6.197 -3.913 830 HB2 GLN 123 1HB GLN 123 -15.382 6.490 -1.702 831 HB3 GLN 123 2HB GLN 123 -15.816 4.781 -1.673 832 HG2 GLN 123 1HG GLN 123 -13.497 4.103 -1.553 833 HG3 GLN 123 2HG GLN 123 -12.964 5.779 -1.902 834 HE21 GLN 123 1HE2 GLN 123 -15.653 4.851 0.171 835 HE22 GLN 123 2HE2 GLN 123 -14.923 5.500 1.660 836 H LYS 124 H LYS 124 -16.560 3.452 -3.947 837 HA LYS 124 HA LYS 124 -14.610 1.413 -4.068 838 HB2 LYS 124 1HB LYS 124 -17.271 1.410 -5.535 839 HB3 LYS 124 2HB LYS 124 -16.254 0.030 -5.152 840 HG2 LYS 124 1HG LYS 124 -16.698 0.293 -2.741 841 HG3 LYS 124 2HG LYS 124 -17.588 1.775 -3.076 842 HD2 LYS 124 1HD LYS 124 -19.247 0.206 -2.837 843 HD3 LYS 124 2HD LYS 124 -19.145 0.443 -4.570 844 HE2 LYS 124 1HE LYS 124 -18.048 -1.900 -2.954 845 HE3 LYS 124 2HE LYS 124 -19.494 -1.872 -3.969 846 HZ1 LYS 124 3HZ LYS 124 -17.974 -2.913 -5.264 847 HZ2 LYS 124 1HZ LYS 124 -16.697 -1.940 -4.857 848 HZ3 LYS 124 2HZ LYS 124 -17.887 -1.409 -5.865 849 H ARG 125 H ARG 125 -15.776 3.562 -6.593 850 HA ARG 125 HA ARG 125 -14.766 1.908 -8.787 851 HB2 ARG 125 1HB ARG 125 -16.503 4.243 -8.474 852 HB3 ARG 125 2HB ARG 125 -15.150 4.677 -9.508 853 HG2 ARG 125 1HG ARG 125 -16.966 3.892 -10.840 854 HG3 ARG 125 2HG ARG 125 -15.600 2.797 -10.998 855 HD2 ARG 125 1HD ARG 125 -17.835 2.231 -8.996 856 HD3 ARG 125 2HD ARG 125 -18.076 1.882 -10.711 857 HE ARG 125 HE ARG 125 -16.475 0.337 -8.848 858 HH11 ARG 125 1HH1 ARG 125 -16.770 1.226 -12.311 859 HH12 ARG 125 2HH1 ARG 125 -15.658 0.005 -12.794 860 HH21 ARG 125 1HH2 ARG 125 -15.053 -1.320 -9.601 861 HH22 ARG 125 2HH2 ARG 125 -14.818 -1.556 -11.267 862 H GLU 126 H GLU 126 -13.881 5.087 -7.475 863 HA GLU 126 HA GLU 126 -11.446 5.442 -8.670 864 HB2 GLU 126 1HB GLU 126 -12.513 6.180 -5.900 865 HB3 GLU 126 2HB GLU 126 -10.877 6.645 -6.411 866 HG2 GLU 126 1HG GLU 126 -12.296 8.464 -6.855 867 HG3 GLU 126 2HG GLU 126 -11.764 7.756 -8.392 868 H VAL 127 H VAL 127 -11.860 3.911 -5.527 869 HA VAL 127 HA VAL 127 -9.210 3.126 -5.048 870 HB VAL 127 HB VAL 127 -11.749 1.750 -4.198 871 HG11 VAL 127 1HG1 VAL 127 -10.471 0.741 -2.352 872 HG12 VAL 127 2HG1 VAL 127 -9.837 0.163 -3.890 873 HG13 VAL 127 3HG1 VAL 127 -8.961 1.418 -2.986 874 HG21 VAL 127 3HG2 VAL 127 -11.317 4.174 -3.405 875 HG22 VAL 127 1HG2 VAL 127 -11.403 2.993 -2.090 876 HG23 VAL 127 2HG2 VAL 127 -9.833 3.592 -2.651 877 H ASP 128 H ASP 128 -11.715 1.250 -6.803 878 HA ASP 128 HA ASP 128 -10.040 -1.069 -7.281 879 HB2 ASP 128 1HB ASP 128 -12.577 -0.870 -7.209 880 HB3 ASP 128 2HB ASP 128 -12.509 -0.128 -8.790 881 H ASP 129 H ASP 129 -10.676 1.988 -8.937 882 HA ASP 129 HA ASP 129 -9.556 1.434 -11.479 883 HB2 ASP 129 1HB ASP 129 -10.799 3.616 -10.151 884 HB3 ASP 129 2HB ASP 129 -9.202 4.175 -10.532 885 H TYR 130 H TYR 130 -8.166 2.664 -8.401 886 HA TYR 130 HA TYR 130 -5.548 3.082 -9.376 887 HB2 TYR 130 1HB TYR 130 -6.416 2.350 -6.585 888 HB3 TYR 130 2HB TYR 130 -4.787 2.849 -7.017 889 HD1 TYR 130 1HD TYR 130 -4.868 5.097 -8.646 890 HD2 TYR 130 2HD TYR 130 -7.590 4.090 -5.518 891 HE1 TYR 130 1HE TYR 130 -5.499 7.427 -8.541 892 HE2 TYR 130 2HE TYR 130 -8.410 6.455 -5.487 893 HH TYR 130 HH TYR 130 -7.010 8.868 -7.769 894 H VAL 131 H VAL 131 -7.053 0.069 -8.198 895 HA VAL 131 HA VAL 131 -4.573 -1.396 -8.181 896 HB VAL 131 HB VAL 131 -7.438 -2.414 -8.536 897 HG11 VAL 131 1HG1 VAL 131 -6.482 -4.559 -7.668 898 HG12 VAL 131 2HG1 VAL 131 -5.803 -4.112 -9.240 899 HG13 VAL 131 3HG1 VAL 131 -4.853 -3.820 -7.782 900 HG21 VAL 131 3HG2 VAL 131 -7.284 -2.929 -6.119 901 HG22 VAL 131 1HG2 VAL 131 -5.699 -2.171 -6.043 902 HG23 VAL 131 2HG2 VAL 131 -7.156 -1.200 -6.393 903 H ALA 132 H ALA 132 -7.018 -0.764 -10.733 904 HA ALA 132 HA ALA 132 -5.657 -2.449 -12.681 905 HB1 ALA 132 1HB ALA 132 -7.652 -0.181 -13.078 906 HB2 ALA 132 2HB ALA 132 -7.199 -1.411 -14.279 907 HB3 ALA 132 3HB ALA 132 -8.077 -1.902 -12.814 908 H GLY 133 H GLY 133 -4.855 0.613 -11.368 909 HA2 GLY 133 1HA GLY 133 -3.642 1.669 -13.859 910 HA3 GLY 133 2HA GLY 133 -4.021 2.554 -12.387 911 H LEU 134 H LEU 134 -2.484 -0.467 -11.674 912 HA LEU 134 HA LEU 134 0.191 0.799 -11.644 913 HB2 LEU 134 1HB LEU 134 0.690 -0.204 -9.598 914 HB3 LEU 134 2HB LEU 134 -0.828 0.646 -9.439 915 HG LEU 134 HG LEU 134 -1.989 -1.623 -9.648 916 HD11 LEU 134 1HD1 LEU 134 -0.239 -3.102 -10.389 917 HD12 LEU 134 2HD1 LEU 134 -0.503 -3.503 -8.710 918 HD13 LEU 134 3HD1 LEU 134 0.884 -2.496 -9.141 919 HD21 LEU 134 3HD2 LEU 134 -0.236 -1.051 -7.220 920 HD22 LEU 134 1HD2 LEU 134 -1.759 -1.964 -7.243 921 HD23 LEU 134 2HD2 LEU 134 -1.788 -0.251 -7.588 922 H ARG 135 H ARG 135 1.883 -0.993 -11.398 923 HA ARG 135 HA ARG 135 1.380 -3.039 -13.524 924 HB2 ARG 135 1HB ARG 135 3.704 -1.099 -13.050 925 HB3 ARG 135 2HB ARG 135 3.774 -2.450 -14.176 926 HG2 ARG 135 1HG ARG 135 1.828 -1.504 -15.440 927 HG3 ARG 135 2HG ARG 135 1.644 -0.241 -14.243 928 HD2 ARG 135 1HD ARG 135 2.634 0.706 -16.168 929 HD3 ARG 135 2HD ARG 135 3.720 0.788 -14.827 930 HE ARG 135 HE ARG 135 3.981 -1.407 -16.855 931 HH11 ARG 135 1HH1 ARG 135 5.604 1.288 -15.159 932 HH12 ARG 135 2HH1 ARG 135 6.860 1.422 -16.356 933 HH21 ARG 135 1HH2 ARG 135 5.608 -1.212 -18.337 934 HH22 ARG 135 2HH2 ARG 135 6.931 -0.083 -18.093 935 H THR 136 H THR 136 3.149 -4.828 -13.418 936 HA THR 136 HA THR 136 3.865 -5.270 -10.559 937 HB THR 136 HB THR 136 3.453 -7.777 -11.566 938 HG1 THR 136 1HG THR 136 1.324 -6.156 -12.553 939 HG21 THR 136 3HG2 THR 136 1.464 -7.844 -10.224 940 HG22 THR 136 1HG2 THR 136 1.428 -6.059 -10.166 941 HG23 THR 136 2HG2 THR 136 2.795 -6.971 -9.461 942 H GLU 137 H GLU 137 5.066 -4.805 -13.464 943 HA GLU 137 HA GLU 137 7.757 -5.372 -13.195 944 HB2 GLU 137 1HB GLU 137 6.070 -7.685 -14.106 945 HB3 GLU 137 2HB GLU 137 7.313 -7.289 -15.255 946 HG2 GLU 137 1HG GLU 137 8.039 -7.675 -12.347 947 HG3 GLU 137 2HG GLU 137 7.798 -9.034 -13.434 Start of MODEL 6 1 H1 GLY 19 H GLY 19 -1.218 -12.521 1.268 2 HA2 GLY 19 1HA GLY 19 -3.775 -11.147 1.888 3 HA3 GLY 19 2HA GLY 19 -3.461 -11.980 0.358 4 H HIS 20 H HIS 20 -4.461 -12.369 3.672 5 HA HIS 20 HA HIS 20 -4.464 -15.344 3.412 6 HB2 HIS 20 1HB HIS 20 -3.156 -13.549 5.381 7 HB3 HIS 20 2HB HIS 20 -4.169 -14.765 6.123 8 HD1 HIS 20 1HD HIS 20 -2.049 -15.981 7.142 9 HD2 HIS 20 2HD HIS 20 -2.195 -15.752 2.931 10 HE1 HIS 20 1HE HIS 20 -0.351 -17.691 6.246 11 H MET 21 H MET 21 -6.464 -12.569 4.147 12 HA MET 21 HA MET 21 -8.678 -14.437 4.780 13 HB2 MET 21 1HB MET 21 -7.566 -12.363 6.647 14 HB3 MET 21 2HB MET 21 -9.309 -12.550 6.582 15 HG2 MET 21 1HG MET 21 -8.056 -15.172 6.803 16 HG3 MET 21 2HG MET 21 -7.508 -14.094 8.068 17 HE1 MET 21 3HE MET 21 -11.906 -15.368 7.339 18 HE2 MET 21 1HE MET 21 -11.005 -14.348 6.195 19 HE3 MET 21 2HE MET 21 -10.498 -16.020 6.494 20 H LYS 22 H LYS 22 -9.364 -13.944 2.703 21 HA LYS 22 HA LYS 22 -10.728 -13.004 1.191 22 HB2 LYS 22 1HB LYS 22 -11.722 -11.510 3.652 23 HB3 LYS 22 2HB LYS 22 -12.306 -11.060 2.075 24 HG2 LYS 22 1HG LYS 22 -13.897 -12.530 2.897 25 HG3 LYS 22 2HG LYS 22 -13.019 -13.420 1.646 26 HD2 LYS 22 1HD LYS 22 -11.727 -14.609 3.406 27 HD3 LYS 22 2HD LYS 22 -12.499 -13.615 4.643 28 HE2 LYS 22 1HE LYS 22 -13.532 -15.788 4.600 29 HE3 LYS 22 2HE LYS 22 -14.704 -14.581 4.069 30 HZ1 LYS 22 3HZ LYS 22 -13.111 -16.213 2.200 31 HZ2 LYS 22 1HZ LYS 22 -14.438 -15.319 1.828 32 HZ3 LYS 22 2HZ LYS 22 -14.594 -16.666 2.773 33 H PHE 23 H PHE 23 -11.438 -10.718 0.286 34 HA PHE 23 HA PHE 23 -10.781 -9.130 -1.112 35 HB2 PHE 23 1HB PHE 23 -8.899 -8.480 1.150 36 HB3 PHE 23 2HB PHE 23 -8.671 -7.737 -0.411 37 HD1 PHE 23 2HD PHE 23 -12.043 -8.503 1.096 38 HD2 PHE 23 1HD PHE 23 -9.081 -5.504 0.134 39 HE1 PHE 23 2HE PHE 23 -13.682 -6.761 1.493 40 HE2 PHE 23 1HE PHE 23 -10.734 -3.749 0.603 41 HZ PHE 23 HZ PHE 23 -13.048 -4.330 1.263 42 H THR 24 H THR 24 -8.463 -8.377 -2.247 43 HA THR 24 HA THR 24 -6.825 -10.743 -2.743 44 HB THR 24 HB THR 24 -6.560 -9.551 -5.135 45 HG1 THR 24 1HG THR 24 -8.557 -8.888 -5.891 46 HG21 THR 24 3HG2 THR 24 -7.312 -11.850 -4.718 47 HG22 THR 24 1HG2 THR 24 -8.351 -11.083 -5.938 48 HG23 THR 24 2HG2 THR 24 -8.938 -11.263 -4.273 49 H ASP 25 H ASP 25 -4.608 -10.105 -3.087 50 HA ASP 25 HA ASP 25 -3.982 -8.433 -0.920 51 HB2 ASP 25 1HB ASP 25 -2.714 -10.420 -1.905 52 HB3 ASP 25 2HB ASP 25 -2.071 -9.297 -3.107 53 H GLN 26 H GLN 26 -4.032 -7.737 -4.398 54 HA GLN 26 HA GLN 26 -2.565 -5.295 -4.303 55 HB2 GLN 26 1HB GLN 26 -4.688 -5.532 -6.366 56 HB3 GLN 26 2HB GLN 26 -3.039 -5.012 -6.483 57 HG2 GLN 26 1HG GLN 26 -2.623 -6.886 -7.555 58 HG3 GLN 26 2HG GLN 26 -2.709 -7.750 -6.055 59 HE21 GLN 26 1HE2 GLN 26 -5.239 -6.296 -8.388 60 HE22 GLN 26 2HE2 GLN 26 -5.966 -7.847 -8.669 61 H GLN 27 H GLN 27 -6.077 -6.072 -4.086 62 HA GLN 27 HA GLN 27 -7.030 -3.369 -4.031 63 HB2 GLN 27 1HB GLN 27 -8.162 -5.906 -2.786 64 HB3 GLN 27 2HB GLN 27 -9.034 -4.401 -2.859 65 HG2 GLN 27 1HG GLN 27 -7.994 -5.612 -5.411 66 HG3 GLN 27 2HG GLN 27 -9.400 -6.324 -4.647 67 HE21 GLN 27 1HE2 GLN 27 -8.909 -4.976 -7.277 68 HE22 GLN 27 2HE2 GLN 27 -10.091 -3.713 -7.404 69 H ILE 28 H ILE 28 -5.735 -5.482 -1.508 70 HA ILE 28 HA ILE 28 -6.453 -3.755 0.696 71 HB ILE 28 HB ILE 28 -4.329 -5.940 0.525 72 HG12 ILE 28 1HG1 ILE 28 -7.170 -6.186 1.630 73 HG13 ILE 28 2HG1 ILE 28 -6.728 -6.671 0.005 74 HG21 ILE 28 1HG2 ILE 28 -5.680 -4.584 2.895 75 HG22 ILE 28 2HG2 ILE 28 -4.626 -6.009 3.002 76 HG23 ILE 28 3HG2 ILE 28 -3.966 -4.477 2.438 77 HD11 ILE 28 3HD1 ILE 28 -5.834 -7.942 2.578 78 HD12 ILE 28 1HD1 ILE 28 -6.634 -8.677 1.189 79 HD13 ILE 28 2HD1 ILE 28 -4.942 -8.193 1.060 80 H GLY 29 H GLY 29 -3.467 -4.245 -1.268 81 HA2 GLY 29 1HA GLY 29 -1.761 -2.545 0.142 82 HA3 GLY 29 2HA GLY 29 -1.626 -2.917 -1.580 83 H VAL 30 H VAL 30 -4.078 -1.668 -2.449 84 HA VAL 30 HA VAL 30 -3.266 1.078 -2.659 85 HB VAL 30 HB VAL 30 -5.863 -0.380 -3.305 86 HG11 VAL 30 1HG1 VAL 30 -6.582 1.584 -4.574 87 HG12 VAL 30 2HG1 VAL 30 -6.434 2.006 -2.867 88 HG13 VAL 30 3HG1 VAL 30 -5.163 2.502 -4.003 89 HG21 VAL 30 3HG2 VAL 30 -3.937 -0.929 -4.757 90 HG22 VAL 30 1HG2 VAL 30 -5.099 0.060 -5.660 91 HG23 VAL 30 2HG2 VAL 30 -3.639 0.807 -5.025 92 H LEU 31 H LEU 31 -5.748 -0.547 -0.594 93 HA LEU 31 HA LEU 31 -6.689 1.923 0.576 94 HB2 LEU 31 1HB LEU 31 -6.717 -0.901 1.733 95 HB3 LEU 31 2HB LEU 31 -7.591 0.496 2.378 96 HG LEU 31 HG LEU 31 -8.062 -0.638 -0.393 97 HD11 LEU 31 1HD1 LEU 31 -10.122 -1.616 0.566 98 HD12 LEU 31 2HD1 LEU 31 -9.613 -1.113 2.193 99 HD13 LEU 31 3HD1 LEU 31 -8.662 -2.322 1.290 100 HD21 LEU 31 3HD2 LEU 31 -9.694 1.248 1.331 101 HD22 LEU 31 1HD2 LEU 31 -10.142 0.665 -0.286 102 HD23 LEU 31 2HD2 LEU 31 -8.735 1.720 -0.095 103 H ALA 32 H ALA 32 -4.310 -0.466 1.540 104 HA ALA 32 HA ALA 32 -3.430 0.682 3.989 105 HB1 ALA 32 1HB ALA 32 -1.803 -0.847 1.904 106 HB2 ALA 32 2HB ALA 32 -1.286 -0.508 3.555 107 HB3 ALA 32 3HB ALA 32 -2.703 -1.550 3.269 108 H GLY 33 H GLY 33 -2.414 1.387 0.597 109 HA2 GLY 33 1HA GLY 33 -0.448 3.332 1.399 110 HA3 GLY 33 2HA GLY 33 -1.095 3.112 -0.214 111 H LEU 34 H LEU 34 -3.972 3.581 0.572 112 HA LEU 34 HA LEU 34 -3.996 6.405 0.575 113 HB2 LEU 34 1HB LEU 34 -6.049 4.256 0.806 114 HB3 LEU 34 2HB LEU 34 -6.457 5.805 1.551 115 HG LEU 34 HG LEU 34 -5.970 7.010 -0.459 116 HD11 LEU 34 1HD1 LEU 34 -4.377 5.528 -1.621 117 HD12 LEU 34 2HD1 LEU 34 -5.748 5.901 -2.656 118 HD13 LEU 34 3HD1 LEU 34 -5.646 4.316 -1.852 119 HD21 LEU 34 3HD2 LEU 34 -7.990 6.268 -1.718 120 HD22 LEU 34 1HD2 LEU 34 -8.261 6.251 0.026 121 HD23 LEU 34 2HD2 LEU 34 -7.961 4.724 -0.831 122 H ALA 35 H ALA 35 -3.627 4.304 3.191 123 HA ALA 35 HA ALA 35 -4.157 6.313 5.293 124 HB1 ALA 35 1HB ALA 35 -3.573 4.580 6.863 125 HB2 ALA 35 2HB ALA 35 -4.621 3.855 5.631 126 HB3 ALA 35 3HB ALA 35 -2.879 3.565 5.587 127 H ILE 36 H ILE 36 -1.401 5.513 3.287 128 HA ILE 36 HA ILE 36 0.409 7.064 4.998 129 HB ILE 36 HB ILE 36 0.993 4.298 3.860 130 HG12 ILE 36 1HG1 ILE 36 2.055 4.065 6.212 131 HG13 ILE 36 2HG1 ILE 36 1.207 5.541 6.675 132 HG21 ILE 36 1HG2 ILE 36 3.009 6.306 5.045 133 HG22 ILE 36 2HG2 ILE 36 3.349 4.651 4.491 134 HG23 ILE 36 3HG2 ILE 36 2.923 5.877 3.331 135 HD11 ILE 36 3HD1 ILE 36 0.323 3.149 7.223 136 HD12 ILE 36 1HD1 ILE 36 -0.800 4.449 6.812 137 HD13 ILE 36 2HD1 ILE 36 -0.365 3.240 5.578 138 H SER 37 H SER 37 0.361 8.786 3.614 139 HA SER 37 HA SER 37 0.533 10.128 1.882 140 HB2 SER 37 1HB SER 37 2.857 8.917 2.085 141 HB3 SER 37 2HB SER 37 2.484 8.390 0.432 142 HG SER 37 HG SER 37 3.486 10.682 1.163 143 HA PRO 38 HA PRO 38 -2.604 7.988 -0.833 144 HB2 PRO 38 1HB PRO 38 -4.413 10.017 -0.692 145 HB3 PRO 38 2HB PRO 38 -4.350 8.602 0.389 146 HG2 PRO 38 1HG PRO 38 -3.235 11.354 0.886 147 HG3 PRO 38 2HG PRO 38 -4.179 10.322 2.010 148 HD2 PRO 38 1HD PRO 38 -1.507 10.471 2.196 149 HD3 PRO 38 2HD PRO 38 -2.340 8.908 2.421 150 H GLU 39 H GLU 39 -1.554 11.455 -0.666 151 HA GLU 39 HA GLU 39 -2.193 12.090 -3.354 152 HB2 GLU 39 1HB GLU 39 -0.190 13.283 -1.396 153 HB3 GLU 39 2HB GLU 39 -0.562 14.008 -2.967 154 HG2 GLU 39 1HG GLU 39 -2.874 14.340 -2.394 155 HG3 GLU 39 2HG GLU 39 -2.712 13.426 -0.894 156 H TRP 40 H TRP 40 0.676 10.477 -2.038 157 HA TRP 40 HA TRP 40 2.304 10.749 -4.409 158 HB2 TRP 40 1HB TRP 40 3.348 10.201 -2.333 159 HB3 TRP 40 2HB TRP 40 2.295 8.822 -2.078 160 HD1 TRP 40 HD TRP 40 5.055 9.873 -4.591 161 HE1 TRP 40 1HE TRP 40 6.431 7.834 -5.192 162 HE3 TRP 40 3HE TRP 40 2.155 6.390 -2.353 163 HZ2 TRP 40 2HZ TRP 40 6.274 4.901 -4.710 164 HZ3 TRP 40 3HZ TRP 40 2.721 3.996 -2.404 165 HH2 TRP 40 HH TRP 40 4.788 3.221 -3.621 166 H LEU 41 H LEU 41 0.416 7.918 -3.190 167 HA LEU 41 HA LEU 41 0.742 6.293 -5.411 168 HB2 LEU 41 1HB LEU 41 -0.119 5.623 -3.257 169 HB3 LEU 41 2HB LEU 41 -1.629 6.485 -3.575 170 HG LEU 41 HG LEU 41 -0.709 4.205 -5.354 171 HD11 LEU 41 1HD1 LEU 41 -1.905 2.605 -4.010 172 HD12 LEU 41 2HD1 LEU 41 -2.512 3.871 -2.912 173 HD13 LEU 41 3HD1 LEU 41 -0.795 3.437 -2.927 174 HD21 LEU 41 3HD2 LEU 41 -3.172 3.857 -5.620 175 HD22 LEU 41 1HD2 LEU 41 -2.638 5.404 -6.252 176 HD23 LEU 41 2HD2 LEU 41 -3.455 5.339 -4.674 177 H LYS 42 H LYS 42 -1.887 8.616 -4.765 178 HA LYS 42 HA LYS 42 -3.435 8.074 -7.090 179 HB2 LYS 42 1HB LYS 42 -3.167 10.604 -5.397 180 HB3 LYS 42 2HB LYS 42 -4.425 10.355 -6.623 181 HG2 LYS 42 1HG LYS 42 -5.371 8.489 -5.391 182 HG3 LYS 42 2HG LYS 42 -4.023 8.430 -4.294 183 HD2 LYS 42 1HD LYS 42 -5.529 9.434 -2.955 184 HD3 LYS 42 2HD LYS 42 -4.719 10.857 -3.586 185 HE2 LYS 42 1HE LYS 42 -7.406 9.710 -4.510 186 HE3 LYS 42 2HE LYS 42 -7.175 11.093 -3.454 187 HZ1 LYS 42 3HZ LYS 42 -5.970 12.159 -5.340 188 HZ2 LYS 42 1HZ LYS 42 -7.588 11.922 -5.563 189 HZ3 LYS 42 2HZ LYS 42 -6.537 10.944 -6.321 190 H GLN 43 H GLN 43 -0.795 10.533 -6.611 191 HA GLN 43 HA GLN 43 -0.940 11.513 -9.324 192 HB2 GLN 43 1HB GLN 43 1.252 11.505 -7.215 193 HB3 GLN 43 2HB GLN 43 1.525 12.034 -8.867 194 HG2 GLN 43 1HG GLN 43 -0.514 13.616 -8.494 195 HG3 GLN 43 2HG GLN 43 -0.229 13.348 -6.776 196 HE21 GLN 43 1HE2 GLN 43 2.824 13.104 -7.255 197 HE22 GLN 43 2HE2 GLN 43 3.331 14.737 -7.600 198 H ASN 44 H ASN 44 0.936 8.847 -7.783 199 HA ASN 44 HA ASN 44 2.543 8.300 -10.024 200 HB2 ASN 44 1HB ASN 44 1.475 6.097 -8.241 201 HB3 ASN 44 2HB ASN 44 2.995 6.134 -9.117 202 HD21 ASN 44 1HD2 ASN 44 3.832 8.994 -7.947 203 HD22 ASN 44 2HD2 ASN 44 4.126 8.487 -6.308 204 H ILE 45 H ILE 45 -0.613 6.850 -9.104 205 HA ILE 45 HA ILE 45 -0.935 5.220 -11.422 206 HB ILE 45 HB ILE 45 -2.906 6.438 -9.456 207 HG12 ILE 45 1HG1 ILE 45 -1.377 4.665 -8.565 208 HG13 ILE 45 2HG1 ILE 45 -3.086 4.284 -8.477 209 HG21 ILE 45 1HG2 ILE 45 -4.529 4.689 -10.434 210 HG22 ILE 45 2HG2 ILE 45 -4.262 6.137 -11.393 211 HG23 ILE 45 3HG2 ILE 45 -3.464 4.621 -11.825 212 HD11 ILE 45 3HD1 ILE 45 -2.848 2.811 -10.507 213 HD12 ILE 45 1HD1 ILE 45 -1.099 3.137 -10.478 214 HD13 ILE 45 2HD1 ILE 45 -1.898 2.302 -9.128 215 H ALA 46 H ALA 46 -1.655 8.719 -10.880 216 HA ALA 46 HA ALA 46 -3.247 8.979 -13.216 217 HB1 ALA 46 1HB ALA 46 -3.365 10.659 -11.513 218 HB2 ALA 46 2HB ALA 46 -1.640 11.044 -11.689 219 HB3 ALA 46 3HB ALA 46 -2.758 11.411 -13.004 220 H ALA 47 H ALA 47 0.126 8.330 -13.036 221 HA ALA 47 HA ALA 47 0.261 8.851 -15.944 222 HB1 ALA 47 1HB ALA 47 2.734 9.204 -15.665 223 HB2 ALA 47 2HB ALA 47 1.726 10.475 -14.974 224 HB3 ALA 47 3HB ALA 47 2.463 9.274 -13.900 225 H ASN 48 H ASN 48 -0.391 6.499 -14.006 226 HA ASN 48 HA ASN 48 -0.022 4.322 -13.743 227 HB2 ASN 48 1HB ASN 48 -0.758 4.709 -16.254 228 HB3 ASN 48 2HB ASN 48 0.835 4.041 -16.601 229 HD21 ASN 48 1HD2 ASN 48 1.299 1.994 -15.146 230 HD22 ASN 48 2HD2 ASN 48 -0.054 0.825 -15.125 231 H GLN 49 H GLN 49 2.136 5.938 -13.001 232 HA GLN 49 HA GLN 49 4.676 4.687 -13.749 233 HB2 GLN 49 1HB GLN 49 3.856 6.931 -11.837 234 HB3 GLN 49 2HB GLN 49 5.525 6.446 -12.039 235 HG2 GLN 49 1HG GLN 49 3.746 7.471 -14.265 236 HG3 GLN 49 2HG GLN 49 4.961 8.418 -13.408 237 HE21 GLN 49 1HE2 GLN 49 6.719 5.817 -13.430 238 HE22 GLN 49 2HE2 GLN 49 7.466 5.953 -15.034 239 H LEU 50 H LEU 50 2.466 3.485 -11.744 240 HA LEU 50 HA LEU 50 4.153 3.173 -9.294 241 HB2 LEU 50 1HB LEU 50 1.848 3.904 -8.911 242 HB3 LEU 50 2HB LEU 50 1.223 2.542 -9.829 243 HG LEU 50 HG LEU 50 2.128 0.968 -8.115 244 HD11 LEU 50 1HD1 LEU 50 2.887 1.749 -5.969 245 HD12 LEU 50 2HD1 LEU 50 2.712 3.462 -6.486 246 HD13 LEU 50 3HD1 LEU 50 3.928 2.395 -7.198 247 HD21 LEU 50 3HD2 LEU 50 0.417 1.592 -6.380 248 HD22 LEU 50 1HD2 LEU 50 -0.166 1.594 -8.029 249 HD23 LEU 50 2HD2 LEU 50 0.198 3.140 -7.228 250 H VAL 51 H VAL 51 5.102 1.235 -8.773 251 HA VAL 51 HA VAL 51 4.377 -1.202 -10.296 252 HB VAL 51 HB VAL 51 7.109 -0.317 -9.326 253 HG11 VAL 51 1HG1 VAL 51 6.181 -2.865 -10.766 254 HG12 VAL 51 2HG1 VAL 51 7.881 -2.351 -10.598 255 HG13 VAL 51 3HG1 VAL 51 6.962 -2.760 -9.174 256 HG21 VAL 51 3HG2 VAL 51 5.977 -0.716 -12.145 257 HG22 VAL 51 1HG2 VAL 51 6.363 0.853 -11.388 258 HG23 VAL 51 2HG2 VAL 51 7.659 -0.287 -11.732 259 H TYR 52 H TYR 52 4.581 -3.132 -9.075 260 HA TYR 52 HA TYR 52 4.271 -2.964 -6.161 261 HB2 TYR 52 1HB TYR 52 2.004 -2.908 -7.059 262 HB3 TYR 52 2HB TYR 52 2.396 -4.130 -8.276 263 HD1 TYR 52 1HD TYR 52 2.014 -3.587 -4.629 264 HD2 TYR 52 2HD TYR 52 2.336 -6.445 -7.823 265 HE1 TYR 52 1HE TYR 52 1.841 -5.374 -3.015 266 HE2 TYR 52 2HE TYR 52 2.184 -8.324 -6.168 267 HH TYR 52 HH TYR 52 1.746 -8.826 -3.854 268 H GLY 53 H GLY 53 5.013 -4.941 -5.162 269 HA2 GLY 53 1HA GLY 53 5.380 -7.318 -6.737 270 HA3 GLY 53 2HA GLY 53 6.935 -6.577 -6.294 271 H ILE 54 H ILE 54 6.591 -9.016 -5.334 272 HA ILE 54 HA ILE 54 6.048 -8.653 -2.428 273 HB ILE 54 HB ILE 54 6.477 -11.138 -4.137 274 HG12 ILE 54 1HG1 ILE 54 4.153 -10.232 -4.151 275 HG13 ILE 54 2HG1 ILE 54 4.305 -11.842 -3.488 276 HG21 ILE 54 1HG2 ILE 54 7.681 -11.694 -2.187 277 HG22 ILE 54 2HG2 ILE 54 6.536 -10.863 -1.119 278 HG23 ILE 54 3HG2 ILE 54 6.078 -12.381 -1.878 279 HD11 ILE 54 3HD1 ILE 54 4.230 -10.834 -1.144 280 HD12 ILE 54 1HD1 ILE 54 3.891 -9.273 -1.930 281 HD13 ILE 54 2HD1 ILE 54 2.757 -10.605 -2.110 282 H VAL 55 H VAL 55 7.801 -8.851 -1.105 283 HA VAL 55 HA VAL 55 10.213 -7.847 -1.747 284 HB VAL 55 HB VAL 55 9.213 -9.583 0.507 285 HG11 VAL 55 1HG1 VAL 55 12.070 -8.686 0.057 286 HG12 VAL 55 2HG1 VAL 55 11.396 -8.833 1.709 287 HG13 VAL 55 3HG1 VAL 55 11.475 -10.240 0.644 288 HG21 VAL 55 3HG2 VAL 55 10.284 -6.731 0.267 289 HG22 VAL 55 1HG2 VAL 55 8.576 -7.132 0.194 290 HG23 VAL 55 2HG2 VAL 55 9.479 -7.415 1.686 291 H LYS 56 H LYS 56 9.754 -11.382 -1.395 292 HA LYS 56 HA LYS 56 10.885 -13.156 -2.092 293 HB2 LYS 56 1HB LYS 56 11.378 -11.302 -4.461 294 HB3 LYS 56 2HB LYS 56 11.967 -12.939 -4.451 295 HG2 LYS 56 1HG LYS 56 9.318 -13.279 -3.593 296 HG3 LYS 56 2HG LYS 56 9.181 -11.926 -4.714 297 HD2 LYS 56 1HD LYS 56 10.189 -13.253 -6.493 298 HD3 LYS 56 2HD LYS 56 10.585 -14.552 -5.335 299 HE2 LYS 56 1HE LYS 56 8.328 -15.140 -4.984 300 HE3 LYS 56 2HE LYS 56 7.723 -13.655 -5.725 301 HZ1 LYS 56 3HZ LYS 56 7.534 -15.723 -7.053 302 HZ2 LYS 56 1HZ LYS 56 9.159 -15.631 -7.359 303 HZ3 LYS 56 2HZ LYS 56 8.102 -14.420 -7.807 304 HA PRO 57 HA PRO 57 15.104 -12.981 -0.819 305 HB2 PRO 57 1HB PRO 57 16.299 -15.112 -2.060 306 HB3 PRO 57 2HB PRO 57 15.125 -15.277 -0.727 307 HG2 PRO 57 1HG PRO 57 14.616 -15.488 -3.710 308 HG3 PRO 57 2HG PRO 57 14.075 -16.604 -2.423 309 HD2 PRO 57 1HD PRO 57 12.465 -14.689 -3.452 310 HD3 PRO 57 2HD PRO 57 12.397 -15.087 -1.726 311 H SER 58 H SER 58 14.424 -12.950 -4.290 312 HA SER 58 HA SER 58 17.108 -12.006 -4.986 313 HB2 SER 58 1HB SER 58 15.815 -12.448 -7.348 314 HB3 SER 58 2HB SER 58 16.729 -13.633 -6.446 315 HG SER 58 HG SER 58 13.965 -13.344 -6.708 316 H ASP 59 H ASP 59 16.427 -10.016 -3.697 317 HA ASP 59 HA ASP 59 16.271 -7.910 -5.592 318 HB2 ASP 59 1HB ASP 59 13.769 -8.419 -4.923 319 HB3 ASP 59 2HB ASP 59 14.216 -7.720 -3.375 320 H THR 60 H THR 60 16.257 -5.769 -3.752 321 HA THR 60 HA THR 60 18.091 -6.580 -1.523 322 HB THR 60 HB THR 60 18.169 -4.118 -3.297 323 HG1 THR 60 1HG THR 60 20.135 -6.023 -2.537 324 HG21 THR 60 3HG2 THR 60 18.535 -3.371 -0.963 325 HG22 THR 60 1HG2 THR 60 20.024 -3.303 -1.911 326 HG23 THR 60 2HG2 THR 60 19.769 -4.613 -0.738 327 H VAL 61 H VAL 61 16.899 -6.596 0.265 328 HA VAL 61 HA VAL 61 15.096 -4.317 0.828 329 HB VAL 61 HB VAL 61 13.504 -6.004 1.780 330 HG11 VAL 61 1HG1 VAL 61 12.512 -6.585 -0.317 331 HG12 VAL 61 2HG1 VAL 61 13.314 -5.037 -0.549 332 HG13 VAL 61 3HG1 VAL 61 14.058 -6.526 -1.169 333 HG21 VAL 61 3HG2 VAL 61 15.283 -7.843 2.036 334 HG22 VAL 61 1HG2 VAL 61 13.715 -8.333 1.435 335 HG23 VAL 61 2HG2 VAL 61 15.059 -8.149 0.297 336 HA PRO 62 HA PRO 62 16.816 -4.502 4.962 337 HB2 PRO 62 1HB PRO 62 14.735 -3.585 6.502 338 HB3 PRO 62 2HB PRO 62 15.672 -2.543 5.383 339 HG2 PRO 62 1HG PRO 62 13.013 -3.901 4.909 340 HG3 PRO 62 2HG PRO 62 13.481 -2.198 4.556 341 HD2 PRO 62 1HD PRO 62 13.459 -4.114 2.656 342 HD3 PRO 62 2HD PRO 62 14.678 -2.817 2.656 343 H ALA 63 H ALA 63 16.347 -5.372 7.226 344 HA ALA 63 HA ALA 63 15.652 -8.140 6.979 345 HB1 ALA 63 1HB ALA 63 16.298 -8.246 9.360 346 HB2 ALA 63 2HB ALA 63 17.496 -7.316 8.449 347 HB3 ALA 63 3HB ALA 63 16.303 -6.477 9.465 348 H GLY 64 H GLY 64 13.848 -9.166 7.516 349 HA2 GLY 64 1HA GLY 64 12.043 -9.778 8.760 350 HA3 GLY 64 2HA GLY 64 12.080 -8.241 9.632 351 H VAL 65 H VAL 65 11.775 -8.918 6.104 352 HA VAL 65 HA VAL 65 8.903 -8.225 6.137 353 HB VAL 65 HB VAL 65 9.348 -6.816 4.019 354 HG11 VAL 65 1HG1 VAL 65 10.219 -5.633 6.653 355 HG12 VAL 65 2HG1 VAL 65 9.578 -4.769 5.239 356 HG13 VAL 65 3HG1 VAL 65 8.543 -5.902 6.127 357 HG21 VAL 65 3HG2 VAL 65 11.424 -5.641 3.787 358 HG22 VAL 65 1HG2 VAL 65 12.105 -6.404 5.234 359 HG23 VAL 65 2HG2 VAL 65 11.792 -7.369 3.772 360 H ASP 66 H ASP 66 9.967 -10.790 6.069 361 HA ASP 66 HA ASP 66 11.427 -11.449 3.882 362 HB2 ASP 66 1HB ASP 66 11.036 -12.494 6.253 363 HB3 ASP 66 2HB ASP 66 9.798 -13.457 5.468 364 H ASP 67 H ASP 67 8.173 -11.317 3.868 365 HA ASP 67 HA ASP 67 7.893 -12.178 1.067 366 HB2 ASP 67 1HB ASP 67 6.681 -14.023 1.227 367 HB3 ASP 67 2HB ASP 67 7.381 -14.204 2.818 368 H TYR 68 H TYR 68 7.662 -9.754 2.807 369 HA TYR 68 HA TYR 68 4.874 -8.914 2.845 370 HB2 TYR 68 1HB TYR 68 7.539 -7.539 3.147 371 HB3 TYR 68 2HB TYR 68 6.079 -6.617 2.938 372 HD1 TYR 68 1HD TYR 68 6.224 -9.815 5.031 373 HD2 TYR 68 2HD TYR 68 5.808 -5.502 4.944 374 HE1 TYR 68 1HE TYR 68 5.565 -9.846 7.344 375 HE2 TYR 68 2HE TYR 68 4.960 -5.578 7.267 376 HH TYR 68 HH TYR 68 4.165 -8.554 8.906 377 H SER 69 H SER 69 3.912 -7.387 1.453 378 HA SER 69 HA SER 69 4.604 -7.385 -1.355 379 HB2 SER 69 1HB SER 69 2.529 -5.951 0.367 380 HB3 SER 69 2HB SER 69 2.506 -6.173 -1.368 381 HG SER 69 HG SER 69 1.285 -7.850 -0.879 382 H TYR 70 H TYR 70 5.208 -5.313 -2.420 383 HA TYR 70 HA TYR 70 5.588 -3.008 -0.689 384 HB2 TYR 70 1HB TYR 70 7.736 -2.399 -1.455 385 HB3 TYR 70 2HB TYR 70 7.858 -3.983 -0.779 386 HD1 TYR 70 2HD TYR 70 8.017 -6.011 -2.426 387 HD2 TYR 70 1HD TYR 70 8.518 -1.904 -3.662 388 HE1 TYR 70 2HE TYR 70 9.384 -6.747 -4.373 389 HE2 TYR 70 1HE TYR 70 9.877 -2.657 -5.599 390 HH TYR 70 HH TYR 70 11.409 -5.527 -5.811 391 H LEU 71 H LEU 71 5.888 -1.016 -1.956 392 HA LEU 71 HA LEU 71 4.716 -0.971 -4.661 393 HB2 LEU 71 1HB LEU 71 3.659 0.382 -2.135 394 HB3 LEU 71 2HB LEU 71 3.354 1.062 -3.726 395 HG LEU 71 HG LEU 71 2.567 -1.788 -3.041 396 HD11 LEU 71 1HD1 LEU 71 0.255 -0.876 -2.678 397 HD12 LEU 71 2HD1 LEU 71 0.936 0.759 -2.638 398 HD13 LEU 71 3HD1 LEU 71 1.439 -0.456 -1.434 399 HD21 LEU 71 3HD2 LEU 71 1.529 0.129 -5.147 400 HD22 LEU 71 1HD2 LEU 71 1.031 -1.549 -4.930 401 HD23 LEU 71 2HD2 LEU 71 2.675 -1.178 -5.466 402 H VAL 72 H VAL 72 5.807 0.573 -5.876 403 HA VAL 72 HA VAL 72 7.252 2.770 -4.629 404 HB VAL 72 HB VAL 72 8.605 0.722 -4.245 405 HG11 VAL 72 1HG1 VAL 72 8.972 0.634 -7.248 406 HG12 VAL 72 2HG1 VAL 72 9.832 -0.351 -6.054 407 HG13 VAL 72 3HG1 VAL 72 8.080 -0.548 -6.274 408 HG21 VAL 72 3HG2 VAL 72 9.914 2.722 -6.127 409 HG22 VAL 72 1HG2 VAL 72 9.710 2.933 -4.378 410 HG23 VAL 72 2HG2 VAL 72 10.761 1.657 -4.995 411 H ALA 73 H ALA 73 8.313 4.131 -6.510 412 HA ALA 73 HA ALA 73 6.475 3.974 -8.837 413 HB1 ALA 73 1HB ALA 73 7.030 6.208 -7.578 414 HB2 ALA 73 2HB ALA 73 8.601 6.054 -8.394 415 HB3 ALA 73 3HB ALA 73 7.133 6.181 -9.355 416 H ALA 74 H ALA 74 7.177 3.712 -10.848 417 HA ALA 74 HA ALA 74 9.409 2.119 -11.487 418 HB1 ALA 74 1HB ALA 74 8.699 2.695 -13.826 419 HB2 ALA 74 2HB ALA 74 7.323 2.239 -12.817 420 HB3 ALA 74 3HB ALA 74 7.644 3.946 -13.182 421 H ASP 75 H ASP 75 9.337 5.463 -10.918 422 HA ASP 75 HA ASP 75 11.895 5.943 -12.344 423 HB2 ASP 75 1HB ASP 75 11.001 7.987 -13.185 424 HB3 ASP 75 2HB ASP 75 9.677 6.847 -13.409 425 H ASP 76 H ASP 76 10.445 5.971 -9.370 426 HA ASP 76 HA ASP 76 12.492 7.818 -8.222 427 HB2 ASP 76 1HB ASP 76 10.219 8.884 -8.266 428 HB3 ASP 76 2HB ASP 76 9.616 7.512 -7.348 429 H GLN 77 H GLN 77 12.674 5.076 -8.781 430 HA GLN 77 HA GLN 77 11.784 3.227 -6.920 431 HB2 GLN 77 1HB GLN 77 14.556 3.252 -8.157 432 HB3 GLN 77 2HB GLN 77 13.786 1.872 -7.384 433 HG2 GLN 77 1HG GLN 77 12.922 1.252 -9.320 434 HG3 GLN 77 2HG GLN 77 11.925 2.690 -9.354 435 HE21 GLN 77 1HE2 GLN 77 12.510 4.397 -10.829 436 HE22 GLN 77 2HE2 GLN 77 13.922 4.276 -11.870 437 H ASP 78 H ASP 78 14.520 5.424 -6.536 438 HA ASP 78 HA ASP 78 15.347 4.230 -3.975 439 HB2 ASP 78 1HB ASP 78 16.466 6.594 -5.516 440 HB3 ASP 78 2HB ASP 78 17.225 5.799 -4.138 441 H GLY 79 H GLY 79 13.001 6.499 -4.818 442 HA2 GLY 79 1HA GLY 79 13.700 8.602 -2.938 443 HA3 GLY 79 2HA GLY 79 12.320 8.540 -4.012 444 H THR 80 H THR 80 10.713 6.675 -3.457 445 HA THR 80 HA THR 80 10.186 6.779 -0.525 446 HB THR 80 HB THR 80 7.881 7.011 -2.397 447 HG1 THR 80 1HG THR 80 9.354 8.577 -3.256 448 HG21 THR 80 3HG2 THR 80 7.721 6.916 0.124 449 HG22 THR 80 1HG2 THR 80 6.964 8.347 -0.590 450 HG23 THR 80 2HG2 THR 80 8.565 8.476 0.197 451 H ILE 81 H ILE 81 9.532 4.737 0.273 452 HA ILE 81 HA ILE 81 8.285 2.928 -1.656 453 HB ILE 81 HB ILE 81 10.872 2.566 -1.497 454 HG12 ILE 81 1HG1 ILE 81 8.803 0.362 -1.246 455 HG13 ILE 81 2HG1 ILE 81 9.614 1.061 -2.581 456 HG21 ILE 81 1HG2 ILE 81 10.181 1.229 1.135 457 HG22 ILE 81 2HG2 ILE 81 11.770 1.312 0.347 458 HG23 ILE 81 3HG2 ILE 81 11.036 2.789 0.979 459 HD11 ILE 81 3HD1 ILE 81 10.980 -0.734 -0.607 460 HD12 ILE 81 1HD1 ILE 81 10.485 -1.130 -2.259 461 HD13 ILE 81 2HD1 ILE 81 11.755 0.078 -1.987 462 H ILE 82 H ILE 82 6.877 1.434 -0.680 463 HA ILE 82 HA ILE 82 6.677 1.521 2.270 464 HB ILE 82 HB ILE 82 4.277 1.658 0.402 465 HG12 ILE 82 1HG1 ILE 82 5.289 3.879 2.242 466 HG13 ILE 82 2HG1 ILE 82 5.564 3.821 0.530 467 HG21 ILE 82 1HG2 ILE 82 3.215 2.131 2.798 468 HG22 ILE 82 2HG2 ILE 82 3.548 0.477 2.281 469 HG23 ILE 82 3HG2 ILE 82 4.647 1.302 3.393 470 HD11 ILE 82 3HD1 ILE 82 3.210 3.854 0.003 471 HD12 ILE 82 1HD1 ILE 82 2.803 4.010 1.732 472 HD13 ILE 82 2HD1 ILE 82 3.726 5.283 0.916 473 H PHE 83 H PHE 83 6.290 -0.460 3.148 474 HA PHE 83 HA PHE 83 5.982 -2.811 1.378 475 HB2 PHE 83 1HB PHE 83 7.358 -2.497 4.080 476 HB3 PHE 83 2HB PHE 83 7.072 -4.016 3.317 477 HD1 PHE 83 1HD PHE 83 8.915 -0.744 2.888 478 HD2 PHE 83 2HD PHE 83 8.614 -4.865 1.657 479 HE1 PHE 83 1HE PHE 83 11.211 -0.646 2.005 480 HE2 PHE 83 2HE PHE 83 10.894 -4.701 0.666 481 HZ PHE 83 HZ PHE 83 12.192 -2.635 0.864 482 H PHE 84 H PHE 84 4.400 -4.403 2.264 483 HA PHE 84 HA PHE 84 3.115 -3.808 4.768 484 HB2 PHE 84 1HB PHE 84 0.851 -3.605 3.978 485 HB3 PHE 84 2HB PHE 84 1.796 -2.326 3.257 486 HD1 PHE 84 2HD PHE 84 2.356 -2.384 0.814 487 HD2 PHE 84 1HD PHE 84 -0.204 -5.357 2.623 488 HE1 PHE 84 2HE PHE 84 1.548 -3.076 -1.428 489 HE2 PHE 84 1HE PHE 84 -1.007 -6.029 0.374 490 HZ PHE 84 HZ PHE 84 -0.147 -4.889 -1.641 491 H LYS 85 H LYS 85 1.654 -5.699 5.377 492 HA LYS 85 HA LYS 85 1.753 -7.970 3.480 493 HB2 LYS 85 1HB LYS 85 3.747 -8.022 4.819 494 HB3 LYS 85 2HB LYS 85 2.820 -8.298 6.286 495 HG2 LYS 85 1HG LYS 85 2.429 -10.077 3.866 496 HG3 LYS 85 2HG LYS 85 3.932 -10.254 4.716 497 HD2 LYS 85 1HD LYS 85 1.688 -10.162 6.562 498 HD3 LYS 85 2HD LYS 85 1.523 -11.497 5.412 499 HE2 LYS 85 1HE LYS 85 4.075 -10.953 6.908 500 HE3 LYS 85 2HE LYS 85 2.744 -11.812 7.691 501 HZ1 LYS 85 3HZ LYS 85 4.201 -12.716 5.281 502 HZ2 LYS 85 1HZ LYS 85 2.849 -13.430 5.852 503 HZ3 LYS 85 2HZ LYS 85 4.223 -13.407 6.759 504 H ALA 86 H ALA 86 -0.277 -8.441 3.235 505 HA ALA 86 HA ALA 86 -2.295 -7.816 5.260 506 HB1 ALA 86 1HB ALA 86 -2.724 -7.355 2.883 507 HB2 ALA 86 2HB ALA 86 -2.577 -9.085 2.513 508 HB3 ALA 86 3HB ALA 86 -3.882 -8.515 3.577 509 H GLU 87 H GLU 87 -1.563 -9.090 6.852 510 HA GLU 87 HA GLU 87 -1.473 -12.004 6.786 511 HB2 GLU 87 1HB GLU 87 -0.043 -10.422 8.163 512 HB3 GLU 87 2HB GLU 87 -1.462 -10.008 9.113 513 HG2 GLU 87 1HG GLU 87 -1.493 -12.098 10.181 514 HG3 GLU 87 2HG GLU 87 -0.655 -12.907 8.859 515 H GLY 88 H GLY 88 -2.926 -13.003 8.724 516 HA2 GLY 88 1HA GLY 88 -5.594 -13.034 8.026 517 HA3 GLY 88 2HA GLY 88 -4.935 -13.468 9.614 518 H GLN 89 H GLN 89 -7.057 -11.446 8.073 519 HA GLN 89 HA GLN 89 -8.313 -9.623 8.551 520 HB2 GLN 89 1HB GLN 89 -7.731 -10.523 11.388 521 HB3 GLN 89 2HB GLN 89 -8.928 -9.316 11.011 522 HG2 GLN 89 1HG GLN 89 -9.060 -12.133 9.882 523 HG3 GLN 89 2HG GLN 89 -9.754 -11.674 11.419 524 HE21 GLN 89 1HE2 GLN 89 -10.409 -8.879 9.521 525 HE22 GLN 89 2HE2 GLN 89 -11.891 -9.480 8.815 526 H THR 90 H THR 90 -5.150 -9.177 8.551 527 HA THR 90 HA THR 90 -5.218 -6.496 9.778 528 HB THR 90 HB THR 90 -3.013 -8.496 10.382 529 HG1 THR 90 1HG THR 90 -4.866 -9.396 11.239 530 HG21 THR 90 3HG2 THR 90 -2.503 -6.108 10.858 531 HG22 THR 90 1HG2 THR 90 -2.583 -7.066 12.326 532 HG23 THR 90 2HG2 THR 90 -3.944 -6.015 11.899 533 H VAL 91 H VAL 91 -3.377 -5.170 9.067 534 HA VAL 91 HA VAL 91 -1.685 -6.299 6.946 535 HB VAL 91 HB VAL 91 -2.915 -3.519 6.780 536 HG11 VAL 91 1HG1 VAL 91 -0.644 -3.743 5.811 537 HG12 VAL 91 2HG1 VAL 91 -1.189 -5.125 4.838 538 HG13 VAL 91 3HG1 VAL 91 -1.856 -3.503 4.545 539 HG21 VAL 91 3HG2 VAL 91 -4.632 -5.262 6.247 540 HG22 VAL 91 1HG2 VAL 91 -4.158 -4.300 4.857 541 HG23 VAL 91 2HG2 VAL 91 -3.526 -5.957 5.053 542 H ILE 92 H ILE 92 0.330 -6.186 7.916 543 HA ILE 92 HA ILE 92 0.930 -4.042 9.844 544 HB ILE 92 HB ILE 92 2.708 -6.208 8.701 545 HG12 ILE 92 1HG1 ILE 92 2.542 -7.284 10.943 546 HG13 ILE 92 2HG1 ILE 92 1.182 -6.241 11.353 547 HG21 ILE 92 1HG2 ILE 92 3.869 -4.209 9.633 548 HG22 ILE 92 2HG2 ILE 92 3.002 -4.421 11.164 549 HG23 ILE 92 3HG2 ILE 92 4.167 -5.644 10.619 550 HD11 ILE 92 3HD1 ILE 92 -0.229 -7.418 9.803 551 HD12 ILE 92 1HD1 ILE 92 1.180 -8.113 8.949 552 HD13 ILE 92 2HD1 ILE 92 0.750 -8.658 10.581 553 H ILE 93 H ILE 93 1.069 -2.097 8.740 554 HA ILE 93 HA ILE 93 2.265 -2.012 6.055 555 HB ILE 93 HB ILE 93 1.261 0.313 7.734 556 HG12 ILE 93 1HG1 ILE 93 -0.306 -1.405 5.758 557 HG13 ILE 93 2HG1 ILE 93 -0.672 -1.187 7.483 558 HG21 ILE 93 1HG2 ILE 93 1.666 -0.047 4.733 559 HG22 ILE 93 2HG2 ILE 93 1.249 1.458 5.571 560 HG23 ILE 93 3HG2 ILE 93 2.829 0.753 5.797 561 HD11 ILE 93 3HD1 ILE 93 -0.924 0.961 5.378 562 HD12 ILE 93 1HD1 ILE 93 -2.214 0.074 6.188 563 HD13 ILE 93 2HD1 ILE 93 -1.173 1.164 7.134 564 H LYS 94 H LYS 94 4.339 -1.333 5.733 565 HA LYS 94 HA LYS 94 5.969 -0.449 8.032 566 HB2 LYS 94 1HB LYS 94 6.386 -2.823 6.190 567 HB3 LYS 94 2HB LYS 94 7.739 -2.050 6.916 568 HG2 LYS 94 1HG LYS 94 6.528 -2.380 9.199 569 HG3 LYS 94 2HG LYS 94 5.495 -3.503 8.316 570 HD2 LYS 94 1HD LYS 94 7.392 -4.916 7.782 571 HD3 LYS 94 2HD LYS 94 8.538 -3.689 8.352 572 HE2 LYS 94 1HE LYS 94 7.617 -3.939 10.663 573 HE3 LYS 94 2HE LYS 94 6.581 -5.264 10.087 574 HZ1 LYS 94 3HZ LYS 94 9.542 -5.316 9.826 575 HZ2 LYS 94 1HZ LYS 94 8.483 -6.559 9.610 576 HZ3 LYS 94 2HZ LYS 94 8.747 -5.971 11.096 577 H TYR 95 H TYR 95 6.313 1.685 7.322 578 HA TYR 95 HA TYR 95 7.210 2.095 4.500 579 HB2 TYR 95 1HB TYR 95 6.015 4.237 4.600 580 HB3 TYR 95 2HB TYR 95 4.928 2.881 4.813 581 HD1 TYR 95 1HD TYR 95 3.963 2.309 6.998 582 HD2 TYR 95 2HD TYR 95 6.306 5.871 6.395 583 HE1 TYR 95 1HE TYR 95 3.192 3.173 9.177 584 HE2 TYR 95 2HE TYR 95 5.536 6.754 8.554 585 HH TYR 95 HH TYR 95 3.384 4.946 10.824 586 H THR 96 H THR 96 8.390 4.321 4.265 587 HA THR 96 HA THR 96 10.028 5.058 6.564 588 HB THR 96 HB THR 96 11.113 3.028 5.828 589 HG1 THR 96 1HG THR 96 13.119 4.105 5.066 590 HG21 THR 96 3HG2 THR 96 11.322 4.271 3.045 591 HG22 THR 96 1HG2 THR 96 10.301 2.883 3.473 592 HG23 THR 96 2HG2 THR 96 12.052 2.740 3.579 593 H SER 97 H SER 97 11.610 6.801 5.806 594 HA SER 97 HA SER 97 10.438 8.467 3.673 595 HB2 SER 97 1HB SER 97 12.242 10.112 4.613 596 HB3 SER 97 2HB SER 97 10.737 9.868 5.500 597 HG SER 97 HG SER 97 12.688 9.818 6.782 598 H GLN 98 H GLN 98 12.803 6.157 4.133 599 HA GLN 98 HA GLN 98 14.228 6.933 1.624 600 HB2 GLN 98 1HB GLN 98 15.626 6.628 4.317 601 HB3 GLN 98 2HB GLN 98 16.453 6.770 2.782 602 HG2 GLN 98 1HG GLN 98 15.545 9.057 2.470 603 HG3 GLN 98 2HG GLN 98 14.680 8.934 4.007 604 HE21 GLN 98 1HE2 GLN 98 17.300 10.469 2.833 605 HE22 GLN 98 2HE2 GLN 98 18.447 10.252 4.111 606 H ARG 99 H ARG 99 15.303 5.205 0.621 607 HA ARG 99 HA ARG 99 14.470 2.491 1.188 608 HB2 ARG 99 1HB ARG 99 16.303 3.818 -0.836 609 HB3 ARG 99 2HB ARG 99 16.326 2.076 -0.698 610 HG2 ARG 99 1HG ARG 99 13.598 2.789 -0.778 611 HG3 ARG 99 2HG ARG 99 14.369 3.730 -2.025 612 HD2 ARG 99 1HD ARG 99 14.636 0.677 -1.755 613 HD3 ARG 99 2HD ARG 99 13.410 1.494 -2.730 614 HE ARG 99 HE ARG 99 16.118 2.248 -3.487 615 HH11 ARG 99 1HH1 ARG 99 13.692 -0.367 -4.024 616 HH12 ARG 99 2HH1 ARG 99 14.008 -0.418 -5.722 617 HH21 ARG 99 1HH2 ARG 99 16.578 1.994 -5.716 618 HH22 ARG 99 2HH2 ARG 99 15.819 0.741 -6.636 619 H ASN 100 H ASN 100 16.383 4.014 3.136 620 HA ASN 100 HA ASN 100 18.020 1.642 3.686 621 HB2 ASN 100 1HB ASN 100 20.045 2.605 3.753 622 HB3 ASN 100 2HB ASN 100 19.345 3.327 2.322 623 HD21 ASN 100 1HD2 ASN 100 17.706 5.182 4.370 624 HD22 ASN 100 2HD2 ASN 100 18.963 6.418 4.591 625 H THR 101 H THR 101 15.749 3.284 5.075 626 HA THR 101 HA THR 101 17.039 3.039 7.762 627 HB THR 101 HB THR 101 15.062 4.672 8.319 628 HG1 THR 101 1HG THR 101 14.690 6.115 6.674 629 HG21 THR 101 3HG2 THR 101 16.595 6.589 8.014 630 HG22 THR 101 1HG2 THR 101 17.606 5.615 6.925 631 HG23 THR 101 2HG2 THR 101 17.471 5.180 8.638 632 H LYS 102 H LYS 102 15.540 2.444 9.536 633 HA LYS 102 HA LYS 102 14.321 -0.072 8.752 634 HB2 LYS 102 1HB LYS 102 15.660 0.293 10.852 635 HB3 LYS 102 2HB LYS 102 14.339 1.265 11.504 636 HG2 LYS 102 1HG LYS 102 13.551 -1.424 10.444 637 HG3 LYS 102 2HG LYS 102 14.671 -1.475 11.807 638 HD2 LYS 102 1HD LYS 102 13.163 -0.507 13.296 639 HD3 LYS 102 2HD LYS 102 12.209 0.235 12.023 640 HE2 LYS 102 1HE LYS 102 10.993 -1.612 13.016 641 HE3 LYS 102 2HE LYS 102 11.330 -1.932 11.314 642 HZ1 LYS 102 3HZ LYS 102 11.682 -3.872 12.649 643 HZ2 LYS 102 1HZ LYS 102 12.744 -3.122 13.634 644 HZ3 LYS 102 2HZ LYS 102 13.128 -3.416 12.036 645 H LEU 103 H LEU 103 12.195 -0.483 8.417 646 HA LEU 103 HA LEU 103 10.407 1.689 7.927 647 HB2 LEU 103 1HB LEU 103 9.724 -1.258 8.397 648 HB3 LEU 103 2HB LEU 103 8.686 -0.086 7.641 649 HG LEU 103 HG LEU 103 9.393 -1.277 5.836 650 HD11 LEU 103 1HD1 LEU 103 10.895 0.022 4.472 651 HD12 LEU 103 2HD1 LEU 103 11.519 0.871 5.884 652 HD13 LEU 103 3HD1 LEU 103 9.814 1.086 5.383 653 HD21 LEU 103 3HD2 LEU 103 11.402 -2.308 5.439 654 HD22 LEU 103 1HD2 LEU 103 11.102 -2.606 7.149 655 HD23 LEU 103 2HD2 LEU 103 12.294 -1.370 6.656 656 H LYS 104 H LYS 104 8.607 2.403 8.965 657 HA LYS 104 HA LYS 104 8.268 2.206 11.813 658 HB2 LYS 104 1HB LYS 104 6.663 3.177 9.400 659 HB3 LYS 104 2HB LYS 104 5.922 3.060 10.966 660 HG2 LYS 104 1HG LYS 104 6.561 5.273 10.814 661 HG3 LYS 104 2HG LYS 104 7.709 4.535 11.912 662 HD2 LYS 104 1HD LYS 104 9.478 4.608 10.323 663 HD3 LYS 104 2HD LYS 104 8.356 4.941 9.002 664 HE2 LYS 104 1HE LYS 104 7.675 7.062 10.405 665 HE3 LYS 104 2HE LYS 104 9.103 6.723 11.382 666 HZ1 LYS 104 3HZ LYS 104 9.039 7.446 8.517 667 HZ2 LYS 104 1HZ LYS 104 10.420 6.959 9.295 668 HZ3 LYS 104 2HZ LYS 104 9.667 8.312 9.749 669 H ALA 105 H ALA 105 6.086 1.376 12.635 670 HA ALA 105 HA ALA 105 5.017 -0.942 11.096 671 HB1 ALA 105 1HB ALA 105 4.628 -2.159 13.228 672 HB2 ALA 105 2HB ALA 105 6.331 -2.010 12.804 673 HB3 ALA 105 3HB ALA 105 5.640 -0.966 14.069 674 H LYS 106 H LYS 106 3.128 -0.187 10.474 675 HA LYS 106 HA LYS 106 1.247 1.022 12.473 676 HB2 LYS 106 1HB LYS 106 1.902 2.689 10.832 677 HB3 LYS 106 2HB LYS 106 1.633 1.551 9.511 678 HG2 LYS 106 1HG LYS 106 -0.214 2.873 9.366 679 HG3 LYS 106 2HG LYS 106 -0.839 1.522 10.318 680 HD2 LYS 106 1HD LYS 106 -0.761 2.803 12.330 681 HD3 LYS 106 2HD LYS 106 0.210 4.093 11.582 682 HE2 LYS 106 1HE LYS 106 -1.577 4.776 10.141 683 HE3 LYS 106 2HE LYS 106 -2.545 3.357 10.545 684 HZ1 LYS 106 3HZ LYS 106 -2.608 4.242 12.872 685 HZ2 LYS 106 1HZ LYS 106 -3.402 5.154 11.751 686 HZ3 LYS 106 2HZ LYS 106 -1.939 5.627 12.308 687 H ALA 107 H ALA 107 0.660 -1.089 13.095 688 HA ALA 107 HA ALA 107 -0.340 -2.945 11.010 689 HB1 ALA 107 1HB ALA 107 0.840 -3.981 12.932 690 HB2 ALA 107 2HB ALA 107 -0.313 -3.210 14.051 691 HB3 ALA 107 3HB ALA 107 -0.872 -4.441 12.902 692 H LEU 108 H LEU 108 -2.475 -3.134 10.590 693 HA LEU 108 HA LEU 108 -4.483 -1.642 12.187 694 HB2 LEU 108 1HB LEU 108 -4.052 -1.469 9.165 695 HB3 LEU 108 2HB LEU 108 -5.428 -0.775 10.024 696 HG LEU 108 HG LEU 108 -2.528 0.068 10.465 697 HD11 LEU 108 1HD1 LEU 108 -3.091 2.016 9.069 698 HD12 LEU 108 2HD1 LEU 108 -4.697 1.309 8.740 699 HD13 LEU 108 3HD1 LEU 108 -3.205 0.489 8.189 700 HD21 LEU 108 3HD2 LEU 108 -4.098 0.543 12.370 701 HD22 LEU 108 1HD2 LEU 108 -5.135 1.429 11.234 702 HD23 LEU 108 2HD2 LEU 108 -3.495 1.997 11.608 703 H THR 109 H THR 109 -6.584 -2.660 11.995 704 HA THR 109 HA THR 109 -6.550 -5.340 10.877 705 HB THR 109 HB THR 109 -9.135 -4.929 11.477 706 HG1 THR 109 1HG THR 109 -9.340 -3.550 13.207 707 HG21 THR 109 3HG2 THR 109 -6.829 -5.388 13.440 708 HG22 THR 109 1HG2 THR 109 -7.633 -6.629 12.467 709 HG23 THR 109 2HG2 THR 109 -8.532 -5.804 13.731 710 H LEU 110 H LEU 110 -7.782 -6.105 9.076 711 HA LEU 110 HA LEU 110 -7.924 -4.463 6.788 712 HB2 LEU 110 1HB LEU 110 -9.283 -7.064 7.619 713 HB3 LEU 110 2HB LEU 110 -9.655 -6.302 6.085 714 HG LEU 110 HG LEU 110 -6.881 -7.228 6.900 715 HD11 LEU 110 1HD1 LEU 110 -8.589 -9.069 6.468 716 HD12 LEU 110 2HD1 LEU 110 -7.233 -9.060 5.342 717 HD13 LEU 110 3HD1 LEU 110 -8.801 -8.421 4.838 718 HD21 LEU 110 3HD2 LEU 110 -6.326 -6.882 4.526 719 HD22 LEU 110 1HD2 LEU 110 -6.785 -5.360 5.266 720 HD23 LEU 110 2HD2 LEU 110 -7.946 -6.199 4.220 721 H SER 111 H SER 111 -10.395 -5.254 9.240 722 HA SER 111 HA SER 111 -12.539 -4.006 7.994 723 HB2 SER 111 1HB SER 111 -12.496 -5.295 10.238 724 HB3 SER 111 2HB SER 111 -12.110 -3.731 10.990 725 HG SER 111 HG SER 111 -14.392 -4.140 10.896 726 H GLN 112 H GLN 112 -9.911 -2.405 9.910 727 HA GLN 112 HA GLN 112 -11.062 0.152 9.968 728 HB2 GLN 112 1HB GLN 112 -8.611 -1.035 10.820 729 HB3 GLN 112 2HB GLN 112 -8.133 0.224 9.693 730 HG2 GLN 112 1HG GLN 112 -10.132 1.444 11.259 731 HG3 GLN 112 2HG GLN 112 -9.270 0.405 12.389 732 HE21 GLN 112 1HE2 GLN 112 -8.746 2.835 9.773 733 HE22 GLN 112 2HE2 GLN 112 -7.510 3.725 10.599 734 H LEU 113 H LEU 113 -8.665 -1.169 7.628 735 HA LEU 113 HA LEU 113 -8.589 1.076 5.929 736 HB2 LEU 113 1HB LEU 113 -8.346 -1.911 5.312 737 HB3 LEU 113 2HB LEU 113 -8.037 -0.668 4.122 738 HG LEU 113 HG LEU 113 -6.490 -1.043 6.708 739 HD11 LEU 113 1HD1 LEU 113 -6.102 -2.801 4.987 740 HD12 LEU 113 2HD1 LEU 113 -4.672 -1.795 5.231 741 HD13 LEU 113 3HD1 LEU 113 -5.688 -1.548 3.795 742 HD21 LEU 113 3HD2 LEU 113 -4.887 0.600 5.761 743 HD22 LEU 113 1HD2 LEU 113 -6.462 1.319 6.067 744 HD23 LEU 113 2HD2 LEU 113 -6.016 0.904 4.418 745 H LYS 114 H LYS 114 -10.957 -1.584 6.007 746 HA LYS 114 HA LYS 114 -12.215 -0.808 3.540 747 HB2 LYS 114 1HB LYS 114 -12.221 -3.094 4.490 748 HB3 LYS 114 2HB LYS 114 -13.222 -2.562 5.845 749 HG2 LYS 114 1HG LYS 114 -14.179 -2.112 2.998 750 HG3 LYS 114 2HG LYS 114 -14.216 -3.713 3.701 751 HD2 LYS 114 1HD LYS 114 -15.656 -3.098 5.453 752 HD3 LYS 114 2HD LYS 114 -15.587 -1.381 5.059 753 HE2 LYS 114 1HE LYS 114 -16.429 -3.205 2.838 754 HE3 LYS 114 2HE LYS 114 -17.546 -3.062 4.194 755 HZ1 LYS 114 3HZ LYS 114 -18.062 -1.419 2.559 756 HZ2 LYS 114 1HZ LYS 114 -16.558 -0.746 2.627 757 HZ3 LYS 114 2HZ LYS 114 -17.585 -0.725 3.933 758 H LYS 115 H LYS 115 -12.747 -0.051 6.972 759 HA LYS 115 HA LYS 115 -15.228 1.395 6.585 760 HB2 LYS 115 1HB LYS 115 -13.404 0.577 8.785 761 HB3 LYS 115 2HB LYS 115 -13.796 2.234 8.901 762 HG2 LYS 115 1HG LYS 115 -15.450 1.285 10.159 763 HG3 LYS 115 2HG LYS 115 -16.309 1.489 8.640 764 HD2 LYS 115 1HD LYS 115 -14.968 -1.116 9.563 765 HD3 LYS 115 2HD LYS 115 -16.649 -0.681 9.852 766 HE2 LYS 115 1HE LYS 115 -16.863 -0.406 7.304 767 HE3 LYS 115 2HE LYS 115 -15.359 -1.349 7.202 768 HZ1 LYS 115 3HZ LYS 115 -17.726 -2.276 8.721 769 HZ2 LYS 115 1HZ LYS 115 -16.465 -3.194 8.188 770 HZ3 LYS 115 2HZ LYS 115 -17.563 -2.584 7.132 771 H GLU 116 H GLU 116 -11.758 2.215 6.453 772 HA GLU 116 HA GLU 116 -12.288 5.037 6.762 773 HB2 GLU 116 1HB GLU 116 -9.819 3.321 6.357 774 HB3 GLU 116 2HB GLU 116 -9.722 5.076 6.291 775 HG2 GLU 116 1HG GLU 116 -10.776 3.472 8.659 776 HG3 GLU 116 2HG GLU 116 -9.203 4.247 8.541 777 H PHE 117 H PHE 117 -11.130 3.015 3.949 778 HA PHE 117 HA PHE 117 -11.864 5.310 2.220 779 HB2 PHE 117 1HB PHE 117 -9.627 3.379 1.715 780 HB3 PHE 117 2HB PHE 117 -9.918 4.931 0.986 781 HD1 PHE 117 2HD PHE 117 -9.531 7.050 2.434 782 HD2 PHE 117 1HD PHE 117 -8.251 3.095 3.619 783 HE1 PHE 117 2HE PHE 117 -7.993 8.038 4.121 784 HE2 PHE 117 1HE PHE 117 -6.756 4.089 5.302 785 HZ PHE 117 HZ PHE 117 -6.600 6.555 5.556 786 H TYR 118 H TYR 118 -13.252 2.580 2.962 787 HA TYR 118 HA TYR 118 -13.955 1.986 0.165 788 HB2 TYR 118 1HB TYR 118 -12.154 0.331 1.109 789 HB3 TYR 118 2HB TYR 118 -13.539 -0.379 1.896 790 HD1 TYR 118 1HD TYR 118 -12.568 0.953 -1.509 791 HD2 TYR 118 2HD TYR 118 -14.666 -2.081 0.737 792 HE1 TYR 118 1HE TYR 118 -13.083 -0.216 -3.637 793 HE2 TYR 118 2HE TYR 118 -15.075 -3.340 -1.336 794 HH TYR 118 HH TYR 118 -13.908 -2.279 -4.503 795 H GLN 119 H GLN 119 -15.159 3.358 2.435 796 HA GLN 119 HA GLN 119 -17.493 1.788 3.164 797 HB2 GLN 119 1HB GLN 119 -17.980 3.550 4.671 798 HB3 GLN 119 2HB GLN 119 -16.288 3.132 4.802 799 HG2 GLN 119 1HG GLN 119 -17.349 5.600 3.366 800 HG3 GLN 119 2HG GLN 119 -16.764 5.568 5.023 801 HE21 GLN 119 1HE2 GLN 119 -15.551 7.326 3.128 802 HE22 GLN 119 2HE2 GLN 119 -13.916 6.739 2.896 803 H THR 120 H THR 120 -16.805 4.211 0.732 804 HA THR 120 HA THR 120 -19.600 5.029 0.541 805 HB THR 120 HB THR 120 -18.908 6.752 -0.833 806 HG1 THR 120 1HG THR 120 -16.970 6.800 -1.950 807 HG21 THR 120 3HG2 THR 120 -16.331 6.267 0.737 808 HG22 THR 120 1HG2 THR 120 -17.814 6.931 1.442 809 HG23 THR 120 2HG2 THR 120 -16.976 7.813 0.165 810 H ARG 121 H ARG 121 -19.938 5.334 -2.192 811 HA ARG 121 HA ARG 121 -19.703 2.590 -3.404 812 HB2 ARG 121 1HB ARG 121 -21.584 4.846 -4.264 813 HB3 ARG 121 2HB ARG 121 -21.430 3.274 -5.017 814 HG2 ARG 121 1HG ARG 121 -22.655 3.883 -2.299 815 HG3 ARG 121 2HG ARG 121 -23.480 3.451 -3.789 816 HD2 ARG 121 1HD ARG 121 -23.559 1.457 -2.634 817 HD3 ARG 121 2HD ARG 121 -22.165 1.219 -3.688 818 HE ARG 121 HE ARG 121 -20.716 1.396 -1.853 819 HH11 ARG 121 1HH1 ARG 121 -24.092 1.860 -0.615 820 HH12 ARG 121 2HH1 ARG 121 -23.464 2.188 0.983 821 HH21 ARG 121 1HH2 ARG 121 -20.123 1.710 0.271 822 HH22 ARG 121 2HH2 ARG 121 -21.323 1.977 1.498 823 H SER 122 H SER 122 -19.403 6.164 -4.000 824 HA SER 122 HA SER 122 -18.320 5.911 -6.583 825 HB2 SER 122 1HB SER 122 -18.686 8.022 -4.543 826 HB3 SER 122 2HB SER 122 -17.245 8.270 -5.540 827 HG SER 122 HG SER 122 -18.364 8.494 -7.246 828 H GLN 123 H GLN 123 -16.617 5.306 -3.517 829 HA GLN 123 HA GLN 123 -14.001 5.815 -4.616 830 HB2 GLN 123 1HB GLN 123 -13.195 5.097 -2.657 831 HB3 GLN 123 2HB GLN 123 -14.808 5.493 -2.130 832 HG2 GLN 123 1HG GLN 123 -13.694 2.716 -2.705 833 HG3 GLN 123 2HG GLN 123 -14.021 3.482 -1.155 834 HE21 GLN 123 1HE2 GLN 123 -15.199 1.071 -1.164 835 HE22 GLN 123 2HE2 GLN 123 -16.918 1.378 -1.361 836 H LYS 124 H LYS 124 -16.318 3.221 -4.889 837 HA LYS 124 HA LYS 124 -14.516 1.193 -5.874 838 HB2 LYS 124 1HB LYS 124 -17.467 1.544 -6.587 839 HB3 LYS 124 2HB LYS 124 -16.496 0.089 -6.793 840 HG2 LYS 124 1HG LYS 124 -16.078 0.075 -4.294 841 HG3 LYS 124 2HG LYS 124 -17.232 1.393 -4.148 842 HD2 LYS 124 1HD LYS 124 -18.940 0.016 -4.105 843 HD3 LYS 124 2HD LYS 124 -18.537 -0.641 -5.691 844 HE2 LYS 124 1HE LYS 124 -17.292 -1.513 -3.058 845 HE3 LYS 124 2HE LYS 124 -18.659 -2.333 -3.835 846 HZ1 LYS 124 3HZ LYS 124 -17.267 -2.829 -5.721 847 HZ2 LYS 124 1HZ LYS 124 -16.474 -3.361 -4.363 848 HZ3 LYS 124 2HZ LYS 124 -16.001 -1.998 -5.116 849 H ARG 125 H ARG 125 -15.279 4.191 -7.282 850 HA ARG 125 HA ARG 125 -14.394 3.250 -9.962 851 HB2 ARG 125 1HB ARG 125 -15.404 5.877 -8.873 852 HB3 ARG 125 2HB ARG 125 -14.205 5.906 -10.167 853 HG2 ARG 125 1HG ARG 125 -16.525 6.020 -10.950 854 HG3 ARG 125 2HG ARG 125 -15.573 4.687 -11.630 855 HD2 ARG 125 1HD ARG 125 -16.753 3.089 -10.122 856 HD3 ARG 125 2HD ARG 125 -17.603 4.436 -9.354 857 HE ARG 125 HE ARG 125 -19.042 4.585 -11.117 858 HH11 ARG 125 1HH1 ARG 125 -16.409 2.364 -12.132 859 HH12 ARG 125 2HH1 ARG 125 -16.876 2.379 -13.783 860 HH21 ARG 125 1HH2 ARG 125 -19.852 4.304 -13.169 861 HH22 ARG 125 2HH2 ARG 125 -19.051 3.363 -14.364 862 H GLU 126 H GLU 126 -13.252 5.807 -7.756 863 HA GLU 126 HA GLU 126 -10.770 5.787 -8.843 864 HB2 GLU 126 1HB GLU 126 -12.029 6.739 -6.269 865 HB3 GLU 126 2HB GLU 126 -10.273 6.639 -6.187 866 HG2 GLU 126 1HG GLU 126 -9.929 8.173 -7.861 867 HG3 GLU 126 2HG GLU 126 -11.543 8.005 -8.550 868 H VAL 127 H VAL 127 -11.483 4.139 -5.791 869 HA VAL 127 HA VAL 127 -8.874 3.099 -5.349 870 HB VAL 127 HB VAL 127 -11.546 1.956 -4.431 871 HG11 VAL 127 1HG1 VAL 127 -10.341 0.926 -2.600 872 HG12 VAL 127 2HG1 VAL 127 -9.699 0.339 -4.140 873 HG13 VAL 127 3HG1 VAL 127 -8.790 1.555 -3.214 874 HG21 VAL 127 3HG2 VAL 127 -9.648 3.936 -3.073 875 HG22 VAL 127 1HG2 VAL 127 -11.251 4.322 -3.711 876 HG23 VAL 127 2HG2 VAL 127 -11.100 3.232 -2.328 877 H ASP 128 H ASP 128 -11.737 1.397 -6.770 878 HA ASP 128 HA ASP 128 -10.270 -0.893 -7.595 879 HB2 ASP 128 1HB ASP 128 -12.906 -0.043 -7.684 880 HB3 ASP 128 2HB ASP 128 -12.508 -0.102 -9.393 881 H ASP 129 H ASP 129 -10.481 2.273 -9.106 882 HA ASP 129 HA ASP 129 -9.395 1.514 -11.654 883 HB2 ASP 129 1HB ASP 129 -10.781 3.418 -11.359 884 HB3 ASP 129 2HB ASP 129 -9.573 4.227 -10.355 885 H TYR 130 H TYR 130 -8.021 2.887 -8.633 886 HA TYR 130 HA TYR 130 -5.314 2.983 -9.465 887 HB2 TYR 130 1HB TYR 130 -6.300 2.266 -6.703 888 HB3 TYR 130 2HB TYR 130 -4.730 2.914 -7.118 889 HD1 TYR 130 1HD TYR 130 -6.002 5.170 -9.059 890 HD2 TYR 130 2HD TYR 130 -6.722 3.930 -4.996 891 HE1 TYR 130 1HE TYR 130 -6.807 7.434 -8.512 892 HE2 TYR 130 2HE TYR 130 -7.628 6.166 -4.477 893 HH TYR 130 HH TYR 130 -7.743 8.804 -6.899 894 H VAL 131 H VAL 131 -7.220 0.231 -8.147 895 HA VAL 131 HA VAL 131 -4.931 -1.546 -8.215 896 HB VAL 131 HB VAL 131 -7.887 -2.292 -8.200 897 HG11 VAL 131 1HG1 VAL 131 -5.301 -3.782 -7.598 898 HG12 VAL 131 2HG1 VAL 131 -6.859 -4.355 -6.981 899 HG13 VAL 131 3HG1 VAL 131 -6.586 -4.253 -8.724 900 HG21 VAL 131 3HG2 VAL 131 -6.030 -2.103 -5.793 901 HG22 VAL 131 1HG2 VAL 131 -7.177 -0.823 -6.222 902 HG23 VAL 131 2HG2 VAL 131 -7.782 -2.410 -5.818 903 H ALA 132 H ALA 132 -7.320 -0.567 -10.656 904 HA ALA 132 HA ALA 132 -6.572 -2.663 -12.546 905 HB1 ALA 132 1HB ALA 132 -8.033 -1.414 -14.077 906 HB2 ALA 132 2HB ALA 132 -8.830 -1.687 -12.524 907 HB3 ALA 132 3HB ALA 132 -8.150 -0.085 -12.914 908 H GLY 133 H GLY 133 -5.200 0.356 -11.578 909 HA2 GLY 133 1HA GLY 133 -3.855 0.877 -14.164 910 HA3 GLY 133 2HA GLY 133 -4.059 1.977 -12.806 911 H LEU 134 H LEU 134 -3.084 -1.089 -11.666 912 HA LEU 134 HA LEU 134 -0.377 0.041 -11.221 913 HB2 LEU 134 1HB LEU 134 -0.365 -0.751 -9.121 914 HB3 LEU 134 2HB LEU 134 -1.986 -0.273 -9.355 915 HG LEU 134 HG LEU 134 -2.692 -2.651 -9.569 916 HD11 LEU 134 1HD1 LEU 134 -0.663 -3.858 -10.271 917 HD12 LEU 134 2HD1 LEU 134 -1.137 -4.414 -8.684 918 HD13 LEU 134 3HD1 LEU 134 0.212 -3.270 -8.850 919 HD21 LEU 134 3HD2 LEU 134 -2.400 -3.066 -7.157 920 HD22 LEU 134 1HD2 LEU 134 -2.650 -1.342 -7.430 921 HD23 LEU 134 2HD2 LEU 134 -1.004 -1.973 -7.118 922 H ARG 135 H ARG 135 1.454 -1.267 -11.294 923 HA ARG 135 HA ARG 135 1.350 -3.391 -13.408 924 HB2 ARG 135 1HB ARG 135 3.419 -1.249 -12.745 925 HB3 ARG 135 2HB ARG 135 3.724 -2.566 -13.872 926 HG2 ARG 135 1HG ARG 135 2.173 -1.806 -15.447 927 HG3 ARG 135 2HG ARG 135 1.352 -0.728 -14.312 928 HD2 ARG 135 1HD ARG 135 2.912 0.932 -14.471 929 HD3 ARG 135 2HD ARG 135 4.256 -0.147 -14.700 930 HE ARG 135 HE ARG 135 2.275 0.661 -16.797 931 HH11 ARG 135 1HH1 ARG 135 5.548 -0.611 -16.089 932 HH12 ARG 135 2HH1 ARG 135 5.794 -1.174 -17.702 933 HH21 ARG 135 1HH2 ARG 135 2.735 0.201 -18.888 934 HH22 ARG 135 2HH2 ARG 135 4.300 -0.368 -19.413 935 H THR 136 H THR 136 2.939 -5.136 -13.159 936 HA THR 136 HA THR 136 4.102 -5.375 -10.445 937 HB THR 136 HB THR 136 2.758 -7.595 -11.937 938 HG1 THR 136 1HG THR 136 1.161 -6.106 -11.573 939 HG21 THR 136 3HG2 THR 136 2.470 -8.406 -9.454 940 HG22 THR 136 1HG2 THR 136 3.767 -7.215 -9.122 941 HG23 THR 136 2HG2 THR 136 4.045 -8.535 -10.227 942 H GLU 137 H GLU 137 5.023 -4.685 -13.121 943 HA GLU 137 HA GLU 137 7.025 -4.490 -14.072 944 HB2 GLU 137 1HB GLU 137 7.475 -4.678 -11.444 945 HB3 GLU 137 2HB GLU 137 8.432 -6.059 -11.942 946 HG2 GLU 137 1HG GLU 137 9.661 -4.588 -13.538 947 HG3 GLU 137 2HG GLU 137 8.644 -3.229 -13.077 Start of MODEL 7 1 H1 GLY 19 H GLY 19 -8.666 -16.612 -5.449 2 HA2 GLY 19 1HA GLY 19 -7.143 -15.562 -7.765 3 HA3 GLY 19 2HA GLY 19 -8.667 -16.452 -7.935 4 H HIS 20 H HIS 20 -10.538 -15.323 -7.863 5 HA HIS 20 HA HIS 20 -10.483 -12.384 -7.534 6 HB2 HIS 20 1HB HIS 20 -12.958 -12.856 -8.362 7 HB3 HIS 20 2HB HIS 20 -11.599 -12.914 -9.466 8 HD1 HIS 20 1HD HIS 20 -13.713 -15.594 -7.485 9 HD2 HIS 20 2HD HIS 20 -11.144 -15.053 -10.775 10 HE1 HIS 20 1HE HIS 20 -13.566 -17.828 -8.665 11 H MET 21 H MET 21 -11.376 -15.222 -5.690 12 HA MET 21 HA MET 21 -13.667 -14.100 -4.388 13 HB2 MET 21 1HB MET 21 -12.203 -16.584 -4.342 14 HB3 MET 21 2HB MET 21 -12.386 -16.032 -2.684 15 HG2 MET 21 1HG MET 21 -14.656 -16.219 -4.695 16 HG3 MET 21 2HG MET 21 -14.228 -17.506 -3.571 17 HE1 MET 21 3HE MET 21 -14.710 -17.658 -1.203 18 HE2 MET 21 1HE MET 21 -13.697 -16.269 -0.756 19 HE3 MET 21 2HE MET 21 -15.362 -16.391 -0.145 20 H LYS 22 H LYS 22 -13.798 -12.705 -2.792 21 HA LYS 22 HA LYS 22 -13.390 -11.293 -1.124 22 HB2 LYS 22 1HB LYS 22 -12.194 -13.643 -0.242 23 HB3 LYS 22 2HB LYS 22 -10.883 -12.483 -0.059 24 HG2 LYS 22 1HG LYS 22 -12.480 -10.996 1.256 25 HG3 LYS 22 2HG LYS 22 -13.703 -12.266 1.067 26 HD2 LYS 22 1HD LYS 22 -11.830 -13.832 2.108 27 HD3 LYS 22 2HD LYS 22 -11.165 -12.282 2.676 28 HE2 LYS 22 1HE LYS 22 -13.264 -11.788 3.852 29 HE3 LYS 22 2HE LYS 22 -14.005 -13.250 3.173 30 HZ1 LYS 22 3HZ LYS 22 -11.777 -13.160 5.130 31 HZ2 LYS 22 1HZ LYS 22 -12.289 -14.530 4.366 32 HZ3 LYS 22 2HZ LYS 22 -13.297 -13.751 5.357 33 H PHE 23 H PHE 23 -11.149 -10.151 -0.007 34 HA PHE 23 HA PHE 23 -10.087 -8.388 -2.061 35 HB2 PHE 23 1HB PHE 23 -9.571 -8.868 0.905 36 HB3 PHE 23 2HB PHE 23 -8.497 -7.880 -0.058 37 HD1 PHE 23 1HD PHE 23 -11.891 -7.345 -1.237 38 HD2 PHE 23 2HD PHE 23 -9.047 -6.274 1.835 39 HE1 PHE 23 1HE PHE 23 -13.039 -5.226 -0.908 40 HE2 PHE 23 2HE PHE 23 -10.228 -4.124 2.166 41 HZ PHE 23 HZ PHE 23 -12.203 -3.565 0.761 42 H THR 24 H THR 24 -7.598 -8.241 -2.223 43 HA THR 24 HA THR 24 -6.230 -10.824 -2.120 44 HB THR 24 HB THR 24 -5.404 -10.562 -4.387 45 HG1 THR 24 1HG THR 24 -5.724 -8.864 -5.571 46 HG21 THR 24 3HG2 THR 24 -7.600 -11.726 -4.250 47 HG22 THR 24 1HG2 THR 24 -7.436 -10.815 -5.766 48 HG23 THR 24 2HG2 THR 24 -8.439 -10.173 -4.471 49 H ASP 25 H ASP 25 -3.784 -10.310 -2.398 50 HA ASP 25 HA ASP 25 -3.029 -8.456 -0.448 51 HB2 ASP 25 1HB ASP 25 -1.433 -9.680 -2.744 52 HB3 ASP 25 2HB ASP 25 -0.723 -8.761 -1.420 53 H GLN 26 H GLN 26 -3.234 -8.091 -3.955 54 HA GLN 26 HA GLN 26 -2.028 -5.544 -4.248 55 HB2 GLN 26 1HB GLN 26 -4.339 -6.381 -6.002 56 HB3 GLN 26 2HB GLN 26 -2.909 -5.446 -6.383 57 HG2 GLN 26 1HG GLN 26 -2.321 -7.426 -7.360 58 HG3 GLN 26 2HG GLN 26 -1.629 -7.716 -5.784 59 HE21 GLN 26 1HE2 GLN 26 -4.702 -8.188 -7.681 60 HE22 GLN 26 2HE2 GLN 26 -4.919 -9.828 -7.145 61 H GLN 27 H GLN 27 -5.453 -6.460 -3.748 62 HA GLN 27 HA GLN 27 -6.616 -3.888 -4.007 63 HB2 GLN 27 1HB GLN 27 -7.626 -6.126 -2.226 64 HB3 GLN 27 2HB GLN 27 -8.582 -4.831 -2.913 65 HG2 GLN 27 1HG GLN 27 -7.179 -6.499 -4.938 66 HG3 GLN 27 2HG GLN 27 -8.300 -7.400 -3.920 67 HE21 GLN 27 1HE2 GLN 27 -8.157 -6.435 -6.871 68 HE22 GLN 27 2HE2 GLN 27 -9.659 -5.672 -7.158 69 H ILE 28 H ILE 28 -5.278 -5.617 -1.286 70 HA ILE 28 HA ILE 28 -6.088 -3.765 0.753 71 HB ILE 28 HB ILE 28 -4.034 -6.023 0.636 72 HG12 ILE 28 1HG1 ILE 28 -6.821 -5.987 1.869 73 HG13 ILE 28 2HG1 ILE 28 -6.552 -6.542 0.250 74 HG21 ILE 28 1HG2 ILE 28 -5.128 -4.434 2.988 75 HG22 ILE 28 2HG2 ILE 28 -4.242 -5.969 3.141 76 HG23 ILE 28 3HG2 ILE 28 -3.428 -4.567 2.478 77 HD11 ILE 28 3HD1 ILE 28 -4.959 -8.282 1.078 78 HD12 ILE 28 1HD1 ILE 28 -5.427 -7.846 2.735 79 HD13 ILE 28 2HD1 ILE 28 -6.637 -8.478 1.612 80 H GLY 29 H GLY 29 -3.146 -4.156 -1.235 81 HA2 GLY 29 1HA GLY 29 -1.411 -2.411 0.101 82 HA3 GLY 29 2HA GLY 29 -1.405 -2.741 -1.639 83 H VAL 30 H VAL 30 -4.081 -1.635 -2.142 84 HA VAL 30 HA VAL 30 -3.441 1.145 -2.470 85 HB VAL 30 HB VAL 30 -6.088 -0.310 -2.789 86 HG11 VAL 30 1HG1 VAL 30 -6.737 1.543 -4.232 87 HG12 VAL 30 2HG1 VAL 30 -6.360 2.190 -2.628 88 HG13 VAL 30 3HG1 VAL 30 -5.187 2.362 -3.949 89 HG21 VAL 30 3HG2 VAL 30 -4.421 -1.274 -4.280 90 HG22 VAL 30 1HG2 VAL 30 -5.371 -0.138 -5.254 91 HG23 VAL 30 2HG2 VAL 30 -3.773 0.327 -4.672 92 H LEU 31 H LEU 31 -5.791 -0.500 -0.304 93 HA LEU 31 HA LEU 31 -6.596 1.820 1.142 94 HB2 LEU 31 1HB LEU 31 -6.692 -1.164 1.494 95 HB3 LEU 31 2HB LEU 31 -6.790 -0.232 2.967 96 HG LEU 31 HG LEU 31 -8.843 0.643 2.538 97 HD11 LEU 31 1HD1 LEU 31 -8.461 0.171 -0.441 98 HD12 LEU 31 2HD1 LEU 31 -8.548 1.743 0.376 99 HD13 LEU 31 3HD1 LEU 31 -9.975 0.749 0.311 100 HD21 LEU 31 3HD2 LEU 31 -8.970 -1.873 2.665 101 HD22 LEU 31 1HD2 LEU 31 -9.011 -1.919 0.904 102 HD23 LEU 31 2HD2 LEU 31 -10.320 -1.124 1.802 103 H ALA 32 H ALA 32 -3.910 -0.402 1.802 104 HA ALA 32 HA ALA 32 -2.912 0.719 4.144 105 HB1 ALA 32 1HB ALA 32 -1.621 -0.795 1.879 106 HB2 ALA 32 2HB ALA 32 -0.762 -0.337 3.366 107 HB3 ALA 32 3HB ALA 32 -2.180 -1.411 3.439 108 H GLY 33 H GLY 33 -2.134 1.519 0.709 109 HA2 GLY 33 1HA GLY 33 -0.221 3.568 1.377 110 HA3 GLY 33 2HA GLY 33 -0.948 3.288 -0.205 111 H LEU 34 H LEU 34 -3.781 3.615 0.878 112 HA LEU 34 HA LEU 34 -3.874 6.451 0.634 113 HB2 LEU 34 1HB LEU 34 -5.978 4.511 1.647 114 HB3 LEU 34 2HB LEU 34 -6.206 6.258 1.436 115 HG LEU 34 HG LEU 34 -5.409 4.423 -0.850 116 HD11 LEU 34 1HD1 LEU 34 -7.640 3.834 -0.135 117 HD12 LEU 34 2HD1 LEU 34 -7.743 4.766 -1.633 118 HD13 LEU 34 3HD1 LEU 34 -8.123 5.554 -0.080 119 HD21 LEU 34 3HD2 LEU 34 -6.083 7.379 -0.573 120 HD22 LEU 34 1HD2 LEU 34 -6.235 6.533 -2.112 121 HD23 LEU 34 2HD2 LEU 34 -4.668 6.598 -1.324 122 H ALA 35 H ALA 35 -3.237 4.533 3.417 123 HA ALA 35 HA ALA 35 -3.758 6.758 5.300 124 HB1 ALA 35 1HB ALA 35 -2.598 5.195 6.912 125 HB2 ALA 35 2HB ALA 35 -4.059 4.555 6.154 126 HB3 ALA 35 3HB ALA 35 -2.467 4.023 5.578 127 H ILE 36 H ILE 36 -1.211 5.982 3.023 128 HA ILE 36 HA ILE 36 0.872 7.269 4.657 129 HB ILE 36 HB ILE 36 1.056 4.511 3.390 130 HG12 ILE 36 1HG1 ILE 36 -0.217 4.189 5.406 131 HG13 ILE 36 2HG1 ILE 36 1.381 3.502 5.522 132 HG21 ILE 36 1HG2 ILE 36 3.261 4.432 4.350 133 HG22 ILE 36 2HG2 ILE 36 3.155 5.790 3.257 134 HG23 ILE 36 3HG2 ILE 36 3.112 6.080 5.009 135 HD11 ILE 36 3HD1 ILE 36 2.106 5.402 6.941 136 HD12 ILE 36 1HD1 ILE 36 0.462 6.039 6.908 137 HD13 ILE 36 2HD1 ILE 36 0.769 4.449 7.622 138 H SER 37 H SER 37 1.128 8.906 3.228 139 HA SER 37 HA SER 37 1.601 10.043 1.307 140 HB2 SER 37 1HB SER 37 2.953 7.468 0.575 141 HB3 SER 37 2HB SER 37 3.234 8.971 -0.258 142 HG SER 37 HG SER 37 3.675 8.422 2.496 143 HA PRO 38 HA PRO 38 -2.044 7.908 -0.869 144 HB2 PRO 38 1HB PRO 38 -3.860 9.964 -0.389 145 HB3 PRO 38 2HB PRO 38 -3.662 8.546 0.665 146 HG2 PRO 38 1HG PRO 38 -2.470 11.305 0.976 147 HG3 PRO 38 2HG PRO 38 -3.233 10.277 2.234 148 HD2 PRO 38 1HD PRO 38 -0.582 10.412 2.025 149 HD3 PRO 38 2HD PRO 38 -1.405 8.853 2.373 150 H GLU 39 H GLU 39 -0.980 11.363 -0.655 151 HA GLU 39 HA GLU 39 -2.162 12.123 -3.084 152 HB2 GLU 39 1HB GLU 39 0.215 13.433 -1.694 153 HB3 GLU 39 2HB GLU 39 -0.839 14.159 -2.923 154 HG2 GLU 39 1HG GLU 39 -2.765 13.443 -1.212 155 HG3 GLU 39 2HG GLU 39 -1.445 13.499 -0.043 156 H TRP 40 H TRP 40 1.224 11.250 -2.418 157 HA TRP 40 HA TRP 40 2.416 11.209 -4.928 158 HB2 TRP 40 1HB TRP 40 3.716 10.765 -2.987 159 HB3 TRP 40 2HB TRP 40 2.637 9.506 -2.436 160 HD1 TRP 40 HD TRP 40 5.364 10.047 -5.083 161 HE1 TRP 40 1HE TRP 40 6.427 7.832 -5.691 162 HE3 TRP 40 3HE TRP 40 2.371 6.946 -2.315 163 HZ2 TRP 40 2HZ TRP 40 6.162 5.033 -4.901 164 HZ3 TRP 40 3HZ TRP 40 2.813 4.521 -2.241 165 HH2 TRP 40 HH TRP 40 4.698 3.538 -3.532 166 H LEU 41 H LEU 41 0.307 8.750 -3.408 167 HA LEU 41 HA LEU 41 0.916 6.758 -5.313 168 HB2 LEU 41 1HB LEU 41 -0.119 5.470 -3.798 169 HB3 LEU 41 2HB LEU 41 -0.345 6.880 -2.880 170 HG LEU 41 HG LEU 41 -2.678 7.135 -3.755 171 HD11 LEU 41 1HD1 LEU 41 -1.754 4.902 -5.521 172 HD12 LEU 41 2HD1 LEU 41 -3.130 6.009 -5.713 173 HD13 LEU 41 3HD1 LEU 41 -3.272 4.570 -4.708 174 HD21 LEU 41 3HD2 LEU 41 -1.824 4.487 -2.516 175 HD22 LEU 41 1HD2 LEU 41 -3.466 5.113 -2.463 176 HD23 LEU 41 2HD2 LEU 41 -2.165 5.975 -1.635 177 H LYS 42 H LYS 42 -1.903 9.006 -5.093 178 HA LYS 42 HA LYS 42 -3.175 8.083 -7.499 179 HB2 LYS 42 1HB LYS 42 -3.321 10.681 -5.926 180 HB3 LYS 42 2HB LYS 42 -4.201 10.451 -7.450 181 HG2 LYS 42 1HG LYS 42 -5.518 8.683 -6.599 182 HG3 LYS 42 2HG LYS 42 -4.478 8.474 -5.201 183 HD2 LYS 42 1HD LYS 42 -6.407 9.455 -4.373 184 HD3 LYS 42 2HD LYS 42 -5.250 10.778 -4.385 185 HE2 LYS 42 1HE LYS 42 -7.375 10.297 -6.515 186 HE3 LYS 42 2HE LYS 42 -7.684 11.197 -5.040 187 HZ1 LYS 42 3HZ LYS 42 -7.177 12.668 -6.854 188 HZ2 LYS 42 1HZ LYS 42 -5.693 12.014 -7.081 189 HZ3 LYS 42 2HZ LYS 42 -6.054 12.822 -5.695 190 H GLN 43 H GLN 43 -0.495 10.523 -7.059 191 HA GLN 43 HA GLN 43 -0.690 11.498 -9.748 192 HB2 GLN 43 1HB GLN 43 1.881 11.163 -8.131 193 HB3 GLN 43 2HB GLN 43 1.618 12.151 -9.568 194 HG2 GLN 43 1HG GLN 43 -0.027 13.520 -8.159 195 HG3 GLN 43 2HG GLN 43 0.620 12.665 -6.766 196 HE21 GLN 43 1HE2 GLN 43 3.478 12.623 -8.031 197 HE22 GLN 43 2HE2 GLN 43 4.029 14.221 -7.606 198 H ASN 44 H ASN 44 1.136 8.851 -8.230 199 HA ASN 44 HA ASN 44 2.546 8.107 -10.566 200 HB2 ASN 44 1HB ASN 44 2.011 6.730 -7.921 201 HB3 ASN 44 2HB ASN 44 2.804 5.880 -9.254 202 HD21 ASN 44 1HD2 ASN 44 3.140 8.875 -7.236 203 HD22 ASN 44 2HD2 ASN 44 4.845 9.045 -7.618 204 H ILE 45 H ILE 45 -0.592 6.826 -9.276 205 HA ILE 45 HA ILE 45 -0.897 4.922 -11.412 206 HB ILE 45 HB ILE 45 -2.945 6.308 -9.626 207 HG12 ILE 45 1HG1 ILE 45 -1.349 4.746 -8.479 208 HG13 ILE 45 2HG1 ILE 45 -3.023 4.282 -8.365 209 HG21 ILE 45 1HG2 ILE 45 -3.317 4.205 -11.783 210 HG22 ILE 45 2HG2 ILE 45 -4.447 4.334 -10.432 211 HG23 ILE 45 3HG2 ILE 45 -4.221 5.707 -11.516 212 HD11 ILE 45 3HD1 ILE 45 -2.740 2.516 -10.007 213 HD12 ILE 45 1HD1 ILE 45 -1.080 3.057 -10.380 214 HD13 ILE 45 2HD1 ILE 45 -1.455 2.376 -8.806 215 H ALA 46 H ALA 46 -1.930 8.383 -11.112 216 HA ALA 46 HA ALA 46 -3.282 8.451 -13.613 217 HB1 ALA 46 1HB ALA 46 -1.926 10.684 -12.062 218 HB2 ALA 46 2HB ALA 46 -3.128 10.884 -13.346 219 HB3 ALA 46 3HB ALA 46 -3.593 10.106 -11.828 220 H ALA 47 H ALA 47 0.071 8.196 -13.008 221 HA ALA 47 HA ALA 47 0.652 8.877 -15.835 222 HB1 ALA 47 1HB ALA 47 2.360 9.152 -13.339 223 HB2 ALA 47 2HB ALA 47 3.001 9.316 -15.001 224 HB3 ALA 47 3HB ALA 47 1.766 10.439 -14.395 225 H ASN 48 H ASN 48 -0.176 6.311 -14.222 226 HA ASN 48 HA ASN 48 0.274 4.157 -14.032 227 HB2 ASN 48 1HB ASN 48 -0.593 4.427 -16.340 228 HB3 ASN 48 2HB ASN 48 1.076 4.447 -16.932 229 HD21 ASN 48 1HD2 ASN 48 -0.616 2.240 -14.461 230 HD22 ASN 48 2HD2 ASN 48 -0.192 0.823 -15.397 231 H GLN 49 H GLN 49 2.411 5.686 -13.105 232 HA GLN 49 HA GLN 49 4.983 4.540 -13.937 233 HB2 GLN 49 1HB GLN 49 4.243 6.235 -11.504 234 HB3 GLN 49 2HB GLN 49 5.882 5.968 -12.117 235 HG2 GLN 49 1HG GLN 49 3.679 7.416 -13.615 236 HG3 GLN 49 2HG GLN 49 4.941 8.196 -12.684 237 HE21 GLN 49 1HE2 GLN 49 4.243 6.334 -15.629 238 HE22 GLN 49 2HE2 GLN 49 5.877 6.444 -16.304 239 H LEU 50 H LEU 50 2.574 3.290 -11.883 240 HA LEU 50 HA LEU 50 4.375 2.884 -9.583 241 HB2 LEU 50 1HB LEU 50 1.987 3.872 -9.436 242 HB3 LEU 50 2HB LEU 50 1.415 2.249 -9.770 243 HG LEU 50 HG LEU 50 2.857 1.488 -7.741 244 HD11 LEU 50 1HD1 LEU 50 2.651 4.458 -7.045 245 HD12 LEU 50 2HD1 LEU 50 4.155 3.662 -7.528 246 HD13 LEU 50 3HD1 LEU 50 3.339 3.165 -6.045 247 HD21 LEU 50 3HD2 LEU 50 0.426 1.551 -7.700 248 HD22 LEU 50 1HD2 LEU 50 0.437 3.301 -7.369 249 HD23 LEU 50 2HD2 LEU 50 1.073 2.162 -6.176 250 H VAL 51 H VAL 51 5.318 0.969 -9.118 251 HA VAL 51 HA VAL 51 4.264 -1.503 -10.375 252 HB VAL 51 HB VAL 51 7.076 -0.745 -9.545 253 HG11 VAL 51 1HG1 VAL 51 6.061 -3.481 -10.457 254 HG12 VAL 51 2HG1 VAL 51 7.764 -3.011 -10.313 255 HG13 VAL 51 3HG1 VAL 51 6.758 -3.092 -8.869 256 HG21 VAL 51 3HG2 VAL 51 6.312 -0.004 -11.828 257 HG22 VAL 51 1HG2 VAL 51 7.607 -1.208 -11.900 258 HG23 VAL 51 2HG2 VAL 51 5.940 -1.702 -12.229 259 H TYR 52 H TYR 52 3.763 -3.140 -9.113 260 HA TYR 52 HA TYR 52 3.858 -3.014 -6.149 261 HB2 TYR 52 1HB TYR 52 1.557 -3.099 -7.000 262 HB3 TYR 52 2HB TYR 52 2.007 -4.297 -8.199 263 HD1 TYR 52 2HD TYR 52 1.955 -3.925 -4.455 264 HD2 TYR 52 1HD TYR 52 1.407 -6.489 -7.866 265 HE1 TYR 52 2HE TYR 52 1.272 -5.799 -2.963 266 HE2 TYR 52 1HE TYR 52 0.908 -8.410 -6.364 267 HH TYR 52 HH TYR 52 1.291 -8.164 -2.843 268 H GLY 53 H GLY 53 4.679 -5.026 -5.159 269 HA2 GLY 53 1HA GLY 53 5.349 -7.264 -6.849 270 HA3 GLY 53 2HA GLY 53 6.775 -6.328 -6.359 271 H ILE 54 H ILE 54 6.755 -8.846 -5.561 272 HA ILE 54 HA ILE 54 6.342 -8.662 -2.621 273 HB ILE 54 HB ILE 54 6.818 -11.113 -4.359 274 HG12 ILE 54 1HG1 ILE 54 4.532 -10.321 -4.718 275 HG13 ILE 54 2HG1 ILE 54 4.594 -11.866 -3.893 276 HG21 ILE 54 1HG2 ILE 54 7.825 -11.458 -2.200 277 HG22 ILE 54 2HG2 ILE 54 6.347 -10.936 -1.365 278 HG23 ILE 54 3HG2 ILE 54 6.377 -12.432 -2.329 279 HD11 ILE 54 3HD1 ILE 54 4.031 -9.184 -2.603 280 HD12 ILE 54 1HD1 ILE 54 2.845 -10.449 -2.950 281 HD13 ILE 54 2HD1 ILE 54 4.098 -10.735 -1.733 282 H VAL 55 H VAL 55 8.204 -8.834 -1.475 283 HA VAL 55 HA VAL 55 10.589 -7.840 -2.412 284 HB VAL 55 HB VAL 55 9.780 -9.507 -0.013 285 HG11 VAL 55 1HG1 VAL 55 12.558 -8.806 -0.835 286 HG12 VAL 55 2HG1 VAL 55 12.099 -8.322 0.787 287 HG13 VAL 55 3HG1 VAL 55 11.938 -10.023 0.310 288 HG21 VAL 55 3HG2 VAL 55 10.574 -6.600 -0.393 289 HG22 VAL 55 1HG2 VAL 55 8.911 -7.183 -0.239 290 HG23 VAL 55 2HG2 VAL 55 10.018 -7.334 1.129 291 H LYS 56 H LYS 56 10.151 -11.374 -1.720 292 HA LYS 56 HA LYS 56 11.269 -13.172 -2.289 293 HB2 LYS 56 1HB LYS 56 11.872 -11.568 -4.790 294 HB3 LYS 56 2HB LYS 56 12.346 -13.233 -4.602 295 HG2 LYS 56 1HG LYS 56 9.696 -13.434 -3.892 296 HG3 LYS 56 2HG LYS 56 9.629 -12.036 -4.985 297 HD2 LYS 56 1HD LYS 56 10.967 -13.435 -6.640 298 HD3 LYS 56 2HD LYS 56 10.781 -14.785 -5.498 299 HE2 LYS 56 1HE LYS 56 8.343 -14.671 -5.719 300 HE3 LYS 56 2HE LYS 56 8.478 -13.261 -6.785 301 HZ1 LYS 56 3HZ LYS 56 8.136 -15.359 -7.967 302 HZ2 LYS 56 1HZ LYS 56 9.617 -15.913 -7.451 303 HZ3 LYS 56 2HZ LYS 56 9.494 -14.611 -8.452 304 HA PRO 57 HA PRO 57 15.514 -12.712 -1.019 305 HB2 PRO 57 1HB PRO 57 16.781 -14.921 -1.998 306 HB3 PRO 57 2HB PRO 57 15.578 -14.976 -0.669 307 HG2 PRO 57 1HG PRO 57 15.105 -15.513 -3.612 308 HG3 PRO 57 2HG PRO 57 14.611 -16.520 -2.210 309 HD2 PRO 57 1HD PRO 57 12.916 -14.790 -3.411 310 HD3 PRO 57 2HD PRO 57 12.872 -15.003 -1.653 311 H SER 58 H SER 58 14.606 -12.535 -4.349 312 HA SER 58 HA SER 58 17.142 -12.257 -5.558 313 HB2 SER 58 1HB SER 58 14.533 -10.936 -6.393 314 HB3 SER 58 2HB SER 58 15.876 -11.434 -7.442 315 HG SER 58 HG SER 58 15.408 -13.566 -7.015 316 H ASP 59 H ASP 59 15.110 -9.837 -3.794 317 HA ASP 59 HA ASP 59 16.640 -7.738 -5.197 318 HB2 ASP 59 1HB ASP 59 14.058 -7.978 -5.310 319 HB3 ASP 59 2HB ASP 59 14.063 -7.252 -3.709 320 H THR 60 H THR 60 16.827 -5.626 -4.016 321 HA THR 60 HA THR 60 18.438 -6.222 -1.666 322 HB THR 60 HB THR 60 18.158 -3.595 -3.164 323 HG1 THR 60 1HG THR 60 18.986 -4.762 -4.705 324 HG21 THR 60 3HG2 THR 60 20.387 -3.170 -2.248 325 HG22 THR 60 1HG2 THR 60 20.411 -4.753 -1.465 326 HG23 THR 60 2HG2 THR 60 19.263 -3.511 -0.916 327 H VAL 61 H VAL 61 17.339 -6.328 0.248 328 HA VAL 61 HA VAL 61 15.306 -4.265 0.869 329 HB VAL 61 HB VAL 61 13.787 -6.088 1.556 330 HG11 VAL 61 1HG1 VAL 61 12.964 -6.571 -0.633 331 HG12 VAL 61 2HG1 VAL 61 13.697 -4.982 -0.732 332 HG13 VAL 61 3HG1 VAL 61 14.551 -6.406 -1.375 333 HG21 VAL 61 3HG2 VAL 61 15.864 -7.924 0.268 334 HG22 VAL 61 1HG2 VAL 61 15.371 -7.882 1.970 335 HG23 VAL 61 2HG2 VAL 61 14.251 -8.418 0.711 336 HA PRO 62 HA PRO 62 16.917 -4.568 5.009 337 HB2 PRO 62 1HB PRO 62 14.794 -3.762 6.542 338 HB3 PRO 62 2HB PRO 62 15.685 -2.648 5.458 339 HG2 PRO 62 1HG PRO 62 13.083 -4.093 4.931 340 HG3 PRO 62 2HG PRO 62 13.482 -2.371 4.632 341 HD2 PRO 62 1HD PRO 62 13.569 -4.280 2.682 342 HD3 PRO 62 2HD PRO 62 14.662 -2.877 2.687 343 H ALA 63 H ALA 63 16.037 -5.571 7.259 344 HA ALA 63 HA ALA 63 15.461 -8.404 6.767 345 HB1 ALA 63 1HB ALA 63 15.836 -6.814 9.323 346 HB2 ALA 63 2HB ALA 63 15.745 -8.570 9.209 347 HB3 ALA 63 3HB ALA 63 17.114 -7.724 8.472 348 H GLY 64 H GLY 64 13.649 -9.469 7.876 349 HA2 GLY 64 1HA GLY 64 11.628 -9.613 8.975 350 HA3 GLY 64 2HA GLY 64 11.617 -7.861 9.218 351 H VAL 65 H VAL 65 12.094 -8.830 5.885 352 HA VAL 65 HA VAL 65 9.254 -8.879 5.215 353 HB VAL 65 HB VAL 65 9.588 -7.064 3.518 354 HG11 VAL 65 1HG1 VAL 65 9.020 -5.266 4.959 355 HG12 VAL 65 2HG1 VAL 65 8.382 -6.741 5.711 356 HG13 VAL 65 3HG1 VAL 65 9.859 -5.995 6.341 357 HG21 VAL 65 3HG2 VAL 65 11.248 -5.303 3.884 358 HG22 VAL 65 1HG2 VAL 65 11.990 -6.227 5.213 359 HG23 VAL 65 2HG2 VAL 65 12.094 -6.817 3.552 360 H ASP 66 H ASP 66 10.285 -11.174 4.864 361 HA ASP 66 HA ASP 66 11.730 -11.354 2.278 362 HB2 ASP 66 1HB ASP 66 10.621 -13.454 4.139 363 HB3 ASP 66 2HB ASP 66 11.417 -13.815 2.636 364 H ASP 67 H ASP 67 8.635 -11.203 3.251 365 HA ASP 67 HA ASP 67 7.490 -12.210 0.715 366 HB2 ASP 67 1HB ASP 67 6.061 -13.747 1.924 367 HB3 ASP 67 2HB ASP 67 7.720 -14.024 2.445 368 H TYR 68 H TYR 68 7.694 -9.624 2.488 369 HA TYR 68 HA TYR 68 4.868 -8.817 2.743 370 HB2 TYR 68 1HB TYR 68 7.498 -7.425 3.157 371 HB3 TYR 68 2HB TYR 68 6.023 -6.509 2.907 372 HD1 TYR 68 2HD TYR 68 6.693 -9.672 4.986 373 HD2 TYR 68 1HD TYR 68 5.246 -5.593 4.881 374 HE1 TYR 68 2HE TYR 68 5.959 -9.872 7.281 375 HE2 TYR 68 1HE TYR 68 4.403 -5.871 7.187 376 HH TYR 68 HH TYR 68 4.313 -8.913 8.890 377 H SER 69 H SER 69 3.859 -7.483 1.232 378 HA SER 69 HA SER 69 4.806 -7.452 -1.513 379 HB2 SER 69 1HB SER 69 2.444 -6.380 0.112 380 HB3 SER 69 2HB SER 69 2.711 -6.012 -1.585 381 HG SER 69 HG SER 69 2.451 -8.651 -0.512 382 H TYR 70 H TYR 70 5.056 -5.283 -2.558 383 HA TYR 70 HA TYR 70 5.339 -3.007 -0.762 384 HB2 TYR 70 1HB TYR 70 7.489 -2.312 -1.611 385 HB3 TYR 70 2HB TYR 70 7.646 -3.890 -0.907 386 HD1 TYR 70 2HD TYR 70 7.666 -1.960 -4.067 387 HD2 TYR 70 1HD TYR 70 8.144 -5.876 -2.319 388 HE1 TYR 70 2HE TYR 70 8.630 -2.793 -6.195 389 HE2 TYR 70 1HE TYR 70 9.179 -6.676 -4.443 390 HH TYR 70 HH TYR 70 10.045 -4.594 -7.060 391 H LEU 71 H LEU 71 5.585 -0.951 -2.024 392 HA LEU 71 HA LEU 71 4.516 -0.926 -4.780 393 HB2 LEU 71 1HB LEU 71 3.387 0.561 -2.362 394 HB3 LEU 71 2HB LEU 71 3.081 1.066 -4.018 395 HG LEU 71 HG LEU 71 2.376 -1.761 -3.184 396 HD11 LEU 71 1HD1 LEU 71 1.354 -0.375 -1.512 397 HD12 LEU 71 2HD1 LEU 71 0.086 -0.874 -2.646 398 HD13 LEU 71 3HD1 LEU 71 0.789 0.771 -2.685 399 HD21 LEU 71 3HD2 LEU 71 1.356 0.112 -5.337 400 HD22 LEU 71 1HD2 LEU 71 0.697 -1.516 -4.989 401 HD23 LEU 71 2HD2 LEU 71 2.356 -1.304 -5.558 402 H VAL 72 H VAL 72 5.589 0.644 -5.945 403 HA VAL 72 HA VAL 72 7.067 2.847 -4.737 404 HB VAL 72 HB VAL 72 8.408 0.825 -4.271 405 HG11 VAL 72 1HG1 VAL 72 9.431 -0.499 -6.100 406 HG12 VAL 72 2HG1 VAL 72 7.665 -0.671 -6.031 407 HG13 VAL 72 3HG1 VAL 72 8.392 0.361 -7.266 408 HG21 VAL 72 3HG2 VAL 72 10.562 1.393 -5.310 409 HG22 VAL 72 1HG2 VAL 72 9.744 2.552 -6.363 410 HG23 VAL 72 2HG2 VAL 72 9.744 2.775 -4.609 411 H ALA 73 H ALA 73 7.948 4.207 -6.620 412 HA ALA 73 HA ALA 73 6.380 3.844 -9.096 413 HB1 ALA 73 1HB ALA 73 7.060 6.135 -8.059 414 HB2 ALA 73 2HB ALA 73 8.666 5.783 -8.731 415 HB3 ALA 73 3HB ALA 73 7.277 5.898 -9.804 416 H ALA 74 H ALA 74 7.424 3.455 -11.138 417 HA ALA 74 HA ALA 74 9.709 1.707 -11.167 418 HB1 ALA 74 1HB ALA 74 8.230 3.261 -13.315 419 HB2 ALA 74 2HB ALA 74 9.510 2.107 -13.663 420 HB3 ALA 74 3HB ALA 74 8.004 1.542 -12.899 421 H ASP 75 H ASP 75 9.493 5.082 -10.885 422 HA ASP 75 HA ASP 75 12.287 5.483 -11.787 423 HB2 ASP 75 1HB ASP 75 9.784 6.986 -12.612 424 HB3 ASP 75 2HB ASP 75 11.323 7.834 -12.569 425 H ASP 76 H ASP 76 10.945 5.200 -9.040 426 HA ASP 76 HA ASP 76 12.420 7.455 -7.815 427 HB2 ASP 76 1HB ASP 76 9.556 6.765 -7.054 428 HB3 ASP 76 2HB ASP 76 10.656 7.654 -6.027 429 H GLN 77 H GLN 77 13.323 4.864 -8.254 430 HA GLN 77 HA GLN 77 12.411 2.970 -6.311 431 HB2 GLN 77 1HB GLN 77 15.178 2.975 -7.570 432 HB3 GLN 77 2HB GLN 77 14.337 1.639 -6.815 433 HG2 GLN 77 1HG GLN 77 12.495 2.116 -8.627 434 HG3 GLN 77 2HG GLN 77 13.763 2.958 -9.475 435 HE21 GLN 77 1HE2 GLN 77 12.342 -0.069 -8.841 436 HE22 GLN 77 2HE2 GLN 77 13.534 -1.127 -9.564 437 H ASP 78 H ASP 78 15.237 5.208 -6.195 438 HA ASP 78 HA ASP 78 15.834 4.429 -3.442 439 HB2 ASP 78 1HB ASP 78 17.567 6.040 -3.385 440 HB3 ASP 78 2HB ASP 78 17.673 5.010 -4.801 441 H GLY 79 H GLY 79 13.347 6.252 -4.682 442 HA2 GLY 79 1HA GLY 79 13.461 8.494 -2.837 443 HA3 GLY 79 2HA GLY 79 12.233 8.187 -4.063 444 H THR 80 H THR 80 10.389 6.879 -3.498 445 HA THR 80 HA THR 80 9.944 6.687 -0.541 446 HB THR 80 HB THR 80 7.864 6.970 -2.712 447 HG1 THR 80 1HG THR 80 9.401 8.762 -2.451 448 HG21 THR 80 3HG2 THR 80 6.442 7.840 -0.857 449 HG22 THR 80 1HG2 THR 80 7.712 7.418 0.318 450 HG23 THR 80 2HG2 THR 80 6.889 6.154 -0.628 451 H ILE 81 H ILE 81 8.876 4.707 0.283 452 HA ILE 81 HA ILE 81 7.817 2.930 -1.687 453 HB ILE 81 HB ILE 81 10.165 2.177 -1.745 454 HG12 ILE 81 1HG1 ILE 81 8.778 -0.015 -0.187 455 HG13 ILE 81 2HG1 ILE 81 8.102 0.514 -1.708 456 HG21 ILE 81 1HG2 ILE 81 9.910 1.534 1.221 457 HG22 ILE 81 2HG2 ILE 81 11.301 1.189 0.184 458 HG23 ILE 81 3HG2 ILE 81 10.865 2.874 0.544 459 HD11 ILE 81 3HD1 ILE 81 9.587 -1.380 -2.083 460 HD12 ILE 81 1HD1 ILE 81 10.281 0.056 -2.846 461 HD13 ILE 81 2HD1 ILE 81 10.936 -0.535 -1.304 462 H ILE 82 H ILE 82 6.404 1.365 -0.732 463 HA ILE 82 HA ILE 82 6.080 1.481 2.200 464 HB ILE 82 HB ILE 82 3.829 1.420 0.149 465 HG12 ILE 82 1HG1 ILE 82 4.471 3.733 2.044 466 HG13 ILE 82 2HG1 ILE 82 4.935 3.728 0.346 467 HG21 ILE 82 1HG2 ILE 82 2.335 1.655 2.156 468 HG22 ILE 82 2HG2 ILE 82 3.251 0.163 2.161 469 HG23 ILE 82 3HG2 ILE 82 3.746 1.491 3.212 470 HD11 ILE 82 3HD1 ILE 82 2.980 4.937 0.375 471 HD12 ILE 82 1HD1 ILE 82 2.533 3.356 -0.285 472 HD13 ILE 82 2HD1 ILE 82 2.122 3.762 1.395 473 H PHE 83 H PHE 83 6.192 -0.579 3.049 474 HA PHE 83 HA PHE 83 5.772 -2.902 1.270 475 HB2 PHE 83 1HB PHE 83 7.215 -2.694 3.940 476 HB3 PHE 83 2HB PHE 83 6.936 -4.170 3.102 477 HD1 PHE 83 2HD PHE 83 8.694 -0.885 2.937 478 HD2 PHE 83 1HD PHE 83 8.466 -4.883 1.339 479 HE1 PHE 83 2HE PHE 83 10.918 -0.588 1.856 480 HE2 PHE 83 1HE PHE 83 10.701 -4.557 0.282 481 HZ PHE 83 HZ PHE 83 11.905 -2.435 0.538 482 H PHE 84 H PHE 84 4.327 -4.614 2.227 483 HA PHE 84 HA PHE 84 2.959 -4.083 4.715 484 HB2 PHE 84 1HB PHE 84 0.639 -4.063 3.629 485 HB3 PHE 84 2HB PHE 84 1.576 -2.584 3.517 486 HD1 PHE 84 1HD PHE 84 2.768 -1.950 1.345 487 HD2 PHE 84 2HD PHE 84 -0.059 -5.194 1.598 488 HE1 PHE 84 1HE PHE 84 2.750 -2.091 -1.062 489 HE2 PHE 84 2HE PHE 84 -0.214 -5.228 -0.879 490 HZ PHE 84 HZ PHE 84 1.196 -3.672 -2.230 491 H LYS 85 H LYS 85 1.675 -5.907 5.395 492 HA LYS 85 HA LYS 85 1.524 -8.297 3.647 493 HB2 LYS 85 1HB LYS 85 3.596 -8.468 4.968 494 HB3 LYS 85 2HB LYS 85 2.570 -8.496 6.401 495 HG2 LYS 85 1HG LYS 85 1.311 -10.418 4.897 496 HG3 LYS 85 2HG LYS 85 2.910 -10.524 4.143 497 HD2 LYS 85 1HD LYS 85 3.936 -10.975 6.313 498 HD3 LYS 85 2HD LYS 85 2.407 -10.469 7.072 499 HE2 LYS 85 1HE LYS 85 1.287 -12.497 6.118 500 HE3 LYS 85 2HE LYS 85 2.857 -13.025 5.469 501 HZ1 LYS 85 3HZ LYS 85 2.311 -12.599 8.370 502 HZ2 LYS 85 1HZ LYS 85 3.685 -13.198 7.710 503 HZ3 LYS 85 2HZ LYS 85 2.325 -14.063 7.628 504 H ALA 86 H ALA 86 -0.576 -8.766 3.645 505 HA ALA 86 HA ALA 86 -2.341 -8.049 5.909 506 HB1 ALA 86 1HB ALA 86 -4.116 -8.966 4.486 507 HB2 ALA 86 2HB ALA 86 -3.134 -7.810 3.562 508 HB3 ALA 86 3HB ALA 86 -2.919 -9.549 3.311 509 H GLU 87 H GLU 87 -2.965 -9.511 7.407 510 HA GLU 87 HA GLU 87 -2.515 -12.436 7.025 511 HB2 GLU 87 1HB GLU 87 -1.668 -10.545 9.236 512 HB3 GLU 87 2HB GLU 87 -2.248 -12.132 9.667 513 HG2 GLU 87 1HG GLU 87 -0.588 -13.109 7.971 514 HG3 GLU 87 2HG GLU 87 0.126 -11.482 7.925 515 H GLY 88 H GLY 88 -4.706 -12.542 6.316 516 HA2 GLY 88 1HA GLY 88 -6.835 -13.221 6.658 517 HA3 GLY 88 2HA GLY 88 -6.557 -13.138 8.399 518 H GLN 89 H GLN 89 -6.098 -10.523 8.809 519 HA GLN 89 HA GLN 89 -7.966 -8.806 7.399 520 HB2 GLN 89 1HB GLN 89 -8.068 -9.098 10.437 521 HB3 GLN 89 2HB GLN 89 -8.764 -7.745 9.526 522 HG2 GLN 89 1HG GLN 89 -10.109 -9.509 8.206 523 HG3 GLN 89 2HG GLN 89 -9.643 -10.631 9.489 524 HE21 GLN 89 1HE2 GLN 89 -11.803 -8.126 8.558 525 HE22 GLN 89 2HE2 GLN 89 -12.630 -8.020 10.075 526 H THR 90 H THR 90 -5.605 -9.112 10.016 527 HA THR 90 HA THR 90 -5.137 -6.362 9.984 528 HB THR 90 HB THR 90 -3.307 -8.373 11.333 529 HG1 THR 90 1HG THR 90 -4.885 -8.121 13.068 530 HG21 THR 90 3HG2 THR 90 -4.252 -5.584 12.168 531 HG22 THR 90 1HG2 THR 90 -2.645 -5.970 11.524 532 HG23 THR 90 2HG2 THR 90 -3.155 -6.626 13.083 533 H VAL 91 H VAL 91 -3.835 -5.072 8.891 534 HA VAL 91 HA VAL 91 -1.799 -6.256 7.091 535 HB VAL 91 HB VAL 91 -3.107 -3.503 6.967 536 HG11 VAL 91 1HG1 VAL 91 -0.884 -3.657 5.858 537 HG12 VAL 91 2HG1 VAL 91 -1.438 -5.073 4.945 538 HG13 VAL 91 3HG1 VAL 91 -2.178 -3.488 4.668 539 HG21 VAL 91 3HG2 VAL 91 -3.743 -5.972 5.342 540 HG22 VAL 91 1HG2 VAL 91 -4.815 -5.238 6.559 541 HG23 VAL 91 2HG2 VAL 91 -4.401 -4.331 5.109 542 H ILE 92 H ILE 92 0.189 -6.148 8.032 543 HA ILE 92 HA ILE 92 0.900 -3.927 9.828 544 HB ILE 92 HB ILE 92 2.598 -6.191 8.725 545 HG12 ILE 92 1HG1 ILE 92 2.437 -7.130 11.068 546 HG13 ILE 92 2HG1 ILE 92 1.072 -6.067 11.381 547 HG21 ILE 92 1HG2 ILE 92 2.995 -4.380 11.163 548 HG22 ILE 92 2HG2 ILE 92 4.124 -5.612 10.564 549 HG23 ILE 92 3HG2 ILE 92 3.811 -4.164 9.601 550 HD11 ILE 92 3HD1 ILE 92 0.599 -8.511 10.818 551 HD12 ILE 92 1HD1 ILE 92 -0.308 -7.349 9.861 552 HD13 ILE 92 2HD1 ILE 92 1.117 -8.163 9.157 553 H ILE 93 H ILE 93 0.863 -2.111 8.568 554 HA ILE 93 HA ILE 93 2.069 -2.029 5.889 555 HB ILE 93 HB ILE 93 1.279 0.445 7.448 556 HG12 ILE 93 1HG1 ILE 93 -0.652 -1.174 5.744 557 HG13 ILE 93 2HG1 ILE 93 -0.783 -0.993 7.506 558 HG21 ILE 93 1HG2 ILE 93 1.340 -0.277 4.470 559 HG22 ILE 93 2HG2 ILE 93 1.103 1.338 5.138 560 HG23 ILE 93 3HG2 ILE 93 2.653 0.535 5.324 561 HD11 ILE 93 3HD1 ILE 93 -1.015 1.287 5.533 562 HD12 ILE 93 1HD1 ILE 93 -2.314 0.468 6.386 563 HD13 ILE 93 2HD1 ILE 93 -1.109 1.398 7.305 564 H LYS 94 H LYS 94 4.178 -1.856 5.692 565 HA LYS 94 HA LYS 94 5.870 -0.812 7.896 566 HB2 LYS 94 1HB LYS 94 6.290 -3.039 5.878 567 HB3 LYS 94 2HB LYS 94 7.600 -2.361 6.785 568 HG2 LYS 94 1HG LYS 94 6.248 -2.922 8.911 569 HG3 LYS 94 2HG LYS 94 5.229 -3.888 7.837 570 HD2 LYS 94 1HD LYS 94 7.247 -5.166 7.092 571 HD3 LYS 94 2HD LYS 94 8.254 -4.208 8.191 572 HE2 LYS 94 1HE LYS 94 6.849 -4.992 10.114 573 HE3 LYS 94 2HE LYS 94 5.910 -5.986 9.001 574 HZ1 LYS 94 3HZ LYS 94 7.428 -7.349 9.978 575 HZ2 LYS 94 1HZ LYS 94 8.687 -6.339 9.854 576 HZ3 LYS 94 2HZ LYS 94 8.113 -7.140 8.504 577 H TYR 95 H TYR 95 5.688 1.386 7.051 578 HA TYR 95 HA TYR 95 6.667 1.808 4.256 579 HB2 TYR 95 1HB TYR 95 5.669 4.045 4.528 580 HB3 TYR 95 2HB TYR 95 4.524 2.731 4.695 581 HD1 TYR 95 2HD TYR 95 3.537 2.098 6.817 582 HD2 TYR 95 1HD TYR 95 6.054 5.566 6.413 583 HE1 TYR 95 2HE TYR 95 2.680 2.964 8.979 584 HE2 TYR 95 1HE TYR 95 5.142 6.469 8.564 585 HH TYR 95 HH TYR 95 3.322 6.300 10.023 586 H THR 96 H THR 96 8.014 3.863 3.974 587 HA THR 96 HA THR 96 9.472 4.685 6.363 588 HB THR 96 HB THR 96 10.856 2.878 5.466 589 HG1 THR 96 1HG THR 96 12.739 4.301 5.224 590 HG21 THR 96 3HG2 THR 96 11.209 4.617 2.989 591 HG22 THR 96 1HG2 THR 96 10.341 3.073 3.042 592 HG23 THR 96 2HG2 THR 96 12.080 3.117 3.368 593 H SER 97 H SER 97 10.936 6.523 5.583 594 HA SER 97 HA SER 97 9.670 8.203 3.505 595 HB2 SER 97 1HB SER 97 10.133 10.149 5.066 596 HB3 SER 97 2HB SER 97 8.777 9.119 5.453 597 HG SER 97 HG SER 97 11.182 9.407 6.760 598 H GLN 98 H GLN 98 12.331 6.546 4.565 599 HA GLN 98 HA GLN 98 13.687 7.680 2.329 600 HB2 GLN 98 1HB GLN 98 15.147 7.673 5.013 601 HB3 GLN 98 2HB GLN 98 15.930 7.675 3.427 602 HG2 GLN 98 1HG GLN 98 14.645 9.831 2.930 603 HG3 GLN 98 2HG GLN 98 14.307 9.895 4.667 604 HE21 GLN 98 1HE2 GLN 98 16.563 10.756 2.261 605 HE22 GLN 98 2HE2 GLN 98 18.018 10.875 3.222 606 H ARG 99 H ARG 99 14.784 6.077 1.271 607 HA ARG 99 HA ARG 99 14.428 3.350 1.954 608 HB2 ARG 99 1HB ARG 99 16.384 4.739 0.093 609 HB3 ARG 99 2HB ARG 99 16.275 2.998 0.209 610 HG2 ARG 99 1HG ARG 99 13.959 4.844 -0.560 611 HG3 ARG 99 2HG ARG 99 15.030 4.031 -1.676 612 HD2 ARG 99 1HD ARG 99 13.057 2.724 0.151 613 HD3 ARG 99 2HD ARG 99 13.000 2.789 -1.614 614 HE ARG 99 HE ARG 99 14.289 0.902 0.071 615 HH11 ARG 99 1HH1 ARG 99 14.656 2.314 -3.210 616 HH12 ARG 99 2HH1 ARG 99 15.866 1.172 -3.692 617 HH21 ARG 99 1HH2 ARG 99 15.738 -0.647 -0.669 618 HH22 ARG 99 2HH2 ARG 99 16.313 -0.628 -2.302 619 H ASN 100 H ASN 100 17.101 5.446 2.672 620 HA ASN 100 HA ASN 100 18.755 3.385 3.734 621 HB2 ASN 100 1HB ASN 100 20.372 4.897 4.258 622 HB3 ASN 100 2HB ASN 100 19.593 5.653 2.890 623 HD21 ASN 100 1HD2 ASN 100 17.321 6.634 4.444 624 HD22 ASN 100 2HD2 ASN 100 17.937 8.084 5.249 625 H THR 101 H THR 101 15.971 3.724 5.086 626 HA THR 101 HA THR 101 17.070 3.183 7.727 627 HB THR 101 HB THR 101 15.138 4.351 8.841 628 HG1 THR 101 1HG THR 101 14.819 5.326 6.214 629 HG21 THR 101 3HG2 THR 101 16.150 6.531 8.906 630 HG22 THR 101 1HG2 THR 101 17.048 6.220 7.396 631 HG23 THR 101 2HG2 THR 101 17.422 5.304 8.871 632 H LYS 102 H LYS 102 15.678 1.812 9.005 633 HA LYS 102 HA LYS 102 14.187 -0.104 7.509 634 HB2 LYS 102 1HB LYS 102 13.650 -1.135 9.551 635 HB3 LYS 102 2HB LYS 102 15.272 -0.519 9.760 636 HG2 LYS 102 1HG LYS 102 14.592 1.207 11.236 637 HG3 LYS 102 2HG LYS 102 12.903 1.140 10.759 638 HD2 LYS 102 1HD LYS 102 14.312 -1.087 12.256 639 HD3 LYS 102 2HD LYS 102 13.336 0.191 12.986 640 HE2 LYS 102 1HE LYS 102 11.749 -0.996 10.872 641 HE3 LYS 102 2HE LYS 102 12.478 -2.316 11.794 642 HZ1 LYS 102 3HZ LYS 102 10.422 -1.760 12.769 643 HZ2 LYS 102 1HZ LYS 102 10.780 -0.146 12.858 644 HZ3 LYS 102 2HZ LYS 102 11.567 -1.218 13.817 645 H LEU 103 H LEU 103 11.886 -0.685 8.282 646 HA LEU 103 HA LEU 103 10.205 1.524 7.455 647 HB2 LEU 103 1HB LEU 103 9.616 -1.352 8.212 648 HB3 LEU 103 2HB LEU 103 8.467 -0.271 7.452 649 HG LEU 103 HG LEU 103 9.129 -1.490 5.630 650 HD11 LEU 103 1HD1 LEU 103 11.246 0.678 5.559 651 HD12 LEU 103 2HD1 LEU 103 9.545 0.828 5.030 652 HD13 LEU 103 3HD1 LEU 103 10.667 -0.258 4.202 653 HD21 LEU 103 3HD2 LEU 103 12.039 -1.604 6.429 654 HD22 LEU 103 1HD2 LEU 103 11.173 -2.507 5.178 655 HD23 LEU 103 2HD2 LEU 103 10.825 -2.837 6.872 656 H LYS 104 H LYS 104 8.503 2.346 8.556 657 HA LYS 104 HA LYS 104 8.203 2.290 11.468 658 HB2 LYS 104 1HB LYS 104 6.481 3.375 9.181 659 HB3 LYS 104 2HB LYS 104 6.034 3.471 10.875 660 HG2 LYS 104 1HG LYS 104 6.845 5.557 10.525 661 HG3 LYS 104 2HG LYS 104 8.214 4.757 11.279 662 HD2 LYS 104 1HD LYS 104 9.270 4.539 9.018 663 HD3 LYS 104 2HD LYS 104 7.842 5.304 8.308 664 HE2 LYS 104 1HE LYS 104 8.982 6.856 10.561 665 HE3 LYS 104 2HE LYS 104 10.210 6.547 9.346 666 HZ1 LYS 104 3HZ LYS 104 7.635 7.769 8.518 667 HZ2 LYS 104 1HZ LYS 104 9.132 7.864 7.813 668 HZ3 LYS 104 2HZ LYS 104 8.837 8.667 9.154 669 H ALA 105 H ALA 105 5.607 1.728 11.964 670 HA ALA 105 HA ALA 105 4.766 -0.720 10.568 671 HB1 ALA 105 1HB ALA 105 5.594 -0.866 13.492 672 HB2 ALA 105 2HB ALA 105 4.875 -2.161 12.511 673 HB3 ALA 105 3HB ALA 105 6.498 -1.571 12.134 674 H LYS 106 H LYS 106 2.778 0.182 10.155 675 HA LYS 106 HA LYS 106 0.991 1.003 12.428 676 HB2 LYS 106 1HB LYS 106 1.283 2.723 10.698 677 HB3 LYS 106 2HB LYS 106 1.019 1.528 9.437 678 HG2 LYS 106 1HG LYS 106 -0.919 2.521 9.288 679 HG3 LYS 106 2HG LYS 106 -1.385 1.328 10.487 680 HD2 LYS 106 1HD LYS 106 -1.647 2.937 12.150 681 HD3 LYS 106 2HD LYS 106 -0.429 4.009 11.464 682 HE2 LYS 106 1HE LYS 106 -2.107 4.259 9.452 683 HE3 LYS 106 2HE LYS 106 -3.317 3.609 10.566 684 HZ1 LYS 106 3HZ LYS 106 -2.817 5.494 12.034 685 HZ2 LYS 106 1HZ LYS 106 -3.328 5.980 10.580 686 HZ3 LYS 106 2HZ LYS 106 -1.717 6.066 10.930 687 H ALA 107 H ALA 107 -0.409 -0.687 13.000 688 HA ALA 107 HA ALA 107 -0.834 -2.903 11.053 689 HB1 ALA 107 1HB ALA 107 -1.099 -4.372 12.997 690 HB2 ALA 107 2HB ALA 107 0.521 -3.641 12.951 691 HB3 ALA 107 3HB ALA 107 -0.719 -3.017 14.078 692 H LEU 108 H LEU 108 -2.954 -3.070 10.403 693 HA LEU 108 HA LEU 108 -5.137 -1.846 12.055 694 HB2 LEU 108 1HB LEU 108 -4.591 -1.464 9.090 695 HB3 LEU 108 2HB LEU 108 -5.912 -0.725 9.994 696 HG LEU 108 HG LEU 108 -2.958 -0.134 10.472 697 HD11 LEU 108 1HD1 LEU 108 -4.967 1.283 8.695 698 HD12 LEU 108 2HD1 LEU 108 -3.494 0.406 8.203 699 HD13 LEU 108 3HD1 LEU 108 -3.366 1.912 9.113 700 HD21 LEU 108 3HD2 LEU 108 -4.478 0.449 12.358 701 HD22 LEU 108 1HD2 LEU 108 -5.447 1.420 11.229 702 HD23 LEU 108 2HD2 LEU 108 -3.774 1.880 11.614 703 H THR 109 H THR 109 -7.202 -2.975 11.744 704 HA THR 109 HA THR 109 -6.968 -5.527 10.322 705 HB THR 109 HB THR 109 -9.503 -5.617 11.055 706 HG1 THR 109 1HG THR 109 -8.815 -4.193 13.266 707 HG21 THR 109 3HG2 THR 109 -8.689 -6.505 13.258 708 HG22 THR 109 1HG2 THR 109 -7.097 -5.798 12.923 709 HG23 THR 109 2HG2 THR 109 -7.740 -7.081 11.886 710 H LEU 110 H LEU 110 -8.028 -6.192 8.454 711 HA LEU 110 HA LEU 110 -8.465 -4.425 6.411 712 HB2 LEU 110 1HB LEU 110 -9.563 -7.215 6.956 713 HB3 LEU 110 2HB LEU 110 -10.068 -6.321 5.556 714 HG LEU 110 HG LEU 110 -7.279 -7.343 6.072 715 HD11 LEU 110 1HD1 LEU 110 -8.890 -8.937 5.197 716 HD12 LEU 110 2HD1 LEU 110 -7.617 -8.568 4.045 717 HD13 LEU 110 3HD1 LEU 110 -9.227 -7.842 3.827 718 HD21 LEU 110 3HD2 LEU 110 -6.575 -6.331 4.030 719 HD22 LEU 110 1HD2 LEU 110 -6.917 -5.160 5.267 720 HD23 LEU 110 2HD2 LEU 110 -8.110 -5.390 3.952 721 H SER 111 H SER 111 -10.721 -5.272 8.867 722 HA SER 111 HA SER 111 -13.071 -4.291 7.601 723 HB2 SER 111 1HB SER 111 -12.424 -5.819 9.778 724 HB3 SER 111 2HB SER 111 -12.839 -4.318 10.567 725 HG SER 111 HG SER 111 -14.684 -5.670 10.216 726 H GLN 112 H GLN 112 -10.676 -2.826 9.879 727 HA GLN 112 HA GLN 112 -11.783 -0.175 9.998 728 HB2 GLN 112 1HB GLN 112 -9.092 -1.446 10.576 729 HB3 GLN 112 2HB GLN 112 -9.154 0.273 10.281 730 HG2 GLN 112 1HG GLN 112 -10.744 -1.235 12.384 731 HG3 GLN 112 2HG GLN 112 -9.320 -0.241 12.653 732 HE21 GLN 112 1HE2 GLN 112 -9.756 2.088 11.210 733 HE22 GLN 112 2HE2 GLN 112 -11.217 2.836 11.810 734 H LEU 113 H LEU 113 -9.134 -1.568 7.939 735 HA LEU 113 HA LEU 113 -8.680 0.686 6.373 736 HB2 LEU 113 1HB LEU 113 -8.701 -2.265 5.523 737 HB3 LEU 113 2HB LEU 113 -8.274 -0.953 4.464 738 HG LEU 113 HG LEU 113 -6.274 -1.833 5.009 739 HD11 LEU 113 1HD1 LEU 113 -6.524 0.513 6.928 740 HD12 LEU 113 2HD1 LEU 113 -6.347 0.645 5.164 741 HD13 LEU 113 3HD1 LEU 113 -5.064 -0.097 6.135 742 HD21 LEU 113 3HD2 LEU 113 -5.368 -2.278 7.186 743 HD22 LEU 113 1HD2 LEU 113 -6.839 -3.198 6.965 744 HD23 LEU 113 2HD2 LEU 113 -6.865 -1.727 7.974 745 H LYS 114 H LYS 114 -11.247 -1.728 5.835 746 HA LYS 114 HA LYS 114 -12.151 -0.563 3.360 747 HB2 LYS 114 1HB LYS 114 -12.453 -2.948 4.126 748 HB3 LYS 114 2HB LYS 114 -13.621 -2.367 5.324 749 HG2 LYS 114 1HG LYS 114 -14.992 -1.416 3.360 750 HG3 LYS 114 2HG LYS 114 -13.833 -2.180 2.287 751 HD2 LYS 114 1HD LYS 114 -15.278 -3.723 4.487 752 HD3 LYS 114 2HD LYS 114 -16.025 -3.444 2.901 753 HE2 LYS 114 1HE LYS 114 -14.184 -4.455 1.688 754 HE3 LYS 114 2HE LYS 114 -13.269 -4.720 3.175 755 HZ1 LYS 114 3HZ LYS 114 -15.891 -5.979 2.641 756 HZ2 LYS 114 1HZ LYS 114 -14.865 -6.343 3.852 757 HZ3 LYS 114 2HZ LYS 114 -14.471 -6.675 2.260 758 H LYS 115 H LYS 115 -12.963 0.035 6.769 759 HA LYS 115 HA LYS 115 -15.236 1.743 6.117 760 HB2 LYS 115 1HB LYS 115 -14.079 0.564 8.465 761 HB3 LYS 115 2HB LYS 115 -13.886 2.284 8.657 762 HG2 LYS 115 1HG LYS 115 -15.968 1.405 9.605 763 HG3 LYS 115 2HG LYS 115 -16.279 2.646 8.394 764 HD2 LYS 115 1HD LYS 115 -17.872 0.790 8.379 765 HD3 LYS 115 2HD LYS 115 -17.071 0.950 6.823 766 HE2 LYS 115 1HE LYS 115 -15.873 -1.083 7.058 767 HE3 LYS 115 2HE LYS 115 -15.928 -0.989 8.830 768 HZ1 LYS 115 3HZ LYS 115 -18.283 -1.492 8.745 769 HZ2 LYS 115 1HZ LYS 115 -17.414 -2.654 7.937 770 HZ3 LYS 115 2HZ LYS 115 -18.262 -1.524 7.103 771 H GLU 116 H GLU 116 -11.960 2.413 7.331 772 HA GLU 116 HA GLU 116 -11.803 5.102 7.189 773 HB2 GLU 116 1HB GLU 116 -9.652 3.125 6.359 774 HB3 GLU 116 2HB GLU 116 -9.335 4.780 6.852 775 HG2 GLU 116 1HG GLU 116 -10.718 2.855 8.747 776 HG3 GLU 116 2HG GLU 116 -8.988 2.746 8.477 777 H PHE 117 H PHE 117 -10.903 2.925 4.493 778 HA PHE 117 HA PHE 117 -10.940 5.237 2.619 779 HB2 PHE 117 1HB PHE 117 -9.206 2.772 2.561 780 HB3 PHE 117 2HB PHE 117 -9.084 4.193 1.543 781 HD1 PHE 117 1HD PHE 117 -8.859 6.497 2.902 782 HD2 PHE 117 2HD PHE 117 -7.678 2.615 4.351 783 HE1 PHE 117 1HE PHE 117 -7.408 7.574 4.583 784 HE2 PHE 117 2HE PHE 117 -6.242 3.702 6.055 785 HZ PHE 117 HZ PHE 117 -6.092 6.178 6.182 786 H TYR 118 H TYR 118 -13.040 2.856 3.253 787 HA TYR 118 HA TYR 118 -13.699 2.738 0.372 788 HB2 TYR 118 1HB TYR 118 -12.572 0.520 1.492 789 HB3 TYR 118 2HB TYR 118 -14.287 0.165 1.649 790 HD1 TYR 118 1HD TYR 118 -15.460 1.253 -0.797 791 HD2 TYR 118 2HD TYR 118 -11.699 -0.758 -0.308 792 HE1 TYR 118 1HE TYR 118 -15.495 0.546 -3.155 793 HE2 TYR 118 2HE TYR 118 -11.815 -1.522 -2.691 794 HH TYR 118 HH TYR 118 -13.184 -1.623 -4.712 795 H GLN 119 H GLN 119 -14.804 3.952 3.229 796 HA GLN 119 HA GLN 119 -17.334 3.000 3.293 797 HB2 GLN 119 1HB GLN 119 -18.095 4.800 4.562 798 HB3 GLN 119 2HB GLN 119 -16.469 4.396 5.027 799 HG2 GLN 119 1HG GLN 119 -16.819 6.722 3.183 800 HG3 GLN 119 2HG GLN 119 -17.285 6.882 4.865 801 HE21 GLN 119 1HE2 GLN 119 -14.531 6.893 2.728 802 HE22 GLN 119 2HE2 GLN 119 -13.335 6.696 3.975 803 H THR 120 H THR 120 -16.425 5.616 0.974 804 HA THR 120 HA THR 120 -19.209 6.412 0.760 805 HB THR 120 HB THR 120 -18.575 8.157 -0.523 806 HG1 THR 120 1HG THR 120 -16.304 7.768 -1.726 807 HG21 THR 120 3HG2 THR 120 -17.249 8.133 1.585 808 HG22 THR 120 1HG2 THR 120 -16.495 9.088 0.283 809 HG23 THR 120 2HG2 THR 120 -15.853 7.471 0.702 810 H ARG 121 H ARG 121 -20.014 6.663 -1.892 811 HA ARG 121 HA ARG 121 -20.207 3.857 -2.902 812 HB2 ARG 121 1HB ARG 121 -22.059 4.596 -4.016 813 HB3 ARG 121 2HB ARG 121 -21.917 5.973 -2.887 814 HG2 ARG 121 1HG ARG 121 -22.409 6.939 -4.871 815 HG3 ARG 121 2HG ARG 121 -20.711 7.256 -4.676 816 HD2 ARG 121 1HD ARG 121 -20.186 6.149 -6.598 817 HD3 ARG 121 2HD ARG 121 -21.202 4.757 -6.177 818 HE ARG 121 HE ARG 121 -22.768 7.041 -6.960 819 HH11 ARG 121 1HH1 ARG 121 -20.649 4.585 -8.515 820 HH12 ARG 121 2HH1 ARG 121 -21.539 4.663 -10.008 821 HH21 ARG 121 1HH2 ARG 121 -24.056 6.818 -8.892 822 HH22 ARG 121 2HH2 ARG 121 -23.445 5.807 -10.194 823 H SER 122 H SER 122 -18.237 6.636 -3.370 824 HA SER 122 HA SER 122 -17.708 6.127 -6.194 825 HB2 SER 122 1HB SER 122 -17.911 8.282 -4.367 826 HB3 SER 122 2HB SER 122 -16.172 8.201 -4.764 827 HG SER 122 HG SER 122 -16.705 8.367 -6.921 828 H GLN 123 H GLN 123 -16.234 5.414 -3.076 829 HA GLN 123 HA GLN 123 -13.617 4.831 -3.798 830 HB2 GLN 123 1HB GLN 123 -15.156 3.016 -2.010 831 HB3 GLN 123 2HB GLN 123 -13.457 3.444 -1.867 832 HG2 GLN 123 1HG GLN 123 -15.511 5.600 -1.443 833 HG3 GLN 123 2HG GLN 123 -15.522 4.206 -0.370 834 HE21 GLN 123 1HE2 GLN 123 -14.793 5.020 1.464 835 HE22 GLN 123 2HE2 GLN 123 -13.298 5.822 1.705 836 H LYS 124 H LYS 124 -16.560 2.879 -4.408 837 HA LYS 124 HA LYS 124 -15.320 0.532 -5.383 838 HB2 LYS 124 1HB LYS 124 -18.022 1.941 -5.857 839 HB3 LYS 124 2HB LYS 124 -17.694 0.431 -6.705 840 HG2 LYS 124 1HG LYS 124 -17.953 -0.879 -4.837 841 HG3 LYS 124 2HG LYS 124 -17.385 0.348 -3.750 842 HD2 LYS 124 1HD LYS 124 -19.638 1.618 -4.398 843 HD3 LYS 124 2HD LYS 124 -20.169 -0.025 -4.799 844 HE2 LYS 124 1HE LYS 124 -19.469 -0.728 -2.472 845 HE3 LYS 124 2HE LYS 124 -18.922 0.897 -2.164 846 HZ1 LYS 124 3HZ LYS 124 -21.568 -0.108 -2.014 847 HZ2 LYS 124 1HZ LYS 124 -21.499 1.264 -2.927 848 HZ3 LYS 124 2HZ LYS 124 -20.940 1.246 -1.359 849 H ARG 125 H ARG 125 -15.031 3.499 -6.728 850 HA ARG 125 HA ARG 125 -14.384 2.527 -9.457 851 HB2 ARG 125 1HB ARG 125 -16.400 4.320 -8.457 852 HB3 ARG 125 2HB ARG 125 -15.223 5.377 -9.135 853 HG2 ARG 125 1HG ARG 125 -17.030 4.819 -10.693 854 HG3 ARG 125 2HG ARG 125 -15.388 4.511 -11.319 855 HD2 ARG 125 1HD ARG 125 -15.666 2.181 -11.258 856 HD3 ARG 125 2HD ARG 125 -16.912 2.276 -10.007 857 HE ARG 125 HE ARG 125 -17.388 3.175 -12.797 858 HH11 ARG 125 1HH1 ARG 125 -17.947 0.626 -10.491 859 HH12 ARG 125 2HH1 ARG 125 -19.634 0.356 -10.867 860 HH21 ARG 125 1HH2 ARG 125 -19.588 2.648 -13.549 861 HH22 ARG 125 2HH2 ARG 125 -20.455 1.356 -12.754 862 H GLU 126 H GLU 126 -13.390 3.927 -6.700 863 HA GLU 126 HA GLU 126 -11.064 5.195 -8.022 864 HB2 GLU 126 1HB GLU 126 -12.424 5.535 -5.322 865 HB3 GLU 126 2HB GLU 126 -10.771 6.110 -5.540 866 HG2 GLU 126 1HG GLU 126 -11.373 7.736 -7.069 867 HG3 GLU 126 2HG GLU 126 -12.839 6.917 -7.540 868 H VAL 127 H VAL 127 -11.660 3.487 -4.926 869 HA VAL 127 HA VAL 127 -9.100 2.407 -4.574 870 HB VAL 127 HB VAL 127 -11.760 1.155 -3.703 871 HG11 VAL 127 1HG1 VAL 127 -9.815 -0.379 -3.579 872 HG12 VAL 127 2HG1 VAL 127 -8.833 0.876 -2.799 873 HG13 VAL 127 3HG1 VAL 127 -10.223 0.195 -1.953 874 HG21 VAL 127 3HG2 VAL 127 -9.872 3.088 -2.238 875 HG22 VAL 127 1HG2 VAL 127 -11.453 3.541 -2.888 876 HG23 VAL 127 2HG2 VAL 127 -11.344 2.332 -1.599 877 H ASP 128 H ASP 128 -11.999 0.787 -5.986 878 HA ASP 128 HA ASP 128 -10.562 -1.461 -6.874 879 HB2 ASP 128 1HB ASP 128 -13.251 -0.536 -6.939 880 HB3 ASP 128 2HB ASP 128 -12.836 -0.875 -8.613 881 H ASP 129 H ASP 129 -10.401 1.699 -8.160 882 HA ASP 129 HA ASP 129 -9.867 0.939 -10.932 883 HB2 ASP 129 1HB ASP 129 -11.130 3.039 -10.070 884 HB3 ASP 129 2HB ASP 129 -9.533 3.724 -9.851 885 H TYR 130 H TYR 130 -8.170 2.364 -8.092 886 HA TYR 130 HA TYR 130 -5.591 2.623 -9.324 887 HB2 TYR 130 1HB TYR 130 -6.142 2.079 -6.407 888 HB3 TYR 130 2HB TYR 130 -4.724 2.837 -7.106 889 HD1 TYR 130 1HD TYR 130 -5.299 5.026 -8.646 890 HD2 TYR 130 2HD TYR 130 -7.606 3.539 -5.349 891 HE1 TYR 130 1HE TYR 130 -6.368 7.211 -8.443 892 HE2 TYR 130 2HE TYR 130 -8.709 5.761 -5.113 893 HH TYR 130 HH TYR 130 -8.009 8.465 -7.347 894 H VAL 131 H VAL 131 -7.207 -0.154 -7.758 895 HA VAL 131 HA VAL 131 -4.901 -1.896 -7.852 896 HB VAL 131 HB VAL 131 -7.842 -2.698 -7.912 897 HG11 VAL 131 1HG1 VAL 131 -6.852 -4.700 -6.596 898 HG12 VAL 131 2HG1 VAL 131 -6.475 -4.644 -8.317 899 HG13 VAL 131 3HG1 VAL 131 -5.264 -4.137 -7.125 900 HG21 VAL 131 3HG2 VAL 131 -7.318 -1.206 -5.930 901 HG22 VAL 131 1HG2 VAL 131 -7.827 -2.831 -5.516 902 HG23 VAL 131 2HG2 VAL 131 -6.095 -2.385 -5.452 903 H ALA 132 H ALA 132 -6.915 -0.622 -10.375 904 HA ALA 132 HA ALA 132 -6.048 -2.736 -12.279 905 HB1 ALA 132 1HB ALA 132 -8.526 -2.338 -12.008 906 HB2 ALA 132 2HB ALA 132 -8.266 -0.673 -12.572 907 HB3 ALA 132 3HB ALA 132 -7.896 -2.044 -13.638 908 H GLY 133 H GLY 133 -5.002 0.220 -11.135 909 HA2 GLY 133 1HA GLY 133 -4.001 1.118 -13.815 910 HA3 GLY 133 2HA GLY 133 -4.258 2.140 -12.407 911 H LEU 134 H LEU 134 -2.994 -0.546 -11.018 912 HA LEU 134 HA LEU 134 -0.251 0.501 -11.020 913 HB2 LEU 134 1HB LEU 134 0.196 -0.995 -9.227 914 HB3 LEU 134 2HB LEU 134 -1.275 -0.096 -8.928 915 HG LEU 134 HG LEU 134 -2.546 -2.226 -9.749 916 HD11 LEU 134 1HD1 LEU 134 0.238 -3.361 -9.233 917 HD12 LEU 134 2HD1 LEU 134 -0.759 -3.589 -10.676 918 HD13 LEU 134 3HD1 LEU 134 -1.231 -4.343 -9.165 919 HD21 LEU 134 3HD2 LEU 134 -2.441 -3.164 -7.479 920 HD22 LEU 134 1HD2 LEU 134 -2.495 -1.397 -7.430 921 HD23 LEU 134 2HD2 LEU 134 -0.955 -2.247 -7.150 922 H ARG 135 H ARG 135 1.526 -1.236 -11.162 923 HA ARG 135 HA ARG 135 1.062 -3.197 -13.349 924 HB2 ARG 135 1HB ARG 135 3.393 -1.252 -12.877 925 HB3 ARG 135 2HB ARG 135 3.488 -2.627 -13.979 926 HG2 ARG 135 1HG ARG 135 1.905 -1.752 -15.458 927 HG3 ARG 135 2HG ARG 135 1.298 -0.546 -14.321 928 HD2 ARG 135 1HD ARG 135 2.976 0.927 -14.701 929 HD3 ARG 135 2HD ARG 135 4.190 -0.288 -15.007 930 HE ARG 135 HE ARG 135 2.087 0.687 -16.887 931 HH11 ARG 135 1HH1 ARG 135 5.417 -0.596 -16.626 932 HH12 ARG 135 2HH1 ARG 135 5.453 -1.031 -18.306 933 HH21 ARG 135 1HH2 ARG 135 2.086 -0.304 -18.966 934 HH22 ARG 135 2HH2 ARG 135 3.546 -0.890 -19.658 935 H THR 136 H THR 136 2.641 -5.055 -13.095 936 HA THR 136 HA THR 136 3.658 -5.314 -10.317 937 HB THR 136 HB THR 136 2.238 -7.430 -11.918 938 HG1 THR 136 1HG THR 136 0.456 -6.987 -10.709 939 HG21 THR 136 3HG2 THR 136 3.419 -8.560 -10.203 940 HG22 THR 136 1HG2 THR 136 1.811 -8.347 -9.519 941 HG23 THR 136 2HG2 THR 136 3.139 -7.263 -9.027 942 H GLU 137 H GLU 137 4.816 -4.890 -13.197 943 HA GLU 137 HA GLU 137 6.361 -5.627 -14.620 944 HB2 GLU 137 1HB GLU 137 7.510 -6.918 -12.132 945 HB3 GLU 137 2HB GLU 137 8.187 -7.259 -13.702 946 HG2 GLU 137 1HG GLU 137 7.802 -4.352 -13.156 947 HG3 GLU 137 2HG GLU 137 8.939 -5.180 -12.101 Start of MODEL 8 1 H1 GLY 19 H GLY 19 -7.598 -18.813 10.241 2 HA2 GLY 19 1HA GLY 19 -5.955 -17.539 8.145 3 HA3 GLY 19 2HA GLY 19 -6.389 -19.245 8.232 4 H HIS 20 H HIS 20 -8.235 -16.079 8.319 5 HA HIS 20 HA HIS 20 -9.502 -16.799 5.780 6 HB2 HIS 20 1HB HIS 20 -10.920 -16.351 8.437 7 HB3 HIS 20 2HB HIS 20 -11.662 -15.809 6.939 8 HD1 HIS 20 1HD HIS 20 -11.250 -18.059 4.964 9 HD2 HIS 20 2HD HIS 20 -12.122 -18.640 9.050 10 HE1 HIS 20 1HE HIS 20 -12.201 -20.423 5.166 11 H MET 21 H MET 21 -10.072 -14.935 4.603 12 HA MET 21 HA MET 21 -9.280 -12.303 5.660 13 HB2 MET 21 1HB MET 21 -7.606 -11.949 3.901 14 HB3 MET 21 2HB MET 21 -7.138 -13.288 4.948 15 HG2 MET 21 1HG MET 21 -7.814 -14.922 3.297 16 HG3 MET 21 2HG MET 21 -8.548 -13.677 2.275 17 HE1 MET 21 3HE MET 21 -6.557 -15.928 1.324 18 HE2 MET 21 1HE MET 21 -7.311 -14.736 0.241 19 HE3 MET 21 2HE MET 21 -5.553 -15.008 0.178 20 H LYS 22 H LYS 22 -9.325 -10.729 3.573 21 HA LYS 22 HA LYS 22 -11.362 -11.356 1.651 22 HB2 LYS 22 1HB LYS 22 -12.787 -9.431 2.166 23 HB3 LYS 22 2HB LYS 22 -12.723 -10.514 3.559 24 HG2 LYS 22 1HG LYS 22 -10.714 -8.872 4.289 25 HG3 LYS 22 2HG LYS 22 -11.537 -7.755 3.215 26 HD2 LYS 22 1HD LYS 22 -12.799 -9.213 5.557 27 HD3 LYS 22 2HD LYS 22 -12.109 -7.589 5.639 28 HE2 LYS 22 1HE LYS 22 -13.796 -6.652 4.261 29 HE3 LYS 22 2HE LYS 22 -14.353 -8.241 3.700 30 HZ1 LYS 22 3HZ LYS 22 -15.776 -7.227 5.494 31 HZ2 LYS 22 1HZ LYS 22 -14.507 -7.450 6.546 32 HZ3 LYS 22 2HZ LYS 22 -15.217 -8.720 5.809 33 H PHE 23 H PHE 23 -11.336 -9.573 0.022 34 HA PHE 23 HA PHE 23 -10.371 -8.320 -1.485 35 HB2 PHE 23 1HB PHE 23 -8.665 -7.348 0.775 36 HB3 PHE 23 2HB PHE 23 -8.707 -6.615 -0.822 37 HD1 PHE 23 1HD PHE 23 -11.283 -6.162 -1.638 38 HD2 PHE 23 2HD PHE 23 -9.817 -6.152 2.409 39 HE1 PHE 23 1HE PHE 23 -13.193 -4.822 -0.975 40 HE2 PHE 23 2HE PHE 23 -11.744 -4.768 3.102 41 HZ PHE 23 HZ PHE 23 -13.473 -4.086 1.417 42 H THR 24 H THR 24 -8.230 -7.995 -2.734 43 HA THR 24 HA THR 24 -6.614 -10.455 -2.608 44 HB THR 24 HB THR 24 -5.949 -10.021 -4.803 45 HG1 THR 24 1HG THR 24 -5.836 -8.185 -5.737 46 HG21 THR 24 3HG2 THR 24 -7.929 -9.692 -6.144 47 HG22 THR 24 1HG2 THR 24 -8.743 -8.757 -4.885 48 HG23 THR 24 2HG2 THR 24 -8.482 -10.484 -4.662 49 H ASP 25 H ASP 25 -4.206 -10.171 -2.527 50 HA ASP 25 HA ASP 25 -3.100 -8.427 -0.726 51 HB2 ASP 25 1HB ASP 25 -1.884 -9.626 -3.245 52 HB3 ASP 25 2HB ASP 25 -0.945 -8.684 -2.094 53 H GLN 26 H GLN 26 -3.373 -7.877 -4.238 54 HA GLN 26 HA GLN 26 -2.090 -5.401 -4.433 55 HB2 GLN 26 1HB GLN 26 -4.558 -6.009 -6.088 56 HB3 GLN 26 2HB GLN 26 -3.140 -5.048 -6.488 57 HG2 GLN 26 1HG GLN 26 -2.707 -6.945 -7.686 58 HG3 GLN 26 2HG GLN 26 -1.824 -7.326 -6.225 59 HE21 GLN 26 1HE2 GLN 26 -4.908 -7.839 -7.987 60 HE22 GLN 26 2HE2 GLN 26 -5.212 -9.430 -7.342 61 H GLN 27 H GLN 27 -5.555 -6.020 -3.895 62 HA GLN 27 HA GLN 27 -6.490 -3.337 -3.907 63 HB2 GLN 27 1HB GLN 27 -7.591 -5.762 -2.466 64 HB3 GLN 27 2HB GLN 27 -8.536 -4.351 -2.872 65 HG2 GLN 27 1HG GLN 27 -7.199 -5.837 -5.120 66 HG3 GLN 27 2HG GLN 27 -8.527 -6.635 -4.264 67 HE21 GLN 27 1HE2 GLN 27 -8.599 -6.264 -6.950 68 HE22 GLN 27 2HE2 GLN 27 -9.703 -5.047 -7.382 69 H ILE 28 H ILE 28 -5.487 -5.491 -1.282 70 HA ILE 28 HA ILE 28 -6.040 -3.773 0.936 71 HB ILE 28 HB ILE 28 -4.066 -6.079 0.440 72 HG12 ILE 28 1HG1 ILE 28 -6.692 -6.143 1.984 73 HG13 ILE 28 2HG1 ILE 28 -6.582 -6.519 0.287 74 HG21 ILE 28 1HG2 ILE 28 -3.753 -6.372 2.808 75 HG22 ILE 28 2HG2 ILE 28 -3.307 -4.720 2.409 76 HG23 ILE 28 3HG2 ILE 28 -4.890 -5.057 3.154 77 HD11 ILE 28 3HD1 ILE 28 -5.228 -8.069 2.515 78 HD12 ILE 28 1HD1 ILE 28 -6.563 -8.586 1.480 79 HD13 ILE 28 2HD1 ILE 28 -4.955 -8.354 0.781 80 H GLY 29 H GLY 29 -3.111 -4.264 -1.090 81 HA2 GLY 29 1HA GLY 29 -1.372 -2.548 0.304 82 HA3 GLY 29 2HA GLY 29 -1.276 -2.990 -1.413 83 H VAL 30 H VAL 30 -3.817 -1.805 -2.209 84 HA VAL 30 HA VAL 30 -2.915 0.900 -2.658 85 HB VAL 30 HB VAL 30 -5.609 -0.449 -3.154 86 HG11 VAL 30 1HG1 VAL 30 -4.598 2.199 -4.253 87 HG12 VAL 30 2HG1 VAL 30 -6.128 1.381 -4.658 88 HG13 VAL 30 3HG1 VAL 30 -5.883 2.022 -3.034 89 HG21 VAL 30 3HG2 VAL 30 -4.670 -0.229 -5.592 90 HG22 VAL 30 1HG2 VAL 30 -3.099 -0.030 -4.801 91 HG23 VAL 30 2HG2 VAL 30 -4.020 -1.506 -4.556 92 H LEU 31 H LEU 31 -5.522 -0.508 -0.623 93 HA LEU 31 HA LEU 31 -6.347 2.015 0.465 94 HB2 LEU 31 1HB LEU 31 -6.521 -0.788 1.652 95 HB3 LEU 31 2HB LEU 31 -7.329 0.627 2.305 96 HG LEU 31 HG LEU 31 -7.827 -0.698 -0.363 97 HD11 LEU 31 1HD1 LEU 31 -8.719 -1.785 1.680 98 HD12 LEU 31 2HD1 LEU 31 -10.001 -1.239 0.593 99 HD13 LEU 31 3HD1 LEU 31 -9.629 -0.305 2.066 100 HD21 LEU 31 3HD2 LEU 31 -9.755 0.922 -0.567 101 HD22 LEU 31 1HD2 LEU 31 -8.146 1.623 -0.807 102 HD23 LEU 31 2HD2 LEU 31 -8.999 1.867 0.730 103 H ALA 32 H ALA 32 -3.958 -0.340 1.575 104 HA ALA 32 HA ALA 32 -3.316 1.003 4.051 105 HB1 ALA 32 1HB ALA 32 -1.151 -0.326 3.800 106 HB2 ALA 32 2HB ALA 32 -2.650 -1.286 3.818 107 HB3 ALA 32 3HB ALA 32 -1.809 -0.966 2.289 108 H GLY 33 H GLY 33 -2.180 1.424 0.666 109 HA2 GLY 33 1HA GLY 33 -0.101 3.264 1.415 110 HA3 GLY 33 2HA GLY 33 -0.688 2.942 -0.212 111 H LEU 34 H LEU 34 -3.552 3.627 0.533 112 HA LEU 34 HA LEU 34 -3.462 6.482 0.382 113 HB2 LEU 34 1HB LEU 34 -5.752 4.701 1.300 114 HB3 LEU 34 2HB LEU 34 -5.873 6.427 0.990 115 HG LEU 34 HG LEU 34 -5.212 4.325 -1.105 116 HD11 LEU 34 1HD1 LEU 34 -7.551 4.275 -0.318 117 HD12 LEU 34 2HD1 LEU 34 -7.433 4.843 -1.992 118 HD13 LEU 34 3HD1 LEU 34 -7.713 6.008 -0.677 119 HD21 LEU 34 3HD2 LEU 34 -4.095 6.393 -1.715 120 HD22 LEU 34 1HD2 LEU 34 -5.554 7.341 -1.352 121 HD23 LEU 34 2HD2 LEU 34 -5.518 6.204 -2.729 122 H ALA 35 H ALA 35 -3.319 4.322 3.177 123 HA ALA 35 HA ALA 35 -3.834 6.470 5.084 124 HB1 ALA 35 1HB ALA 35 -2.477 3.783 5.543 125 HB2 ALA 35 2HB ALA 35 -3.138 4.877 6.776 126 HB3 ALA 35 3HB ALA 35 -4.207 4.057 5.629 127 H ILE 36 H ILE 36 -1.063 5.593 3.136 128 HA ILE 36 HA ILE 36 0.739 7.234 4.811 129 HB ILE 36 HB ILE 36 1.227 4.391 3.847 130 HG12 ILE 36 1HG1 ILE 36 2.247 4.296 6.213 131 HG13 ILE 36 2HG1 ILE 36 1.457 5.826 6.559 132 HG21 ILE 36 1HG2 ILE 36 3.258 6.568 4.557 133 HG22 ILE 36 2HG2 ILE 36 3.624 4.835 4.668 134 HG23 ILE 36 3HG2 ILE 36 3.228 5.525 3.135 135 HD11 ILE 36 3HD1 ILE 36 -0.150 3.456 5.611 136 HD12 ILE 36 1HD1 ILE 36 0.453 3.522 7.279 137 HD13 ILE 36 2HD1 ILE 36 -0.613 4.792 6.703 138 H SER 37 H SER 37 0.548 8.917 3.487 139 HA SER 37 HA SER 37 0.970 10.329 1.790 140 HB2 SER 37 1HB SER 37 3.159 8.544 1.881 141 HB3 SER 37 2HB SER 37 2.872 8.846 0.177 142 HG SER 37 HG SER 37 4.286 10.299 1.360 143 HA PRO 38 HA PRO 38 -2.114 7.988 -0.796 144 HB2 PRO 38 1HB PRO 38 -4.108 9.918 -0.620 145 HB3 PRO 38 2HB PRO 38 -3.962 8.557 0.499 146 HG2 PRO 38 1HG PRO 38 -2.989 11.392 0.856 147 HG3 PRO 38 2HG PRO 38 -3.811 10.337 2.044 148 HD2 PRO 38 1HD PRO 38 -1.133 10.697 2.091 149 HD3 PRO 38 2HD PRO 38 -1.854 9.100 2.463 150 H GLU 39 H GLU 39 -1.059 11.397 -0.631 151 HA GLU 39 HA GLU 39 -1.966 12.086 -3.264 152 HB2 GLU 39 1HB GLU 39 -0.047 13.347 -1.279 153 HB3 GLU 39 2HB GLU 39 -0.252 14.006 -2.929 154 HG2 GLU 39 1HG GLU 39 -2.668 14.190 -2.632 155 HG3 GLU 39 2HG GLU 39 -2.581 13.401 -1.055 156 H TRP 40 H TRP 40 1.333 11.127 -2.116 157 HA TRP 40 HA TRP 40 2.583 10.804 -4.576 158 HB2 TRP 40 1HB TRP 40 3.741 10.390 -2.479 159 HB3 TRP 40 2HB TRP 40 2.648 9.099 -2.067 160 HD1 TRP 40 HD TRP 40 5.373 9.804 -4.722 161 HE1 TRP 40 1HE TRP 40 6.641 7.622 -5.135 162 HE3 TRP 40 3HE TRP 40 2.312 6.612 -2.131 163 HZ2 TRP 40 2HZ TRP 40 6.045 4.774 -4.858 164 HZ3 TRP 40 3HZ TRP 40 2.645 4.160 -2.292 165 HH2 TRP 40 HH TRP 40 4.525 3.234 -3.627 166 H LEU 41 H LEU 41 0.712 8.255 -2.892 167 HA LEU 41 HA LEU 41 0.722 6.237 -4.768 168 HB2 LEU 41 1HB LEU 41 -0.156 6.262 -2.399 169 HB3 LEU 41 2HB LEU 41 -1.551 7.128 -2.941 170 HG LEU 41 HG LEU 41 -2.279 4.994 -2.552 171 HD11 LEU 41 1HD1 LEU 41 -3.139 4.103 -4.581 172 HD12 LEU 41 2HD1 LEU 41 -1.883 4.863 -5.553 173 HD13 LEU 41 3HD1 LEU 41 -3.119 5.856 -4.735 174 HD21 LEU 41 3HD2 LEU 41 -1.179 2.952 -3.588 175 HD22 LEU 41 1HD2 LEU 41 -0.333 3.764 -2.258 176 HD23 LEU 41 2HD2 LEU 41 0.222 4.017 -3.906 177 H LYS 42 H LYS 42 -1.817 8.742 -4.518 178 HA LYS 42 HA LYS 42 -3.254 8.001 -6.892 179 HB2 LYS 42 1HB LYS 42 -3.051 10.572 -5.244 180 HB3 LYS 42 2HB LYS 42 -4.215 10.348 -6.548 181 HG2 LYS 42 1HG LYS 42 -5.369 8.633 -5.424 182 HG3 LYS 42 2HG LYS 42 -4.107 8.370 -4.220 183 HD2 LYS 42 1HD LYS 42 -4.562 10.414 -3.095 184 HD3 LYS 42 2HD LYS 42 -5.454 11.050 -4.472 185 HE2 LYS 42 1HE LYS 42 -7.221 9.321 -4.110 186 HE3 LYS 42 2HE LYS 42 -6.371 8.781 -2.653 187 HZ1 LYS 42 3HZ LYS 42 -6.778 10.894 -1.647 188 HZ2 LYS 42 1HZ LYS 42 -8.185 10.375 -2.241 189 HZ3 LYS 42 2HZ LYS 42 -7.371 11.528 -3.088 190 H GLN 43 H GLN 43 -0.657 10.489 -6.365 191 HA GLN 43 HA GLN 43 -0.792 11.567 -9.014 192 HB2 GLN 43 1HB GLN 43 1.421 11.437 -6.929 193 HB3 GLN 43 2HB GLN 43 1.591 12.247 -8.487 194 HG2 GLN 43 1HG GLN 43 0.039 13.922 -7.999 195 HG3 GLN 43 2HG GLN 43 -0.653 13.046 -6.637 196 HE21 GLN 43 1HE2 GLN 43 2.924 13.221 -7.007 197 HE22 GLN 43 2HE2 GLN 43 3.122 14.383 -5.701 198 H ASN 44 H ASN 44 0.911 8.747 -7.613 199 HA ASN 44 HA ASN 44 2.537 8.229 -9.906 200 HB2 ASN 44 1HB ASN 44 1.351 6.066 -8.169 201 HB3 ASN 44 2HB ASN 44 2.846 6.005 -9.089 202 HD21 ASN 44 1HD2 ASN 44 4.208 8.492 -7.950 203 HD22 ASN 44 2HD2 ASN 44 4.320 8.038 -6.265 204 H ILE 45 H ILE 45 -0.732 6.959 -8.910 205 HA ILE 45 HA ILE 45 -1.205 5.488 -11.318 206 HB ILE 45 HB ILE 45 -3.185 6.774 -9.394 207 HG12 ILE 45 1HG1 ILE 45 -1.792 5.091 -8.298 208 HG13 ILE 45 2HG1 ILE 45 -3.454 4.613 -8.393 209 HG21 ILE 45 1HG2 ILE 45 -3.608 4.856 -11.711 210 HG22 ILE 45 2HG2 ILE 45 -4.740 4.980 -10.370 211 HG23 ILE 45 3HG2 ILE 45 -4.428 6.390 -11.365 212 HD11 ILE 45 3HD1 ILE 45 -2.027 2.691 -8.847 213 HD12 ILE 45 1HD1 ILE 45 -2.924 3.087 -10.313 214 HD13 ILE 45 2HD1 ILE 45 -1.214 3.549 -10.171 215 H ALA 46 H ALA 46 -1.826 8.933 -10.542 216 HA ALA 46 HA ALA 46 -3.307 9.558 -12.838 217 HB1 ALA 46 1HB ALA 46 -2.995 11.012 -10.820 218 HB2 ALA 46 2HB ALA 46 -1.326 11.351 -11.377 219 HB3 ALA 46 3HB ALA 46 -2.712 11.856 -12.353 220 H ALA 47 H ALA 47 -0.018 8.627 -12.706 221 HA ALA 47 HA ALA 47 0.312 9.300 -15.550 222 HB1 ALA 47 1HB ALA 47 1.742 10.862 -14.467 223 HB2 ALA 47 2HB ALA 47 2.359 9.646 -13.349 224 HB3 ALA 47 3HB ALA 47 2.784 9.577 -15.085 225 H ASN 48 H ASN 48 -0.672 6.912 -14.018 226 HA ASN 48 HA ASN 48 -0.527 4.687 -13.900 227 HB2 ASN 48 1HB ASN 48 -0.825 5.396 -16.397 228 HB3 ASN 48 2HB ASN 48 0.776 4.685 -16.613 229 HD21 ASN 48 1HD2 ASN 48 0.863 2.410 -15.394 230 HD22 ASN 48 2HD2 ASN 48 -0.549 1.364 -15.620 231 H GLN 49 H GLN 49 1.819 6.012 -12.786 232 HA GLN 49 HA GLN 49 4.257 4.751 -13.769 233 HB2 GLN 49 1HB GLN 49 3.550 6.502 -11.345 234 HB3 GLN 49 2HB GLN 49 5.158 5.970 -11.683 235 HG2 GLN 49 1HG GLN 49 3.499 7.800 -13.402 236 HG3 GLN 49 2HG GLN 49 4.860 8.271 -12.395 237 HE21 GLN 49 1HE2 GLN 49 3.868 6.617 -15.352 238 HE22 GLN 49 2HE2 GLN 49 5.480 6.363 -16.011 239 H LEU 50 H LEU 50 2.021 4.008 -11.357 240 HA LEU 50 HA LEU 50 3.804 3.232 -9.261 241 HB2 LEU 50 1HB LEU 50 1.307 4.178 -9.425 242 HB3 LEU 50 2HB LEU 50 0.873 2.520 -9.441 243 HG LEU 50 HG LEU 50 2.380 4.118 -7.317 244 HD11 LEU 50 1HD1 LEU 50 -0.303 2.708 -7.336 245 HD12 LEU 50 2HD1 LEU 50 -0.006 4.455 -7.361 246 HD13 LEU 50 3HD1 LEU 50 0.390 3.537 -5.930 247 HD21 LEU 50 3HD2 LEU 50 3.424 2.056 -7.010 248 HD22 LEU 50 1HD2 LEU 50 1.889 1.152 -7.147 249 HD23 LEU 50 2HD2 LEU 50 2.250 2.239 -5.751 250 H VAL 51 H VAL 51 4.314 1.099 -8.459 251 HA VAL 51 HA VAL 51 3.505 -1.212 -10.100 252 HB VAL 51 HB VAL 51 6.207 -0.680 -8.797 253 HG11 VAL 51 1HG1 VAL 51 5.271 -2.894 -10.676 254 HG12 VAL 51 2HG1 VAL 51 6.975 -2.572 -10.273 255 HG13 VAL 51 3HG1 VAL 51 5.860 -3.069 -9.010 256 HG21 VAL 51 3HG2 VAL 51 5.450 -0.441 -11.741 257 HG22 VAL 51 1HG2 VAL 51 5.977 0.879 -10.671 258 HG23 VAL 51 2HG2 VAL 51 7.104 -0.403 -11.097 259 H TYR 52 H TYR 52 3.477 -3.214 -8.893 260 HA TYR 52 HA TYR 52 3.534 -3.103 -5.934 261 HB2 TYR 52 1HB TYR 52 1.201 -3.420 -6.499 262 HB3 TYR 52 2HB TYR 52 1.604 -4.515 -7.826 263 HD1 TYR 52 1HD TYR 52 2.268 -6.853 -7.439 264 HD2 TYR 52 2HD TYR 52 1.177 -4.250 -4.176 265 HE1 TYR 52 1HE TYR 52 2.138 -8.811 -5.935 266 HE2 TYR 52 2HE TYR 52 1.073 -6.209 -2.665 267 HH TYR 52 HH TYR 52 1.767 -8.402 -2.418 268 H GLY 53 H GLY 53 4.795 -4.824 -5.090 269 HA2 GLY 53 1HA GLY 53 5.383 -7.113 -6.818 270 HA3 GLY 53 2HA GLY 53 6.789 -6.180 -6.271 271 H ILE 54 H ILE 54 6.435 -8.809 -5.592 272 HA ILE 54 HA ILE 54 6.197 -8.622 -2.630 273 HB ILE 54 HB ILE 54 6.561 -10.975 -4.553 274 HG12 ILE 54 1HG1 ILE 54 4.199 -10.148 -4.287 275 HG13 ILE 54 2HG1 ILE 54 4.466 -11.820 -3.854 276 HG21 ILE 54 1HG2 ILE 54 7.963 -11.496 -2.695 277 HG22 ILE 54 2HG2 ILE 54 6.748 -10.963 -1.522 278 HG23 ILE 54 3HG2 ILE 54 6.480 -12.428 -2.493 279 HD11 ILE 54 3HD1 ILE 54 4.257 -9.535 -1.860 280 HD12 ILE 54 1HD1 ILE 54 2.967 -10.687 -2.259 281 HD13 ILE 54 2HD1 ILE 54 4.425 -11.261 -1.450 282 H VAL 55 H VAL 55 8.080 -8.722 -1.528 283 HA VAL 55 HA VAL 55 10.371 -7.578 -2.383 284 HB VAL 55 HB VAL 55 9.733 -9.573 -0.214 285 HG11 VAL 55 1HG1 VAL 55 12.415 -8.278 -0.736 286 HG12 VAL 55 2HG1 VAL 55 11.871 -8.697 0.893 287 HG13 VAL 55 3HG1 VAL 55 12.050 -9.953 -0.308 288 HG21 VAL 55 3HG2 VAL 55 8.950 -6.984 -0.452 289 HG22 VAL 55 1HG2 VAL 55 9.261 -7.803 1.066 290 HG23 VAL 55 2HG2 VAL 55 10.490 -6.732 0.351 291 H LYS 56 H LYS 56 10.224 -11.090 -1.811 292 HA LYS 56 HA LYS 56 11.283 -12.831 -2.343 293 HB2 LYS 56 1HB LYS 56 12.071 -11.387 -4.819 294 HB3 LYS 56 2HB LYS 56 12.172 -13.142 -4.589 295 HG2 LYS 56 1HG LYS 56 9.516 -12.801 -4.163 296 HG3 LYS 56 2HG LYS 56 9.811 -11.370 -5.159 297 HD2 LYS 56 1HD LYS 56 11.023 -13.006 -6.766 298 HD3 LYS 56 2HD LYS 56 10.243 -14.286 -5.815 299 HE2 LYS 56 1HE LYS 56 8.029 -13.144 -6.298 300 HE3 LYS 56 2HE LYS 56 8.900 -12.044 -7.381 301 HZ1 LYS 56 3HZ LYS 56 8.679 -14.978 -7.691 302 HZ2 LYS 56 1HZ LYS 56 9.565 -14.005 -8.697 303 HZ3 LYS 56 2HZ LYS 56 7.939 -13.879 -8.607 304 HA PRO 57 HA PRO 57 15.153 -12.113 -0.626 305 HB2 PRO 57 1HB PRO 57 16.439 -14.517 -0.797 306 HB3 PRO 57 2HB PRO 57 14.954 -14.236 0.156 307 HG2 PRO 57 1HG PRO 57 15.179 -15.467 -2.585 308 HG3 PRO 57 2HG PRO 57 14.212 -16.023 -1.177 309 HD2 PRO 57 1HD PRO 57 13.196 -14.532 -3.253 310 HD3 PRO 57 2HD PRO 57 12.537 -14.455 -1.602 311 H SER 58 H SER 58 15.212 -12.976 -3.987 312 HA SER 58 HA SER 58 18.020 -12.594 -4.477 313 HB2 SER 58 1HB SER 58 15.927 -11.972 -6.551 314 HB3 SER 58 2HB SER 58 17.505 -12.745 -6.727 315 HG SER 58 HG SER 58 16.539 -14.534 -5.436 316 H ASP 59 H ASP 59 15.862 -10.322 -3.326 317 HA ASP 59 HA ASP 59 17.231 -8.039 -4.643 318 HB2 ASP 59 1HB ASP 59 14.365 -8.437 -3.788 319 HB3 ASP 59 2HB ASP 59 15.065 -6.826 -3.896 320 H THR 60 H THR 60 17.044 -6.035 -3.033 321 HA THR 60 HA THR 60 18.353 -6.989 -0.549 322 HB THR 60 HB THR 60 18.625 -4.344 -2.032 323 HG1 THR 60 1HG THR 60 20.265 -5.216 -3.140 324 HG21 THR 60 3HG2 THR 60 20.509 -5.777 -0.113 325 HG22 THR 60 1HG2 THR 60 19.477 -4.405 0.321 326 HG23 THR 60 2HG2 THR 60 20.770 -4.195 -0.866 327 H VAL 61 H VAL 61 17.341 -6.515 1.379 328 HA VAL 61 HA VAL 61 15.271 -4.417 1.490 329 HB VAL 61 HB VAL 61 13.807 -6.197 2.668 330 HG11 VAL 61 1HG1 VAL 61 14.023 -6.208 -0.364 331 HG12 VAL 61 2HG1 VAL 61 12.606 -6.545 0.661 332 HG13 VAL 61 3HG1 VAL 61 13.245 -4.926 0.616 333 HG21 VAL 61 3HG2 VAL 61 13.871 -8.426 1.782 334 HG22 VAL 61 1HG2 VAL 61 15.262 -8.052 0.764 335 HG23 VAL 61 2HG2 VAL 61 15.426 -8.084 2.553 336 HA PRO 62 HA PRO 62 16.601 -4.105 5.770 337 HB2 PRO 62 1HB PRO 62 14.102 -3.242 6.786 338 HB3 PRO 62 2HB PRO 62 15.453 -2.222 6.269 339 HG2 PRO 62 1HG PRO 62 12.893 -2.635 4.891 340 HG3 PRO 62 2HG PRO 62 14.207 -1.487 4.508 341 HD2 PRO 62 1HD PRO 62 13.508 -3.995 3.259 342 HD3 PRO 62 2HD PRO 62 14.725 -2.790 2.771 343 H ALA 63 H ALA 63 15.772 -4.985 7.985 344 HA ALA 63 HA ALA 63 15.133 -7.759 7.574 345 HB1 ALA 63 1HB ALA 63 16.618 -6.949 9.360 346 HB2 ALA 63 2HB ALA 63 15.238 -6.164 10.179 347 HB3 ALA 63 3HB ALA 63 15.302 -7.943 9.997 348 H GLY 64 H GLY 64 13.358 -8.905 7.884 349 HA2 GLY 64 1HA GLY 64 11.274 -9.566 8.376 350 HA3 GLY 64 2HA GLY 64 11.022 -8.108 9.415 351 H VAL 65 H VAL 65 11.625 -9.093 6.126 352 HA VAL 65 HA VAL 65 9.182 -8.563 4.912 353 HB VAL 65 HB VAL 65 9.129 -6.402 5.360 354 HG11 VAL 65 1HG1 VAL 65 11.555 -6.005 6.418 355 HG12 VAL 65 2HG1 VAL 65 12.192 -6.109 4.747 356 HG13 VAL 65 3HG1 VAL 65 11.167 -4.765 5.247 357 HG21 VAL 65 3HG2 VAL 65 10.746 -5.488 3.191 358 HG22 VAL 65 1HG2 VAL 65 9.742 -6.864 2.863 359 HG23 VAL 65 2HG2 VAL 65 9.016 -5.405 3.645 360 H ASP 66 H ASP 66 10.330 -10.704 4.596 361 HA ASP 66 HA ASP 66 12.152 -10.585 2.272 362 HB2 ASP 66 1HB ASP 66 11.249 -12.985 3.908 363 HB3 ASP 66 2HB ASP 66 12.564 -12.925 2.759 364 H ASP 67 H ASP 67 9.042 -11.068 3.110 365 HA ASP 67 HA ASP 67 8.162 -11.843 0.380 366 HB2 ASP 67 1HB ASP 67 8.359 -13.923 1.846 367 HB3 ASP 67 2HB ASP 67 7.041 -13.257 2.842 368 H TYR 68 H TYR 68 8.123 -9.541 2.368 369 HA TYR 68 HA TYR 68 5.351 -8.836 2.897 370 HB2 TYR 68 1HB TYR 68 7.893 -7.557 3.244 371 HB3 TYR 68 2HB TYR 68 6.495 -6.505 2.954 372 HD1 TYR 68 2HD TYR 68 7.027 -9.776 4.861 373 HD2 TYR 68 1HD TYR 68 5.602 -5.696 4.972 374 HE1 TYR 68 2HE TYR 68 6.031 -10.211 7.020 375 HE2 TYR 68 1HE TYR 68 4.550 -6.154 7.167 376 HH TYR 68 HH TYR 68 4.357 -9.425 8.498 377 H SER 69 H SER 69 4.131 -7.413 1.423 378 HA SER 69 HA SER 69 4.855 -7.341 -1.393 379 HB2 SER 69 1HB SER 69 2.637 -6.285 0.420 380 HB3 SER 69 2HB SER 69 2.754 -5.940 -1.295 381 HG SER 69 HG SER 69 2.607 -8.568 -0.161 382 H TYR 70 H TYR 70 5.199 -5.169 -2.402 383 HA TYR 70 HA TYR 70 5.427 -2.901 -0.598 384 HB2 TYR 70 1HB TYR 70 7.491 -2.055 -1.508 385 HB3 TYR 70 2HB TYR 70 7.781 -3.605 -0.774 386 HD1 TYR 70 2HD TYR 70 7.991 -5.690 -2.305 387 HD2 TYR 70 1HD TYR 70 8.155 -1.630 -3.775 388 HE1 TYR 70 2HE TYR 70 9.206 -6.459 -4.339 389 HE2 TYR 70 1HE TYR 70 9.344 -2.434 -5.812 390 HH TYR 70 HH TYR 70 10.485 -4.233 -6.783 391 H LEU 71 H LEU 71 5.136 -0.852 -1.675 392 HA LEU 71 HA LEU 71 4.268 -0.956 -4.507 393 HB2 LEU 71 1HB LEU 71 3.469 1.069 -2.348 394 HB3 LEU 71 2HB LEU 71 2.940 1.008 -4.008 395 HG LEU 71 HG LEU 71 1.125 0.324 -2.830 396 HD11 LEU 71 1HD1 LEU 71 2.293 -2.389 -3.423 397 HD12 LEU 71 2HD1 LEU 71 1.722 -1.301 -4.686 398 HD13 LEU 71 3HD1 LEU 71 0.583 -1.908 -3.453 399 HD21 LEU 71 3HD2 LEU 71 0.936 -1.215 -1.033 400 HD22 LEU 71 1HD2 LEU 71 1.946 0.184 -0.679 401 HD23 LEU 71 2HD2 LEU 71 2.711 -1.399 -1.004 402 H VAL 72 H VAL 72 5.541 0.403 -5.785 403 HA VAL 72 HA VAL 72 6.806 2.751 -4.684 404 HB VAL 72 HB VAL 72 8.506 1.023 -4.270 405 HG11 VAL 72 1HG1 VAL 72 8.670 0.640 -7.288 406 HG12 VAL 72 2HG1 VAL 72 9.690 -0.121 -6.052 407 HG13 VAL 72 3HG1 VAL 72 7.970 -0.519 -6.147 408 HG21 VAL 72 3HG2 VAL 72 9.578 2.747 -6.511 409 HG22 VAL 72 1HG2 VAL 72 9.114 3.433 -4.954 410 HG23 VAL 72 2HG2 VAL 72 10.374 2.213 -5.021 411 H ALA 73 H ALA 73 7.704 4.034 -6.767 412 HA ALA 73 HA ALA 73 5.960 3.330 -9.087 413 HB1 ALA 73 1HB ALA 73 7.302 5.996 -8.816 414 HB2 ALA 73 2HB ALA 73 5.844 5.541 -9.685 415 HB3 ALA 73 3HB ALA 73 5.789 5.680 -7.922 416 H ALA 74 H ALA 74 6.966 3.280 -11.152 417 HA ALA 74 HA ALA 74 9.393 1.837 -11.077 418 HB1 ALA 74 1HB ALA 74 7.974 3.196 -13.395 419 HB2 ALA 74 2HB ALA 74 9.274 1.999 -13.572 420 HB3 ALA 74 3HB ALA 74 7.725 1.506 -12.837 421 H ASP 75 H ASP 75 8.891 5.185 -11.281 422 HA ASP 75 HA ASP 75 11.743 5.739 -11.804 423 HB2 ASP 75 1HB ASP 75 10.184 6.053 -13.807 424 HB3 ASP 75 2HB ASP 75 9.460 7.402 -12.933 425 H ASP 76 H ASP 76 10.091 5.484 -9.360 426 HA ASP 76 HA ASP 76 11.162 7.835 -7.986 427 HB2 ASP 76 1HB ASP 76 8.590 8.047 -8.050 428 HB3 ASP 76 2HB ASP 76 8.538 6.550 -7.120 429 H GLN 77 H GLN 77 12.398 5.578 -8.738 430 HA GLN 77 HA GLN 77 11.700 3.161 -7.449 431 HB2 GLN 77 1HB GLN 77 13.521 4.149 -9.514 432 HB3 GLN 77 2HB GLN 77 14.383 3.044 -8.470 433 HG2 GLN 77 1HG GLN 77 11.684 2.369 -9.710 434 HG3 GLN 77 2HG GLN 77 13.226 2.076 -10.520 435 HE21 GLN 77 1HE2 GLN 77 11.054 0.131 -9.310 436 HE22 GLN 77 2HE2 GLN 77 11.989 -0.909 -8.288 437 H ASP 78 H ASP 78 14.410 5.416 -6.959 438 HA ASP 78 HA ASP 78 14.952 4.251 -4.256 439 HB2 ASP 78 1HB ASP 78 17.073 5.103 -4.277 440 HB3 ASP 78 2HB ASP 78 16.900 4.487 -5.914 441 H GLY 79 H GLY 79 12.552 5.583 -4.901 442 HA2 GLY 79 1HA GLY 79 12.744 8.197 -3.490 443 HA3 GLY 79 2HA GLY 79 11.539 7.740 -4.690 444 H THR 80 H THR 80 9.579 7.311 -3.778 445 HA THR 80 HA THR 80 9.521 6.771 -0.902 446 HB THR 80 HB THR 80 6.961 6.935 -2.376 447 HG1 THR 80 1HG THR 80 8.118 8.504 -3.476 448 HG21 THR 80 3HG2 THR 80 6.369 8.230 -0.382 449 HG22 THR 80 1HG2 THR 80 8.069 8.290 0.136 450 HG23 THR 80 2HG2 THR 80 7.213 6.749 0.130 451 H ILE 81 H ILE 81 8.884 4.803 0.000 452 HA ILE 81 HA ILE 81 7.506 2.870 -1.757 453 HB ILE 81 HB ILE 81 9.915 2.439 -1.886 454 HG12 ILE 81 1HG1 ILE 81 9.054 0.159 -0.104 455 HG13 ILE 81 2HG1 ILE 81 8.153 0.451 -1.574 456 HG21 ILE 81 1HG2 ILE 81 10.948 1.399 0.383 457 HG22 ILE 81 2HG2 ILE 81 11.091 3.100 -0.088 458 HG23 ILE 81 3HG2 ILE 81 9.881 2.605 1.102 459 HD11 ILE 81 3HD1 ILE 81 10.225 0.327 -2.931 460 HD12 ILE 81 1HD1 ILE 81 11.219 0.277 -1.495 461 HD13 ILE 81 2HD1 ILE 81 10.154 -1.108 -1.877 462 H ILE 82 H ILE 82 6.238 1.364 -0.720 463 HA ILE 82 HA ILE 82 6.019 1.620 2.223 464 HB ILE 82 HB ILE 82 3.567 1.380 0.471 465 HG12 ILE 82 1HG1 ILE 82 4.553 4.046 1.557 466 HG13 ILE 82 2HG1 ILE 82 4.599 3.592 -0.152 467 HG21 ILE 82 1HG2 ILE 82 3.771 0.918 3.118 468 HG22 ILE 82 2HG2 ILE 82 3.543 2.676 3.189 469 HG23 ILE 82 3HG2 ILE 82 2.346 1.644 2.396 470 HD11 ILE 82 3HD1 ILE 82 2.660 4.887 0.096 471 HD12 ILE 82 1HD1 ILE 82 2.129 3.217 -0.116 472 HD13 ILE 82 2HD1 ILE 82 2.097 3.973 1.502 473 H PHE 83 H PHE 83 6.696 -0.390 2.922 474 HA PHE 83 HA PHE 83 6.021 -2.813 1.388 475 HB2 PHE 83 1HB PHE 83 7.301 -2.461 4.105 476 HB3 PHE 83 2HB PHE 83 7.030 -3.994 3.355 477 HD1 PHE 83 1HD PHE 83 8.390 -4.618 1.324 478 HD2 PHE 83 2HD PHE 83 9.141 -1.082 3.640 479 HE1 PHE 83 1HE PHE 83 10.627 -4.383 0.248 480 HE2 PHE 83 2HE PHE 83 11.399 -0.866 2.591 481 HZ PHE 83 HZ PHE 83 12.113 -2.508 0.887 482 H PHE 84 H PHE 84 4.490 -4.484 2.285 483 HA PHE 84 HA PHE 84 3.223 -3.926 4.790 484 HB2 PHE 84 1HB PHE 84 0.903 -3.949 4.146 485 HB3 PHE 84 2HB PHE 84 1.661 -2.612 3.332 486 HD1 PHE 84 1HD PHE 84 1.979 -2.737 0.725 487 HD2 PHE 84 2HD PHE 84 -0.063 -5.817 3.005 488 HE1 PHE 84 1HE PHE 84 1.100 -3.692 -1.330 489 HE2 PHE 84 2HE PHE 84 -0.993 -6.721 0.899 490 HZ PHE 84 HZ PHE 84 -0.428 -5.660 -1.253 491 H LYS 85 H LYS 85 1.874 -5.846 5.497 492 HA LYS 85 HA LYS 85 1.579 -7.982 3.539 493 HB2 LYS 85 1HB LYS 85 3.751 -8.366 5.027 494 HB3 LYS 85 2HB LYS 85 2.537 -9.009 6.144 495 HG2 LYS 85 1HG LYS 85 1.630 -10.180 3.932 496 HG3 LYS 85 2HG LYS 85 3.257 -9.836 3.303 497 HD2 LYS 85 1HD LYS 85 4.236 -11.194 5.085 498 HD3 LYS 85 2HD LYS 85 2.613 -11.254 5.859 499 HE2 LYS 85 1HE LYS 85 1.693 -12.420 3.900 500 HE3 LYS 85 2HE LYS 85 3.262 -12.400 3.091 501 HZ1 LYS 85 3HZ LYS 85 4.002 -14.070 4.429 502 HZ2 LYS 85 1HZ LYS 85 2.383 -14.420 4.461 503 HZ3 LYS 85 2HZ LYS 85 3.046 -13.665 5.727 504 H ALA 86 H ALA 86 -0.393 -8.945 3.837 505 HA ALA 86 HA ALA 86 -1.996 -8.246 6.207 506 HB1 ALA 86 1HB ALA 86 -3.141 -8.505 4.028 507 HB2 ALA 86 2HB ALA 86 -2.585 -10.192 3.927 508 HB3 ALA 86 3HB ALA 86 -3.714 -9.695 5.208 509 H GLU 87 H GLU 87 -2.490 -9.740 7.817 510 HA GLU 87 HA GLU 87 -1.025 -12.345 7.964 511 HB2 GLU 87 1HB GLU 87 -0.891 -9.901 9.690 512 HB3 GLU 87 2HB GLU 87 -0.953 -11.416 10.556 513 HG2 GLU 87 1HG GLU 87 1.069 -10.822 8.344 514 HG3 GLU 87 2HG GLU 87 1.351 -10.549 10.074 515 H GLY 88 H GLY 88 -3.987 -11.359 7.581 516 HA2 GLY 88 1HA GLY 88 -5.883 -12.824 7.995 517 HA3 GLY 88 2HA GLY 88 -5.184 -13.286 9.557 518 H GLN 89 H GLN 89 -7.253 -11.154 7.941 519 HA GLN 89 HA GLN 89 -8.256 -9.170 8.303 520 HB2 GLN 89 1HB GLN 89 -8.516 -10.399 11.039 521 HB3 GLN 89 2HB GLN 89 -9.392 -8.950 10.542 522 HG2 GLN 89 1HG GLN 89 -9.613 -11.699 9.318 523 HG3 GLN 89 2HG GLN 89 -10.821 -10.884 10.316 524 HE21 GLN 89 1HE2 GLN 89 -11.148 -11.941 7.599 525 HE22 GLN 89 2HE2 GLN 89 -11.532 -10.579 6.539 526 H THR 90 H THR 90 -5.180 -9.174 9.039 527 HA THR 90 HA THR 90 -5.209 -6.448 10.151 528 HB THR 90 HB THR 90 -3.169 -8.456 11.107 529 HG1 THR 90 1HG THR 90 -5.067 -9.506 11.562 530 HG21 THR 90 3HG2 THR 90 -2.922 -6.054 11.690 531 HG22 THR 90 1HG2 THR 90 -3.225 -7.033 13.131 532 HG23 THR 90 2HG2 THR 90 -4.536 -6.064 12.435 533 H VAL 91 H VAL 91 -3.412 -5.198 9.422 534 HA VAL 91 HA VAL 91 -1.608 -6.441 7.432 535 HB VAL 91 HB VAL 91 -3.100 -3.804 7.090 536 HG11 VAL 91 1HG1 VAL 91 -2.056 -3.758 4.835 537 HG12 VAL 91 2HG1 VAL 91 -0.821 -3.729 6.097 538 HG13 VAL 91 3HG1 VAL 91 -1.150 -5.236 5.220 539 HG21 VAL 91 3HG2 VAL 91 -3.352 -6.353 5.458 540 HG22 VAL 91 1HG2 VAL 91 -4.562 -5.763 6.631 541 HG23 VAL 91 2HG2 VAL 91 -4.191 -4.804 5.204 542 H ILE 92 H ILE 92 0.426 -6.156 8.260 543 HA ILE 92 HA ILE 92 1.077 -3.832 9.905 544 HB ILE 92 HB ILE 92 2.908 -5.999 8.775 545 HG12 ILE 92 1HG1 ILE 92 2.922 -6.787 11.202 546 HG13 ILE 92 2HG1 ILE 92 1.430 -5.887 11.456 547 HG21 ILE 92 1HG2 ILE 92 3.252 -4.081 11.143 548 HG22 ILE 92 2HG2 ILE 92 4.470 -5.189 10.478 549 HG23 ILE 92 3HG2 ILE 92 3.926 -3.788 9.538 550 HD11 ILE 92 3HD1 ILE 92 0.263 -7.407 9.952 551 HD12 ILE 92 1HD1 ILE 92 1.814 -8.089 9.378 552 HD13 ILE 92 2HD1 ILE 92 1.251 -8.373 11.042 553 H ILE 93 H ILE 93 1.022 -2.010 8.692 554 HA ILE 93 HA ILE 93 2.086 -1.892 5.952 555 HB ILE 93 HB ILE 93 1.249 0.537 7.550 556 HG12 ILE 93 1HG1 ILE 93 -0.694 -1.302 6.092 557 HG13 ILE 93 2HG1 ILE 93 -0.702 -0.925 7.831 558 HG21 ILE 93 1HG2 ILE 93 0.873 1.429 5.287 559 HG22 ILE 93 2HG2 ILE 93 2.473 0.704 5.365 560 HG23 ILE 93 3HG2 ILE 93 1.144 -0.168 4.580 561 HD11 ILE 93 3HD1 ILE 93 -1.212 1.408 7.390 562 HD12 ILE 93 1HD1 ILE 93 -1.311 1.075 5.649 563 HD13 ILE 93 2HD1 ILE 93 -2.439 0.293 6.756 564 H LYS 94 H LYS 94 4.263 -1.746 5.767 565 HA LYS 94 HA LYS 94 5.868 -0.705 8.056 566 HB2 LYS 94 1HB LYS 94 6.547 -2.816 5.997 567 HB3 LYS 94 2HB LYS 94 7.686 -2.126 7.104 568 HG2 LYS 94 1HG LYS 94 6.172 -2.939 8.975 569 HG3 LYS 94 2HG LYS 94 5.303 -3.850 7.741 570 HD2 LYS 94 1HD LYS 94 6.840 -5.493 7.777 571 HD3 LYS 94 2HD LYS 94 8.153 -4.406 7.413 572 HE2 LYS 94 1HE LYS 94 8.433 -3.900 9.804 573 HE3 LYS 94 2HE LYS 94 6.876 -4.669 10.195 574 HZ1 LYS 94 3HZ LYS 94 7.710 -6.696 10.068 575 HZ2 LYS 94 1HZ LYS 94 9.055 -5.922 10.584 576 HZ3 LYS 94 2HZ LYS 94 8.909 -6.364 8.994 577 H TYR 95 H TYR 95 6.164 1.456 7.463 578 HA TYR 95 HA TYR 95 6.977 1.984 4.633 579 HB2 TYR 95 1HB TYR 95 5.732 4.066 4.803 580 HB3 TYR 95 2HB TYR 95 4.715 2.650 4.996 581 HD1 TYR 95 2HD TYR 95 3.723 2.011 7.087 582 HD2 TYR 95 1HD TYR 95 6.003 5.656 6.755 583 HE1 TYR 95 2HE TYR 95 2.824 2.775 9.221 584 HE2 TYR 95 1HE TYR 95 5.082 6.423 8.938 585 HH TYR 95 HH TYR 95 3.253 6.011 10.545 586 H THR 96 H THR 96 7.989 4.378 4.459 587 HA THR 96 HA THR 96 9.521 5.250 6.698 588 HB THR 96 HB THR 96 10.790 3.192 6.382 589 HG1 THR 96 1HG THR 96 12.345 4.669 6.455 590 HG21 THR 96 3HG2 THR 96 10.458 3.712 3.410 591 HG22 THR 96 1HG2 THR 96 10.020 2.299 4.345 592 HG23 THR 96 2HG2 THR 96 11.725 2.623 4.070 593 H SER 97 H SER 97 11.006 7.038 5.811 594 HA SER 97 HA SER 97 9.896 8.440 3.529 595 HB2 SER 97 1HB SER 97 12.324 9.602 4.220 596 HB3 SER 97 2HB SER 97 10.762 10.100 4.787 597 HG SER 97 HG SER 97 12.438 9.725 6.360 598 H GLN 98 H GLN 98 12.038 5.930 3.956 599 HA GLN 98 HA GLN 98 13.658 6.623 1.560 600 HB2 GLN 98 1HB GLN 98 14.469 6.817 4.281 601 HB3 GLN 98 2HB GLN 98 15.251 5.358 3.673 602 HG2 GLN 98 1HG GLN 98 16.127 6.613 1.745 603 HG3 GLN 98 2HG GLN 98 15.325 8.103 2.362 604 HE21 GLN 98 1HE2 GLN 98 18.270 7.338 1.902 605 HE22 GLN 98 2HE2 GLN 98 19.057 7.482 3.471 606 H ARG 99 H ARG 99 15.362 4.513 1.398 607 HA ARG 99 HA ARG 99 13.563 2.237 0.931 608 HB2 ARG 99 1HB ARG 99 15.316 1.860 -0.984 609 HB3 ARG 99 2HB ARG 99 13.966 2.950 -1.074 610 HG2 ARG 99 1HG ARG 99 16.570 4.092 -0.166 611 HG3 ARG 99 2HG ARG 99 16.397 3.648 -1.880 612 HD2 ARG 99 1HD ARG 99 14.619 5.074 -2.262 613 HD3 ARG 99 2HD ARG 99 14.099 5.141 -0.624 614 HE ARG 99 HE ARG 99 16.754 6.336 -1.052 615 HH11 ARG 99 1HH1 ARG 99 13.286 7.098 -1.201 616 HH12 ARG 99 2HH1 ARG 99 13.549 8.782 -0.969 617 HH21 ARG 99 1HH2 ARG 99 17.025 8.574 -0.750 618 HH22 ARG 99 2HH2 ARG 99 15.631 9.589 -0.453 619 H ASN 100 H ASN 100 16.980 2.758 1.272 620 HA ASN 100 HA ASN 100 17.263 0.158 2.450 621 HB2 ASN 100 1HB ASN 100 19.725 0.732 2.680 622 HB3 ASN 100 2HB ASN 100 19.042 0.576 1.097 623 HD21 ASN 100 1HD2 ASN 100 18.621 2.368 -0.089 624 HD22 ASN 100 2HD2 ASN 100 19.643 3.789 -0.015 625 H THR 101 H THR 101 15.573 1.255 4.292 626 HA THR 101 HA THR 101 17.290 1.617 6.636 627 HB THR 101 HB THR 101 15.972 3.515 7.508 628 HG1 THR 101 1HG THR 101 14.858 3.403 4.929 629 HG21 THR 101 3HG2 THR 101 16.950 5.336 6.252 630 HG22 THR 101 1HG2 THR 101 17.296 4.269 4.882 631 HG23 THR 101 2HG2 THR 101 18.135 4.038 6.416 632 H LYS 102 H LYS 102 16.082 1.327 8.673 633 HA LYS 102 HA LYS 102 14.132 -0.711 8.491 634 HB2 LYS 102 1HB LYS 102 15.805 -0.048 10.433 635 HB3 LYS 102 2HB LYS 102 14.506 1.012 10.975 636 HG2 LYS 102 1HG LYS 102 14.379 -1.090 12.173 637 HG3 LYS 102 2HG LYS 102 12.999 -0.987 11.089 638 HD2 LYS 102 1HD LYS 102 15.045 -2.288 9.587 639 HD3 LYS 102 2HD LYS 102 15.171 -2.973 11.185 640 HE2 LYS 102 1HE LYS 102 12.523 -2.770 9.656 641 HE3 LYS 102 2HE LYS 102 13.644 -4.144 9.507 642 HZ1 LYS 102 3HZ LYS 102 12.378 -3.290 12.042 643 HZ2 LYS 102 1HZ LYS 102 13.374 -4.569 11.866 644 HZ3 LYS 102 2HZ LYS 102 11.933 -4.591 11.133 645 H LEU 103 H LEU 103 11.904 -0.595 9.595 646 HA LEU 103 HA LEU 103 10.455 1.554 8.135 647 HB2 LEU 103 1HB LEU 103 9.590 -1.251 8.833 648 HB3 LEU 103 2HB LEU 103 8.730 -0.166 7.769 649 HG LEU 103 HG LEU 103 9.614 -1.705 6.336 650 HD11 LEU 103 1HD1 LEU 103 10.135 0.474 5.515 651 HD12 LEU 103 2HD1 LEU 103 11.370 -0.685 5.006 652 HD13 LEU 103 3HD1 LEU 103 11.731 0.459 6.305 653 HD21 LEU 103 3HD2 LEU 103 11.531 -2.932 6.475 654 HD22 LEU 103 1HD2 LEU 103 11.051 -2.787 8.140 655 HD23 LEU 103 2HD2 LEU 103 12.369 -1.759 7.511 656 H LYS 104 H LYS 104 8.339 2.104 8.976 657 HA LYS 104 HA LYS 104 7.947 1.977 11.910 658 HB2 LYS 104 1HB LYS 104 6.189 3.022 9.639 659 HB3 LYS 104 2HB LYS 104 5.726 3.035 11.335 660 HG2 LYS 104 1HG LYS 104 6.453 5.189 11.009 661 HG3 LYS 104 2HG LYS 104 7.827 4.428 11.808 662 HD2 LYS 104 1HD LYS 104 9.037 4.299 9.673 663 HD3 LYS 104 2HD LYS 104 7.585 4.759 8.786 664 HE2 LYS 104 1HE LYS 104 9.062 6.635 8.871 665 HE3 LYS 104 2HE LYS 104 7.632 7.000 9.845 666 HZ1 LYS 104 3HZ LYS 104 8.878 6.704 11.809 667 HZ2 LYS 104 1HZ LYS 104 9.861 7.570 10.809 668 HZ3 LYS 104 2HZ LYS 104 10.124 5.970 11.040 669 H ALA 105 H ALA 105 5.511 1.194 12.502 670 HA ALA 105 HA ALA 105 4.965 -1.423 11.222 671 HB1 ALA 105 1HB ALA 105 5.657 -0.972 14.162 672 HB2 ALA 105 2HB ALA 105 5.181 -2.510 13.420 673 HB3 ALA 105 3HB ALA 105 6.703 -1.752 12.952 674 H LYS 106 H LYS 106 3.241 0.421 10.711 675 HA LYS 106 HA LYS 106 1.124 0.857 12.691 676 HB2 LYS 106 1HB LYS 106 1.654 2.453 10.913 677 HB3 LYS 106 2HB LYS 106 1.466 1.185 9.693 678 HG2 LYS 106 1HG LYS 106 -0.316 2.468 9.309 679 HG3 LYS 106 2HG LYS 106 -1.027 1.207 10.293 680 HD2 LYS 106 1HD LYS 106 -1.327 2.681 12.106 681 HD3 LYS 106 2HD LYS 106 -0.051 3.796 11.574 682 HE2 LYS 106 1HE LYS 106 -1.481 4.486 9.649 683 HE3 LYS 106 2HE LYS 106 -2.765 3.421 10.252 684 HZ1 LYS 106 3HZ LYS 106 -3.155 5.671 10.955 685 HZ2 LYS 106 1HZ LYS 106 -1.681 5.765 11.673 686 HZ3 LYS 106 2HZ LYS 106 -2.861 4.790 12.276 687 H ALA 107 H ALA 107 -0.359 -0.777 13.148 688 HA ALA 107 HA ALA 107 -0.691 -3.012 11.204 689 HB1 ALA 107 1HB ALA 107 -0.263 -3.292 14.190 690 HB2 ALA 107 2HB ALA 107 -1.027 -4.542 13.183 691 HB3 ALA 107 3HB ALA 107 0.628 -4.060 12.836 692 H LEU 108 H LEU 108 -2.540 -2.281 10.393 693 HA LEU 108 HA LEU 108 -4.795 -1.493 12.202 694 HB2 LEU 108 1HB LEU 108 -4.187 -1.167 9.246 695 HB3 LEU 108 2HB LEU 108 -5.817 -0.986 9.855 696 HG LEU 108 HG LEU 108 -5.554 1.079 10.554 697 HD11 LEU 108 1HD1 LEU 108 -4.173 0.577 12.534 698 HD12 LEU 108 2HD1 LEU 108 -3.668 2.060 11.754 699 HD13 LEU 108 3HD1 LEU 108 -2.715 0.568 11.539 700 HD21 LEU 108 3HD2 LEU 108 -4.552 1.026 8.279 701 HD22 LEU 108 1HD2 LEU 108 -2.932 0.908 9.003 702 HD23 LEU 108 2HD2 LEU 108 -3.970 2.360 9.239 703 H THR 109 H THR 109 -6.884 -2.467 11.712 704 HA THR 109 HA THR 109 -6.666 -5.246 10.829 705 HB THR 109 HB THR 109 -9.086 -5.381 11.182 706 HG1 THR 109 1HG THR 109 -8.947 -2.788 12.303 707 HG21 THR 109 3HG2 THR 109 -7.444 -5.796 13.012 708 HG22 THR 109 1HG2 THR 109 -9.018 -5.239 13.602 709 HG23 THR 109 2HG2 THR 109 -7.631 -4.124 13.558 710 H LEU 110 H LEU 110 -7.779 -6.091 8.889 711 HA LEU 110 HA LEU 110 -7.737 -4.482 6.496 712 HB2 LEU 110 1HB LEU 110 -9.148 -7.071 7.345 713 HB3 LEU 110 2HB LEU 110 -9.415 -6.367 5.768 714 HG LEU 110 HG LEU 110 -6.714 -7.322 6.788 715 HD11 LEU 110 1HD1 LEU 110 -6.970 -9.202 5.302 716 HD12 LEU 110 2HD1 LEU 110 -8.435 -8.533 4.579 717 HD13 LEU 110 3HD1 LEU 110 -8.482 -9.140 6.236 718 HD21 LEU 110 3HD2 LEU 110 -6.526 -5.490 5.100 719 HD22 LEU 110 1HD2 LEU 110 -7.651 -6.360 4.045 720 HD23 LEU 110 2HD2 LEU 110 -6.045 -7.036 4.405 721 H SER 111 H SER 111 -10.154 -5.274 8.929 722 HA SER 111 HA SER 111 -12.390 -4.140 7.645 723 HB2 SER 111 1HB SER 111 -12.255 -5.806 9.583 724 HB3 SER 111 2HB SER 111 -11.902 -4.427 10.631 725 HG SER 111 HG SER 111 -13.888 -3.878 10.579 726 H GLN 112 H GLN 112 -9.850 -2.668 9.757 727 HA GLN 112 HA GLN 112 -10.922 -0.090 10.036 728 HB2 GLN 112 1HB GLN 112 -8.349 -1.344 10.404 729 HB3 GLN 112 2HB GLN 112 -8.109 0.159 9.539 730 HG2 GLN 112 1HG GLN 112 -8.467 1.388 11.363 731 HG3 GLN 112 2HG GLN 112 -9.959 0.541 11.775 732 HE21 GLN 112 1HE2 GLN 112 -9.921 -0.961 13.340 733 HE22 GLN 112 2HE2 GLN 112 -8.514 -1.484 14.214 734 H LEU 113 H LEU 113 -8.488 -1.174 7.589 735 HA LEU 113 HA LEU 113 -8.548 1.147 6.092 736 HB2 LEU 113 1HB LEU 113 -7.941 -1.709 5.234 737 HB3 LEU 113 2HB LEU 113 -7.836 -0.373 4.128 738 HG LEU 113 HG LEU 113 -5.657 -0.754 4.809 739 HD11 LEU 113 1HD1 LEU 113 -6.453 1.602 6.554 740 HD12 LEU 113 2HD1 LEU 113 -6.263 1.664 4.787 741 HD13 LEU 113 3HD1 LEU 113 -4.882 1.277 5.811 742 HD21 LEU 113 3HD2 LEU 113 -6.153 -2.141 6.772 743 HD22 LEU 113 1HD2 LEU 113 -6.450 -0.658 7.709 744 HD23 LEU 113 2HD2 LEU 113 -4.840 -0.988 7.027 745 H LYS 114 H LYS 114 -10.788 -1.572 5.765 746 HA LYS 114 HA LYS 114 -12.046 -0.576 3.369 747 HB2 LYS 114 1HB LYS 114 -12.378 -2.863 4.139 748 HB3 LYS 114 2HB LYS 114 -13.176 -2.327 5.616 749 HG2 LYS 114 1HG LYS 114 -14.252 -1.527 2.878 750 HG3 LYS 114 2HG LYS 114 -14.570 -3.106 3.549 751 HD2 LYS 114 1HD LYS 114 -15.608 -2.143 5.522 752 HD3 LYS 114 2HD LYS 114 -15.472 -0.518 4.833 753 HE2 LYS 114 1HE LYS 114 -16.980 -2.821 3.560 754 HE3 LYS 114 2HE LYS 114 -17.699 -1.539 4.544 755 HZ1 LYS 114 3HZ LYS 114 -16.792 -1.432 1.817 756 HZ2 LYS 114 1HZ LYS 114 -16.544 -0.043 2.689 757 HZ3 LYS 114 2HZ LYS 114 -18.041 -0.716 2.543 758 H LYS 115 H LYS 115 -12.893 -0.146 6.890 759 HA LYS 115 HA LYS 115 -15.248 1.345 6.171 760 HB2 LYS 115 1HB LYS 115 -14.529 -0.072 8.377 761 HB3 LYS 115 2HB LYS 115 -14.014 1.539 8.863 762 HG2 LYS 115 1HG LYS 115 -16.136 1.858 9.551 763 HG3 LYS 115 2HG LYS 115 -16.535 2.038 7.864 764 HD2 LYS 115 1HD LYS 115 -16.699 -0.519 9.515 765 HD3 LYS 115 2HD LYS 115 -18.050 0.513 9.058 766 HE2 LYS 115 1HE LYS 115 -17.521 -0.017 6.611 767 HE3 LYS 115 2HE LYS 115 -16.356 -1.214 7.189 768 HZ1 LYS 115 3HZ LYS 115 -19.287 -1.218 7.512 769 HZ2 LYS 115 1HZ LYS 115 -18.360 -2.080 8.531 770 HZ3 LYS 115 2HZ LYS 115 -18.319 -2.424 6.936 771 H GLU 116 H GLU 116 -11.943 2.131 6.941 772 HA GLU 116 HA GLU 116 -12.049 4.963 7.117 773 HB2 GLU 116 1HB GLU 116 -9.934 2.992 6.160 774 HB3 GLU 116 2HB GLU 116 -9.590 4.671 6.475 775 HG2 GLU 116 1HG GLU 116 -10.742 2.956 8.699 776 HG3 GLU 116 2HG GLU 116 -9.062 2.755 8.216 777 H PHE 117 H PHE 117 -10.526 3.295 4.334 778 HA PHE 117 HA PHE 117 -11.140 5.635 2.767 779 HB2 PHE 117 1HB PHE 117 -9.454 3.149 2.398 780 HB3 PHE 117 2HB PHE 117 -9.602 4.353 1.122 781 HD1 PHE 117 1HD PHE 117 -9.065 6.837 1.731 782 HD2 PHE 117 2HD PHE 117 -7.779 3.410 4.033 783 HE1 PHE 117 1HE PHE 117 -7.349 8.232 2.843 784 HE2 PHE 117 2HE PHE 117 -6.147 4.861 5.224 785 HZ PHE 117 HZ PHE 117 -5.904 7.259 4.591 786 H TYR 118 H TYR 118 -12.673 2.547 2.945 787 HA TYR 118 HA TYR 118 -13.503 2.677 0.092 788 HB2 TYR 118 1HB TYR 118 -12.005 0.745 1.084 789 HB3 TYR 118 2HB TYR 118 -13.488 0.208 1.778 790 HD1 TYR 118 1HD TYR 118 -12.430 1.485 -1.667 791 HD2 TYR 118 2HD TYR 118 -14.465 -1.538 0.663 792 HE1 TYR 118 1HE TYR 118 -12.828 0.150 -3.746 793 HE2 TYR 118 2HE TYR 118 -14.838 -2.846 -1.345 794 HH TYR 118 HH TYR 118 -13.565 -2.090 -4.497 795 H GLN 119 H GLN 119 -14.884 4.278 1.819 796 HA GLN 119 HA GLN 119 -16.906 2.821 3.158 797 HB2 GLN 119 1HB GLN 119 -17.621 4.887 4.090 798 HB3 GLN 119 2HB GLN 119 -15.876 4.763 4.093 799 HG2 GLN 119 1HG GLN 119 -17.525 6.517 2.258 800 HG3 GLN 119 2HG GLN 119 -16.636 7.032 3.678 801 HE21 GLN 119 1HE2 GLN 119 -13.996 5.883 3.382 802 HE22 GLN 119 2HE2 GLN 119 -13.431 6.393 1.806 803 H THR 120 H THR 120 -17.126 4.641 0.115 804 HA THR 120 HA THR 120 -20.062 4.199 0.100 805 HB THR 120 HB THR 120 -19.838 6.386 -0.056 806 HG1 THR 120 1HG THR 120 -19.677 6.944 -2.497 807 HG21 THR 120 3HG2 THR 120 -17.497 6.674 -0.034 808 HG22 THR 120 1HG2 THR 120 -18.209 7.749 -1.230 809 HG23 THR 120 2HG2 THR 120 -17.355 6.294 -1.760 810 H ARG 121 H ARG 121 -20.440 4.383 -2.652 811 HA ARG 121 HA ARG 121 -19.237 1.894 -3.793 812 HB2 ARG 121 1HB ARG 121 -21.075 2.371 -5.606 813 HB3 ARG 121 2HB ARG 121 -21.510 1.488 -4.160 814 HG2 ARG 121 1HG ARG 121 -21.881 4.491 -4.155 815 HG3 ARG 121 2HG ARG 121 -22.943 3.540 -5.172 816 HD2 ARG 121 1HD ARG 121 -22.546 2.798 -2.247 817 HD3 ARG 121 2HD ARG 121 -23.715 4.025 -2.729 818 HE ARG 121 HE ARG 121 -23.903 1.153 -3.126 819 HH11 ARG 121 1HH1 ARG 121 -25.228 4.337 -4.131 820 HH12 ARG 121 2HH1 ARG 121 -26.518 3.577 -5.031 821 HH21 ARG 121 1HH2 ARG 121 -25.661 0.287 -4.294 822 HH22 ARG 121 2HH2 ARG 121 -26.812 1.367 -5.065 823 H SER 122 H SER 122 -19.424 5.415 -3.993 824 HA SER 122 HA SER 122 -18.647 5.547 -6.798 825 HB2 SER 122 1HB SER 122 -18.594 7.970 -6.185 826 HB3 SER 122 2HB SER 122 -20.123 7.158 -5.813 827 HG SER 122 HG SER 122 -18.588 8.562 -4.220 828 H GLN 123 H GLN 123 -16.865 5.480 -3.644 829 HA GLN 123 HA GLN 123 -14.481 6.605 -4.786 830 HB2 GLN 123 1HB GLN 123 -13.316 5.963 -2.907 831 HB3 GLN 123 2HB GLN 123 -14.925 6.170 -2.253 832 HG2 GLN 123 1HG GLN 123 -13.594 3.485 -2.977 833 HG3 GLN 123 2HG GLN 123 -13.653 4.177 -1.389 834 HE21 GLN 123 1HE2 GLN 123 -14.793 1.675 -1.388 835 HE22 GLN 123 2HE2 GLN 123 -16.530 1.981 -1.258 836 H LYS 124 H LYS 124 -15.960 3.468 -4.914 837 HA LYS 124 HA LYS 124 -13.775 1.802 -5.559 838 HB2 LYS 124 1HB LYS 124 -16.496 1.622 -6.895 839 HB3 LYS 124 2HB LYS 124 -15.313 0.333 -6.695 840 HG2 LYS 124 1HG LYS 124 -15.692 0.471 -4.183 841 HG3 LYS 124 2HG LYS 124 -16.963 1.647 -4.491 842 HD2 LYS 124 1HD LYS 124 -18.250 -0.323 -4.500 843 HD3 LYS 124 2HD LYS 124 -17.852 -0.206 -6.216 844 HE2 LYS 124 1HE LYS 124 -15.644 -1.516 -5.346 845 HE3 LYS 124 2HE LYS 124 -16.754 -2.029 -4.075 846 HZ1 LYS 124 3HZ LYS 124 -18.218 -2.778 -5.995 847 HZ2 LYS 124 1HZ LYS 124 -16.775 -3.598 -5.835 848 HZ3 LYS 124 2HZ LYS 124 -16.889 -2.487 -6.972 849 H ARG 125 H ARG 125 -15.458 4.213 -7.538 850 HA ARG 125 HA ARG 125 -14.527 3.253 -10.055 851 HB2 ARG 125 1HB ARG 125 -16.001 5.568 -8.969 852 HB3 ARG 125 2HB ARG 125 -14.779 6.136 -10.054 853 HG2 ARG 125 1HG ARG 125 -16.796 5.867 -11.159 854 HG3 ARG 125 2HG ARG 125 -15.586 4.698 -11.798 855 HD2 ARG 125 1HD ARG 125 -16.926 2.929 -11.244 856 HD3 ARG 125 2HD ARG 125 -17.228 3.553 -9.618 857 HE ARG 125 HE ARG 125 -18.922 3.809 -11.958 858 HH11 ARG 125 1HH1 ARG 125 -17.974 5.814 -9.190 859 HH12 ARG 125 2HH1 ARG 125 -19.460 6.701 -9.289 860 HH21 ARG 125 1HH2 ARG 125 -20.944 4.854 -11.796 861 HH22 ARG 125 2HH2 ARG 125 -21.225 6.002 -10.539 862 H GLU 126 H GLU 126 -12.885 5.118 -7.532 863 HA GLU 126 HA GLU 126 -10.658 5.536 -9.402 864 HB2 GLU 126 1HB GLU 126 -11.197 6.488 -6.531 865 HB3 GLU 126 2HB GLU 126 -9.708 6.774 -7.423 866 HG2 GLU 126 1HG GLU 126 -10.941 8.735 -7.639 867 HG3 GLU 126 2HG GLU 126 -10.998 7.892 -9.204 868 H VAL 127 H VAL 127 -11.362 4.217 -6.155 869 HA VAL 127 HA VAL 127 -8.785 3.161 -5.667 870 HB VAL 127 HB VAL 127 -11.396 1.952 -4.679 871 HG11 VAL 127 1HG1 VAL 127 -10.105 1.149 -2.776 872 HG12 VAL 127 2HG1 VAL 127 -9.279 0.605 -4.228 873 HG13 VAL 127 3HG1 VAL 127 -8.638 1.985 -3.335 874 HG21 VAL 127 3HG2 VAL 127 -11.050 3.434 -2.648 875 HG22 VAL 127 1HG2 VAL 127 -9.660 4.187 -3.454 876 HG23 VAL 127 2HG2 VAL 127 -11.279 4.415 -4.096 877 H ASP 128 H ASP 128 -11.618 1.385 -7.096 878 HA ASP 128 HA ASP 128 -10.214 -1.028 -7.615 879 HB2 ASP 128 1HB ASP 128 -12.748 -0.364 -7.758 880 HB3 ASP 128 2HB ASP 128 -12.386 0.072 -9.429 881 H ASP 129 H ASP 129 -10.435 2.021 -9.395 882 HA ASP 129 HA ASP 129 -9.238 1.125 -11.867 883 HB2 ASP 129 1HB ASP 129 -10.477 3.134 -12.048 884 HB3 ASP 129 2HB ASP 129 -9.754 3.830 -10.634 885 H TYR 130 H TYR 130 -7.944 2.639 -8.844 886 HA TYR 130 HA TYR 130 -5.265 2.827 -9.627 887 HB2 TYR 130 1HB TYR 130 -6.236 2.063 -6.860 888 HB3 TYR 130 2HB TYR 130 -4.701 2.768 -7.270 889 HD1 TYR 130 1HD TYR 130 -6.400 4.932 -9.211 890 HD2 TYR 130 2HD TYR 130 -6.318 3.728 -5.072 891 HE1 TYR 130 1HE TYR 130 -7.029 7.223 -8.525 892 HE2 TYR 130 2HE TYR 130 -7.207 5.936 -4.415 893 HH TYR 130 HH TYR 130 -8.333 7.801 -5.340 894 H VAL 131 H VAL 131 -7.062 0.006 -8.337 895 HA VAL 131 HA VAL 131 -4.720 -1.659 -8.077 896 HB VAL 131 HB VAL 131 -7.670 -2.388 -8.226 897 HG11 VAL 131 1HG1 VAL 131 -6.419 -4.389 -8.787 898 HG12 VAL 131 2HG1 VAL 131 -5.203 -4.051 -7.545 899 HG13 VAL 131 3HG1 VAL 131 -6.845 -4.531 -7.082 900 HG21 VAL 131 3HG2 VAL 131 -7.591 -2.567 -5.836 901 HG22 VAL 131 1HG2 VAL 131 -5.837 -2.282 -5.813 902 HG23 VAL 131 2HG2 VAL 131 -6.963 -0.978 -6.244 903 H ALA 132 H ALA 132 -6.918 -0.988 -10.809 904 HA ALA 132 HA ALA 132 -5.578 -3.079 -12.433 905 HB1 ALA 132 1HB ALA 132 -7.912 -2.933 -12.822 906 HB2 ALA 132 2HB ALA 132 -7.864 -1.163 -12.978 907 HB3 ALA 132 3HB ALA 132 -7.123 -2.198 -14.227 908 H GLY 133 H GLY 133 -5.204 0.280 -11.679 909 HA2 GLY 133 1HA GLY 133 -3.829 1.102 -14.081 910 HA3 GLY 133 2HA GLY 133 -3.972 1.967 -12.550 911 H LEU 134 H LEU 134 -2.870 0.249 -10.734 912 HA LEU 134 HA LEU 134 -0.095 0.664 -11.050 913 HB2 LEU 134 1HB LEU 134 0.252 -0.626 -9.057 914 HB3 LEU 134 2HB LEU 134 -1.152 0.401 -8.877 915 HG LEU 134 HG LEU 134 -2.512 -1.758 -9.542 916 HD11 LEU 134 1HD1 LEU 134 -0.691 -3.334 -10.059 917 HD12 LEU 134 2HD1 LEU 134 -1.454 -3.841 -8.566 918 HD13 LEU 134 3HD1 LEU 134 0.091 -2.962 -8.525 919 HD21 LEU 134 3HD2 LEU 134 -2.624 -0.637 -7.358 920 HD22 LEU 134 1HD2 LEU 134 -1.158 -1.498 -6.831 921 HD23 LEU 134 2HD2 LEU 134 -2.659 -2.391 -7.169 922 H ARG 135 H ARG 135 1.570 -0.585 -11.601 923 HA ARG 135 HA ARG 135 1.121 -2.884 -13.407 924 HB2 ARG 135 1HB ARG 135 3.391 -0.960 -12.697 925 HB3 ARG 135 2HB ARG 135 3.788 -2.538 -13.317 926 HG2 ARG 135 1HG ARG 135 3.587 -1.686 -15.355 927 HG3 ARG 135 2HG ARG 135 1.856 -1.794 -15.113 928 HD2 ARG 135 1HD ARG 135 1.821 0.566 -14.279 929 HD3 ARG 135 2HD ARG 135 3.557 0.655 -14.553 930 HE ARG 135 HE ARG 135 1.430 0.674 -16.553 931 HH11 ARG 135 1HH1 ARG 135 4.959 0.186 -16.071 932 HH12 ARG 135 2HH1 ARG 135 5.285 0.320 -17.772 933 HH21 ARG 135 1HH2 ARG 135 1.914 0.607 -18.769 934 HH22 ARG 135 2HH2 ARG 135 3.579 0.564 -19.301 935 H THR 136 H THR 136 2.681 -4.739 -13.128 936 HA THR 136 HA THR 136 3.246 -5.308 -10.272 937 HB THR 136 HB THR 136 3.214 -7.757 -11.522 938 HG1 THR 136 1HG THR 136 0.918 -6.371 -12.515 939 HG21 THR 136 3HG2 THR 136 2.113 -7.305 -9.454 940 HG22 THR 136 1HG2 THR 136 0.927 -8.029 -10.544 941 HG23 THR 136 2HG2 THR 136 0.901 -6.271 -10.228 942 H GLU 137 H GLU 137 4.577 -4.466 -13.030 943 HA GLU 137 HA GLU 137 7.290 -4.718 -12.285 944 HB2 GLU 137 1HB GLU 137 8.116 -6.001 -14.210 945 HB3 GLU 137 2HB GLU 137 7.108 -7.014 -13.175 946 HG2 GLU 137 1HG GLU 137 5.202 -6.739 -14.764 947 HG3 GLU 137 2HG GLU 137 6.227 -5.755 -15.816 Start of MODEL 9 1 H1 GLY 19 H GLY 19 -4.454 -13.358 6.078 2 HA2 GLY 19 1HA GLY 19 -6.776 -13.352 6.853 3 HA3 GLY 19 2HA GLY 19 -7.209 -12.509 5.351 4 H HIS 20 H HIS 20 -8.727 -14.476 5.253 5 HA HIS 20 HA HIS 20 -7.514 -16.506 3.552 6 HB2 HIS 20 1HB HIS 20 -9.329 -17.231 5.914 7 HB3 HIS 20 2HB HIS 20 -8.811 -18.323 4.633 8 HD1 HIS 20 1HD HIS 20 -5.632 -17.241 4.902 9 HD2 HIS 20 2HD HIS 20 -8.247 -18.855 7.757 10 HE1 HIS 20 1HE HIS 20 -4.168 -18.235 6.747 11 H MET 21 H MET 21 -8.788 -16.633 1.790 12 HA MET 21 HA MET 21 -10.294 -15.902 0.293 13 HB2 MET 21 1HB MET 21 -11.185 -18.029 1.158 14 HB3 MET 21 2HB MET 21 -12.193 -17.147 2.304 15 HG2 MET 21 1HG MET 21 -12.724 -16.025 -0.269 16 HG3 MET 21 2HG MET 21 -12.668 -17.767 -0.500 17 HE1 MET 21 3HE MET 21 -15.173 -17.309 -1.447 18 HE2 MET 21 1HE MET 21 -16.511 -16.718 -0.441 19 HE3 MET 21 2HE MET 21 -15.196 -15.613 -0.908 20 H LYS 22 H LYS 22 -9.538 -13.591 1.403 21 HA LYS 22 HA LYS 22 -12.062 -12.083 1.227 22 HB2 LYS 22 1HB LYS 22 -11.207 -12.731 3.722 23 HB3 LYS 22 2HB LYS 22 -10.190 -11.336 3.471 24 HG2 LYS 22 1HG LYS 22 -12.014 -10.458 4.551 25 HG3 LYS 22 2HG LYS 22 -12.420 -10.075 2.882 26 HD2 LYS 22 1HD LYS 22 -13.434 -12.658 4.129 27 HD3 LYS 22 2HD LYS 22 -14.171 -11.122 4.596 28 HE2 LYS 22 1HE LYS 22 -14.725 -10.640 2.237 29 HE3 LYS 22 2HE LYS 22 -14.015 -12.195 1.754 30 HZ1 LYS 22 3HZ LYS 22 -15.691 -13.341 2.956 31 HZ2 LYS 22 1HZ LYS 22 -16.458 -12.228 2.051 32 HZ3 LYS 22 2HZ LYS 22 -16.291 -11.957 3.642 33 H PHE 23 H PHE 23 -11.688 -10.684 -0.329 34 HA PHE 23 HA PHE 23 -10.964 -8.954 -1.511 35 HB2 PHE 23 1HB PHE 23 -9.027 -8.632 0.724 36 HB3 PHE 23 2HB PHE 23 -8.875 -7.659 -0.705 37 HD1 PHE 23 1HD PHE 23 -12.132 -8.629 0.999 38 HD2 PHE 23 2HD PHE 23 -9.298 -5.489 0.135 39 HE1 PHE 23 1HE PHE 23 -13.829 -6.976 1.481 40 HE2 PHE 23 2HE PHE 23 -10.970 -3.821 0.808 41 HZ PHE 23 HZ PHE 23 -13.266 -4.522 1.444 42 H THR 24 H THR 24 -8.587 -8.232 -2.642 43 HA THR 24 HA THR 24 -6.888 -10.596 -3.005 44 HB THR 24 HB THR 24 -6.520 -9.528 -5.375 45 HG1 THR 24 1HG THR 24 -8.502 -8.721 -6.217 46 HG21 THR 24 3HG2 THR 24 -9.047 -11.099 -4.732 47 HG22 THR 24 1HG2 THR 24 -7.425 -11.801 -4.921 48 HG23 THR 24 2HG2 THR 24 -8.206 -11.040 -6.311 49 H ASP 25 H ASP 25 -4.682 -10.059 -3.078 50 HA ASP 25 HA ASP 25 -3.932 -8.048 -1.346 51 HB2 ASP 25 1HB ASP 25 -2.265 -9.591 -3.346 52 HB3 ASP 25 2HB ASP 25 -1.633 -8.734 -1.930 53 H GLN 26 H GLN 26 -4.246 -7.957 -4.730 54 HA GLN 26 HA GLN 26 -2.853 -5.630 -5.567 55 HB2 GLN 26 1HB GLN 26 -5.580 -6.622 -6.459 56 HB3 GLN 26 2HB GLN 26 -4.436 -5.666 -7.405 57 HG2 GLN 26 1HG GLN 26 -3.194 -7.483 -8.007 58 HG3 GLN 26 2HG GLN 26 -3.358 -8.323 -6.531 59 HE21 GLN 26 1HE2 GLN 26 -5.731 -7.095 -9.046 60 HE22 GLN 26 2HE2 GLN 26 -6.451 -8.682 -9.297 61 H GLN 27 H GLN 27 -6.164 -6.093 -4.213 62 HA GLN 27 HA GLN 27 -6.974 -3.342 -4.335 63 HB2 GLN 27 1HB GLN 27 -8.031 -5.630 -2.641 64 HB3 GLN 27 2HB GLN 27 -8.879 -4.171 -2.992 65 HG2 GLN 27 1HG GLN 27 -8.024 -5.992 -5.281 66 HG3 GLN 27 2HG GLN 27 -9.364 -6.458 -4.261 67 HE21 GLN 27 1HE2 GLN 27 -8.990 -5.402 -7.228 68 HE22 GLN 27 2HE2 GLN 27 -10.258 -4.251 -7.423 69 H ILE 28 H ILE 28 -5.472 -5.400 -1.919 70 HA ILE 28 HA ILE 28 -5.949 -3.720 0.320 71 HB ILE 28 HB ILE 28 -3.894 -5.921 -0.131 72 HG12 ILE 28 1HG1 ILE 28 -6.608 -5.880 1.271 73 HG13 ILE 28 2HG1 ILE 28 -6.348 -6.501 -0.349 74 HG21 ILE 28 1HG2 ILE 28 -3.176 -4.507 1.784 75 HG22 ILE 28 2HG2 ILE 28 -4.786 -4.669 2.514 76 HG23 ILE 28 3HG2 ILE 28 -3.710 -6.080 2.326 77 HD11 ILE 28 3HD1 ILE 28 -5.399 -7.705 2.234 78 HD12 ILE 28 1HD1 ILE 28 -6.335 -8.423 0.901 79 HD13 ILE 28 2HD1 ILE 28 -4.608 -8.094 0.692 80 H GLY 29 H GLY 29 -3.051 -3.956 -1.819 81 HA2 GLY 29 1HA GLY 29 -1.441 -2.254 -0.216 82 HA3 GLY 29 2HA GLY 29 -1.207 -2.536 -1.948 83 H VAL 30 H VAL 30 -3.916 -1.481 -2.624 84 HA VAL 30 HA VAL 30 -3.329 1.319 -2.811 85 HB VAL 30 HB VAL 30 -5.875 -0.285 -3.288 86 HG11 VAL 30 1HG1 VAL 30 -6.464 2.082 -2.817 87 HG12 VAL 30 2HG1 VAL 30 -5.337 2.600 -4.093 88 HG13 VAL 30 3HG1 VAL 30 -6.770 1.615 -4.489 89 HG21 VAL 30 3HG2 VAL 30 -4.129 -0.881 -4.868 90 HG22 VAL 30 1HG2 VAL 30 -5.279 0.166 -5.703 91 HG23 VAL 30 2HG2 VAL 30 -3.734 0.832 -5.155 92 H LEU 31 H LEU 31 -5.698 -0.535 -0.857 93 HA LEU 31 HA LEU 31 -6.587 1.639 0.731 94 HB2 LEU 31 1HB LEU 31 -6.646 -1.350 0.836 95 HB3 LEU 31 2HB LEU 31 -6.799 -0.541 2.379 96 HG LEU 31 HG LEU 31 -8.802 0.542 1.816 97 HD11 LEU 31 1HD1 LEU 31 -8.389 1.356 -0.467 98 HD12 LEU 31 2HD1 LEU 31 -9.886 0.437 -0.415 99 HD13 LEU 31 3HD1 LEU 31 -8.406 -0.305 -1.090 100 HD21 LEU 31 3HD2 LEU 31 -9.015 -1.907 2.243 101 HD22 LEU 31 1HD2 LEU 31 -8.935 -2.199 0.494 102 HD23 LEU 31 2HD2 LEU 31 -10.295 -1.290 1.191 103 H ALA 32 H ALA 32 -3.782 -0.525 1.278 104 HA ALA 32 HA ALA 32 -3.134 0.610 3.852 105 HB1 ALA 32 1HB ALA 32 -1.465 -0.967 1.846 106 HB2 ALA 32 2HB ALA 32 -0.933 -0.529 3.478 107 HB3 ALA 32 3HB ALA 32 -2.332 -1.611 3.257 108 H GLY 33 H GLY 33 -1.960 1.299 0.495 109 HA2 GLY 33 1HA GLY 33 -0.049 3.274 1.403 110 HA3 GLY 33 2HA GLY 33 -0.535 2.946 -0.250 111 H LEU 34 H LEU 34 -3.506 3.379 0.586 112 HA LEU 34 HA LEU 34 -3.698 6.224 0.424 113 HB2 LEU 34 1HB LEU 34 -5.564 3.928 0.706 114 HB3 LEU 34 2HB LEU 34 -6.095 5.377 1.544 115 HG LEU 34 HG LEU 34 -5.845 6.731 -0.418 116 HD11 LEU 34 1HD1 LEU 34 -5.526 5.761 -2.677 117 HD12 LEU 34 2HD1 LEU 34 -5.193 4.179 -1.952 118 HD13 LEU 34 3HD1 LEU 34 -4.091 5.543 -1.681 119 HD21 LEU 34 3HD2 LEU 34 -8.003 5.693 0.034 120 HD22 LEU 34 1HD2 LEU 34 -7.525 4.214 -0.833 121 HD23 LEU 34 2HD2 LEU 34 -7.759 5.740 -1.717 122 H ALA 35 H ALA 35 -3.161 4.162 3.094 123 HA ALA 35 HA ALA 35 -3.810 6.236 5.115 124 HB1 ALA 35 1HB ALA 35 -4.296 3.904 5.704 125 HB2 ALA 35 2HB ALA 35 -2.598 3.454 5.438 126 HB3 ALA 35 3HB ALA 35 -3.012 4.545 6.750 127 H ILE 36 H ILE 36 -1.052 5.399 3.161 128 HA ILE 36 HA ILE 36 0.696 7.049 4.853 129 HB ILE 36 HB ILE 36 1.338 4.237 3.877 130 HG12 ILE 36 1HG1 ILE 36 2.416 4.220 6.263 131 HG13 ILE 36 2HG1 ILE 36 1.484 5.675 6.587 132 HG21 ILE 36 1HG2 ILE 36 3.299 6.398 4.770 133 HG22 ILE 36 2HG2 ILE 36 3.704 4.677 4.548 134 HG23 ILE 36 3HG2 ILE 36 3.245 5.643 3.172 135 HD11 ILE 36 3HD1 ILE 36 0.059 3.218 5.612 136 HD12 ILE 36 1HD1 ILE 36 0.664 3.279 7.290 137 HD13 ILE 36 2HD1 ILE 36 -0.489 4.487 6.727 138 H SER 37 H SER 37 0.515 8.755 3.487 139 HA SER 37 HA SER 37 0.701 10.092 1.782 140 HB2 SER 37 1HB SER 37 3.079 8.979 1.859 141 HB3 SER 37 2HB SER 37 2.613 8.363 0.257 142 HG SER 37 HG SER 37 3.252 10.908 1.118 143 HA PRO 38 HA PRO 38 -2.425 7.679 -0.690 144 HB2 PRO 38 1HB PRO 38 -4.318 9.745 -0.576 145 HB3 PRO 38 2HB PRO 38 -4.256 8.361 0.537 146 HG2 PRO 38 1HG PRO 38 -3.164 11.140 0.928 147 HG3 PRO 38 2HG PRO 38 -4.043 10.115 2.101 148 HD2 PRO 38 1HD PRO 38 -1.354 10.356 2.178 149 HD3 PRO 38 2HD PRO 38 -2.124 8.777 2.508 150 H GLU 39 H GLU 39 -1.547 11.163 -0.670 151 HA GLU 39 HA GLU 39 -2.142 11.739 -3.366 152 HB2 GLU 39 1HB GLU 39 -0.474 12.962 -1.206 153 HB3 GLU 39 2HB GLU 39 -0.052 13.389 -2.861 154 HG2 GLU 39 1HG GLU 39 -1.571 15.014 -2.068 155 HG3 GLU 39 2HG GLU 39 -2.360 14.074 -3.337 156 H TRP 40 H TRP 40 0.985 10.495 -1.988 157 HA TRP 40 HA TRP 40 2.415 10.631 -4.435 158 HB2 TRP 40 1HB TRP 40 3.583 10.275 -2.373 159 HB3 TRP 40 2HB TRP 40 2.645 8.829 -2.016 160 HD1 TRP 40 HD TRP 40 5.547 9.991 -4.212 161 HE1 TRP 40 1HE TRP 40 7.011 7.942 -4.768 162 HE3 TRP 40 3HE TRP 40 2.415 6.352 -2.541 163 HZ2 TRP 40 2HZ TRP 40 6.625 5.098 -4.895 164 HZ3 TRP 40 3HZ TRP 40 2.862 3.965 -3.081 165 HH2 TRP 40 HH TRP 40 4.995 3.324 -4.206 166 H LEU 41 H LEU 41 0.424 7.975 -3.038 167 HA LEU 41 HA LEU 41 0.783 6.131 -5.171 168 HB2 LEU 41 1HB LEU 41 -0.106 5.466 -3.054 169 HB3 LEU 41 2HB LEU 41 -1.491 6.531 -3.182 170 HG LEU 41 HG LEU 41 -1.056 4.292 -5.199 171 HD11 LEU 41 1HD1 LEU 41 -0.988 3.295 -2.946 172 HD12 LEU 41 2HD1 LEU 41 -2.422 2.848 -3.842 173 HD13 LEU 41 3HD1 LEU 41 -2.525 4.065 -2.537 174 HD21 LEU 41 3HD2 LEU 41 -3.514 5.802 -4.235 175 HD22 LEU 41 1HD2 LEU 41 -3.595 4.308 -5.188 176 HD23 LEU 41 2HD2 LEU 41 -2.862 5.731 -5.891 177 H LYS 42 H LYS 42 -1.898 8.465 -4.637 178 HA LYS 42 HA LYS 42 -3.335 7.939 -7.004 179 HB2 LYS 42 1HB LYS 42 -3.015 10.519 -5.390 180 HB3 LYS 42 2HB LYS 42 -4.283 10.263 -6.586 181 HG2 LYS 42 1HG LYS 42 -5.449 8.728 -5.265 182 HG3 LYS 42 2HG LYS 42 -4.040 8.236 -4.363 183 HD2 LYS 42 1HD LYS 42 -5.207 9.416 -2.779 184 HD3 LYS 42 2HD LYS 42 -4.038 10.611 -3.319 185 HE2 LYS 42 1HE LYS 42 -5.757 11.645 -4.769 186 HE3 LYS 42 2HE LYS 42 -6.915 10.422 -4.251 187 HZ1 LYS 42 3HZ LYS 42 -7.154 12.490 -3.025 188 HZ2 LYS 42 1HZ LYS 42 -5.631 12.343 -2.383 189 HZ3 LYS 42 2HZ LYS 42 -6.830 11.231 -2.050 190 H GLN 43 H GLN 43 -0.550 10.199 -6.540 191 HA GLN 43 HA GLN 43 -0.856 11.374 -9.132 192 HB2 GLN 43 1HB GLN 43 1.447 11.221 -7.142 193 HB3 GLN 43 2HB GLN 43 1.600 12.005 -8.722 194 HG2 GLN 43 1HG GLN 43 -0.436 13.393 -8.179 195 HG3 GLN 43 2HG GLN 43 -0.353 12.801 -6.521 196 HE21 GLN 43 1HE2 GLN 43 2.426 12.829 -5.980 197 HE22 GLN 43 2HE2 GLN 43 3.009 14.471 -6.192 198 H ASN 44 H ASN 44 1.244 8.749 -7.880 199 HA ASN 44 HA ASN 44 2.592 8.375 -10.376 200 HB2 ASN 44 1HB ASN 44 2.238 6.632 -7.932 201 HB3 ASN 44 2HB ASN 44 3.154 6.097 -9.359 202 HD21 ASN 44 1HD2 ASN 44 3.249 8.314 -6.541 203 HD22 ASN 44 2HD2 ASN 44 4.849 8.852 -6.899 204 H ILE 45 H ILE 45 -0.509 7.005 -9.144 205 HA ILE 45 HA ILE 45 -0.881 5.174 -11.342 206 HB ILE 45 HB ILE 45 -2.903 6.678 -9.626 207 HG12 ILE 45 1HG1 ILE 45 -1.501 5.141 -8.320 208 HG13 ILE 45 2HG1 ILE 45 -3.169 4.661 -8.352 209 HG21 ILE 45 1HG2 ILE 45 -4.504 4.858 -10.399 210 HG22 ILE 45 2HG2 ILE 45 -4.086 6.066 -11.593 211 HG23 ILE 45 3HG2 ILE 45 -3.332 4.457 -11.663 212 HD11 ILE 45 3HD1 ILE 45 -1.668 2.751 -8.515 213 HD12 ILE 45 1HD1 ILE 45 -2.642 2.881 -9.991 214 HD13 ILE 45 2HD1 ILE 45 -0.936 3.391 -9.994 215 H ALA 46 H ALA 46 -1.754 8.677 -10.908 216 HA ALA 46 HA ALA 46 -2.901 8.890 -13.527 217 HB1 ALA 46 1HB ALA 46 -1.715 11.032 -11.735 218 HB2 ALA 46 2HB ALA 46 -2.753 11.309 -13.147 219 HB3 ALA 46 3HB ALA 46 -3.399 10.472 -11.720 220 H ALA 47 H ALA 47 0.388 8.497 -12.621 221 HA ALA 47 HA ALA 47 1.352 9.471 -15.253 222 HB1 ALA 47 1HB ALA 47 2.910 8.554 -12.828 223 HB2 ALA 47 2HB ALA 47 3.556 9.301 -14.307 224 HB3 ALA 47 3HB ALA 47 2.536 10.247 -13.215 225 H ASN 48 H ASN 48 0.087 6.634 -13.981 226 HA ASN 48 HA ASN 48 0.384 4.437 -14.232 227 HB2 ASN 48 1HB ASN 48 -0.359 5.217 -16.533 228 HB3 ASN 48 2HB ASN 48 1.311 4.988 -17.047 229 HD21 ASN 48 1HD2 ASN 48 2.189 2.679 -16.484 230 HD22 ASN 48 2HD2 ASN 48 1.104 1.361 -16.954 231 H GLN 49 H GLN 49 2.465 5.709 -12.952 232 HA GLN 49 HA GLN 49 5.008 4.449 -13.913 233 HB2 GLN 49 1HB GLN 49 4.381 6.832 -12.145 234 HB3 GLN 49 2HB GLN 49 5.940 6.069 -12.043 235 HG2 GLN 49 1HG GLN 49 5.049 6.838 -14.803 236 HG3 GLN 49 2HG GLN 49 5.522 8.107 -13.683 237 HE21 GLN 49 1HE2 GLN 49 6.806 4.758 -14.416 238 HE22 GLN 49 2HE2 GLN 49 8.443 5.357 -14.641 239 H LEU 50 H LEU 50 2.561 3.918 -11.676 240 HA LEU 50 HA LEU 50 4.278 3.324 -9.359 241 HB2 LEU 50 1HB LEU 50 1.701 4.304 -9.583 242 HB3 LEU 50 2HB LEU 50 1.374 2.627 -9.285 243 HG LEU 50 HG LEU 50 2.851 4.631 -7.532 244 HD11 LEU 50 1HD1 LEU 50 0.454 2.829 -7.045 245 HD12 LEU 50 2HD1 LEU 50 0.418 4.575 -7.393 246 HD13 LEU 50 3HD1 LEU 50 1.139 3.983 -5.887 247 HD21 LEU 50 3HD2 LEU 50 3.164 2.875 -5.821 248 HD22 LEU 50 1HD2 LEU 50 4.254 2.842 -7.183 249 HD23 LEU 50 2HD2 LEU 50 2.908 1.672 -7.105 250 H VAL 51 H VAL 51 4.870 1.238 -8.696 251 HA VAL 51 HA VAL 51 3.835 -1.057 -10.244 252 HB VAL 51 HB VAL 51 6.601 -0.521 -9.103 253 HG11 VAL 51 1HG1 VAL 51 7.280 -2.548 -10.440 254 HG12 VAL 51 2HG1 VAL 51 6.307 -2.913 -9.041 255 HG13 VAL 51 3HG1 VAL 51 5.559 -2.931 -10.666 256 HG21 VAL 51 3HG2 VAL 51 7.323 -0.443 -11.469 257 HG22 VAL 51 1HG2 VAL 51 5.645 -0.625 -12.004 258 HG23 VAL 51 2HG2 VAL 51 6.172 0.833 -11.134 259 H TYR 52 H TYR 52 4.056 -3.115 -9.016 260 HA TYR 52 HA TYR 52 3.711 -3.114 -6.098 261 HB2 TYR 52 1HB TYR 52 1.424 -2.910 -6.763 262 HB3 TYR 52 2HB TYR 52 1.718 -3.778 -8.264 263 HD1 TYR 52 2HD TYR 52 1.052 -4.305 -4.630 264 HD2 TYR 52 1HD TYR 52 1.480 -6.074 -8.533 265 HE1 TYR 52 2HE TYR 52 0.233 -6.474 -3.749 266 HE2 TYR 52 1HE TYR 52 0.775 -8.231 -7.642 267 HH TYR 52 HH TYR 52 0.085 -9.380 -5.745 268 H GLY 53 H GLY 53 5.422 -4.557 -5.679 269 HA2 GLY 53 1HA GLY 53 5.249 -7.109 -7.108 270 HA3 GLY 53 2HA GLY 53 6.845 -6.299 -7.173 271 H ILE 54 H ILE 54 6.870 -8.684 -6.035 272 HA ILE 54 HA ILE 54 6.390 -8.370 -3.106 273 HB ILE 54 HB ILE 54 6.725 -10.834 -4.847 274 HG12 ILE 54 1HG1 ILE 54 4.510 -9.830 -5.074 275 HG13 ILE 54 2HG1 ILE 54 4.390 -11.329 -4.204 276 HG21 ILE 54 1HG2 ILE 54 6.495 -10.614 -1.822 277 HG22 ILE 54 2HG2 ILE 54 6.110 -12.089 -2.725 278 HG23 ILE 54 3HG2 ILE 54 7.739 -11.426 -2.779 279 HD11 ILE 54 3HD1 ILE 54 4.116 -8.549 -3.091 280 HD12 ILE 54 1HD1 ILE 54 2.944 -9.857 -3.072 281 HD13 ILE 54 2HD1 ILE 54 4.398 -9.955 -2.024 282 H VAL 55 H VAL 55 7.953 -8.630 -1.666 283 HA VAL 55 HA VAL 55 10.608 -7.923 -2.204 284 HB VAL 55 HB VAL 55 9.198 -9.298 0.108 285 HG11 VAL 55 1HG1 VAL 55 12.146 -8.840 -0.247 286 HG12 VAL 55 2HG1 VAL 55 11.417 -8.624 1.369 287 HG13 VAL 55 3HG1 VAL 55 11.304 -10.172 0.530 288 HG21 VAL 55 3HG2 VAL 55 9.658 -7.067 1.163 289 HG22 VAL 55 1HG2 VAL 55 10.410 -6.534 -0.356 290 HG23 VAL 55 2HG2 VAL 55 8.690 -6.921 -0.302 291 H LYS 56 H LYS 56 9.475 -11.257 -1.396 292 HA LYS 56 HA LYS 56 10.265 -13.264 -1.839 293 HB2 LYS 56 1HB LYS 56 10.956 -11.748 -4.386 294 HB3 LYS 56 2HB LYS 56 11.550 -13.367 -4.200 295 HG2 LYS 56 1HG LYS 56 8.803 -13.490 -3.392 296 HG3 LYS 56 2HG LYS 56 8.836 -12.426 -4.806 297 HD2 LYS 56 1HD LYS 56 9.885 -14.130 -6.148 298 HD3 LYS 56 2HD LYS 56 10.273 -15.084 -4.708 299 HE2 LYS 56 1HE LYS 56 7.854 -15.430 -4.291 300 HE3 LYS 56 2HE LYS 56 7.500 -14.616 -5.838 301 HZ1 LYS 56 3HZ LYS 56 7.651 -17.042 -6.043 302 HZ2 LYS 56 1HZ LYS 56 9.198 -17.017 -5.518 303 HZ3 LYS 56 2HZ LYS 56 8.798 -16.290 -6.956 304 HA PRO 57 HA PRO 57 14.432 -13.891 -0.507 305 HB2 PRO 57 1HB PRO 57 15.247 -16.130 -1.945 306 HB3 PRO 57 2HB PRO 57 14.185 -16.165 -0.505 307 HG2 PRO 57 1HG PRO 57 13.411 -16.196 -3.435 308 HG3 PRO 57 2HG PRO 57 12.818 -17.264 -2.121 309 HD2 PRO 57 1HD PRO 57 11.380 -15.139 -2.905 310 HD3 PRO 57 2HD PRO 57 11.530 -15.509 -1.174 311 H SER 58 H SER 58 13.751 -13.596 -3.952 312 HA SER 58 HA SER 58 16.513 -13.623 -4.737 313 HB2 SER 58 1HB SER 58 13.974 -13.077 -6.316 314 HB3 SER 58 2HB SER 58 15.553 -13.477 -7.008 315 HG SER 58 HG SER 58 14.073 -15.262 -6.755 316 H ASP 59 H ASP 59 15.021 -11.018 -3.332 317 HA ASP 59 HA ASP 59 16.239 -9.064 -5.235 318 HB2 ASP 59 1HB ASP 59 13.566 -9.434 -4.775 319 HB3 ASP 59 2HB ASP 59 13.936 -8.229 -3.557 320 H THR 60 H THR 60 16.755 -6.899 -4.136 321 HA THR 60 HA THR 60 18.238 -7.497 -1.634 322 HB THR 60 HB THR 60 18.337 -5.082 -3.507 323 HG1 THR 60 1HG THR 60 19.111 -7.151 -4.344 324 HG21 THR 60 3HG2 THR 60 19.136 -4.443 -1.305 325 HG22 THR 60 1HG2 THR 60 20.539 -4.762 -2.346 326 HG23 THR 60 2HG2 THR 60 20.040 -5.969 -1.150 327 H VAL 61 H VAL 61 17.122 -7.048 0.273 328 HA VAL 61 HA VAL 61 15.354 -4.667 0.322 329 HB VAL 61 HB VAL 61 13.663 -6.184 1.456 330 HG11 VAL 61 1HG1 VAL 61 13.535 -5.309 -0.916 331 HG12 VAL 61 2HG1 VAL 61 14.167 -6.881 -1.460 332 HG13 VAL 61 3HG1 VAL 61 12.629 -6.781 -0.611 333 HG21 VAL 61 3HG2 VAL 61 15.224 -8.427 0.156 334 HG22 VAL 61 1HG2 VAL 61 15.282 -8.062 1.897 335 HG23 VAL 61 2HG2 VAL 61 13.774 -8.561 1.157 336 HA PRO 62 HA PRO 62 16.580 -4.225 4.594 337 HB2 PRO 62 1HB PRO 62 14.195 -3.480 5.773 338 HB3 PRO 62 2HB PRO 62 15.257 -2.381 4.834 339 HG2 PRO 62 1HG PRO 62 12.773 -3.840 3.939 340 HG3 PRO 62 2HG PRO 62 13.274 -2.150 3.570 341 HD2 PRO 62 1HD PRO 62 13.577 -4.173 1.824 342 HD3 PRO 62 2HD PRO 62 14.769 -2.872 1.923 343 H ALA 63 H ALA 63 16.164 -5.140 6.754 344 HA ALA 63 HA ALA 63 15.438 -7.919 6.681 345 HB1 ALA 63 1HB ALA 63 15.630 -7.676 9.227 346 HB2 ALA 63 2HB ALA 63 17.075 -7.209 8.308 347 HB3 ALA 63 3HB ALA 63 15.980 -5.963 8.961 348 H GLY 64 H GLY 64 13.546 -8.929 7.185 349 HA2 GLY 64 1HA GLY 64 11.752 -9.295 8.615 350 HA3 GLY 64 2HA GLY 64 11.698 -7.581 8.995 351 H VAL 65 H VAL 65 11.644 -8.630 5.625 352 HA VAL 65 HA VAL 65 8.734 -8.115 5.453 353 HB VAL 65 HB VAL 65 9.242 -6.652 3.440 354 HG11 VAL 65 1HG1 VAL 65 8.476 -5.735 5.547 355 HG12 VAL 65 2HG1 VAL 65 10.156 -5.567 6.115 356 HG13 VAL 65 3HG1 VAL 65 9.583 -4.640 4.706 357 HG21 VAL 65 3HG2 VAL 65 11.709 -7.333 3.235 358 HG22 VAL 65 1HG2 VAL 65 11.362 -5.609 3.154 359 HG23 VAL 65 2HG2 VAL 65 12.001 -6.308 4.653 360 H ASP 66 H ASP 66 10.153 -10.671 5.332 361 HA ASP 66 HA ASP 66 11.487 -11.247 3.056 362 HB2 ASP 66 1HB ASP 66 11.263 -12.456 5.316 363 HB3 ASP 66 2HB ASP 66 9.878 -13.297 4.615 364 H ASP 67 H ASP 67 8.240 -11.034 3.043 365 HA ASP 67 HA ASP 67 7.875 -11.631 0.256 366 HB2 ASP 67 1HB ASP 67 7.701 -13.983 1.426 367 HB3 ASP 67 2HB ASP 67 6.108 -13.442 1.946 368 H TYR 68 H TYR 68 7.656 -9.458 2.056 369 HA TYR 68 HA TYR 68 4.774 -8.799 2.311 370 HB2 TYR 68 1HB TYR 68 7.364 -7.256 2.587 371 HB3 TYR 68 2HB TYR 68 5.814 -6.460 2.500 372 HD1 TYR 68 1HD TYR 68 6.646 -9.634 4.448 373 HD2 TYR 68 2HD TYR 68 5.449 -5.477 4.560 374 HE1 TYR 68 1HE TYR 68 6.236 -9.821 6.838 375 HE2 TYR 68 2HE TYR 68 4.984 -5.691 6.977 376 HH TYR 68 HH TYR 68 4.842 -8.687 8.561 377 H SER 69 H SER 69 3.827 -7.217 0.914 378 HA SER 69 HA SER 69 4.840 -7.050 -1.835 379 HB2 SER 69 1HB SER 69 2.773 -5.267 -1.508 380 HB3 SER 69 2HB SER 69 2.597 -6.926 -2.076 381 HG SER 69 HG SER 69 1.370 -5.968 -0.070 382 H TYR 70 H TYR 70 5.504 -4.990 -2.694 383 HA TYR 70 HA TYR 70 5.640 -2.775 -0.834 384 HB2 TYR 70 1HB TYR 70 7.833 -2.058 -1.434 385 HB3 TYR 70 2HB TYR 70 7.977 -3.668 -0.791 386 HD1 TYR 70 2HD TYR 70 8.203 -5.646 -2.407 387 HD2 TYR 70 1HD TYR 70 8.563 -1.547 -3.704 388 HE1 TYR 70 2HE TYR 70 9.148 -6.400 -4.559 389 HE2 TYR 70 1HE TYR 70 9.604 -2.337 -5.831 390 HH TYR 70 HH TYR 70 10.389 -5.703 -6.436 391 H LEU 71 H LEU 71 5.498 -0.782 -1.828 392 HA LEU 71 HA LEU 71 4.768 -0.748 -4.711 393 HB2 LEU 71 1HB LEU 71 3.811 1.216 -2.589 394 HB3 LEU 71 2HB LEU 71 3.298 1.065 -4.251 395 HG LEU 71 HG LEU 71 1.521 0.212 -3.177 396 HD11 LEU 71 1HD1 LEU 71 2.484 -1.531 -4.753 397 HD12 LEU 71 2HD1 LEU 71 1.215 -2.035 -3.622 398 HD13 LEU 71 3HD1 LEU 71 2.902 -2.456 -3.303 399 HD21 LEU 71 3HD2 LEU 71 1.366 -1.038 -1.188 400 HD22 LEU 71 1HD2 LEU 71 2.305 0.423 -0.954 401 HD23 LEU 71 2HD2 LEU 71 3.150 -1.148 -1.064 402 H VAL 72 H VAL 72 6.112 0.491 -5.889 403 HA VAL 72 HA VAL 72 7.366 2.870 -4.831 404 HB VAL 72 HB VAL 72 9.037 1.117 -4.343 405 HG11 VAL 72 1HG1 VAL 72 8.471 -0.459 -6.207 406 HG12 VAL 72 2HG1 VAL 72 9.218 0.667 -7.348 407 HG13 VAL 72 3HG1 VAL 72 10.210 -0.094 -6.090 408 HG21 VAL 72 3HG2 VAL 72 10.941 2.236 -5.100 409 HG22 VAL 72 1HG2 VAL 72 10.205 2.750 -6.613 410 HG23 VAL 72 2HG2 VAL 72 9.706 3.495 -5.083 411 H ALA 73 H ALA 73 8.157 4.146 -6.855 412 HA ALA 73 HA ALA 73 6.441 3.480 -9.191 413 HB1 ALA 73 1HB ALA 73 6.718 5.903 -8.146 414 HB2 ALA 73 2HB ALA 73 8.236 5.882 -9.076 415 HB3 ALA 73 3HB ALA 73 6.711 5.661 -9.910 416 H ALA 74 H ALA 74 7.543 3.388 -11.298 417 HA ALA 74 HA ALA 74 9.844 1.740 -11.215 418 HB1 ALA 74 1HB ALA 74 8.224 1.845 -13.110 419 HB2 ALA 74 2HB ALA 74 8.897 3.428 -13.562 420 HB3 ALA 74 3HB ALA 74 9.916 1.983 -13.647 421 H ASP 75 H ASP 75 9.683 5.119 -10.956 422 HA ASP 75 HA ASP 75 12.588 5.458 -11.517 423 HB2 ASP 75 1HB ASP 75 10.664 6.518 -13.022 424 HB3 ASP 75 2HB ASP 75 10.686 7.766 -11.779 425 H ASP 76 H ASP 76 10.699 5.130 -8.899 426 HA ASP 76 HA ASP 76 11.739 7.525 -7.445 427 HB2 ASP 76 1HB ASP 76 9.237 7.147 -7.722 428 HB3 ASP 76 2HB ASP 76 9.383 5.807 -6.592 429 H GLN 77 H GLN 77 13.077 5.015 -8.036 430 HA GLN 77 HA GLN 77 13.034 2.939 -6.252 431 HB2 GLN 77 1HB GLN 77 15.396 4.160 -7.712 432 HB3 GLN 77 2HB GLN 77 15.470 2.576 -6.940 433 HG2 GLN 77 1HG GLN 77 14.162 1.556 -8.538 434 HG3 GLN 77 2HG GLN 77 13.262 3.021 -8.943 435 HE21 GLN 77 1HE2 GLN 77 13.635 3.379 -11.100 436 HE22 GLN 77 2HE2 GLN 77 15.223 3.576 -11.797 437 H ASP 78 H ASP 78 15.001 5.889 -5.917 438 HA ASP 78 HA ASP 78 15.847 4.992 -3.188 439 HB2 ASP 78 1HB ASP 78 17.761 6.283 -3.325 440 HB3 ASP 78 2HB ASP 78 17.638 5.519 -4.905 441 H GLY 79 H GLY 79 13.584 6.923 -4.671 442 HA2 GLY 79 1HA GLY 79 13.551 9.216 -2.895 443 HA3 GLY 79 2HA GLY 79 12.333 8.767 -4.102 444 H THR 80 H THR 80 11.071 6.611 -3.476 445 HA THR 80 HA THR 80 10.490 6.604 -0.572 446 HB THR 80 HB THR 80 8.108 6.721 -2.322 447 HG1 THR 80 1HG THR 80 9.037 8.302 -3.362 448 HG21 THR 80 3HG2 THR 80 8.058 6.679 0.173 449 HG22 THR 80 1HG2 THR 80 7.326 8.167 -0.481 450 HG23 THR 80 2HG2 THR 80 8.955 8.216 0.210 451 H ILE 81 H ILE 81 8.984 4.811 0.062 452 HA ILE 81 HA ILE 81 8.210 2.845 -1.816 453 HB ILE 81 HB ILE 81 10.581 2.139 -1.632 454 HG12 ILE 81 1HG1 ILE 81 9.044 0.118 0.016 455 HG13 ILE 81 2HG1 ILE 81 8.539 0.482 -1.618 456 HG21 ILE 81 1HG2 ILE 81 11.144 3.076 0.589 457 HG22 ILE 81 2HG2 ILE 81 10.097 1.883 1.380 458 HG23 ILE 81 3HG2 ILE 81 11.549 1.360 0.510 459 HD11 ILE 81 3HD1 ILE 81 10.778 -0.118 -2.492 460 HD12 ILE 81 1HD1 ILE 81 11.333 -0.462 -0.837 461 HD13 ILE 81 2HD1 ILE 81 10.077 -1.457 -1.568 462 H ILE 82 H ILE 82 6.646 1.405 -0.771 463 HA ILE 82 HA ILE 82 6.406 1.663 2.168 464 HB ILE 82 HB ILE 82 4.006 1.657 0.283 465 HG12 ILE 82 1HG1 ILE 82 4.820 4.085 1.932 466 HG13 ILE 82 2HG1 ILE 82 5.324 3.870 0.270 467 HG21 ILE 82 1HG2 ILE 82 4.210 1.982 3.322 468 HG22 ILE 82 2HG2 ILE 82 2.722 2.190 2.399 469 HG23 ILE 82 3HG2 ILE 82 3.505 0.618 2.442 470 HD11 ILE 82 3HD1 ILE 82 3.369 5.273 0.341 471 HD12 ILE 82 1HD1 ILE 82 3.103 3.773 -0.561 472 HD13 ILE 82 2HD1 ILE 82 2.419 3.967 1.074 473 H PHE 83 H PHE 83 5.852 -0.346 3.119 474 HA PHE 83 HA PHE 83 5.655 -2.703 1.312 475 HB2 PHE 83 1HB PHE 83 6.989 -2.442 4.035 476 HB3 PHE 83 2HB PHE 83 6.739 -3.940 3.242 477 HD1 PHE 83 2HD PHE 83 8.590 -0.709 3.064 478 HD2 PHE 83 1HD PHE 83 8.314 -4.748 1.573 479 HE1 PHE 83 2HE PHE 83 10.865 -0.512 2.079 480 HE2 PHE 83 1HE PHE 83 10.594 -4.526 0.605 481 HZ PHE 83 HZ PHE 83 11.863 -2.432 0.853 482 H PHE 84 H PHE 84 4.048 -4.357 2.067 483 HA PHE 84 HA PHE 84 2.794 -3.857 4.650 484 HB2 PHE 84 1HB PHE 84 0.513 -3.799 3.907 485 HB3 PHE 84 2HB PHE 84 1.378 -2.478 3.162 486 HD1 PHE 84 2HD PHE 84 1.920 -2.567 0.665 487 HD2 PHE 84 1HD PHE 84 -0.526 -5.565 2.618 488 HE1 PHE 84 2HE PHE 84 1.112 -3.372 -1.526 489 HE2 PHE 84 1HE PHE 84 -1.376 -6.290 0.419 490 HZ PHE 84 HZ PHE 84 -0.561 -5.201 -1.659 491 H LYS 85 H LYS 85 1.511 -5.636 5.438 492 HA LYS 85 HA LYS 85 1.194 -7.969 3.715 493 HB2 LYS 85 1HB LYS 85 3.473 -8.320 4.649 494 HB3 LYS 85 2HB LYS 85 2.759 -8.460 6.245 495 HG2 LYS 85 1HG LYS 85 1.962 -10.569 5.849 496 HG3 LYS 85 2HG LYS 85 1.361 -10.118 4.228 497 HD2 LYS 85 1HD LYS 85 3.520 -10.259 3.256 498 HD3 LYS 85 2HD LYS 85 4.257 -10.809 4.776 499 HE2 LYS 85 1HE LYS 85 2.007 -12.225 3.281 500 HE3 LYS 85 2HE LYS 85 3.722 -12.597 3.061 501 HZ1 LYS 85 3HZ LYS 85 3.803 -13.212 5.418 502 HZ2 LYS 85 1HZ LYS 85 2.829 -14.139 4.541 503 HZ3 LYS 85 2HZ LYS 85 2.181 -12.989 5.573 504 H ALA 86 H ALA 86 -0.904 -8.200 3.987 505 HA ALA 86 HA ALA 86 -2.492 -7.787 6.315 506 HB1 ALA 86 1HB ALA 86 -3.338 -7.654 4.001 507 HB2 ALA 86 2HB ALA 86 -3.067 -9.394 3.811 508 HB3 ALA 86 3HB ALA 86 -4.265 -8.802 4.975 509 H GLU 87 H GLU 87 -2.243 -8.919 8.184 510 HA GLU 87 HA GLU 87 -2.034 -11.846 7.975 511 HB2 GLU 87 1HB GLU 87 -0.638 -9.865 9.747 512 HB3 GLU 87 2HB GLU 87 -0.904 -11.485 10.330 513 HG2 GLU 87 1HG GLU 87 0.693 -10.568 7.887 514 HG3 GLU 87 2HG GLU 87 1.329 -11.307 9.353 515 H GLY 88 H GLY 88 -3.934 -12.584 8.301 516 HA2 GLY 88 1HA GLY 88 -6.076 -12.909 9.167 517 HA3 GLY 88 2HA GLY 88 -5.099 -12.973 10.648 518 H GLN 89 H GLN 89 -6.917 -10.884 8.530 519 HA GLN 89 HA GLN 89 -8.031 -8.895 8.718 520 HB2 GLN 89 1HB GLN 89 -7.785 -9.162 11.719 521 HB3 GLN 89 2HB GLN 89 -8.282 -7.735 10.886 522 HG2 GLN 89 1HG GLN 89 -10.261 -8.980 11.468 523 HG3 GLN 89 2HG GLN 89 -10.045 -8.968 9.715 524 HE21 GLN 89 1HE2 GLN 89 -11.074 -10.774 9.028 525 HE22 GLN 89 2HE2 GLN 89 -10.917 -12.341 9.765 526 H THR 90 H THR 90 -5.692 -8.392 11.285 527 HA THR 90 HA THR 90 -5.176 -5.931 10.352 528 HB THR 90 HB THR 90 -3.302 -7.588 12.131 529 HG1 THR 90 1HG THR 90 -5.124 -7.902 13.194 530 HG21 THR 90 3HG2 THR 90 -3.024 -5.472 13.369 531 HG22 THR 90 1HG2 THR 90 -4.206 -4.654 12.321 532 HG23 THR 90 2HG2 THR 90 -2.646 -5.200 11.649 533 H VAL 91 H VAL 91 -3.805 -4.961 8.950 534 HA VAL 91 HA VAL 91 -1.697 -6.549 7.715 535 HB VAL 91 HB VAL 91 -1.883 -5.326 6.051 536 HG11 VAL 91 1HG1 VAL 91 -4.101 -6.453 6.403 537 HG12 VAL 91 2HG1 VAL 91 -4.738 -4.803 6.582 538 HG13 VAL 91 3HG1 VAL 91 -3.939 -5.307 5.066 539 HG21 VAL 91 3HG2 VAL 91 -2.791 -3.231 5.341 540 HG22 VAL 91 1HG2 VAL 91 -2.841 -2.806 7.067 541 HG23 VAL 91 2HG2 VAL 91 -1.286 -3.273 6.259 542 H ILE 92 H ILE 92 0.368 -6.409 8.360 543 HA ILE 92 HA ILE 92 1.303 -4.132 9.929 544 HB ILE 92 HB ILE 92 2.749 -6.481 8.686 545 HG12 ILE 92 1HG1 ILE 92 2.872 -7.220 11.195 546 HG13 ILE 92 2HG1 ILE 92 1.538 -6.129 11.464 547 HG21 ILE 92 1HG2 ILE 92 3.761 -4.894 11.053 548 HG22 ILE 92 2HG2 ILE 92 4.623 -6.014 10.022 549 HG23 ILE 92 3HG2 ILE 92 4.153 -4.432 9.375 550 HD11 ILE 92 3HD1 ILE 92 0.063 -7.530 10.135 551 HD12 ILE 92 1HD1 ILE 92 1.462 -8.402 9.438 552 HD13 ILE 92 2HD1 ILE 92 1.037 -8.587 11.151 553 H ILE 93 H ILE 93 1.292 -2.286 8.728 554 HA ILE 93 HA ILE 93 2.480 -2.243 6.011 555 HB ILE 93 HB ILE 93 1.708 0.187 7.644 556 HG12 ILE 93 1HG1 ILE 93 -0.090 -1.315 5.668 557 HG13 ILE 93 2HG1 ILE 93 -0.305 -1.288 7.418 558 HG21 ILE 93 1HG2 ILE 93 1.821 -0.233 4.605 559 HG22 ILE 93 2HG2 ILE 93 1.691 1.305 5.476 560 HG23 ILE 93 3HG2 ILE 93 3.187 0.383 5.529 561 HD11 ILE 93 3HD1 ILE 93 -0.581 1.075 5.539 562 HD12 ILE 93 1HD1 ILE 93 -1.823 0.312 6.529 563 HD13 ILE 93 2HD1 ILE 93 -0.505 1.219 7.317 564 H LYS 94 H LYS 94 4.566 -1.536 5.684 565 HA LYS 94 HA LYS 94 6.178 -0.704 8.000 566 HB2 LYS 94 1HB LYS 94 6.699 -3.006 6.128 567 HB3 LYS 94 2HB LYS 94 8.047 -2.151 6.761 568 HG2 LYS 94 1HG LYS 94 7.155 -2.521 9.101 569 HG3 LYS 94 2HG LYS 94 5.860 -3.500 8.391 570 HD2 LYS 94 1HD LYS 94 7.512 -5.113 7.541 571 HD3 LYS 94 2HD LYS 94 8.830 -4.085 8.150 572 HE2 LYS 94 1HE LYS 94 7.783 -4.341 10.472 573 HE3 LYS 94 2HE LYS 94 6.723 -5.579 9.772 574 HZ1 LYS 94 3HZ LYS 94 8.649 -6.518 10.840 575 HZ2 LYS 94 1HZ LYS 94 9.679 -5.692 9.872 576 HZ3 LYS 94 2HZ LYS 94 8.723 -6.855 9.220 577 H TYR 95 H TYR 95 6.861 1.365 7.557 578 HA TYR 95 HA TYR 95 7.327 2.089 4.686 579 HB2 TYR 95 1HB TYR 95 5.963 4.141 5.163 580 HB3 TYR 95 2HB TYR 95 5.054 2.653 5.149 581 HD1 TYR 95 2HD TYR 95 6.507 5.281 7.399 582 HD2 TYR 95 1HD TYR 95 3.972 1.825 7.015 583 HE1 TYR 95 2HE TYR 95 5.709 5.640 9.691 584 HE2 TYR 95 1HE TYR 95 3.198 2.104 9.298 585 HH TYR 95 HH TYR 95 3.854 3.292 11.487 586 H THR 96 H THR 96 8.309 4.389 4.527 587 HA THR 96 HA THR 96 10.003 5.103 6.805 588 HB THR 96 HB THR 96 11.130 3.138 5.840 589 HG1 THR 96 1HG THR 96 13.067 4.520 5.134 590 HG21 THR 96 3HG2 THR 96 10.300 3.293 3.477 591 HG22 THR 96 1HG2 THR 96 12.054 3.151 3.573 592 HG23 THR 96 2HG2 THR 96 11.311 4.727 3.231 593 H SER 97 H SER 97 11.423 6.957 6.124 594 HA SER 97 HA SER 97 10.265 8.532 3.879 595 HB2 SER 97 1HB SER 97 11.238 10.483 5.359 596 HB3 SER 97 2HB SER 97 9.609 9.860 5.546 597 HG SER 97 HG SER 97 11.140 10.116 7.467 598 H GLN 98 H GLN 98 12.820 6.598 4.643 599 HA GLN 98 HA GLN 98 14.280 7.762 2.381 600 HB2 GLN 98 1HB GLN 98 15.613 7.256 5.072 601 HB3 GLN 98 2HB GLN 98 16.499 7.256 3.550 602 HG2 GLN 98 1HG GLN 98 15.685 9.598 3.124 603 HG3 GLN 98 2HG GLN 98 15.031 9.611 4.773 604 HE21 GLN 98 1HE2 GLN 98 17.744 10.442 2.959 605 HE22 GLN 98 2HE2 GLN 98 19.018 10.213 4.134 606 H ARG 99 H ARG 99 15.539 6.247 1.236 607 HA ARG 99 HA ARG 99 14.627 3.509 1.501 608 HB2 ARG 99 1HB ARG 99 15.154 4.903 -0.659 609 HB3 ARG 99 2HB ARG 99 16.820 4.448 -0.368 610 HG2 ARG 99 1HG ARG 99 15.952 2.885 -1.938 611 HG3 ARG 99 2HG ARG 99 16.070 2.018 -0.420 612 HD2 ARG 99 1HD ARG 99 13.515 2.759 -0.169 613 HD3 ARG 99 2HD ARG 99 13.607 2.894 -1.920 614 HE ARG 99 HE ARG 99 13.771 0.516 -0.210 615 HH11 ARG 99 1HH1 ARG 99 14.172 1.668 -3.624 616 HH12 ARG 99 2HH1 ARG 99 14.042 0.048 -4.246 617 HH21 ARG 99 1HH2 ARG 99 13.481 -1.615 -1.256 618 HH22 ARG 99 2HH2 ARG 99 13.808 -1.717 -2.941 619 H ASN 100 H ASN 100 16.920 5.007 3.306 620 HA ASN 100 HA ASN 100 18.708 2.661 3.433 621 HB2 ASN 100 1HB ASN 100 20.371 4.340 4.508 622 HB3 ASN 100 2HB ASN 100 20.194 4.189 2.780 623 HD21 ASN 100 1HD2 ASN 100 19.065 5.780 1.628 624 HD22 ASN 100 2HD2 ASN 100 18.997 7.431 2.234 625 H THR 101 H THR 101 16.278 3.736 5.121 626 HA THR 101 HA THR 101 17.500 3.273 7.812 627 HB THR 101 HB THR 101 15.613 4.791 8.533 628 HG1 THR 101 1HG THR 101 14.466 5.798 7.058 629 HG21 THR 101 3HG2 THR 101 16.714 6.858 7.790 630 HG22 THR 101 1HG2 THR 101 17.582 5.983 6.522 631 HG23 THR 101 2HG2 THR 101 17.929 5.643 8.229 632 H LYS 102 H LYS 102 15.740 2.773 9.586 633 HA LYS 102 HA LYS 102 14.735 0.154 8.953 634 HB2 LYS 102 1HB LYS 102 15.683 0.771 11.186 635 HB3 LYS 102 2HB LYS 102 14.315 1.851 11.440 636 HG2 LYS 102 1HG LYS 102 13.710 -0.111 12.605 637 HG3 LYS 102 2HG LYS 102 12.798 -0.204 11.123 638 HD2 LYS 102 1HD LYS 102 14.956 -1.586 10.303 639 HD3 LYS 102 2HD LYS 102 15.136 -1.839 12.042 640 HE2 LYS 102 1HE LYS 102 12.717 -2.660 12.066 641 HE3 LYS 102 2HE LYS 102 12.694 -2.495 10.307 642 HZ1 LYS 102 3HZ LYS 102 13.181 -4.720 10.857 643 HZ2 LYS 102 1HZ LYS 102 14.390 -4.307 11.898 644 HZ3 LYS 102 2HZ LYS 102 14.617 -4.066 10.303 645 H LEU 103 H LEU 103 12.674 -0.431 8.327 646 HA LEU 103 HA LEU 103 10.677 1.567 7.789 647 HB2 LEU 103 1HB LEU 103 10.233 -1.397 8.234 648 HB3 LEU 103 2HB LEU 103 9.053 -0.305 7.574 649 HG LEU 103 HG LEU 103 9.763 -1.380 5.706 650 HD11 LEU 103 1HD1 LEU 103 11.696 0.960 5.712 651 HD12 LEU 103 2HD1 LEU 103 9.962 1.031 5.284 652 HD13 LEU 103 3HD1 LEU 103 11.092 0.079 4.308 653 HD21 LEU 103 3HD2 LEU 103 12.703 -1.192 6.259 654 HD22 LEU 103 1HD2 LEU 103 11.747 -2.317 5.261 655 HD23 LEU 103 2HD2 LEU 103 11.725 -2.480 7.004 656 H LYS 104 H LYS 104 9.131 2.390 9.030 657 HA LYS 104 HA LYS 104 8.804 1.879 11.879 658 HB2 LYS 104 1HB LYS 104 7.469 3.524 9.689 659 HB3 LYS 104 2HB LYS 104 6.705 3.317 11.237 660 HG2 LYS 104 1HG LYS 104 7.772 5.334 11.490 661 HG3 LYS 104 2HG LYS 104 8.883 4.212 12.293 662 HD2 LYS 104 1HD LYS 104 10.247 4.156 10.172 663 HD3 LYS 104 2HD LYS 104 9.113 5.283 9.447 664 HE2 LYS 104 1HE LYS 104 10.807 5.821 11.940 665 HE3 LYS 104 2HE LYS 104 11.218 6.340 10.299 666 HZ1 LYS 104 3HZ LYS 104 8.938 7.290 11.919 667 HZ2 LYS 104 1HZ LYS 104 9.127 7.581 10.275 668 HZ3 LYS 104 2HZ LYS 104 10.208 8.145 11.328 669 H ALA 105 H ALA 105 6.413 1.484 12.499 670 HA ALA 105 HA ALA 105 5.180 -0.696 10.830 671 HB1 ALA 105 1HB ALA 105 5.529 -0.498 13.851 672 HB2 ALA 105 2HB ALA 105 4.557 -1.729 13.040 673 HB3 ALA 105 3HB ALA 105 6.301 -1.669 12.767 674 H LYS 106 H LYS 106 2.842 -0.774 10.933 675 HA LYS 106 HA LYS 106 1.198 0.759 12.658 676 HB2 LYS 106 1HB LYS 106 1.982 2.499 10.870 677 HB3 LYS 106 2HB LYS 106 0.810 1.701 9.837 678 HG2 LYS 106 1HG LYS 106 -0.342 2.298 12.458 679 HG3 LYS 106 2HG LYS 106 0.592 3.702 11.914 680 HD2 LYS 106 1HD LYS 106 -0.821 3.104 9.657 681 HD3 LYS 106 2HD LYS 106 -1.921 2.551 10.939 682 HE2 LYS 106 1HE LYS 106 -0.654 5.332 10.760 683 HE3 LYS 106 2HE LYS 106 -2.238 4.946 10.090 684 HZ1 LYS 106 3HZ LYS 106 -1.580 4.652 12.965 685 HZ2 LYS 106 1HZ LYS 106 -3.079 4.530 12.259 686 HZ3 LYS 106 2HZ LYS 106 -2.305 5.958 12.310 687 H ALA 107 H ALA 107 -0.097 -0.998 13.016 688 HA ALA 107 HA ALA 107 -0.390 -2.972 10.881 689 HB1 ALA 107 1HB ALA 107 -1.199 -3.179 13.808 690 HB2 ALA 107 2HB ALA 107 -0.893 -4.503 12.682 691 HB3 ALA 107 3HB ALA 107 0.436 -3.508 13.209 692 H LEU 108 H LEU 108 -2.546 -2.999 9.619 693 HA LEU 108 HA LEU 108 -4.710 -1.393 11.093 694 HB2 LEU 108 1HB LEU 108 -4.108 -1.450 8.138 695 HB3 LEU 108 2HB LEU 108 -5.564 -0.844 8.866 696 HG LEU 108 HG LEU 108 -4.080 0.905 8.194 697 HD11 LEU 108 1HD1 LEU 108 -5.637 1.255 10.110 698 HD12 LEU 108 2HD1 LEU 108 -4.208 2.280 10.197 699 HD13 LEU 108 3HD1 LEU 108 -4.319 0.840 11.234 700 HD21 LEU 108 3HD2 LEU 108 -1.961 1.295 8.999 701 HD22 LEU 108 1HD2 LEU 108 -1.952 -0.458 8.812 702 HD23 LEU 108 2HD2 LEU 108 -2.147 0.251 10.424 703 H THR 109 H THR 109 -6.526 -2.456 11.610 704 HA THR 109 HA THR 109 -6.958 -5.165 10.789 705 HB THR 109 HB THR 109 -9.278 -4.641 11.696 706 HG1 THR 109 1HG THR 109 -8.691 -2.630 13.196 707 HG21 THR 109 3HG2 THR 109 -7.488 -5.792 12.947 708 HG22 THR 109 1HG2 THR 109 -8.433 -4.742 14.001 709 HG23 THR 109 2HG2 THR 109 -6.814 -4.236 13.453 710 H LEU 110 H LEU 110 -8.233 -6.038 9.120 711 HA LEU 110 HA LEU 110 -8.747 -4.612 6.748 712 HB2 LEU 110 1HB LEU 110 -10.168 -6.988 8.074 713 HB3 LEU 110 2HB LEU 110 -10.564 -6.419 6.468 714 HG LEU 110 HG LEU 110 -7.916 -7.492 7.331 715 HD11 LEU 110 1HD1 LEU 110 -9.879 -8.615 5.286 716 HD12 LEU 110 2HD1 LEU 110 -9.709 -9.215 6.954 717 HD13 LEU 110 3HD1 LEU 110 -8.370 -9.366 5.810 718 HD21 LEU 110 3HD2 LEU 110 -8.700 -6.237 4.778 719 HD22 LEU 110 1HD2 LEU 110 -7.298 -7.345 4.893 720 HD23 LEU 110 2HD2 LEU 110 -7.312 -5.855 5.822 721 H SER 111 H SER 111 -10.702 -4.877 9.640 722 HA SER 111 HA SER 111 -12.963 -3.555 8.510 723 HB2 SER 111 1HB SER 111 -12.742 -4.784 10.799 724 HB3 SER 111 2HB SER 111 -12.325 -3.170 11.438 725 HG SER 111 HG SER 111 -14.683 -4.090 11.150 726 H GLN 112 H GLN 112 -10.032 -2.085 10.073 727 HA GLN 112 HA GLN 112 -10.818 0.632 9.959 728 HB2 GLN 112 1HB GLN 112 -8.187 -0.837 10.045 729 HB3 GLN 112 2HB GLN 112 -8.138 0.755 9.338 730 HG2 GLN 112 1HG GLN 112 -9.106 0.063 12.105 731 HG3 GLN 112 2HG GLN 112 -7.579 0.837 11.665 732 HE21 GLN 112 1HE2 GLN 112 -8.094 2.895 10.037 733 HE22 GLN 112 2HE2 GLN 112 -9.416 3.920 10.544 734 H LEU 113 H LEU 113 -8.800 -1.147 7.533 735 HA LEU 113 HA LEU 113 -8.704 1.006 5.744 736 HB2 LEU 113 1HB LEU 113 -8.734 -1.967 4.990 737 HB3 LEU 113 2HB LEU 113 -8.323 -0.640 3.937 738 HG LEU 113 HG LEU 113 -6.294 -1.526 4.411 739 HD11 LEU 113 1HD1 LEU 113 -6.485 0.627 6.553 740 HD12 LEU 113 2HD1 LEU 113 -6.294 0.936 4.811 741 HD13 LEU 113 3HD1 LEU 113 -5.025 0.090 5.694 742 HD21 LEU 113 3HD2 LEU 113 -7.027 -3.062 6.196 743 HD22 LEU 113 1HD2 LEU 113 -6.900 -1.721 7.354 744 HD23 LEU 113 2HD2 LEU 113 -5.463 -2.318 6.508 745 H LYS 114 H LYS 114 -11.318 -1.328 6.128 746 HA LYS 114 HA LYS 114 -12.546 -0.821 3.543 747 HB2 LYS 114 1HB LYS 114 -12.742 -2.872 4.778 748 HB3 LYS 114 2HB LYS 114 -13.637 -2.054 6.085 749 HG2 LYS 114 1HG LYS 114 -15.398 -1.432 4.376 750 HG3 LYS 114 2HG LYS 114 -14.484 -2.335 3.151 751 HD2 LYS 114 1HD LYS 114 -15.847 -3.333 5.692 752 HD3 LYS 114 2HD LYS 114 -16.259 -3.743 4.023 753 HE2 LYS 114 1HE LYS 114 -15.128 -5.627 4.581 754 HE3 LYS 114 2HE LYS 114 -13.766 -4.710 3.973 755 HZ1 LYS 114 3HZ LYS 114 -13.079 -4.251 6.185 756 HZ2 LYS 114 1HZ LYS 114 -13.490 -5.842 6.209 757 HZ3 LYS 114 2HZ LYS 114 -14.509 -4.740 6.848 758 H LYS 115 H LYS 115 -12.930 0.441 6.949 759 HA LYS 115 HA LYS 115 -15.205 2.060 6.190 760 HB2 LYS 115 1HB LYS 115 -13.770 1.332 8.640 761 HB3 LYS 115 2HB LYS 115 -13.800 3.068 8.480 762 HG2 LYS 115 1HG LYS 115 -15.820 2.378 9.679 763 HG3 LYS 115 2HG LYS 115 -16.265 2.990 8.083 764 HD2 LYS 115 1HD LYS 115 -17.596 1.044 8.446 765 HD3 LYS 115 2HD LYS 115 -16.382 0.574 7.266 766 HE2 LYS 115 1HE LYS 115 -15.871 -1.164 8.606 767 HE3 LYS 115 2HE LYS 115 -15.111 0.011 9.687 768 HZ1 LYS 115 3HZ LYS 115 -17.441 0.266 10.642 769 HZ2 LYS 115 1HZ LYS 115 -16.612 -1.095 11.019 770 HZ3 LYS 115 2HZ LYS 115 -17.806 -1.149 9.881 771 H GLU 116 H GLU 116 -11.719 2.715 6.871 772 HA GLU 116 HA GLU 116 -11.730 5.383 6.305 773 HB2 GLU 116 1HB GLU 116 -9.540 3.384 5.620 774 HB3 GLU 116 2HB GLU 116 -9.353 5.130 5.613 775 HG2 GLU 116 1HG GLU 116 -9.721 3.312 7.984 776 HG3 GLU 116 2HG GLU 116 -8.404 4.412 7.624 777 H PHE 117 H PHE 117 -11.159 2.839 3.820 778 HA PHE 117 HA PHE 117 -11.541 4.974 1.769 779 HB2 PHE 117 1HB PHE 117 -9.659 2.642 1.564 780 HB3 PHE 117 2HB PHE 117 -9.753 4.112 0.598 781 HD1 PHE 117 1HD PHE 117 -9.590 6.383 2.231 782 HD2 PHE 117 2HD PHE 117 -7.797 2.523 2.993 783 HE1 PHE 117 1HE PHE 117 -7.929 7.437 3.737 784 HE2 PHE 117 2HE PHE 117 -6.155 3.588 4.481 785 HZ PHE 117 HZ PHE 117 -6.219 6.059 4.869 786 H TYR 118 H TYR 118 -13.365 2.524 2.832 787 HA TYR 118 HA TYR 118 -14.339 2.098 0.096 788 HB2 TYR 118 1HB TYR 118 -12.537 0.303 0.965 789 HB3 TYR 118 2HB TYR 118 -13.929 -0.377 1.766 790 HD1 TYR 118 1HD TYR 118 -13.046 0.998 -1.680 791 HD2 TYR 118 2HD TYR 118 -14.857 -2.115 0.657 792 HE1 TYR 118 1HE TYR 118 -13.353 -0.339 -3.748 793 HE2 TYR 118 2HE TYR 118 -15.235 -3.474 -1.446 794 HH TYR 118 HH TYR 118 -14.338 -2.359 -4.662 795 H GLN 119 H GLN 119 -15.216 3.333 2.638 796 HA GLN 119 HA GLN 119 -17.288 2.108 3.908 797 HB2 GLN 119 1HB GLN 119 -18.069 4.382 4.476 798 HB3 GLN 119 2HB GLN 119 -16.342 4.263 4.551 799 HG2 GLN 119 1HG GLN 119 -16.756 5.082 1.927 800 HG3 GLN 119 2HG GLN 119 -18.016 5.933 2.799 801 HE21 GLN 119 1HE2 GLN 119 -14.431 5.146 3.454 802 HE22 GLN 119 2HE2 GLN 119 -14.015 6.830 3.455 803 H THR 120 H THR 120 -17.439 3.444 0.674 804 HA THR 120 HA THR 120 -20.374 2.887 0.477 805 HB THR 120 HB THR 120 -19.982 5.223 0.969 806 HG1 THR 120 1HG THR 120 -21.255 5.959 -0.530 807 HG21 THR 120 3HG2 THR 120 -18.338 5.415 -1.581 808 HG22 THR 120 1HG2 THR 120 -17.658 5.485 0.058 809 HG23 THR 120 2HG2 THR 120 -18.766 6.730 -0.485 810 H ARG 121 H ARG 121 -21.162 2.750 -1.800 811 HA ARG 121 HA ARG 121 -19.405 1.035 -3.398 812 HB2 ARG 121 1HB ARG 121 -22.257 2.003 -3.656 813 HB3 ARG 121 2HB ARG 121 -21.444 1.397 -5.066 814 HG2 ARG 121 1HG ARG 121 -21.285 -0.775 -4.263 815 HG3 ARG 121 2HG ARG 121 -21.193 -0.267 -2.579 816 HD2 ARG 121 1HD ARG 121 -23.625 0.325 -2.646 817 HD3 ARG 121 2HD ARG 121 -23.705 -0.318 -4.291 818 HE ARG 121 HE ARG 121 -22.715 -1.949 -2.002 819 HH11 ARG 121 1HH1 ARG 121 -25.156 -1.718 -4.648 820 HH12 ARG 121 2HH1 ARG 121 -25.767 -3.296 -4.271 821 HH21 ARG 121 1HH2 ARG 121 -23.531 -4.028 -1.707 822 HH22 ARG 121 2HH2 ARG 121 -24.799 -4.606 -2.778 823 H SER 122 H SER 122 -20.427 4.454 -3.517 824 HA SER 122 HA SER 122 -19.621 4.829 -6.244 825 HB2 SER 122 1HB SER 122 -20.967 6.237 -4.386 826 HB3 SER 122 2HB SER 122 -19.414 7.036 -4.207 827 HG SER 122 HG SER 122 -19.519 7.613 -6.379 828 H GLN 123 H GLN 123 -17.778 4.993 -3.225 829 HA GLN 123 HA GLN 123 -15.307 5.849 -4.351 830 HB2 GLN 123 1HB GLN 123 -15.822 6.027 -2.001 831 HB3 GLN 123 2HB GLN 123 -16.028 4.276 -1.855 832 HG2 GLN 123 1HG GLN 123 -13.703 3.864 -2.070 833 HG3 GLN 123 2HG GLN 123 -13.390 5.508 -2.695 834 HE21 GLN 123 1HE2 GLN 123 -15.400 4.601 0.108 835 HE22 GLN 123 2HE2 GLN 123 -14.364 5.425 1.290 836 H LYS 124 H LYS 124 -16.926 2.763 -4.700 837 HA LYS 124 HA LYS 124 -14.632 1.075 -4.988 838 HB2 LYS 124 1HB LYS 124 -17.354 0.957 -6.383 839 HB3 LYS 124 2HB LYS 124 -16.122 -0.248 -6.524 840 HG2 LYS 124 1HG LYS 124 -16.104 -0.568 -4.055 841 HG3 LYS 124 2HG LYS 124 -17.436 0.559 -3.892 842 HD2 LYS 124 1HD LYS 124 -18.898 -0.925 -5.204 843 HD3 LYS 124 2HD LYS 124 -17.503 -1.942 -5.607 844 HE2 LYS 124 1HE LYS 124 -17.180 -2.368 -3.133 845 HE3 LYS 124 2HE LYS 124 -18.769 -1.618 -2.874 846 HZ1 LYS 124 3HZ LYS 124 -19.698 -3.346 -4.353 847 HZ2 LYS 124 1HZ LYS 124 -18.924 -4.003 -3.056 848 HZ3 LYS 124 2HZ LYS 124 -18.194 -4.003 -4.522 849 H ARG 125 H ARG 125 -16.072 3.511 -7.106 850 HA ARG 125 HA ARG 125 -14.945 2.701 -9.552 851 HB2 ARG 125 1HB ARG 125 -16.213 5.120 -8.446 852 HB3 ARG 125 2HB ARG 125 -14.816 5.577 -9.396 853 HG2 ARG 125 1HG ARG 125 -15.843 4.090 -11.264 854 HG3 ARG 125 2HG ARG 125 -17.320 4.169 -10.253 855 HD2 ARG 125 1HD ARG 125 -16.867 6.740 -10.208 856 HD3 ARG 125 2HD ARG 125 -15.686 6.434 -11.495 857 HE ARG 125 HE ARG 125 -18.339 5.333 -11.989 858 HH11 ARG 125 1HH1 ARG 125 -16.226 8.161 -12.488 859 HH12 ARG 125 2HH1 ARG 125 -17.270 8.922 -13.618 860 HH21 ARG 125 1HH2 ARG 125 -19.770 6.381 -13.389 861 HH22 ARG 125 2HH2 ARG 125 -19.395 7.939 -14.069 862 H GLU 126 H GLU 126 -13.644 5.051 -7.208 863 HA GLU 126 HA GLU 126 -11.283 5.467 -8.774 864 HB2 GLU 126 1HB GLU 126 -12.657 6.626 -6.471 865 HB3 GLU 126 2HB GLU 126 -10.958 6.415 -6.043 866 HG2 GLU 126 1HG GLU 126 -10.175 7.728 -7.787 867 HG3 GLU 126 2HG GLU 126 -11.639 7.534 -8.746 868 H VAL 127 H VAL 127 -11.923 3.807 -5.752 869 HA VAL 127 HA VAL 127 -9.278 3.085 -5.125 870 HB VAL 127 HB VAL 127 -11.836 1.583 -4.509 871 HG11 VAL 127 1HG1 VAL 127 -10.636 0.595 -2.645 872 HG12 VAL 127 2HG1 VAL 127 -9.740 0.209 -4.122 873 HG13 VAL 127 3HG1 VAL 127 -9.138 1.478 -3.052 874 HG21 VAL 127 3HG2 VAL 127 -11.694 2.811 -2.369 875 HG22 VAL 127 1HG2 VAL 127 -10.202 3.622 -2.868 876 HG23 VAL 127 2HG2 VAL 127 -11.730 3.990 -3.675 877 H ASP 128 H ASP 128 -11.756 1.091 -6.838 878 HA ASP 128 HA ASP 128 -10.006 -0.993 -7.639 879 HB2 ASP 128 1HB ASP 128 -12.548 -0.826 -7.715 880 HB3 ASP 128 2HB ASP 128 -12.376 0.038 -9.240 881 H ASP 129 H ASP 129 -10.515 2.246 -9.125 882 HA ASP 129 HA ASP 129 -9.256 1.544 -11.619 883 HB2 ASP 129 1HB ASP 129 -10.745 3.518 -11.312 884 HB3 ASP 129 2HB ASP 129 -9.470 4.309 -10.378 885 H TYR 130 H TYR 130 -8.008 2.831 -8.490 886 HA TYR 130 HA TYR 130 -5.306 3.104 -9.410 887 HB2 TYR 130 1HB TYR 130 -6.113 2.297 -6.625 888 HB3 TYR 130 2HB TYR 130 -4.628 3.074 -7.110 889 HD1 TYR 130 1HD TYR 130 -5.353 5.506 -8.574 890 HD2 TYR 130 2HD TYR 130 -7.340 3.657 -5.238 891 HE1 TYR 130 1HE TYR 130 -6.383 7.663 -8.001 892 HE2 TYR 130 2HE TYR 130 -8.469 5.783 -4.722 893 HH TYR 130 HH TYR 130 -7.665 8.838 -6.410 894 H VAL 131 H VAL 131 -7.153 0.306 -8.102 895 HA VAL 131 HA VAL 131 -4.912 -1.492 -8.075 896 HB VAL 131 HB VAL 131 -7.845 -2.266 -8.442 897 HG11 VAL 131 1HG1 VAL 131 -7.043 -4.317 -7.188 898 HG12 VAL 131 2HG1 VAL 131 -6.306 -4.137 -8.785 899 HG13 VAL 131 3HG1 VAL 131 -5.393 -3.677 -7.333 900 HG21 VAL 131 3HG2 VAL 131 -6.321 -1.931 -5.826 901 HG22 VAL 131 1HG2 VAL 131 -7.549 -0.810 -6.401 902 HG23 VAL 131 2HG2 VAL 131 -8.018 -2.455 -6.037 903 H ALA 132 H ALA 132 -7.272 -0.619 -10.599 904 HA ALA 132 HA ALA 132 -6.305 -2.628 -12.449 905 HB1 ALA 132 1HB ALA 132 -8.659 -1.884 -12.304 906 HB2 ALA 132 2HB ALA 132 -8.172 -0.260 -12.827 907 HB3 ALA 132 3HB ALA 132 -7.985 -1.661 -13.922 908 H GLY 133 H GLY 133 -5.354 0.669 -11.750 909 HA2 GLY 133 1HA GLY 133 -3.860 0.949 -14.302 910 HA3 GLY 133 2HA GLY 133 -4.290 2.215 -13.162 911 H LEU 134 H LEU 134 -3.166 -0.080 -11.111 912 HA LEU 134 HA LEU 134 -0.427 0.971 -11.132 913 HB2 LEU 134 1HB LEU 134 -0.063 -0.115 -9.107 914 HB3 LEU 134 2HB LEU 134 -1.649 0.606 -9.051 915 HG LEU 134 HG LEU 134 -2.552 -1.784 -9.648 916 HD11 LEU 134 1HD1 LEU 134 -0.546 -3.040 -10.086 917 HD12 LEU 134 2HD1 LEU 134 -1.000 -3.507 -8.446 918 HD13 LEU 134 3HD1 LEU 134 0.275 -2.297 -8.720 919 HD21 LEU 134 3HD2 LEU 134 -1.309 -1.143 -6.959 920 HD22 LEU 134 1HD2 LEU 134 -2.629 -2.316 -7.243 921 HD23 LEU 134 2HD2 LEU 134 -2.899 -0.585 -7.511 922 H ARG 135 H ARG 135 1.450 -0.268 -11.540 923 HA ARG 135 HA ARG 135 1.046 -2.414 -13.538 924 HB2 ARG 135 1HB ARG 135 3.568 -0.966 -12.638 925 HB3 ARG 135 2HB ARG 135 3.448 -2.058 -14.012 926 HG2 ARG 135 1HG ARG 135 1.949 -0.432 -15.159 927 HG3 ARG 135 2HG ARG 135 2.043 0.638 -13.757 928 HD2 ARG 135 1HD ARG 135 3.775 1.628 -14.727 929 HD3 ARG 135 2HD ARG 135 4.737 0.243 -14.281 930 HE ARG 135 HE ARG 135 3.707 1.019 -16.919 931 HH11 ARG 135 1HH1 ARG 135 5.573 -1.493 -15.203 932 HH12 ARG 135 2HH1 ARG 135 5.750 -2.458 -16.635 933 HH21 ARG 135 1HH2 ARG 135 4.328 0.012 -18.720 934 HH22 ARG 135 2HH2 ARG 135 5.400 -1.374 -18.692 935 H THR 136 H THR 136 2.485 -4.378 -13.342 936 HA THR 136 HA THR 136 3.176 -5.014 -10.526 937 HB THR 136 HB THR 136 2.203 -6.897 -12.670 938 HG1 THR 136 1HG THR 136 0.626 -5.456 -12.242 939 HG21 THR 136 3HG2 THR 136 3.219 -8.283 -11.111 940 HG22 THR 136 1HG2 THR 136 1.542 -8.270 -10.561 941 HG23 THR 136 2HG2 THR 136 2.777 -7.275 -9.743 942 H GLU 137 H GLU 137 4.529 -4.072 -13.189 943 HA GLU 137 HA GLU 137 6.222 -4.208 -14.464 944 HB2 GLU 137 1HB GLU 137 8.353 -4.561 -13.809 945 HB3 GLU 137 2HB GLU 137 7.540 -3.817 -12.447 946 HG2 GLU 137 1HG GLU 137 7.596 -5.877 -11.176 947 HG3 GLU 137 2HG GLU 137 8.175 -6.789 -12.596 Start of MODEL 10 1 H1 GLY 19 H GLY 19 -8.119 -11.968 -11.182 2 HA2 GLY 19 1HA GLY 19 -9.109 -13.077 -9.273 3 HA3 GLY 19 2HA GLY 19 -8.455 -11.792 -8.242 4 H HIS 20 H HIS 20 -11.169 -12.586 -8.351 5 HA HIS 20 HA HIS 20 -12.323 -9.983 -8.377 6 HB2 HIS 20 1HB HIS 20 -12.589 -10.627 -10.845 7 HB3 HIS 20 2HB HIS 20 -13.657 -11.918 -10.311 8 HD1 HIS 20 1HD HIS 20 -13.452 -8.021 -10.032 9 HD2 HIS 20 2HD HIS 20 -16.151 -11.252 -9.941 10 HE1 HIS 20 1HE HIS 20 -15.780 -7.004 -9.956 11 H MET 21 H MET 21 -11.753 -11.848 -6.377 12 HA MET 21 HA MET 21 -14.418 -12.134 -5.280 13 HB2 MET 21 1HB MET 21 -13.690 -14.403 -6.436 14 HB3 MET 21 2HB MET 21 -12.541 -14.512 -5.109 15 HG2 MET 21 1HG MET 21 -14.263 -15.732 -4.308 16 HG3 MET 21 2HG MET 21 -14.660 -14.191 -3.574 17 HE1 MET 21 3HE MET 21 -16.895 -12.959 -3.966 18 HE2 MET 21 1HE MET 21 -16.402 -12.483 -5.614 19 HE3 MET 21 2HE MET 21 -17.983 -13.220 -5.344 20 H LYS 22 H LYS 22 -14.356 -11.543 -3.218 21 HA LYS 22 HA LYS 22 -13.734 -10.543 -1.391 22 HB2 LYS 22 1HB LYS 22 -12.622 -11.733 0.187 23 HB3 LYS 22 2HB LYS 22 -13.097 -12.979 -0.935 24 HG2 LYS 22 1HG LYS 22 -10.451 -12.168 -1.719 25 HG3 LYS 22 2HG LYS 22 -10.467 -12.197 0.038 26 HD2 LYS 22 1HD LYS 22 -11.475 -14.576 -0.164 27 HD3 LYS 22 2HD LYS 22 -11.086 -14.466 -1.889 28 HE2 LYS 22 1HE LYS 22 -9.058 -15.268 -1.340 29 HE3 LYS 22 2HE LYS 22 -8.703 -13.646 -0.723 30 HZ1 LYS 22 3HZ LYS 22 -8.218 -15.093 1.040 31 HZ2 LYS 22 1HZ LYS 22 -9.512 -16.058 0.730 32 HZ3 LYS 22 2HZ LYS 22 -9.744 -14.598 1.427 33 H PHE 23 H PHE 23 -11.608 -9.686 -0.057 34 HA PHE 23 HA PHE 23 -10.487 -7.514 -1.602 35 HB2 PHE 23 1HB PHE 23 -10.000 -8.770 1.114 36 HB3 PHE 23 2HB PHE 23 -8.895 -7.593 0.460 37 HD1 PHE 23 2HD PHE 23 -9.835 -5.377 -0.410 38 HD2 PHE 23 1HD PHE 23 -11.801 -7.868 2.492 39 HE1 PHE 23 2HE PHE 23 -11.239 -3.453 0.286 40 HE2 PHE 23 1HE PHE 23 -13.072 -5.903 3.317 41 HZ PHE 23 HZ PHE 23 -12.803 -3.685 2.208 42 H THR 24 H THR 24 -8.742 -7.766 -3.043 43 HA THR 24 HA THR 24 -7.212 -10.293 -2.983 44 HB THR 24 HB THR 24 -6.543 -9.795 -5.217 45 HG1 THR 24 1HG THR 24 -6.634 -7.957 -6.155 46 HG21 THR 24 3HG2 THR 24 -9.427 -8.818 -5.135 47 HG22 THR 24 1HG2 THR 24 -8.954 -10.519 -5.010 48 HG23 THR 24 2HG2 THR 24 -8.583 -9.600 -6.480 49 H ASP 25 H ASP 25 -4.727 -9.996 -3.305 50 HA ASP 25 HA ASP 25 -3.621 -8.412 -1.238 51 HB2 ASP 25 1HB ASP 25 -2.358 -9.493 -3.800 52 HB3 ASP 25 2HB ASP 25 -1.455 -8.655 -2.537 53 H GLN 26 H GLN 26 -3.930 -7.770 -4.715 54 HA GLN 26 HA GLN 26 -2.587 -5.305 -4.873 55 HB2 GLN 26 1HB GLN 26 -5.079 -5.799 -6.479 56 HB3 GLN 26 2HB GLN 26 -3.600 -4.933 -6.892 57 HG2 GLN 26 1HG GLN 26 -3.308 -6.783 -8.141 58 HG3 GLN 26 2HG GLN 26 -2.501 -7.336 -6.690 59 HE21 GLN 26 1HE2 GLN 26 -5.860 -7.374 -8.315 60 HE22 GLN 26 2HE2 GLN 26 -5.962 -9.086 -7.988 61 H GLN 27 H GLN 27 -6.034 -6.001 -4.215 62 HA GLN 27 HA GLN 27 -6.984 -3.322 -4.176 63 HB2 GLN 27 1HB GLN 27 -8.036 -5.818 -2.790 64 HB3 GLN 27 2HB GLN 27 -8.949 -4.351 -2.968 65 HG2 GLN 27 1HG GLN 27 -7.883 -5.649 -5.459 66 HG3 GLN 27 2HG GLN 27 -9.204 -6.449 -4.617 67 HE21 GLN 27 1HE2 GLN 27 -8.979 -5.239 -7.320 68 HE22 GLN 27 2HE2 GLN 27 -10.258 -4.054 -7.445 69 H ILE 28 H ILE 28 -5.904 -5.493 -1.510 70 HA ILE 28 HA ILE 28 -6.544 -3.621 0.549 71 HB ILE 28 HB ILE 28 -4.489 -5.858 0.595 72 HG12 ILE 28 1HG1 ILE 28 -7.388 -6.117 1.559 73 HG13 ILE 28 2HG1 ILE 28 -6.967 -6.466 -0.077 74 HG21 ILE 28 1HG2 ILE 28 -6.018 -4.429 2.824 75 HG22 ILE 28 2HG2 ILE 28 -5.049 -5.889 3.068 76 HG23 ILE 28 3HG2 ILE 28 -4.264 -4.395 2.545 77 HD11 ILE 28 3HD1 ILE 28 -5.893 -7.923 2.344 78 HD12 ILE 28 1HD1 ILE 28 -6.825 -8.553 0.964 79 HD13 ILE 28 2HD1 ILE 28 -5.151 -8.062 0.734 80 H GLY 29 H GLY 29 -3.627 -4.153 -1.441 81 HA2 GLY 29 1HA GLY 29 -1.833 -2.508 -0.039 82 HA3 GLY 29 2HA GLY 29 -1.798 -2.818 -1.787 83 H VAL 30 H VAL 30 -4.450 -1.609 -2.311 84 HA VAL 30 HA VAL 30 -3.488 1.100 -2.678 85 HB VAL 30 HB VAL 30 -6.095 -0.340 -3.328 86 HG11 VAL 30 1HG1 VAL 30 -6.728 1.520 -4.710 87 HG12 VAL 30 2HG1 VAL 30 -6.522 2.105 -3.058 88 HG13 VAL 30 3HG1 VAL 30 -5.255 2.415 -4.271 89 HG21 VAL 30 3HG2 VAL 30 -4.154 -1.076 -4.680 90 HG22 VAL 30 1HG2 VAL 30 -5.212 -0.082 -5.687 91 HG23 VAL 30 2HG2 VAL 30 -3.733 0.613 -5.015 92 H LEU 31 H LEU 31 -5.976 -0.449 -0.662 93 HA LEU 31 HA LEU 31 -6.903 1.912 0.689 94 HB2 LEU 31 1HB LEU 31 -7.088 -1.059 1.014 95 HB3 LEU 31 2HB LEU 31 -7.189 -0.145 2.512 96 HG LEU 31 HG LEU 31 -9.093 1.053 1.849 97 HD11 LEU 31 1HD1 LEU 31 -10.252 0.739 -0.301 98 HD12 LEU 31 2HD1 LEU 31 -8.879 -0.223 -0.903 99 HD13 LEU 31 3HD1 LEU 31 -8.678 1.498 -0.515 100 HD21 LEU 31 3HD2 LEU 31 -10.402 -1.255 0.892 101 HD22 LEU 31 1HD2 LEU 31 -10.239 -0.720 2.571 102 HD23 LEU 31 2HD2 LEU 31 -9.061 -1.845 1.867 103 H ALA 32 H ALA 32 -4.370 -0.437 1.599 104 HA ALA 32 HA ALA 32 -3.530 0.688 3.996 105 HB1 ALA 32 1HB ALA 32 -2.656 -1.398 3.472 106 HB2 ALA 32 2HB ALA 32 -2.187 -0.906 1.840 107 HB3 ALA 32 3HB ALA 32 -1.256 -0.322 3.229 108 H GLY 33 H GLY 33 -2.463 1.535 0.665 109 HA2 GLY 33 1HA GLY 33 -0.656 3.606 1.440 110 HA3 GLY 33 2HA GLY 33 -1.409 3.417 -0.153 111 H LEU 34 H LEU 34 -4.227 3.695 0.919 112 HA LEU 34 HA LEU 34 -4.301 6.536 0.783 113 HB2 LEU 34 1HB LEU 34 -6.401 4.528 1.644 114 HB3 LEU 34 2HB LEU 34 -6.718 6.262 1.614 115 HG LEU 34 HG LEU 34 -5.792 4.639 -0.777 116 HD11 LEU 34 1HD1 LEU 34 -8.083 4.880 -1.607 117 HD12 LEU 34 2HD1 LEU 34 -8.542 5.705 -0.091 118 HD13 LEU 34 3HD1 LEU 34 -8.037 4.005 -0.069 119 HD21 LEU 34 3HD2 LEU 34 -6.597 6.803 -1.987 120 HD22 LEU 34 1HD2 LEU 34 -5.047 6.840 -1.173 121 HD23 LEU 34 2HD2 LEU 34 -6.486 7.581 -0.400 122 H ALA 35 H ALA 35 -3.805 4.474 3.467 123 HA ALA 35 HA ALA 35 -4.211 6.720 5.372 124 HB1 ALA 35 1HB ALA 35 -4.387 3.849 5.501 125 HB2 ALA 35 2HB ALA 35 -3.277 4.458 6.763 126 HB3 ALA 35 3HB ALA 35 -4.925 5.071 6.666 127 H ILE 36 H ILE 36 -1.612 5.375 3.481 128 HA ILE 36 HA ILE 36 0.364 6.816 5.135 129 HB ILE 36 HB ILE 36 0.712 4.014 4.020 130 HG12 ILE 36 1HG1 ILE 36 1.817 3.762 6.369 131 HG13 ILE 36 2HG1 ILE 36 1.033 5.277 6.816 132 HG21 ILE 36 1HG2 ILE 36 2.721 5.386 3.402 133 HG22 ILE 36 2HG2 ILE 36 2.869 5.905 5.075 134 HG23 ILE 36 3HG2 ILE 36 3.103 4.201 4.624 135 HD11 ILE 36 3HD1 ILE 36 -0.479 2.839 5.865 136 HD12 ILE 36 1HD1 ILE 36 0.012 3.134 7.555 137 HD13 ILE 36 2HD1 ILE 36 -1.084 4.266 6.745 138 H SER 37 H SER 37 0.260 8.566 3.827 139 HA SER 37 HA SER 37 0.634 9.949 2.122 140 HB2 SER 37 1HB SER 37 2.826 8.425 2.284 141 HB3 SER 37 2HB SER 37 2.389 8.044 0.625 142 HG SER 37 HG SER 37 3.784 9.874 0.925 143 HA PRO 38 HA PRO 38 -2.679 7.712 -0.373 144 HB2 PRO 38 1HB PRO 38 -4.397 9.964 -0.327 145 HB3 PRO 38 2HB PRO 38 -4.514 8.569 0.760 146 HG2 PRO 38 1HG PRO 38 -3.212 11.227 1.262 147 HG3 PRO 38 2HG PRO 38 -4.166 10.211 2.386 148 HD2 PRO 38 1HD PRO 38 -1.473 10.293 2.513 149 HD3 PRO 38 2HD PRO 38 -2.343 8.750 2.759 150 H GLU 39 H GLU 39 -1.646 11.112 -0.426 151 HA GLU 39 HA GLU 39 -2.372 11.635 -3.101 152 HB2 GLU 39 1HB GLU 39 -0.355 13.059 -1.309 153 HB3 GLU 39 2HB GLU 39 -1.067 13.703 -2.796 154 HG2 GLU 39 1HG GLU 39 -3.369 13.227 -1.705 155 HG3 GLU 39 2HG GLU 39 -2.480 12.974 -0.210 156 H TRP 40 H TRP 40 0.684 10.448 -1.688 157 HA TRP 40 HA TRP 40 2.268 10.595 -4.069 158 HB2 TRP 40 1HB TRP 40 3.301 10.140 -1.929 159 HB3 TRP 40 2HB TRP 40 2.311 8.716 -1.681 160 HD1 TRP 40 HD TRP 40 5.251 9.923 -3.789 161 HE1 TRP 40 1HE TRP 40 6.726 7.915 -4.403 162 HE3 TRP 40 3HE TRP 40 2.137 6.210 -2.220 163 HZ2 TRP 40 2HZ TRP 40 6.480 4.977 -4.323 164 HZ3 TRP 40 3HZ TRP 40 2.674 3.848 -2.579 165 HH2 TRP 40 HH TRP 40 4.881 3.211 -3.603 166 H LEU 41 H LEU 41 0.264 7.882 -2.720 167 HA LEU 41 HA LEU 41 0.669 6.157 -4.903 168 HB2 LEU 41 1HB LEU 41 -0.191 5.381 -2.861 169 HB3 LEU 41 2HB LEU 41 -1.617 6.395 -2.914 170 HG LEU 41 HG LEU 41 -1.225 4.429 -5.175 171 HD11 LEU 41 1HD1 LEU 41 -2.178 3.562 -2.421 172 HD12 LEU 41 2HD1 LEU 41 -0.625 3.120 -3.161 173 HD13 LEU 41 3HD1 LEU 41 -2.128 2.568 -3.905 174 HD21 LEU 41 3HD2 LEU 41 -3.212 5.794 -5.273 175 HD22 LEU 41 1HD2 LEU 41 -3.596 5.417 -3.583 176 HD23 LEU 41 2HD2 LEU 41 -3.694 4.155 -4.855 177 H LYS 42 H LYS 42 -2.030 8.476 -4.416 178 HA LYS 42 HA LYS 42 -3.403 7.951 -6.841 179 HB2 LYS 42 1HB LYS 42 -3.164 10.370 -5.019 180 HB3 LYS 42 2HB LYS 42 -4.218 10.389 -6.440 181 HG2 LYS 42 1HG LYS 42 -5.607 8.684 -5.625 182 HG3 LYS 42 2HG LYS 42 -4.458 8.134 -4.412 183 HD2 LYS 42 1HD LYS 42 -4.996 9.753 -2.897 184 HD3 LYS 42 2HD LYS 42 -5.430 10.960 -4.101 185 HE2 LYS 42 1HE LYS 42 -7.143 8.489 -3.863 186 HE3 LYS 42 2HE LYS 42 -7.298 9.741 -2.621 187 HZ1 LYS 42 3HZ LYS 42 -7.346 10.758 -5.317 188 HZ2 LYS 42 1HZ LYS 42 -8.303 11.112 -4.035 189 HZ3 LYS 42 2HZ LYS 42 -8.616 9.789 -4.949 190 H GLN 43 H GLN 43 -0.697 10.340 -6.277 191 HA GLN 43 HA GLN 43 -0.914 11.422 -8.934 192 HB2 GLN 43 1HB GLN 43 1.314 11.424 -6.843 193 HB3 GLN 43 2HB GLN 43 1.410 12.277 -8.390 194 HG2 GLN 43 1HG GLN 43 -0.645 13.570 -7.770 195 HG3 GLN 43 2HG GLN 43 -0.622 12.855 -6.193 196 HE21 GLN 43 1HE2 GLN 43 2.575 12.995 -6.296 197 HE22 GLN 43 2HE2 GLN 43 2.856 14.706 -6.087 198 H ASN 44 H ASN 44 0.984 8.761 -7.470 199 HA ASN 44 HA ASN 44 2.614 8.381 -9.823 200 HB2 ASN 44 1HB ASN 44 1.994 6.579 -7.462 201 HB3 ASN 44 2HB ASN 44 3.016 6.087 -8.820 202 HD21 ASN 44 1HD2 ASN 44 2.897 8.166 -5.986 203 HD22 ASN 44 2HD2 ASN 44 4.572 8.518 -5.983 204 H ILE 45 H ILE 45 -0.503 6.838 -8.747 205 HA ILE 45 HA ILE 45 -0.665 4.971 -10.876 206 HB ILE 45 HB ILE 45 -2.788 6.410 -9.247 207 HG12 ILE 45 1HG1 ILE 45 -1.401 4.784 -7.986 208 HG13 ILE 45 2HG1 ILE 45 -3.079 4.376 -8.036 209 HG21 ILE 45 1HG2 ILE 45 -3.135 4.263 -11.358 210 HG22 ILE 45 2HG2 ILE 45 -4.313 4.554 -10.076 211 HG23 ILE 45 3HG2 ILE 45 -3.942 5.840 -11.226 212 HD11 ILE 45 3HD1 ILE 45 -0.921 3.092 -9.775 213 HD12 ILE 45 1HD1 ILE 45 -1.591 2.414 -8.293 214 HD13 ILE 45 2HD1 ILE 45 -2.629 2.610 -9.704 215 H ALA 46 H ALA 46 -1.692 8.415 -10.749 216 HA ALA 46 HA ALA 46 -3.047 8.489 -13.161 217 HB1 ALA 46 1HB ALA 46 -3.205 10.270 -11.590 218 HB2 ALA 46 2HB ALA 46 -1.485 10.630 -11.667 219 HB3 ALA 46 3HB ALA 46 -2.532 10.963 -13.077 220 H ALA 47 H ALA 47 0.427 8.228 -12.836 221 HA ALA 47 HA ALA 47 0.642 8.440 -15.810 222 HB1 ALA 47 1HB ALA 47 2.612 9.422 -13.730 223 HB2 ALA 47 2HB ALA 47 3.034 9.148 -15.446 224 HB3 ALA 47 3HB ALA 47 1.795 10.317 -14.997 225 H ASN 48 H ASN 48 -0.032 6.167 -14.035 226 HA ASN 48 HA ASN 48 0.471 4.015 -13.585 227 HB2 ASN 48 1HB ASN 48 -0.027 4.121 -16.063 228 HB3 ASN 48 2HB ASN 48 1.711 3.983 -16.357 229 HD21 ASN 48 1HD2 ASN 48 2.719 1.831 -15.970 230 HD22 ASN 48 2HD2 ASN 48 1.641 0.447 -15.801 231 H GLN 49 H GLN 49 2.339 5.798 -12.524 232 HA GLN 49 HA GLN 49 5.102 4.887 -13.064 233 HB2 GLN 49 1HB GLN 49 4.035 6.590 -10.772 234 HB3 GLN 49 2HB GLN 49 5.716 6.434 -11.252 235 HG2 GLN 49 1HG GLN 49 3.580 7.667 -12.998 236 HG3 GLN 49 2HG GLN 49 4.554 8.575 -11.860 237 HE21 GLN 49 1HE2 GLN 49 4.743 6.582 -14.822 238 HE22 GLN 49 2HE2 GLN 49 6.319 7.233 -15.324 239 H LEU 50 H LEU 50 2.491 3.608 -11.306 240 HA LEU 50 HA LEU 50 4.143 3.147 -8.862 241 HB2 LEU 50 1HB LEU 50 1.715 4.366 -9.071 242 HB3 LEU 50 2HB LEU 50 1.186 2.744 -8.842 243 HG LEU 50 HG LEU 50 2.947 4.454 -7.029 244 HD11 LEU 50 1HD1 LEU 50 1.179 4.029 -5.382 245 HD12 LEU 50 2HD1 LEU 50 0.324 2.992 -6.549 246 HD13 LEU 50 3HD1 LEU 50 0.521 4.729 -6.869 247 HD21 LEU 50 3HD2 LEU 50 3.047 2.690 -5.381 248 HD22 LEU 50 1HD2 LEU 50 3.964 2.282 -6.805 249 HD23 LEU 50 2HD2 LEU 50 2.380 1.511 -6.553 250 H VAL 51 H VAL 51 4.790 1.100 -8.411 251 HA VAL 51 HA VAL 51 3.414 -1.152 -9.768 252 HB VAL 51 HB VAL 51 5.862 -0.469 -10.290 253 HG11 VAL 51 1HG1 VAL 51 6.769 -0.235 -8.226 254 HG12 VAL 51 2HG1 VAL 51 6.548 -1.992 -7.870 255 HG13 VAL 51 3HG1 VAL 51 7.588 -1.449 -9.225 256 HG21 VAL 51 3HG2 VAL 51 6.538 -2.780 -10.722 257 HG22 VAL 51 1HG2 VAL 51 5.543 -3.393 -9.381 258 HG23 VAL 51 2HG2 VAL 51 4.792 -2.786 -10.824 259 H TYR 52 H TYR 52 2.869 -2.913 -8.651 260 HA TYR 52 HA TYR 52 3.155 -2.956 -5.688 261 HB2 TYR 52 1HB TYR 52 0.851 -3.170 -6.343 262 HB3 TYR 52 2HB TYR 52 1.244 -4.145 -7.743 263 HD1 TYR 52 1HD TYR 52 1.313 -4.278 -3.979 264 HD2 TYR 52 2HD TYR 52 1.193 -6.474 -7.702 265 HE1 TYR 52 1HE TYR 52 0.957 -6.383 -2.726 266 HE2 TYR 52 2HE TYR 52 0.799 -8.568 -6.462 267 HH TYR 52 HH TYR 52 0.709 -8.719 -2.885 268 H GLY 53 H GLY 53 4.505 -4.691 -4.882 269 HA2 GLY 53 1HA GLY 53 5.166 -6.887 -6.676 270 HA3 GLY 53 2HA GLY 53 6.544 -5.839 -6.284 271 H ILE 54 H ILE 54 6.960 -8.275 -5.451 272 HA ILE 54 HA ILE 54 6.432 -8.280 -2.517 273 HB ILE 54 HB ILE 54 7.025 -10.623 -4.371 274 HG12 ILE 54 1HG1 ILE 54 4.655 -9.824 -4.506 275 HG13 ILE 54 2HG1 ILE 54 4.890 -11.475 -4.004 276 HG21 ILE 54 1HG2 ILE 54 6.647 -10.588 -1.343 277 HG22 ILE 54 2HG2 ILE 54 6.634 -12.051 -2.348 278 HG23 ILE 54 3HG2 ILE 54 8.085 -11.070 -2.254 279 HD11 ILE 54 3HD1 ILE 54 3.077 -10.346 -2.743 280 HD12 ILE 54 1HD1 ILE 54 4.362 -10.918 -1.670 281 HD13 ILE 54 2HD1 ILE 54 4.261 -9.199 -2.095 282 H VAL 55 H VAL 55 8.182 -8.497 -1.243 283 HA VAL 55 HA VAL 55 10.756 -7.656 -1.941 284 HB VAL 55 HB VAL 55 9.507 -9.180 0.368 285 HG11 VAL 55 1HG1 VAL 55 12.408 -8.552 -0.054 286 HG12 VAL 55 2HG1 VAL 55 11.728 -8.434 1.588 287 HG13 VAL 55 3HG1 VAL 55 11.657 -9.963 0.724 288 HG21 VAL 55 3HG2 VAL 55 9.828 -7.045 1.526 289 HG22 VAL 55 1HG2 VAL 55 10.686 -6.396 0.122 290 HG23 VAL 55 2HG2 VAL 55 8.952 -6.766 0.027 291 H LYS 56 H LYS 56 10.022 -10.985 -0.908 292 HA LYS 56 HA LYS 56 11.099 -12.866 -0.952 293 HB2 LYS 56 1HB LYS 56 11.901 -12.003 -3.721 294 HB3 LYS 56 2HB LYS 56 12.286 -13.593 -3.090 295 HG2 LYS 56 1HG LYS 56 9.419 -12.725 -2.901 296 HG3 LYS 56 2HG LYS 56 10.045 -13.013 -4.515 297 HD2 LYS 56 1HD LYS 56 10.702 -15.338 -3.811 298 HD3 LYS 56 2HD LYS 56 10.044 -14.978 -2.196 299 HE2 LYS 56 1HE LYS 56 8.064 -15.746 -2.989 300 HE3 LYS 56 2HE LYS 56 7.947 -14.186 -3.762 301 HZ1 LYS 56 3HZ LYS 56 7.540 -15.737 -5.393 302 HZ2 LYS 56 1HZ LYS 56 8.802 -16.712 -5.028 303 HZ3 LYS 56 2HZ LYS 56 9.043 -15.236 -5.740 304 HA PRO 57 HA PRO 57 15.336 -11.920 0.265 305 HB2 PRO 57 1HB PRO 57 16.505 -14.411 0.263 306 HB3 PRO 57 2HB PRO 57 15.407 -13.806 1.530 307 HG2 PRO 57 1HG PRO 57 14.782 -15.645 -0.749 308 HG3 PRO 57 2HG PRO 57 14.209 -15.738 0.937 309 HD2 PRO 57 1HD PRO 57 12.738 -14.711 -1.175 310 HD3 PRO 57 2HD PRO 57 12.489 -14.189 0.511 311 H SER 58 H SER 58 14.356 -13.062 -2.798 312 HA SER 58 HA SER 58 16.805 -13.207 -4.207 313 HB2 SER 58 1HB SER 58 14.078 -12.388 -5.247 314 HB3 SER 58 2HB SER 58 15.379 -13.216 -6.114 315 HG SER 58 HG SER 58 13.835 -14.706 -5.558 316 H ASP 59 H ASP 59 15.869 -10.479 -2.514 317 HA ASP 59 HA ASP 59 16.913 -8.619 -4.568 318 HB2 ASP 59 1HB ASP 59 14.340 -8.740 -4.425 319 HB3 ASP 59 2HB ASP 59 14.499 -8.008 -2.840 320 H THR 60 H THR 60 17.267 -6.406 -3.423 321 HA THR 60 HA THR 60 18.914 -6.833 -1.011 322 HB THR 60 HB THR 60 18.576 -4.202 -2.476 323 HG1 THR 60 1HG THR 60 19.437 -4.879 -4.176 324 HG21 THR 60 3HG2 THR 60 20.940 -3.951 -1.838 325 HG22 THR 60 1HG2 THR 60 20.964 -5.612 -1.207 326 HG23 THR 60 2HG2 THR 60 19.974 -4.383 -0.407 327 H VAL 61 H VAL 61 17.728 -6.718 0.906 328 HA VAL 61 HA VAL 61 15.780 -4.540 1.240 329 HB VAL 61 HB VAL 61 14.046 -6.258 1.965 330 HG11 VAL 61 1HG1 VAL 61 14.596 -6.251 -1.033 331 HG12 VAL 61 2HG1 VAL 61 13.047 -6.444 -0.216 332 HG13 VAL 61 3HG1 VAL 61 13.870 -4.895 -0.135 333 HG21 VAL 61 3HG2 VAL 61 15.740 -8.192 1.874 334 HG22 VAL 61 1HG2 VAL 61 14.173 -8.512 1.160 335 HG23 VAL 61 2HG2 VAL 61 15.555 -8.162 0.118 336 HA PRO 62 HA PRO 62 17.026 -5.030 5.447 337 HB2 PRO 62 1HB PRO 62 14.884 -3.969 6.818 338 HB3 PRO 62 2HB PRO 62 16.068 -3.000 5.895 339 HG2 PRO 62 1HG PRO 62 13.321 -3.886 5.028 340 HG3 PRO 62 2HG PRO 62 14.107 -2.300 4.796 341 HD2 PRO 62 1HD PRO 62 13.955 -4.293 2.896 342 HD3 PRO 62 2HD PRO 62 15.279 -3.106 2.938 343 H ALA 63 H ALA 63 16.363 -6.109 7.523 344 HA ALA 63 HA ALA 63 15.484 -8.776 6.899 345 HB1 ALA 63 1HB ALA 63 16.139 -7.465 9.569 346 HB2 ALA 63 2HB ALA 63 16.071 -9.202 9.251 347 HB3 ALA 63 3HB ALA 63 17.328 -8.220 8.477 348 H GLY 64 H GLY 64 13.637 -9.915 7.702 349 HA2 GLY 64 1HA GLY 64 11.581 -10.230 8.688 350 HA3 GLY 64 2HA GLY 64 11.735 -8.678 9.499 351 H VAL 65 H VAL 65 11.849 -9.033 5.932 352 HA VAL 65 HA VAL 65 8.975 -8.402 5.724 353 HB VAL 65 HB VAL 65 9.494 -6.803 3.816 354 HG11 VAL 65 1HG1 VAL 65 9.673 -4.865 5.256 355 HG12 VAL 65 2HG1 VAL 65 8.545 -6.066 5.896 356 HG13 VAL 65 3HG1 VAL 65 10.147 -5.896 6.629 357 HG21 VAL 65 3HG2 VAL 65 12.204 -6.523 5.165 358 HG22 VAL 65 1HG2 VAL 65 11.938 -7.284 3.594 359 HG23 VAL 65 2HG2 VAL 65 11.575 -5.571 3.804 360 H ASP 66 H ASP 66 10.581 -10.857 5.482 361 HA ASP 66 HA ASP 66 11.760 -11.155 3.086 362 HB2 ASP 66 1HB ASP 66 11.962 -12.509 5.246 363 HB3 ASP 66 2HB ASP 66 10.558 -13.448 4.703 364 H ASP 67 H ASP 67 8.531 -11.353 3.473 365 HA ASP 67 HA ASP 67 8.033 -12.114 0.661 366 HB2 ASP 67 1HB ASP 67 6.649 -13.898 1.019 367 HB3 ASP 67 2HB ASP 67 7.808 -14.163 2.314 368 H TYR 68 H TYR 68 7.856 -9.701 2.523 369 HA TYR 68 HA TYR 68 5.020 -8.934 2.671 370 HB2 TYR 68 1HB TYR 68 7.620 -7.474 3.086 371 HB3 TYR 68 2HB TYR 68 6.109 -6.623 2.918 372 HD1 TYR 68 2HD TYR 68 6.559 -9.908 4.785 373 HD2 TYR 68 1HD TYR 68 5.729 -5.667 5.018 374 HE1 TYR 68 2HE TYR 68 5.861 -10.169 7.094 375 HE2 TYR 68 1HE TYR 68 4.999 -5.960 7.367 376 HH TYR 68 HH TYR 68 4.650 -9.152 8.859 377 H SER 69 H SER 69 3.961 -7.590 1.287 378 HA SER 69 HA SER 69 5.021 -7.260 -1.411 379 HB2 SER 69 1HB SER 69 2.831 -5.739 -1.459 380 HB3 SER 69 2HB SER 69 2.780 -7.494 -1.648 381 HG SER 69 HG SER 69 2.504 -6.292 0.906 382 H TYR 70 H TYR 70 5.182 -5.121 -2.361 383 HA TYR 70 HA TYR 70 5.368 -2.865 -0.523 384 HB2 TYR 70 1HB TYR 70 7.394 -1.991 -1.606 385 HB3 TYR 70 2HB TYR 70 7.693 -3.483 -0.771 386 HD1 TYR 70 1HD TYR 70 7.031 -2.127 -4.233 387 HD2 TYR 70 2HD TYR 70 8.795 -5.271 -1.850 388 HE1 TYR 70 1HE TYR 70 8.103 -3.025 -6.246 389 HE2 TYR 70 2HE TYR 70 9.929 -6.141 -3.855 390 HH TYR 70 HH TYR 70 10.349 -5.864 -6.102 391 H LEU 71 H LEU 71 5.494 -0.812 -1.854 392 HA LEU 71 HA LEU 71 4.251 -1.006 -4.504 393 HB2 LEU 71 1HB LEU 71 3.442 0.719 -2.151 394 HB3 LEU 71 2HB LEU 71 3.129 1.260 -3.784 395 HG LEU 71 HG LEU 71 2.187 -1.491 -2.973 396 HD11 LEU 71 1HD1 LEU 71 0.744 1.120 -2.408 397 HD12 LEU 71 2HD1 LEU 71 1.456 0.000 -1.216 398 HD13 LEU 71 3HD1 LEU 71 0.072 -0.519 -2.212 399 HD21 LEU 71 3HD2 LEU 71 0.421 -1.094 -4.605 400 HD22 LEU 71 1HD2 LEU 71 1.994 -0.812 -5.362 401 HD23 LEU 71 2HD2 LEU 71 0.990 0.565 -4.873 402 H VAL 72 H VAL 72 5.564 0.416 -6.034 403 HA VAL 72 HA VAL 72 7.138 2.505 -4.677 404 HB VAL 72 HB VAL 72 8.568 0.651 -4.375 405 HG11 VAL 72 1HG1 VAL 72 9.402 -0.879 -5.898 406 HG12 VAL 72 2HG1 VAL 72 7.656 -0.880 -6.152 407 HG13 VAL 72 3HG1 VAL 72 8.739 -0.030 -7.294 408 HG21 VAL 72 3HG2 VAL 72 9.646 2.716 -5.161 409 HG22 VAL 72 1HG2 VAL 72 10.535 1.258 -5.665 410 HG23 VAL 72 2HG2 VAL 72 9.571 2.120 -6.845 411 H ALA 73 H ALA 73 8.063 4.073 -6.181 412 HA ALA 73 HA ALA 73 6.457 4.414 -8.586 413 HB1 ALA 73 1HB ALA 73 6.860 6.305 -7.145 414 HB2 ALA 73 2HB ALA 73 8.605 5.962 -7.146 415 HB3 ALA 73 3HB ALA 73 7.793 6.538 -8.648 416 H ALA 74 H ALA 74 7.095 3.241 -10.248 417 HA ALA 74 HA ALA 74 9.525 1.954 -10.816 418 HB1 ALA 74 1HB ALA 74 7.278 2.854 -12.686 419 HB2 ALA 74 2HB ALA 74 8.400 1.537 -12.978 420 HB3 ALA 74 3HB ALA 74 7.216 1.398 -11.678 421 H ASP 75 H ASP 75 8.821 5.250 -11.118 422 HA ASP 75 HA ASP 75 11.097 5.630 -13.006 423 HB2 ASP 75 1HB ASP 75 9.195 6.854 -13.919 424 HB3 ASP 75 2HB ASP 75 8.730 7.414 -12.305 425 H ASP 76 H ASP 76 9.694 6.391 -9.884 426 HA ASP 76 HA ASP 76 12.012 8.111 -9.256 427 HB2 ASP 76 1HB ASP 76 9.396 8.587 -8.889 428 HB3 ASP 76 2HB ASP 76 9.666 7.667 -7.448 429 H GLN 77 H GLN 77 12.794 5.667 -9.670 430 HA GLN 77 HA GLN 77 12.336 3.802 -7.615 431 HB2 GLN 77 1HB GLN 77 14.329 3.908 -9.867 432 HB3 GLN 77 2HB GLN 77 14.408 2.613 -8.681 433 HG2 GLN 77 1HG GLN 77 11.840 2.298 -9.143 434 HG3 GLN 77 2HG GLN 77 12.136 3.241 -10.588 435 HE21 GLN 77 1HE2 GLN 77 13.210 0.311 -8.778 436 HE22 GLN 77 2HE2 GLN 77 13.703 -0.604 -10.182 437 H ASP 78 H ASP 78 14.290 6.466 -7.125 438 HA ASP 78 HA ASP 78 15.357 5.202 -4.627 439 HB2 ASP 78 1HB ASP 78 17.220 5.562 -6.066 440 HB3 ASP 78 2HB ASP 78 16.761 7.262 -6.309 441 H GLY 79 H GLY 79 12.870 6.846 -5.611 442 HA2 GLY 79 1HA GLY 79 12.929 9.186 -3.879 443 HA3 GLY 79 2HA GLY 79 11.566 8.574 -4.816 444 H THR 80 H THR 80 10.213 6.936 -3.948 445 HA THR 80 HA THR 80 10.460 6.548 -1.002 446 HB THR 80 HB THR 80 7.934 6.964 -2.612 447 HG1 THR 80 1HG THR 80 8.156 9.150 -2.235 448 HG21 THR 80 3HG2 THR 80 7.455 6.100 -0.382 449 HG22 THR 80 1HG2 THR 80 7.014 7.806 -0.442 450 HG23 THR 80 2HG2 THR 80 8.521 7.324 0.359 451 H ILE 81 H ILE 81 9.158 4.662 -0.169 452 HA ILE 81 HA ILE 81 8.072 2.833 -2.046 453 HB ILE 81 HB ILE 81 10.369 2.026 -2.196 454 HG12 ILE 81 1HG1 ILE 81 9.142 0.107 -0.181 455 HG13 ILE 81 2HG1 ILE 81 8.417 0.349 -1.766 456 HG21 ILE 81 1HG2 ILE 81 11.725 1.329 -0.259 457 HG22 ILE 81 2HG2 ILE 81 11.373 3.051 -0.207 458 HG23 ILE 81 3HG2 ILE 81 10.486 1.935 0.850 459 HD11 ILE 81 3HD1 ILE 81 9.864 -1.592 -1.804 460 HD12 ILE 81 1HD1 ILE 81 10.535 -0.335 -2.855 461 HD13 ILE 81 2HD1 ILE 81 11.246 -0.640 -1.249 462 H ILE 82 H ILE 82 6.630 1.305 -0.866 463 HA ILE 82 HA ILE 82 6.501 1.704 2.071 464 HB ILE 82 HB ILE 82 3.997 1.782 0.366 465 HG12 ILE 82 1HG1 ILE 82 5.548 4.237 1.353 466 HG13 ILE 82 2HG1 ILE 82 5.365 3.760 -0.340 467 HG21 ILE 82 1HG2 ILE 82 4.530 2.993 3.086 468 HG22 ILE 82 2HG2 ILE 82 2.976 2.553 2.399 469 HG23 ILE 82 3HG2 ILE 82 4.069 1.276 2.936 470 HD11 ILE 82 3HD1 ILE 82 3.843 5.565 0.194 471 HD12 ILE 82 1HD1 ILE 82 2.987 4.083 -0.261 472 HD13 ILE 82 2HD1 ILE 82 3.048 4.591 1.431 473 H PHE 83 H PHE 83 6.706 -0.342 3.006 474 HA PHE 83 HA PHE 83 5.937 -2.723 1.458 475 HB2 PHE 83 1HB PHE 83 7.278 -2.486 4.174 476 HB3 PHE 83 2HB PHE 83 6.962 -3.965 3.364 477 HD1 PHE 83 2HD PHE 83 8.217 -4.564 1.251 478 HD2 PHE 83 1HD PHE 83 9.102 -1.038 3.545 479 HE1 PHE 83 2HE PHE 83 10.382 -4.287 0.043 480 HE2 PHE 83 1HE PHE 83 11.309 -0.826 2.357 481 HZ PHE 83 HZ PHE 83 11.926 -2.484 0.627 482 H PHE 84 H PHE 84 4.464 -4.388 2.389 483 HA PHE 84 HA PHE 84 3.128 -3.896 4.854 484 HB2 PHE 84 1HB PHE 84 0.827 -3.665 4.043 485 HB3 PHE 84 2HB PHE 84 1.788 -2.318 3.485 486 HD1 PHE 84 2HD PHE 84 2.768 -2.433 1.011 487 HD2 PHE 84 1HD PHE 84 -0.446 -4.939 2.481 488 HE1 PHE 84 2HE PHE 84 2.104 -2.952 -1.295 489 HE2 PHE 84 1HE PHE 84 -1.135 -5.396 0.149 490 HZ PHE 84 HZ PHE 84 0.123 -4.406 -1.741 491 H LYS 85 H LYS 85 1.902 -5.798 5.498 492 HA LYS 85 HA LYS 85 1.496 -7.917 3.469 493 HB2 LYS 85 1HB LYS 85 3.653 -8.254 4.925 494 HB3 LYS 85 2HB LYS 85 2.484 -8.801 6.138 495 HG2 LYS 85 1HG LYS 85 1.485 -10.101 3.959 496 HG3 LYS 85 2HG LYS 85 3.155 -9.891 3.403 497 HD2 LYS 85 1HD LYS 85 3.892 -10.949 5.575 498 HD3 LYS 85 2HD LYS 85 2.152 -11.184 5.924 499 HE2 LYS 85 1HE LYS 85 1.935 -12.549 3.853 500 HE3 LYS 85 2HE LYS 85 3.636 -12.194 3.453 501 HZ1 LYS 85 3HZ LYS 85 2.577 -14.034 5.442 502 HZ2 LYS 85 1HZ LYS 85 4.063 -13.309 5.703 503 HZ3 LYS 85 2HZ LYS 85 3.838 -14.166 4.339 504 H ALA 86 H ALA 86 -0.714 -8.238 3.534 505 HA ALA 86 HA ALA 86 -2.138 -7.614 6.057 506 HB1 ALA 86 1HB ALA 86 -3.181 -6.629 4.182 507 HB2 ALA 86 2HB ALA 86 -3.215 -8.190 3.296 508 HB3 ALA 86 3HB ALA 86 -4.187 -7.953 4.769 509 H GLU 87 H GLU 87 -1.763 -9.136 7.436 510 HA GLU 87 HA GLU 87 -1.364 -11.970 6.726 511 HB2 GLU 87 1HB GLU 87 -1.448 -10.401 9.306 512 HB3 GLU 87 2HB GLU 87 -1.689 -12.154 9.347 513 HG2 GLU 87 1HG GLU 87 0.460 -12.354 7.951 514 HG3 GLU 87 2HG GLU 87 0.738 -10.650 8.351 515 H GLY 88 H GLY 88 -4.123 -10.105 6.836 516 HA2 GLY 88 1HA GLY 88 -6.284 -10.955 6.353 517 HA3 GLY 88 2HA GLY 88 -5.854 -12.532 7.056 518 H GLN 89 H GLN 89 -7.906 -10.227 7.615 519 HA GLN 89 HA GLN 89 -8.727 -8.855 9.158 520 HB2 GLN 89 1HB GLN 89 -7.705 -10.870 11.165 521 HB3 GLN 89 2HB GLN 89 -8.857 -9.601 11.505 522 HG2 GLN 89 1HG GLN 89 -9.329 -11.916 9.590 523 HG3 GLN 89 2HG GLN 89 -10.035 -11.692 11.196 524 HE21 GLN 89 1HE2 GLN 89 -10.608 -11.177 7.885 525 HE22 GLN 89 2HE2 GLN 89 -11.779 -9.865 8.015 526 H THR 90 H THR 90 -5.248 -9.242 9.320 527 HA THR 90 HA THR 90 -5.163 -6.531 10.361 528 HB THR 90 HB THR 90 -3.549 -8.799 11.585 529 HG1 THR 90 1HG THR 90 -5.968 -7.729 12.036 530 HG21 THR 90 3HG2 THR 90 -3.597 -5.829 12.304 531 HG22 THR 90 1HG2 THR 90 -2.203 -6.754 11.683 532 HG23 THR 90 2HG2 THR 90 -2.859 -7.118 13.276 533 H VAL 91 H VAL 91 -3.154 -5.408 9.775 534 HA VAL 91 HA VAL 91 -1.498 -6.692 7.726 535 HB VAL 91 HB VAL 91 -3.396 -5.784 6.643 536 HG11 VAL 91 1HG1 VAL 91 -4.251 -4.101 7.855 537 HG12 VAL 91 2HG1 VAL 91 -2.885 -3.010 7.400 538 HG13 VAL 91 3HG1 VAL 91 -3.999 -3.667 6.168 539 HG21 VAL 91 3HG2 VAL 91 -1.090 -5.586 5.471 540 HG22 VAL 91 1HG2 VAL 91 -2.297 -4.470 4.840 541 HG23 VAL 91 2HG2 VAL 91 -1.064 -3.910 5.986 542 H ILE 92 H ILE 92 0.498 -6.457 8.438 543 HA ILE 92 HA ILE 92 1.275 -4.126 10.017 544 HB ILE 92 HB ILE 92 2.924 -6.461 8.979 545 HG12 ILE 92 1HG1 ILE 92 2.877 -7.105 11.450 546 HG13 ILE 92 2HG1 ILE 92 1.508 -6.026 11.662 547 HG21 ILE 92 1HG2 ILE 92 4.197 -4.375 9.548 548 HG22 ILE 92 2HG2 ILE 92 3.499 -4.412 11.176 549 HG23 ILE 92 3HG2 ILE 92 4.573 -5.717 10.627 550 HD11 ILE 92 3HD1 ILE 92 0.098 -7.476 10.354 551 HD12 ILE 92 1HD1 ILE 92 1.508 -8.348 9.677 552 HD13 ILE 92 2HD1 ILE 92 1.064 -8.539 11.382 553 H ILE 93 H ILE 93 1.429 -2.305 8.888 554 HA ILE 93 HA ILE 93 2.594 -2.241 6.157 555 HB ILE 93 HB ILE 93 1.326 0.005 7.766 556 HG12 ILE 93 1HG1 ILE 93 0.085 -1.879 5.703 557 HG13 ILE 93 2HG1 ILE 93 -0.349 -1.755 7.423 558 HG21 ILE 93 1HG2 ILE 93 1.878 -0.277 4.789 559 HG22 ILE 93 2HG2 ILE 93 1.249 1.165 5.602 560 HG23 ILE 93 3HG2 ILE 93 2.909 0.645 5.893 561 HD11 ILE 93 3HD1 ILE 93 -1.050 0.578 7.078 562 HD12 ILE 93 1HD1 ILE 93 -0.841 0.359 5.329 563 HD13 ILE 93 2HD1 ILE 93 -2.019 -0.637 6.198 564 H LYS 94 H LYS 94 4.653 -1.588 5.855 565 HA LYS 94 HA LYS 94 6.285 -0.564 8.162 566 HB2 LYS 94 1HB LYS 94 6.704 -2.916 6.317 567 HB3 LYS 94 2HB LYS 94 8.074 -2.086 6.903 568 HG2 LYS 94 1HG LYS 94 7.289 -2.442 9.270 569 HG3 LYS 94 2HG LYS 94 5.949 -3.394 8.632 570 HD2 LYS 94 1HD LYS 94 7.546 -5.018 7.675 571 HD3 LYS 94 2HD LYS 94 8.911 -4.023 8.231 572 HE2 LYS 94 1HE LYS 94 8.068 -4.315 10.600 573 HE3 LYS 94 2HE LYS 94 6.816 -5.394 9.979 574 HZ1 LYS 94 3HZ LYS 94 8.497 -6.702 10.777 575 HZ2 LYS 94 1HZ LYS 94 9.724 -5.902 10.065 576 HZ3 LYS 94 2HZ LYS 94 8.706 -6.844 9.170 577 H TYR 95 H TYR 95 6.487 1.627 7.450 578 HA TYR 95 HA TYR 95 7.298 1.969 4.587 579 HB2 TYR 95 1HB TYR 95 6.163 4.106 4.664 580 HB3 TYR 95 2HB TYR 95 5.101 2.756 5.059 581 HD1 TYR 95 1HD TYR 95 7.066 5.512 6.665 582 HD2 TYR 95 2HD TYR 95 3.797 2.716 6.948 583 HE1 TYR 95 1HE TYR 95 6.380 6.564 8.768 584 HE2 TYR 95 2HE TYR 95 3.083 3.731 9.080 585 HH TYR 95 HH TYR 95 4.718 6.718 10.328 586 H THR 96 H THR 96 8.620 3.994 4.152 587 HA THR 96 HA THR 96 10.136 5.056 6.378 588 HB THR 96 HB THR 96 11.431 3.059 5.807 589 HG1 THR 96 1HG THR 96 13.382 4.232 5.407 590 HG21 THR 96 3HG2 THR 96 10.819 2.838 3.373 591 HG22 THR 96 1HG2 THR 96 12.553 2.808 3.642 592 HG23 THR 96 2HG2 THR 96 11.772 4.276 3.009 593 H SER 97 H SER 97 11.569 6.801 5.536 594 HA SER 97 HA SER 97 10.404 8.341 3.277 595 HB2 SER 97 1HB SER 97 11.551 10.259 4.616 596 HB3 SER 97 2HB SER 97 10.044 9.557 5.199 597 HG SER 97 HG SER 97 12.620 9.317 6.282 598 H GLN 98 H GLN 98 12.912 6.358 4.047 599 HA GLN 98 HA GLN 98 14.675 7.575 1.958 600 HB2 GLN 98 1HB GLN 98 15.559 6.474 4.647 601 HB3 GLN 98 2HB GLN 98 16.657 6.700 3.288 602 HG2 GLN 98 1HG GLN 98 16.365 9.089 3.332 603 HG3 GLN 98 2HG GLN 98 15.070 8.965 4.537 604 HE21 GLN 98 1HE2 GLN 98 18.507 9.180 4.117 605 HE22 GLN 98 2HE2 GLN 98 18.955 8.860 5.779 606 H ARG 99 H ARG 99 15.176 6.107 0.447 607 HA ARG 99 HA ARG 99 14.121 3.502 0.439 608 HB2 ARG 99 1HB ARG 99 16.269 4.953 -1.152 609 HB3 ARG 99 2HB ARG 99 15.978 3.269 -1.494 610 HG2 ARG 99 1HG ARG 99 13.472 4.883 -1.200 611 HG3 ARG 99 2HG ARG 99 14.539 5.465 -2.443 612 HD2 ARG 99 1HD ARG 99 12.670 3.754 -2.957 613 HD3 ARG 99 2HD ARG 99 14.220 3.677 -3.811 614 HE ARG 99 HE ARG 99 14.578 1.886 -1.769 615 HH11 ARG 99 1HH1 ARG 99 12.331 2.393 -4.490 616 HH12 ARG 99 2HH1 ARG 99 12.194 0.666 -4.789 617 HH21 ARG 99 1HH2 ARG 99 14.260 -0.487 -2.282 618 HH22 ARG 99 2HH2 ARG 99 13.077 -0.833 -3.506 619 H ASN 100 H ASN 100 17.031 4.544 1.980 620 HA ASN 100 HA ASN 100 18.141 1.896 1.928 621 HB2 ASN 100 1HB ASN 100 20.212 3.029 2.932 622 HB3 ASN 100 2HB ASN 100 19.772 3.369 1.277 623 HD21 ASN 100 1HD2 ASN 100 18.784 5.277 0.764 624 HD22 ASN 100 2HD2 ASN 100 19.007 6.740 1.706 625 H THR 101 H THR 101 16.105 3.071 4.036 626 HA THR 101 HA THR 101 17.654 2.133 6.452 627 HB THR 101 HB THR 101 16.387 3.748 7.776 628 HG1 THR 101 1HG THR 101 15.213 5.329 6.588 629 HG21 THR 101 3HG2 THR 101 18.585 4.323 6.602 630 HG22 THR 101 1HG2 THR 101 17.563 5.702 7.024 631 HG23 THR 101 2HG2 THR 101 17.621 5.123 5.352 632 H LYS 102 H LYS 102 16.352 1.500 8.437 633 HA LYS 102 HA LYS 102 14.598 -0.700 7.703 634 HB2 LYS 102 1HB LYS 102 16.282 -0.739 9.565 635 HB3 LYS 102 2HB LYS 102 15.314 0.410 10.469 636 HG2 LYS 102 1HG LYS 102 13.871 -2.027 9.489 637 HG3 LYS 102 2HG LYS 102 15.166 -2.354 10.628 638 HD2 LYS 102 1HD LYS 102 14.154 -1.300 12.399 639 HD3 LYS 102 2HD LYS 102 13.197 -0.204 11.380 640 HE2 LYS 102 1HE LYS 102 11.716 -1.955 10.689 641 HE3 LYS 102 2HE LYS 102 12.737 -3.212 11.403 642 HZ1 LYS 102 3HZ LYS 102 12.155 -2.395 13.560 643 HZ2 LYS 102 1HZ LYS 102 10.805 -2.766 12.705 644 HZ3 LYS 102 2HZ LYS 102 11.226 -1.182 12.923 645 H LEU 103 H LEU 103 12.355 -0.921 8.480 646 HA LEU 103 HA LEU 103 10.956 1.534 7.777 647 HB2 LEU 103 1HB LEU 103 10.012 -1.330 8.208 648 HB3 LEU 103 2HB LEU 103 8.995 -0.077 7.600 649 HG LEU 103 HG LEU 103 9.518 -1.049 5.659 650 HD11 LEU 103 1HD1 LEU 103 10.273 1.233 5.374 651 HD12 LEU 103 2HD1 LEU 103 11.191 0.137 4.357 652 HD13 LEU 103 3HD1 LEU 103 11.948 0.767 5.813 653 HD21 LEU 103 3HD2 LEU 103 10.917 -2.810 6.524 654 HD22 LEU 103 1HD2 LEU 103 12.335 -1.732 6.534 655 HD23 LEU 103 2HD2 LEU 103 11.548 -2.177 5.008 656 H LYS 104 H LYS 104 8.939 2.112 8.795 657 HA LYS 104 HA LYS 104 8.916 2.175 11.743 658 HB2 LYS 104 1HB LYS 104 7.166 3.342 9.524 659 HB3 LYS 104 2HB LYS 104 6.640 3.347 11.199 660 HG2 LYS 104 1HG LYS 104 7.553 5.449 10.890 661 HG3 LYS 104 2HG LYS 104 8.754 4.564 11.817 662 HD2 LYS 104 1HD LYS 104 10.115 4.248 9.771 663 HD3 LYS 104 2HD LYS 104 8.849 5.040 8.812 664 HE2 LYS 104 1HE LYS 104 9.191 7.133 10.129 665 HE3 LYS 104 2HE LYS 104 10.478 6.328 11.050 666 HZ1 LYS 104 3HZ LYS 104 11.306 7.680 9.198 667 HZ2 LYS 104 1HZ LYS 104 10.471 6.775 8.142 668 HZ3 LYS 104 2HZ LYS 104 11.715 6.075 9.012 669 H ALA 105 H ALA 105 6.236 1.761 12.385 670 HA ALA 105 HA ALA 105 5.477 -0.888 11.366 671 HB1 ALA 105 1HB ALA 105 7.033 -1.465 13.175 672 HB2 ALA 105 2HB ALA 105 6.140 -0.404 14.309 673 HB3 ALA 105 3HB ALA 105 5.370 -1.851 13.640 674 H LYS 106 H LYS 106 3.540 -0.003 10.585 675 HA LYS 106 HA LYS 106 1.544 0.821 12.662 676 HB2 LYS 106 1HB LYS 106 1.912 2.474 10.785 677 HB3 LYS 106 2HB LYS 106 1.529 1.189 9.646 678 HG2 LYS 106 1HG LYS 106 -0.418 2.242 9.636 679 HG3 LYS 106 2HG LYS 106 -0.776 1.114 10.944 680 HD2 LYS 106 1HD LYS 106 -0.569 2.829 12.596 681 HD3 LYS 106 2HD LYS 106 0.222 3.953 11.457 682 HE2 LYS 106 1HE LYS 106 -1.795 4.075 10.081 683 HE3 LYS 106 2HE LYS 106 -2.605 2.885 11.118 684 HZ1 LYS 106 3HZ LYS 106 -2.397 4.567 12.957 685 HZ2 LYS 106 1HZ LYS 106 -3.369 5.027 11.734 686 HZ3 LYS 106 2HZ LYS 106 -1.870 5.648 11.807 687 H ALA 107 H ALA 107 -0.366 -0.612 12.665 688 HA ALA 107 HA ALA 107 -0.330 -2.882 10.810 689 HB1 ALA 107 1HB ALA 107 0.809 -3.743 12.793 690 HB2 ALA 107 2HB ALA 107 -0.545 -3.207 13.816 691 HB3 ALA 107 3HB ALA 107 -0.791 -4.489 12.605 692 H LEU 108 H LEU 108 -2.692 -3.123 9.954 693 HA LEU 108 HA LEU 108 -4.615 -1.658 11.778 694 HB2 LEU 108 1HB LEU 108 -4.298 -1.551 8.780 695 HB3 LEU 108 2HB LEU 108 -5.819 -1.170 9.618 696 HG LEU 108 HG LEU 108 -5.039 0.897 9.288 697 HD11 LEU 108 1HD1 LEU 108 -4.327 1.956 11.259 698 HD12 LEU 108 2HD1 LEU 108 -3.482 0.520 11.857 699 HD13 LEU 108 3HD1 LEU 108 -5.274 0.575 11.795 700 HD21 LEU 108 3HD2 LEU 108 -2.197 -0.062 9.722 701 HD22 LEU 108 1HD2 LEU 108 -2.705 1.608 9.285 702 HD23 LEU 108 2HD2 LEU 108 -3.014 0.268 8.190 703 H THR 109 H THR 109 -6.845 -2.536 11.611 704 HA THR 109 HA THR 109 -6.733 -5.359 10.899 705 HB THR 109 HB THR 109 -9.131 -5.455 11.387 706 HG1 THR 109 1HG THR 109 -9.066 -2.946 12.580 707 HG21 THR 109 3HG2 THR 109 -7.553 -4.131 13.638 708 HG22 THR 109 1HG2 THR 109 -7.361 -5.822 13.127 709 HG23 THR 109 2HG2 THR 109 -8.915 -5.278 13.751 710 H LEU 110 H LEU 110 -8.074 -6.319 9.103 711 HA LEU 110 HA LEU 110 -8.127 -4.739 6.688 712 HB2 LEU 110 1HB LEU 110 -9.650 -7.211 7.631 713 HB3 LEU 110 2HB LEU 110 -9.871 -6.496 6.053 714 HG LEU 110 HG LEU 110 -7.264 -7.660 7.082 715 HD11 LEU 110 1HD1 LEU 110 -9.205 -8.589 4.934 716 HD12 LEU 110 2HD1 LEU 110 -9.129 -9.270 6.557 717 HD13 LEU 110 3HD1 LEU 110 -7.731 -9.431 5.466 718 HD21 LEU 110 3HD2 LEU 110 -7.981 -6.410 4.391 719 HD22 LEU 110 1HD2 LEU 110 -6.537 -7.421 4.666 720 HD23 LEU 110 2HD2 LEU 110 -6.715 -5.878 5.506 721 H SER 111 H SER 111 -10.418 -5.260 9.346 722 HA SER 111 HA SER 111 -12.585 -4.090 7.975 723 HB2 SER 111 1HB SER 111 -12.461 -5.611 10.126 724 HB3 SER 111 2HB SER 111 -12.409 -4.070 10.985 725 HG SER 111 HG SER 111 -14.555 -5.129 10.436 726 H GLN 112 H GLN 112 -10.043 -2.674 10.079 727 HA GLN 112 HA GLN 112 -10.963 -0.069 10.283 728 HB2 GLN 112 1HB GLN 112 -8.311 -1.368 10.407 729 HB3 GLN 112 2HB GLN 112 -8.230 0.241 9.746 730 HG2 GLN 112 1HG GLN 112 -8.200 1.072 11.775 731 HG3 GLN 112 2HG GLN 112 -9.862 0.574 12.017 732 HE21 GLN 112 1HE2 GLN 112 -10.196 -0.744 13.687 733 HE22 GLN 112 2HE2 GLN 112 -8.982 -1.591 14.617 734 H LEU 113 H LEU 113 -8.859 -1.419 7.672 735 HA LEU 113 HA LEU 113 -8.796 0.877 6.088 736 HB2 LEU 113 1HB LEU 113 -8.566 -2.085 5.391 737 HB3 LEU 113 2HB LEU 113 -8.533 -0.879 4.155 738 HG LEU 113 HG LEU 113 -6.318 -1.411 4.520 739 HD11 LEU 113 1HD1 LEU 113 -5.290 0.663 5.140 740 HD12 LEU 113 2HD1 LEU 113 -6.669 1.157 6.104 741 HD13 LEU 113 3HD1 LEU 113 -6.823 1.067 4.351 742 HD21 LEU 113 3HD2 LEU 113 -6.479 -2.498 6.703 743 HD22 LEU 113 1HD2 LEU 113 -6.680 -0.910 7.491 744 HD23 LEU 113 2HD2 LEU 113 -5.165 -1.314 6.658 745 H LYS 114 H LYS 114 -11.266 -1.642 6.116 746 HA LYS 114 HA LYS 114 -12.599 -0.717 3.724 747 HB2 LYS 114 1HB LYS 114 -12.927 -2.965 4.613 748 HB3 LYS 114 2HB LYS 114 -13.623 -2.328 6.096 749 HG2 LYS 114 1HG LYS 114 -14.895 -1.717 3.398 750 HG3 LYS 114 2HG LYS 114 -15.149 -3.253 4.192 751 HD2 LYS 114 1HD LYS 114 -16.036 -2.162 6.203 752 HD3 LYS 114 2HD LYS 114 -15.942 -0.583 5.424 753 HE2 LYS 114 1HE LYS 114 -17.389 -2.843 4.075 754 HE3 LYS 114 2HE LYS 114 -18.187 -1.991 5.398 755 HZ1 LYS 114 3HZ LYS 114 -18.036 0.034 4.188 756 HZ2 LYS 114 1HZ LYS 114 -18.664 -1.086 3.160 757 HZ3 LYS 114 2HZ LYS 114 -17.094 -0.625 3.019 758 H LYS 115 H LYS 115 -12.956 0.054 7.207 759 HA LYS 115 HA LYS 115 -15.324 1.689 6.780 760 HB2 LYS 115 1HB LYS 115 -13.851 0.570 9.000 761 HB3 LYS 115 2HB LYS 115 -13.779 2.289 9.163 762 HG2 LYS 115 1HG LYS 115 -15.661 1.905 10.310 763 HG3 LYS 115 2HG LYS 115 -16.402 2.201 8.751 764 HD2 LYS 115 1HD LYS 115 -15.650 -0.616 9.645 765 HD3 LYS 115 2HD LYS 115 -17.124 0.128 10.232 766 HE2 LYS 115 1HE LYS 115 -16.607 -0.023 7.266 767 HE3 LYS 115 2HE LYS 115 -17.206 -1.425 8.149 768 HZ1 LYS 115 3HZ LYS 115 -19.094 -0.120 8.907 769 HZ2 LYS 115 1HZ LYS 115 -19.051 -0.114 7.296 770 HZ3 LYS 115 2HZ LYS 115 -18.565 1.206 8.107 771 H GLU 116 H GLU 116 -11.807 2.277 6.980 772 HA GLU 116 HA GLU 116 -11.965 5.137 6.954 773 HB2 GLU 116 1HB GLU 116 -9.784 3.233 6.012 774 HB3 GLU 116 2HB GLU 116 -9.625 4.961 6.175 775 HG2 GLU 116 1HG GLU 116 -10.639 3.890 8.672 776 HG3 GLU 116 2HG GLU 116 -9.294 2.922 8.160 777 H PHE 117 H PHE 117 -11.214 2.825 4.272 778 HA PHE 117 HA PHE 117 -11.939 4.988 2.350 779 HB2 PHE 117 1HB PHE 117 -9.670 3.095 1.899 780 HB3 PHE 117 2HB PHE 117 -9.994 4.669 1.212 781 HD1 PHE 117 1HD PHE 117 -9.832 6.717 2.862 782 HD2 PHE 117 2HD PHE 117 -8.071 2.846 3.569 783 HE1 PHE 117 1HE PHE 117 -8.245 7.735 4.492 784 HE2 PHE 117 2HE PHE 117 -6.551 3.854 5.237 785 HZ PHE 117 HZ PHE 117 -6.637 6.306 5.695 786 H TYR 118 H TYR 118 -13.378 2.257 3.107 787 HA TYR 118 HA TYR 118 -13.957 1.920 0.248 788 HB2 TYR 118 1HB TYR 118 -12.336 0.039 1.241 789 HB3 TYR 118 2HB TYR 118 -13.831 -0.725 1.602 790 HD1 TYR 118 2HD TYR 118 -12.427 1.286 -1.324 791 HD2 TYR 118 1HD TYR 118 -14.481 -2.299 -0.030 792 HE1 TYR 118 2HE TYR 118 -12.368 0.407 -3.651 793 HE2 TYR 118 1HE TYR 118 -14.418 -3.164 -2.346 794 HH TYR 118 HH TYR 118 -12.383 -1.833 -4.733 795 H GLN 119 H GLN 119 -15.750 3.303 1.159 796 HA GLN 119 HA GLN 119 -17.785 1.717 2.579 797 HB2 GLN 119 1HB GLN 119 -18.309 3.717 3.843 798 HB3 GLN 119 2HB GLN 119 -16.568 3.400 3.890 799 HG2 GLN 119 1HG GLN 119 -16.715 5.078 1.719 800 HG3 GLN 119 2HG GLN 119 -18.060 5.677 2.688 801 HE21 GLN 119 1HE2 GLN 119 -14.667 5.722 2.162 802 HE22 GLN 119 2HE2 GLN 119 -14.121 6.298 3.695 803 H THR 120 H THR 120 -17.495 3.904 -0.215 804 HA THR 120 HA THR 120 -20.409 3.580 -0.724 805 HB THR 120 HB THR 120 -20.111 5.699 0.355 806 HG1 THR 120 1HG THR 120 -20.385 7.145 -1.604 807 HG21 THR 120 3HG2 THR 120 -17.940 6.421 -1.659 808 HG22 THR 120 1HG2 THR 120 -17.681 6.072 0.057 809 HG23 THR 120 2HG2 THR 120 -18.622 7.468 -0.382 810 H ARG 121 H ARG 121 -20.938 3.749 -3.067 811 HA ARG 121 HA ARG 121 -19.099 2.256 -4.668 812 HB2 ARG 121 1HB ARG 121 -21.342 4.143 -5.436 813 HB3 ARG 121 2HB ARG 121 -20.477 3.204 -6.631 814 HG2 ARG 121 1HG ARG 121 -21.783 1.467 -6.401 815 HG3 ARG 121 2HG ARG 121 -21.278 1.264 -4.709 816 HD2 ARG 121 1HD ARG 121 -23.041 2.679 -3.920 817 HD3 ARG 121 2HD ARG 121 -23.399 3.262 -5.532 818 HE ARG 121 HE ARG 121 -24.120 1.016 -6.194 819 HH11 ARG 121 1HH1 ARG 121 -24.190 1.818 -2.704 820 HH12 ARG 121 2HH1 ARG 121 -25.807 1.211 -2.515 821 HH21 ARG 121 1HH2 ARG 121 -26.154 0.103 -5.850 822 HH22 ARG 121 2HH2 ARG 121 -26.866 0.082 -4.249 823 H SER 122 H SER 122 -19.463 5.761 -4.323 824 HA SER 122 HA SER 122 -18.109 6.629 -6.585 825 HB2 SER 122 1HB SER 122 -18.196 7.598 -3.727 826 HB3 SER 122 2HB SER 122 -17.515 8.565 -5.073 827 HG SER 122 HG SER 122 -19.429 8.737 -5.966 828 H GLN 123 H GLN 123 -16.621 5.528 -3.399 829 HA GLN 123 HA GLN 123 -14.017 6.116 -4.598 830 HB2 GLN 123 1HB GLN 123 -13.038 5.775 -2.640 831 HB3 GLN 123 2HB GLN 123 -14.654 6.004 -2.011 832 HG2 GLN 123 1HG GLN 123 -13.548 3.212 -2.538 833 HG3 GLN 123 2HG GLN 123 -13.214 4.138 -1.091 834 HE21 GLN 123 1HE2 GLN 123 -15.093 1.642 -1.825 835 HE22 GLN 123 2HE2 GLN 123 -16.625 2.159 -1.165 836 H LYS 124 H LYS 124 -16.172 3.348 -4.343 837 HA LYS 124 HA LYS 124 -14.310 1.365 -5.340 838 HB2 LYS 124 1HB LYS 124 -17.328 1.405 -5.671 839 HB3 LYS 124 2HB LYS 124 -16.251 0.058 -5.956 840 HG2 LYS 124 1HG LYS 124 -15.554 0.314 -3.457 841 HG3 LYS 124 2HG LYS 124 -17.001 1.315 -3.313 842 HD2 LYS 124 1HD LYS 124 -17.392 -1.018 -2.607 843 HD3 LYS 124 2HD LYS 124 -18.424 -0.541 -3.973 844 HE2 LYS 124 1HE LYS 124 -16.922 -1.680 -5.545 845 HE3 LYS 124 2HE LYS 124 -15.766 -2.026 -4.259 846 HZ1 LYS 124 3HZ LYS 124 -17.473 -3.472 -3.288 847 HZ2 LYS 124 1HZ LYS 124 -16.991 -3.916 -4.811 848 HZ3 LYS 124 2HZ LYS 124 -18.448 -3.203 -4.604 849 H ARG 125 H ARG 125 -15.421 4.094 -7.020 850 HA ARG 125 HA ARG 125 -14.821 2.768 -9.642 851 HB2 ARG 125 1HB ARG 125 -15.458 5.633 -8.834 852 HB3 ARG 125 2HB ARG 125 -14.535 5.290 -10.298 853 HG2 ARG 125 1HG ARG 125 -16.898 5.548 -10.761 854 HG3 ARG 125 2HG ARG 125 -16.274 3.969 -11.244 855 HD2 ARG 125 1HD ARG 125 -17.329 2.911 -9.312 856 HD3 ARG 125 2HD ARG 125 -17.824 4.496 -8.668 857 HE ARG 125 HE ARG 125 -18.927 4.505 -11.142 858 HH11 ARG 125 1HH1 ARG 125 -19.166 1.873 -8.746 859 HH12 ARG 125 2HH1 ARG 125 -20.903 1.776 -8.937 860 HH21 ARG 125 1HH2 ARG 125 -21.026 4.206 -11.493 861 HH22 ARG 125 2HH2 ARG 125 -22.002 3.123 -10.521 862 H GLU 126 H GLU 126 -13.375 5.587 -8.043 863 HA GLU 126 HA GLU 126 -11.033 5.239 -9.390 864 HB2 GLU 126 1HB GLU 126 -12.133 6.974 -7.331 865 HB3 GLU 126 2HB GLU 126 -10.446 6.681 -6.930 866 HG2 GLU 126 1HG GLU 126 -9.660 7.753 -8.808 867 HG3 GLU 126 2HG GLU 126 -11.032 7.261 -9.808 868 H VAL 127 H VAL 127 -11.577 4.347 -6.052 869 HA VAL 127 HA VAL 127 -9.003 3.375 -5.392 870 HB VAL 127 HB VAL 127 -11.629 2.404 -4.277 871 HG11 VAL 127 1HG1 VAL 127 -8.840 2.399 -3.068 872 HG12 VAL 127 2HG1 VAL 127 -10.337 1.999 -2.213 873 HG13 VAL 127 3HG1 VAL 127 -9.783 0.975 -3.532 874 HG21 VAL 127 3HG2 VAL 127 -9.805 4.671 -3.322 875 HG22 VAL 127 1HG2 VAL 127 -11.405 4.905 -4.025 876 HG23 VAL 127 2HG2 VAL 127 -11.235 4.080 -2.459 877 H ASP 128 H ASP 128 -11.660 1.756 -7.086 878 HA ASP 128 HA ASP 128 -10.256 -0.830 -7.167 879 HB2 ASP 128 1HB ASP 128 -12.780 -0.406 -6.994 880 HB3 ASP 128 2HB ASP 128 -12.715 -0.040 -8.722 881 H ASP 129 H ASP 129 -10.753 2.006 -9.270 882 HA ASP 129 HA ASP 129 -9.499 0.852 -11.599 883 HB2 ASP 129 1HB ASP 129 -10.238 3.650 -10.739 884 HB3 ASP 129 2HB ASP 129 -9.089 3.441 -12.056 885 H TYR 130 H TYR 130 -8.168 2.561 -8.739 886 HA TYR 130 HA TYR 130 -5.463 2.799 -9.687 887 HB2 TYR 130 1HB TYR 130 -6.359 2.155 -6.893 888 HB3 TYR 130 2HB TYR 130 -4.828 2.867 -7.367 889 HD1 TYR 130 1HD TYR 130 -6.198 5.024 -9.372 890 HD2 TYR 130 2HD TYR 130 -6.958 3.728 -5.354 891 HE1 TYR 130 1HE TYR 130 -7.075 7.273 -8.817 892 HE2 TYR 130 2HE TYR 130 -7.940 5.944 -4.811 893 HH TYR 130 HH TYR 130 -7.725 8.662 -7.048 894 H VAL 131 H VAL 131 -7.320 -0.027 -8.695 895 HA VAL 131 HA VAL 131 -4.934 -1.695 -8.378 896 HB VAL 131 HB VAL 131 -7.878 -2.489 -8.511 897 HG11 VAL 131 1HG1 VAL 131 -6.656 -4.448 -8.940 898 HG12 VAL 131 2HG1 VAL 131 -5.356 -3.978 -7.846 899 HG13 VAL 131 3HG1 VAL 131 -6.930 -4.512 -7.205 900 HG21 VAL 131 3HG2 VAL 131 -7.792 -2.635 -6.094 901 HG22 VAL 131 1HG2 VAL 131 -6.075 -2.185 -6.076 902 HG23 VAL 131 2HG2 VAL 131 -7.313 -1.002 -6.539 903 H ALA 132 H ALA 132 -6.699 -0.410 -11.035 904 HA ALA 132 HA ALA 132 -5.653 -2.515 -12.860 905 HB1 ALA 132 1HB ALA 132 -7.188 -1.616 -14.481 906 HB2 ALA 132 2HB ALA 132 -8.086 -2.041 -13.010 907 HB3 ALA 132 3HB ALA 132 -7.711 -0.338 -13.369 908 H GLY 133 H GLY 133 -5.213 0.763 -11.778 909 HA2 GLY 133 1HA GLY 133 -3.557 1.559 -14.084 910 HA3 GLY 133 2HA GLY 133 -4.060 2.544 -12.710 911 H LEU 134 H LEU 134 -2.697 -0.591 -11.971 912 HA LEU 134 HA LEU 134 -0.176 0.716 -11.135 913 HB2 LEU 134 1HB LEU 134 0.051 -1.003 -9.409 914 HB3 LEU 134 2HB LEU 134 -1.289 0.104 -9.201 915 HG LEU 134 HG LEU 134 -2.828 -1.749 -10.091 916 HD11 LEU 134 1HD1 LEU 134 -0.432 -3.514 -9.403 917 HD12 LEU 134 2HD1 LEU 134 -1.158 -3.344 -11.012 918 HD13 LEU 134 3HD1 LEU 134 -2.092 -4.071 -9.719 919 HD21 LEU 134 3HD2 LEU 134 -2.890 -2.836 -7.854 920 HD22 LEU 134 1HD2 LEU 134 -2.742 -1.081 -7.750 921 HD23 LEU 134 2HD2 LEU 134 -1.312 -2.110 -7.470 922 H ARG 135 H ARG 135 1.657 -0.318 -11.389 923 HA ARG 135 HA ARG 135 2.060 -2.318 -13.517 924 HB2 ARG 135 1HB ARG 135 3.840 -0.613 -11.701 925 HB3 ARG 135 2HB ARG 135 4.536 -1.866 -12.687 926 HG2 ARG 135 1HG ARG 135 3.684 -0.749 -14.719 927 HG3 ARG 135 2HG ARG 135 2.929 0.498 -13.696 928 HD2 ARG 135 1HD ARG 135 4.867 1.612 -13.372 929 HD3 ARG 135 2HD ARG 135 5.728 0.166 -12.978 930 HE ARG 135 HE ARG 135 5.341 1.308 -15.681 931 HH11 ARG 135 1HH1 ARG 135 7.106 -1.118 -13.654 932 HH12 ARG 135 2HH1 ARG 135 8.132 -1.577 -14.937 933 HH21 ARG 135 1HH2 ARG 135 6.769 0.608 -17.373 934 HH22 ARG 135 2HH2 ARG 135 7.855 -0.696 -17.048 935 H THR 136 H THR 136 3.611 -4.113 -12.761 936 HA THR 136 HA THR 136 3.047 -5.092 -10.048 937 HB THR 136 HB THR 136 2.833 -7.415 -11.569 938 HG1 THR 136 1HG THR 136 2.229 -6.267 -13.434 939 HG21 THR 136 3HG2 THR 136 0.466 -7.459 -10.803 940 HG22 THR 136 1HG2 THR 136 0.711 -5.816 -10.149 941 HG23 THR 136 2HG2 THR 136 1.697 -7.196 -9.573 942 H GLU 137 H GLU 137 5.194 -4.437 -12.285 943 HA GLU 137 HA GLU 137 7.509 -5.296 -11.080 944 HB2 GLU 137 1HB GLU 137 8.400 -6.874 -12.785 945 HB3 GLU 137 2HB GLU 137 7.027 -7.583 -11.922 946 HG2 GLU 137 1HG GLU 137 5.541 -6.940 -13.827 947 HG3 GLU 137 2HG GLU 137 6.941 -6.326 -14.720 Start of MODEL 11 1 H1 GLY 19 H GLY 19 -8.729 -23.036 3.329 2 HA2 GLY 19 1HA GLY 19 -9.702 -23.058 1.103 3 HA3 GLY 19 2HA GLY 19 -10.974 -22.912 2.336 4 H HIS 20 H HIS 20 -11.781 -20.650 2.809 5 HA HIS 20 HA HIS 20 -11.904 -19.062 0.321 6 HB2 HIS 20 1HB HIS 20 -13.263 -18.965 3.031 7 HB3 HIS 20 2HB HIS 20 -13.226 -17.521 2.008 8 HD1 HIS 20 1HD HIS 20 -15.319 -20.588 2.408 9 HD2 HIS 20 2HD HIS 20 -14.083 -17.949 -0.657 10 HE1 HIS 20 1HE HIS 20 -16.955 -20.871 0.513 11 H MET 21 H MET 21 -11.328 -16.829 0.261 12 HA MET 21 HA MET 21 -9.285 -15.926 2.215 13 HB2 MET 21 1HB MET 21 -8.173 -14.780 0.366 14 HB3 MET 21 2HB MET 21 -8.150 -16.529 0.163 15 HG2 MET 21 1HG MET 21 -9.916 -16.422 -1.511 16 HG3 MET 21 2HG MET 21 -10.155 -14.703 -1.205 17 HE1 MET 21 3HE MET 21 -10.128 -15.227 -4.038 18 HE2 MET 21 1HE MET 21 -9.862 -13.563 -3.462 19 HE3 MET 21 2HE MET 21 -8.820 -14.242 -4.733 20 H LYS 22 H LYS 22 -9.071 -13.430 2.070 21 HA LYS 22 HA LYS 22 -11.607 -12.076 1.406 22 HB2 LYS 22 1HB LYS 22 -10.213 -12.080 4.104 23 HB3 LYS 22 2HB LYS 22 -11.216 -10.730 3.584 24 HG2 LYS 22 1HG LYS 22 -12.267 -13.590 3.802 25 HG3 LYS 22 2HG LYS 22 -12.320 -12.396 5.081 26 HD2 LYS 22 1HD LYS 22 -14.348 -11.909 4.319 27 HD3 LYS 22 2HD LYS 22 -13.515 -10.931 3.127 28 HE2 LYS 22 1HE LYS 22 -13.640 -12.825 1.496 29 HE3 LYS 22 2HE LYS 22 -14.392 -13.822 2.743 30 HZ1 LYS 22 3HZ LYS 22 -16.224 -12.153 2.818 31 HZ2 LYS 22 1HZ LYS 22 -16.147 -12.978 1.426 32 HZ3 LYS 22 2HZ LYS 22 -15.590 -11.434 1.481 33 H PHE 23 H PHE 23 -11.268 -10.070 0.616 34 HA PHE 23 HA PHE 23 -10.262 -8.596 -0.718 35 HB2 PHE 23 1HB PHE 23 -8.576 -8.386 1.747 36 HB3 PHE 23 2HB PHE 23 -8.023 -7.625 0.272 37 HD1 PHE 23 2HD PHE 23 -11.185 -7.848 2.301 38 HD2 PHE 23 1HD PHE 23 -8.688 -5.489 -0.313 39 HE1 PHE 23 2HE PHE 23 -12.770 -5.941 2.465 40 HE2 PHE 23 1HE PHE 23 -10.268 -3.615 -0.128 41 HZ PHE 23 HZ PHE 23 -12.308 -3.816 1.259 42 H THR 24 H THR 24 -7.776 -8.092 -1.743 43 HA THR 24 HA THR 24 -6.308 -10.525 -2.405 44 HB THR 24 HB THR 24 -6.370 -9.356 -4.816 45 HG1 THR 24 1HG THR 24 -8.077 -8.234 -5.297 46 HG21 THR 24 3HG2 THR 24 -8.779 -10.924 -3.759 47 HG22 THR 24 1HG2 THR 24 -7.234 -11.661 -4.243 48 HG23 THR 24 2HG2 THR 24 -8.244 -10.845 -5.452 49 H ASP 25 H ASP 25 -4.056 -9.944 -2.634 50 HA ASP 25 HA ASP 25 -3.127 -7.843 -1.174 51 HB2 ASP 25 1HB ASP 25 -1.626 -8.955 -3.569 52 HB3 ASP 25 2HB ASP 25 -0.935 -7.989 -2.241 53 H GLN 26 H GLN 26 -3.566 -7.897 -4.684 54 HA GLN 26 HA GLN 26 -2.765 -5.394 -5.568 55 HB2 GLN 26 1HB GLN 26 -4.946 -7.372 -6.229 56 HB3 GLN 26 2HB GLN 26 -5.120 -5.787 -6.911 57 HG2 GLN 26 1HG GLN 26 -2.386 -6.901 -7.264 58 HG3 GLN 26 2HG GLN 26 -3.626 -7.914 -7.955 59 HE21 GLN 26 1HE2 GLN 26 -5.438 -5.630 -8.779 60 HE22 GLN 26 2HE2 GLN 26 -4.540 -4.704 -9.944 61 H GLN 27 H GLN 27 -5.962 -6.139 -4.062 62 HA GLN 27 HA GLN 27 -6.957 -3.429 -4.260 63 HB2 GLN 27 1HB GLN 27 -7.860 -5.862 -2.689 64 HB3 GLN 27 2HB GLN 27 -8.760 -4.362 -2.725 65 HG2 GLN 27 1HG GLN 27 -8.053 -5.844 -5.289 66 HG3 GLN 27 2HG GLN 27 -9.419 -6.321 -4.309 67 HE21 GLN 27 1HE2 GLN 27 -9.300 -5.210 -7.107 68 HE22 GLN 27 2HE2 GLN 27 -10.435 -3.876 -7.093 69 H ILE 28 H ILE 28 -5.294 -5.330 -1.786 70 HA ILE 28 HA ILE 28 -5.922 -3.555 0.402 71 HB ILE 28 HB ILE 28 -3.813 -5.733 0.055 72 HG12 ILE 28 1HG1 ILE 28 -6.526 -5.768 1.479 73 HG13 ILE 28 2HG1 ILE 28 -6.241 -6.397 -0.118 74 HG21 ILE 28 1HG2 ILE 28 -3.556 -5.763 2.465 75 HG22 ILE 28 2HG2 ILE 28 -3.182 -4.154 1.908 76 HG23 ILE 28 3HG2 ILE 28 -4.755 -4.459 2.672 77 HD11 ILE 28 3HD1 ILE 28 -6.098 -8.325 1.150 78 HD12 ILE 28 1HD1 ILE 28 -4.393 -7.873 0.991 79 HD13 ILE 28 2HD1 ILE 28 -5.310 -7.491 2.485 80 H GLY 29 H GLY 29 -3.083 -3.894 -1.809 81 HA2 GLY 29 1HA GLY 29 -1.411 -2.142 -0.363 82 HA3 GLY 29 2HA GLY 29 -1.268 -2.498 -2.078 83 H VAL 30 H VAL 30 -3.880 -1.365 -2.849 84 HA VAL 30 HA VAL 30 -3.250 1.416 -3.025 85 HB VAL 30 HB VAL 30 -5.799 -0.168 -3.532 86 HG11 VAL 30 1HG1 VAL 30 -5.298 2.774 -4.134 87 HG12 VAL 30 2HG1 VAL 30 -6.695 1.810 -4.705 88 HG13 VAL 30 3HG1 VAL 30 -6.501 2.142 -2.989 89 HG21 VAL 30 3HG2 VAL 30 -3.949 -0.567 -5.119 90 HG22 VAL 30 1HG2 VAL 30 -5.223 0.365 -5.915 91 HG23 VAL 30 2HG2 VAL 30 -3.775 1.194 -5.371 92 H LEU 31 H LEU 31 -5.381 -0.426 -0.849 93 HA LEU 31 HA LEU 31 -6.388 1.843 0.619 94 HB2 LEU 31 1HB LEU 31 -6.330 -1.153 0.890 95 HB3 LEU 31 2HB LEU 31 -6.579 -0.244 2.354 96 HG LEU 31 HG LEU 31 -8.651 0.550 1.741 97 HD11 LEU 31 1HD1 LEU 31 -9.632 0.465 -0.542 98 HD12 LEU 31 2HD1 LEU 31 -8.050 -0.049 -1.180 99 HD13 LEU 31 3HD1 LEU 31 -8.252 1.554 -0.451 100 HD21 LEU 31 3HD2 LEU 31 -9.939 -1.371 0.944 101 HD22 LEU 31 1HD2 LEU 31 -8.645 -1.939 2.016 102 HD23 LEU 31 2HD2 LEU 31 -8.460 -2.103 0.268 103 H ALA 32 H ALA 32 -3.507 -0.242 1.037 104 HA ALA 32 HA ALA 32 -2.673 0.953 3.509 105 HB1 ALA 32 1HB ALA 32 -0.509 -0.139 3.026 106 HB2 ALA 32 2HB ALA 32 -1.868 -1.256 2.758 107 HB3 ALA 32 3HB ALA 32 -1.042 -0.495 1.378 108 H GLY 33 H GLY 33 -1.878 1.700 0.063 109 HA2 GLY 33 1HA GLY 33 -0.049 3.836 0.704 110 HA3 GLY 33 2HA GLY 33 -0.841 3.557 -0.846 111 H LEU 34 H LEU 34 -3.637 3.756 0.158 112 HA LEU 34 HA LEU 34 -3.943 6.573 0.374 113 HB2 LEU 34 1HB LEU 34 -5.724 4.205 0.505 114 HB3 LEU 34 2HB LEU 34 -6.228 5.553 1.520 115 HG LEU 34 HG LEU 34 -6.153 7.108 -0.322 116 HD11 LEU 34 1HD1 LEU 34 -4.450 6.127 -1.791 117 HD12 LEU 34 2HD1 LEU 34 -5.962 6.330 -2.677 118 HD13 LEU 34 3HD1 LEU 34 -5.480 4.718 -2.096 119 HD21 LEU 34 3HD2 LEU 34 -7.791 4.599 -0.890 120 HD22 LEU 34 1HD2 LEU 34 -8.116 6.210 -1.574 121 HD23 LEU 34 2HD2 LEU 34 -8.249 5.959 0.167 122 H ALA 35 H ALA 35 -3.470 4.121 2.827 123 HA ALA 35 HA ALA 35 -3.978 5.879 5.080 124 HB1 ALA 35 1HB ALA 35 -3.083 4.173 6.458 125 HB2 ALA 35 2HB ALA 35 -3.933 3.313 5.175 126 HB3 ALA 35 3HB ALA 35 -2.196 3.433 5.151 127 H ILE 36 H ILE 36 -1.180 5.514 2.899 128 HA ILE 36 HA ILE 36 0.526 7.086 4.730 129 HB ILE 36 HB ILE 36 1.297 4.568 3.229 130 HG12 ILE 36 1HG1 ILE 36 0.030 3.785 5.090 131 HG13 ILE 36 2HG1 ILE 36 1.724 3.441 5.308 132 HG21 ILE 36 1HG2 ILE 36 2.928 6.293 5.144 133 HG22 ILE 36 2HG2 ILE 36 3.457 4.792 4.359 134 HG23 ILE 36 3HG2 ILE 36 3.138 6.207 3.386 135 HD11 ILE 36 3HD1 ILE 36 0.746 4.063 7.418 136 HD12 ILE 36 1HD1 ILE 36 1.894 5.329 6.937 137 HD13 ILE 36 2HD1 ILE 36 0.157 5.600 6.770 138 H SER 37 H SER 37 0.306 8.909 3.443 139 HA SER 37 HA SER 37 0.782 10.358 1.819 140 HB2 SER 37 1HB SER 37 3.064 9.131 2.019 141 HB3 SER 37 2HB SER 37 2.679 8.503 0.411 142 HG SER 37 HG SER 37 3.851 10.585 0.560 143 HA PRO 38 HA PRO 38 -2.383 7.941 -0.647 144 HB2 PRO 38 1HB PRO 38 -4.328 9.913 -0.573 145 HB3 PRO 38 2HB PRO 38 -4.145 8.668 0.689 146 HG2 PRO 38 1HG PRO 38 -3.066 11.488 0.698 147 HG3 PRO 38 2HG PRO 38 -3.942 10.639 2.007 148 HD2 PRO 38 1HD PRO 38 -1.270 10.809 2.039 149 HD3 PRO 38 2HD PRO 38 -2.054 9.267 2.489 150 H GLU 39 H GLU 39 -1.235 11.350 -0.796 151 HA GLU 39 HA GLU 39 -2.095 11.693 -3.529 152 HB2 GLU 39 1HB GLU 39 -0.703 13.673 -3.533 153 HB3 GLU 39 2HB GLU 39 -1.857 13.607 -2.186 154 HG2 GLU 39 1HG GLU 39 -0.107 13.180 -0.588 155 HG3 GLU 39 2HG GLU 39 1.091 12.970 -1.876 156 H TRP 40 H TRP 40 1.013 10.672 -2.065 157 HA TRP 40 HA TRP 40 2.514 10.526 -4.504 158 HB2 TRP 40 1HB TRP 40 3.645 10.366 -2.413 159 HB3 TRP 40 2HB TRP 40 2.686 8.973 -1.929 160 HD1 TRP 40 HD TRP 40 5.381 9.872 -4.535 161 HE1 TRP 40 1HE TRP 40 6.733 7.776 -5.114 162 HE3 TRP 40 3HE TRP 40 2.430 6.475 -2.168 163 HZ2 TRP 40 2HZ TRP 40 6.318 4.946 -4.869 164 HZ3 TRP 40 3HZ TRP 40 2.745 4.084 -2.561 165 HH2 TRP 40 HH TRP 40 4.720 3.258 -3.849 166 H LEU 41 H LEU 41 0.605 8.029 -2.813 167 HA LEU 41 HA LEU 41 0.572 5.973 -4.694 168 HB2 LEU 41 1HB LEU 41 -0.290 5.765 -2.472 169 HB3 LEU 41 2HB LEU 41 -1.469 7.000 -2.710 170 HG LEU 41 HG LEU 41 -2.543 4.909 -2.518 171 HD11 LEU 41 1HD1 LEU 41 -3.955 4.752 -4.401 172 HD12 LEU 41 2HD1 LEU 41 -2.767 5.479 -5.481 173 HD13 LEU 41 3HD1 LEU 41 -3.546 6.448 -4.192 174 HD21 LEU 41 3HD2 LEU 41 -0.837 3.396 -3.127 175 HD22 LEU 41 1HD2 LEU 41 -0.880 3.928 -4.841 176 HD23 LEU 41 2HD2 LEU 41 -2.252 3.060 -4.124 177 H LYS 42 H LYS 42 -1.805 8.683 -4.515 178 HA LYS 42 HA LYS 42 -3.207 8.004 -6.870 179 HB2 LYS 42 1HB LYS 42 -2.906 10.622 -5.350 180 HB3 LYS 42 2HB LYS 42 -3.996 10.441 -6.725 181 HG2 LYS 42 1HG LYS 42 -5.396 8.896 -5.628 182 HG3 LYS 42 2HG LYS 42 -4.169 8.452 -4.477 183 HD2 LYS 42 1HD LYS 42 -5.649 9.572 -3.170 184 HD3 LYS 42 2HD LYS 42 -4.381 10.772 -3.428 185 HE2 LYS 42 1HE LYS 42 -5.695 11.979 -4.980 186 HE3 LYS 42 2HE LYS 42 -6.850 10.672 -5.191 187 HZ1 LYS 42 3HZ LYS 42 -6.542 12.001 -2.572 188 HZ2 LYS 42 1HZ LYS 42 -7.800 11.081 -3.166 189 HZ3 LYS 42 2HZ LYS 42 -7.554 12.586 -3.726 190 H GLN 43 H GLN 43 -0.317 10.150 -6.545 191 HA GLN 43 HA GLN 43 -0.518 11.138 -9.245 192 HB2 GLN 43 1HB GLN 43 1.778 11.015 -7.257 193 HB3 GLN 43 2HB GLN 43 1.912 11.799 -8.827 194 HG2 GLN 43 1HG GLN 43 0.407 13.533 -8.285 195 HG3 GLN 43 2HG GLN 43 -0.282 12.660 -6.921 196 HE21 GLN 43 1HE2 GLN 43 1.602 11.958 -5.332 197 HE22 GLN 43 2HE2 GLN 43 2.857 13.154 -4.951 198 H ASN 44 H ASN 44 1.399 8.549 -7.665 199 HA ASN 44 HA ASN 44 2.870 7.709 -9.934 200 HB2 ASN 44 1HB ASN 44 1.796 6.063 -7.583 201 HB3 ASN 44 2HB ASN 44 2.906 5.473 -8.823 202 HD21 ASN 44 1HD2 ASN 44 3.637 8.805 -7.589 203 HD22 ASN 44 2HD2 ASN 44 4.890 8.171 -6.582 204 H ILE 45 H ILE 45 -0.375 6.720 -8.768 205 HA ILE 45 HA ILE 45 -0.978 4.814 -10.807 206 HB ILE 45 HB ILE 45 -2.639 6.585 -8.987 207 HG12 ILE 45 1HG1 ILE 45 -1.431 4.661 -7.974 208 HG13 ILE 45 2HG1 ILE 45 -3.174 4.631 -7.789 209 HG21 ILE 45 1HG2 ILE 45 -4.611 5.159 -9.674 210 HG22 ILE 45 2HG2 ILE 45 -4.139 6.405 -10.811 211 HG23 ILE 45 3HG2 ILE 45 -3.700 4.712 -11.123 212 HD11 ILE 45 3HD1 ILE 45 -3.251 2.982 -9.754 213 HD12 ILE 45 1HD1 ILE 45 -1.484 2.940 -9.684 214 HD13 ILE 45 2HD1 ILE 45 -2.460 2.406 -8.290 215 H ALA 46 H ALA 46 -1.819 8.336 -10.577 216 HA ALA 46 HA ALA 46 -3.247 8.511 -12.936 217 HB1 ALA 46 1HB ALA 46 -1.428 10.592 -11.665 218 HB2 ALA 46 2HB ALA 46 -2.672 10.928 -12.874 219 HB3 ALA 46 3HB ALA 46 -3.144 10.309 -11.282 220 H ALA 47 H ALA 47 0.267 8.828 -12.471 221 HA ALA 47 HA ALA 47 0.888 9.344 -15.207 222 HB1 ALA 47 1HB ALA 47 2.238 10.036 -13.252 223 HB2 ALA 47 2HB ALA 47 2.653 8.334 -12.952 224 HB3 ALA 47 3HB ALA 47 3.186 9.155 -14.449 225 H ASN 48 H ASN 48 -0.187 6.424 -13.925 226 HA ASN 48 HA ASN 48 0.102 4.263 -14.261 227 HB2 ASN 48 1HB ASN 48 -0.819 4.903 -16.475 228 HB3 ASN 48 2HB ASN 48 0.824 4.943 -17.125 229 HD21 ASN 48 1HD2 ASN 48 -1.435 2.724 -15.340 230 HD22 ASN 48 2HD2 ASN 48 -0.872 1.263 -16.078 231 H GLN 49 H GLN 49 2.219 5.549 -13.080 232 HA GLN 49 HA GLN 49 4.625 4.022 -14.063 233 HB2 GLN 49 1HB GLN 49 4.622 6.436 -12.246 234 HB3 GLN 49 2HB GLN 49 6.036 5.624 -12.923 235 HG2 GLN 49 1HG GLN 49 3.949 7.062 -14.577 236 HG3 GLN 49 2HG GLN 49 5.420 7.796 -14.001 237 HE21 GLN 49 1HE2 GLN 49 4.406 4.834 -15.908 238 HE22 GLN 49 2HE2 GLN 49 5.564 5.195 -17.167 239 H LEU 50 H LEU 50 2.268 3.718 -11.723 240 HA LEU 50 HA LEU 50 3.985 3.040 -9.469 241 HB2 LEU 50 1HB LEU 50 1.581 3.882 -9.220 242 HB3 LEU 50 2HB LEU 50 1.042 2.385 -9.930 243 HG LEU 50 HG LEU 50 1.994 1.085 -8.073 244 HD11 LEU 50 1HD1 LEU 50 2.766 3.746 -6.768 245 HD12 LEU 50 2HD1 LEU 50 3.912 2.582 -7.432 246 HD13 LEU 50 3HD1 LEU 50 2.928 2.108 -6.079 247 HD21 LEU 50 3HD2 LEU 50 -0.276 2.005 -7.926 248 HD22 LEU 50 1HD2 LEU 50 0.337 3.460 -7.115 249 HD23 LEU 50 2HD2 LEU 50 0.436 1.858 -6.345 250 H VAL 51 H VAL 51 4.929 1.055 -9.111 251 HA VAL 51 HA VAL 51 3.854 -1.313 -10.531 252 HB VAL 51 HB VAL 51 6.721 -0.753 -9.663 253 HG11 VAL 51 1HG1 VAL 51 6.253 -3.164 -9.460 254 HG12 VAL 51 2HG1 VAL 51 5.516 -3.191 -11.083 255 HG13 VAL 51 3HG1 VAL 51 7.241 -2.883 -10.882 256 HG21 VAL 51 3HG2 VAL 51 6.114 0.472 -11.743 257 HG22 VAL 51 1HG2 VAL 51 7.233 -0.851 -12.090 258 HG23 VAL 51 2HG2 VAL 51 5.516 -1.042 -12.466 259 H TYR 52 H TYR 52 3.669 -3.148 -9.232 260 HA TYR 52 HA TYR 52 3.765 -2.898 -6.268 261 HB2 TYR 52 1HB TYR 52 1.468 -2.957 -6.929 262 HB3 TYR 52 2HB TYR 52 1.782 -4.117 -8.212 263 HD1 TYR 52 2HD TYR 52 1.750 -3.788 -4.482 264 HD2 TYR 52 1HD TYR 52 1.516 -6.406 -7.908 265 HE1 TYR 52 2HE TYR 52 1.290 -5.703 -2.983 266 HE2 TYR 52 1HE TYR 52 1.216 -8.344 -6.407 267 HH TYR 52 HH TYR 52 1.093 -9.085 -4.188 268 H GLY 53 H GLY 53 4.567 -4.852 -5.222 269 HA2 GLY 53 1HA GLY 53 5.352 -7.123 -6.837 270 HA3 GLY 53 2HA GLY 53 6.704 -6.090 -6.347 271 H ILE 54 H ILE 54 6.923 -8.530 -5.415 272 HA ILE 54 HA ILE 54 6.187 -8.423 -2.545 273 HB ILE 54 HB ILE 54 6.957 -10.693 -4.407 274 HG12 ILE 54 1HG1 ILE 54 4.597 -10.109 -4.627 275 HG13 ILE 54 2HG1 ILE 54 4.816 -11.657 -3.851 276 HG21 ILE 54 1HG2 ILE 54 6.620 -10.803 -1.395 277 HG22 ILE 54 2HG2 ILE 54 6.684 -12.220 -2.464 278 HG23 ILE 54 3HG2 ILE 54 8.079 -11.147 -2.340 279 HD11 ILE 54 3HD1 ILE 54 3.025 -10.487 -2.734 280 HD12 ILE 54 1HD1 ILE 54 4.397 -10.580 -1.602 281 HD13 ILE 54 2HD1 ILE 54 4.036 -9.067 -2.481 282 H VAL 55 H VAL 55 7.897 -8.581 -1.130 283 HA VAL 55 HA VAL 55 10.418 -7.495 -1.744 284 HB VAL 55 HB VAL 55 9.315 -9.169 0.542 285 HG11 VAL 55 1HG1 VAL 55 11.540 -8.167 1.723 286 HG12 VAL 55 2HG1 VAL 55 11.442 -9.776 1.027 287 HG13 VAL 55 3HG1 VAL 55 12.175 -8.473 0.085 288 HG21 VAL 55 3HG2 VAL 55 9.422 -6.323 -0.176 289 HG22 VAL 55 1HG2 VAL 55 8.482 -7.148 1.065 290 HG23 VAL 55 2HG2 VAL 55 10.107 -6.604 1.426 291 H LYS 56 H LYS 56 10.340 -10.889 -0.562 292 HA LYS 56 HA LYS 56 11.723 -12.567 -0.957 293 HB2 LYS 56 1HB LYS 56 11.265 -11.630 -3.821 294 HB3 LYS 56 2HB LYS 56 12.261 -13.027 -3.502 295 HG2 LYS 56 1HG LYS 56 9.507 -12.821 -2.196 296 HG3 LYS 56 2HG LYS 56 9.646 -13.262 -3.880 297 HD2 LYS 56 1HD LYS 56 11.173 -15.140 -3.222 298 HD3 LYS 56 2HD LYS 56 10.912 -14.699 -1.518 299 HE2 LYS 56 1HE LYS 56 8.422 -14.990 -1.897 300 HE3 LYS 56 2HE LYS 56 8.772 -15.569 -3.531 301 HZ1 LYS 56 3HZ LYS 56 8.513 -17.390 -2.062 302 HZ2 LYS 56 1HZ LYS 56 9.638 -16.819 -1.008 303 HZ3 LYS 56 2HZ LYS 56 10.092 -17.341 -2.523 304 HA PRO 57 HA PRO 57 15.876 -11.091 -0.834 305 HB2 PRO 57 1HB PRO 57 17.399 -13.301 -1.164 306 HB3 PRO 57 2HB PRO 57 16.258 -13.128 0.205 307 HG2 PRO 57 1HG PRO 57 15.810 -14.529 -2.464 308 HG3 PRO 57 2HG PRO 57 15.563 -15.212 -0.828 309 HD2 PRO 57 1HD PRO 57 13.509 -14.135 -2.215 310 HD3 PRO 57 2HD PRO 57 13.636 -13.892 -0.454 311 H SER 58 H SER 58 14.681 -11.837 -3.940 312 HA SER 58 HA SER 58 17.031 -12.206 -5.479 313 HB2 SER 58 1HB SER 58 14.361 -10.972 -6.295 314 HB3 SER 58 2HB SER 58 15.526 -11.766 -7.345 315 HG SER 58 HG SER 58 14.829 -13.650 -6.784 316 H ASP 59 H ASP 59 15.651 -9.331 -4.077 317 HA ASP 59 HA ASP 59 17.729 -7.620 -5.290 318 HB2 ASP 59 1HB ASP 59 14.761 -7.247 -5.116 319 HB3 ASP 59 2HB ASP 59 15.645 -5.944 -4.388 320 H THR 60 H THR 60 18.217 -5.759 -3.709 321 HA THR 60 HA THR 60 18.522 -6.759 -1.028 322 HB THR 60 HB THR 60 20.006 -5.031 -2.186 323 HG1 THR 60 1HG THR 60 19.587 -3.817 0.147 324 HG21 THR 60 3HG2 THR 60 18.182 -3.481 -2.881 325 HG22 THR 60 1HG2 THR 60 19.443 -2.674 -1.903 326 HG23 THR 60 2HG2 THR 60 17.896 -3.091 -1.168 327 H VAL 61 H VAL 61 17.417 -6.187 0.844 328 HA VAL 61 HA VAL 61 15.225 -4.313 0.842 329 HB VAL 61 HB VAL 61 13.749 -6.143 1.922 330 HG11 VAL 61 1HG1 VAL 61 13.503 -4.985 -0.381 331 HG12 VAL 61 2HG1 VAL 61 14.033 -6.545 -1.070 332 HG13 VAL 61 3HG1 VAL 61 12.567 -6.408 -0.070 333 HG21 VAL 61 3HG2 VAL 61 15.434 -8.032 0.227 334 HG22 VAL 61 1HG2 VAL 61 15.579 -7.899 1.988 335 HG23 VAL 61 2HG2 VAL 61 14.068 -8.454 1.245 336 HA PRO 62 HA PRO 62 16.650 -4.197 5.096 337 HB2 PRO 62 1HB PRO 62 14.445 -3.310 6.470 338 HB3 PRO 62 2HB PRO 62 15.356 -2.269 5.341 339 HG2 PRO 62 1HG PRO 62 12.825 -3.813 4.805 340 HG3 PRO 62 2HG PRO 62 13.191 -2.108 4.386 341 HD2 PRO 62 1HD PRO 62 13.391 -4.170 2.615 342 HD3 PRO 62 2HD PRO 62 14.481 -2.760 2.536 343 H ALA 63 H ALA 63 16.216 -5.170 7.255 344 HA ALA 63 HA ALA 63 15.206 -7.883 7.154 345 HB1 ALA 63 1HB ALA 63 16.060 -6.048 9.449 346 HB2 ALA 63 2HB ALA 63 15.628 -7.749 9.641 347 HB3 ALA 63 3HB ALA 63 17.037 -7.315 8.660 348 H GLY 64 H GLY 64 13.262 -8.676 7.817 349 HA2 GLY 64 1HA GLY 64 11.413 -8.838 9.137 350 HA3 GLY 64 2HA GLY 64 11.480 -7.133 9.529 351 H VAL 65 H VAL 65 11.389 -8.672 6.268 352 HA VAL 65 HA VAL 65 8.602 -7.958 5.793 353 HB VAL 65 HB VAL 65 9.168 -6.570 3.744 354 HG11 VAL 65 1HG1 VAL 65 8.248 -5.570 5.829 355 HG12 VAL 65 2HG1 VAL 65 9.918 -5.104 6.261 356 HG13 VAL 65 3HG1 VAL 65 9.179 -4.478 4.783 357 HG21 VAL 65 3HG2 VAL 65 11.240 -5.363 3.588 358 HG22 VAL 65 1HG2 VAL 65 11.830 -6.051 5.122 359 HG23 VAL 65 2HG2 VAL 65 11.642 -7.079 3.692 360 H ASP 66 H ASP 66 10.204 -10.479 5.772 361 HA ASP 66 HA ASP 66 11.615 -10.792 3.435 362 HB2 ASP 66 1HB ASP 66 11.635 -12.092 5.711 363 HB3 ASP 66 2HB ASP 66 10.452 -13.149 4.967 364 H ASP 67 H ASP 67 8.396 -11.217 3.686 365 HA ASP 67 HA ASP 67 7.968 -11.712 0.851 366 HB2 ASP 67 1HB ASP 67 8.090 -14.057 1.625 367 HB3 ASP 67 2HB ASP 67 6.818 -13.748 2.796 368 H TYR 68 H TYR 68 7.740 -9.509 2.223 369 HA TYR 68 HA TYR 68 4.826 -9.015 2.681 370 HB2 TYR 68 1HB TYR 68 7.306 -7.370 3.119 371 HB3 TYR 68 2HB TYR 68 5.712 -6.637 2.951 372 HD1 TYR 68 2HD TYR 68 6.257 -9.935 4.745 373 HD2 TYR 68 1HD TYR 68 5.460 -5.698 5.097 374 HE1 TYR 68 2HE TYR 68 5.468 -10.293 7.000 375 HE2 TYR 68 1HE TYR 68 4.674 -6.059 7.409 376 HH TYR 68 HH TYR 68 4.171 -9.339 8.727 377 H SER 69 H SER 69 3.764 -7.540 1.287 378 HA SER 69 HA SER 69 4.782 -7.351 -1.454 379 HB2 SER 69 1HB SER 69 2.589 -5.662 -1.204 380 HB3 SER 69 2HB SER 69 2.591 -7.297 -1.837 381 HG SER 69 HG SER 69 2.072 -6.555 0.853 382 H TYR 70 H TYR 70 5.023 -5.216 -2.473 383 HA TYR 70 HA TYR 70 5.235 -2.928 -0.682 384 HB2 TYR 70 1HB TYR 70 7.363 -2.220 -1.433 385 HB3 TYR 70 2HB TYR 70 7.568 -3.859 -0.856 386 HD1 TYR 70 2HD TYR 70 7.386 -1.711 -3.940 387 HD2 TYR 70 1HD TYR 70 8.359 -5.614 -2.322 388 HE1 TYR 70 2HE TYR 70 8.332 -2.392 -6.110 389 HE2 TYR 70 1HE TYR 70 9.443 -6.192 -4.473 390 HH TYR 70 HH TYR 70 9.334 -5.585 -6.894 391 H LEU 71 H LEU 71 5.558 -0.937 -2.042 392 HA LEU 71 HA LEU 71 4.495 -1.036 -4.776 393 HB2 LEU 71 1HB LEU 71 3.339 0.465 -2.378 394 HB3 LEU 71 2HB LEU 71 3.115 1.020 -4.020 395 HG LEU 71 HG LEU 71 2.345 -1.821 -3.283 396 HD11 LEU 71 1HD1 LEU 71 0.675 0.660 -2.796 397 HD12 LEU 71 2HD1 LEU 71 1.156 -0.611 -1.655 398 HD13 LEU 71 3HD1 LEU 71 0.029 -0.978 -2.961 399 HD21 LEU 71 3HD2 LEU 71 0.797 -1.548 -5.172 400 HD22 LEU 71 1HD2 LEU 71 2.453 -1.183 -5.678 401 HD23 LEU 71 2HD2 LEU 71 1.326 0.131 -5.378 402 H VAL 72 H VAL 72 5.554 0.530 -6.017 403 HA VAL 72 HA VAL 72 6.765 2.863 -4.887 404 HB VAL 72 HB VAL 72 8.414 1.102 -4.273 405 HG11 VAL 72 1HG1 VAL 72 9.621 -0.171 -5.883 406 HG12 VAL 72 2HG1 VAL 72 7.926 -0.317 -6.367 407 HG13 VAL 72 3HG1 VAL 72 8.973 0.790 -7.239 408 HG21 VAL 72 3HG2 VAL 72 10.330 2.335 -4.883 409 HG22 VAL 72 1HG2 VAL 72 9.599 2.927 -6.381 410 HG23 VAL 72 2HG2 VAL 72 9.030 3.510 -4.810 411 H ALA 73 H ALA 73 7.533 4.261 -6.826 412 HA ALA 73 HA ALA 73 6.091 3.559 -9.286 413 HB1 ALA 73 1HB ALA 73 8.032 5.831 -9.246 414 HB2 ALA 73 2HB ALA 73 6.436 5.717 -9.977 415 HB3 ALA 73 3HB ALA 73 6.602 6.005 -8.227 416 H ALA 74 H ALA 74 7.253 3.318 -11.320 417 HA ALA 74 HA ALA 74 9.533 1.660 -11.206 418 HB1 ALA 74 1HB ALA 74 7.942 1.603 -13.080 419 HB2 ALA 74 2HB ALA 74 8.414 3.262 -13.558 420 HB3 ALA 74 3HB ALA 74 9.573 1.917 -13.683 421 H ASP 75 H ASP 75 9.368 5.057 -11.193 422 HA ASP 75 HA ASP 75 12.282 5.356 -11.810 423 HB2 ASP 75 1HB ASP 75 10.111 7.429 -11.500 424 HB3 ASP 75 2HB ASP 75 11.815 7.804 -11.711 425 H ASP 76 H ASP 76 9.935 5.696 -9.180 426 HA ASP 76 HA ASP 76 11.573 7.057 -7.302 427 HB2 ASP 76 1HB ASP 76 9.023 5.427 -7.066 428 HB3 ASP 76 2HB ASP 76 9.770 6.173 -5.672 429 H GLN 77 H GLN 77 12.531 4.369 -8.527 430 HA GLN 77 HA GLN 77 12.376 2.294 -6.661 431 HB2 GLN 77 1HB GLN 77 14.299 2.872 -8.905 432 HB3 GLN 77 2HB GLN 77 14.401 1.387 -7.977 433 HG2 GLN 77 1HG GLN 77 11.900 2.288 -9.452 434 HG3 GLN 77 2HG GLN 77 13.136 1.263 -10.180 435 HE21 GLN 77 1HE2 GLN 77 13.682 -0.676 -8.170 436 HE22 GLN 77 2HE2 GLN 77 12.205 -1.563 -7.994 437 H ASP 78 H ASP 78 14.313 5.119 -6.383 438 HA ASP 78 HA ASP 78 15.818 3.812 -4.170 439 HB2 ASP 78 1HB ASP 78 17.747 4.481 -4.901 440 HB3 ASP 78 2HB ASP 78 16.983 4.833 -6.443 441 H GLY 79 H GLY 79 13.292 5.880 -4.758 442 HA2 GLY 79 1HA GLY 79 13.987 7.899 -2.720 443 HA3 GLY 79 2HA GLY 79 12.606 7.904 -3.819 444 H THR 80 H THR 80 10.747 6.582 -3.305 445 HA THR 80 HA THR 80 10.423 6.203 -0.367 446 HB THR 80 HB THR 80 8.256 6.623 -2.472 447 HG1 THR 80 1HG THR 80 9.501 8.448 -2.512 448 HG21 THR 80 3HG2 THR 80 6.952 7.514 -0.556 449 HG22 THR 80 1HG2 THR 80 8.265 7.092 0.568 450 HG23 THR 80 2HG2 THR 80 7.346 5.829 -0.312 451 H ILE 81 H ILE 81 8.776 4.406 0.235 452 HA ILE 81 HA ILE 81 7.929 2.562 -1.655 453 HB ILE 81 HB ILE 81 10.204 1.677 -1.664 454 HG12 ILE 81 1HG1 ILE 81 8.836 -0.333 0.089 455 HG13 ILE 81 2HG1 ILE 81 8.115 0.112 -1.456 456 HG21 ILE 81 1HG2 ILE 81 11.322 0.812 0.405 457 HG22 ILE 81 2HG2 ILE 81 11.091 2.563 0.443 458 HG23 ILE 81 3HG2 ILE 81 10.012 1.506 1.381 459 HD11 ILE 81 3HD1 ILE 81 9.650 -1.873 -1.625 460 HD12 ILE 81 1HD1 ILE 81 10.124 -0.528 -2.678 461 HD13 ILE 81 2HD1 ILE 81 11.005 -0.841 -1.168 462 H ILE 82 H ILE 82 6.328 1.173 -0.681 463 HA ILE 82 HA ILE 82 5.946 1.503 2.241 464 HB ILE 82 HB ILE 82 3.654 1.640 0.264 465 HG12 ILE 82 1HG1 ILE 82 5.045 4.025 1.534 466 HG13 ILE 82 2HG1 ILE 82 5.068 3.602 -0.187 467 HG21 ILE 82 1HG2 ILE 82 2.282 2.178 2.092 468 HG22 ILE 82 2HG2 ILE 82 3.368 1.000 2.825 469 HG23 ILE 82 3HG2 ILE 82 3.616 2.744 3.087 470 HD11 ILE 82 3HD1 ILE 82 2.611 3.856 -0.284 471 HD12 ILE 82 1HD1 ILE 82 2.636 4.448 1.390 472 HD13 ILE 82 2HD1 ILE 82 3.487 5.349 0.126 473 H PHE 83 H PHE 83 6.438 -0.560 2.921 474 HA PHE 83 HA PHE 83 5.633 -2.864 1.332 475 HB2 PHE 83 1HB PHE 83 6.921 -2.790 4.086 476 HB3 PHE 83 2HB PHE 83 6.707 -4.181 3.074 477 HD1 PHE 83 1HD PHE 83 8.637 -0.988 3.424 478 HD2 PHE 83 2HD PHE 83 8.220 -4.704 1.294 479 HE1 PHE 83 1HE PHE 83 10.907 -0.683 2.425 480 HE2 PHE 83 2HE PHE 83 10.489 -4.384 0.317 481 HZ PHE 83 HZ PHE 83 11.824 -2.391 0.890 482 H PHE 84 H PHE 84 4.101 -4.511 2.223 483 HA PHE 84 HA PHE 84 2.937 -4.038 4.767 484 HB2 PHE 84 1HB PHE 84 0.605 -3.776 4.206 485 HB3 PHE 84 2HB PHE 84 1.482 -2.491 3.389 486 HD1 PHE 84 2HD PHE 84 2.012 -2.735 0.909 487 HD2 PHE 84 1HD PHE 84 -0.660 -5.430 2.957 488 HE1 PHE 84 2HE PHE 84 1.112 -3.508 -1.271 489 HE2 PHE 84 1HE PHE 84 -1.505 -6.246 0.779 490 HZ PHE 84 HZ PHE 84 -0.642 -5.282 -1.336 491 H LYS 85 H LYS 85 1.664 -5.923 5.444 492 HA LYS 85 HA LYS 85 1.258 -8.070 3.460 493 HB2 LYS 85 1HB LYS 85 3.412 -8.528 4.643 494 HB3 LYS 85 2HB LYS 85 2.579 -8.447 6.181 495 HG2 LYS 85 1HG LYS 85 3.000 -10.712 5.686 496 HG3 LYS 85 2HG LYS 85 1.268 -10.449 5.593 497 HD2 LYS 85 1HD LYS 85 2.968 -10.457 3.074 498 HD3 LYS 85 2HD LYS 85 2.462 -11.968 3.851 499 HE2 LYS 85 1HE LYS 85 0.089 -11.173 3.789 500 HE3 LYS 85 2HE LYS 85 0.621 -9.798 2.802 501 HZ1 LYS 85 3HZ LYS 85 0.869 -12.628 1.996 502 HZ2 LYS 85 1HZ LYS 85 1.295 -11.305 1.097 503 HZ3 LYS 85 2HZ LYS 85 -0.268 -11.593 1.513 504 H ALA 86 H ALA 86 -1.007 -8.164 3.569 505 HA ALA 86 HA ALA 86 -2.365 -7.710 6.184 506 HB1 ALA 86 1HB ALA 86 -3.353 -8.005 3.377 507 HB2 ALA 86 2HB ALA 86 -4.398 -8.190 4.808 508 HB3 ALA 86 3HB ALA 86 -3.574 -6.652 4.521 509 H GLU 87 H GLU 87 -3.434 -9.499 7.103 510 HA GLU 87 HA GLU 87 -2.777 -12.235 6.220 511 HB2 GLU 87 1HB GLU 87 -2.018 -11.073 8.936 512 HB3 GLU 87 2HB GLU 87 -1.747 -12.709 8.308 513 HG2 GLU 87 1HG GLU 87 -0.264 -11.748 6.558 514 HG3 GLU 87 2HG GLU 87 -0.337 -10.197 7.438 515 H GLY 88 H GLY 88 -3.432 -13.113 8.966 516 HA2 GLY 88 1HA GLY 88 -6.225 -13.528 8.896 517 HA3 GLY 88 2HA GLY 88 -5.136 -13.724 10.286 518 H GLN 89 H GLN 89 -7.063 -11.461 8.490 519 HA GLN 89 HA GLN 89 -8.209 -9.599 8.934 520 HB2 GLN 89 1HB GLN 89 -8.321 -10.742 11.741 521 HB3 GLN 89 2HB GLN 89 -9.282 -9.368 11.184 522 HG2 GLN 89 1HG GLN 89 -9.399 -12.185 10.023 523 HG3 GLN 89 2HG GLN 89 -10.596 -11.420 11.078 524 HE21 GLN 89 1HE2 GLN 89 -10.223 -12.212 7.852 525 HE22 GLN 89 2HE2 GLN 89 -11.277 -10.958 7.247 526 H THR 90 H THR 90 -5.135 -9.620 9.598 527 HA THR 90 HA THR 90 -5.062 -6.928 10.819 528 HB THR 90 HB THR 90 -2.950 -9.106 11.138 529 HG1 THR 90 1HG THR 90 -4.799 -9.884 12.122 530 HG21 THR 90 3HG2 THR 90 -3.504 -6.545 12.690 531 HG22 THR 90 1HG2 THR 90 -2.093 -6.879 11.650 532 HG23 THR 90 2HG2 THR 90 -2.305 -7.776 13.153 533 H VAL 91 H VAL 91 -3.133 -5.644 9.986 534 HA VAL 91 HA VAL 91 -1.644 -6.764 7.757 535 HB VAL 91 HB VAL 91 -3.592 -5.810 6.809 536 HG11 VAL 91 1HG1 VAL 91 -3.017 -3.069 7.571 537 HG12 VAL 91 2HG1 VAL 91 -4.239 -3.722 6.458 538 HG13 VAL 91 3HG1 VAL 91 -4.330 -4.140 8.181 539 HG21 VAL 91 3HG2 VAL 91 -1.305 -3.920 6.105 540 HG22 VAL 91 1HG2 VAL 91 -1.299 -5.587 5.577 541 HG23 VAL 91 2HG2 VAL 91 -2.560 -4.481 4.977 542 H ILE 92 H ILE 92 0.350 -6.540 8.394 543 HA ILE 92 HA ILE 92 1.248 -4.240 9.973 544 HB ILE 92 HB ILE 92 2.761 -6.465 8.607 545 HG12 ILE 92 1HG1 ILE 92 3.098 -7.297 11.036 546 HG13 ILE 92 2HG1 ILE 92 1.723 -6.287 11.484 547 HG21 ILE 92 1HG2 ILE 92 4.605 -5.821 10.122 548 HG22 ILE 92 2HG2 ILE 92 4.117 -4.473 9.096 549 HG23 ILE 92 3HG2 ILE 92 3.604 -4.511 10.806 550 HD11 ILE 92 3HD1 ILE 92 0.219 -7.691 10.242 551 HD12 ILE 92 1HD1 ILE 92 1.551 -8.460 9.344 552 HD13 ILE 92 2HD1 ILE 92 1.320 -8.786 11.069 553 H ILE 93 H ILE 93 0.895 -2.433 8.694 554 HA ILE 93 HA ILE 93 2.113 -2.266 6.004 555 HB ILE 93 HB ILE 93 1.109 0.082 7.637 556 HG12 ILE 93 1HG1 ILE 93 -0.471 -1.579 5.627 557 HG13 ILE 93 2HG1 ILE 93 -0.838 -1.421 7.364 558 HG21 ILE 93 1HG2 ILE 93 1.128 1.212 5.469 559 HG22 ILE 93 2HG2 ILE 93 2.694 0.457 5.692 560 HG23 ILE 93 3HG2 ILE 93 1.507 -0.304 4.632 561 HD11 ILE 93 3HD1 ILE 93 -2.341 -0.076 6.092 562 HD12 ILE 93 1HD1 ILE 93 -1.286 0.943 7.106 563 HD13 ILE 93 2HD1 ILE 93 -1.032 0.830 5.343 564 H LYS 94 H LYS 94 4.199 -1.747 5.762 565 HA LYS 94 HA LYS 94 5.758 -0.691 8.054 566 HB2 LYS 94 1HB LYS 94 6.127 -3.257 6.592 567 HB3 LYS 94 2HB LYS 94 7.570 -2.329 6.783 568 HG2 LYS 94 1HG LYS 94 7.277 -2.189 9.202 569 HG3 LYS 94 2HG LYS 94 5.739 -3.045 9.102 570 HD2 LYS 94 1HD LYS 94 6.974 -5.049 8.204 571 HD3 LYS 94 2HD LYS 94 8.478 -4.125 8.321 572 HE2 LYS 94 1HE LYS 94 7.876 -3.789 10.826 573 HE3 LYS 94 2HE LYS 94 6.676 -5.081 10.578 574 HZ1 LYS 94 3HZ LYS 94 9.583 -5.303 10.167 575 HZ2 LYS 94 1HZ LYS 94 8.529 -6.513 9.882 576 HZ3 LYS 94 2HZ LYS 94 8.747 -5.934 11.421 577 H TYR 95 H TYR 95 5.963 1.380 7.305 578 HA TYR 95 HA TYR 95 6.906 1.775 4.496 579 HB2 TYR 95 1HB TYR 95 5.475 3.668 4.367 580 HB3 TYR 95 2HB TYR 95 4.515 2.291 4.905 581 HD1 TYR 95 1HD TYR 95 3.567 2.161 7.054 582 HD2 TYR 95 2HD TYR 95 5.930 5.541 5.915 583 HE1 TYR 95 1HE TYR 95 2.953 3.319 9.211 584 HE2 TYR 95 2HE TYR 95 5.223 6.765 7.963 585 HH TYR 95 HH TYR 95 3.869 6.702 9.881 586 H THR 96 H THR 96 7.952 4.040 4.283 587 HA THR 96 HA THR 96 9.681 4.532 6.659 588 HB THR 96 HB THR 96 10.682 2.819 5.461 589 HG1 THR 96 1HG THR 96 12.635 3.881 4.932 590 HG21 THR 96 3HG2 THR 96 11.414 2.993 3.128 591 HG22 THR 96 1HG2 THR 96 10.587 4.552 2.944 592 HG23 THR 96 2HG2 THR 96 9.664 3.057 3.226 593 H SER 97 H SER 97 11.334 6.278 5.471 594 HA SER 97 HA SER 97 9.715 8.186 3.931 595 HB2 SER 97 1HB SER 97 11.118 10.058 4.927 596 HB3 SER 97 2HB SER 97 9.807 9.376 5.872 597 HG SER 97 HG SER 97 12.592 8.857 6.247 598 H GLN 98 H GLN 98 12.182 6.039 4.123 599 HA GLN 98 HA GLN 98 13.340 6.947 1.560 600 HB2 GLN 98 1HB GLN 98 14.906 6.876 4.155 601 HB3 GLN 98 2HB GLN 98 15.643 6.289 2.690 602 HG2 GLN 98 1HG GLN 98 15.001 8.572 1.626 603 HG3 GLN 98 2HG GLN 98 14.721 9.105 3.293 604 HE21 GLN 98 1HE2 GLN 98 16.654 10.682 2.788 605 HE22 GLN 98 2HE2 GLN 98 18.233 9.950 3.058 606 H ARG 99 H ARG 99 14.094 5.258 0.304 607 HA ARG 99 HA ARG 99 13.662 2.539 0.960 608 HB2 ARG 99 1HB ARG 99 15.484 3.978 -0.978 609 HB3 ARG 99 2HB ARG 99 15.618 2.243 -0.796 610 HG2 ARG 99 1HG ARG 99 12.868 3.356 -1.382 611 HG3 ARG 99 2HG ARG 99 14.087 3.345 -2.657 612 HD2 ARG 99 1HD ARG 99 14.520 0.913 -2.187 613 HD3 ARG 99 2HD ARG 99 13.077 0.910 -1.159 614 HE ARG 99 HE ARG 99 12.047 1.934 -3.395 615 HH11 ARG 99 1HH1 ARG 99 14.323 -0.813 -3.163 616 HH12 ARG 99 2HH1 ARG 99 13.916 -1.467 -4.708 617 HH21 ARG 99 1HH2 ARG 99 11.442 0.966 -5.423 618 HH22 ARG 99 2HH2 ARG 99 12.302 -0.398 -6.013 619 H ASN 100 H ASN 100 16.383 4.557 1.745 620 HA ASN 100 HA ASN 100 17.992 2.310 2.533 621 HB2 ASN 100 1HB ASN 100 18.461 5.279 2.669 622 HB3 ASN 100 2HB ASN 100 19.488 4.264 3.624 623 HD21 ASN 100 1HD2 ASN 100 18.684 5.140 0.384 624 HD22 ASN 100 2HD2 ASN 100 20.159 4.477 -0.312 625 H THR 101 H THR 101 15.590 3.473 4.224 626 HA THR 101 HA THR 101 16.877 2.775 6.845 627 HB THR 101 HB THR 101 15.903 4.689 7.953 628 HG1 THR 101 1HG THR 101 14.228 5.356 6.899 629 HG21 THR 101 3HG2 THR 101 17.417 6.358 7.194 630 HG22 THR 101 1HG2 THR 101 17.496 5.669 5.563 631 HG23 THR 101 2HG2 THR 101 18.208 4.804 6.943 632 H LYS 102 H LYS 102 15.424 2.524 8.694 633 HA LYS 102 HA LYS 102 13.952 0.279 7.962 634 HB2 LYS 102 1HB LYS 102 15.070 1.369 10.357 635 HB3 LYS 102 2HB LYS 102 13.395 1.051 10.740 636 HG2 LYS 102 1HG LYS 102 15.287 -0.959 9.438 637 HG3 LYS 102 2HG LYS 102 15.046 -0.836 11.171 638 HD2 LYS 102 1HD LYS 102 12.862 -1.545 9.172 639 HD3 LYS 102 2HD LYS 102 13.765 -2.710 10.095 640 HE2 LYS 102 1HE LYS 102 12.030 -0.545 11.387 641 HE3 LYS 102 2HE LYS 102 11.507 -2.190 11.055 642 HZ1 LYS 102 3HZ LYS 102 13.773 -1.493 12.802 643 HZ2 LYS 102 1HZ LYS 102 13.207 -3.032 12.482 644 HZ3 LYS 102 2HZ LYS 102 12.293 -1.915 13.304 645 H LEU 103 H LEU 103 11.778 -0.309 8.849 646 HA LEU 103 HA LEU 103 9.904 1.655 7.757 647 HB2 LEU 103 1HB LEU 103 9.503 -1.258 8.480 648 HB3 LEU 103 2HB LEU 103 8.356 -0.278 7.635 649 HG LEU 103 HG LEU 103 9.242 -1.473 5.898 650 HD11 LEU 103 1HD1 LEU 103 9.543 0.867 5.287 651 HD12 LEU 103 2HD1 LEU 103 10.763 -0.180 4.545 652 HD13 LEU 103 3HD1 LEU 103 11.225 0.813 5.911 653 HD21 LEU 103 3HD2 LEU 103 11.301 -2.424 5.692 654 HD22 LEU 103 1HD2 LEU 103 10.976 -2.572 7.408 655 HD23 LEU 103 2HD2 LEU 103 12.105 -1.311 6.823 656 H LYS 104 H LYS 104 8.292 2.489 8.880 657 HA LYS 104 HA LYS 104 7.989 2.372 11.765 658 HB2 LYS 104 1HB LYS 104 6.183 3.354 9.493 659 HB3 LYS 104 2HB LYS 104 5.710 3.399 11.184 660 HG2 LYS 104 1HG LYS 104 6.442 5.490 11.026 661 HG3 LYS 104 2HG LYS 104 7.937 4.707 11.543 662 HD2 LYS 104 1HD LYS 104 8.938 4.941 9.401 663 HD3 LYS 104 2HD LYS 104 7.364 5.144 8.614 664 HE2 LYS 104 1HE LYS 104 7.059 7.299 9.898 665 HE3 LYS 104 2HE LYS 104 8.698 7.121 10.520 666 HZ1 LYS 104 3HZ LYS 104 8.600 8.609 8.651 667 HZ2 LYS 104 1HZ LYS 104 7.999 7.459 7.634 668 HZ3 LYS 104 2HZ LYS 104 9.520 7.317 8.289 669 H ALA 105 H ALA 105 5.851 1.621 12.659 670 HA ALA 105 HA ALA 105 4.881 -0.906 11.360 671 HB1 ALA 105 1HB ALA 105 6.388 -1.471 13.176 672 HB2 ALA 105 2HB ALA 105 5.493 -0.417 14.295 673 HB3 ALA 105 3HB ALA 105 4.722 -1.873 13.633 674 H LYS 106 H LYS 106 3.056 0.035 10.467 675 HA LYS 106 HA LYS 106 0.942 0.975 12.371 676 HB2 LYS 106 1HB LYS 106 1.544 2.671 10.692 677 HB3 LYS 106 2HB LYS 106 1.294 1.485 9.403 678 HG2 LYS 106 1HG LYS 106 -0.756 2.395 9.242 679 HG3 LYS 106 2HG LYS 106 -1.155 1.372 10.600 680 HD2 LYS 106 1HD LYS 106 -1.742 3.171 11.770 681 HD3 LYS 106 2HD LYS 106 -0.071 3.717 11.753 682 HE2 LYS 106 1HE LYS 106 -0.608 4.713 9.404 683 HE3 LYS 106 2HE LYS 106 -2.307 4.439 9.826 684 HZ1 LYS 106 3HZ LYS 106 -0.391 6.154 11.279 685 HZ2 LYS 106 1HZ LYS 106 -1.938 5.908 11.779 686 HZ3 LYS 106 2HZ LYS 106 -1.629 6.668 10.356 687 H ALA 107 H ALA 107 0.557 -1.261 13.004 688 HA ALA 107 HA ALA 107 -0.265 -3.139 10.917 689 HB1 ALA 107 1HB ALA 107 0.683 -4.051 13.004 690 HB2 ALA 107 2HB ALA 107 -0.588 -3.226 13.947 691 HB3 ALA 107 3HB ALA 107 -1.011 -4.537 12.825 692 H LEU 108 H LEU 108 -2.620 -3.342 10.207 693 HA LEU 108 HA LEU 108 -4.479 -1.843 11.993 694 HB2 LEU 108 1HB LEU 108 -4.299 -1.672 8.964 695 HB3 LEU 108 2HB LEU 108 -5.659 -1.042 9.906 696 HG LEU 108 HG LEU 108 -2.799 -0.072 10.293 697 HD11 LEU 108 1HD1 LEU 108 -3.373 0.268 8.003 698 HD12 LEU 108 2HD1 LEU 108 -3.315 1.809 8.849 699 HD13 LEU 108 3HD1 LEU 108 -4.898 1.086 8.440 700 HD21 LEU 108 3HD2 LEU 108 -4.376 0.441 12.136 701 HD22 LEU 108 1HD2 LEU 108 -5.484 1.204 10.982 702 HD23 LEU 108 2HD2 LEU 108 -3.877 1.904 11.282 703 H THR 109 H THR 109 -6.827 -2.601 11.088 704 HA THR 109 HA THR 109 -6.570 -5.510 10.625 705 HB THR 109 HB THR 109 -8.951 -5.591 11.227 706 HG1 THR 109 1HG THR 109 -8.670 -3.023 12.247 707 HG21 THR 109 3HG2 THR 109 -7.127 -4.312 13.304 708 HG22 THR 109 1HG2 THR 109 -7.205 -6.040 12.920 709 HG23 THR 109 2HG2 THR 109 -8.600 -5.227 13.658 710 H LEU 110 H LEU 110 -7.786 -6.587 9.040 711 HA LEU 110 HA LEU 110 -8.211 -5.279 6.507 712 HB2 LEU 110 1HB LEU 110 -9.299 -7.834 7.830 713 HB3 LEU 110 2HB LEU 110 -9.767 -7.355 6.220 714 HG LEU 110 HG LEU 110 -6.944 -8.074 7.083 715 HD11 LEU 110 1HD1 LEU 110 -8.843 -9.449 5.113 716 HD12 LEU 110 2HD1 LEU 110 -8.547 -9.998 6.778 717 HD13 LEU 110 3HD1 LEU 110 -7.239 -9.978 5.602 718 HD21 LEU 110 3HD2 LEU 110 -8.127 -6.973 4.506 719 HD22 LEU 110 1HD2 LEU 110 -6.631 -7.942 4.506 720 HD23 LEU 110 2HD2 LEU 110 -6.690 -6.415 5.404 721 H SER 111 H SER 111 -10.035 -5.155 9.425 722 HA SER 111 HA SER 111 -12.538 -4.440 8.100 723 HB2 SER 111 1HB SER 111 -12.048 -5.532 10.543 724 HB3 SER 111 2HB SER 111 -12.048 -3.834 10.989 725 HG SER 111 HG SER 111 -14.073 -3.945 10.945 726 H GLN 112 H GLN 112 -9.944 -2.776 10.070 727 HA GLN 112 HA GLN 112 -10.759 -0.165 9.918 728 HB2 GLN 112 1HB GLN 112 -8.122 -1.510 10.088 729 HB3 GLN 112 2HB GLN 112 -8.047 0.058 9.327 730 HG2 GLN 112 1HG GLN 112 -7.823 0.894 11.359 731 HG3 GLN 112 2HG GLN 112 -9.570 0.741 11.465 732 HE21 GLN 112 1HE2 GLN 112 -10.167 -0.211 13.428 733 HE22 GLN 112 2HE2 GLN 112 -9.215 -1.528 14.174 734 H LEU 113 H LEU 113 -8.624 -1.733 7.435 735 HA LEU 113 HA LEU 113 -8.470 0.571 5.869 736 HB2 LEU 113 1HB LEU 113 -8.187 -2.360 5.170 737 HB3 LEU 113 2HB LEU 113 -8.033 -1.129 3.946 738 HG LEU 113 HG LEU 113 -5.889 -1.771 4.650 739 HD11 LEU 113 1HD1 LEU 113 -6.304 0.759 4.239 740 HD12 LEU 113 2HD1 LEU 113 -4.846 0.347 5.144 741 HD13 LEU 113 3HD1 LEU 113 -6.279 0.949 5.997 742 HD21 LEU 113 3HD2 LEU 113 -6.575 -0.988 7.488 743 HD22 LEU 113 1HD2 LEU 113 -4.984 -1.468 6.862 744 HD23 LEU 113 2HD2 LEU 113 -6.328 -2.626 6.849 745 H LYS 114 H LYS 114 -10.978 -1.925 5.681 746 HA LYS 114 HA LYS 114 -12.297 -0.847 3.348 747 HB2 LYS 114 1HB LYS 114 -12.635 -3.153 4.359 748 HB3 LYS 114 2HB LYS 114 -13.491 -2.409 5.708 749 HG2 LYS 114 1HG LYS 114 -15.108 -1.406 3.938 750 HG3 LYS 114 2HG LYS 114 -14.300 -2.463 2.746 751 HD2 LYS 114 1HD LYS 114 -14.806 -4.402 4.243 752 HD3 LYS 114 2HD LYS 114 -15.691 -3.301 5.324 753 HE2 LYS 114 1HE LYS 114 -16.358 -4.153 2.457 754 HE3 LYS 114 2HE LYS 114 -17.192 -4.631 3.931 755 HZ1 LYS 114 3HZ LYS 114 -17.303 -2.060 2.550 756 HZ2 LYS 114 1HZ LYS 114 -17.677 -2.143 4.168 757 HZ3 LYS 114 2HZ LYS 114 -18.519 -3.022 3.081 758 H LYS 115 H LYS 115 -12.608 -0.314 6.867 759 HA LYS 115 HA LYS 115 -14.802 1.571 6.722 760 HB2 LYS 115 1HB LYS 115 -14.043 -0.217 8.552 761 HB3 LYS 115 2HB LYS 115 -13.037 1.130 9.075 762 HG2 LYS 115 1HG LYS 115 -14.769 2.096 10.123 763 HG3 LYS 115 2HG LYS 115 -15.737 2.106 8.660 764 HD2 LYS 115 1HD LYS 115 -15.460 -0.317 10.485 765 HD3 LYS 115 2HD LYS 115 -16.757 0.881 10.582 766 HE2 LYS 115 1HE LYS 115 -17.395 0.389 8.231 767 HE3 LYS 115 2HE LYS 115 -16.181 -0.903 8.147 768 HZ1 LYS 115 3HZ LYS 115 -18.562 -1.498 8.749 769 HZ2 LYS 115 1HZ LYS 115 -18.256 -0.867 10.230 770 HZ3 LYS 115 2HZ LYS 115 -17.380 -2.153 9.718 771 H GLU 116 H GLU 116 -11.509 1.849 6.085 772 HA GLU 116 HA GLU 116 -11.337 4.660 6.899 773 HB2 GLU 116 1HB GLU 116 -9.335 2.628 5.905 774 HB3 GLU 116 2HB GLU 116 -8.926 4.338 6.117 775 HG2 GLU 116 1HG GLU 116 -10.006 2.735 8.453 776 HG3 GLU 116 2HG GLU 116 -8.315 2.633 7.979 777 H PHE 117 H PHE 117 -10.925 2.590 3.994 778 HA PHE 117 HA PHE 117 -11.241 4.972 2.252 779 HB2 PHE 117 1HB PHE 117 -9.245 2.733 1.910 780 HB3 PHE 117 2HB PHE 117 -9.415 4.210 0.974 781 HD1 PHE 117 2HD PHE 117 -9.294 6.472 2.447 782 HD2 PHE 117 1HD PHE 117 -7.519 2.685 3.512 783 HE1 PHE 117 2HE PHE 117 -7.801 7.619 4.071 784 HE2 PHE 117 1HE PHE 117 -6.049 3.835 5.115 785 HZ PHE 117 HZ PHE 117 -6.192 6.314 5.420 786 H TYR 118 H TYR 118 -13.046 2.387 2.947 787 HA TYR 118 HA TYR 118 -13.790 2.186 0.086 788 HB2 TYR 118 1HB TYR 118 -12.257 0.230 0.982 789 HB3 TYR 118 2HB TYR 118 -13.774 -0.359 1.666 790 HD1 TYR 118 2HD TYR 118 -12.795 1.275 -1.650 791 HD2 TYR 118 1HD TYR 118 -14.439 -2.185 0.357 792 HE1 TYR 118 2HE TYR 118 -13.136 0.164 -3.832 793 HE2 TYR 118 1HE TYR 118 -14.923 -3.221 -1.841 794 HH TYR 118 HH TYR 118 -13.782 -1.911 -4.883 795 H GLN 119 H GLN 119 -14.871 3.257 2.833 796 HA GLN 119 HA GLN 119 -17.358 2.124 3.227 797 HB2 GLN 119 1HB GLN 119 -18.086 4.413 4.029 798 HB3 GLN 119 2HB GLN 119 -16.795 3.597 4.858 799 HG2 GLN 119 1HG GLN 119 -16.355 5.821 2.806 800 HG3 GLN 119 2HG GLN 119 -16.550 6.084 4.543 801 HE21 GLN 119 1HE2 GLN 119 -14.081 6.676 2.771 802 HE22 GLN 119 2HE2 GLN 119 -12.866 5.791 3.640 803 H THR 120 H THR 120 -16.939 5.110 1.116 804 HA THR 120 HA THR 120 -19.729 4.953 0.568 805 HB THR 120 HB THR 120 -19.444 6.901 -0.700 806 HG1 THR 120 1HG THR 120 -17.364 7.629 -1.347 807 HG21 THR 120 3HG2 THR 120 -17.195 7.215 1.302 808 HG22 THR 120 1HG2 THR 120 -18.917 7.216 1.754 809 HG23 THR 120 2HG2 THR 120 -18.280 8.454 0.673 810 H ARG 121 H ARG 121 -20.413 5.268 -1.936 811 HA ARG 121 HA ARG 121 -19.560 2.866 -3.399 812 HB2 ARG 121 1HB ARG 121 -21.685 4.997 -3.762 813 HB3 ARG 121 2HB ARG 121 -21.101 4.116 -5.193 814 HG2 ARG 121 1HG ARG 121 -21.577 1.943 -3.811 815 HG3 ARG 121 2HG ARG 121 -22.472 2.973 -2.700 816 HD2 ARG 121 1HD ARG 121 -23.750 3.831 -4.782 817 HD3 ARG 121 2HD ARG 121 -22.929 2.537 -5.660 818 HE ARG 121 HE ARG 121 -24.138 0.912 -4.606 819 HH11 ARG 121 1HH1 ARG 121 -25.009 4.115 -3.253 820 HH12 ARG 121 2HH1 ARG 121 -26.651 3.688 -2.949 821 HH21 ARG 121 1HH2 ARG 121 -26.332 0.299 -3.941 822 HH22 ARG 121 2HH2 ARG 121 -27.290 1.439 -3.067 823 H SER 122 H SER 122 -19.580 6.436 -4.113 824 HA SER 122 HA SER 122 -18.360 5.978 -6.587 825 HB2 SER 122 1HB SER 122 -18.223 8.484 -4.917 826 HB3 SER 122 2HB SER 122 -18.191 8.350 -6.687 827 HG SER 122 HG SER 122 -20.217 8.836 -6.296 828 H GLN 123 H GLN 123 -16.903 6.259 -3.359 829 HA GLN 123 HA GLN 123 -14.200 6.755 -4.070 830 HB2 GLN 123 1HB GLN 123 -14.920 6.778 -1.779 831 HB3 GLN 123 2HB GLN 123 -15.512 5.109 -1.883 832 HG2 GLN 123 1HG GLN 123 -13.279 4.202 -1.889 833 HG3 GLN 123 2HG GLN 123 -12.576 5.834 -2.130 834 HE21 GLN 123 1HE2 GLN 123 -15.123 4.532 0.097 835 HE22 GLN 123 2HE2 GLN 123 -14.280 5.170 1.548 836 H LYS 124 H LYS 124 -16.155 3.782 -4.238 837 HA LYS 124 HA LYS 124 -13.972 1.991 -4.593 838 HB2 LYS 124 1HB LYS 124 -16.746 1.647 -5.783 839 HB3 LYS 124 2HB LYS 124 -15.622 0.373 -5.324 840 HG2 LYS 124 1HG LYS 124 -15.963 0.903 -2.924 841 HG3 LYS 124 2HG LYS 124 -16.933 2.293 -3.354 842 HD2 LYS 124 1HD LYS 124 -18.622 0.902 -2.946 843 HD3 LYS 124 2HD LYS 124 -18.442 0.519 -4.649 844 HE2 LYS 124 1HE LYS 124 -17.316 -1.522 -4.180 845 HE3 LYS 124 2HE LYS 124 -16.890 -1.014 -2.543 846 HZ1 LYS 124 3HZ LYS 124 -19.135 -1.184 -1.873 847 HZ2 LYS 124 1HZ LYS 124 -18.702 -2.621 -2.608 848 HZ3 LYS 124 2HZ LYS 124 -19.668 -1.548 -3.387 849 H ARG 125 H ARG 125 -15.491 4.271 -6.765 850 HA ARG 125 HA ARG 125 -14.807 2.860 -9.202 851 HB2 ARG 125 1HB ARG 125 -16.376 5.146 -8.629 852 HB3 ARG 125 2HB ARG 125 -14.914 5.847 -9.345 853 HG2 ARG 125 1HG ARG 125 -15.255 4.082 -11.234 854 HG3 ARG 125 2HG ARG 125 -16.859 3.884 -10.534 855 HD2 ARG 125 1HD ARG 125 -17.333 6.277 -10.881 856 HD3 ARG 125 2HD ARG 125 -15.695 6.521 -11.495 857 HE ARG 125 HE ARG 125 -17.017 4.421 -12.922 858 HH11 ARG 125 1HH1 ARG 125 -17.056 7.967 -12.747 859 HH12 ARG 125 2HH1 ARG 125 -17.393 8.237 -14.395 860 HH21 ARG 125 1HH2 ARG 125 -17.626 4.680 -15.091 861 HH22 ARG 125 2HH2 ARG 125 -17.699 6.259 -15.806 862 H GLU 126 H GLU 126 -13.378 5.595 -7.355 863 HA GLU 126 HA GLU 126 -10.974 5.762 -8.885 864 HB2 GLU 126 1HB GLU 126 -11.845 6.683 -6.124 865 HB3 GLU 126 2HB GLU 126 -10.199 6.775 -6.580 866 HG2 GLU 126 1HG GLU 126 -10.790 8.794 -7.227 867 HG3 GLU 126 2HG GLU 126 -11.052 7.951 -8.762 868 H VAL 127 H VAL 127 -11.508 4.334 -5.660 869 HA VAL 127 HA VAL 127 -8.960 3.317 -5.313 870 HB VAL 127 HB VAL 127 -11.634 2.156 -4.419 871 HG11 VAL 127 1HG1 VAL 127 -8.873 1.408 -3.367 872 HG12 VAL 127 2HG1 VAL 127 -10.424 0.929 -2.664 873 HG13 VAL 127 3HG1 VAL 127 -9.969 0.336 -4.258 874 HG21 VAL 127 3HG2 VAL 127 -9.497 3.787 -2.935 875 HG22 VAL 127 1HG2 VAL 127 -10.996 4.460 -3.564 876 HG23 VAL 127 2HG2 VAL 127 -11.042 3.250 -2.265 877 H ASP 128 H ASP 128 -11.714 1.551 -6.985 878 HA ASP 128 HA ASP 128 -10.021 -0.733 -7.526 879 HB2 ASP 128 1HB ASP 128 -12.539 -0.669 -7.221 880 HB3 ASP 128 2HB ASP 128 -12.647 0.060 -8.822 881 H ASP 129 H ASP 129 -10.603 2.318 -9.185 882 HA ASP 129 HA ASP 129 -9.568 1.576 -11.770 883 HB2 ASP 129 1HB ASP 129 -10.838 3.551 -11.690 884 HB3 ASP 129 2HB ASP 129 -9.900 4.266 -10.361 885 H TYR 130 H TYR 130 -8.185 2.993 -8.776 886 HA TYR 130 HA TYR 130 -5.512 3.102 -9.644 887 HB2 TYR 130 1HB TYR 130 -6.413 2.497 -6.821 888 HB3 TYR 130 2HB TYR 130 -4.927 3.206 -7.299 889 HD1 TYR 130 2HD TYR 130 -6.738 5.232 -9.333 890 HD2 TYR 130 1HD TYR 130 -6.637 4.229 -5.136 891 HE1 TYR 130 2HE TYR 130 -7.509 7.482 -8.777 892 HE2 TYR 130 1HE TYR 130 -7.530 6.403 -4.572 893 HH TYR 130 HH TYR 130 -8.019 9.001 -7.062 894 H VAL 131 H VAL 131 -7.367 0.393 -8.154 895 HA VAL 131 HA VAL 131 -5.085 -1.297 -7.807 896 HB VAL 131 HB VAL 131 -8.042 -2.014 -8.034 897 HG11 VAL 131 1HG1 VAL 131 -7.247 -4.076 -6.705 898 HG12 VAL 131 2HG1 VAL 131 -6.790 -4.045 -8.404 899 HG13 VAL 131 3HG1 VAL 131 -5.598 -3.612 -7.164 900 HG21 VAL 131 3HG2 VAL 131 -8.037 -2.065 -5.623 901 HG22 VAL 131 1HG2 VAL 131 -6.263 -1.829 -5.553 902 HG23 VAL 131 2HG2 VAL 131 -7.317 -0.529 -6.051 903 H ALA 132 H ALA 132 -6.924 -0.484 -10.708 904 HA ALA 132 HA ALA 132 -5.484 -2.682 -12.124 905 HB1 ALA 132 1HB ALA 132 -7.904 -2.700 -12.408 906 HB2 ALA 132 2HB ALA 132 -7.872 -1.023 -12.993 907 HB3 ALA 132 3HB ALA 132 -7.073 -2.321 -13.934 908 H GLY 133 H GLY 133 -5.387 0.726 -11.624 909 HA2 GLY 133 1HA GLY 133 -3.908 1.442 -14.034 910 HA3 GLY 133 2HA GLY 133 -4.099 2.388 -12.558 911 H LEU 134 H LEU 134 -3.125 0.117 -10.832 912 HA LEU 134 HA LEU 134 -0.281 0.676 -11.068 913 HB2 LEU 134 1HB LEU 134 0.009 -0.512 -9.055 914 HB3 LEU 134 2HB LEU 134 -1.449 0.446 -8.935 915 HG LEU 134 HG LEU 134 -2.693 -1.790 -9.611 916 HD11 LEU 134 1HD1 LEU 134 -0.036 -2.745 -8.470 917 HD12 LEU 134 2HD1 LEU 134 -0.746 -3.257 -9.987 918 HD13 LEU 134 3HD1 LEU 134 -1.491 -3.748 -8.474 919 HD21 LEU 134 3HD2 LEU 134 -2.885 -2.291 -7.203 920 HD22 LEU 134 1HD2 LEU 134 -2.911 -0.545 -7.488 921 HD23 LEU 134 2HD2 LEU 134 -1.417 -1.328 -6.892 922 H ARG 135 H ARG 135 1.377 -0.757 -11.487 923 HA ARG 135 HA ARG 135 0.691 -2.959 -13.366 924 HB2 ARG 135 1HB ARG 135 3.134 -1.156 -13.046 925 HB3 ARG 135 2HB ARG 135 3.013 -2.449 -14.229 926 HG2 ARG 135 1HG ARG 135 1.265 -1.333 -15.444 927 HG3 ARG 135 2HG ARG 135 0.935 -0.209 -14.132 928 HD2 ARG 135 1HD ARG 135 2.020 1.150 -15.561 929 HD3 ARG 135 2HD ARG 135 3.347 0.670 -14.507 930 HE ARG 135 HE ARG 135 3.351 -1.197 -16.565 931 HH11 ARG 135 1HH1 ARG 135 3.465 2.378 -16.517 932 HH12 ARG 135 2HH1 ARG 135 4.430 2.463 -17.958 933 HH21 ARG 135 1HH2 ARG 135 4.746 -0.981 -18.412 934 HH22 ARG 135 2HH2 ARG 135 5.062 0.613 -19.045 935 H THR 136 H THR 136 2.417 -4.833 -13.254 936 HA THR 136 HA THR 136 3.535 -5.067 -10.517 937 HB THR 136 HB THR 136 2.206 -7.318 -12.028 938 HG1 THR 136 1HG THR 136 0.681 -5.713 -11.368 939 HG21 THR 136 3HG2 THR 136 3.654 -8.313 -10.436 940 HG22 THR 136 1HG2 THR 136 2.061 -8.361 -9.696 941 HG23 THR 136 2HG2 THR 136 3.232 -7.133 -9.180 942 H GLU 137 H GLU 137 4.413 -4.543 -13.520 943 HA GLU 137 HA GLU 137 7.048 -5.565 -13.345 944 HB2 GLU 137 1HB GLU 137 4.998 -7.241 -14.643 945 HB3 GLU 137 2HB GLU 137 6.182 -6.754 -15.836 946 HG2 GLU 137 1HG GLU 137 7.145 -7.902 -13.205 947 HG3 GLU 137 2HG GLU 137 6.452 -8.961 -14.404 Start of MODEL 12 1 H1 GLY 19 H GLY 19 -6.315 -20.797 -0.731 2 HA2 GLY 19 1HA GLY 19 -4.393 -19.623 0.340 3 HA3 GLY 19 2HA GLY 19 -3.837 -19.274 -1.308 4 H HIS 20 H HIS 20 -5.419 -18.014 -2.720 5 HA HIS 20 HA HIS 20 -5.946 -15.581 -1.504 6 HB2 HIS 20 1HB HIS 20 -7.167 -16.474 -4.130 7 HB3 HIS 20 2HB HIS 20 -6.637 -14.864 -3.656 8 HD1 HIS 20 1HD HIS 20 -5.516 -17.886 -5.529 9 HD2 HIS 20 2HD HIS 20 -3.786 -14.659 -3.415 10 HE1 HIS 20 1HE HIS 20 -3.071 -17.828 -6.192 11 H MET 21 H MET 21 -7.558 -15.496 0.219 12 HA MET 21 HA MET 21 -10.273 -15.502 -0.811 13 HB2 MET 21 1HB MET 21 -9.882 -17.939 -0.189 14 HB3 MET 21 2HB MET 21 -9.703 -17.421 1.487 15 HG2 MET 21 1HG MET 21 -11.982 -16.489 1.444 16 HG3 MET 21 2HG MET 21 -12.142 -16.918 -0.262 17 HE1 MET 21 3HE MET 21 -14.663 -19.181 1.717 18 HE2 MET 21 1HE MET 21 -14.126 -17.548 2.158 19 HE3 MET 21 2HE MET 21 -14.476 -17.937 0.464 20 H LYS 22 H LYS 22 -11.541 -14.114 0.266 21 HA LYS 22 HA LYS 22 -12.264 -12.467 1.560 22 HB2 LYS 22 1HB LYS 22 -9.984 -12.813 3.505 23 HB3 LYS 22 2HB LYS 22 -11.400 -11.821 3.694 24 HG2 LYS 22 1HG LYS 22 -12.866 -13.699 3.898 25 HG3 LYS 22 2HG LYS 22 -11.616 -14.855 3.449 26 HD2 LYS 22 1HD LYS 22 -11.204 -13.048 5.850 27 HD3 LYS 22 2HD LYS 22 -12.232 -14.456 5.972 28 HE2 LYS 22 1HE LYS 22 -9.985 -14.992 6.750 29 HE3 LYS 22 2HE LYS 22 -10.435 -15.967 5.364 30 HZ1 LYS 22 3HZ LYS 22 -8.160 -15.131 5.243 31 HZ2 LYS 22 1HZ LYS 22 -8.678 -13.585 5.238 32 HZ3 LYS 22 2HZ LYS 22 -9.041 -14.579 3.970 33 H PHE 23 H PHE 23 -11.918 -10.920 0.026 34 HA PHE 23 HA PHE 23 -11.035 -9.209 -1.079 35 HB2 PHE 23 1HB PHE 23 -9.655 -8.885 1.582 36 HB3 PHE 23 2HB PHE 23 -9.222 -7.869 0.230 37 HD1 PHE 23 1HD PHE 23 -12.688 -9.134 1.260 38 HD2 PHE 23 2HD PHE 23 -10.047 -5.789 0.655 39 HE1 PHE 23 1HE PHE 23 -14.573 -7.611 1.440 40 HE2 PHE 23 2HE PHE 23 -11.948 -4.241 0.829 41 HZ PHE 23 HZ PHE 23 -14.254 -5.139 1.225 42 H THR 24 H THR 24 -8.459 -8.263 -1.770 43 HA THR 24 HA THR 24 -6.839 -10.669 -2.304 44 HB THR 24 HB THR 24 -6.711 -9.773 -4.717 45 HG1 THR 24 1HG THR 24 -8.362 -8.683 -5.483 46 HG21 THR 24 3HG2 THR 24 -7.809 -11.918 -3.994 47 HG22 THR 24 1HG2 THR 24 -8.541 -11.171 -5.416 48 HG23 THR 24 2HG2 THR 24 -9.349 -11.034 -3.855 49 H ASP 25 H ASP 25 -4.690 -10.238 -2.955 50 HA ASP 25 HA ASP 25 -3.526 -8.418 -1.219 51 HB2 ASP 25 1HB ASP 25 -2.279 -9.670 -3.690 52 HB3 ASP 25 2HB ASP 25 -1.397 -8.922 -2.353 53 H GLN 26 H GLN 26 -4.153 -8.035 -4.729 54 HA GLN 26 HA GLN 26 -2.608 -5.677 -5.054 55 HB2 GLN 26 1HB GLN 26 -5.056 -5.884 -6.731 56 HB3 GLN 26 2HB GLN 26 -3.413 -5.445 -7.139 57 HG2 GLN 26 1HG GLN 26 -3.374 -7.445 -8.151 58 HG3 GLN 26 2HG GLN 26 -3.050 -8.111 -6.577 59 HE21 GLN 26 1HE2 GLN 26 -5.552 -7.486 -9.040 60 HE22 GLN 26 2HE2 GLN 26 -6.807 -8.498 -8.366 61 H GLN 27 H GLN 27 -6.048 -6.188 -4.337 62 HA GLN 27 HA GLN 27 -6.910 -3.464 -4.360 63 HB2 GLN 27 1HB GLN 27 -8.014 -5.931 -2.957 64 HB3 GLN 27 2HB GLN 27 -8.894 -4.445 -3.148 65 HG2 GLN 27 1HG GLN 27 -7.874 -6.094 -5.530 66 HG3 GLN 27 2HG GLN 27 -9.410 -6.384 -4.732 67 HE21 GLN 27 1HE2 GLN 27 -8.872 -5.551 -7.622 68 HE22 GLN 27 2HE2 GLN 27 -9.808 -4.120 -7.827 69 H ILE 28 H ILE 28 -5.920 -5.674 -1.695 70 HA ILE 28 HA ILE 28 -6.259 -3.800 0.412 71 HB ILE 28 HB ILE 28 -4.440 -6.237 0.133 72 HG12 ILE 28 1HG1 ILE 28 -7.070 -6.010 1.677 73 HG13 ILE 28 2HG1 ILE 28 -7.015 -6.541 0.021 74 HG21 ILE 28 1HG2 ILE 28 -4.413 -6.182 2.685 75 HG22 ILE 28 2HG2 ILE 28 -3.498 -4.899 1.908 76 HG23 ILE 28 3HG2 ILE 28 -5.098 -4.553 2.579 77 HD11 ILE 28 3HD1 ILE 28 -5.685 -7.954 2.383 78 HD12 ILE 28 1HD1 ILE 28 -7.068 -8.492 1.420 79 HD13 ILE 28 2HD1 ILE 28 -5.457 -8.405 0.684 80 H GLY 29 H GLY 29 -3.430 -4.374 -1.736 81 HA2 GLY 29 1HA GLY 29 -1.675 -2.699 -0.242 82 HA3 GLY 29 2HA GLY 29 -1.472 -3.179 -1.926 83 H VAL 30 H VAL 30 -4.302 -1.813 -2.405 84 HA VAL 30 HA VAL 30 -3.268 0.872 -2.945 85 HB VAL 30 HB VAL 30 -6.083 -0.305 -3.141 86 HG11 VAL 30 1HG1 VAL 30 -6.163 2.155 -2.896 87 HG12 VAL 30 2HG1 VAL 30 -4.994 2.315 -4.230 88 HG13 VAL 30 3HG1 VAL 30 -6.608 1.626 -4.528 89 HG21 VAL 30 3HG2 VAL 30 -3.824 0.126 -5.121 90 HG22 VAL 30 1HG2 VAL 30 -4.663 -1.387 -4.748 91 HG23 VAL 30 2HG2 VAL 30 -5.497 -0.098 -5.641 92 H LEU 31 H LEU 31 -5.654 -0.648 -0.728 93 HA LEU 31 HA LEU 31 -6.206 1.796 0.644 94 HB2 LEU 31 1HB LEU 31 -6.491 -1.026 1.744 95 HB3 LEU 31 2HB LEU 31 -7.255 0.443 2.337 96 HG LEU 31 HG LEU 31 -7.876 -1.116 -0.172 97 HD11 LEU 31 1HD1 LEU 31 -8.974 -1.629 2.006 98 HD12 LEU 31 2HD1 LEU 31 -10.122 -1.105 0.773 99 HD13 LEU 31 3HD1 LEU 31 -9.625 0.026 2.050 100 HD21 LEU 31 3HD2 LEU 31 -8.702 1.759 0.382 101 HD22 LEU 31 1HD2 LEU 31 -9.561 0.690 -0.733 102 HD23 LEU 31 2HD2 LEU 31 -7.880 1.129 -1.060 103 H ALA 32 H ALA 32 -3.800 -0.734 1.252 104 HA ALA 32 HA ALA 32 -2.674 0.293 3.654 105 HB1 ALA 32 1HB ALA 32 -1.185 -1.003 1.329 106 HB2 ALA 32 2HB ALA 32 -0.609 -0.856 2.997 107 HB3 ALA 32 3HB ALA 32 -2.010 -1.895 2.628 108 H GLY 33 H GLY 33 -1.876 1.220 0.236 109 HA2 GLY 33 1HA GLY 33 0.050 3.201 1.037 110 HA3 GLY 33 2HA GLY 33 -0.748 3.061 -0.533 111 H LEU 34 H LEU 34 -3.517 3.314 0.475 112 HA LEU 34 HA LEU 34 -3.649 6.149 0.628 113 HB2 LEU 34 1HB LEU 34 -5.761 4.067 1.280 114 HB3 LEU 34 2HB LEU 34 -6.071 5.798 1.283 115 HG LEU 34 HG LEU 34 -5.157 4.231 -1.161 116 HD11 LEU 34 1HD1 LEU 34 -7.882 5.399 -0.447 117 HD12 LEU 34 2HD1 LEU 34 -7.455 3.679 -0.431 118 HD13 LEU 34 3HD1 LEU 34 -7.448 4.558 -1.959 119 HD21 LEU 34 3HD2 LEU 34 -4.390 6.526 -1.350 120 HD22 LEU 34 1HD2 LEU 34 -5.974 7.152 -0.835 121 HD23 LEU 34 2HD2 LEU 34 -5.774 6.309 -2.403 122 H ALA 35 H ALA 35 -3.383 3.791 3.239 123 HA ALA 35 HA ALA 35 -3.957 5.793 5.302 124 HB1 ALA 35 1HB ALA 35 -3.064 4.079 6.855 125 HB2 ALA 35 2HB ALA 35 -4.327 3.448 5.793 126 HB3 ALA 35 3HB ALA 35 -2.616 3.061 5.468 127 H ILE 36 H ILE 36 -1.229 5.326 3.220 128 HA ILE 36 HA ILE 36 0.623 6.633 5.138 129 HB ILE 36 HB ILE 36 1.189 4.157 3.475 130 HG12 ILE 36 1HG1 ILE 36 -0.080 3.409 5.389 131 HG13 ILE 36 2HG1 ILE 36 1.603 2.925 5.475 132 HG21 ILE 36 1HG2 ILE 36 3.381 4.137 4.573 133 HG22 ILE 36 2HG2 ILE 36 3.172 5.592 3.619 134 HG23 ILE 36 3HG2 ILE 36 3.026 5.682 5.377 135 HD11 ILE 36 3HD1 ILE 36 1.955 4.822 7.148 136 HD12 ILE 36 1HD1 ILE 36 0.183 4.896 7.226 137 HD13 ILE 36 2HD1 ILE 36 1.020 3.413 7.654 138 H SER 37 H SER 37 0.328 8.567 3.968 139 HA SER 37 HA SER 37 0.815 10.125 2.443 140 HB2 SER 37 1HB SER 37 3.041 8.593 2.567 141 HB3 SER 37 2HB SER 37 2.689 8.399 0.860 142 HG SER 37 HG SER 37 2.733 10.674 0.684 143 HA PRO 38 HA PRO 38 -2.208 7.789 -0.364 144 HB2 PRO 38 1HB PRO 38 -4.287 9.644 -0.125 145 HB3 PRO 38 2HB PRO 38 -4.107 8.203 0.896 146 HG2 PRO 38 1HG PRO 38 -3.191 11.017 1.463 147 HG3 PRO 38 2HG PRO 38 -4.050 9.897 2.562 148 HD2 PRO 38 1HD PRO 38 -1.404 10.214 2.788 149 HD3 PRO 38 2HD PRO 38 -2.102 8.573 2.881 150 H GLU 39 H GLU 39 -1.366 11.239 -0.058 151 HA GLU 39 HA GLU 39 -2.148 12.056 -2.697 152 HB2 GLU 39 1HB GLU 39 -0.082 13.047 -0.733 153 HB3 GLU 39 2HB GLU 39 -0.438 13.900 -2.250 154 HG2 GLU 39 1HG GLU 39 -2.584 14.522 -1.618 155 HG3 GLU 39 2HG GLU 39 -2.742 13.227 -0.434 156 H TRP 40 H TRP 40 0.800 10.466 -1.478 157 HA TRP 40 HA TRP 40 2.340 10.907 -3.892 158 HB2 TRP 40 1HB TRP 40 3.606 10.419 -1.948 159 HB3 TRP 40 2HB TRP 40 2.616 9.038 -1.526 160 HD1 TRP 40 HD TRP 40 5.336 9.995 -4.115 161 HE1 TRP 40 1HE TRP 40 6.682 7.938 -4.636 162 HE3 TRP 40 3HE TRP 40 2.281 6.511 -1.943 163 HZ2 TRP 40 2HZ TRP 40 6.400 5.041 -4.327 164 HZ3 TRP 40 3HZ TRP 40 2.654 4.118 -2.357 165 HH2 TRP 40 HH TRP 40 4.782 3.347 -3.461 166 H LEU 41 H LEU 41 0.530 8.111 -2.514 167 HA LEU 41 HA LEU 41 0.652 6.400 -4.717 168 HB2 LEU 41 1HB LEU 41 -0.181 5.744 -2.572 169 HB3 LEU 41 2HB LEU 41 -1.563 6.826 -2.665 170 HG LEU 41 HG LEU 41 -1.208 4.607 -4.722 171 HD11 LEU 41 1HD1 LEU 41 -2.615 3.186 -3.201 172 HD12 LEU 41 2HD1 LEU 41 -2.392 4.390 -1.923 173 HD13 LEU 41 3HD1 LEU 41 -0.994 3.500 -2.603 174 HD21 LEU 41 3HD2 LEU 41 -3.612 6.103 -3.584 175 HD22 LEU 41 1HD2 LEU 41 -3.736 4.650 -4.613 176 HD23 LEU 41 2HD2 LEU 41 -3.026 6.112 -5.263 177 H LYS 42 H LYS 42 -1.849 8.919 -4.098 178 HA LYS 42 HA LYS 42 -3.264 8.643 -6.480 179 HB2 LYS 42 1HB LYS 42 -2.799 10.936 -4.574 180 HB3 LYS 42 2HB LYS 42 -3.807 11.147 -5.995 181 HG2 LYS 42 1HG LYS 42 -5.344 9.428 -5.306 182 HG3 LYS 42 2HG LYS 42 -4.318 8.935 -3.956 183 HD2 LYS 42 1HD LYS 42 -4.656 11.050 -2.820 184 HD3 LYS 42 2HD LYS 42 -5.491 11.722 -4.241 185 HE2 LYS 42 1HE LYS 42 -7.311 10.107 -3.993 186 HE3 LYS 42 2HE LYS 42 -6.503 9.371 -2.593 187 HZ1 LYS 42 3HZ LYS 42 -7.411 12.182 -2.693 188 HZ2 LYS 42 1HZ LYS 42 -6.872 11.344 -1.345 189 HZ3 LYS 42 2HZ LYS 42 -8.285 10.989 -2.034 190 H GLN 43 H GLN 43 -0.496 10.913 -5.911 191 HA GLN 43 HA GLN 43 -0.460 11.930 -8.556 192 HB2 GLN 43 1HB GLN 43 1.552 12.845 -8.208 193 HB3 GLN 43 2HB GLN 43 0.628 13.039 -6.657 194 HG2 GLN 43 1HG GLN 43 1.944 11.371 -5.728 195 HG3 GLN 43 2HG GLN 43 2.615 11.043 -7.351 196 HE21 GLN 43 1HE2 GLN 43 4.920 11.483 -6.674 197 HE22 GLN 43 2HE2 GLN 43 5.390 13.108 -6.408 198 H ASN 44 H ASN 44 1.169 9.219 -7.217 199 HA ASN 44 HA ASN 44 2.679 8.468 -9.499 200 HB2 ASN 44 1HB ASN 44 1.497 6.474 -7.570 201 HB3 ASN 44 2HB ASN 44 2.959 6.312 -8.508 202 HD21 ASN 44 1HD2 ASN 44 4.152 9.098 -7.486 203 HD22 ASN 44 2HD2 ASN 44 4.303 8.708 -5.812 204 H ILE 45 H ILE 45 -0.518 7.145 -8.382 205 HA ILE 45 HA ILE 45 -0.937 5.394 -10.560 206 HB ILE 45 HB ILE 45 -2.782 6.866 -8.633 207 HG12 ILE 45 1HG1 ILE 45 -1.420 5.103 -7.639 208 HG13 ILE 45 2HG1 ILE 45 -3.115 4.754 -7.541 209 HG21 ILE 45 1HG2 ILE 45 -4.630 5.342 -9.292 210 HG22 ILE 45 2HG2 ILE 45 -4.218 6.521 -10.523 211 HG23 ILE 45 3HG2 ILE 45 -3.684 4.841 -10.718 212 HD11 ILE 45 3HD1 ILE 45 -2.892 3.145 -9.430 213 HD12 ILE 45 1HD1 ILE 45 -1.149 3.516 -9.509 214 HD13 ILE 45 2HD1 ILE 45 -1.821 2.745 -8.079 215 H ALA 46 H ALA 46 -1.750 8.863 -10.162 216 HA ALA 46 HA ALA 46 -3.274 9.106 -12.566 217 HB1 ALA 46 1HB ALA 46 -1.684 11.203 -11.025 218 HB2 ALA 46 2HB ALA 46 -2.984 11.506 -12.198 219 HB3 ALA 46 3HB ALA 46 -3.355 10.714 -10.665 220 H ALA 47 H ALA 47 0.051 8.520 -12.220 221 HA ALA 47 HA ALA 47 0.570 9.375 -15.009 222 HB1 ALA 47 1HB ALA 47 1.753 10.783 -13.398 223 HB2 ALA 47 2HB ALA 47 2.451 9.343 -12.631 224 HB3 ALA 47 3HB ALA 47 2.882 9.772 -14.320 225 H ASN 48 H ASN 48 -0.277 6.754 -13.376 226 HA ASN 48 HA ASN 48 0.236 4.588 -13.147 227 HB2 ASN 48 1HB ASN 48 -0.465 4.964 -15.642 228 HB3 ASN 48 2HB ASN 48 1.186 4.475 -16.006 229 HD21 ASN 48 1HD2 ASN 48 1.832 2.318 -14.676 230 HD22 ASN 48 2HD2 ASN 48 0.589 1.071 -14.658 231 H GLN 49 H GLN 49 2.227 6.221 -12.188 232 HA GLN 49 HA GLN 49 4.799 4.864 -12.816 233 HB2 GLN 49 1HB GLN 49 4.589 7.365 -11.179 234 HB3 GLN 49 2HB GLN 49 6.018 6.576 -11.805 235 HG2 GLN 49 1HG GLN 49 3.928 7.924 -13.510 236 HG3 GLN 49 2HG GLN 49 5.397 8.701 -12.970 237 HE21 GLN 49 1HE2 GLN 49 4.014 6.492 -15.316 238 HE22 GLN 49 2HE2 GLN 49 5.546 6.249 -16.202 239 H LEU 50 H LEU 50 2.744 3.403 -11.436 240 HA LEU 50 HA LEU 50 4.076 3.257 -8.809 241 HB2 LEU 50 1HB LEU 50 1.599 4.453 -8.967 242 HB3 LEU 50 2HB LEU 50 1.123 2.812 -8.806 243 HG LEU 50 HG LEU 50 2.829 4.547 -6.967 244 HD11 LEU 50 1HD1 LEU 50 0.234 3.039 -6.436 245 HD12 LEU 50 2HD1 LEU 50 0.420 4.789 -6.673 246 HD13 LEU 50 3HD1 LEU 50 1.112 4.037 -5.260 247 HD21 LEU 50 3HD2 LEU 50 2.381 1.624 -6.433 248 HD22 LEU 50 1HD2 LEU 50 3.073 2.849 -5.320 249 HD23 LEU 50 2HD2 LEU 50 3.933 2.437 -6.771 250 H VAL 51 H VAL 51 4.418 1.155 -8.186 251 HA VAL 51 HA VAL 51 3.190 -1.064 -9.720 252 HB VAL 51 HB VAL 51 5.619 -0.400 -10.264 253 HG11 VAL 51 1HG1 VAL 51 6.303 -1.936 -7.910 254 HG12 VAL 51 2HG1 VAL 51 7.256 -1.647 -9.405 255 HG13 VAL 51 3HG1 VAL 51 6.711 -0.244 -8.448 256 HG21 VAL 51 3HG2 VAL 51 5.763 -2.604 -11.165 257 HG22 VAL 51 1HG2 VAL 51 5.588 -3.358 -9.586 258 HG23 VAL 51 2HG2 VAL 51 4.167 -2.867 -10.429 259 H TYR 52 H TYR 52 3.379 -3.108 -8.614 260 HA TYR 52 HA TYR 52 3.239 -3.064 -5.676 261 HB2 TYR 52 1HB TYR 52 0.936 -3.108 -6.277 262 HB3 TYR 52 2HB TYR 52 1.226 -4.027 -7.746 263 HD1 TYR 52 1HD TYR 52 1.095 -4.226 -4.007 264 HD2 TYR 52 2HD TYR 52 1.429 -6.450 -7.678 265 HE1 TYR 52 1HE TYR 52 0.806 -6.347 -2.741 266 HE2 TYR 52 2HE TYR 52 1.204 -8.572 -6.442 267 HH TYR 52 HH TYR 52 0.739 -9.525 -4.361 268 H GLY 53 H GLY 53 4.824 -4.503 -5.065 269 HA2 GLY 53 1HA GLY 53 5.430 -6.805 -6.814 270 HA3 GLY 53 2HA GLY 53 6.751 -5.762 -6.282 271 H ILE 54 H ILE 54 7.153 -8.208 -5.441 272 HA ILE 54 HA ILE 54 6.430 -8.211 -2.552 273 HB ILE 54 HB ILE 54 6.854 -10.532 -4.460 274 HG12 ILE 54 1HG1 ILE 54 4.520 -9.449 -4.323 275 HG13 ILE 54 2HG1 ILE 54 4.667 -11.181 -4.169 276 HG21 ILE 54 1HG2 ILE 54 6.498 -12.041 -2.505 277 HG22 ILE 54 2HG2 ILE 54 7.995 -11.128 -2.409 278 HG23 ILE 54 3HG2 ILE 54 6.616 -10.648 -1.423 279 HD11 ILE 54 3HD1 ILE 54 4.311 -11.036 -1.745 280 HD12 ILE 54 1HD1 ILE 54 4.341 -9.284 -1.825 281 HD13 ILE 54 2HD1 ILE 54 3.018 -10.177 -2.596 282 H VAL 55 H VAL 55 8.142 -8.483 -1.189 283 HA VAL 55 HA VAL 55 10.697 -7.666 -1.678 284 HB VAL 55 HB VAL 55 9.352 -9.387 0.429 285 HG11 VAL 55 1HG1 VAL 55 11.467 -8.741 1.840 286 HG12 VAL 55 2HG1 VAL 55 11.495 -10.175 0.817 287 HG13 VAL 55 3HG1 VAL 55 12.273 -8.681 0.255 288 HG21 VAL 55 3HG2 VAL 55 10.502 -6.569 0.447 289 HG22 VAL 55 1HG2 VAL 55 8.785 -6.958 0.190 290 HG23 VAL 55 2HG2 VAL 55 9.547 -7.337 1.724 291 H LYS 56 H LYS 56 10.095 -11.192 -1.009 292 HA LYS 56 HA LYS 56 11.355 -12.975 -1.469 293 HB2 LYS 56 1HB LYS 56 11.678 -11.513 -4.116 294 HB3 LYS 56 2HB LYS 56 12.321 -13.104 -3.894 295 HG2 LYS 56 1HG LYS 56 9.423 -12.594 -3.184 296 HG3 LYS 56 2HG LYS 56 9.893 -12.715 -4.858 297 HD2 LYS 56 1HD LYS 56 10.704 -14.989 -4.545 298 HD3 LYS 56 2HD LYS 56 10.529 -14.852 -2.787 299 HE2 LYS 56 1HE LYS 56 8.626 -16.095 -3.543 300 HE3 LYS 56 2HE LYS 56 8.066 -14.488 -3.095 301 HZ1 LYS 56 3HZ LYS 56 8.475 -14.139 -5.712 302 HZ2 LYS 56 1HZ LYS 56 7.058 -14.729 -5.072 303 HZ3 LYS 56 2HZ LYS 56 8.143 -15.736 -5.714 304 HA PRO 57 HA PRO 57 15.414 -12.069 -0.084 305 HB2 PRO 57 1HB PRO 57 16.965 -14.195 -0.676 306 HB3 PRO 57 2HB PRO 57 15.517 -14.335 0.368 307 HG2 PRO 57 1HG PRO 57 15.755 -14.991 -2.566 308 HG3 PRO 57 2HG PRO 57 15.019 -15.970 -1.260 309 HD2 PRO 57 1HD PRO 57 13.629 -14.325 -2.962 310 HD3 PRO 57 2HD PRO 57 13.052 -14.697 -1.322 311 H SER 58 H SER 58 14.800 -11.846 -3.342 312 HA SER 58 HA SER 58 17.206 -12.043 -4.699 313 HB2 SER 58 1HB SER 58 15.711 -10.604 -6.340 314 HB3 SER 58 2HB SER 58 15.207 -12.240 -5.918 315 HG SER 58 HG SER 58 13.520 -10.710 -5.780 316 H ASP 59 H ASP 59 15.387 -9.041 -4.303 317 HA ASP 59 HA ASP 59 17.862 -7.480 -4.541 318 HB2 ASP 59 1HB ASP 59 14.954 -6.890 -4.766 319 HB3 ASP 59 2HB ASP 59 15.982 -5.597 -4.149 320 H THR 60 H THR 60 18.388 -5.783 -2.965 321 HA THR 60 HA THR 60 18.783 -7.106 -0.461 322 HB THR 60 HB THR 60 19.438 -4.200 -0.813 323 HG1 THR 60 1HG THR 60 19.924 -4.757 -2.790 324 HG21 THR 60 3HG2 THR 60 21.568 -4.872 0.192 325 HG22 THR 60 1HG2 THR 60 21.106 -6.586 0.082 326 HG23 THR 60 2HG2 THR 60 20.222 -5.484 1.158 327 H VAL 61 H VAL 61 17.455 -7.019 1.282 328 HA VAL 61 HA VAL 61 15.676 -4.681 1.665 329 HB VAL 61 HB VAL 61 13.912 -6.397 2.317 330 HG11 VAL 61 1HG1 VAL 61 13.118 -6.684 0.001 331 HG12 VAL 61 2HG1 VAL 61 13.781 -5.067 0.251 332 HG13 VAL 61 3HG1 VAL 61 14.742 -6.273 -0.615 333 HG21 VAL 61 3HG2 VAL 61 15.581 -8.345 2.388 334 HG22 VAL 61 1HG2 VAL 61 14.044 -8.643 1.584 335 HG23 VAL 61 2HG2 VAL 61 15.495 -8.364 0.617 336 HA PRO 62 HA PRO 62 16.788 -5.160 5.955 337 HB2 PRO 62 1HB PRO 62 14.491 -4.423 7.263 338 HB3 PRO 62 2HB PRO 62 15.597 -3.267 6.468 339 HG2 PRO 62 1HG PRO 62 13.009 -4.416 5.445 340 HG3 PRO 62 2HG PRO 62 13.604 -2.731 5.329 341 HD2 PRO 62 1HD PRO 62 13.768 -4.538 3.282 342 HD3 PRO 62 2HD PRO 62 14.970 -3.251 3.498 343 H ALA 63 H ALA 63 16.021 -6.330 7.970 344 HA ALA 63 HA ALA 63 15.024 -9.020 7.329 345 HB1 ALA 63 1HB ALA 63 15.717 -7.616 9.959 346 HB2 ALA 63 2HB ALA 63 15.368 -9.351 9.758 347 HB3 ALA 63 3HB ALA 63 16.807 -8.634 9.002 348 H GLY 64 H GLY 64 13.040 -9.880 8.081 349 HA2 GLY 64 1HA GLY 64 10.993 -9.996 9.107 350 HA3 GLY 64 2HA GLY 64 11.273 -8.414 9.840 351 H VAL 65 H VAL 65 11.215 -9.478 6.423 352 HA VAL 65 HA VAL 65 8.602 -8.374 5.921 353 HB VAL 65 HB VAL 65 9.363 -6.984 3.936 354 HG11 VAL 65 1HG1 VAL 65 9.472 -4.964 5.015 355 HG12 VAL 65 2HG1 VAL 65 8.470 -6.009 6.036 356 HG13 VAL 65 3HG1 VAL 65 10.157 -5.654 6.491 357 HG21 VAL 65 3HG2 VAL 65 12.034 -6.794 5.386 358 HG22 VAL 65 1HG2 VAL 65 11.766 -7.742 3.913 359 HG23 VAL 65 2HG2 VAL 65 11.539 -5.983 3.878 360 H ASP 66 H ASP 66 10.025 -11.015 5.821 361 HA ASP 66 HA ASP 66 11.423 -11.421 3.546 362 HB2 ASP 66 1HB ASP 66 11.139 -12.820 5.741 363 HB3 ASP 66 2HB ASP 66 9.796 -13.586 4.936 364 H ASP 67 H ASP 67 8.169 -11.455 3.657 365 HA ASP 67 HA ASP 67 7.793 -12.367 0.882 366 HB2 ASP 67 1HB ASP 67 5.928 -13.853 1.640 367 HB3 ASP 67 2HB ASP 67 7.449 -14.324 2.373 368 H TYR 68 H TYR 68 7.652 -9.804 2.506 369 HA TYR 68 HA TYR 68 4.882 -8.942 2.549 370 HB2 TYR 68 1HB TYR 68 7.551 -7.582 2.915 371 HB3 TYR 68 2HB TYR 68 6.095 -6.648 2.720 372 HD1 TYR 68 2HD TYR 68 6.427 -9.900 4.669 373 HD2 TYR 68 1HD TYR 68 5.751 -5.619 4.792 374 HE1 TYR 68 2HE TYR 68 5.486 -10.133 6.879 375 HE2 TYR 68 1HE TYR 68 4.792 -5.855 7.050 376 HH TYR 68 HH TYR 68 4.309 -9.083 8.583 377 H SER 69 H SER 69 3.914 -7.434 1.187 378 HA SER 69 HA SER 69 4.830 -7.286 -1.575 379 HB2 SER 69 1HB SER 69 2.559 -5.839 -0.216 380 HB3 SER 69 2HB SER 69 2.798 -6.070 -1.937 381 HG SER 69 HG SER 69 2.206 -8.182 -1.732 382 H TYR 70 H TYR 70 5.101 -5.091 -2.552 383 HA TYR 70 HA TYR 70 5.534 -2.897 -0.693 384 HB2 TYR 70 1HB TYR 70 7.625 -2.175 -1.672 385 HB3 TYR 70 2HB TYR 70 7.831 -3.751 -0.951 386 HD1 TYR 70 1HD TYR 70 7.326 -1.997 -4.254 387 HD2 TYR 70 2HD TYR 70 8.751 -5.556 -2.225 388 HE1 TYR 70 1HE TYR 70 8.277 -2.820 -6.401 389 HE2 TYR 70 2HE TYR 70 9.820 -6.306 -4.338 390 HH TYR 70 HH TYR 70 10.202 -5.854 -6.602 391 H LEU 71 H LEU 71 5.360 -0.802 -1.750 392 HA LEU 71 HA LEU 71 4.378 -0.855 -4.542 393 HB2 LEU 71 1HB LEU 71 3.770 1.235 -2.398 394 HB3 LEU 71 2HB LEU 71 3.101 1.102 -4.006 395 HG LEU 71 HG LEU 71 1.362 0.435 -2.848 396 HD11 LEU 71 1HD1 LEU 71 2.269 -1.537 -4.305 397 HD12 LEU 71 2HD1 LEU 71 0.853 -1.779 -3.255 398 HD13 LEU 71 3HD1 LEU 71 2.454 -2.353 -2.758 399 HD21 LEU 71 3HD2 LEU 71 1.235 -0.794 -0.770 400 HD22 LEU 71 1HD2 LEU 71 2.269 0.634 -0.629 401 HD23 LEU 71 2HD2 LEU 71 3.009 -0.977 -0.763 402 H VAL 72 H VAL 72 5.572 0.553 -6.016 403 HA VAL 72 HA VAL 72 7.209 2.677 -4.809 404 HB VAL 72 HB VAL 72 8.726 0.841 -4.524 405 HG11 VAL 72 1HG1 VAL 72 9.489 -0.690 -6.148 406 HG12 VAL 72 2HG1 VAL 72 7.715 -0.746 -6.222 407 HG13 VAL 72 3HG1 VAL 72 8.639 0.126 -7.465 408 HG21 VAL 72 3HG2 VAL 72 10.625 1.527 -5.838 409 HG22 VAL 72 1HG2 VAL 72 9.563 2.202 -7.101 410 HG23 VAL 72 2HG2 VAL 72 9.649 2.972 -5.476 411 H ALA 73 H ALA 73 8.020 4.277 -6.611 412 HA ALA 73 HA ALA 73 6.225 4.015 -8.895 413 HB1 ALA 73 1HB ALA 73 7.108 6.403 -9.278 414 HB2 ALA 73 2HB ALA 73 6.105 6.145 -7.830 415 HB3 ALA 73 3HB ALA 73 7.845 6.256 -7.666 416 H ALA 74 H ALA 74 6.925 3.237 -10.747 417 HA ALA 74 HA ALA 74 9.389 1.880 -10.818 418 HB1 ALA 74 1HB ALA 74 7.403 1.192 -12.076 419 HB2 ALA 74 2HB ALA 74 7.691 2.573 -13.220 420 HB3 ALA 74 3HB ALA 74 8.846 1.260 -13.097 421 H ASP 75 H ASP 75 8.987 5.155 -11.543 422 HA ASP 75 HA ASP 75 11.470 5.250 -13.198 423 HB2 ASP 75 1HB ASP 75 9.190 5.901 -14.251 424 HB3 ASP 75 2HB ASP 75 9.182 7.277 -13.133 425 H ASP 76 H ASP 76 10.451 5.580 -10.192 426 HA ASP 76 HA ASP 76 12.367 7.676 -9.373 427 HB2 ASP 76 1HB ASP 76 9.965 8.541 -9.364 428 HB3 ASP 76 2HB ASP 76 9.550 7.183 -8.371 429 H GLN 77 H GLN 77 12.732 4.845 -9.699 430 HA GLN 77 HA GLN 77 11.629 3.380 -7.570 431 HB2 GLN 77 1HB GLN 77 14.165 2.611 -9.062 432 HB3 GLN 77 2HB GLN 77 13.122 1.543 -8.105 433 HG2 GLN 77 1HG GLN 77 11.205 2.242 -9.642 434 HG3 GLN 77 2HG GLN 77 12.435 2.952 -10.706 435 HE21 GLN 77 1HE2 GLN 77 12.007 -0.243 -8.908 436 HE22 GLN 77 2HE2 GLN 77 12.271 -1.190 -10.354 437 H ASP 78 H ASP 78 14.236 5.558 -7.238 438 HA ASP 78 HA ASP 78 15.190 4.355 -4.692 439 HB2 ASP 78 1HB ASP 78 17.173 5.620 -4.978 440 HB3 ASP 78 2HB ASP 78 16.871 4.769 -6.490 441 H GLY 79 H GLY 79 12.824 6.484 -5.670 442 HA2 GLY 79 1HA GLY 79 13.356 8.693 -3.839 443 HA3 GLY 79 2HA GLY 79 11.911 8.416 -4.805 444 H THR 80 H THR 80 10.408 6.626 -4.052 445 HA THR 80 HA THR 80 10.386 6.471 -1.085 446 HB THR 80 HB THR 80 8.018 6.742 -2.973 447 HG1 THR 80 1HG THR 80 8.694 8.739 -3.111 448 HG21 THR 80 3HG2 THR 80 8.297 7.066 0.038 449 HG22 THR 80 1HG2 THR 80 7.332 5.834 -0.826 450 HG23 THR 80 2HG2 THR 80 6.842 7.522 -0.898 451 H ILE 81 H ILE 81 9.313 4.549 -0.194 452 HA ILE 81 HA ILE 81 8.143 2.704 -2.030 453 HB ILE 81 HB ILE 81 10.434 1.870 -2.162 454 HG12 ILE 81 1HG1 ILE 81 9.138 -0.066 -0.209 455 HG13 ILE 81 2HG1 ILE 81 8.438 0.216 -1.789 456 HG21 ILE 81 1HG2 ILE 81 11.793 1.164 -0.294 457 HG22 ILE 81 2HG2 ILE 81 11.333 2.850 -0.056 458 HG23 ILE 81 3HG2 ILE 81 10.524 1.583 0.864 459 HD11 ILE 81 3HD1 ILE 81 9.912 -1.741 -1.850 460 HD12 ILE 81 1HD1 ILE 81 10.595 -0.452 -2.861 461 HD13 ILE 81 2HD1 ILE 81 11.261 -0.783 -1.246 462 H ILE 82 H ILE 82 6.672 1.299 -0.868 463 HA ILE 82 HA ILE 82 6.591 1.571 2.089 464 HB ILE 82 HB ILE 82 4.247 1.856 0.172 465 HG12 ILE 82 1HG1 ILE 82 5.169 3.804 2.336 466 HG13 ILE 82 2HG1 ILE 82 5.686 3.922 0.660 467 HG21 ILE 82 1HG2 ILE 82 2.804 2.034 2.216 468 HG22 ILE 82 2HG2 ILE 82 3.529 0.443 2.042 469 HG23 ILE 82 3HG2 ILE 82 4.194 1.583 3.223 470 HD11 ILE 82 3HD1 ILE 82 2.819 4.165 1.584 471 HD12 ILE 82 1HD1 ILE 82 3.883 5.436 0.954 472 HD13 ILE 82 2HD1 ILE 82 3.378 4.108 -0.102 473 H PHE 83 H PHE 83 6.814 -0.457 2.940 474 HA PHE 83 HA PHE 83 6.154 -2.829 1.294 475 HB2 PHE 83 1HB PHE 83 7.401 -2.593 4.059 476 HB3 PHE 83 2HB PHE 83 7.112 -4.080 3.246 477 HD1 PHE 83 2HD PHE 83 8.453 -4.676 1.168 478 HD2 PHE 83 1HD PHE 83 9.254 -1.156 3.500 479 HE1 PHE 83 2HE PHE 83 10.637 -4.379 -0.006 480 HE2 PHE 83 1HE PHE 83 11.460 -0.904 2.360 481 HZ PHE 83 HZ PHE 83 12.141 -2.521 0.619 482 H PHE 84 H PHE 84 4.526 -4.412 2.124 483 HA PHE 84 HA PHE 84 3.296 -3.861 4.637 484 HB2 PHE 84 1HB PHE 84 1.042 -3.528 4.032 485 HB3 PHE 84 2HB PHE 84 1.918 -2.384 3.045 486 HD1 PHE 84 1HD PHE 84 2.125 -2.715 0.589 487 HD2 PHE 84 2HD PHE 84 -0.169 -5.429 3.027 488 HE1 PHE 84 1HE PHE 84 1.006 -3.624 -1.438 489 HE2 PHE 84 2HE PHE 84 -1.249 -6.345 1.010 490 HZ PHE 84 HZ PHE 84 -0.676 -5.454 -1.220 491 H LYS 85 H LYS 85 1.901 -5.722 5.320 492 HA LYS 85 HA LYS 85 1.525 -7.812 3.283 493 HB2 LYS 85 1HB LYS 85 3.611 -8.294 4.698 494 HB3 LYS 85 2HB LYS 85 2.418 -8.828 5.900 495 HG2 LYS 85 1HG LYS 85 1.309 -10.084 3.869 496 HG3 LYS 85 2HG LYS 85 2.824 -9.773 2.993 497 HD2 LYS 85 1HD LYS 85 4.071 -11.008 4.691 498 HD3 LYS 85 2HD LYS 85 2.595 -11.011 5.695 499 HE2 LYS 85 1HE LYS 85 1.429 -12.333 3.925 500 HE3 LYS 85 2HE LYS 85 2.954 -12.445 3.023 501 HZ1 LYS 85 3HZ LYS 85 2.362 -14.350 4.449 502 HZ2 LYS 85 1HZ LYS 85 2.597 -13.428 5.787 503 HZ3 LYS 85 2HZ LYS 85 3.869 -13.743 4.768 504 H ALA 86 H ALA 86 -0.486 -8.474 3.312 505 HA ALA 86 HA ALA 86 -2.338 -8.010 5.545 506 HB1 ALA 86 1HB ALA 86 -3.785 -9.506 4.051 507 HB2 ALA 86 2HB ALA 86 -3.293 -7.929 3.402 508 HB3 ALA 86 3HB ALA 86 -2.485 -9.409 2.845 509 H GLU 87 H GLU 87 -2.356 -9.191 7.270 510 HA GLU 87 HA GLU 87 -1.638 -12.072 7.280 511 HB2 GLU 87 1HB GLU 87 -0.612 -9.778 8.968 512 HB3 GLU 87 2HB GLU 87 -0.708 -11.393 9.649 513 HG2 GLU 87 1HG GLU 87 0.773 -10.875 7.051 514 HG3 GLU 87 2HG GLU 87 1.518 -10.542 8.600 515 H GLY 88 H GLY 88 -4.012 -12.086 6.979 516 HA2 GLY 88 1HA GLY 88 -5.913 -12.910 7.988 517 HA3 GLY 88 2HA GLY 88 -5.347 -12.345 9.566 518 H GLN 89 H GLN 89 -6.992 -10.999 10.331 519 HA GLN 89 HA GLN 89 -8.250 -8.969 8.543 520 HB2 GLN 89 1HB GLN 89 -8.782 -9.622 11.465 521 HB3 GLN 89 2HB GLN 89 -9.659 -8.459 10.468 522 HG2 GLN 89 1HG GLN 89 -9.610 -11.463 10.170 523 HG3 GLN 89 2HG GLN 89 -10.994 -10.425 10.509 524 HE21 GLN 89 1HE2 GLN 89 -9.567 -12.239 8.132 525 HE22 GLN 89 2HE2 GLN 89 -10.023 -11.341 6.720 526 H THR 90 H THR 90 -5.319 -8.847 9.221 527 HA THR 90 HA THR 90 -5.302 -6.039 9.964 528 HB THR 90 HB THR 90 -3.554 -8.148 11.299 529 HG1 THR 90 1HG THR 90 -4.557 -7.264 13.178 530 HG21 THR 90 3HG2 THR 90 -2.224 -6.171 10.932 531 HG22 THR 90 1HG2 THR 90 -2.652 -6.253 12.642 532 HG23 THR 90 2HG2 THR 90 -3.499 -5.118 11.564 533 H VAL 91 H VAL 91 -3.573 -4.934 8.984 534 HA VAL 91 HA VAL 91 -1.820 -6.492 7.167 535 HB VAL 91 HB VAL 91 -3.109 -3.777 6.676 536 HG11 VAL 91 1HG1 VAL 91 -0.856 -5.122 5.145 537 HG12 VAL 91 2HG1 VAL 91 -1.776 -3.730 4.550 538 HG13 VAL 91 3HG1 VAL 91 -0.776 -3.582 6.006 539 HG21 VAL 91 3HG2 VAL 91 -3.060 -6.145 4.790 540 HG22 VAL 91 1HG2 VAL 91 -4.351 -5.978 5.982 541 HG23 VAL 91 2HG2 VAL 91 -4.094 -4.727 4.749 542 H ILE 92 H ILE 92 0.261 -6.170 7.756 543 HA ILE 92 HA ILE 92 0.947 -4.001 9.675 544 HB ILE 92 HB ILE 92 2.677 -6.260 8.609 545 HG12 ILE 92 1HG1 ILE 92 0.965 -7.437 9.743 546 HG13 ILE 92 2HG1 ILE 92 2.333 -7.339 10.839 547 HG21 ILE 92 1HG2 ILE 92 2.985 -4.416 11.030 548 HG22 ILE 92 2HG2 ILE 92 4.086 -5.739 10.579 549 HG23 ILE 92 3HG2 ILE 92 3.913 -4.335 9.521 550 HD11 ILE 92 3HD1 ILE 92 1.263 -5.588 12.144 551 HD12 ILE 92 1HD1 ILE 92 -0.123 -5.586 11.017 552 HD13 ILE 92 2HD1 ILE 92 0.212 -7.017 12.000 553 H ILE 93 H ILE 93 1.347 -2.126 8.619 554 HA ILE 93 HA ILE 93 2.480 -2.232 5.871 555 HB ILE 93 HB ILE 93 1.620 0.304 7.276 556 HG12 ILE 93 1HG1 ILE 93 -0.193 -1.382 5.489 557 HG13 ILE 93 2HG1 ILE 93 -0.378 -1.251 7.245 558 HG21 ILE 93 1HG2 ILE 93 1.375 0.950 4.773 559 HG22 ILE 93 2HG2 ILE 93 3.020 0.565 5.286 560 HG23 ILE 93 3HG2 ILE 93 2.046 -0.603 4.379 561 HD11 ILE 93 3HD1 ILE 93 -0.744 0.998 5.256 562 HD12 ILE 93 1HD1 ILE 93 -1.960 0.216 6.263 563 HD13 ILE 93 2HD1 ILE 93 -0.692 1.210 7.019 564 H LYS 94 H LYS 94 4.592 -1.448 5.562 565 HA LYS 94 HA LYS 94 6.154 -0.507 7.915 566 HB2 LYS 94 1HB LYS 94 6.669 -2.933 6.208 567 HB3 LYS 94 2HB LYS 94 7.979 -2.019 6.860 568 HG2 LYS 94 1HG LYS 94 6.994 -2.208 9.153 569 HG3 LYS 94 2HG LYS 94 5.769 -3.303 8.500 570 HD2 LYS 94 1HD LYS 94 7.388 -4.977 7.986 571 HD3 LYS 94 2HD LYS 94 8.743 -3.827 8.137 572 HE2 LYS 94 1HE LYS 94 8.340 -3.566 10.543 573 HE3 LYS 94 2HE LYS 94 6.925 -4.634 10.435 574 HZ1 LYS 94 3HZ LYS 94 8.855 -5.806 11.228 575 HZ2 LYS 94 1HZ LYS 94 9.687 -5.510 9.828 576 HZ3 LYS 94 2HZ LYS 94 8.309 -6.417 9.820 577 H TYR 95 H TYR 95 6.445 1.594 7.222 578 HA TYR 95 HA TYR 95 7.326 1.954 4.397 579 HB2 TYR 95 1HB TYR 95 6.328 4.184 4.552 580 HB3 TYR 95 2HB TYR 95 5.193 2.869 4.691 581 HD1 TYR 95 1HD TYR 95 4.082 2.297 6.781 582 HD2 TYR 95 2HD TYR 95 6.755 5.648 6.531 583 HE1 TYR 95 1HE TYR 95 3.364 3.037 9.006 584 HE2 TYR 95 2HE TYR 95 5.856 6.545 8.676 585 HH TYR 95 HH TYR 95 3.773 6.220 10.215 586 H THR 96 H THR 96 8.669 3.945 4.053 587 HA THR 96 HA THR 96 10.153 5.016 6.286 588 HB THR 96 HB THR 96 11.477 3.035 5.889 589 HG1 THR 96 1HG THR 96 13.416 4.134 5.528 590 HG21 THR 96 3HG2 THR 96 12.784 3.143 3.519 591 HG22 THR 96 1HG2 THR 96 11.201 3.771 2.997 592 HG23 THR 96 2HG2 THR 96 11.319 2.194 3.758 593 H SER 97 H SER 97 11.683 6.694 5.340 594 HA SER 97 HA SER 97 10.427 8.097 3.054 595 HB2 SER 97 1HB SER 97 11.347 10.142 4.039 596 HB3 SER 97 2HB SER 97 10.094 9.383 5.026 597 HG SER 97 HG SER 97 12.663 9.962 5.597 598 H GLN 98 H GLN 98 12.487 5.915 3.337 599 HA GLN 98 HA GLN 98 14.328 7.175 1.377 600 HB2 GLN 98 1HB GLN 98 15.257 5.025 3.273 601 HB3 GLN 98 2HB GLN 98 16.240 5.846 2.076 602 HG2 GLN 98 1HG GLN 98 15.066 7.277 4.483 603 HG3 GLN 98 2HG GLN 98 16.621 6.432 4.441 604 HE21 GLN 98 1HE2 GLN 98 14.886 9.196 2.746 605 HE22 GLN 98 2HE2 GLN 98 16.376 10.047 2.466 606 H ARG 99 H ARG 99 15.527 5.105 0.309 607 HA ARG 99 HA ARG 99 13.433 3.203 -0.572 608 HB2 ARG 99 1HB ARG 99 15.160 4.382 -2.062 609 HB3 ARG 99 2HB ARG 99 16.282 3.175 -1.466 610 HG2 ARG 99 1HG ARG 99 13.856 1.778 -2.205 611 HG3 ARG 99 2HG ARG 99 14.095 3.012 -3.411 612 HD2 ARG 99 1HD ARG 99 16.641 1.990 -3.201 613 HD3 ARG 99 2HD ARG 99 15.642 0.573 -2.747 614 HE ARG 99 HE ARG 99 14.462 1.685 -4.999 615 HH11 ARG 99 1HH1 ARG 99 17.782 0.437 -4.558 616 HH12 ARG 99 2HH1 ARG 99 17.990 0.179 -6.248 617 HH21 ARG 99 1HH2 ARG 99 14.905 1.611 -7.137 618 HH22 ARG 99 2HH2 ARG 99 16.362 0.957 -7.786 619 H ASN 100 H ASN 100 16.065 3.212 1.634 620 HA ASN 100 HA ASN 100 16.207 0.241 1.701 621 HB2 ASN 100 1HB ASN 100 18.565 0.478 1.366 622 HB3 ASN 100 2HB ASN 100 17.669 1.242 0.063 623 HD21 ASN 100 1HD2 ASN 100 19.073 1.938 3.150 624 HD22 ASN 100 2HD2 ASN 100 19.896 3.448 2.708 625 H THR 101 H THR 101 15.219 2.278 3.852 626 HA THR 101 HA THR 101 17.277 1.498 5.927 627 HB THR 101 HB THR 101 16.806 3.608 7.066 628 HG1 THR 101 1HG THR 101 15.656 5.192 5.946 629 HG21 THR 101 3HG2 THR 101 17.590 4.144 4.183 630 HG22 THR 101 1HG2 THR 101 18.658 3.365 5.372 631 HG23 THR 101 2HG2 THR 101 18.093 5.008 5.646 632 H LYS 102 H LYS 102 16.357 2.017 8.266 633 HA LYS 102 HA LYS 102 14.645 -0.061 8.872 634 HB2 LYS 102 1HB LYS 102 16.089 0.958 10.546 635 HB3 LYS 102 2HB LYS 102 15.226 2.496 10.410 636 HG2 LYS 102 1HG LYS 102 14.538 1.407 12.451 637 HG3 LYS 102 2HG LYS 102 13.199 1.440 11.335 638 HD2 LYS 102 1HD LYS 102 14.031 -1.000 10.699 639 HD3 LYS 102 2HD LYS 102 14.875 -0.885 12.237 640 HE2 LYS 102 1HE LYS 102 12.567 -0.228 13.233 641 HE3 LYS 102 2HE LYS 102 11.884 -0.708 11.645 642 HZ1 LYS 102 3HZ LYS 102 11.826 -2.454 13.318 643 HZ2 LYS 102 1HZ LYS 102 13.503 -2.523 13.323 644 HZ3 LYS 102 2HZ LYS 102 12.648 -2.861 11.947 645 H LEU 103 H LEU 103 12.586 -0.372 8.717 646 HA LEU 103 HA LEU 103 10.753 1.629 7.684 647 HB2 LEU 103 1HB LEU 103 10.360 -1.223 8.655 648 HB3 LEU 103 2HB LEU 103 9.239 -0.385 7.564 649 HG LEU 103 HG LEU 103 12.109 -1.250 6.918 650 HD11 LEU 103 1HD1 LEU 103 9.591 -2.232 5.580 651 HD12 LEU 103 2HD1 LEU 103 10.477 -3.104 6.866 652 HD13 LEU 103 3HD1 LEU 103 11.231 -2.755 5.312 653 HD21 LEU 103 3HD2 LEU 103 11.643 -0.457 4.621 654 HD22 LEU 103 1HD2 LEU 103 11.691 0.845 5.781 655 HD23 LEU 103 2HD2 LEU 103 10.114 0.266 5.190 656 H LYS 104 H LYS 104 8.679 2.096 8.689 657 HA LYS 104 HA LYS 104 8.782 2.492 11.596 658 HB2 LYS 104 1HB LYS 104 7.044 3.321 9.242 659 HB3 LYS 104 2HB LYS 104 6.366 3.364 10.846 660 HG2 LYS 104 1HG LYS 104 7.131 5.506 10.504 661 HG3 LYS 104 2HG LYS 104 8.289 4.792 11.609 662 HD2 LYS 104 1HD LYS 104 9.993 4.640 9.941 663 HD3 LYS 104 2HD LYS 104 8.831 4.989 8.653 664 HE2 LYS 104 1HE LYS 104 8.295 7.167 9.962 665 HE3 LYS 104 2HE LYS 104 9.701 6.823 10.958 666 HZ1 LYS 104 3HZ LYS 104 11.085 7.141 9.010 667 HZ2 LYS 104 1HZ LYS 104 10.073 8.409 9.244 668 HZ3 LYS 104 2HZ LYS 104 9.719 7.356 8.049 669 H ALA 105 H ALA 105 6.529 2.003 12.684 670 HA ALA 105 HA ALA 105 5.523 -0.703 11.889 671 HB1 ALA 105 1HB ALA 105 5.038 -1.057 14.292 672 HB2 ALA 105 2HB ALA 105 6.778 -0.850 13.990 673 HB3 ALA 105 3HB ALA 105 5.825 0.487 14.678 674 H LYS 106 H LYS 106 3.449 -0.485 11.022 675 HA LYS 106 HA LYS 106 1.465 0.967 12.613 676 HB2 LYS 106 1HB LYS 106 2.401 2.344 10.653 677 HB3 LYS 106 2HB LYS 106 1.594 1.188 9.594 678 HG2 LYS 106 1HG LYS 106 -0.051 2.662 9.608 679 HG3 LYS 106 2HG LYS 106 -0.509 1.984 11.168 680 HD2 LYS 106 1HD LYS 106 0.384 3.807 12.351 681 HD3 LYS 106 2HD LYS 106 1.482 4.262 11.030 682 HE2 LYS 106 1HE LYS 106 -0.553 4.826 9.612 683 HE3 LYS 106 2HE LYS 106 -1.528 4.674 11.080 684 HZ1 LYS 106 3HZ LYS 106 -0.211 6.457 12.050 685 HZ2 LYS 106 1HZ LYS 106 -0.874 6.948 10.640 686 HZ3 LYS 106 2HZ LYS 106 0.699 6.592 10.656 687 H ALA 107 H ALA 107 -0.403 -0.323 12.729 688 HA ALA 107 HA ALA 107 -0.553 -2.815 11.093 689 HB1 ALA 107 1HB ALA 107 -0.918 -4.069 13.185 690 HB2 ALA 107 2HB ALA 107 0.727 -3.375 13.076 691 HB3 ALA 107 3HB ALA 107 -0.492 -2.612 14.126 692 H LEU 108 H LEU 108 -2.553 -2.424 10.159 693 HA LEU 108 HA LEU 108 -4.715 -1.144 11.804 694 HB2 LEU 108 1HB LEU 108 -4.302 -1.017 8.813 695 HB3 LEU 108 2HB LEU 108 -5.667 -0.354 9.701 696 HG LEU 108 HG LEU 108 -4.365 1.445 9.039 697 HD11 LEU 108 1HD1 LEU 108 -3.596 2.510 11.130 698 HD12 LEU 108 2HD1 LEU 108 -3.716 0.967 11.981 699 HD13 LEU 108 3HD1 LEU 108 -5.186 1.742 11.311 700 HD21 LEU 108 3HD2 LEU 108 -2.069 1.729 9.218 701 HD22 LEU 108 1HD2 LEU 108 -2.273 0.068 8.645 702 HD23 LEU 108 2HD2 LEU 108 -1.868 0.362 10.346 703 H THR 109 H THR 109 -6.808 -2.148 11.627 704 HA THR 109 HA THR 109 -6.771 -4.863 10.660 705 HB THR 109 HB THR 109 -9.204 -4.819 11.323 706 HG1 THR 109 1HG THR 109 -9.241 -2.753 12.865 707 HG21 THR 109 3HG2 THR 109 -8.740 -4.802 13.722 708 HG22 THR 109 1HG2 THR 109 -7.267 -3.873 13.469 709 HG23 THR 109 2HG2 THR 109 -7.370 -5.541 12.862 710 H LEU 110 H LEU 110 -8.055 -5.811 8.970 711 HA LEU 110 HA LEU 110 -8.505 -4.252 6.604 712 HB2 LEU 110 1HB LEU 110 -9.523 -6.930 7.676 713 HB3 LEU 110 2HB LEU 110 -10.263 -6.251 6.251 714 HG LEU 110 HG LEU 110 -7.342 -6.976 6.476 715 HD11 LEU 110 1HD1 LEU 110 -8.792 -8.964 6.386 716 HD12 LEU 110 2HD1 LEU 110 -8.015 -8.763 4.814 717 HD13 LEU 110 3HD1 LEU 110 -9.710 -8.279 5.026 718 HD21 LEU 110 3HD2 LEU 110 -7.295 -6.629 4.022 719 HD22 LEU 110 1HD2 LEU 110 -7.686 -5.139 4.858 720 HD23 LEU 110 2HD2 LEU 110 -8.983 -6.045 4.057 721 H SER 111 H SER 111 -10.401 -4.680 9.520 722 HA SER 111 HA SER 111 -12.845 -3.653 8.395 723 HB2 SER 111 1HB SER 111 -12.249 -4.864 10.751 724 HB3 SER 111 2HB SER 111 -12.367 -3.189 11.292 725 HG SER 111 HG SER 111 -14.446 -3.564 11.209 726 H GLN 112 H GLN 112 -10.096 -2.037 10.115 727 HA GLN 112 HA GLN 112 -11.090 0.582 10.124 728 HB2 GLN 112 1HB GLN 112 -8.418 -0.737 10.292 729 HB3 GLN 112 2HB GLN 112 -8.357 0.871 9.611 730 HG2 GLN 112 1HG GLN 112 -9.575 0.127 12.286 731 HG3 GLN 112 2HG GLN 112 -8.008 0.898 12.031 732 HE21 GLN 112 1HE2 GLN 112 -8.910 2.812 9.865 733 HE22 GLN 112 2HE2 GLN 112 -9.909 3.944 10.696 734 H LEU 113 H LEU 113 -8.834 -0.756 7.669 735 HA LEU 113 HA LEU 113 -8.922 1.480 6.018 736 HB2 LEU 113 1HB LEU 113 -8.350 -1.459 5.459 737 HB3 LEU 113 2HB LEU 113 -8.329 -0.292 4.166 738 HG LEU 113 HG LEU 113 -6.141 -0.698 4.897 739 HD11 LEU 113 1HD1 LEU 113 -6.662 1.613 4.151 740 HD12 LEU 113 2HD1 LEU 113 -5.271 1.502 5.213 741 HD13 LEU 113 3HD1 LEU 113 -6.810 2.105 5.859 742 HD21 LEU 113 3HD2 LEU 113 -6.515 -1.325 7.242 743 HD22 LEU 113 1HD2 LEU 113 -6.811 0.389 7.643 744 HD23 LEU 113 2HD2 LEU 113 -5.228 -0.129 7.033 745 H LYS 114 H LYS 114 -11.174 -1.220 6.089 746 HA LYS 114 HA LYS 114 -12.326 -0.665 3.478 747 HB2 LYS 114 1HB LYS 114 -12.329 -2.879 4.571 748 HB3 LYS 114 2HB LYS 114 -13.358 -2.249 5.880 749 HG2 LYS 114 1HG LYS 114 -15.130 -1.786 4.169 750 HG3 LYS 114 2HG LYS 114 -14.102 -2.518 2.927 751 HD2 LYS 114 1HD LYS 114 -15.377 -3.760 5.400 752 HD3 LYS 114 2HD LYS 114 -15.744 -4.121 3.717 753 HE2 LYS 114 1HE LYS 114 -14.594 -5.998 4.318 754 HE3 LYS 114 2HE LYS 114 -13.270 -5.049 3.631 755 HZ1 LYS 114 3HZ LYS 114 -12.533 -4.540 5.858 756 HZ2 LYS 114 1HZ LYS 114 -12.844 -6.159 5.852 757 HZ3 LYS 114 2HZ LYS 114 -13.911 -5.154 6.527 758 H LYS 115 H LYS 115 -12.901 0.435 6.844 759 HA LYS 115 HA LYS 115 -15.393 1.772 6.149 760 HB2 LYS 115 1HB LYS 115 -13.884 1.080 8.573 761 HB3 LYS 115 2HB LYS 115 -14.184 2.790 8.526 762 HG2 LYS 115 1HG LYS 115 -16.094 1.736 9.610 763 HG3 LYS 115 2HG LYS 115 -16.622 2.311 8.038 764 HD2 LYS 115 1HD LYS 115 -17.565 0.125 8.249 765 HD3 LYS 115 2HD LYS 115 -16.223 -0.064 7.139 766 HE2 LYS 115 1HE LYS 115 -16.108 -1.905 8.580 767 HE3 LYS 115 2HE LYS 115 -14.812 -0.828 9.107 768 HZ1 LYS 115 3HZ LYS 115 -17.479 -1.070 10.391 769 HZ2 LYS 115 1HZ LYS 115 -16.252 -0.050 10.882 770 HZ3 LYS 115 2HZ LYS 115 -16.058 -1.665 10.963 771 H GLU 116 H GLU 116 -12.012 2.800 6.877 772 HA GLU 116 HA GLU 116 -12.304 5.503 6.349 773 HB2 GLU 116 1HB GLU 116 -9.957 3.654 5.818 774 HB3 GLU 116 2HB GLU 116 -9.867 5.421 5.753 775 HG2 GLU 116 1HG GLU 116 -10.532 5.577 8.108 776 HG3 GLU 116 2HG GLU 116 -10.720 3.833 8.213 777 H PHE 117 H PHE 117 -11.217 3.034 3.961 778 HA PHE 117 HA PHE 117 -11.600 5.025 1.816 779 HB2 PHE 117 1HB PHE 117 -9.600 2.780 2.137 780 HB3 PHE 117 2HB PHE 117 -9.656 3.962 0.831 781 HD1 PHE 117 2HD PHE 117 -9.511 6.528 1.575 782 HD2 PHE 117 1HD PHE 117 -8.145 3.179 3.907 783 HE1 PHE 117 2HE PHE 117 -7.894 7.992 2.748 784 HE2 PHE 117 1HE PHE 117 -6.511 4.640 5.064 785 HZ PHE 117 HZ PHE 117 -6.379 7.074 4.452 786 H TYR 118 H TYR 118 -13.352 2.398 2.748 787 HA TYR 118 HA TYR 118 -14.016 1.940 -0.093 788 HB2 TYR 118 1HB TYR 118 -12.307 0.212 0.827 789 HB3 TYR 118 2HB TYR 118 -13.715 -0.507 1.590 790 HD1 TYR 118 2HD TYR 118 -12.642 0.919 -1.769 791 HD2 TYR 118 1HD TYR 118 -14.830 -2.155 0.337 792 HE1 TYR 118 2HE TYR 118 -12.976 -0.316 -3.919 793 HE2 TYR 118 1HE TYR 118 -15.242 -3.332 -1.792 794 HH TYR 118 HH TYR 118 -13.765 -2.541 -4.845 795 H GLN 119 H GLN 119 -15.441 3.278 2.268 796 HA GLN 119 HA GLN 119 -17.465 1.495 3.051 797 HB2 GLN 119 1HB GLN 119 -18.492 3.289 4.178 798 HB3 GLN 119 2HB GLN 119 -16.761 3.484 4.312 799 HG2 GLN 119 1HG GLN 119 -18.471 5.094 2.419 800 HG3 GLN 119 2HG GLN 119 -18.100 5.582 4.037 801 HE21 GLN 119 1HE2 GLN 119 -15.197 4.586 3.824 802 HE22 GLN 119 2HE2 GLN 119 -14.428 5.829 2.938 803 H THR 120 H THR 120 -17.461 3.820 0.442 804 HA THR 120 HA THR 120 -20.350 3.494 -0.058 805 HB THR 120 HB THR 120 -19.509 5.680 0.558 806 HG1 THR 120 1HG THR 120 -20.163 6.892 -1.152 807 HG21 THR 120 3HG2 THR 120 -17.153 5.416 -0.110 808 HG22 THR 120 1HG2 THR 120 -17.806 6.875 -0.790 809 HG23 THR 120 2HG2 THR 120 -17.652 5.458 -1.828 810 H ARG 121 H ARG 121 -20.875 3.881 -2.548 811 HA ARG 121 HA ARG 121 -19.575 1.705 -4.042 812 HB2 ARG 121 1HB ARG 121 -21.966 3.509 -4.378 813 HB3 ARG 121 2HB ARG 121 -21.294 2.789 -5.832 814 HG2 ARG 121 1HG ARG 121 -21.854 0.673 -5.393 815 HG3 ARG 121 2HG ARG 121 -21.658 0.802 -3.643 816 HD2 ARG 121 1HD ARG 121 -23.945 2.238 -5.002 817 HD3 ARG 121 2HD ARG 121 -24.052 0.508 -4.724 818 HE ARG 121 HE ARG 121 -24.064 2.662 -2.747 819 HH11 ARG 121 1HH1 ARG 121 -23.990 -0.876 -3.285 820 HH12 ARG 121 2HH1 ARG 121 -24.663 -1.218 -1.738 821 HH21 ARG 121 1HH2 ARG 121 -24.972 2.098 -0.722 822 HH22 ARG 121 2HH2 ARG 121 -24.897 0.487 -0.108 823 H SER 122 H SER 122 -20.005 5.239 -4.532 824 HA SER 122 HA SER 122 -18.683 5.421 -6.932 825 HB2 SER 122 1HB SER 122 -18.815 7.355 -4.599 826 HB3 SER 122 2HB SER 122 -18.468 7.797 -6.297 827 HG SER 122 HG SER 122 -20.595 8.121 -5.995 828 H GLN 123 H GLN 123 -17.262 5.316 -3.656 829 HA GLN 123 HA GLN 123 -14.594 6.000 -4.393 830 HB2 GLN 123 1HB GLN 123 -15.407 6.005 -2.096 831 HB3 GLN 123 2HB GLN 123 -15.655 4.260 -2.116 832 HG2 GLN 123 1HG GLN 123 -13.320 3.806 -2.021 833 HG3 GLN 123 2HG GLN 123 -12.893 5.473 -2.486 834 HE21 GLN 123 1HE2 GLN 123 -15.154 4.039 -0.156 835 HE22 GLN 123 2HE2 GLN 123 -14.731 5.112 1.195 836 H LYS 124 H LYS 124 -16.376 2.988 -4.766 837 HA LYS 124 HA LYS 124 -14.067 1.267 -4.939 838 HB2 LYS 124 1HB LYS 124 -16.742 0.758 -6.274 839 HB3 LYS 124 2HB LYS 124 -15.553 -0.435 -5.747 840 HG2 LYS 124 1HG LYS 124 -16.050 0.150 -3.356 841 HG3 LYS 124 2HG LYS 124 -17.164 1.380 -3.919 842 HD2 LYS 124 1HD LYS 124 -18.656 -0.246 -3.452 843 HD3 LYS 124 2HD LYS 124 -18.407 -0.553 -5.166 844 HE2 LYS 124 1HE LYS 124 -16.817 -2.370 -4.590 845 HE3 LYS 124 2HE LYS 124 -16.962 -1.963 -2.874 846 HZ1 LYS 124 3HZ LYS 124 -19.350 -2.475 -3.057 847 HZ2 LYS 124 1HZ LYS 124 -18.386 -3.782 -3.326 848 HZ3 LYS 124 2HZ LYS 124 -19.083 -3.006 -4.608 849 H ARG 125 H ARG 125 -15.744 3.412 -7.205 850 HA ARG 125 HA ARG 125 -14.655 2.233 -9.628 851 HB2 ARG 125 1HB ARG 125 -16.215 4.664 -8.897 852 HB3 ARG 125 2HB ARG 125 -14.952 5.040 -10.043 853 HG2 ARG 125 1HG ARG 125 -17.078 4.505 -11.105 854 HG3 ARG 125 2HG ARG 125 -15.776 3.406 -11.610 855 HD2 ARG 125 1HD ARG 125 -16.719 1.573 -10.570 856 HD3 ARG 125 2HD ARG 125 -17.368 2.530 -9.239 857 HE ARG 125 HE ARG 125 -19.330 2.711 -10.233 858 HH11 ARG 125 1HH1 ARG 125 -17.051 2.080 -12.948 859 HH12 ARG 125 2HH1 ARG 125 -18.333 1.984 -14.091 860 HH21 ARG 125 1HH2 ARG 125 -20.975 2.312 -11.768 861 HH22 ARG 125 2HH2 ARG 125 -20.538 1.869 -13.373 862 H GLU 126 H GLU 126 -13.616 4.878 -7.431 863 HA GLU 126 HA GLU 126 -11.245 5.324 -9.033 864 HB2 GLU 126 1HB GLU 126 -12.313 6.244 -6.326 865 HB3 GLU 126 2HB GLU 126 -10.589 6.391 -6.633 866 HG2 GLU 126 1HG GLU 126 -11.072 8.328 -7.454 867 HG3 GLU 126 2HG GLU 126 -11.433 7.481 -8.947 868 H VAL 127 H VAL 127 -11.622 3.867 -5.822 869 HA VAL 127 HA VAL 127 -9.017 2.951 -5.483 870 HB VAL 127 HB VAL 127 -11.633 1.676 -4.614 871 HG11 VAL 127 1HG1 VAL 127 -10.380 0.432 -2.899 872 HG12 VAL 127 2HG1 VAL 127 -9.935 -0.108 -4.513 873 HG13 VAL 127 3HG1 VAL 127 -8.840 0.960 -3.621 874 HG21 VAL 127 3HG2 VAL 127 -11.097 3.958 -3.697 875 HG22 VAL 127 1HG2 VAL 127 -11.058 2.725 -2.432 876 HG23 VAL 127 2HG2 VAL 127 -9.544 3.344 -3.117 877 H ASP 128 H ASP 128 -11.623 1.014 -7.152 878 HA ASP 128 HA ASP 128 -9.747 -1.064 -7.807 879 HB2 ASP 128 1HB ASP 128 -12.324 -1.058 -7.532 880 HB3 ASP 128 2HB ASP 128 -12.373 -0.608 -9.236 881 H ASP 129 H ASP 129 -10.380 2.040 -9.257 882 HA ASP 129 HA ASP 129 -9.183 1.325 -11.832 883 HB2 ASP 129 1HB ASP 129 -10.240 3.923 -10.764 884 HB3 ASP 129 2HB ASP 129 -9.153 3.871 -12.119 885 H TYR 130 H TYR 130 -8.178 2.681 -8.720 886 HA TYR 130 HA TYR 130 -5.454 3.254 -9.505 887 HB2 TYR 130 1HB TYR 130 -6.307 2.288 -6.790 888 HB3 TYR 130 2HB TYR 130 -4.911 3.235 -7.207 889 HD1 TYR 130 1HD TYR 130 -6.928 5.266 -8.980 890 HD2 TYR 130 2HD TYR 130 -6.634 3.810 -4.941 891 HE1 TYR 130 1HE TYR 130 -8.091 7.299 -8.146 892 HE2 TYR 130 2HE TYR 130 -7.813 5.765 -4.110 893 HH TYR 130 HH TYR 130 -8.322 8.619 -5.956 894 H VAL 131 H VAL 131 -7.215 0.276 -8.476 895 HA VAL 131 HA VAL 131 -4.883 -1.365 -8.454 896 HB VAL 131 HB VAL 131 -7.737 -2.266 -8.896 897 HG11 VAL 131 1HG1 VAL 131 -5.213 -3.775 -8.041 898 HG12 VAL 131 2HG1 VAL 131 -6.854 -4.434 -7.933 899 HG13 VAL 131 3HG1 VAL 131 -6.157 -4.070 -9.503 900 HG21 VAL 131 3HG2 VAL 131 -7.309 -1.036 -6.700 901 HG22 VAL 131 1HG2 VAL 131 -7.774 -2.707 -6.515 902 HG23 VAL 131 2HG2 VAL 131 -6.075 -2.259 -6.341 903 H ALA 132 H ALA 132 -6.719 -0.013 -11.115 904 HA ALA 132 HA ALA 132 -5.459 -1.828 -13.076 905 HB1 ALA 132 1HB ALA 132 -6.859 -0.689 -14.705 906 HB2 ALA 132 2HB ALA 132 -7.847 -1.205 -13.330 907 HB3 ALA 132 3HB ALA 132 -7.367 0.502 -13.488 908 H GLY 133 H GLY 133 -4.058 0.421 -11.298 909 HA2 GLY 133 1HA GLY 133 -2.574 1.712 -13.534 910 HA3 GLY 133 2HA GLY 133 -3.180 2.628 -12.159 911 H LEU 134 H LEU 134 -2.109 -0.501 -11.268 912 HA LEU 134 HA LEU 134 0.144 0.816 -9.848 913 HB2 LEU 134 1HB LEU 134 -0.369 -0.659 -8.059 914 HB3 LEU 134 2HB LEU 134 -1.665 0.475 -8.394 915 HG LEU 134 HG LEU 134 -3.021 -1.235 -9.326 916 HD11 LEU 134 1HD1 LEU 134 -2.561 -3.650 -9.243 917 HD12 LEU 134 2HD1 LEU 134 -0.866 -3.314 -8.850 918 HD13 LEU 134 3HD1 LEU 134 -1.555 -2.821 -10.412 919 HD21 LEU 134 3HD2 LEU 134 -3.339 -2.602 -7.245 920 HD22 LEU 134 1HD2 LEU 134 -2.998 -0.895 -6.906 921 HD23 LEU 134 2HD2 LEU 134 -1.720 -2.110 -6.718 922 H ARG 135 H ARG 135 0.277 -0.677 -12.113 923 HA ARG 135 HA ARG 135 1.287 -2.463 -13.330 924 HB2 ARG 135 1HB ARG 135 3.368 -0.986 -11.692 925 HB3 ARG 135 2HB ARG 135 3.927 -2.385 -12.517 926 HG2 ARG 135 1HG ARG 135 3.199 -1.624 -14.652 927 HG3 ARG 135 2HG ARG 135 2.224 -0.307 -13.957 928 HD2 ARG 135 1HD ARG 135 4.047 0.864 -13.240 929 HD3 ARG 135 2HD ARG 135 5.164 -0.491 -13.388 930 HE ARG 135 HE ARG 135 3.850 0.640 -15.805 931 HH11 ARG 135 1HH1 ARG 135 6.927 -0.294 -14.189 932 HH12 ARG 135 2HH1 ARG 135 7.912 0.341 -15.446 933 HH21 ARG 135 1HH2 ARG 135 5.205 1.450 -17.457 934 HH22 ARG 135 2HH2 ARG 135 6.924 1.510 -17.222 935 H THR 136 H THR 136 3.298 -4.285 -12.712 936 HA THR 136 HA THR 136 2.675 -5.239 -10.099 937 HB THR 136 HB THR 136 2.680 -7.698 -11.571 938 HG1 THR 136 1HG THR 136 2.127 -6.652 -13.424 939 HG21 THR 136 3HG2 THR 136 0.238 -6.375 -10.328 940 HG22 THR 136 1HG2 THR 136 1.364 -7.512 -9.559 941 HG23 THR 136 2HG2 THR 136 0.335 -8.050 -10.881 942 H GLU 137 H GLU 137 4.817 -4.573 -12.343 943 HA GLU 137 HA GLU 137 7.053 -5.852 -11.210 944 HB2 GLU 137 1HB GLU 137 5.863 -7.753 -12.614 945 HB3 GLU 137 2HB GLU 137 6.490 -6.887 -14.022 946 HG2 GLU 137 1HG GLU 137 8.791 -7.127 -13.109 947 HG3 GLU 137 2HG GLU 137 8.143 -7.874 -11.654 Start of MODEL 13 1 H1 GLY 19 H GLY 19 -22.022 -11.264 -4.031 2 HA2 GLY 19 1HA GLY 19 -20.946 -12.786 -5.551 3 HA3 GLY 19 2HA GLY 19 -20.456 -11.125 -5.950 4 H HIS 20 H HIS 20 -18.783 -13.189 -6.795 5 HA HIS 20 HA HIS 20 -16.875 -14.071 -4.910 6 HB2 HIS 20 1HB HIS 20 -15.675 -14.924 -6.832 7 HB3 HIS 20 2HB HIS 20 -17.392 -15.226 -7.001 8 HD1 HIS 20 1HD HIS 20 -18.564 -14.165 -9.138 9 HD2 HIS 20 2HD HIS 20 -14.555 -13.044 -8.502 10 HE1 HIS 20 1HE HIS 20 -17.849 -12.828 -11.207 11 H MET 21 H MET 21 -17.157 -10.939 -5.564 12 HA MET 21 HA MET 21 -14.744 -10.004 -6.621 13 HB2 MET 21 1HB MET 21 -17.007 -8.859 -6.330 14 HB3 MET 21 2HB MET 21 -16.590 -8.632 -4.638 15 HG2 MET 21 1HG MET 21 -14.384 -7.529 -5.872 16 HG3 MET 21 2HG MET 21 -15.622 -7.234 -7.085 17 HE1 MET 21 3HE MET 21 -15.225 -5.549 -2.822 18 HE2 MET 21 1HE MET 21 -15.309 -7.291 -3.141 19 HE3 MET 21 2HE MET 21 -13.990 -6.329 -3.824 20 H LYS 22 H LYS 22 -15.520 -10.729 -3.168 21 HA LYS 22 HA LYS 22 -14.212 -10.887 -1.368 22 HB2 LYS 22 1HB LYS 22 -13.472 -12.674 -2.982 23 HB3 LYS 22 2HB LYS 22 -11.998 -11.747 -3.248 24 HG2 LYS 22 1HG LYS 22 -11.210 -12.188 -1.070 25 HG3 LYS 22 2HG LYS 22 -12.835 -12.407 -0.404 26 HD2 LYS 22 1HD LYS 22 -13.037 -14.589 -1.287 27 HD3 LYS 22 2HD LYS 22 -11.715 -14.348 -2.430 28 HE2 LYS 22 1HE LYS 22 -11.161 -15.836 -0.493 29 HE3 LYS 22 2HE LYS 22 -10.044 -14.511 -0.785 30 HZ1 LYS 22 3HZ LYS 22 -12.136 -14.340 1.323 31 HZ2 LYS 22 1HZ LYS 22 -10.810 -13.368 1.083 32 HZ3 LYS 22 2HZ LYS 22 -10.652 -14.912 1.560 33 H PHE 23 H PHE 23 -11.355 -10.504 -1.110 34 HA PHE 23 HA PHE 23 -10.842 -7.728 -1.837 35 HB2 PHE 23 1HB PHE 23 -9.880 -9.259 0.625 36 HB3 PHE 23 2HB PHE 23 -8.956 -7.950 -0.100 37 HD1 PHE 23 1HD PHE 23 -9.849 -5.682 -0.273 38 HD2 PHE 23 2HD PHE 23 -11.868 -8.727 1.979 39 HE1 PHE 23 1HE PHE 23 -11.296 -3.951 0.733 40 HE2 PHE 23 2HE PHE 23 -13.247 -6.986 3.103 41 HZ PHE 23 HZ PHE 23 -12.968 -4.586 2.476 42 H THR 24 H THR 24 -8.539 -7.697 -2.726 43 HA THR 24 HA THR 24 -7.344 -10.365 -3.170 44 HB THR 24 HB THR 24 -6.471 -9.686 -5.321 45 HG1 THR 24 1HG THR 24 -6.747 -7.805 -6.197 46 HG21 THR 24 3HG2 THR 24 -9.432 -8.964 -5.317 47 HG22 THR 24 1HG2 THR 24 -8.802 -10.628 -5.335 48 HG23 THR 24 2HG2 THR 24 -8.471 -9.536 -6.689 49 H ASP 25 H ASP 25 -4.883 -10.020 -3.553 50 HA ASP 25 HA ASP 25 -3.838 -8.724 -1.239 51 HB2 ASP 25 1HB ASP 25 -2.558 -9.771 -3.810 52 HB3 ASP 25 2HB ASP 25 -1.607 -9.082 -2.511 53 H GLN 26 H GLN 26 -3.973 -7.776 -4.657 54 HA GLN 26 HA GLN 26 -2.428 -5.393 -4.485 55 HB2 GLN 26 1HB GLN 26 -4.776 -5.548 -6.366 56 HB3 GLN 26 2HB GLN 26 -3.186 -4.854 -6.609 57 HG2 GLN 26 1HG GLN 26 -3.141 -6.698 -7.981 58 HG3 GLN 26 2HG GLN 26 -2.386 -7.384 -6.547 59 HE21 GLN 26 1HE2 GLN 26 -5.508 -6.925 -8.317 60 HE22 GLN 26 2HE2 GLN 26 -6.066 -8.568 -7.980 61 H GLN 27 H GLN 27 -5.932 -5.963 -4.253 62 HA GLN 27 HA GLN 27 -6.879 -3.349 -4.051 63 HB2 GLN 27 1HB GLN 27 -7.850 -5.979 -2.873 64 HB3 GLN 27 2HB GLN 27 -8.815 -4.535 -2.846 65 HG2 GLN 27 1HG GLN 27 -7.692 -5.564 -5.453 66 HG3 GLN 27 2HG GLN 27 -9.133 -6.301 -4.776 67 HE21 GLN 27 1HE2 GLN 27 -9.066 -5.187 -7.298 68 HE22 GLN 27 2HE2 GLN 27 -9.931 -3.664 -7.350 69 H ILE 28 H ILE 28 -5.898 -5.576 -1.421 70 HA ILE 28 HA ILE 28 -6.512 -3.759 0.689 71 HB ILE 28 HB ILE 28 -4.546 -6.095 0.599 72 HG12 ILE 28 1HG1 ILE 28 -7.388 -6.125 1.736 73 HG13 ILE 28 2HG1 ILE 28 -7.077 -6.528 0.078 74 HG21 ILE 28 1HG2 ILE 28 -4.073 -4.665 2.543 75 HG22 ILE 28 2HG2 ILE 28 -5.806 -4.505 2.900 76 HG23 ILE 28 3HG2 ILE 28 -4.990 -6.048 3.136 77 HD11 ILE 28 3HD1 ILE 28 -5.823 -7.986 2.434 78 HD12 ILE 28 1HD1 ILE 28 -7.145 -8.558 1.413 79 HD13 ILE 28 2HD1 ILE 28 -5.521 -8.333 0.725 80 H GLY 29 H GLY 29 -3.662 -4.115 -1.392 81 HA2 GLY 29 1HA GLY 29 -1.840 -2.530 0.134 82 HA3 GLY 29 2HA GLY 29 -1.764 -2.897 -1.604 83 H VAL 30 H VAL 30 -4.459 -1.634 -2.112 84 HA VAL 30 HA VAL 30 -3.361 1.062 -2.520 85 HB VAL 30 HB VAL 30 -5.962 -0.293 -3.341 86 HG11 VAL 30 1HG1 VAL 30 -6.407 2.136 -2.995 87 HG12 VAL 30 2HG1 VAL 30 -5.042 2.522 -4.072 88 HG13 VAL 30 3HG1 VAL 30 -6.470 1.663 -4.688 89 HG21 VAL 30 3HG2 VAL 30 -4.862 0.122 -5.638 90 HG22 VAL 30 1HG2 VAL 30 -3.409 0.574 -4.758 91 HG23 VAL 30 2HG2 VAL 30 -4.040 -1.070 -4.606 92 H LEU 31 H LEU 31 -5.957 -0.531 -0.672 93 HA LEU 31 HA LEU 31 -6.849 1.775 0.745 94 HB2 LEU 31 1HB LEU 31 -7.181 -1.155 0.882 95 HB3 LEU 31 2HB LEU 31 -7.025 -0.453 2.484 96 HG LEU 31 HG LEU 31 -8.841 1.005 2.186 97 HD11 LEU 31 1HD1 LEU 31 -10.296 0.950 0.126 98 HD12 LEU 31 2HD1 LEU 31 -9.047 -0.027 -0.683 99 HD13 LEU 31 3HD1 LEU 31 -8.715 1.646 -0.203 100 HD21 LEU 31 3HD2 LEU 31 -9.313 -1.426 2.719 101 HD22 LEU 31 1HD2 LEU 31 -9.806 -1.602 1.037 102 HD23 LEU 31 2HD2 LEU 31 -10.669 -0.468 2.093 103 H ALA 32 H ALA 32 -4.210 -0.520 1.533 104 HA ALA 32 HA ALA 32 -3.393 0.762 3.918 105 HB1 ALA 32 1HB ALA 32 -1.219 -0.381 3.517 106 HB2 ALA 32 2HB ALA 32 -2.613 -1.459 3.283 107 HB3 ALA 32 3HB ALA 32 -1.752 -0.797 1.881 108 H GLY 33 H GLY 33 -2.459 1.484 0.519 109 HA2 GLY 33 1HA GLY 33 -0.491 3.466 1.312 110 HA3 GLY 33 2HA GLY 33 -1.091 3.149 -0.316 111 H LEU 34 H LEU 34 -3.988 3.538 0.749 112 HA LEU 34 HA LEU 34 -4.114 6.388 0.489 113 HB2 LEU 34 1HB LEU 34 -6.027 4.148 0.812 114 HB3 LEU 34 2HB LEU 34 -6.517 5.630 1.632 115 HG LEU 34 HG LEU 34 -6.285 6.935 -0.355 116 HD11 LEU 34 1HD1 LEU 34 -5.567 4.363 -1.837 117 HD12 LEU 34 2HD1 LEU 34 -4.519 5.778 -1.614 118 HD13 LEU 34 3HD1 LEU 34 -5.968 5.911 -2.608 119 HD21 LEU 34 3HD2 LEU 34 -7.930 4.405 -0.844 120 HD22 LEU 34 1HD2 LEU 34 -8.204 5.993 -1.605 121 HD23 LEU 34 2HD2 LEU 34 -8.422 5.800 0.137 122 H ALA 35 H ALA 35 -3.764 4.320 3.239 123 HA ALA 35 HA ALA 35 -4.171 6.528 5.182 124 HB1 ALA 35 1HB ALA 35 -3.149 3.677 5.542 125 HB2 ALA 35 2HB ALA 35 -3.289 4.872 6.856 126 HB3 ALA 35 3HB ALA 35 -4.729 4.327 6.023 127 H ILE 36 H ILE 36 -1.476 5.189 3.348 128 HA ILE 36 HA ILE 36 0.422 6.946 4.822 129 HB ILE 36 HB ILE 36 0.815 4.078 3.898 130 HG12 ILE 36 1HG1 ILE 36 1.716 3.750 6.209 131 HG13 ILE 36 2HG1 ILE 36 1.201 5.372 6.666 132 HG21 ILE 36 1HG2 ILE 36 3.127 4.245 4.443 133 HG22 ILE 36 2HG2 ILE 36 2.834 5.595 3.371 134 HG23 ILE 36 3HG2 ILE 36 2.966 5.882 5.108 135 HD11 ILE 36 3HD1 ILE 36 -0.787 3.314 5.728 136 HD12 ILE 36 1HD1 ILE 36 -0.142 3.305 7.387 137 HD13 ILE 36 2HD1 ILE 36 -1.011 4.719 6.814 138 H SER 37 H SER 37 0.158 8.543 3.300 139 HA SER 37 HA SER 37 0.767 9.759 1.529 140 HB2 SER 37 1HB SER 37 2.649 7.476 1.252 141 HB3 SER 37 2HB SER 37 2.406 8.420 -0.184 142 HG SER 37 HG SER 37 3.859 9.558 0.689 143 HA PRO 38 HA PRO 38 -2.681 7.683 -0.860 144 HB2 PRO 38 1HB PRO 38 -4.406 9.875 -0.655 145 HB3 PRO 38 2HB PRO 38 -4.416 8.466 0.424 146 HG2 PRO 38 1HG PRO 38 -3.112 11.147 0.861 147 HG3 PRO 38 2HG PRO 38 -4.028 10.137 2.028 148 HD2 PRO 38 1HD PRO 38 -1.329 10.192 2.034 149 HD3 PRO 38 2HD PRO 38 -2.214 8.669 2.334 150 H GLU 39 H GLU 39 -1.470 11.104 -0.834 151 HA GLU 39 HA GLU 39 -2.371 11.579 -3.509 152 HB2 GLU 39 1HB GLU 39 -0.307 13.128 -1.887 153 HB3 GLU 39 2HB GLU 39 -1.071 13.651 -3.402 154 HG2 GLU 39 1HG GLU 39 -3.331 13.217 -2.171 155 HG3 GLU 39 2HG GLU 39 -2.369 13.210 -0.698 156 H TRP 40 H TRP 40 0.846 10.676 -2.192 157 HA TRP 40 HA TRP 40 2.222 10.609 -4.653 158 HB2 TRP 40 1HB TRP 40 3.466 10.431 -2.623 159 HB3 TRP 40 2HB TRP 40 2.492 9.080 -2.078 160 HD1 TRP 40 HD TRP 40 5.433 9.830 -4.377 161 HE1 TRP 40 1HE TRP 40 6.594 7.679 -5.072 162 HE3 TRP 40 3HE TRP 40 2.157 6.453 -2.313 163 HZ2 TRP 40 2HZ TRP 40 6.192 4.862 -4.765 164 HZ3 TRP 40 3HZ TRP 40 2.560 4.046 -2.563 165 HH2 TRP 40 HH TRP 40 4.660 3.208 -3.725 166 H LEU 41 H LEU 41 0.115 8.174 -3.120 167 HA LEU 41 HA LEU 41 0.510 6.077 -5.071 168 HB2 LEU 41 1HB LEU 41 -0.341 5.654 -2.893 169 HB3 LEU 41 2HB LEU 41 -1.728 6.685 -3.121 170 HG LEU 41 HG LEU 41 -1.228 4.275 -4.898 171 HD11 LEU 41 1HD1 LEU 41 -2.735 3.020 -3.373 172 HD12 LEU 41 2HD1 LEU 41 -2.737 4.391 -2.246 173 HD13 LEU 41 3HD1 LEU 41 -1.233 3.493 -2.561 174 HD21 LEU 41 3HD2 LEU 41 -3.047 5.801 -5.687 175 HD22 LEU 41 1HD2 LEU 41 -3.824 5.692 -4.095 176 HD23 LEU 41 2HD2 LEU 41 -3.690 4.289 -5.139 177 H LYS 42 H LYS 42 -2.192 8.434 -4.766 178 HA LYS 42 HA LYS 42 -3.410 7.798 -7.193 179 HB2 LYS 42 1HB LYS 42 -3.256 10.457 -5.718 180 HB3 LYS 42 2HB LYS 42 -4.404 10.125 -7.022 181 HG2 LYS 42 1HG LYS 42 -5.602 8.555 -5.721 182 HG3 LYS 42 2HG LYS 42 -4.310 8.344 -4.557 183 HD2 LYS 42 1HD LYS 42 -5.994 9.651 -3.493 184 HD3 LYS 42 2HD LYS 42 -4.623 10.721 -3.803 185 HE2 LYS 42 1HE LYS 42 -5.842 11.486 -5.928 186 HE3 LYS 42 2HE LYS 42 -7.208 10.500 -5.400 187 HZ1 LYS 42 3HZ LYS 42 -6.151 12.927 -4.121 188 HZ2 LYS 42 1HZ LYS 42 -7.076 11.852 -3.288 189 HZ3 LYS 42 2HZ LYS 42 -7.687 12.577 -4.622 190 H GLN 43 H GLN 43 -0.610 10.048 -6.725 191 HA GLN 43 HA GLN 43 -0.884 11.215 -9.289 192 HB2 GLN 43 1HB GLN 43 1.134 12.252 -9.027 193 HB3 GLN 43 2HB GLN 43 0.223 12.383 -7.483 194 HG2 GLN 43 1HG GLN 43 1.626 11.303 -6.333 195 HG3 GLN 43 2HG GLN 43 1.882 10.123 -7.603 196 HE21 GLN 43 1HE2 GLN 43 3.155 12.973 -6.031 197 HE22 GLN 43 2HE2 GLN 43 4.609 13.109 -7.032 198 H ASN 44 H ASN 44 1.024 8.582 -8.152 199 HA ASN 44 HA ASN 44 2.358 8.072 -10.644 200 HB2 ASN 44 1HB ASN 44 2.083 6.552 -8.086 201 HB3 ASN 44 2HB ASN 44 2.880 5.820 -9.475 202 HD21 ASN 44 1HD2 ASN 44 3.286 8.179 -6.847 203 HD22 ASN 44 2HD2 ASN 44 4.780 8.808 -7.473 204 H ILE 45 H ILE 45 -0.708 6.763 -9.300 205 HA ILE 45 HA ILE 45 -1.240 5.073 -11.546 206 HB ILE 45 HB ILE 45 -3.171 6.625 -9.785 207 HG12 ILE 45 1HG1 ILE 45 -1.837 5.029 -8.486 208 HG13 ILE 45 2HG1 ILE 45 -3.513 4.568 -8.585 209 HG21 ILE 45 1HG2 ILE 45 -4.408 6.117 -11.733 210 HG22 ILE 45 2HG2 ILE 45 -3.629 4.539 -11.935 211 HG23 ILE 45 3HG2 ILE 45 -4.788 4.793 -10.635 212 HD11 ILE 45 3HD1 ILE 45 -1.226 3.335 -10.185 213 HD12 ILE 45 1HD1 ILE 45 -2.094 2.593 -8.853 214 HD13 ILE 45 2HD1 ILE 45 -2.944 2.887 -10.363 215 H ALA 46 H ALA 46 -1.813 8.620 -11.084 216 HA ALA 46 HA ALA 46 -3.199 8.924 -13.537 217 HB1 ALA 46 1HB ALA 46 -1.589 11.042 -12.060 218 HB2 ALA 46 2HB ALA 46 -2.912 11.294 -13.196 219 HB3 ALA 46 3HB ALA 46 -3.244 10.546 -11.624 220 H ALA 47 H ALA 47 0.052 8.103 -13.272 221 HA ALA 47 HA ALA 47 0.433 8.909 -16.096 222 HB1 ALA 47 1HB ALA 47 2.853 9.238 -15.643 223 HB2 ALA 47 2HB ALA 47 1.831 10.425 -14.844 224 HB3 ALA 47 3HB ALA 47 2.522 9.085 -13.900 225 H ASN 48 H ASN 48 -0.398 6.462 -14.378 226 HA ASN 48 HA ASN 48 -0.065 4.320 -14.114 227 HB2 ASN 48 1HB ASN 48 -0.780 4.723 -16.564 228 HB3 ASN 48 2HB ASN 48 0.791 4.094 -16.983 229 HD21 ASN 48 1HD2 ASN 48 1.193 1.904 -15.356 230 HD22 ASN 48 2HD2 ASN 48 -0.164 0.784 -15.530 231 H GLN 49 H GLN 49 2.234 5.803 -13.299 232 HA GLN 49 HA GLN 49 4.659 4.319 -14.145 233 HB2 GLN 49 1HB GLN 49 4.291 6.753 -12.339 234 HB3 GLN 49 2HB GLN 49 5.854 6.051 -12.747 235 HG2 GLN 49 1HG GLN 49 3.947 7.396 -14.646 236 HG3 GLN 49 2HG GLN 49 5.528 7.956 -14.143 237 HE21 GLN 49 1HE2 GLN 49 3.765 5.862 -16.254 238 HE22 GLN 49 2HE2 GLN 49 5.090 5.230 -17.208 239 H LEU 50 H LEU 50 2.508 3.409 -11.930 240 HA LEU 50 HA LEU 50 4.375 2.936 -9.643 241 HB2 LEU 50 1HB LEU 50 2.031 3.615 -9.226 242 HB3 LEU 50 2HB LEU 50 1.472 2.187 -10.111 243 HG LEU 50 HG LEU 50 2.541 0.682 -8.445 244 HD11 LEU 50 1HD1 LEU 50 3.041 3.293 -6.974 245 HD12 LEU 50 2HD1 LEU 50 4.228 2.074 -7.438 246 HD13 LEU 50 3HD1 LEU 50 3.040 1.708 -6.179 247 HD21 LEU 50 3HD2 LEU 50 0.081 1.731 -8.404 248 HD22 LEU 50 1HD2 LEU 50 0.631 2.293 -6.845 249 HD23 LEU 50 2HD2 LEU 50 0.659 0.564 -7.224 250 H VAL 51 H VAL 51 5.329 0.909 -9.201 251 HA VAL 51 HA VAL 51 4.302 -1.468 -10.662 252 HB VAL 51 HB VAL 51 7.113 -0.876 -9.699 253 HG11 VAL 51 1HG1 VAL 51 5.995 -3.496 -10.724 254 HG12 VAL 51 2HG1 VAL 51 7.728 -3.101 -10.623 255 HG13 VAL 51 3HG1 VAL 51 6.772 -3.166 -9.154 256 HG21 VAL 51 3HG2 VAL 51 6.169 -1.694 -12.499 257 HG22 VAL 51 1HG2 VAL 51 6.338 0.004 -12.000 258 HG23 VAL 51 2HG2 VAL 51 7.753 -1.039 -12.022 259 H TYR 52 H TYR 52 3.240 -2.769 -9.429 260 HA TYR 52 HA TYR 52 3.490 -3.033 -6.513 261 HB2 TYR 52 1HB TYR 52 1.342 -3.433 -7.662 262 HB3 TYR 52 2HB TYR 52 2.100 -4.581 -8.758 263 HD1 TYR 52 1HD TYR 52 2.754 -6.872 -7.981 264 HD2 TYR 52 2HD TYR 52 0.724 -4.050 -5.409 265 HE1 TYR 52 1HE TYR 52 2.190 -8.702 -6.428 266 HE2 TYR 52 2HE TYR 52 0.207 -5.884 -3.822 267 HH TYR 52 HH TYR 52 0.803 -9.282 -4.570 268 H GLY 53 H GLY 53 4.983 -4.516 -5.567 269 HA2 GLY 53 1HA GLY 53 6.105 -6.613 -7.293 270 HA3 GLY 53 2HA GLY 53 7.248 -5.448 -6.597 271 H ILE 54 H ILE 54 7.511 -8.085 -6.071 272 HA ILE 54 HA ILE 54 6.793 -8.319 -3.229 273 HB ILE 54 HB ILE 54 7.190 -10.401 -5.378 274 HG12 ILE 54 1HG1 ILE 54 4.911 -9.397 -5.262 275 HG13 ILE 54 2HG1 ILE 54 4.981 -11.124 -5.048 276 HG21 ILE 54 1HG2 ILE 54 6.844 -12.181 -3.692 277 HG22 ILE 54 2HG2 ILE 54 8.329 -11.269 -3.418 278 HG23 ILE 54 3HG2 ILE 54 6.917 -10.975 -2.400 279 HD11 ILE 54 3HD1 ILE 54 4.635 -10.868 -2.598 280 HD12 ILE 54 1HD1 ILE 54 4.657 -9.097 -2.794 281 HD13 ILE 54 2HD1 ILE 54 3.354 -10.061 -3.515 282 H VAL 55 H VAL 55 8.499 -8.516 -1.935 283 HA VAL 55 HA VAL 55 11.053 -7.536 -2.499 284 HB VAL 55 HB VAL 55 9.825 -9.123 -0.172 285 HG11 VAL 55 1HG1 VAL 55 12.136 -9.799 -0.032 286 HG12 VAL 55 2HG1 VAL 55 12.726 -8.223 -0.540 287 HG13 VAL 55 3HG1 VAL 55 11.945 -8.437 1.057 288 HG21 VAL 55 3HG2 VAL 55 10.219 -6.951 0.954 289 HG22 VAL 55 1HG2 VAL 55 10.743 -6.263 -0.609 290 HG23 VAL 55 2HG2 VAL 55 9.090 -6.858 -0.390 291 H LYS 56 H LYS 56 10.446 -10.930 -1.602 292 HA LYS 56 HA LYS 56 11.497 -12.820 -1.913 293 HB2 LYS 56 1HB LYS 56 12.147 -11.600 -4.619 294 HB3 LYS 56 2HB LYS 56 12.635 -13.224 -4.203 295 HG2 LYS 56 1HG LYS 56 9.904 -13.084 -3.437 296 HG3 LYS 56 2HG LYS 56 9.985 -12.187 -4.952 297 HD2 LYS 56 1HD LYS 56 10.895 -14.113 -6.104 298 HD3 LYS 56 2HD LYS 56 11.112 -14.992 -4.559 299 HE2 LYS 56 1HE LYS 56 8.746 -15.053 -4.153 300 HE3 LYS 56 2HE LYS 56 8.415 -14.020 -5.546 301 HZ1 LYS 56 3HZ LYS 56 8.046 -16.433 -5.832 302 HZ2 LYS 56 1HZ LYS 56 9.677 -16.666 -5.853 303 HZ3 LYS 56 2HZ LYS 56 8.960 -15.739 -7.011 304 HA PRO 57 HA PRO 57 15.501 -12.338 -0.293 305 HB2 PRO 57 1HB PRO 57 16.797 -14.683 -0.844 306 HB3 PRO 57 2HB PRO 57 15.423 -14.537 0.296 307 HG2 PRO 57 1HG PRO 57 15.341 -15.413 -2.607 308 HG3 PRO 57 2HG PRO 57 14.625 -16.237 -1.183 309 HD2 PRO 57 1HD PRO 57 13.133 -14.619 -2.735 310 HD3 PRO 57 2HD PRO 57 12.934 -14.622 -0.972 311 H SER 58 H SER 58 15.078 -12.808 -3.659 312 HA SER 58 HA SER 58 17.683 -12.525 -4.683 313 HB2 SER 58 1HB SER 58 15.150 -11.386 -5.909 314 HB3 SER 58 2HB SER 58 16.573 -12.034 -6.739 315 HG SER 58 HG SER 58 16.017 -14.112 -5.827 316 H ASP 59 H ASP 59 15.875 -10.138 -2.840 317 HA ASP 59 HA ASP 59 17.672 -8.038 -3.872 318 HB2 ASP 59 1HB ASP 59 14.733 -8.170 -4.056 319 HB3 ASP 59 2HB ASP 59 15.286 -6.685 -3.341 320 H THR 60 H THR 60 16.841 -5.909 -2.324 321 HA THR 60 HA THR 60 18.429 -6.781 0.029 322 HB THR 60 HB THR 60 18.775 -4.436 -1.885 323 HG1 THR 60 1HG THR 60 19.997 -7.012 -1.823 324 HG21 THR 60 3HG2 THR 60 20.725 -5.609 0.136 325 HG22 THR 60 1HG2 THR 60 19.809 -4.094 0.339 326 HG23 THR 60 2HG2 THR 60 20.996 -4.235 -0.966 327 H VAL 61 H VAL 61 17.265 -6.379 1.789 328 HA VAL 61 HA VAL 61 15.284 -4.167 1.885 329 HB VAL 61 HB VAL 61 13.615 -5.923 2.531 330 HG11 VAL 61 1HG1 VAL 61 12.871 -6.197 0.321 331 HG12 VAL 61 2HG1 VAL 61 13.786 -4.704 0.288 332 HG13 VAL 61 3HG1 VAL 61 14.507 -6.190 -0.360 333 HG21 VAL 61 3HG2 VAL 61 13.949 -8.227 1.832 334 HG22 VAL 61 1HG2 VAL 61 15.529 -7.862 1.142 335 HG23 VAL 61 2HG2 VAL 61 15.272 -7.780 2.901 336 HA PRO 62 HA PRO 62 16.216 -4.155 6.160 337 HB2 PRO 62 1HB PRO 62 13.654 -3.514 7.195 338 HB3 PRO 62 2HB PRO 62 14.889 -2.342 6.610 339 HG2 PRO 62 1HG PRO 62 12.436 -3.364 5.312 340 HG3 PRO 62 2HG PRO 62 13.246 -1.785 5.086 341 HD2 PRO 62 1HD PRO 62 13.336 -3.923 3.319 342 HD3 PRO 62 2HD PRO 62 14.581 -2.654 3.396 343 H ALA 63 H ALA 63 15.510 -5.116 8.290 344 HA ALA 63 HA ALA 63 15.008 -7.901 8.103 345 HB1 ALA 63 1HB ALA 63 16.268 -6.920 9.930 346 HB2 ALA 63 2HB ALA 63 14.861 -5.943 10.443 347 HB3 ALA 63 3HB ALA 63 14.823 -7.699 10.598 348 H GLY 64 H GLY 64 13.174 -9.156 8.402 349 HA2 GLY 64 1HA GLY 64 11.000 -9.752 8.665 350 HA3 GLY 64 2HA GLY 64 10.719 -8.249 9.624 351 H VAL 65 H VAL 65 11.819 -8.949 6.371 352 HA VAL 65 HA VAL 65 9.320 -8.753 5.123 353 HB VAL 65 HB VAL 65 9.018 -6.615 5.458 354 HG11 VAL 65 1HG1 VAL 65 11.340 -5.905 6.525 355 HG12 VAL 65 2HG1 VAL 65 12.037 -5.959 4.885 356 HG13 VAL 65 3HG1 VAL 65 10.787 -4.785 5.288 357 HG21 VAL 65 3HG2 VAL 65 10.768 -6.251 3.129 358 HG22 VAL 65 1HG2 VAL 65 9.272 -7.212 3.155 359 HG23 VAL 65 2HG2 VAL 65 9.261 -5.468 3.708 360 H ASP 66 H ASP 66 10.420 -10.707 4.759 361 HA ASP 66 HA ASP 66 12.166 -10.482 2.357 362 HB2 ASP 66 1HB ASP 66 12.469 -12.227 4.352 363 HB3 ASP 66 2HB ASP 66 11.258 -13.149 3.435 364 H ASP 67 H ASP 67 9.012 -10.520 3.161 365 HA ASP 67 HA ASP 67 8.109 -11.286 0.419 366 HB2 ASP 67 1HB ASP 67 6.722 -12.983 1.178 367 HB3 ASP 67 2HB ASP 67 8.174 -13.254 2.122 368 H TYR 68 H TYR 68 7.852 -8.949 2.795 369 HA TYR 68 HA TYR 68 5.008 -8.463 2.864 370 HB2 TYR 68 1HB TYR 68 7.340 -6.847 3.506 371 HB3 TYR 68 2HB TYR 68 5.763 -6.076 3.330 372 HD1 TYR 68 1HD TYR 68 6.421 -9.495 4.790 373 HD2 TYR 68 2HD TYR 68 5.069 -5.446 5.459 374 HE1 TYR 68 1HE TYR 68 5.843 -10.103 7.042 375 HE2 TYR 68 2HE TYR 68 4.370 -6.046 7.725 376 HH TYR 68 HH TYR 68 3.960 -9.092 8.938 377 H SER 69 H SER 69 3.837 -7.833 0.869 378 HA SER 69 HA SER 69 5.038 -7.304 -1.543 379 HB2 SER 69 1HB SER 69 2.378 -6.249 -0.539 380 HB3 SER 69 2HB SER 69 2.747 -6.837 -2.172 381 HG SER 69 HG SER 69 1.543 -8.312 -0.951 382 H TYR 70 H TYR 70 5.602 -5.345 -2.670 383 HA TYR 70 HA TYR 70 5.506 -2.882 -1.024 384 HB2 TYR 70 1HB TYR 70 7.681 -2.263 -1.629 385 HB3 TYR 70 2HB TYR 70 7.766 -3.846 -0.966 386 HD1 TYR 70 2HD TYR 70 7.885 -1.945 -4.220 387 HD2 TYR 70 1HD TYR 70 8.721 -5.663 -2.201 388 HE1 TYR 70 2HE TYR 70 9.259 -2.691 -6.139 389 HE2 TYR 70 1HE TYR 70 10.164 -6.347 -4.108 390 HH TYR 70 HH TYR 70 11.306 -5.591 -5.966 391 H LEU 71 H LEU 71 5.928 -0.906 -2.274 392 HA LEU 71 HA LEU 71 4.723 -0.823 -4.986 393 HB2 LEU 71 1HB LEU 71 3.838 0.596 -2.426 394 HB3 LEU 71 2HB LEU 71 3.371 1.158 -4.015 395 HG LEU 71 HG LEU 71 2.726 -1.649 -3.043 396 HD11 LEU 71 1HD1 LEU 71 1.023 0.860 -2.795 397 HD12 LEU 71 2HD1 LEU 71 1.753 -0.070 -1.496 398 HD13 LEU 71 3HD1 LEU 71 0.476 -0.811 -2.480 399 HD21 LEU 71 3HD2 LEU 71 2.605 -1.296 -5.495 400 HD22 LEU 71 1HD2 LEU 71 1.512 0.066 -5.230 401 HD23 LEU 71 2HD2 LEU 71 1.002 -1.580 -4.795 402 H VAL 72 H VAL 72 6.007 0.541 -6.212 403 HA VAL 72 HA VAL 72 7.309 2.874 -5.093 404 HB VAL 72 HB VAL 72 8.797 0.969 -4.453 405 HG11 VAL 72 1HG1 VAL 72 8.383 -0.506 -6.437 406 HG12 VAL 72 2HG1 VAL 72 9.354 0.608 -7.420 407 HG13 VAL 72 3HG1 VAL 72 10.095 -0.254 -6.057 408 HG21 VAL 72 3HG2 VAL 72 10.091 2.819 -6.474 409 HG22 VAL 72 1HG2 VAL 72 9.675 3.253 -4.813 410 HG23 VAL 72 2HG2 VAL 72 10.859 1.982 -5.101 411 H ALA 73 H ALA 73 8.296 4.214 -7.011 412 HA ALA 73 HA ALA 73 6.713 3.621 -9.445 413 HB1 ALA 73 1HB ALA 73 7.950 6.273 -8.693 414 HB2 ALA 73 2HB ALA 73 6.657 5.919 -9.854 415 HB3 ALA 73 3HB ALA 73 6.332 5.789 -8.114 416 H ALA 74 H ALA 74 7.715 3.942 -11.434 417 HA ALA 74 HA ALA 74 9.958 2.518 -11.727 418 HB1 ALA 74 1HB ALA 74 8.726 2.620 -13.656 419 HB2 ALA 74 2HB ALA 74 8.553 4.398 -13.614 420 HB3 ALA 74 3HB ALA 74 10.079 3.636 -14.133 421 H ASP 75 H ASP 75 10.012 5.880 -11.197 422 HA ASP 75 HA ASP 75 12.927 6.093 -11.890 423 HB2 ASP 75 1HB ASP 75 10.858 8.269 -11.244 424 HB3 ASP 75 2HB ASP 75 12.517 8.562 -11.681 425 H ASP 76 H ASP 76 11.021 5.609 -9.193 426 HA ASP 76 HA ASP 76 13.017 6.937 -7.452 427 HB2 ASP 76 1HB ASP 76 11.400 7.800 -6.034 428 HB3 ASP 76 2HB ASP 76 10.941 8.256 -7.672 429 H GLN 77 H GLN 77 13.005 4.381 -8.552 430 HA GLN 77 HA GLN 77 12.269 2.280 -6.785 431 HB2 GLN 77 1HB GLN 77 14.698 2.558 -8.577 432 HB3 GLN 77 2HB GLN 77 14.324 1.099 -7.659 433 HG2 GLN 77 1HG GLN 77 12.071 1.004 -8.809 434 HG3 GLN 77 2HG GLN 77 12.635 2.301 -9.878 435 HE21 GLN 77 1HE2 GLN 77 12.090 -0.913 -10.320 436 HE22 GLN 77 2HE2 GLN 77 13.590 -1.360 -11.029 437 H ASP 78 H ASP 78 14.705 4.724 -6.251 438 HA ASP 78 HA ASP 78 15.466 3.381 -3.689 439 HB2 ASP 78 1HB ASP 78 17.627 4.321 -3.761 440 HB3 ASP 78 2HB ASP 78 17.328 3.514 -5.291 441 H GLY 79 H GLY 79 13.360 5.566 -4.655 442 HA2 GLY 79 1HA GLY 79 13.939 7.804 -2.852 443 HA3 GLY 79 2HA GLY 79 12.595 7.628 -3.985 444 H THR 80 H THR 80 10.679 7.533 -2.874 445 HA THR 80 HA THR 80 10.411 6.541 -0.171 446 HB THR 80 HB THR 80 8.116 6.732 -2.128 447 HG1 THR 80 1HG THR 80 8.787 8.624 -2.459 448 HG21 THR 80 3HG2 THR 80 6.854 7.555 -0.270 449 HG22 THR 80 1HG2 THR 80 8.281 7.425 0.805 450 HG23 THR 80 2HG2 THR 80 7.528 5.960 0.109 451 H ILE 81 H ILE 81 9.202 4.453 0.363 452 HA ILE 81 HA ILE 81 8.230 2.849 -1.763 453 HB ILE 81 HB ILE 81 10.457 1.956 -1.965 454 HG12 ILE 81 1HG1 ILE 81 9.077 -0.124 -0.251 455 HG13 ILE 81 2HG1 ILE 81 8.404 0.377 -1.791 456 HG21 ILE 81 1HG2 ILE 81 11.701 2.506 -0.080 457 HG22 ILE 81 2HG2 ILE 81 10.503 1.842 1.063 458 HG23 ILE 81 3HG2 ILE 81 11.531 0.774 0.104 459 HD11 ILE 81 3HD1 ILE 81 10.505 -0.254 -2.959 460 HD12 ILE 81 1HD1 ILE 81 11.217 -0.770 -1.416 461 HD13 ILE 81 2HD1 ILE 81 9.829 -1.625 -2.068 462 H ILE 82 H ILE 82 6.639 1.455 -0.904 463 HA ILE 82 HA ILE 82 6.303 1.507 2.030 464 HB ILE 82 HB ILE 82 4.140 1.942 -0.074 465 HG12 ILE 82 1HG1 ILE 82 5.120 3.768 2.171 466 HG13 ILE 82 2HG1 ILE 82 5.599 3.946 0.488 467 HG21 ILE 82 1HG2 ILE 82 3.889 1.595 2.965 468 HG22 ILE 82 2HG2 ILE 82 2.573 2.108 1.898 469 HG23 ILE 82 3HG2 ILE 82 3.263 0.509 1.717 470 HD11 ILE 82 3HD1 ILE 82 3.359 4.401 -0.234 471 HD12 ILE 82 1HD1 ILE 82 2.759 4.240 1.431 472 HD13 ILE 82 2HD1 ILE 82 3.891 5.539 1.010 473 H PHE 83 H PHE 83 5.835 -0.434 2.896 474 HA PHE 83 HA PHE 83 5.499 -2.751 1.105 475 HB2 PHE 83 1HB PHE 83 6.899 -2.601 3.761 476 HB3 PHE 83 2HB PHE 83 6.666 -4.023 2.810 477 HD1 PHE 83 2HD PHE 83 8.328 -0.661 2.737 478 HD2 PHE 83 1HD PHE 83 8.478 -4.778 1.539 479 HE1 PHE 83 2HE PHE 83 10.677 -0.358 1.999 480 HE2 PHE 83 1HE PHE 83 10.818 -4.447 0.738 481 HZ PHE 83 HZ PHE 83 11.914 -2.251 0.966 482 H PHE 84 H PHE 84 3.987 -4.380 2.119 483 HA PHE 84 HA PHE 84 2.936 -3.856 4.771 484 HB2 PHE 84 1HB PHE 84 0.525 -3.816 4.036 485 HB3 PHE 84 2HB PHE 84 1.417 -2.372 3.584 486 HD1 PHE 84 2HD PHE 84 2.356 -2.191 1.164 487 HD2 PHE 84 1HD PHE 84 -0.641 -5.069 2.361 488 HE1 PHE 84 2HE PHE 84 1.877 -2.676 -1.196 489 HE2 PHE 84 1HE PHE 84 -1.188 -5.441 -0.031 490 HZ PHE 84 HZ PHE 84 0.127 -4.305 -1.813 491 H LYS 85 H LYS 85 1.812 -5.688 5.602 492 HA LYS 85 HA LYS 85 1.503 -7.965 3.742 493 HB2 LYS 85 1HB LYS 85 3.452 -8.262 5.262 494 HB3 LYS 85 2HB LYS 85 2.338 -8.323 6.621 495 HG2 LYS 85 1HG LYS 85 3.073 -10.514 5.881 496 HG3 LYS 85 2HG LYS 85 1.313 -10.358 5.622 497 HD2 LYS 85 1HD LYS 85 3.060 -9.666 3.298 498 HD3 LYS 85 2HD LYS 85 3.119 -11.352 3.818 499 HE2 LYS 85 1HE LYS 85 0.813 -11.698 3.516 500 HE3 LYS 85 2HE LYS 85 0.457 -9.975 3.458 501 HZ1 LYS 85 3HZ LYS 85 1.998 -11.384 1.377 502 HZ2 LYS 85 1HZ LYS 85 1.448 -9.812 1.350 503 HZ3 LYS 85 2HZ LYS 85 0.362 -11.013 1.297 504 H ALA 86 H ALA 86 -0.608 -8.065 3.458 505 HA ALA 86 HA ALA 86 -2.547 -7.569 5.609 506 HB1 ALA 86 1HB ALA 86 -3.089 -7.134 3.203 507 HB2 ALA 86 2HB ALA 86 -2.864 -8.855 2.850 508 HB3 ALA 86 3HB ALA 86 -4.156 -8.352 3.962 509 H GLU 87 H GLU 87 -1.707 -8.916 7.197 510 HA GLU 87 HA GLU 87 -1.416 -11.817 6.742 511 HB2 GLU 87 1HB GLU 87 -1.262 -10.166 9.306 512 HB3 GLU 87 2HB GLU 87 -0.887 -11.901 9.089 513 HG2 GLU 87 1HG GLU 87 0.965 -11.310 7.567 514 HG3 GLU 87 2HG GLU 87 0.660 -9.598 7.862 515 H GLY 88 H GLY 88 -2.690 -12.812 8.951 516 HA2 GLY 88 1HA GLY 88 -5.368 -13.011 8.226 517 HA3 GLY 88 2HA GLY 88 -4.692 -13.451 9.793 518 H GLN 89 H GLN 89 -6.554 -11.246 8.031 519 HA GLN 89 HA GLN 89 -8.086 -9.587 8.652 520 HB2 GLN 89 1HB GLN 89 -7.795 -11.010 11.295 521 HB3 GLN 89 2HB GLN 89 -9.033 -9.835 10.904 522 HG2 GLN 89 1HG GLN 89 -9.967 -12.041 10.663 523 HG3 GLN 89 2HG GLN 89 -9.899 -11.262 9.089 524 HE21 GLN 89 1HE2 GLN 89 -8.733 -12.360 7.341 525 HE22 GLN 89 2HE2 GLN 89 -7.760 -13.783 7.748 526 H THR 90 H THR 90 -5.019 -9.134 8.992 527 HA THR 90 HA THR 90 -5.197 -6.517 10.332 528 HB THR 90 HB THR 90 -2.969 -8.525 10.836 529 HG1 THR 90 1HG THR 90 -4.779 -9.472 11.708 530 HG21 THR 90 3HG2 THR 90 -2.474 -6.136 11.330 531 HG22 THR 90 1HG2 THR 90 -2.506 -7.116 12.800 532 HG23 THR 90 2HG2 THR 90 -3.889 -6.074 12.407 533 H VAL 91 H VAL 91 -3.863 -4.995 9.266 534 HA VAL 91 HA VAL 91 -1.980 -6.012 7.207 535 HB VAL 91 HB VAL 91 -3.380 -3.318 7.090 536 HG11 VAL 91 1HG1 VAL 91 -2.394 -3.238 4.837 537 HG12 VAL 91 2HG1 VAL 91 -1.107 -3.506 6.022 538 HG13 VAL 91 3HG1 VAL 91 -1.699 -4.860 5.045 539 HG21 VAL 91 3HG2 VAL 91 -4.603 -4.186 5.151 540 HG22 VAL 91 1HG2 VAL 91 -3.938 -5.805 5.428 541 HG23 VAL 91 2HG2 VAL 91 -5.054 -5.078 6.613 542 H ILE 92 H ILE 92 0.002 -5.918 8.212 543 HA ILE 92 HA ILE 92 0.683 -3.608 9.887 544 HB ILE 92 HB ILE 92 2.409 -5.941 8.969 545 HG12 ILE 92 1HG1 ILE 92 2.105 -6.610 11.439 546 HG13 ILE 92 2HG1 ILE 92 0.648 -5.631 11.448 547 HG21 ILE 92 1HG2 ILE 92 3.639 -3.900 9.687 548 HG22 ILE 92 2HG2 ILE 92 2.739 -3.908 11.224 549 HG23 ILE 92 3HG2 ILE 92 3.860 -5.230 10.831 550 HD11 ILE 92 3HD1 ILE 92 1.158 -7.848 9.434 551 HD12 ILE 92 1HD1 ILE 92 0.487 -8.185 11.045 552 HD13 ILE 92 2HD1 ILE 92 -0.418 -7.173 9.915 553 H ILE 93 H ILE 93 0.846 -1.825 8.682 554 HA ILE 93 HA ILE 93 1.941 -1.885 5.954 555 HB ILE 93 HB ILE 93 1.025 0.580 7.468 556 HG12 ILE 93 1HG1 ILE 93 -0.733 -1.279 5.804 557 HG13 ILE 93 2HG1 ILE 93 -0.859 -1.074 7.562 558 HG21 ILE 93 1HG2 ILE 93 2.352 0.755 5.297 559 HG22 ILE 93 2HG2 ILE 93 1.045 -0.113 4.488 560 HG23 ILE 93 3HG2 ILE 93 0.748 1.477 5.208 561 HD11 ILE 93 3HD1 ILE 93 -2.594 0.138 6.498 562 HD12 ILE 93 1HD1 ILE 93 -1.475 1.244 7.323 563 HD13 ILE 93 2HD1 ILE 93 -1.450 1.084 5.541 564 H LYS 94 H LYS 94 4.060 -1.826 5.732 565 HA LYS 94 HA LYS 94 5.827 -0.721 7.852 566 HB2 LYS 94 1HB LYS 94 6.069 -2.916 5.807 567 HB3 LYS 94 2HB LYS 94 7.481 -2.257 6.587 568 HG2 LYS 94 1HG LYS 94 6.269 -2.873 8.801 569 HG3 LYS 94 2HG LYS 94 5.304 -3.913 7.775 570 HD2 LYS 94 1HD LYS 94 6.962 -5.461 7.503 571 HD3 LYS 94 2HD LYS 94 8.276 -4.342 7.429 572 HE2 LYS 94 1HE LYS 94 7.922 -3.995 9.975 573 HE3 LYS 94 2HE LYS 94 6.553 -5.088 9.891 574 HZ1 LYS 94 3HZ LYS 94 8.084 -6.887 9.288 575 HZ2 LYS 94 1HZ LYS 94 8.334 -6.228 10.759 576 HZ3 LYS 94 2HZ LYS 94 9.364 -5.873 9.533 577 H TYR 95 H TYR 95 6.080 1.472 7.144 578 HA TYR 95 HA TYR 95 7.000 1.854 4.317 579 HB2 TYR 95 1HB TYR 95 5.882 4.077 4.490 580 HB3 TYR 95 2HB TYR 95 4.778 2.712 4.566 581 HD1 TYR 95 2HD TYR 95 3.662 2.041 6.578 582 HD2 TYR 95 1HD TYR 95 6.244 5.493 6.516 583 HE1 TYR 95 2HE TYR 95 2.791 2.721 8.786 584 HE2 TYR 95 1HE TYR 95 5.314 6.211 8.712 585 HH TYR 95 HH TYR 95 2.534 5.150 10.011 586 H THR 96 H THR 96 8.245 3.905 4.027 587 HA THR 96 HA THR 96 9.785 4.931 6.266 588 HB THR 96 HB THR 96 10.751 2.741 5.779 589 HG1 THR 96 1HG THR 96 12.467 3.492 6.361 590 HG21 THR 96 3HG2 THR 96 11.583 3.874 3.125 591 HG22 THR 96 1HG2 THR 96 10.394 2.577 3.330 592 HG23 THR 96 2HG2 THR 96 12.089 2.323 3.793 593 H SER 97 H SER 97 11.407 6.431 5.391 594 HA SER 97 HA SER 97 10.322 8.000 3.128 595 HB2 SER 97 1HB SER 97 12.109 9.642 4.284 596 HB3 SER 97 2HB SER 97 10.425 9.589 4.784 597 HG SER 97 HG SER 97 12.087 9.474 6.474 598 H GLN 98 H GLN 98 12.676 5.751 3.825 599 HA GLN 98 HA GLN 98 14.067 6.522 1.342 600 HB2 GLN 98 1HB GLN 98 15.811 6.254 3.815 601 HB3 GLN 98 2HB GLN 98 16.356 6.412 2.161 602 HG2 GLN 98 1HG GLN 98 15.530 8.704 2.048 603 HG3 GLN 98 2HG GLN 98 14.886 8.577 3.698 604 HE21 GLN 98 1HE2 GLN 98 17.848 8.981 1.804 605 HE22 GLN 98 2HE2 GLN 98 18.886 9.274 3.162 606 H ARG 99 H ARG 99 14.968 4.844 0.283 607 HA ARG 99 HA ARG 99 14.366 2.177 0.899 608 HB2 ARG 99 1HB ARG 99 15.236 3.407 -1.290 609 HB3 ARG 99 2HB ARG 99 16.818 2.926 -0.701 610 HG2 ARG 99 1HG ARG 99 16.055 1.351 -2.330 611 HG3 ARG 99 2HG ARG 99 16.023 0.513 -0.775 612 HD2 ARG 99 1HD ARG 99 13.673 0.429 -0.744 613 HD3 ARG 99 2HD ARG 99 13.514 1.890 -1.731 614 HE ARG 99 HE ARG 99 13.793 0.735 -3.682 615 HH11 ARG 99 1HH1 ARG 99 14.173 -1.707 -1.032 616 HH12 ARG 99 2HH1 ARG 99 13.916 -3.002 -2.186 617 HH21 ARG 99 1HH2 ARG 99 13.451 -1.092 -5.050 618 HH22 ARG 99 2HH2 ARG 99 13.752 -2.644 -4.411 619 H ASN 100 H ASN 100 17.212 4.032 1.608 620 HA ASN 100 HA ASN 100 18.539 1.903 3.089 621 HB2 ASN 100 1HB ASN 100 20.342 3.356 3.460 622 HB3 ASN 100 2HB ASN 100 19.833 3.491 1.794 623 HD21 ASN 100 1HD2 ASN 100 17.959 5.290 4.204 624 HD22 ASN 100 2HD2 ASN 100 18.611 6.861 3.769 625 H THR 101 H THR 101 15.828 2.702 4.246 626 HA THR 101 HA THR 101 16.938 2.824 6.976 627 HB THR 101 HB THR 101 14.785 4.226 7.566 628 HG1 THR 101 1HG THR 101 14.497 4.398 5.029 629 HG21 THR 101 3HG2 THR 101 17.120 4.903 8.024 630 HG22 THR 101 1HG2 THR 101 16.075 6.266 7.594 631 HG23 THR 101 2HG2 THR 101 17.210 5.631 6.395 632 H LYS 102 H LYS 102 15.644 1.982 8.611 633 HA LYS 102 HA LYS 102 14.075 -0.298 7.930 634 HB2 LYS 102 1HB LYS 102 15.369 0.269 10.136 635 HB3 LYS 102 2HB LYS 102 13.962 1.208 10.583 636 HG2 LYS 102 1HG LYS 102 13.802 -0.927 11.666 637 HG3 LYS 102 2HG LYS 102 12.572 -0.896 10.429 638 HD2 LYS 102 1HD LYS 102 14.688 -2.040 9.061 639 HD3 LYS 102 2HD LYS 102 15.005 -2.586 10.686 640 HE2 LYS 102 1HE LYS 102 12.380 -3.018 9.163 641 HE3 LYS 102 2HE LYS 102 13.701 -4.185 9.284 642 HZ1 LYS 102 3HZ LYS 102 11.970 -3.267 11.468 643 HZ2 LYS 102 1HZ LYS 102 13.337 -4.181 11.711 644 HZ3 LYS 102 2HZ LYS 102 12.081 -4.763 10.853 645 H LEU 103 H LEU 103 11.837 -0.552 8.857 646 HA LEU 103 HA LEU 103 10.136 1.505 7.618 647 HB2 LEU 103 1HB LEU 103 9.576 -1.446 8.122 648 HB3 LEU 103 2HB LEU 103 8.642 -0.355 7.099 649 HG LEU 103 HG LEU 103 11.446 -1.442 6.603 650 HD11 LEU 103 1HD1 LEU 103 10.472 -2.495 4.638 651 HD12 LEU 103 2HD1 LEU 103 8.898 -1.804 5.015 652 HD13 LEU 103 3HD1 LEU 103 9.634 -3.000 6.116 653 HD21 LEU 103 3HD2 LEU 103 11.307 -0.318 4.357 654 HD22 LEU 103 1HD2 LEU 103 11.525 0.773 5.704 655 HD23 LEU 103 2HD2 LEU 103 9.906 0.600 4.952 656 H LYS 104 H LYS 104 8.069 1.934 8.653 657 HA LYS 104 HA LYS 104 7.897 1.712 11.563 658 HB2 LYS 104 1HB LYS 104 6.281 2.839 9.263 659 HB3 LYS 104 2HB LYS 104 5.442 2.481 10.748 660 HG2 LYS 104 1HG LYS 104 6.087 4.783 10.804 661 HG3 LYS 104 2HG LYS 104 6.996 3.914 12.029 662 HD2 LYS 104 1HD LYS 104 9.007 3.987 10.786 663 HD3 LYS 104 2HD LYS 104 8.157 4.497 9.315 664 HE2 LYS 104 1HE LYS 104 7.654 6.655 10.218 665 HE3 LYS 104 2HE LYS 104 8.086 6.159 11.858 666 HZ1 LYS 104 3HZ LYS 104 9.729 7.532 10.754 667 HZ2 LYS 104 1HZ LYS 104 10.063 6.300 9.668 668 HZ3 LYS 104 2HZ LYS 104 10.359 6.089 11.258 669 H ALA 105 H ALA 105 5.574 0.809 12.310 670 HA ALA 105 HA ALA 105 4.634 -1.444 10.683 671 HB1 ALA 105 1HB ALA 105 5.497 -1.798 13.589 672 HB2 ALA 105 2HB ALA 105 4.601 -2.985 12.626 673 HB3 ALA 105 3HB ALA 105 6.254 -2.548 12.167 674 H LYS 106 H LYS 106 3.091 0.372 10.376 675 HA LYS 106 HA LYS 106 1.227 1.076 12.558 676 HB2 LYS 106 1HB LYS 106 1.626 2.639 10.681 677 HB3 LYS 106 2HB LYS 106 1.164 1.384 9.535 678 HG2 LYS 106 1HG LYS 106 -0.658 2.715 9.533 679 HG3 LYS 106 2HG LYS 106 -1.168 1.443 10.629 680 HD2 LYS 106 1HD LYS 106 -1.054 2.874 12.513 681 HD3 LYS 106 2HD LYS 106 0.129 3.931 11.716 682 HE2 LYS 106 1HE LYS 106 -1.571 4.681 10.110 683 HE3 LYS 106 2HE LYS 106 -2.817 3.752 10.953 684 HZ1 LYS 106 3HZ LYS 106 -2.527 5.131 12.868 685 HZ2 LYS 106 1HZ LYS 106 -2.705 6.120 11.601 686 HZ3 LYS 106 2HZ LYS 106 -1.196 5.867 12.247 687 H ALA 107 H ALA 107 0.236 -0.827 13.346 688 HA ALA 107 HA ALA 107 -0.732 -2.797 11.329 689 HB1 ALA 107 1HB ALA 107 -0.586 -3.012 14.373 690 HB2 ALA 107 2HB ALA 107 -1.131 -4.276 13.258 691 HB3 ALA 107 3HB ALA 107 0.564 -3.751 13.227 692 H LEU 108 H LEU 108 -2.847 -3.037 10.956 693 HA LEU 108 HA LEU 108 -4.917 -1.608 12.521 694 HB2 LEU 108 1HB LEU 108 -4.401 -1.396 9.532 695 HB3 LEU 108 2HB LEU 108 -5.779 -0.674 10.367 696 HG LEU 108 HG LEU 108 -2.886 0.116 10.893 697 HD11 LEU 108 1HD1 LEU 108 -3.298 2.070 9.436 698 HD12 LEU 108 2HD1 LEU 108 -4.842 1.348 8.944 699 HD13 LEU 108 3HD1 LEU 108 -3.312 0.515 8.593 700 HD21 LEU 108 3HD2 LEU 108 -4.538 0.703 12.676 701 HD22 LEU 108 1HD2 LEU 108 -5.446 1.638 11.483 702 HD23 LEU 108 2HD2 LEU 108 -3.782 2.113 11.893 703 H THR 109 H THR 109 -7.015 -2.593 12.017 704 HA THR 109 HA THR 109 -6.794 -5.388 11.168 705 HB THR 109 HB THR 109 -9.328 -5.277 11.533 706 HG1 THR 109 1HG THR 109 -8.665 -2.856 12.825 707 HG21 THR 109 3HG2 THR 109 -7.760 -6.273 13.113 708 HG22 THR 109 1HG2 THR 109 -8.986 -5.352 13.997 709 HG23 THR 109 2HG2 THR 109 -7.358 -4.682 13.780 710 H LEU 110 H LEU 110 -7.929 -6.386 9.411 711 HA LEU 110 HA LEU 110 -8.067 -4.870 6.967 712 HB2 LEU 110 1HB LEU 110 -8.970 -7.603 7.870 713 HB3 LEU 110 2HB LEU 110 -9.709 -6.949 6.423 714 HG LEU 110 HG LEU 110 -6.701 -7.214 6.790 715 HD11 LEU 110 1HD1 LEU 110 -6.872 -9.100 5.171 716 HD12 LEU 110 2HD1 LEU 110 -8.645 -8.981 5.210 717 HD13 LEU 110 3HD1 LEU 110 -7.734 -9.473 6.645 718 HD21 LEU 110 3HD2 LEU 110 -7.323 -5.493 5.091 719 HD22 LEU 110 1HD2 LEU 110 -8.433 -6.651 4.323 720 HD23 LEU 110 2HD2 LEU 110 -6.684 -6.934 4.313 721 H SER 111 H SER 111 -10.341 -5.338 9.588 722 HA SER 111 HA SER 111 -12.552 -4.168 8.151 723 HB2 SER 111 1HB SER 111 -12.485 -5.455 10.469 724 HB3 SER 111 2HB SER 111 -12.425 -3.805 11.120 725 HG SER 111 HG SER 111 -14.588 -4.700 10.730 726 H GLN 112 H GLN 112 -10.051 -2.586 10.325 727 HA GLN 112 HA GLN 112 -10.929 -0.019 10.359 728 HB2 GLN 112 1HB GLN 112 -8.392 -1.430 10.659 729 HB3 GLN 112 2HB GLN 112 -8.111 0.037 9.786 730 HG2 GLN 112 1HG GLN 112 -8.005 1.090 11.736 731 HG3 GLN 112 2HG GLN 112 -9.752 0.903 11.845 732 HE21 GLN 112 1HE2 GLN 112 -10.294 0.218 13.851 733 HE22 GLN 112 2HE2 GLN 112 -9.289 -0.804 14.867 734 H LEU 113 H LEU 113 -8.736 -1.368 7.886 735 HA LEU 113 HA LEU 113 -8.613 0.846 6.143 736 HB2 LEU 113 1HB LEU 113 -8.251 -2.168 5.777 737 HB3 LEU 113 2HB LEU 113 -8.043 -1.061 4.445 738 HG LEU 113 HG LEU 113 -5.933 -1.782 5.490 739 HD11 LEU 113 1HD1 LEU 113 -5.842 0.161 4.179 740 HD12 LEU 113 2HD1 LEU 113 -4.904 0.524 5.617 741 HD13 LEU 113 3HD1 LEU 113 -6.533 1.193 5.434 742 HD21 LEU 113 3HD2 LEU 113 -6.539 -1.763 7.868 743 HD22 LEU 113 1HD2 LEU 113 -6.641 0.021 7.826 744 HD23 LEU 113 2HD2 LEU 113 -5.107 -0.811 7.511 745 H LYS 114 H LYS 114 -11.065 -1.855 6.196 746 HA LYS 114 HA LYS 114 -12.176 -1.162 3.645 747 HB2 LYS 114 1HB LYS 114 -12.312 -3.393 4.571 748 HB3 LYS 114 2HB LYS 114 -13.103 -2.828 6.043 749 HG2 LYS 114 1HG LYS 114 -14.339 -2.416 3.305 750 HG3 LYS 114 2HG LYS 114 -14.524 -3.933 4.212 751 HD2 LYS 114 1HD LYS 114 -15.874 -3.115 5.783 752 HD3 LYS 114 2HD LYS 114 -15.268 -1.515 5.777 753 HE2 LYS 114 1HE LYS 114 -16.246 -1.746 3.158 754 HE3 LYS 114 2HE LYS 114 -17.443 -2.607 4.125 755 HZ1 LYS 114 3HZ LYS 114 -17.927 -0.245 3.842 756 HZ2 LYS 114 1HZ LYS 114 -16.516 0.165 4.569 757 HZ3 LYS 114 2HZ LYS 114 -17.751 -0.600 5.414 758 H LYS 115 H LYS 115 -12.635 -0.085 7.000 759 HA LYS 115 HA LYS 115 -15.157 1.285 6.424 760 HB2 LYS 115 1HB LYS 115 -13.492 0.628 8.744 761 HB3 LYS 115 2HB LYS 115 -13.740 2.344 8.692 762 HG2 LYS 115 1HG LYS 115 -15.463 1.178 10.009 763 HG3 LYS 115 2HG LYS 115 -16.169 2.052 8.653 764 HD2 LYS 115 1HD LYS 115 -17.257 -0.100 9.015 765 HD3 LYS 115 2HD LYS 115 -16.526 -0.010 7.430 766 HE2 LYS 115 1HE LYS 115 -16.066 -2.196 8.201 767 HE3 LYS 115 2HE LYS 115 -14.543 -1.321 8.359 768 HZ1 LYS 115 3HZ LYS 115 -15.043 -2.641 10.292 769 HZ2 LYS 115 1HZ LYS 115 -16.452 -1.837 10.574 770 HZ3 LYS 115 2HZ LYS 115 -14.969 -1.088 10.716 771 H GLU 116 H GLU 116 -11.861 2.365 7.162 772 HA GLU 116 HA GLU 116 -12.180 5.003 6.751 773 HB2 GLU 116 1HB GLU 116 -9.805 3.159 6.319 774 HB3 GLU 116 2HB GLU 116 -9.612 4.900 6.287 775 HG2 GLU 116 1HG GLU 116 -10.939 3.515 8.669 776 HG3 GLU 116 2HG GLU 116 -9.208 3.743 8.565 777 H PHE 117 H PHE 117 -11.242 2.758 4.093 778 HA PHE 117 HA PHE 117 -11.696 5.053 2.228 779 HB2 PHE 117 1HB PHE 117 -9.747 2.828 1.816 780 HB3 PHE 117 2HB PHE 117 -9.856 4.351 0.978 781 HD1 PHE 117 2HD PHE 117 -9.745 6.473 2.758 782 HD2 PHE 117 1HD PHE 117 -7.958 2.581 3.376 783 HE1 PHE 117 2HE PHE 117 -8.073 7.471 4.298 784 HE2 PHE 117 1HE PHE 117 -6.217 3.596 4.711 785 HZ PHE 117 HZ PHE 117 -6.305 6.053 5.282 786 H TYR 118 H TYR 118 -13.450 2.675 3.178 787 HA TYR 118 HA TYR 118 -14.417 2.135 0.442 788 HB2 TYR 118 1HB TYR 118 -12.892 0.216 1.847 789 HB3 TYR 118 2HB TYR 118 -14.549 -0.320 1.963 790 HD1 TYR 118 1HD TYR 118 -13.010 1.377 -1.118 791 HD2 TYR 118 2HD TYR 118 -14.299 -2.283 0.813 792 HE1 TYR 118 1HE TYR 118 -12.725 0.172 -3.236 793 HE2 TYR 118 2HE TYR 118 -14.024 -3.481 -1.328 794 HH TYR 118 HH TYR 118 -12.946 -2.081 -4.400 795 H GLN 119 H GLN 119 -15.225 3.544 3.211 796 HA GLN 119 HA GLN 119 -17.788 2.630 3.813 797 HB2 GLN 119 1HB GLN 119 -18.456 4.859 4.409 798 HB3 GLN 119 2HB GLN 119 -16.961 4.360 5.125 799 HG2 GLN 119 1HG GLN 119 -16.941 6.333 2.905 800 HG3 GLN 119 2HG GLN 119 -17.250 6.779 4.564 801 HE21 GLN 119 1HE2 GLN 119 -14.751 6.856 2.412 802 HE22 GLN 119 2HE2 GLN 119 -13.484 6.261 3.454 803 H THR 120 H THR 120 -17.206 5.235 1.263 804 HA THR 120 HA THR 120 -20.047 4.760 0.552 805 HB THR 120 HB THR 120 -19.742 7.012 0.518 806 HG1 THR 120 1HG THR 120 -19.621 7.752 -1.569 807 HG21 THR 120 3HG2 THR 120 -17.662 8.146 -0.303 808 HG22 THR 120 1HG2 THR 120 -16.911 6.551 -0.460 809 HG23 THR 120 2HG2 THR 120 -17.442 7.133 1.126 810 H ARG 121 H ARG 121 -20.711 4.153 -1.600 811 HA ARG 121 HA ARG 121 -18.861 2.303 -2.902 812 HB2 ARG 121 1HB ARG 121 -21.175 1.638 -2.694 813 HB3 ARG 121 2HB ARG 121 -21.723 3.098 -3.518 814 HG2 ARG 121 1HG ARG 121 -20.792 2.351 -5.616 815 HG3 ARG 121 2HG ARG 121 -19.954 0.992 -4.837 816 HD2 ARG 121 1HD ARG 121 -22.003 -0.130 -4.359 817 HD3 ARG 121 2HD ARG 121 -22.982 1.281 -4.764 818 HE ARG 121 HE ARG 121 -21.769 -0.652 -6.617 819 HH11 ARG 121 1HH1 ARG 121 -23.231 2.586 -6.300 820 HH12 ARG 121 2HH1 ARG 121 -23.280 2.853 -8.005 821 HH21 ARG 121 1HH2 ARG 121 -22.217 -0.403 -8.886 822 HH22 ARG 121 2HH2 ARG 121 -23.031 1.029 -9.452 823 H SER 122 H SER 122 -19.669 5.700 -3.317 824 HA SER 122 HA SER 122 -18.972 5.879 -6.092 825 HB2 SER 122 1HB SER 122 -20.014 7.602 -4.379 826 HB3 SER 122 2HB SER 122 -18.327 8.035 -4.062 827 HG SER 122 HG SER 122 -18.166 8.344 -6.422 828 H GLN 123 H GLN 123 -16.980 6.159 -3.081 829 HA GLN 123 HA GLN 123 -14.557 6.583 -4.473 830 HB2 GLN 123 1HB GLN 123 -13.582 6.586 -2.424 831 HB3 GLN 123 2HB GLN 123 -15.266 6.703 -1.893 832 HG2 GLN 123 1HG GLN 123 -15.256 4.195 -1.608 833 HG3 GLN 123 2HG GLN 123 -13.521 4.218 -1.804 834 HE21 GLN 123 1HE2 GLN 123 -15.900 4.321 0.400 835 HE22 GLN 123 2HE2 GLN 123 -14.989 5.134 1.727 836 H LYS 124 H LYS 124 -16.341 3.668 -4.010 837 HA LYS 124 HA LYS 124 -14.153 1.800 -4.516 838 HB2 LYS 124 1HB LYS 124 -17.130 1.299 -4.938 839 HB3 LYS 124 2HB LYS 124 -15.846 0.098 -4.818 840 HG2 LYS 124 1HG LYS 124 -15.401 0.782 -2.494 841 HG3 LYS 124 2HG LYS 124 -16.710 1.943 -2.568 842 HD2 LYS 124 1HD LYS 124 -18.352 0.186 -2.914 843 HD3 LYS 124 2HD LYS 124 -17.077 -1.018 -3.110 844 HE2 LYS 124 1HE LYS 124 -16.315 -0.700 -0.815 845 HE3 LYS 124 2HE LYS 124 -17.498 0.613 -0.571 846 HZ1 LYS 124 3HZ LYS 124 -18.053 -2.245 -1.037 847 HZ2 LYS 124 1HZ LYS 124 -19.233 -1.113 -1.109 848 HZ3 LYS 124 2HZ LYS 124 -18.442 -1.371 0.301 849 H ARG 125 H ARG 125 -15.630 4.040 -6.599 850 HA ARG 125 HA ARG 125 -14.830 2.473 -9.001 851 HB2 ARG 125 1HB ARG 125 -15.776 5.322 -8.500 852 HB3 ARG 125 2HB ARG 125 -14.773 4.952 -9.896 853 HG2 ARG 125 1HG ARG 125 -17.203 4.898 -10.358 854 HG3 ARG 125 2HG ARG 125 -16.313 3.436 -10.808 855 HD2 ARG 125 1HD ARG 125 -17.185 2.234 -8.906 856 HD3 ARG 125 2HD ARG 125 -17.909 3.701 -8.225 857 HE ARG 125 HE ARG 125 -19.124 3.614 -10.619 858 HH11 ARG 125 1HH1 ARG 125 -18.326 0.628 -8.833 859 HH12 ARG 125 2HH1 ARG 125 -19.768 -0.166 -9.352 860 HH21 ARG 125 1HH2 ARG 125 -21.004 2.582 -11.211 861 HH22 ARG 125 2HH2 ARG 125 -21.189 0.884 -10.905 862 H GLU 126 H GLU 126 -13.665 5.537 -7.539 863 HA GLU 126 HA GLU 126 -11.355 5.463 -8.874 864 HB2 GLU 126 1HB GLU 126 -12.007 6.722 -6.186 865 HB3 GLU 126 2HB GLU 126 -10.431 6.937 -6.943 866 HG2 GLU 126 1HG GLU 126 -11.771 8.738 -7.575 867 HG3 GLU 126 2HG GLU 126 -11.450 7.738 -8.996 868 H VAL 127 H VAL 127 -11.702 4.377 -5.595 869 HA VAL 127 HA VAL 127 -9.066 3.537 -4.995 870 HB VAL 127 HB VAL 127 -11.728 2.469 -4.012 871 HG11 VAL 127 1HG1 VAL 127 -10.028 0.735 -3.594 872 HG12 VAL 127 2HG1 VAL 127 -8.984 1.944 -2.821 873 HG13 VAL 127 3HG1 VAL 127 -10.562 1.521 -2.109 874 HG21 VAL 127 3HG2 VAL 127 -11.263 4.857 -3.442 875 HG22 VAL 127 1HG2 VAL 127 -11.197 3.836 -2.000 876 HG23 VAL 127 2HG2 VAL 127 -9.700 4.386 -2.769 877 H ASP 128 H ASP 128 -11.698 1.643 -6.531 878 HA ASP 128 HA ASP 128 -10.070 -0.764 -6.751 879 HB2 ASP 128 1HB ASP 128 -12.725 -0.252 -6.562 880 HB3 ASP 128 2HB ASP 128 -12.604 -0.390 -8.317 881 H ASP 129 H ASP 129 -10.886 2.012 -8.725 882 HA ASP 129 HA ASP 129 -9.885 1.281 -11.295 883 HB2 ASP 129 1HB ASP 129 -10.571 3.783 -9.838 884 HB3 ASP 129 2HB ASP 129 -9.237 3.942 -10.965 885 H TYR 130 H TYR 130 -8.281 2.892 -8.458 886 HA TYR 130 HA TYR 130 -5.719 3.118 -9.592 887 HB2 TYR 130 1HB TYR 130 -6.305 2.554 -6.688 888 HB3 TYR 130 2HB TYR 130 -4.864 3.295 -7.317 889 HD1 TYR 130 2HD TYR 130 -6.032 5.494 -9.087 890 HD2 TYR 130 1HD TYR 130 -7.036 4.101 -5.157 891 HE1 TYR 130 2HE TYR 130 -7.003 7.726 -8.556 892 HE2 TYR 130 1HE TYR 130 -8.105 6.290 -4.644 893 HH TYR 130 HH TYR 130 -8.030 9.048 -6.935 894 H VAL 131 H VAL 131 -7.276 0.278 -8.233 895 HA VAL 131 HA VAL 131 -4.839 -1.307 -8.038 896 HB VAL 131 HB VAL 131 -7.776 -2.152 -8.070 897 HG11 VAL 131 1HG1 VAL 131 -6.755 -4.146 -6.764 898 HG12 VAL 131 2HG1 VAL 131 -6.563 -4.120 -8.515 899 HG13 VAL 131 3HG1 VAL 131 -5.213 -3.631 -7.465 900 HG21 VAL 131 3HG2 VAL 131 -7.748 -2.124 -5.708 901 HG22 VAL 131 1HG2 VAL 131 -5.987 -1.929 -5.637 902 HG23 VAL 131 2HG2 VAL 131 -7.040 -0.592 -6.145 903 H ALA 132 H ALA 132 -7.064 -0.568 -10.671 904 HA ALA 132 HA ALA 132 -5.891 -2.720 -12.355 905 HB1 ALA 132 1HB ALA 132 -7.529 -2.054 -13.989 906 HB2 ALA 132 2HB ALA 132 -8.339 -2.322 -12.439 907 HB3 ALA 132 3HB ALA 132 -8.028 -0.657 -13.007 908 H GLY 133 H GLY 133 -5.568 0.667 -11.613 909 HA2 GLY 133 1HA GLY 133 -4.279 1.440 -14.074 910 HA3 GLY 133 2HA GLY 133 -4.508 2.399 -12.613 911 H LEU 134 H LEU 134 -2.924 -0.553 -11.910 912 HA LEU 134 HA LEU 134 -0.305 0.846 -11.741 913 HB2 LEU 134 1HB LEU 134 0.238 -0.667 -9.905 914 HB3 LEU 134 2HB LEU 134 -1.164 0.355 -9.624 915 HG LEU 134 HG LEU 134 -2.655 -1.597 -10.133 916 HD11 LEU 134 1HD1 LEU 134 -1.149 -3.153 -11.296 917 HD12 LEU 134 2HD1 LEU 134 -1.707 -3.877 -9.798 918 HD13 LEU 134 3HD1 LEU 134 -0.070 -3.202 -9.882 919 HD21 LEU 134 3HD2 LEU 134 -2.189 -0.806 -7.861 920 HD22 LEU 134 1HD2 LEU 134 -0.739 -1.833 -7.777 921 HD23 LEU 134 2HD2 LEU 134 -2.359 -2.563 -7.887 922 H ARG 135 H ARG 135 1.642 -0.613 -11.820 923 HA ARG 135 HA ARG 135 1.394 -2.675 -13.960 924 HB2 ARG 135 1HB ARG 135 3.901 -1.178 -13.093 925 HB3 ARG 135 2HB ARG 135 3.694 -2.244 -14.457 926 HG2 ARG 135 1HG ARG 135 2.141 -0.542 -15.503 927 HG3 ARG 135 2HG ARG 135 2.416 0.520 -14.106 928 HD2 ARG 135 1HD ARG 135 3.910 1.231 -15.898 929 HD3 ARG 135 2HD ARG 135 4.833 0.537 -14.574 930 HE ARG 135 HE ARG 135 5.558 -1.145 -15.891 931 HH11 ARG 135 1HH1 ARG 135 3.012 0.480 -17.796 932 HH12 ARG 135 2HH1 ARG 135 3.045 -0.765 -19.031 933 HH21 ARG 135 1HH2 ARG 135 5.596 -2.623 -17.465 934 HH22 ARG 135 2HH2 ARG 135 4.558 -2.559 -18.855 935 H THR 136 H THR 136 3.285 -4.308 -13.665 936 HA THR 136 HA THR 136 3.532 -5.055 -10.812 937 HB THR 136 HB THR 136 3.109 -7.401 -12.222 938 HG1 THR 136 1HG THR 136 0.903 -6.482 -13.230 939 HG21 THR 136 3HG2 THR 136 0.998 -5.649 -10.906 940 HG22 THR 136 1HG2 THR 136 2.064 -6.825 -10.104 941 HG23 THR 136 2HG2 THR 136 0.846 -7.391 -11.248 942 H GLU 137 H GLU 137 5.118 -4.324 -13.426 943 HA GLU 137 HA GLU 137 7.032 -4.499 -14.421 944 HB2 GLU 137 1HB GLU 137 8.165 -4.854 -12.153 945 HB3 GLU 137 2HB GLU 137 8.190 -6.578 -12.573 946 HG2 GLU 137 1HG GLU 137 9.303 -5.976 -14.752 947 HG3 GLU 137 2HG GLU 137 9.286 -4.278 -14.276 Start of MODEL 14 1 H1 GLY 19 H GLY 19 -12.345 -18.799 -0.219 2 HA2 GLY 19 1HA GLY 19 -13.452 -16.751 0.373 3 HA3 GLY 19 2HA GLY 19 -14.375 -18.111 1.053 4 H HIS 20 H HIS 20 -15.196 -17.087 2.901 5 HA HIS 20 HA HIS 20 -15.399 -15.841 4.680 6 HB2 HIS 20 1HB HIS 20 -12.879 -17.340 5.295 7 HB3 HIS 20 2HB HIS 20 -13.270 -15.999 6.344 8 HD1 HIS 20 1HD HIS 20 -14.214 -19.543 5.819 9 HD2 HIS 20 2HD HIS 20 -15.835 -16.037 7.501 10 HE1 HIS 20 1HE HIS 20 -16.106 -20.280 7.402 11 H MET 21 H MET 21 -14.361 -14.122 6.132 12 HA MET 21 HA MET 21 -13.774 -11.711 4.866 13 HB2 MET 21 1HB MET 21 -13.270 -12.884 7.611 14 HB3 MET 21 2HB MET 21 -12.523 -11.351 7.217 15 HG2 MET 21 1HG MET 21 -15.491 -11.955 7.178 16 HG3 MET 21 2HG MET 21 -14.621 -11.056 8.409 17 HE1 MET 21 3HE MET 21 -13.540 -7.809 6.255 18 HE2 MET 21 1HE MET 21 -13.211 -8.724 7.743 19 HE3 MET 21 2HE MET 21 -12.615 -9.319 6.169 20 H LYS 22 H LYS 22 -12.189 -11.544 3.332 21 HA LYS 22 HA LYS 22 -9.442 -11.725 4.184 22 HB2 LYS 22 1HB LYS 22 -10.343 -14.038 2.996 23 HB3 LYS 22 2HB LYS 22 -10.007 -13.081 1.557 24 HG2 LYS 22 1HG LYS 22 -7.714 -12.626 2.980 25 HG3 LYS 22 2HG LYS 22 -8.157 -14.193 3.639 26 HD2 LYS 22 1HD LYS 22 -7.579 -13.443 0.749 27 HD3 LYS 22 2HD LYS 22 -6.594 -14.435 1.829 28 HE2 LYS 22 1HE LYS 22 -8.291 -16.202 1.817 29 HE3 LYS 22 2HE LYS 22 -9.348 -15.236 0.774 30 HZ1 LYS 22 3HZ LYS 22 -7.876 -15.453 -1.001 31 HZ2 LYS 22 1HZ LYS 22 -7.825 -16.955 -0.320 32 HZ3 LYS 22 2HZ LYS 22 -6.607 -15.870 -0.062 33 H PHE 23 H PHE 23 -8.238 -11.061 1.796 34 HA PHE 23 HA PHE 23 -9.923 -9.264 0.250 35 HB2 PHE 23 1HB PHE 23 -8.246 -8.227 2.351 36 HB3 PHE 23 2HB PHE 23 -7.526 -7.793 0.818 37 HD1 PHE 23 2HD PHE 23 -8.795 -6.488 -0.872 38 HD2 PHE 23 1HD PHE 23 -10.318 -7.190 3.086 39 HE1 PHE 23 2HE PHE 23 -10.509 -4.763 -1.239 40 HE2 PHE 23 1HE PHE 23 -11.913 -5.289 2.787 41 HZ PHE 23 HZ PHE 23 -12.065 -4.124 0.595 42 H THR 24 H THR 24 -7.874 -8.198 -1.403 43 HA THR 24 HA THR 24 -6.266 -10.504 -2.276 44 HB THR 24 HB THR 24 -6.685 -9.005 -4.502 45 HG1 THR 24 1HG THR 24 -8.518 -8.135 -4.584 46 HG21 THR 24 3HG2 THR 24 -7.052 -11.480 -4.164 47 HG22 THR 24 1HG2 THR 24 -8.352 -10.744 -5.122 48 HG23 THR 24 2HG2 THR 24 -8.610 -11.119 -3.399 49 H ASP 25 H ASP 25 -4.126 -10.032 -2.765 50 HA ASP 25 HA ASP 25 -3.108 -7.993 -1.044 51 HB2 ASP 25 1HB ASP 25 -1.720 -9.786 -3.065 52 HB3 ASP 25 2HB ASP 25 -0.876 -8.767 -1.881 53 H GLN 26 H GLN 26 -3.246 -8.339 -4.556 54 HA GLN 26 HA GLN 26 -2.167 -5.925 -5.520 55 HB2 GLN 26 1HB GLN 26 -4.464 -7.762 -6.245 56 HB3 GLN 26 2HB GLN 26 -4.304 -6.278 -7.138 57 HG2 GLN 26 1HG GLN 26 -1.969 -8.204 -6.802 58 HG3 GLN 26 2HG GLN 26 -3.170 -8.441 -8.043 59 HE21 GLN 26 1HE2 GLN 26 -3.082 -5.108 -8.035 60 HE22 GLN 26 2HE2 GLN 26 -1.828 -4.942 -9.230 61 H GLN 27 H GLN 27 -5.460 -6.508 -4.205 62 HA GLN 27 HA GLN 27 -6.299 -3.785 -4.467 63 HB2 GLN 27 1HB GLN 27 -7.401 -6.194 -2.967 64 HB3 GLN 27 2HB GLN 27 -8.145 -4.625 -2.887 65 HG2 GLN 27 1HG GLN 27 -9.204 -6.213 -4.456 66 HG3 GLN 27 2HG GLN 27 -8.799 -4.643 -5.084 67 HE21 GLN 27 1HE2 GLN 27 -8.578 -4.860 -7.250 68 HE22 GLN 27 2HE2 GLN 27 -7.485 -5.964 -8.022 69 H ILE 28 H ILE 28 -4.877 -5.604 -1.616 70 HA ILE 28 HA ILE 28 -5.485 -3.579 0.231 71 HB ILE 28 HB ILE 28 -3.242 -5.602 0.279 72 HG12 ILE 28 1HG1 ILE 28 -6.184 -5.710 0.829 73 HG13 ILE 28 2HG1 ILE 28 -5.057 -6.941 0.309 74 HG21 ILE 28 1HG2 ILE 28 -2.744 -3.730 1.809 75 HG22 ILE 28 2HG2 ILE 28 -4.352 -3.884 2.542 76 HG23 ILE 28 3HG2 ILE 28 -3.124 -5.171 2.708 77 HD11 ILE 28 3HD1 ILE 28 -5.869 -7.631 2.396 78 HD12 ILE 28 1HD1 ILE 28 -4.212 -7.089 2.673 79 HD13 ILE 28 2HD1 ILE 28 -5.584 -6.042 3.130 80 H GLY 29 H GLY 29 -2.708 -3.742 -2.008 81 HA2 GLY 29 1HA GLY 29 -1.041 -1.914 -0.787 82 HA3 GLY 29 2HA GLY 29 -1.184 -2.061 -2.544 83 H VAL 30 H VAL 30 -3.707 -1.045 -3.025 84 HA VAL 30 HA VAL 30 -3.226 1.732 -2.940 85 HB VAL 30 HB VAL 30 -5.768 0.142 -3.510 86 HG11 VAL 30 1HG1 VAL 30 -5.123 3.039 -4.209 87 HG12 VAL 30 2HG1 VAL 30 -6.553 2.111 -4.720 88 HG13 VAL 30 3HG1 VAL 30 -6.344 2.516 -3.018 89 HG21 VAL 30 3HG2 VAL 30 -3.617 1.351 -5.332 90 HG22 VAL 30 1HG2 VAL 30 -3.914 -0.378 -5.056 91 HG23 VAL 30 2HG2 VAL 30 -5.119 0.598 -5.888 92 H LEU 31 H LEU 31 -5.311 -0.310 -0.902 93 HA LEU 31 HA LEU 31 -6.462 1.937 0.538 94 HB2 LEU 31 1HB LEU 31 -6.414 -1.048 1.182 95 HB3 LEU 31 2HB LEU 31 -7.387 0.157 2.033 96 HG LEU 31 HG LEU 31 -7.643 -0.599 -0.923 97 HD11 LEU 31 1HD1 LEU 31 -9.430 -1.881 -0.415 98 HD12 LEU 31 2HD1 LEU 31 -9.983 -0.853 0.886 99 HD13 LEU 31 3HD1 LEU 31 -8.654 -2.033 1.166 100 HD21 LEU 31 3HD2 LEU 31 -9.771 0.895 -0.661 101 HD22 LEU 31 1HD2 LEU 31 -8.207 1.710 -0.811 102 HD23 LEU 31 2HD2 LEU 31 -8.985 1.516 0.774 103 H ALA 32 H ALA 32 -3.748 -0.213 1.075 104 HA ALA 32 HA ALA 32 -3.042 0.714 3.711 105 HB1 ALA 32 1HB ALA 32 -0.800 -0.222 3.166 106 HB2 ALA 32 2HB ALA 32 -2.106 -1.361 2.775 107 HB3 ALA 32 3HB ALA 32 -1.299 -0.449 1.483 108 H GLY 33 H GLY 33 -1.971 1.728 0.401 109 HA2 GLY 33 1HA GLY 33 -0.331 3.902 1.171 110 HA3 GLY 33 2HA GLY 33 -1.220 3.763 -0.361 111 H LEU 34 H LEU 34 -3.918 3.729 0.786 112 HA LEU 34 HA LEU 34 -4.238 6.556 0.947 113 HB2 LEU 34 1HB LEU 34 -6.185 4.324 1.570 114 HB3 LEU 34 2HB LEU 34 -6.599 6.021 1.773 115 HG LEU 34 HG LEU 34 -5.786 4.749 -0.857 116 HD11 LEU 34 1HD1 LEU 34 -8.484 5.727 0.106 117 HD12 LEU 34 2HD1 LEU 34 -7.976 4.033 -0.161 118 HD13 LEU 34 3HD1 LEU 34 -8.104 5.148 -1.525 119 HD21 LEU 34 3HD2 LEU 34 -6.649 6.954 -1.790 120 HD22 LEU 34 1HD2 LEU 34 -5.076 7.023 -1.016 121 HD23 LEU 34 2HD2 LEU 34 -6.535 7.613 -0.153 122 H ALA 35 H ALA 35 -3.717 4.189 3.493 123 HA ALA 35 HA ALA 35 -4.241 6.111 5.648 124 HB1 ALA 35 1HB ALA 35 -4.541 3.683 6.058 125 HB2 ALA 35 2HB ALA 35 -2.838 3.398 5.662 126 HB3 ALA 35 3HB ALA 35 -3.270 4.349 7.092 127 H ILE 36 H ILE 36 -1.571 5.540 3.468 128 HA ILE 36 HA ILE 36 0.393 6.871 5.230 129 HB ILE 36 HB ILE 36 0.675 4.131 3.933 130 HG12 ILE 36 1HG1 ILE 36 -0.563 3.922 6.036 131 HG13 ILE 36 2HG1 ILE 36 1.012 3.181 6.131 132 HG21 ILE 36 1HG2 ILE 36 2.770 5.725 5.482 133 HG22 ILE 36 2HG2 ILE 36 2.904 4.029 4.954 134 HG23 ILE 36 3HG2 ILE 36 2.809 5.310 3.764 135 HD11 ILE 36 3HD1 ILE 36 1.882 5.018 7.486 136 HD12 ILE 36 1HD1 ILE 36 0.347 5.877 7.370 137 HD13 ILE 36 2HD1 ILE 36 0.428 4.315 8.206 138 H SER 37 H SER 37 0.352 8.608 3.855 139 HA SER 37 HA SER 37 0.721 9.954 2.163 140 HB2 SER 37 1HB SER 37 3.006 8.804 2.283 141 HB3 SER 37 2HB SER 37 2.539 8.016 0.757 142 HG SER 37 HG SER 37 3.634 10.202 0.665 143 HA PRO 38 HA PRO 38 -2.541 7.876 -0.424 144 HB2 PRO 38 1HB PRO 38 -4.318 10.006 -0.200 145 HB3 PRO 38 2HB PRO 38 -4.310 8.613 0.903 146 HG2 PRO 38 1HG PRO 38 -3.072 11.311 1.307 147 HG3 PRO 38 2HG PRO 38 -4.003 10.329 2.481 148 HD2 PRO 38 1HD PRO 38 -1.295 10.420 2.506 149 HD3 PRO 38 2HD PRO 38 -2.159 8.893 2.869 150 H GLU 39 H GLU 39 -1.410 11.261 -0.084 151 HA GLU 39 HA GLU 39 -1.762 12.209 -2.661 152 HB2 GLU 39 1HB GLU 39 -0.101 12.855 -0.280 153 HB3 GLU 39 2HB GLU 39 0.682 13.261 -1.803 154 HG2 GLU 39 1HG GLU 39 -0.391 15.185 -1.599 155 HG3 GLU 39 2HG GLU 39 -1.710 14.306 -2.354 156 H TRP 40 H TRP 40 1.235 10.578 -1.394 157 HA TRP 40 HA TRP 40 2.641 10.630 -3.810 158 HB2 TRP 40 1HB TRP 40 3.723 10.000 -1.774 159 HB3 TRP 40 2HB TRP 40 2.643 8.624 -1.549 160 HD1 TRP 40 HD TRP 40 5.556 9.735 -3.817 161 HE1 TRP 40 1HE TRP 40 6.826 7.695 -4.598 162 HE3 TRP 40 3HE TRP 40 2.297 6.169 -2.141 163 HZ2 TRP 40 2HZ TRP 40 6.527 4.768 -4.396 164 HZ3 TRP 40 3HZ TRP 40 2.771 3.762 -2.541 165 HH2 TRP 40 HH TRP 40 4.907 3.058 -3.603 166 H LEU 41 H LEU 41 0.439 7.996 -2.625 167 HA LEU 41 HA LEU 41 0.820 6.396 -4.939 168 HB2 LEU 41 1HB LEU 41 -0.109 5.525 -2.875 169 HB3 LEU 41 2HB LEU 41 -1.566 6.483 -3.056 170 HG LEU 41 HG LEU 41 -0.783 4.737 -5.374 171 HD11 LEU 41 1HD1 LEU 41 -0.225 3.273 -3.539 172 HD12 LEU 41 2HD1 LEU 41 -1.653 2.674 -4.383 173 HD13 LEU 41 3HD1 LEU 41 -1.823 3.499 -2.813 174 HD21 LEU 41 3HD2 LEU 41 -2.956 5.990 -5.471 175 HD22 LEU 41 1HD2 LEU 41 -3.533 5.032 -4.106 176 HD23 LEU 41 2HD2 LEU 41 -3.136 4.239 -5.619 177 H LYS 42 H LYS 42 -1.736 8.856 -4.245 178 HA LYS 42 HA LYS 42 -3.189 8.559 -6.660 179 HB2 LYS 42 1HB LYS 42 -2.676 11.012 -4.922 180 HB3 LYS 42 2HB LYS 42 -3.838 10.988 -6.249 181 HG2 LYS 42 1HG LYS 42 -5.233 9.400 -5.187 182 HG3 LYS 42 2HG LYS 42 -3.981 8.918 -4.046 183 HD2 LYS 42 1HD LYS 42 -4.081 11.088 -2.920 184 HD3 LYS 42 2HD LYS 42 -5.361 11.628 -4.016 185 HE2 LYS 42 1HE LYS 42 -5.705 8.971 -2.629 186 HE3 LYS 42 2HE LYS 42 -5.847 10.419 -1.604 187 HZ1 LYS 42 3HZ LYS 42 -7.338 10.437 -4.078 188 HZ2 LYS 42 1HZ LYS 42 -7.797 10.950 -2.560 189 HZ3 LYS 42 2HZ LYS 42 -7.850 9.358 -3.000 190 H GLN 43 H GLN 43 -0.268 10.523 -5.947 191 HA GLN 43 HA GLN 43 -0.306 11.892 -8.491 192 HB2 GLN 43 1HB GLN 43 1.721 11.604 -6.238 193 HB3 GLN 43 2HB GLN 43 1.970 12.649 -7.640 194 HG2 GLN 43 1HG GLN 43 0.113 14.053 -7.102 195 HG3 GLN 43 2HG GLN 43 -0.574 12.927 -5.977 196 HE21 GLN 43 1HE2 GLN 43 2.425 12.721 -4.823 197 HE22 GLN 43 2HE2 GLN 43 2.380 14.021 -3.651 198 H ASN 44 H ASN 44 1.338 9.001 -7.156 199 HA ASN 44 HA ASN 44 2.943 8.487 -9.457 200 HB2 ASN 44 1HB ASN 44 1.885 6.634 -7.275 201 HB3 ASN 44 2HB ASN 44 2.827 6.067 -8.648 202 HD21 ASN 44 1HD2 ASN 44 3.413 9.062 -6.717 203 HD22 ASN 44 2HD2 ASN 44 4.929 8.491 -6.114 204 H ILE 45 H ILE 45 -0.320 7.260 -8.533 205 HA ILE 45 HA ILE 45 -0.692 5.563 -10.783 206 HB ILE 45 HB ILE 45 -2.596 7.001 -8.905 207 HG12 ILE 45 1HG1 ILE 45 -1.262 5.157 -7.921 208 HG13 ILE 45 2HG1 ILE 45 -2.979 4.866 -7.912 209 HG21 ILE 45 1HG2 ILE 45 -3.963 6.755 -10.843 210 HG22 ILE 45 2HG2 ILE 45 -3.353 5.128 -11.172 211 HG23 ILE 45 3HG2 ILE 45 -4.380 5.430 -9.761 212 HD11 ILE 45 3HD1 ILE 45 -2.643 3.356 -9.934 213 HD12 ILE 45 1HD1 ILE 45 -0.895 3.593 -9.722 214 HD13 ILE 45 2HD1 ILE 45 -1.854 2.817 -8.450 215 H ALA 46 H ALA 46 -1.231 9.092 -10.397 216 HA ALA 46 HA ALA 46 -2.813 9.568 -12.623 217 HB1 ALA 46 1HB ALA 46 -1.880 11.832 -12.579 218 HB2 ALA 46 2HB ALA 46 -2.096 11.257 -10.920 219 HB3 ALA 46 3HB ALA 46 -0.482 11.276 -11.669 220 H ALA 47 H ALA 47 0.693 9.061 -12.508 221 HA ALA 47 HA ALA 47 0.943 9.138 -15.463 222 HB1 ALA 47 1HB ALA 47 2.849 9.411 -13.131 223 HB2 ALA 47 2HB ALA 47 3.433 9.123 -14.779 224 HB3 ALA 47 3HB ALA 47 2.474 10.567 -14.404 225 H ASN 48 H ASN 48 0.025 6.735 -13.433 226 HA ASN 48 HA ASN 48 0.298 4.538 -13.167 227 HB2 ASN 48 1HB ASN 48 -0.295 4.770 -15.640 228 HB3 ASN 48 2HB ASN 48 1.375 4.350 -15.985 229 HD21 ASN 48 1HD2 ASN 48 1.879 2.084 -14.354 230 HD22 ASN 48 2HD2 ASN 48 0.793 0.836 -14.952 231 H GLN 49 H GLN 49 2.659 6.292 -12.521 232 HA GLN 49 HA GLN 49 5.069 4.650 -13.088 233 HB2 GLN 49 1HB GLN 49 6.310 6.340 -12.072 234 HB3 GLN 49 2HB GLN 49 5.330 7.000 -13.339 235 HG2 GLN 49 1HG GLN 49 3.884 8.139 -11.821 236 HG3 GLN 49 2HG GLN 49 4.280 7.061 -10.489 237 HE21 GLN 49 1HE2 GLN 49 6.601 6.991 -9.876 238 HE22 GLN 49 2HE2 GLN 49 7.535 8.494 -9.866 239 H LEU 50 H LEU 50 2.718 3.916 -11.194 240 HA LEU 50 HA LEU 50 4.197 3.524 -8.646 241 HB2 LEU 50 1HB LEU 50 1.702 4.255 -8.599 242 HB3 LEU 50 2HB LEU 50 1.346 2.738 -9.388 243 HG LEU 50 HG LEU 50 2.408 1.539 -7.378 244 HD11 LEU 50 1HD1 LEU 50 2.455 4.383 -6.236 245 HD12 LEU 50 2HD1 LEU 50 3.862 3.341 -6.515 246 HD13 LEU 50 3HD1 LEU 50 2.677 2.900 -5.294 247 HD21 LEU 50 3HD2 LEU 50 0.078 3.405 -6.852 248 HD22 LEU 50 1HD2 LEU 50 0.539 2.030 -5.811 249 HD23 LEU 50 2HD2 LEU 50 0.014 1.748 -7.465 250 H VAL 51 H VAL 51 4.813 1.372 -8.144 251 HA VAL 51 HA VAL 51 3.859 -0.802 -9.893 252 HB VAL 51 HB VAL 51 6.312 0.016 -10.305 253 HG11 VAL 51 1HG1 VAL 51 6.986 -1.573 -7.974 254 HG12 VAL 51 2HG1 VAL 51 8.013 -1.050 -9.330 255 HG13 VAL 51 3HG1 VAL 51 7.231 0.197 -8.317 256 HG21 VAL 51 3HG2 VAL 51 6.883 -2.172 -11.065 257 HG22 VAL 51 1HG2 VAL 51 6.239 -2.944 -9.614 258 HG23 VAL 51 2HG2 VAL 51 5.159 -2.376 -10.818 259 H TYR 52 H TYR 52 4.209 -2.895 -8.815 260 HA TYR 52 HA TYR 52 3.897 -2.926 -5.908 261 HB2 TYR 52 1HB TYR 52 1.626 -2.872 -6.654 262 HB3 TYR 52 2HB TYR 52 1.992 -3.789 -8.098 263 HD1 TYR 52 2HD TYR 52 1.616 -4.185 -4.385 264 HD2 TYR 52 1HD TYR 52 1.680 -6.080 -8.265 265 HE1 TYR 52 2HE TYR 52 0.671 -6.300 -3.415 266 HE2 TYR 52 1HE TYR 52 0.868 -8.159 -7.288 267 HH TYR 52 HH TYR 52 0.278 -9.239 -5.354 268 H GLY 53 H GLY 53 4.499 -5.201 -5.166 269 HA2 GLY 53 1HA GLY 53 5.213 -7.265 -6.933 270 HA3 GLY 53 2HA GLY 53 6.678 -6.306 -6.618 271 H ILE 54 H ILE 54 6.883 -8.790 -5.804 272 HA ILE 54 HA ILE 54 6.497 -8.860 -2.806 273 HB ILE 54 HB ILE 54 6.743 -11.151 -4.813 274 HG12 ILE 54 1HG1 ILE 54 4.557 -10.136 -5.193 275 HG13 ILE 54 2HG1 ILE 54 4.390 -11.695 -4.422 276 HG21 ILE 54 1HG2 ILE 54 6.089 -12.568 -2.883 277 HG22 ILE 54 2HG2 ILE 54 7.602 -11.699 -2.597 278 HG23 ILE 54 3HG2 ILE 54 6.106 -11.151 -1.818 279 HD11 ILE 54 3HD1 ILE 54 3.965 -10.580 -2.224 280 HD12 ILE 54 1HD1 ILE 54 4.123 -9.004 -3.026 281 HD13 ILE 54 2HD1 ILE 54 2.816 -10.090 -3.484 282 H VAL 55 H VAL 55 7.894 -8.873 -1.764 283 HA VAL 55 HA VAL 55 10.528 -8.308 -1.933 284 HB VAL 55 HB VAL 55 10.184 -9.629 0.416 285 HG11 VAL 55 1HG1 VAL 55 10.362 -7.272 0.521 286 HG12 VAL 55 2HG1 VAL 55 8.856 -7.048 -0.416 287 HG13 VAL 55 3HG1 VAL 55 8.819 -7.645 1.252 288 HG21 VAL 55 3HG2 VAL 55 7.320 -9.402 -0.196 289 HG22 VAL 55 1HG2 VAL 55 8.264 -10.907 -0.134 290 HG23 VAL 55 2HG2 VAL 55 8.216 -9.858 1.273 291 H LYS 56 H LYS 56 9.643 -11.581 -0.777 292 HA LYS 56 HA LYS 56 10.607 -13.565 -0.969 293 HB2 LYS 56 1HB LYS 56 11.169 -12.589 -3.792 294 HB3 LYS 56 2HB LYS 56 11.577 -14.192 -3.266 295 HG2 LYS 56 1HG LYS 56 8.830 -13.631 -2.459 296 HG3 LYS 56 2HG LYS 56 9.034 -13.174 -4.159 297 HD2 LYS 56 1HD LYS 56 10.050 -15.394 -4.582 298 HD3 LYS 56 2HD LYS 56 9.765 -15.837 -2.880 299 HE2 LYS 56 1HE LYS 56 7.298 -15.300 -3.330 300 HE3 LYS 56 2HE LYS 56 7.724 -15.224 -5.055 301 HZ1 LYS 56 3HZ LYS 56 6.947 -17.381 -4.422 302 HZ2 LYS 56 1HZ LYS 56 8.077 -17.529 -3.247 303 HZ3 LYS 56 2HZ LYS 56 8.523 -17.505 -4.859 304 HA PRO 57 HA PRO 57 14.951 -13.283 -0.043 305 HB2 PRO 57 1HB PRO 57 15.510 -15.843 -1.459 306 HB3 PRO 57 2HB PRO 57 15.760 -15.425 0.256 307 HG2 PRO 57 1HG PRO 57 13.721 -17.061 -0.674 308 HG3 PRO 57 2HG PRO 57 13.635 -16.104 0.840 309 HD2 PRO 57 1HD PRO 57 12.337 -15.626 -1.795 310 HD3 PRO 57 2HD PRO 57 11.816 -15.158 -0.156 311 H SER 58 H SER 58 13.848 -13.145 -3.296 312 HA SER 58 HA SER 58 16.500 -13.522 -4.511 313 HB2 SER 58 1HB SER 58 13.670 -13.298 -5.587 314 HB3 SER 58 2HB SER 58 15.082 -13.181 -6.647 315 HG SER 58 HG SER 58 14.513 -15.349 -4.870 316 H ASP 59 H ASP 59 14.106 -10.777 -4.270 317 HA ASP 59 HA ASP 59 16.031 -9.094 -5.768 318 HB2 ASP 59 1HB ASP 59 13.146 -8.827 -5.052 319 HB3 ASP 59 2HB ASP 59 14.105 -7.374 -4.880 320 H THR 60 H THR 60 16.481 -6.909 -4.702 321 HA THR 60 HA THR 60 17.584 -7.371 -2.025 322 HB THR 60 HB THR 60 17.515 -4.776 -3.609 323 HG1 THR 60 1HG THR 60 18.499 -6.615 -4.706 324 HG21 THR 60 3HG2 THR 60 19.436 -4.185 -2.211 325 HG22 THR 60 1HG2 THR 60 19.389 -5.792 -1.426 326 HG23 THR 60 2HG2 THR 60 18.082 -4.630 -1.177 327 H VAL 61 H VAL 61 16.078 -7.398 -0.395 328 HA VAL 61 HA VAL 61 14.640 -4.880 0.071 329 HB VAL 61 HB VAL 61 12.818 -6.298 1.203 330 HG11 VAL 61 1HG1 VAL 61 11.654 -6.563 -1.037 331 HG12 VAL 61 2HG1 VAL 61 12.318 -4.963 -0.648 332 HG13 VAL 61 3HG1 VAL 61 13.144 -6.027 -1.779 333 HG21 VAL 61 3HG2 VAL 61 13.866 -8.449 1.314 334 HG22 VAL 61 1HG2 VAL 61 12.382 -8.540 0.349 335 HG23 VAL 61 2HG2 VAL 61 13.970 -8.555 -0.444 336 HA PRO 62 HA PRO 62 16.712 -5.158 3.856 337 HB2 PRO 62 1HB PRO 62 15.041 -4.017 5.727 338 HB3 PRO 62 2HB PRO 62 15.851 -3.105 4.419 339 HG2 PRO 62 1HG PRO 62 13.025 -4.148 4.520 340 HG3 PRO 62 2HG PRO 62 13.606 -2.546 3.955 341 HD2 PRO 62 1HD PRO 62 13.009 -4.599 2.273 342 HD3 PRO 62 2HD PRO 62 14.259 -3.418 1.880 343 H ALA 63 H ALA 63 16.859 -6.111 5.965 344 HA ALA 63 HA ALA 63 15.682 -8.630 6.405 345 HB1 ALA 63 1HB ALA 63 16.857 -6.641 8.414 346 HB2 ALA 63 2HB ALA 63 16.664 -8.386 8.662 347 HB3 ALA 63 3HB ALA 63 17.789 -7.796 7.436 348 H GLY 64 H GLY 64 13.577 -9.148 6.969 349 HA2 GLY 64 1HA GLY 64 11.912 -9.119 8.615 350 HA3 GLY 64 2HA GLY 64 12.134 -7.393 8.862 351 H VAL 65 H VAL 65 11.852 -8.829 5.601 352 HA VAL 65 HA VAL 65 9.002 -8.386 5.429 353 HB VAL 65 HB VAL 65 9.259 -7.080 3.271 354 HG11 VAL 65 1HG1 VAL 65 9.041 -4.952 4.334 355 HG12 VAL 65 2HG1 VAL 65 8.288 -6.172 5.372 356 HG13 VAL 65 3HG1 VAL 65 9.883 -5.513 5.788 357 HG21 VAL 65 3HG2 VAL 65 11.763 -7.173 3.092 358 HG22 VAL 65 1HG2 VAL 65 11.091 -5.536 3.024 359 HG23 VAL 65 2HG2 VAL 65 11.868 -6.124 4.509 360 H ASP 66 H ASP 66 9.271 -10.621 5.422 361 HA ASP 66 HA ASP 66 10.679 -12.002 3.297 362 HB2 ASP 66 1HB ASP 66 10.053 -13.997 4.475 363 HB3 ASP 66 2HB ASP 66 10.476 -12.808 5.719 364 H ASP 67 H ASP 67 7.727 -10.847 3.425 365 HA ASP 67 HA ASP 67 6.678 -12.054 1.030 366 HB2 ASP 67 1HB ASP 67 6.284 -13.934 2.692 367 HB3 ASP 67 2HB ASP 67 5.183 -12.854 3.546 368 H TYR 68 H TYR 68 7.050 -9.444 2.541 369 HA TYR 68 HA TYR 68 4.337 -8.313 2.830 370 HB2 TYR 68 1HB TYR 68 7.139 -7.285 3.313 371 HB3 TYR 68 2HB TYR 68 5.796 -6.195 3.088 372 HD1 TYR 68 1HD TYR 68 6.428 -9.303 5.207 373 HD2 TYR 68 2HD TYR 68 4.818 -5.306 4.944 374 HE1 TYR 68 1HE TYR 68 5.823 -9.413 7.560 375 HE2 TYR 68 2HE TYR 68 4.139 -5.433 7.303 376 HH TYR 68 HH TYR 68 4.707 -8.351 9.321 377 H SER 69 H SER 69 3.345 -7.881 0.869 378 HA SER 69 HA SER 69 4.559 -7.429 -1.604 379 HB2 SER 69 1HB SER 69 2.084 -6.072 -0.518 380 HB3 SER 69 2HB SER 69 2.357 -6.730 -2.142 381 HG SER 69 HG SER 69 1.912 -8.756 -1.385 382 H TYR 70 H TYR 70 5.370 -5.462 -2.558 383 HA TYR 70 HA TYR 70 5.463 -3.086 -0.764 384 HB2 TYR 70 1HB TYR 70 7.536 -2.396 -1.746 385 HB3 TYR 70 2HB TYR 70 7.721 -3.960 -1.036 386 HD1 TYR 70 2HD TYR 70 7.373 -2.157 -4.277 387 HD2 TYR 70 1HD TYR 70 8.372 -5.860 -2.335 388 HE1 TYR 70 2HE TYR 70 8.307 -2.973 -6.409 389 HE2 TYR 70 1HE TYR 70 9.396 -6.704 -4.432 390 HH TYR 70 HH TYR 70 9.188 -4.884 -7.463 391 H LEU 71 H LEU 71 5.775 -1.062 -1.993 392 HA LEU 71 HA LEU 71 4.559 -0.983 -4.650 393 HB2 LEU 71 1HB LEU 71 3.921 0.964 -2.385 394 HB3 LEU 71 2HB LEU 71 3.360 1.102 -4.049 395 HG LEU 71 HG LEU 71 2.599 -1.142 -2.140 396 HD11 LEU 71 1HD1 LEU 71 0.462 -0.022 -1.927 397 HD12 LEU 71 2HD1 LEU 71 0.993 1.289 -2.994 398 HD13 LEU 71 3HD1 LEU 71 1.754 1.059 -1.400 399 HD21 LEU 71 3HD2 LEU 71 2.445 -1.793 -4.534 400 HD22 LEU 71 1HD2 LEU 71 1.470 -0.360 -4.871 401 HD23 LEU 71 2HD2 LEU 71 0.845 -1.645 -3.810 402 H VAL 72 H VAL 72 5.904 0.496 -5.999 403 HA VAL 72 HA VAL 72 7.451 2.454 -4.491 404 HB VAL 72 HB VAL 72 8.858 0.562 -4.346 405 HG11 VAL 72 1HG1 VAL 72 8.110 -0.795 -6.176 406 HG12 VAL 72 2HG1 VAL 72 9.156 0.176 -7.270 407 HG13 VAL 72 3HG1 VAL 72 9.852 -0.734 -5.925 408 HG21 VAL 72 3HG2 VAL 72 9.945 2.820 -4.918 409 HG22 VAL 72 1HG2 VAL 72 10.929 1.405 -5.342 410 HG23 VAL 72 2HG2 VAL 72 10.017 2.240 -6.609 411 H ALA 73 H ALA 73 8.544 3.972 -6.056 412 HA ALA 73 HA ALA 73 6.681 4.590 -8.249 413 HB1 ALA 73 1HB ALA 73 8.127 6.629 -8.387 414 HB2 ALA 73 2HB ALA 73 7.343 6.443 -6.807 415 HB3 ALA 73 3HB ALA 73 9.054 6.036 -6.999 416 H ALA 74 H ALA 74 7.232 3.838 -10.325 417 HA ALA 74 HA ALA 74 9.700 2.381 -10.746 418 HB1 ALA 74 1HB ALA 74 7.642 3.424 -12.745 419 HB2 ALA 74 2HB ALA 74 8.914 2.235 -13.088 420 HB3 ALA 74 3HB ALA 74 7.618 1.824 -11.956 421 H ASP 75 H ASP 75 8.617 5.573 -11.209 422 HA ASP 75 HA ASP 75 11.072 6.363 -12.661 423 HB2 ASP 75 1HB ASP 75 8.288 7.213 -12.745 424 HB3 ASP 75 2HB ASP 75 9.184 8.578 -12.129 425 H ASP 76 H ASP 76 10.095 6.259 -9.487 426 HA ASP 76 HA ASP 76 12.366 7.987 -8.780 427 HB2 ASP 76 1HB ASP 76 10.453 8.172 -6.642 428 HB3 ASP 76 2HB ASP 76 11.283 9.410 -7.526 429 H GLN 77 H GLN 77 12.670 5.438 -9.386 430 HA GLN 77 HA GLN 77 12.226 3.454 -7.498 431 HB2 GLN 77 1HB GLN 77 14.793 3.983 -9.032 432 HB3 GLN 77 2HB GLN 77 14.669 2.667 -7.873 433 HG2 GLN 77 1HG GLN 77 12.654 1.819 -9.154 434 HG3 GLN 77 2HG GLN 77 13.080 2.971 -10.429 435 HE21 GLN 77 1HE2 GLN 77 13.047 0.251 -11.092 436 HE22 GLN 77 2HE2 GLN 77 14.698 -0.263 -11.343 437 H ASP 78 H ASP 78 14.816 5.888 -7.139 438 HA ASP 78 HA ASP 78 15.549 4.929 -4.442 439 HB2 ASP 78 1HB ASP 78 16.638 6.944 -6.424 440 HB3 ASP 78 2HB ASP 78 17.061 7.089 -4.723 441 H GLY 79 H GLY 79 12.904 6.620 -5.392 442 HA2 GLY 79 1HA GLY 79 13.184 9.097 -3.942 443 HA3 GLY 79 2HA GLY 79 11.807 8.552 -4.893 444 H THR 80 H THR 80 10.493 6.668 -3.805 445 HA THR 80 HA THR 80 10.390 6.845 -0.858 446 HB THR 80 HB THR 80 7.841 7.119 -2.443 447 HG1 THR 80 1HG THR 80 8.729 8.934 -3.126 448 HG21 THR 80 3HG2 THR 80 7.618 6.641 -0.041 449 HG22 THR 80 1HG2 THR 80 7.065 8.283 -0.395 450 HG23 THR 80 2HG2 THR 80 8.655 8.033 0.352 451 H ILE 81 H ILE 81 9.052 4.936 0.057 452 HA ILE 81 HA ILE 81 8.066 3.002 -1.888 453 HB ILE 81 HB ILE 81 10.687 2.716 -1.511 454 HG12 ILE 81 1HG1 ILE 81 8.703 0.403 -1.325 455 HG13 ILE 81 2HG1 ILE 81 9.336 1.297 -2.643 456 HG21 ILE 81 1HG2 ILE 81 11.447 1.474 0.366 457 HG22 ILE 81 2HG2 ILE 81 10.607 2.895 0.991 458 HG23 ILE 81 3HG2 ILE 81 9.806 1.290 1.017 459 HD11 ILE 81 3HD1 ILE 81 11.011 -0.495 -0.889 460 HD12 ILE 81 1HD1 ILE 81 10.436 -0.862 -2.525 461 HD13 ILE 81 2HD1 ILE 81 11.603 0.451 -2.282 462 H ILE 82 H ILE 82 6.778 1.335 -0.839 463 HA ILE 82 HA ILE 82 6.334 1.575 2.069 464 HB ILE 82 HB ILE 82 4.121 1.640 -0.028 465 HG12 ILE 82 1HG1 ILE 82 4.988 3.827 1.921 466 HG13 ILE 82 2HG1 ILE 82 5.271 3.832 0.177 467 HG21 ILE 82 1HG2 ILE 82 2.572 1.918 1.930 468 HG22 ILE 82 2HG2 ILE 82 3.370 0.366 1.912 469 HG23 ILE 82 3HG2 ILE 82 3.928 1.626 3.031 470 HD11 ILE 82 3HD1 ILE 82 2.606 4.132 1.519 471 HD12 ILE 82 1HD1 ILE 82 3.472 5.244 0.445 472 HD13 ILE 82 2HD1 ILE 82 2.822 3.739 -0.212 473 H PHE 83 H PHE 83 5.609 -0.454 2.965 474 HA PHE 83 HA PHE 83 5.332 -2.762 1.156 475 HB2 PHE 83 1HB PHE 83 6.836 -2.669 3.795 476 HB3 PHE 83 2HB PHE 83 6.427 -4.108 2.940 477 HD1 PHE 83 1HD PHE 83 8.420 -0.922 2.564 478 HD2 PHE 83 2HD PHE 83 7.938 -5.047 1.385 479 HE1 PHE 83 1HE PHE 83 10.664 -0.896 1.523 480 HE2 PHE 83 2HE PHE 83 10.158 -4.982 0.316 481 HZ PHE 83 HZ PHE 83 11.541 -2.919 0.398 482 H PHE 84 H PHE 84 3.791 -4.349 2.024 483 HA PHE 84 HA PHE 84 2.482 -3.765 4.548 484 HB2 PHE 84 1HB PHE 84 0.236 -3.685 3.595 485 HB3 PHE 84 2HB PHE 84 1.200 -2.348 3.002 486 HD1 PHE 84 2HD PHE 84 1.999 -2.309 0.616 487 HD2 PHE 84 1HD PHE 84 -0.546 -5.474 2.101 488 HE1 PHE 84 2HE PHE 84 1.446 -2.981 -1.708 489 HE2 PHE 84 1HE PHE 84 -1.103 -6.099 -0.228 490 HZ PHE 84 HZ PHE 84 -0.177 -4.805 -2.122 491 H LYS 85 H LYS 85 1.162 -5.626 5.247 492 HA LYS 85 HA LYS 85 1.127 -8.073 3.583 493 HB2 LYS 85 1HB LYS 85 3.320 -8.041 4.695 494 HB3 LYS 85 2HB LYS 85 2.517 -7.965 6.247 495 HG2 LYS 85 1HG LYS 85 1.347 -10.188 4.837 496 HG3 LYS 85 2HG LYS 85 3.076 -10.263 4.478 497 HD2 LYS 85 1HD LYS 85 3.646 -10.240 6.813 498 HD3 LYS 85 2HD LYS 85 1.981 -9.797 7.245 499 HE2 LYS 85 1HE LYS 85 1.169 -11.997 6.727 500 HE3 LYS 85 2HE LYS 85 2.668 -12.423 5.889 501 HZ1 LYS 85 3HZ LYS 85 3.834 -12.366 7.940 502 HZ2 LYS 85 1HZ LYS 85 2.578 -13.391 8.104 503 HZ3 LYS 85 2HZ LYS 85 2.481 -11.933 8.819 504 H ALA 86 H ALA 86 -0.858 -8.952 3.896 505 HA ALA 86 HA ALA 86 -2.574 -8.240 6.148 506 HB1 ALA 86 1HB ALA 86 -3.975 -10.134 5.236 507 HB2 ALA 86 2HB ALA 86 -3.621 -8.856 4.059 508 HB3 ALA 86 3HB ALA 86 -2.727 -10.400 4.007 509 H GLU 87 H GLU 87 -3.220 -9.703 7.823 510 HA GLU 87 HA GLU 87 -1.485 -12.096 8.274 511 HB2 GLU 87 1HB GLU 87 -2.191 -9.922 10.292 512 HB3 GLU 87 2HB GLU 87 -1.444 -11.482 10.679 513 HG2 GLU 87 1HG GLU 87 0.412 -10.877 9.031 514 HG3 GLU 87 2HG GLU 87 -0.239 -9.226 9.051 515 H GLY 88 H GLY 88 -4.672 -11.058 7.909 516 HA2 GLY 88 1HA GLY 88 -6.370 -12.782 8.073 517 HA3 GLY 88 2HA GLY 88 -5.703 -13.298 9.610 518 H GLN 89 H GLN 89 -7.280 -10.632 7.979 519 HA GLN 89 HA GLN 89 -8.845 -9.158 8.539 520 HB2 GLN 89 1HB GLN 89 -8.971 -10.211 11.367 521 HB3 GLN 89 2HB GLN 89 -10.013 -9.027 10.597 522 HG2 GLN 89 1HG GLN 89 -10.439 -10.929 8.802 523 HG3 GLN 89 2HG GLN 89 -9.877 -12.000 10.087 524 HE21 GLN 89 1HE2 GLN 89 -12.112 -9.290 9.438 525 HE22 GLN 89 2HE2 GLN 89 -13.280 -9.766 10.692 526 H THR 90 H THR 90 -5.787 -9.009 9.209 527 HA THR 90 HA THR 90 -5.920 -6.187 9.899 528 HB THR 90 HB THR 90 -4.227 -8.199 11.456 529 HG1 THR 90 1HG THR 90 -5.547 -7.705 13.137 530 HG21 THR 90 3HG2 THR 90 -2.947 -6.102 11.233 531 HG22 THR 90 1HG2 THR 90 -3.553 -6.290 12.872 532 HG23 THR 90 2HG2 THR 90 -4.364 -5.165 11.775 533 H VAL 91 H VAL 91 -3.877 -5.081 9.255 534 HA VAL 91 HA VAL 91 -2.122 -6.587 7.456 535 HB VAL 91 HB VAL 91 -3.493 -3.922 6.864 536 HG11 VAL 91 1HG1 VAL 91 -2.300 -3.869 4.722 537 HG12 VAL 91 2HG1 VAL 91 -1.171 -3.809 6.068 538 HG13 VAL 91 3HG1 VAL 91 -1.391 -5.328 5.165 539 HG21 VAL 91 3HG2 VAL 91 -3.610 -6.497 5.223 540 HG22 VAL 91 1HG2 VAL 91 -4.899 -5.946 6.314 541 HG23 VAL 91 2HG2 VAL 91 -4.470 -4.973 4.918 542 H ILE 92 H ILE 92 -0.009 -5.946 7.720 543 HA ILE 92 HA ILE 92 0.592 -3.789 9.683 544 HB ILE 92 HB ILE 92 2.403 -5.972 8.592 545 HG12 ILE 92 1HG1 ILE 92 0.707 -7.183 9.735 546 HG13 ILE 92 2HG1 ILE 92 2.154 -7.175 10.712 547 HG21 ILE 92 1HG2 ILE 92 2.651 -4.118 11.018 548 HG22 ILE 92 2HG2 ILE 92 3.795 -5.405 10.581 549 HG23 ILE 92 3HG2 ILE 92 3.579 -4.014 9.509 550 HD11 ILE 92 3HD1 ILE 92 0.150 -6.901 12.074 551 HD12 ILE 92 1HD1 ILE 92 1.164 -5.462 12.202 552 HD13 ILE 92 2HD1 ILE 92 -0.312 -5.446 11.189 553 H ILE 93 H ILE 93 1.035 -1.848 8.633 554 HA ILE 93 HA ILE 93 2.171 -1.987 5.900 555 HB ILE 93 HB ILE 93 1.329 0.561 7.292 556 HG12 ILE 93 1HG1 ILE 93 -0.468 -1.199 5.552 557 HG13 ILE 93 2HG1 ILE 93 -0.661 -0.974 7.292 558 HG21 ILE 93 1HG2 ILE 93 1.540 -0.301 4.353 559 HG22 ILE 93 2HG2 ILE 93 1.198 1.335 4.916 560 HG23 ILE 93 3HG2 ILE 93 2.776 0.620 5.213 561 HD11 ILE 93 3HD1 ILE 93 -0.991 1.470 6.931 562 HD12 ILE 93 1HD1 ILE 93 -1.000 1.175 5.181 563 HD13 ILE 93 2HD1 ILE 93 -2.240 0.441 6.202 564 H LYS 94 H LYS 94 4.231 -1.507 5.564 565 HA LYS 94 HA LYS 94 5.984 -0.630 7.793 566 HB2 LYS 94 1HB LYS 94 6.209 -2.998 5.920 567 HB3 LYS 94 2HB LYS 94 7.652 -2.262 6.545 568 HG2 LYS 94 1HG LYS 94 6.823 -2.639 8.886 569 HG3 LYS 94 2HG LYS 94 5.432 -3.497 8.202 570 HD2 LYS 94 1HD LYS 94 7.031 -5.093 7.091 571 HD3 LYS 94 2HD LYS 94 8.380 -4.274 7.882 572 HE2 LYS 94 1HE LYS 94 7.609 -4.922 10.072 573 HE3 LYS 94 2HE LYS 94 6.041 -5.458 9.447 574 HZ1 LYS 94 3HZ LYS 94 7.641 -7.237 10.001 575 HZ2 LYS 94 1HZ LYS 94 8.569 -6.831 8.696 576 HZ3 LYS 94 2HZ LYS 94 7.027 -7.331 8.494 577 H TYR 95 H TYR 95 6.338 1.509 7.096 578 HA TYR 95 HA TYR 95 7.095 1.963 4.238 579 HB2 TYR 95 1HB TYR 95 5.918 4.161 4.527 580 HB3 TYR 95 2HB TYR 95 4.862 2.771 4.581 581 HD1 TYR 95 2HD TYR 95 3.879 1.963 6.659 582 HD2 TYR 95 1HD TYR 95 6.168 5.610 6.510 583 HE1 TYR 95 2HE TYR 95 3.070 2.552 8.928 584 HE2 TYR 95 1HE TYR 95 5.318 6.246 8.747 585 HH TYR 95 HH TYR 95 3.833 4.184 10.932 586 H THR 96 H THR 96 8.272 4.199 4.023 587 HA THR 96 HA THR 96 9.631 5.128 6.386 588 HB THR 96 HB THR 96 10.979 3.150 5.928 589 HG1 THR 96 1HG THR 96 12.881 4.333 6.010 590 HG21 THR 96 3HG2 THR 96 11.539 4.369 3.182 591 HG22 THR 96 1HG2 THR 96 10.605 2.896 3.485 592 HG23 THR 96 2HG2 THR 96 12.321 2.936 3.890 593 H SER 97 H SER 97 11.186 6.908 5.728 594 HA SER 97 HA SER 97 10.060 8.559 3.565 595 HB2 SER 97 1HB SER 97 11.504 10.317 4.739 596 HB3 SER 97 2HB SER 97 10.138 9.712 5.669 597 HG SER 97 HG SER 97 12.116 9.862 6.831 598 H GLN 98 H GLN 98 12.499 6.363 4.125 599 HA GLN 98 HA GLN 98 14.216 7.409 1.907 600 HB2 GLN 98 1HB GLN 98 14.907 7.241 4.813 601 HB3 GLN 98 2HB GLN 98 16.095 6.567 3.728 602 HG2 GLN 98 1HG GLN 98 16.338 8.624 2.505 603 HG3 GLN 98 2HG GLN 98 15.054 9.399 3.467 604 HE21 GLN 98 1HE2 GLN 98 18.178 9.817 3.174 605 HE22 GLN 98 2HE2 GLN 98 18.747 9.859 4.805 606 H ARG 99 H ARG 99 14.556 5.783 0.551 607 HA ARG 99 HA ARG 99 13.838 3.152 0.837 608 HB2 ARG 99 1HB ARG 99 14.317 4.146 -1.336 609 HB3 ARG 99 2HB ARG 99 15.980 4.439 -0.909 610 HG2 ARG 99 1HG ARG 99 15.744 2.604 -2.475 611 HG3 ARG 99 2HG ARG 99 16.504 2.093 -0.966 612 HD2 ARG 99 1HD ARG 99 14.234 1.150 -0.298 613 HD3 ARG 99 2HD ARG 99 13.699 1.490 -1.959 614 HE ARG 99 HE ARG 99 16.121 0.171 -2.214 615 HH11 ARG 99 1HH1 ARG 99 13.133 -0.832 -0.493 616 HH12 ARG 99 2HH1 ARG 99 13.065 -2.320 -1.450 617 HH21 ARG 99 1HH2 ARG 99 16.184 -2.036 -2.909 618 HH22 ARG 99 2HH2 ARG 99 15.021 -3.156 -2.318 619 H ASN 100 H ASN 100 16.842 4.599 1.773 620 HA ASN 100 HA ASN 100 18.276 2.162 2.118 621 HB2 ASN 100 1HB ASN 100 19.808 4.043 3.480 622 HB3 ASN 100 2HB ASN 100 19.947 3.590 1.801 623 HD21 ASN 100 1HD2 ASN 100 19.404 5.037 0.233 624 HD22 ASN 100 2HD2 ASN 100 18.781 6.671 0.534 625 H THR 101 H THR 101 15.940 3.172 3.980 626 HA THR 101 HA THR 101 17.351 2.582 6.562 627 HB THR 101 HB THR 101 15.909 4.229 7.660 628 HG1 THR 101 1HG THR 101 14.897 4.659 5.049 629 HG21 THR 101 3HG2 THR 101 16.907 6.251 6.753 630 HG22 THR 101 1HG2 THR 101 17.369 5.408 5.263 631 HG23 THR 101 2HG2 THR 101 18.108 4.948 6.802 632 H LYS 102 H LYS 102 15.822 2.191 8.477 633 HA LYS 102 HA LYS 102 14.477 -0.306 8.029 634 HB2 LYS 102 1HB LYS 102 15.601 0.520 10.156 635 HB3 LYS 102 2HB LYS 102 14.245 1.618 10.379 636 HG2 LYS 102 1HG LYS 102 13.852 -0.144 11.821 637 HG3 LYS 102 2HG LYS 102 12.717 -0.434 10.530 638 HD2 LYS 102 1HD LYS 102 15.399 -1.820 10.423 639 HD3 LYS 102 2HD LYS 102 14.253 -2.315 11.667 640 HE2 LYS 102 1HE LYS 102 12.524 -2.702 9.848 641 HE3 LYS 102 2HE LYS 102 13.828 -2.451 8.658 642 HZ1 LYS 102 3HZ LYS 102 13.602 -4.583 10.686 643 HZ2 LYS 102 1HZ LYS 102 15.022 -4.274 9.865 644 HZ3 LYS 102 2HZ LYS 102 13.716 -4.777 9.065 645 H LEU 103 H LEU 103 12.193 -0.758 8.269 646 HA LEU 103 HA LEU 103 10.427 1.393 7.305 647 HB2 LEU 103 1HB LEU 103 9.881 -1.553 7.838 648 HB3 LEU 103 2HB LEU 103 8.720 -0.394 7.239 649 HG LEU 103 HG LEU 103 9.292 -1.509 5.321 650 HD11 LEU 103 1HD1 LEU 103 10.579 -0.076 3.860 651 HD12 LEU 103 2HD1 LEU 103 11.305 0.763 5.235 652 HD13 LEU 103 3HD1 LEU 103 9.554 0.901 4.915 653 HD21 LEU 103 3HD2 LEU 103 12.251 -1.478 5.954 654 HD22 LEU 103 1HD2 LEU 103 11.393 -2.311 4.643 655 HD23 LEU 103 2HD2 LEU 103 11.139 -2.834 6.306 656 H LYS 104 H LYS 104 8.989 2.344 8.536 657 HA LYS 104 HA LYS 104 8.713 2.052 11.416 658 HB2 LYS 104 1HB LYS 104 6.987 3.444 9.299 659 HB3 LYS 104 2HB LYS 104 6.677 3.489 11.020 660 HG2 LYS 104 1HG LYS 104 7.700 5.474 10.810 661 HG3 LYS 104 2HG LYS 104 9.083 4.477 11.248 662 HD2 LYS 104 1HD LYS 104 9.776 4.414 8.848 663 HD3 LYS 104 2HD LYS 104 8.283 5.244 8.408 664 HE2 LYS 104 1HE LYS 104 9.944 6.937 8.377 665 HE3 LYS 104 2HE LYS 104 8.993 7.198 9.837 666 HZ1 LYS 104 3HZ LYS 104 11.741 6.127 9.640 667 HZ2 LYS 104 1HZ LYS 104 10.849 5.978 11.027 668 HZ3 LYS 104 2HZ LYS 104 11.195 7.461 10.400 669 H ALA 105 H ALA 105 6.174 1.692 12.113 670 HA ALA 105 HA ALA 105 5.102 -0.692 10.732 671 HB1 ALA 105 1HB ALA 105 5.072 -1.965 12.858 672 HB2 ALA 105 2HB ALA 105 6.733 -1.613 12.337 673 HB3 ALA 105 3HB ALA 105 5.995 -0.676 13.653 674 H LYS 106 H LYS 106 3.077 0.098 10.313 675 HA LYS 106 HA LYS 106 1.476 0.996 12.666 676 HB2 LYS 106 1HB LYS 106 1.899 2.905 11.083 677 HB3 LYS 106 2HB LYS 106 1.096 1.974 9.811 678 HG2 LYS 106 1HG LYS 106 -0.876 2.778 10.477 679 HG3 LYS 106 2HG LYS 106 -0.699 1.943 12.011 680 HD2 LYS 106 1HD LYS 106 -1.131 4.130 12.617 681 HD3 LYS 106 2HD LYS 106 0.632 4.047 12.775 682 HE2 LYS 106 1HE LYS 106 0.786 5.072 10.448 683 HE3 LYS 106 2HE LYS 106 -0.989 5.161 10.435 684 HZ1 LYS 106 3HZ LYS 106 -0.707 6.513 12.542 685 HZ2 LYS 106 1HZ LYS 106 -0.272 7.255 11.144 686 HZ3 LYS 106 2HZ LYS 106 0.875 6.647 12.170 687 H ALA 107 H ALA 107 0.283 -0.803 13.123 688 HA ALA 107 HA ALA 107 -0.624 -2.616 10.966 689 HB1 ALA 107 1HB ALA 107 -1.112 -2.652 13.985 690 HB2 ALA 107 2HB ALA 107 -1.583 -3.915 12.835 691 HB3 ALA 107 3HB ALA 107 0.134 -3.591 13.150 692 H LEU 108 H LEU 108 -2.781 -2.631 10.294 693 HA LEU 108 HA LEU 108 -4.771 -0.939 11.682 694 HB2 LEU 108 1HB LEU 108 -4.390 -0.965 8.651 695 HB3 LEU 108 2HB LEU 108 -5.771 -0.318 9.500 696 HG LEU 108 HG LEU 108 -4.493 1.489 8.751 697 HD11 LEU 108 1HD1 LEU 108 -4.048 1.247 11.747 698 HD12 LEU 108 2HD1 LEU 108 -5.471 1.902 10.923 699 HD13 LEU 108 3HD1 LEU 108 -3.917 2.731 10.800 700 HD21 LEU 108 3HD2 LEU 108 -2.025 0.717 10.272 701 HD22 LEU 108 1HD2 LEU 108 -2.242 1.872 8.944 702 HD23 LEU 108 2HD2 LEU 108 -2.314 0.129 8.632 703 H THR 109 H THR 109 -6.695 -2.136 11.898 704 HA THR 109 HA THR 109 -6.857 -4.833 11.039 705 HB THR 109 HB THR 109 -9.459 -3.779 11.543 706 HG1 THR 109 1HG THR 109 -7.932 -3.090 13.761 707 HG21 THR 109 3HG2 THR 109 -9.166 -5.029 13.720 708 HG22 THR 109 1HG2 THR 109 -7.475 -5.300 13.275 709 HG23 THR 109 2HG2 THR 109 -8.794 -5.956 12.271 710 H LEU 110 H LEU 110 -8.272 -5.769 9.329 711 HA LEU 110 HA LEU 110 -8.662 -4.354 6.835 712 HB2 LEU 110 1HB LEU 110 -10.094 -6.686 8.250 713 HB3 LEU 110 2HB LEU 110 -10.602 -6.072 6.685 714 HG LEU 110 HG LEU 110 -7.993 -7.477 7.293 715 HD11 LEU 110 1HD1 LEU 110 -10.164 -8.828 6.938 716 HD12 LEU 110 2HD1 LEU 110 -8.878 -9.167 5.766 717 HD13 LEU 110 3HD1 LEU 110 -10.246 -8.137 5.314 718 HD21 LEU 110 3HD2 LEU 110 -8.938 -6.126 4.761 719 HD22 LEU 110 1HD2 LEU 110 -7.572 -7.270 4.828 720 HD23 LEU 110 2HD2 LEU 110 -7.483 -5.726 5.693 721 H SER 111 H SER 111 -10.698 -4.793 9.735 722 HA SER 111 HA SER 111 -13.004 -3.539 8.790 723 HB2 SER 111 1HB SER 111 -12.879 -4.728 10.954 724 HB3 SER 111 2HB SER 111 -11.731 -3.523 11.542 725 HG SER 111 HG SER 111 -13.238 -2.145 11.925 726 H GLN 112 H GLN 112 -10.328 -1.913 10.689 727 HA GLN 112 HA GLN 112 -10.847 0.618 10.558 728 HB2 GLN 112 1HB GLN 112 -8.836 -0.915 11.318 729 HB3 GLN 112 2HB GLN 112 -8.065 -0.293 9.872 730 HG2 GLN 112 1HG GLN 112 -7.827 1.810 10.763 731 HG3 GLN 112 2HG GLN 112 -9.413 1.705 11.546 732 HE21 GLN 112 1HE2 GLN 112 -9.403 1.660 13.643 733 HE22 GLN 112 2HE2 GLN 112 -8.231 0.829 14.692 734 H LEU 113 H LEU 113 -8.846 -0.952 7.983 735 HA LEU 113 HA LEU 113 -8.866 1.376 6.323 736 HB2 LEU 113 1HB LEU 113 -8.371 -1.521 5.550 737 HB3 LEU 113 2HB LEU 113 -8.051 -0.130 4.519 738 HG LEU 113 HG LEU 113 -6.625 -0.762 7.124 739 HD11 LEU 113 1HD1 LEU 113 -5.658 -0.797 4.222 740 HD12 LEU 113 2HD1 LEU 113 -6.143 -2.232 5.152 741 HD13 LEU 113 3HD1 LEU 113 -4.740 -1.281 5.667 742 HD21 LEU 113 3HD2 LEU 113 -6.682 1.679 6.837 743 HD22 LEU 113 1HD2 LEU 113 -6.190 1.523 5.134 744 HD23 LEU 113 2HD2 LEU 113 -5.070 1.079 6.432 745 H LYS 114 H LYS 114 -11.184 -1.369 6.501 746 HA LYS 114 HA LYS 114 -12.288 -0.863 3.888 747 HB2 LYS 114 1HB LYS 114 -12.427 -3.044 5.122 748 HB3 LYS 114 2HB LYS 114 -13.578 -2.302 6.247 749 HG2 LYS 114 1HG LYS 114 -15.008 -1.711 4.257 750 HG3 LYS 114 2HG LYS 114 -13.878 -2.525 3.187 751 HD2 LYS 114 1HD LYS 114 -15.322 -3.914 5.479 752 HD3 LYS 114 2HD LYS 114 -16.016 -3.747 3.856 753 HE2 LYS 114 1HE LYS 114 -13.927 -4.911 2.977 754 HE3 LYS 114 2HE LYS 114 -13.580 -5.354 4.662 755 HZ1 LYS 114 3HZ LYS 114 -15.770 -6.468 4.698 756 HZ2 LYS 114 1HZ LYS 114 -14.844 -7.093 3.514 757 HZ3 LYS 114 2HZ LYS 114 -16.029 -6.034 3.126 758 H LYS 115 H LYS 115 -12.989 0.271 7.253 759 HA LYS 115 HA LYS 115 -15.335 1.778 6.537 760 HB2 LYS 115 1HB LYS 115 -13.678 1.185 8.929 761 HB3 LYS 115 2HB LYS 115 -13.987 2.872 8.771 762 HG2 LYS 115 1HG LYS 115 -15.843 2.357 9.958 763 HG3 LYS 115 2HG LYS 115 -16.543 2.043 8.378 764 HD2 LYS 115 1HD LYS 115 -15.259 -0.014 10.230 765 HD3 LYS 115 2HD LYS 115 -16.989 0.271 10.086 766 HE2 LYS 115 1HE LYS 115 -15.318 -0.578 7.698 767 HE3 LYS 115 2HE LYS 115 -15.936 -1.753 8.871 768 HZ1 LYS 115 3HZ LYS 115 -17.440 -1.487 7.005 769 HZ2 LYS 115 1HZ LYS 115 -17.653 0.095 7.323 770 HZ3 LYS 115 2HZ LYS 115 -18.169 -1.052 8.389 771 H GLU 116 H GLU 116 -11.834 2.591 7.062 772 HA GLU 116 HA GLU 116 -12.029 5.327 6.649 773 HB2 GLU 116 1HB GLU 116 -9.768 3.428 5.922 774 HB3 GLU 116 2HB GLU 116 -9.671 5.174 5.779 775 HG2 GLU 116 1HG GLU 116 -9.832 3.593 8.333 776 HG3 GLU 116 2HG GLU 116 -8.520 4.586 7.745 777 H PHE 117 H PHE 117 -11.471 2.831 4.177 778 HA PHE 117 HA PHE 117 -11.702 4.900 2.040 779 HB2 PHE 117 1HB PHE 117 -9.735 2.643 2.367 780 HB3 PHE 117 2HB PHE 117 -9.767 3.902 1.127 781 HD1 PHE 117 1HD PHE 117 -9.863 6.428 2.424 782 HD2 PHE 117 2HD PHE 117 -7.923 2.817 3.762 783 HE1 PHE 117 1HE PHE 117 -8.340 7.766 3.887 784 HE2 PHE 117 2HE PHE 117 -6.429 4.155 5.194 785 HZ PHE 117 HZ PHE 117 -6.644 6.640 5.270 786 H TYR 118 H TYR 118 -13.515 2.385 2.933 787 HA TYR 118 HA TYR 118 -14.082 1.880 0.114 788 HB2 TYR 118 1HB TYR 118 -12.333 0.134 1.053 789 HB3 TYR 118 2HB TYR 118 -13.724 -0.591 1.828 790 HD1 TYR 118 2HD TYR 118 -12.393 0.558 -1.521 791 HD2 TYR 118 1HD TYR 118 -15.093 -2.095 0.577 792 HE1 TYR 118 2HE TYR 118 -12.843 -0.646 -3.643 793 HE2 TYR 118 1HE TYR 118 -15.642 -3.224 -1.554 794 HH TYR 118 HH TYR 118 -13.970 -2.986 -4.434 795 H GLN 119 H GLN 119 -15.460 3.379 1.855 796 HA GLN 119 HA GLN 119 -17.694 1.750 2.893 797 HB2 GLN 119 1HB GLN 119 -18.169 3.479 4.360 798 HB3 GLN 119 2HB GLN 119 -16.438 3.222 4.384 799 HG2 GLN 119 1HG GLN 119 -17.933 5.541 3.125 800 HG3 GLN 119 2HG GLN 119 -17.021 5.576 4.615 801 HE21 GLN 119 1HE2 GLN 119 -14.562 4.426 3.935 802 HE22 GLN 119 2HE2 GLN 119 -13.784 5.556 2.891 803 H THR 120 H THR 120 -17.162 4.159 0.384 804 HA THR 120 HA THR 120 -20.044 4.646 -0.001 805 HB THR 120 HB THR 120 -19.172 6.302 -1.678 806 HG1 THR 120 1HG THR 120 -16.839 6.638 -1.444 807 HG21 THR 120 3HG2 THR 120 -19.546 7.089 0.615 808 HG22 THR 120 1HG2 THR 120 -18.009 7.774 0.014 809 HG23 THR 120 2HG2 THR 120 -17.995 6.412 1.132 810 H ARG 121 H ARG 121 -20.364 4.829 -2.755 811 HA ARG 121 HA ARG 121 -20.020 1.970 -3.515 812 HB2 ARG 121 1HB ARG 121 -22.300 3.659 -3.447 813 HB3 ARG 121 2HB ARG 121 -21.890 3.585 -5.145 814 HG2 ARG 121 1HG ARG 121 -22.469 1.355 -5.314 815 HG3 ARG 121 2HG ARG 121 -21.757 0.947 -3.786 816 HD2 ARG 121 1HD ARG 121 -23.913 2.381 -2.869 817 HD3 ARG 121 2HD ARG 121 -24.564 1.758 -4.389 818 HE ARG 121 HE ARG 121 -24.592 -0.364 -3.495 819 HH11 ARG 121 1HH1 ARG 121 -22.537 1.657 -1.390 820 HH12 ARG 121 2HH1 ARG 121 -21.868 0.315 -0.552 821 HH21 ARG 121 1HH2 ARG 121 -23.865 -2.129 -2.101 822 HH22 ARG 121 2HH2 ARG 121 -22.923 -1.733 -0.690 823 H SER 122 H SER 122 -19.762 5.309 -4.945 824 HA SER 122 HA SER 122 -18.546 4.351 -7.351 825 HB2 SER 122 1HB SER 122 -18.343 7.005 -5.917 826 HB3 SER 122 2HB SER 122 -17.732 6.692 -7.556 827 HG SER 122 HG SER 122 -19.641 7.142 -8.135 828 H GLN 123 H GLN 123 -17.087 4.994 -4.131 829 HA GLN 123 HA GLN 123 -14.396 4.881 -4.919 830 HB2 GLN 123 1HB GLN 123 -15.282 5.566 -2.795 831 HB3 GLN 123 2HB GLN 123 -15.775 3.901 -2.401 832 HG2 GLN 123 1HG GLN 123 -13.384 3.284 -2.172 833 HG3 GLN 123 2HG GLN 123 -12.944 4.934 -2.714 834 HE21 GLN 123 1HE2 GLN 123 -15.694 4.674 -0.637 835 HE22 GLN 123 2HE2 GLN 123 -14.867 5.250 0.804 836 H LYS 124 H LYS 124 -16.708 2.287 -5.061 837 HA LYS 124 HA LYS 124 -14.831 0.072 -4.738 838 HB2 LYS 124 1HB LYS 124 -17.504 0.199 -6.206 839 HB3 LYS 124 2HB LYS 124 -16.609 -1.257 -5.772 840 HG2 LYS 124 1HG LYS 124 -16.843 -0.656 -3.350 841 HG3 LYS 124 2HG LYS 124 -17.789 0.756 -3.795 842 HD2 LYS 124 1HD LYS 124 -19.560 -0.565 -3.465 843 HD3 LYS 124 2HD LYS 124 -19.235 -1.176 -5.086 844 HE2 LYS 124 1HE LYS 124 -18.286 -2.347 -2.431 845 HE3 LYS 124 2HE LYS 124 -19.564 -2.985 -3.469 846 HZ1 LYS 124 3HZ LYS 124 -17.549 -4.212 -3.820 847 HZ2 LYS 124 1HZ LYS 124 -16.688 -2.877 -4.215 848 HZ3 LYS 124 2HZ LYS 124 -17.928 -3.414 -5.171 849 H ARG 125 H ARG 125 -15.575 2.395 -7.231 850 HA ARG 125 HA ARG 125 -14.153 0.927 -9.339 851 HB2 ARG 125 1HB ARG 125 -15.052 3.863 -9.343 852 HB3 ARG 125 2HB ARG 125 -14.535 2.864 -10.707 853 HG2 ARG 125 1HG ARG 125 -16.436 1.296 -9.973 854 HG3 ARG 125 2HG ARG 125 -17.017 2.666 -8.992 855 HD2 ARG 125 1HD ARG 125 -16.507 2.980 -11.957 856 HD3 ARG 125 2HD ARG 125 -17.955 2.135 -11.375 857 HE ARG 125 HE ARG 125 -17.435 4.846 -10.315 858 HH11 ARG 125 1HH1 ARG 125 -19.004 2.944 -12.824 859 HH12 ARG 125 2HH1 ARG 125 -20.388 3.940 -13.039 860 HH21 ARG 125 1HH2 ARG 125 -19.173 6.375 -10.650 861 HH22 ARG 125 2HH2 ARG 125 -20.352 6.073 -11.875 862 H GLU 126 H GLU 126 -13.791 4.128 -7.744 863 HA GLU 126 HA GLU 126 -11.567 4.613 -8.859 864 HB2 GLU 126 1HB GLU 126 -12.715 5.525 -6.238 865 HB3 GLU 126 2HB GLU 126 -10.985 5.800 -6.321 866 HG2 GLU 126 1HG GLU 126 -12.153 7.737 -6.998 867 HG3 GLU 126 2HG GLU 126 -11.165 7.106 -8.320 868 H VAL 127 H VAL 127 -11.596 3.181 -5.642 869 HA VAL 127 HA VAL 127 -8.835 2.896 -5.154 870 HB VAL 127 HB VAL 127 -11.257 1.235 -4.338 871 HG11 VAL 127 1HG1 VAL 127 -9.254 -0.261 -4.204 872 HG12 VAL 127 2HG1 VAL 127 -8.498 0.906 -3.108 873 HG13 VAL 127 3HG1 VAL 127 -10.018 0.067 -2.667 874 HG21 VAL 127 3HG2 VAL 127 -10.914 2.406 -2.165 875 HG22 VAL 127 1HG2 VAL 127 -9.487 3.229 -2.832 876 HG23 VAL 127 2HG2 VAL 127 -11.096 3.569 -3.481 877 H ASP 128 H ASP 128 -11.077 0.517 -6.739 878 HA ASP 128 HA ASP 128 -8.924 -1.334 -7.200 879 HB2 ASP 128 1HB ASP 128 -11.529 -1.728 -7.100 880 HB3 ASP 128 2HB ASP 128 -11.469 -1.357 -8.825 881 H ASP 129 H ASP 129 -10.234 1.372 -8.993 882 HA ASP 129 HA ASP 129 -9.121 0.786 -11.557 883 HB2 ASP 129 1HB ASP 129 -10.926 2.422 -11.106 884 HB3 ASP 129 2HB ASP 129 -9.743 3.483 -10.341 885 H TYR 130 H TYR 130 -7.875 2.515 -8.679 886 HA TYR 130 HA TYR 130 -5.268 3.157 -9.712 887 HB2 TYR 130 1HB TYR 130 -6.001 2.492 -6.883 888 HB3 TYR 130 2HB TYR 130 -4.624 3.406 -7.424 889 HD1 TYR 130 2HD TYR 130 -6.520 5.080 -9.536 890 HD2 TYR 130 1HD TYR 130 -6.672 4.224 -5.311 891 HE1 TYR 130 2HE TYR 130 -7.779 7.133 -9.167 892 HE2 TYR 130 1HE TYR 130 -7.943 6.223 -4.918 893 HH TYR 130 HH TYR 130 -9.149 8.260 -7.650 894 H VAL 131 H VAL 131 -6.628 0.116 -8.387 895 HA VAL 131 HA VAL 131 -4.032 -1.214 -8.329 896 HB VAL 131 HB VAL 131 -6.764 -2.568 -8.488 897 HG11 VAL 131 1HG1 VAL 131 -5.572 -4.331 -7.129 898 HG12 VAL 131 2HG1 VAL 131 -4.972 -4.143 -8.771 899 HG13 VAL 131 3HG1 VAL 131 -4.060 -3.436 -7.418 900 HG21 VAL 131 3HG2 VAL 131 -5.368 -1.962 -5.867 901 HG22 VAL 131 1HG2 VAL 131 -6.689 -0.970 -6.506 902 HG23 VAL 131 2HG2 VAL 131 -6.983 -2.655 -6.154 903 H ALA 132 H ALA 132 -6.155 -0.307 -10.871 904 HA ALA 132 HA ALA 132 -4.755 -2.140 -12.749 905 HB1 ALA 132 1HB ALA 132 -7.234 -2.360 -12.706 906 HB2 ALA 132 2HB ALA 132 -7.372 -0.631 -13.124 907 HB3 ALA 132 3HB ALA 132 -6.616 -1.775 -14.262 908 H GLY 133 H GLY 133 -3.986 0.579 -11.417 909 HA2 GLY 133 1HA GLY 133 -3.141 1.967 -13.926 910 HA3 GLY 133 2HA GLY 133 -3.572 2.806 -12.432 911 H LEU 134 H LEU 134 -1.920 -0.260 -12.064 912 HA LEU 134 HA LEU 134 0.638 1.146 -11.562 913 HB2 LEU 134 1HB LEU 134 0.941 -0.260 -9.566 914 HB3 LEU 134 2HB LEU 134 -0.348 0.933 -9.483 915 HG LEU 134 HG LEU 134 -2.014 -0.957 -9.909 916 HD11 LEU 134 1HD1 LEU 134 -1.295 -3.204 -9.170 917 HD12 LEU 134 2HD1 LEU 134 0.394 -2.670 -9.191 918 HD13 LEU 134 3HD1 LEU 134 -0.544 -2.764 -10.694 919 HD21 LEU 134 3HD2 LEU 134 -1.901 -1.707 -7.519 920 HD22 LEU 134 1HD2 LEU 134 -1.749 0.049 -7.733 921 HD23 LEU 134 2HD2 LEU 134 -0.302 -0.950 -7.396 922 H ARG 135 H ARG 135 2.463 -0.011 -11.737 923 HA ARG 135 HA ARG 135 2.631 -2.151 -13.722 924 HB2 ARG 135 1HB ARG 135 4.491 -0.461 -12.014 925 HB3 ARG 135 2HB ARG 135 5.192 -1.766 -12.888 926 HG2 ARG 135 1HG ARG 135 4.815 -0.773 -14.956 927 HG3 ARG 135 2HG ARG 135 3.411 0.165 -14.413 928 HD2 ARG 135 1HD ARG 135 4.749 1.811 -13.338 929 HD3 ARG 135 2HD ARG 135 6.067 0.744 -13.165 930 HE ARG 135 HE ARG 135 6.865 1.132 -15.259 931 HH11 ARG 135 1HH1 ARG 135 3.712 2.746 -15.106 932 HH12 ARG 135 2HH1 ARG 135 3.523 2.825 -16.835 933 HH21 ARG 135 1HH2 ARG 135 6.854 1.699 -17.411 934 HH22 ARG 135 2HH2 ARG 135 5.543 2.547 -18.141 935 H THR 136 H THR 136 4.353 -3.993 -12.903 936 HA THR 136 HA THR 136 3.479 -4.968 -10.271 937 HB THR 136 HB THR 136 3.445 -7.211 -12.009 938 HG1 THR 136 1HG THR 136 2.008 -6.746 -13.570 939 HG21 THR 136 3HG2 THR 136 1.155 -5.726 -10.696 940 HG22 THR 136 1HG2 THR 136 2.068 -7.141 -10.085 941 HG23 THR 136 2HG2 THR 136 1.015 -7.327 -11.482 942 H GLU 137 H GLU 137 5.982 -4.306 -12.108 943 HA GLU 137 HA GLU 137 7.848 -5.727 -10.475 944 HB2 GLU 137 1HB GLU 137 7.055 -7.106 -12.846 945 HB3 GLU 137 2HB GLU 137 8.657 -6.453 -13.178 946 HG2 GLU 137 1HG GLU 137 9.566 -7.516 -11.180 947 HG3 GLU 137 2HG GLU 137 7.951 -7.984 -10.640 Start of MODEL 15 1 H1 GLY 19 H GLY 19 -4.884 -14.026 3.637 2 HA2 GLY 19 1HA GLY 19 -6.479 -15.776 3.105 3 HA3 GLY 19 2HA GLY 19 -7.188 -14.172 2.800 4 H HIS 20 H HIS 20 -8.647 -15.115 1.246 5 HA HIS 20 HA HIS 20 -7.440 -15.796 -1.389 6 HB2 HIS 20 1HB HIS 20 -9.709 -17.225 0.070 7 HB3 HIS 20 2HB HIS 20 -9.293 -17.469 -1.629 8 HD1 HIS 20 1HD HIS 20 -6.559 -18.187 -1.979 9 HD2 HIS 20 2HD HIS 20 -8.536 -18.921 1.672 10 HE1 HIS 20 1HE HIS 20 -5.138 -19.868 -0.722 11 H MET 21 H MET 21 -10.530 -14.997 0.271 12 HA MET 21 HA MET 21 -11.300 -13.381 -2.138 13 HB2 MET 21 1HB MET 21 -13.577 -14.067 -1.857 14 HB3 MET 21 2HB MET 21 -12.558 -15.488 -2.075 15 HG2 MET 21 1HG MET 21 -12.625 -15.981 0.304 16 HG3 MET 21 2HG MET 21 -13.531 -14.504 0.640 17 HE1 MET 21 3HE MET 21 -16.040 -14.088 0.082 18 HE2 MET 21 1HE MET 21 -15.784 -14.412 -1.650 19 HE3 MET 21 2HE MET 21 -17.076 -15.249 -0.776 20 H LYS 22 H LYS 22 -10.976 -13.437 1.352 21 HA LYS 22 HA LYS 22 -12.406 -10.864 1.648 22 HB2 LYS 22 1HB LYS 22 -10.814 -12.577 3.580 23 HB3 LYS 22 2HB LYS 22 -11.423 -10.956 3.945 24 HG2 LYS 22 1HG LYS 22 -13.722 -11.738 3.297 25 HG3 LYS 22 2HG LYS 22 -13.116 -13.387 3.175 26 HD2 LYS 22 1HD LYS 22 -12.913 -13.652 5.446 27 HD3 LYS 22 2HD LYS 22 -12.486 -11.972 5.739 28 HE2 LYS 22 1HE LYS 22 -15.309 -12.967 5.174 29 HE3 LYS 22 2HE LYS 22 -14.639 -12.502 6.741 30 HZ1 LYS 22 3HZ LYS 22 -15.261 -10.758 4.471 31 HZ2 LYS 22 1HZ LYS 22 -14.155 -10.288 5.598 32 HZ3 LYS 22 2HZ LYS 22 -15.696 -10.590 6.046 33 H PHE 23 H PHE 23 -11.459 -9.458 0.380 34 HA PHE 23 HA PHE 23 -10.060 -7.996 -0.493 35 HB2 PHE 23 1HB PHE 23 -8.456 -8.584 1.994 36 HB3 PHE 23 2HB PHE 23 -7.762 -7.682 0.679 37 HD1 PHE 23 1HD PHE 23 -8.671 -5.572 -0.102 38 HD2 PHE 23 2HD PHE 23 -10.238 -7.550 3.379 39 HE1 PHE 23 1HE PHE 23 -9.779 -3.493 0.546 40 HE2 PHE 23 2HE PHE 23 -11.236 -5.408 4.131 41 HZ PHE 23 HZ PHE 23 -11.017 -3.355 2.716 42 H THR 24 H THR 24 -7.872 -7.775 -1.583 43 HA THR 24 HA THR 24 -6.465 -10.253 -2.096 44 HB THR 24 HB THR 24 -6.239 -9.826 -4.444 45 HG1 THR 24 1HG THR 24 -6.578 -8.071 -5.368 46 HG21 THR 24 3HG2 THR 24 -8.456 -10.061 -5.343 47 HG22 THR 24 1HG2 THR 24 -9.196 -9.273 -3.940 48 HG23 THR 24 2HG2 THR 24 -8.462 -10.881 -3.766 49 H ASP 25 H ASP 25 -4.160 -9.654 -2.458 50 HA ASP 25 HA ASP 25 -3.433 -7.677 -0.628 51 HB2 ASP 25 1HB ASP 25 -1.913 -9.324 -2.635 52 HB3 ASP 25 2HB ASP 25 -1.093 -8.104 -1.646 53 H GLN 26 H GLN 26 -3.735 -7.477 -4.127 54 HA GLN 26 HA GLN 26 -2.504 -4.961 -4.570 55 HB2 GLN 26 1HB GLN 26 -5.035 -5.721 -6.044 56 HB3 GLN 26 2HB GLN 26 -3.611 -4.863 -6.618 57 HG2 GLN 26 1HG GLN 26 -3.435 -6.901 -7.687 58 HG3 GLN 26 2HG GLN 26 -2.388 -7.155 -6.298 59 HE21 GLN 26 1HE2 GLN 26 -5.787 -7.584 -7.453 60 HE22 GLN 26 2HE2 GLN 26 -5.914 -9.238 -6.847 61 H GLN 27 H GLN 27 -5.840 -5.744 -3.604 62 HA GLN 27 HA GLN 27 -6.938 -3.105 -3.819 63 HB2 GLN 27 1HB GLN 27 -7.782 -5.427 -2.062 64 HB3 GLN 27 2HB GLN 27 -8.788 -4.051 -2.444 65 HG2 GLN 27 1HG GLN 27 -7.740 -5.667 -4.748 66 HG3 GLN 27 2HG GLN 27 -8.877 -6.481 -3.676 67 HE21 GLN 27 1HE2 GLN 27 -8.881 -5.397 -6.562 68 HE22 GLN 27 2HE2 GLN 27 -10.280 -4.356 -6.688 69 H ILE 28 H ILE 28 -5.545 -4.984 -1.162 70 HA ILE 28 HA ILE 28 -5.970 -3.084 0.979 71 HB ILE 28 HB ILE 28 -3.831 -5.234 0.573 72 HG12 ILE 28 1HG1 ILE 28 -6.379 -5.659 2.177 73 HG13 ILE 28 2HG1 ILE 28 -6.347 -5.958 0.481 74 HG21 ILE 28 1HG2 ILE 28 -3.330 -3.606 2.432 75 HG22 ILE 28 2HG2 ILE 28 -4.838 -4.122 3.220 76 HG23 ILE 28 3HG2 ILE 28 -3.504 -5.273 2.939 77 HD11 ILE 28 3HD1 ILE 28 -4.041 -7.290 1.389 78 HD12 ILE 28 1HD1 ILE 28 -5.326 -7.668 2.552 79 HD13 ILE 28 2HD1 ILE 28 -5.554 -8.010 0.840 80 H GLY 29 H GLY 29 -3.209 -3.724 -1.282 81 HA2 GLY 29 1HA GLY 29 -1.364 -1.921 -0.291 82 HA3 GLY 29 2HA GLY 29 -1.543 -2.374 -1.994 83 H VAL 30 H VAL 30 -4.218 -1.240 -2.373 84 HA VAL 30 HA VAL 30 -3.538 1.554 -2.790 85 HB VAL 30 HB VAL 30 -6.170 0.050 -3.041 86 HG11 VAL 30 1HG1 VAL 30 -5.554 2.922 -3.839 87 HG12 VAL 30 2HG1 VAL 30 -7.045 2.015 -4.210 88 HG13 VAL 30 3HG1 VAL 30 -6.659 2.419 -2.542 89 HG21 VAL 30 3HG2 VAL 30 -4.169 1.115 -5.086 90 HG22 VAL 30 1HG2 VAL 30 -4.499 -0.595 -4.722 91 HG23 VAL 30 2HG2 VAL 30 -5.743 0.411 -5.471 92 H LEU 31 H LEU 31 -5.877 -0.063 -0.528 93 HA LEU 31 HA LEU 31 -6.633 2.391 0.679 94 HB2 LEU 31 1HB LEU 31 -6.624 -0.273 2.095 95 HB3 LEU 31 2HB LEU 31 -7.611 1.130 2.506 96 HG LEU 31 HG LEU 31 -7.801 -0.678 0.046 97 HD11 LEU 31 1HD1 LEU 31 -9.728 -0.238 2.345 98 HD12 LEU 31 2HD1 LEU 31 -8.717 -1.689 2.056 99 HD13 LEU 31 3HD1 LEU 31 -10.019 -1.263 0.927 100 HD21 LEU 31 3HD2 LEU 31 -9.743 0.498 -0.669 101 HD22 LEU 31 1HD2 LEU 31 -8.404 1.651 -0.593 102 HD23 LEU 31 2HD2 LEU 31 -9.656 1.632 0.679 103 H ALA 32 H ALA 32 -4.080 0.115 1.576 104 HA ALA 32 HA ALA 32 -3.168 1.414 3.946 105 HB1 ALA 32 1HB ALA 32 -1.059 0.085 3.433 106 HB2 ALA 32 2HB ALA 32 -2.555 -0.881 3.469 107 HB3 ALA 32 3HB ALA 32 -1.820 -0.422 1.921 108 H GLY 33 H GLY 33 -2.328 1.889 0.475 109 HA2 GLY 33 1HA GLY 33 -0.227 3.804 0.996 110 HA3 GLY 33 2HA GLY 33 -1.039 3.494 -0.542 111 H LEU 34 H LEU 34 -3.781 4.031 0.749 112 HA LEU 34 HA LEU 34 -3.751 6.909 0.438 113 HB2 LEU 34 1HB LEU 34 -5.938 5.173 1.625 114 HB3 LEU 34 2HB LEU 34 -6.089 6.868 1.137 115 HG LEU 34 HG LEU 34 -5.347 4.671 -0.817 116 HD11 LEU 34 1HD1 LEU 34 -7.574 4.282 0.200 117 HD12 LEU 34 2HD1 LEU 34 -7.613 4.543 -1.532 118 HD13 LEU 34 3HD1 LEU 34 -8.106 5.855 -0.403 119 HD21 LEU 34 3HD2 LEU 34 -6.377 7.484 -1.308 120 HD22 LEU 34 1HD2 LEU 34 -5.914 6.243 -2.512 121 HD23 LEU 34 2HD2 LEU 34 -4.691 6.958 -1.495 122 H ALA 35 H ALA 35 -3.897 4.719 3.248 123 HA ALA 35 HA ALA 35 -3.967 6.791 5.220 124 HB1 ALA 35 1HB ALA 35 -2.706 4.020 5.449 125 HB2 ALA 35 2HB ALA 35 -3.208 5.074 6.785 126 HB3 ALA 35 3HB ALA 35 -4.426 4.378 5.697 127 H ILE 36 H ILE 36 -1.305 5.515 3.247 128 HA ILE 36 HA ILE 36 0.673 7.109 4.764 129 HB ILE 36 HB ILE 36 1.167 4.411 3.505 130 HG12 ILE 36 1HG1 ILE 36 -0.193 3.915 5.425 131 HG13 ILE 36 2HG1 ILE 36 1.474 3.463 5.715 132 HG21 ILE 36 1HG2 ILE 36 2.960 6.026 5.375 133 HG22 ILE 36 2HG2 ILE 36 3.343 4.594 4.389 134 HG23 ILE 36 3HG2 ILE 36 3.062 6.152 3.625 135 HD11 ILE 36 3HD1 ILE 36 1.749 5.504 7.146 136 HD12 ILE 36 1HD1 ILE 36 0.031 5.854 6.908 137 HD13 ILE 36 2HD1 ILE 36 0.520 4.364 7.721 138 H SER 37 H SER 37 0.596 8.744 3.367 139 HA SER 37 HA SER 37 1.356 10.059 1.689 140 HB2 SER 37 1HB SER 37 3.206 8.969 0.137 141 HB3 SER 37 2HB SER 37 3.446 9.472 1.829 142 HG SER 37 HG SER 37 2.837 6.847 1.236 143 HA PRO 38 HA PRO 38 -1.843 8.284 -1.113 144 HB2 PRO 38 1HB PRO 38 -3.680 10.329 -0.951 145 HB3 PRO 38 2HB PRO 38 -3.590 8.989 0.215 146 HG2 PRO 38 1HG PRO 38 -2.375 11.742 0.484 147 HG3 PRO 38 2HG PRO 38 -3.356 10.835 1.685 148 HD2 PRO 38 1HD PRO 38 -0.659 10.870 1.808 149 HD3 PRO 38 2HD PRO 38 -1.564 9.367 2.161 150 H GLU 39 H GLU 39 -0.532 11.639 -0.978 151 HA GLU 39 HA GLU 39 -1.293 12.508 -3.564 152 HB2 GLU 39 1HB GLU 39 0.994 13.223 -1.718 153 HB3 GLU 39 2HB GLU 39 0.760 14.047 -3.268 154 HG2 GLU 39 1HG GLU 39 -1.302 13.951 -1.028 155 HG3 GLU 39 2HG GLU 39 -0.121 15.233 -1.245 156 H TRP 40 H TRP 40 1.968 11.349 -2.589 157 HA TRP 40 HA TRP 40 3.161 10.912 -5.005 158 HB2 TRP 40 1HB TRP 40 4.362 10.596 -2.977 159 HB3 TRP 40 2HB TRP 40 3.241 9.370 -2.397 160 HD1 TRP 40 HD TRP 40 6.143 9.789 -4.868 161 HE1 TRP 40 1HE TRP 40 7.124 7.487 -5.415 162 HE3 TRP 40 3HE TRP 40 2.720 6.835 -2.460 163 HZ2 TRP 40 2HZ TRP 40 6.490 4.742 -4.929 164 HZ3 TRP 40 3HZ TRP 40 2.888 4.380 -2.569 165 HH2 TRP 40 HH TRP 40 4.806 3.296 -3.734 166 H LEU 41 H LEU 41 0.986 8.530 -3.359 167 HA LEU 41 HA LEU 41 1.191 6.545 -5.378 168 HB2 LEU 41 1HB LEU 41 0.373 6.025 -3.237 169 HB3 LEU 41 2HB LEU 41 -1.010 7.108 -3.350 170 HG LEU 41 HG LEU 41 -0.694 4.847 -5.356 171 HD11 LEU 41 1HD1 LEU 41 -1.868 3.303 -3.850 172 HD12 LEU 41 2HD1 LEU 41 -1.839 4.521 -2.550 173 HD13 LEU 41 3HD1 LEU 41 -0.327 3.804 -3.144 174 HD21 LEU 41 3HD2 LEU 41 -3.111 6.137 -4.006 175 HD22 LEU 41 1HD2 LEU 41 -3.196 4.804 -5.184 176 HD23 LEU 41 2HD2 LEU 41 -2.618 6.383 -5.703 177 H LYS 42 H LYS 42 -1.180 9.238 -5.007 178 HA LYS 42 HA LYS 42 -2.658 8.553 -7.377 179 HB2 LYS 42 1HB LYS 42 -2.408 11.088 -5.712 180 HB3 LYS 42 2HB LYS 42 -3.372 11.023 -7.193 181 HG2 LYS 42 1HG LYS 42 -4.721 9.202 -6.356 182 HG3 LYS 42 2HG LYS 42 -3.743 9.085 -4.882 183 HD2 LYS 42 1HD LYS 42 -4.477 11.274 -4.140 184 HD3 LYS 42 2HD LYS 42 -5.366 11.547 -5.663 185 HE2 LYS 42 1HE LYS 42 -6.833 9.652 -5.228 186 HE3 LYS 42 2HE LYS 42 -5.903 9.187 -3.803 187 HZ1 LYS 42 3HZ LYS 42 -6.698 11.132 -2.659 188 HZ2 LYS 42 1HZ LYS 42 -7.951 10.338 -3.290 189 HZ3 LYS 42 2HZ LYS 42 -7.466 11.709 -4.020 190 H GLN 43 H GLN 43 0.288 10.605 -6.922 191 HA GLN 43 HA GLN 43 0.268 11.643 -9.602 192 HB2 GLN 43 1HB GLN 43 2.662 11.044 -7.792 193 HB3 GLN 43 2HB GLN 43 2.690 11.967 -9.284 194 HG2 GLN 43 1HG GLN 43 0.820 13.397 -7.930 195 HG3 GLN 43 2HG GLN 43 1.771 12.792 -6.572 196 HE21 GLN 43 1HE2 GLN 43 4.395 12.926 -7.274 197 HE22 GLN 43 2HE2 GLN 43 4.798 14.543 -7.817 198 H ASN 44 H ASN 44 1.538 8.672 -8.112 199 HA ASN 44 HA ASN 44 2.897 7.797 -10.501 200 HB2 ASN 44 1HB ASN 44 2.303 6.513 -7.821 201 HB3 ASN 44 2HB ASN 44 2.916 5.564 -9.189 202 HD21 ASN 44 1HD2 ASN 44 3.727 8.396 -7.116 203 HD22 ASN 44 2HD2 ASN 44 5.382 8.460 -7.678 204 H ILE 45 H ILE 45 -0.256 6.799 -8.990 205 HA ILE 45 HA ILE 45 -0.860 4.904 -11.033 206 HB ILE 45 HB ILE 45 -2.692 6.561 -9.253 207 HG12 ILE 45 1HG1 ILE 45 -1.239 4.908 -8.060 208 HG13 ILE 45 2HG1 ILE 45 -2.947 4.622 -7.895 209 HG21 ILE 45 1HG2 ILE 45 -4.340 4.583 -9.995 210 HG22 ILE 45 2HG2 ILE 45 -4.140 6.030 -10.985 211 HG23 ILE 45 3HG2 ILE 45 -3.294 4.530 -11.397 212 HD11 ILE 45 3HD1 ILE 45 -1.042 3.084 -9.699 213 HD12 ILE 45 1HD1 ILE 45 -1.797 2.518 -8.192 214 HD13 ILE 45 2HD1 ILE 45 -2.796 2.809 -9.615 215 H ALA 46 H ALA 46 -1.591 8.465 -10.834 216 HA ALA 46 HA ALA 46 -3.101 8.588 -13.194 217 HB1 ALA 46 1HB ALA 46 -1.178 10.691 -12.093 218 HB2 ALA 46 2HB ALA 46 -2.503 10.964 -13.245 219 HB3 ALA 46 3HB ALA 46 -2.871 10.467 -11.591 220 H ALA 47 H ALA 47 0.437 8.645 -12.754 221 HA ALA 47 HA ALA 47 0.953 8.807 -15.610 222 HB1 ALA 47 1HB ALA 47 2.356 9.990 -13.979 223 HB2 ALA 47 2HB ALA 47 2.832 8.428 -13.266 224 HB3 ALA 47 3HB ALA 47 3.285 8.838 -14.946 225 H ASN 48 H ASN 48 -0.175 6.221 -13.963 226 HA ASN 48 HA ASN 48 0.195 4.024 -13.809 227 HB2 ASN 48 1HB ASN 48 -0.839 4.205 -16.040 228 HB3 ASN 48 2HB ASN 48 0.767 4.258 -16.767 229 HD21 ASN 48 1HD2 ASN 48 -0.767 2.078 -14.192 230 HD22 ASN 48 2HD2 ASN 48 -0.374 0.646 -15.107 231 H GLN 49 H GLN 49 2.293 5.404 -12.884 232 HA GLN 49 HA GLN 49 4.690 3.794 -13.657 233 HB2 GLN 49 1HB GLN 49 4.530 6.265 -11.923 234 HB3 GLN 49 2HB GLN 49 6.022 5.437 -12.346 235 HG2 GLN 49 1HG GLN 49 4.186 6.700 -14.392 236 HG3 GLN 49 2HG GLN 49 5.486 7.549 -13.594 237 HE21 GLN 49 1HE2 GLN 49 5.624 4.146 -14.973 238 HE22 GLN 49 2HE2 GLN 49 6.862 4.573 -16.109 239 H LEU 50 H LEU 50 2.294 3.269 -11.450 240 HA LEU 50 HA LEU 50 4.059 2.884 -9.117 241 HB2 LEU 50 1HB LEU 50 1.655 3.831 -8.957 242 HB3 LEU 50 2HB LEU 50 1.107 2.218 -9.339 243 HG LEU 50 HG LEU 50 2.541 1.424 -7.297 244 HD11 LEU 50 1HD1 LEU 50 3.040 3.103 -5.591 245 HD12 LEU 50 2HD1 LEU 50 2.431 4.408 -6.624 246 HD13 LEU 50 3HD1 LEU 50 3.907 3.531 -7.059 247 HD21 LEU 50 3HD2 LEU 50 0.809 2.177 -5.649 248 HD22 LEU 50 1HD2 LEU 50 0.134 1.514 -7.137 249 HD23 LEU 50 2HD2 LEU 50 0.164 3.275 -6.883 250 H VAL 51 H VAL 51 5.118 1.011 -8.764 251 HA VAL 51 HA VAL 51 4.198 -1.469 -10.109 252 HB VAL 51 HB VAL 51 6.995 -0.706 -9.188 253 HG11 VAL 51 1HG1 VAL 51 7.698 -2.715 -10.458 254 HG12 VAL 51 2HG1 VAL 51 6.626 -3.168 -9.146 255 HG13 VAL 51 3HG1 VAL 51 5.996 -3.114 -10.801 256 HG21 VAL 51 3HG2 VAL 51 6.374 0.623 -11.123 257 HG22 VAL 51 1HG2 VAL 51 7.440 -0.676 -11.672 258 HG23 VAL 51 2HG2 VAL 51 5.674 -0.800 -11.933 259 H TYR 52 H TYR 52 3.403 -2.937 -8.921 260 HA TYR 52 HA TYR 52 3.764 -3.239 -6.001 261 HB2 TYR 52 1HB TYR 52 1.464 -3.267 -6.743 262 HB3 TYR 52 2HB TYR 52 1.851 -4.180 -8.149 263 HD1 TYR 52 1HD TYR 52 2.175 -4.808 -4.406 264 HD2 TYR 52 2HD TYR 52 1.093 -6.240 -8.331 265 HE1 TYR 52 1HE TYR 52 1.307 -6.938 -3.425 266 HE2 TYR 52 2HE TYR 52 0.413 -8.387 -7.398 267 HH TYR 52 HH TYR 52 -0.191 -9.464 -5.452 268 H GLY 53 H GLY 53 4.628 -5.334 -5.259 269 HA2 GLY 53 1HA GLY 53 5.150 -7.467 -7.031 270 HA3 GLY 53 2HA GLY 53 6.626 -6.491 -6.850 271 H ILE 54 H ILE 54 6.926 -8.963 -6.022 272 HA ILE 54 HA ILE 54 6.538 -8.970 -3.097 273 HB ILE 54 HB ILE 54 6.606 -11.216 -5.134 274 HG12 ILE 54 1HG1 ILE 54 4.425 -10.051 -4.866 275 HG13 ILE 54 2HG1 ILE 54 4.398 -11.748 -4.440 276 HG21 ILE 54 1HG2 ILE 54 6.331 -12.843 -3.297 277 HG22 ILE 54 2HG2 ILE 54 7.873 -12.002 -3.177 278 HG23 ILE 54 3HG2 ILE 54 6.558 -11.557 -2.110 279 HD11 ILE 54 3HD1 ILE 54 3.042 -10.371 -2.892 280 HD12 ILE 54 1HD1 ILE 54 4.367 -11.162 -2.021 281 HD13 ILE 54 2HD1 ILE 54 4.480 -9.444 -2.443 282 H VAL 55 H VAL 55 8.198 -9.303 -1.900 283 HA VAL 55 HA VAL 55 10.732 -8.350 -2.558 284 HB VAL 55 HB VAL 55 9.495 -9.749 -0.163 285 HG11 VAL 55 1HG1 VAL 55 11.788 -10.381 0.161 286 HG12 VAL 55 2HG1 VAL 55 12.357 -8.785 -0.366 287 HG13 VAL 55 3HG1 VAL 55 11.483 -8.980 1.173 288 HG21 VAL 55 3HG2 VAL 55 8.847 -7.423 -0.812 289 HG22 VAL 55 1HG2 VAL 55 9.689 -7.459 0.764 290 HG23 VAL 55 2HG2 VAL 55 10.514 -6.937 -0.735 291 H LYS 56 H LYS 56 10.280 -11.754 -1.353 292 HA LYS 56 HA LYS 56 11.541 -13.573 -1.666 293 HB2 LYS 56 1HB LYS 56 11.765 -12.465 -4.474 294 HB3 LYS 56 2HB LYS 56 12.172 -14.105 -4.033 295 HG2 LYS 56 1HG LYS 56 9.621 -13.853 -2.938 296 HG3 LYS 56 2HG LYS 56 9.537 -12.815 -4.379 297 HD2 LYS 56 1HD LYS 56 10.415 -14.728 -5.720 298 HD3 LYS 56 2HD LYS 56 10.349 -15.734 -4.255 299 HE2 LYS 56 1HE LYS 56 7.983 -15.606 -4.109 300 HE3 LYS 56 2HE LYS 56 7.890 -14.270 -5.270 301 HZ1 LYS 56 3HZ LYS 56 8.507 -15.720 -7.016 302 HZ2 LYS 56 1HZ LYS 56 7.276 -16.467 -6.191 303 HZ3 LYS 56 2HZ LYS 56 8.839 -16.959 -5.993 304 HA PRO 57 HA PRO 57 15.859 -12.564 -1.005 305 HB2 PRO 57 1HB PRO 57 17.338 -14.626 -2.044 306 HB3 PRO 57 2HB PRO 57 16.404 -14.721 -0.524 307 HG2 PRO 57 1HG PRO 57 15.595 -15.685 -3.270 308 HG3 PRO 57 2HG PRO 57 15.430 -16.537 -1.708 309 HD2 PRO 57 1HD PRO 57 13.390 -15.207 -2.896 310 HD3 PRO 57 2HD PRO 57 13.531 -15.277 -1.136 311 H SER 58 H SER 58 14.447 -12.578 -4.060 312 HA SER 58 HA SER 58 16.733 -12.327 -5.741 313 HB2 SER 58 1HB SER 58 13.762 -11.855 -6.272 314 HB3 SER 58 2HB SER 58 15.031 -12.193 -7.476 315 HG SER 58 HG SER 58 15.403 -14.145 -6.013 316 H ASP 59 H ASP 59 15.677 -9.901 -3.667 317 HA ASP 59 HA ASP 59 16.989 -7.992 -5.434 318 HB2 ASP 59 1HB ASP 59 14.141 -7.736 -4.747 319 HB3 ASP 59 2HB ASP 59 15.049 -6.369 -4.182 320 H THR 60 H THR 60 17.023 -5.779 -3.896 321 HA THR 60 HA THR 60 18.454 -6.541 -1.441 322 HB THR 60 HB THR 60 19.422 -4.743 -2.761 323 HG1 THR 60 1HG THR 60 19.500 -4.543 -0.452 324 HG21 THR 60 3HG2 THR 60 18.256 -2.607 -3.085 325 HG22 THR 60 1HG2 THR 60 16.801 -3.265 -2.295 326 HG23 THR 60 2HG2 THR 60 17.336 -3.916 -3.857 327 H VAL 61 H VAL 61 17.477 -6.243 0.606 328 HA VAL 61 HA VAL 61 15.232 -4.524 0.923 329 HB VAL 61 HB VAL 61 13.884 -6.381 2.173 330 HG11 VAL 61 1HG1 VAL 61 12.333 -6.554 0.519 331 HG12 VAL 61 2HG1 VAL 61 13.176 -5.107 0.049 332 HG13 VAL 61 3HG1 VAL 61 13.521 -6.589 -0.813 333 HG21 VAL 61 3HG2 VAL 61 13.952 -8.606 1.285 334 HG22 VAL 61 1HG2 VAL 61 15.101 -8.124 -0.004 335 HG23 VAL 61 2HG2 VAL 61 15.610 -8.150 1.688 336 HA PRO 62 HA PRO 62 17.069 -4.569 5.010 337 HB2 PRO 62 1HB PRO 62 15.124 -3.441 6.559 338 HB3 PRO 62 2HB PRO 62 15.970 -2.534 5.274 339 HG2 PRO 62 1HG PRO 62 13.285 -3.894 5.116 340 HG3 PRO 62 2HG PRO 62 13.715 -2.239 4.600 341 HD2 PRO 62 1HD PRO 62 13.614 -4.340 2.859 342 HD3 PRO 62 2HD PRO 62 14.761 -3.004 2.643 343 H ALA 63 H ALA 63 16.348 -5.222 7.414 344 HA ALA 63 HA ALA 63 15.817 -8.043 7.277 345 HB1 ALA 63 1HB ALA 63 16.075 -6.183 9.699 346 HB2 ALA 63 2HB ALA 63 16.188 -7.970 9.707 347 HB3 ALA 63 3HB ALA 63 17.410 -7.016 8.851 348 H GLY 64 H GLY 64 14.170 -9.211 7.735 349 HA2 GLY 64 1HA GLY 64 12.129 -9.938 8.394 350 HA3 GLY 64 2HA GLY 64 12.081 -8.594 9.555 351 H VAL 65 H VAL 65 12.062 -8.948 5.991 352 HA VAL 65 HA VAL 65 9.247 -8.145 5.897 353 HB VAL 65 HB VAL 65 9.822 -6.659 3.787 354 HG11 VAL 65 1HG1 VAL 65 10.114 -5.538 6.555 355 HG12 VAL 65 2HG1 VAL 65 9.723 -4.648 5.064 356 HG13 VAL 65 3HG1 VAL 65 8.602 -5.873 5.698 357 HG21 VAL 65 3HG2 VAL 65 12.338 -6.151 5.420 358 HG22 VAL 65 1HG2 VAL 65 12.295 -7.057 3.892 359 HG23 VAL 65 2HG2 VAL 65 11.805 -5.353 3.916 360 H ASP 66 H ASP 66 10.639 -10.650 5.630 361 HA ASP 66 HA ASP 66 11.753 -11.241 3.233 362 HB2 ASP 66 1HB ASP 66 11.496 -13.628 3.867 363 HB3 ASP 66 2HB ASP 66 11.932 -12.600 5.220 364 H ASP 67 H ASP 67 8.528 -10.930 3.565 365 HA ASP 67 HA ASP 67 8.085 -11.400 0.714 366 HB2 ASP 67 1HB ASP 67 7.755 -13.668 2.032 367 HB3 ASP 67 2HB ASP 67 6.154 -13.008 2.376 368 H TYR 68 H TYR 68 7.962 -9.207 2.642 369 HA TYR 68 HA TYR 68 5.126 -8.461 2.955 370 HB2 TYR 68 1HB TYR 68 7.743 -7.155 3.614 371 HB3 TYR 68 2HB TYR 68 6.325 -6.166 3.376 372 HD1 TYR 68 2HD TYR 68 6.710 -9.564 5.042 373 HD2 TYR 68 1HD TYR 68 5.470 -5.436 5.380 374 HE1 TYR 68 2HE TYR 68 5.536 -10.100 7.109 375 HE2 TYR 68 1HE TYR 68 4.345 -5.928 7.464 376 HH TYR 68 HH TYR 68 3.892 -9.356 8.584 377 H SER 69 H SER 69 3.984 -8.010 1.066 378 HA SER 69 HA SER 69 5.018 -7.501 -1.424 379 HB2 SER 69 1HB SER 69 2.433 -6.429 -0.196 380 HB3 SER 69 2HB SER 69 2.732 -6.918 -1.871 381 HG SER 69 HG SER 69 1.583 -8.530 -0.634 382 H TYR 70 H TYR 70 5.592 -5.543 -2.545 383 HA TYR 70 HA TYR 70 5.645 -3.101 -0.833 384 HB2 TYR 70 1HB TYR 70 7.766 -2.471 -1.642 385 HB3 TYR 70 2HB TYR 70 7.876 -4.038 -0.917 386 HD1 TYR 70 2HD TYR 70 7.871 -6.133 -2.531 387 HD2 TYR 70 1HD TYR 70 8.700 -2.083 -3.791 388 HE1 TYR 70 2HE TYR 70 9.084 -6.991 -4.514 389 HE2 TYR 70 1HE TYR 70 9.918 -2.967 -5.767 390 HH TYR 70 HH TYR 70 10.543 -6.419 -6.299 391 H LEU 71 H LEU 71 5.816 -1.102 -1.946 392 HA LEU 71 HA LEU 71 4.615 -0.938 -4.629 393 HB2 LEU 71 1HB LEU 71 3.652 0.478 -2.109 394 HB3 LEU 71 2HB LEU 71 3.332 1.096 -3.720 395 HG LEU 71 HG LEU 71 2.457 -1.686 -2.853 396 HD11 LEU 71 1HD1 LEU 71 1.432 0.056 -1.443 397 HD12 LEU 71 2HD1 LEU 71 0.247 -0.723 -2.507 398 HD13 LEU 71 3HD1 LEU 71 0.861 0.906 -2.891 399 HD21 LEU 71 3HD2 LEU 71 0.863 -1.349 -4.807 400 HD22 LEU 71 1HD2 LEU 71 2.567 -1.471 -5.275 401 HD23 LEU 71 2HD2 LEU 71 1.771 0.104 -5.227 402 H VAL 72 H VAL 72 5.657 0.567 -5.795 403 HA VAL 72 HA VAL 72 7.369 2.624 -4.686 404 HB VAL 72 HB VAL 72 8.495 0.443 -4.289 405 HG11 VAL 72 1HG1 VAL 72 8.421 0.051 -7.267 406 HG12 VAL 72 2HG1 VAL 72 9.404 -0.865 -6.122 407 HG13 VAL 72 3HG1 VAL 72 7.640 -0.918 -5.989 408 HG21 VAL 72 3HG2 VAL 72 9.910 2.447 -4.736 409 HG22 VAL 72 1HG2 VAL 72 10.669 0.889 -5.095 410 HG23 VAL 72 2HG2 VAL 72 10.060 1.861 -6.427 411 H ALA 73 H ALA 73 8.472 3.634 -6.840 412 HA ALA 73 HA ALA 73 6.410 3.722 -8.962 413 HB1 ALA 73 1HB ALA 73 7.569 5.813 -8.111 414 HB2 ALA 73 2HB ALA 73 9.075 5.177 -8.808 415 HB3 ALA 73 3HB ALA 73 7.696 5.552 -9.854 416 H ALA 74 H ALA 74 7.653 3.710 -11.255 417 HA ALA 74 HA ALA 74 9.553 1.411 -11.369 418 HB1 ALA 74 1HB ALA 74 7.824 1.365 -13.041 419 HB2 ALA 74 2HB ALA 74 8.188 3.037 -13.557 420 HB3 ALA 74 3HB ALA 74 9.348 1.723 -13.842 421 H ASP 75 H ASP 75 9.643 4.790 -11.068 422 HA ASP 75 HA ASP 75 12.303 5.023 -12.363 423 HB2 ASP 75 1HB ASP 75 10.033 5.636 -13.717 424 HB3 ASP 75 2HB ASP 75 10.326 7.183 -12.954 425 H ASP 76 H ASP 76 11.335 5.063 -9.536 426 HA ASP 76 HA ASP 76 12.755 7.532 -8.666 427 HB2 ASP 76 1HB ASP 76 10.136 6.585 -7.424 428 HB3 ASP 76 2HB ASP 76 11.210 7.805 -6.780 429 H GLN 77 H GLN 77 13.716 4.711 -8.941 430 HA GLN 77 HA GLN 77 12.838 3.105 -6.822 431 HB2 GLN 77 1HB GLN 77 15.372 2.876 -8.483 432 HB3 GLN 77 2HB GLN 77 14.914 1.705 -7.250 433 HG2 GLN 77 1HG GLN 77 12.706 1.382 -8.438 434 HG3 GLN 77 2HG GLN 77 13.364 2.323 -9.783 435 HE21 GLN 77 1HE2 GLN 77 12.610 -0.770 -9.244 436 HE22 GLN 77 2HE2 GLN 77 14.033 -1.604 -9.784 437 H ASP 78 H ASP 78 15.120 5.692 -6.485 438 HA ASP 78 HA ASP 78 16.191 4.625 -3.941 439 HB2 ASP 78 1HB ASP 78 17.919 6.192 -4.181 440 HB3 ASP 78 2HB ASP 78 17.661 5.587 -5.820 441 H GLY 79 H GLY 79 13.485 6.259 -4.822 442 HA2 GLY 79 1HA GLY 79 13.637 8.536 -2.973 443 HA3 GLY 79 2HA GLY 79 12.376 8.181 -4.157 444 H THR 80 H THR 80 10.443 7.948 -3.065 445 HA THR 80 HA THR 80 10.294 6.878 -0.358 446 HB THR 80 HB THR 80 8.078 7.219 -2.418 447 HG1 THR 80 1HG THR 80 8.972 9.074 -0.413 448 HG21 THR 80 3HG2 THR 80 6.670 7.688 -0.374 449 HG22 THR 80 1HG2 THR 80 8.040 7.093 0.610 450 HG23 THR 80 2HG2 THR 80 7.209 6.018 -0.550 451 H ILE 81 H ILE 81 9.221 4.804 0.185 452 HA ILE 81 HA ILE 81 8.360 3.081 -1.954 453 HB ILE 81 HB ILE 81 10.903 2.647 -1.600 454 HG12 ILE 81 1HG1 ILE 81 8.942 0.333 -1.305 455 HG13 ILE 81 2HG1 ILE 81 9.602 1.083 -2.718 456 HG21 ILE 81 1HG2 ILE 81 10.160 1.134 0.893 457 HG22 ILE 81 2HG2 ILE 81 11.757 1.574 0.283 458 HG23 ILE 81 3HG2 ILE 81 10.734 2.832 0.980 459 HD11 ILE 81 3HD1 ILE 81 11.885 0.337 -2.137 460 HD12 ILE 81 1HD1 ILE 81 11.227 -0.512 -0.725 461 HD13 ILE 81 2HD1 ILE 81 10.746 -1.008 -2.360 462 H ILE 82 H ILE 82 6.944 1.354 -0.931 463 HA ILE 82 HA ILE 82 6.468 1.655 1.987 464 HB ILE 82 HB ILE 82 4.289 1.609 -0.121 465 HG12 ILE 82 1HG1 ILE 82 5.094 3.981 1.673 466 HG13 ILE 82 2HG1 ILE 82 5.446 3.821 -0.048 467 HG21 ILE 82 1HG2 ILE 82 4.115 1.790 2.933 468 HG22 ILE 82 2HG2 ILE 82 2.749 1.968 1.821 469 HG23 ILE 82 3HG2 ILE 82 3.590 0.442 1.909 470 HD11 ILE 82 3HD1 ILE 82 2.745 4.159 1.211 471 HD12 ILE 82 1HD1 ILE 82 3.617 5.196 0.055 472 HD13 ILE 82 2HD1 ILE 82 2.999 3.622 -0.474 473 H PHE 83 H PHE 83 5.918 -0.355 2.955 474 HA PHE 83 HA PHE 83 5.791 -2.754 1.219 475 HB2 PHE 83 1HB PHE 83 7.236 -2.390 3.875 476 HB3 PHE 83 2HB PHE 83 6.844 -3.935 3.202 477 HD1 PHE 83 2HD PHE 83 8.892 -0.860 2.656 478 HD2 PHE 83 1HD PHE 83 8.276 -4.982 1.553 479 HE1 PHE 83 2HE PHE 83 11.169 -0.946 1.689 480 HE2 PHE 83 1HE PHE 83 10.541 -5.042 0.576 481 HZ PHE 83 HZ PHE 83 12.013 -3.038 0.683 482 H PHE 84 H PHE 84 4.286 -4.361 2.140 483 HA PHE 84 HA PHE 84 3.127 -3.849 4.715 484 HB2 PHE 84 1HB PHE 84 0.803 -3.726 4.034 485 HB3 PHE 84 2HB PHE 84 1.669 -2.393 3.307 486 HD1 PHE 84 2HD PHE 84 2.350 -2.551 0.815 487 HD2 PHE 84 1HD PHE 84 -0.432 -5.280 2.680 488 HE1 PHE 84 2HE PHE 84 1.492 -3.217 -1.414 489 HE2 PHE 84 1HE PHE 84 -1.286 -5.923 0.435 490 HZ PHE 84 HZ PHE 84 -0.323 -4.892 -1.604 491 H LYS 85 H LYS 85 1.928 -5.778 5.459 492 HA LYS 85 HA LYS 85 1.476 -7.831 3.401 493 HB2 LYS 85 1HB LYS 85 3.650 -8.289 4.920 494 HB3 LYS 85 2HB LYS 85 2.427 -8.969 5.975 495 HG2 LYS 85 1HG LYS 85 1.512 -10.029 3.677 496 HG3 LYS 85 2HG LYS 85 3.186 -9.782 3.141 497 HD2 LYS 85 1HD LYS 85 3.980 -11.199 5.009 498 HD3 LYS 85 2HD LYS 85 2.324 -11.178 5.670 499 HE2 LYS 85 1HE LYS 85 1.540 -12.257 3.514 500 HE3 LYS 85 2HE LYS 85 3.233 -12.550 3.100 501 HZ1 LYS 85 3HZ LYS 85 3.410 -14.007 4.977 502 HZ2 LYS 85 1HZ LYS 85 1.958 -14.376 4.286 503 HZ3 LYS 85 2HZ LYS 85 2.037 -13.449 5.653 504 H ALA 86 H ALA 86 -0.643 -7.974 3.488 505 HA ALA 86 HA ALA 86 -2.083 -7.731 6.080 506 HB1 ALA 86 1HB ALA 86 -3.309 -6.593 4.549 507 HB2 ALA 86 2HB ALA 86 -3.014 -7.807 3.245 508 HB3 ALA 86 3HB ALA 86 -4.085 -8.175 4.623 509 H GLU 87 H GLU 87 -3.157 -9.520 6.769 510 HA GLU 87 HA GLU 87 -2.512 -12.235 5.799 511 HB2 GLU 87 1HB GLU 87 -1.851 -11.107 8.563 512 HB3 GLU 87 2HB GLU 87 -1.844 -12.820 8.125 513 HG2 GLU 87 1HG GLU 87 -0.194 -11.993 6.210 514 HG3 GLU 87 2HG GLU 87 0.082 -10.651 7.323 515 H GLY 88 H GLY 88 -3.619 -13.214 8.439 516 HA2 GLY 88 1HA GLY 88 -6.358 -13.453 7.578 517 HA3 GLY 88 2HA GLY 88 -5.649 -14.114 9.050 518 H GLN 89 H GLN 89 -7.009 -11.322 7.546 519 HA GLN 89 HA GLN 89 -8.263 -9.597 8.204 520 HB2 GLN 89 1HB GLN 89 -8.607 -10.926 10.892 521 HB3 GLN 89 2HB GLN 89 -9.594 -9.634 10.218 522 HG2 GLN 89 1HG GLN 89 -9.442 -12.513 9.280 523 HG3 GLN 89 2HG GLN 89 -10.798 -11.693 10.035 524 HE21 GLN 89 1HE2 GLN 89 -9.367 -12.524 7.032 525 HE22 GLN 89 2HE2 GLN 89 -10.302 -11.481 5.993 526 H THR 90 H THR 90 -5.217 -9.779 8.975 527 HA THR 90 HA THR 90 -5.244 -7.228 10.425 528 HB THR 90 HB THR 90 -2.830 -8.934 10.903 529 HG1 THR 90 1HG THR 90 -3.766 -9.930 12.701 530 HG21 THR 90 3HG2 THR 90 -3.039 -6.678 11.867 531 HG22 THR 90 1HG2 THR 90 -2.984 -7.897 13.145 532 HG23 THR 90 2HG2 THR 90 -4.540 -7.159 12.697 533 H VAL 91 H VAL 91 -3.211 -5.928 9.891 534 HA VAL 91 HA VAL 91 -1.486 -6.990 7.816 535 HB VAL 91 HB VAL 91 -3.312 -5.783 6.646 536 HG11 VAL 91 1HG1 VAL 91 -3.725 -3.622 6.534 537 HG12 VAL 91 2HG1 VAL 91 -3.925 -4.180 8.194 538 HG13 VAL 91 3HG1 VAL 91 -2.496 -3.201 7.788 539 HG21 VAL 91 3HG2 VAL 91 -2.043 -4.371 5.104 540 HG22 VAL 91 1HG2 VAL 91 -0.852 -3.980 6.356 541 HG23 VAL 91 2HG2 VAL 91 -0.888 -5.569 5.649 542 H ILE 92 H ILE 92 0.594 -6.143 8.027 543 HA ILE 92 HA ILE 92 0.979 -3.853 9.830 544 HB ILE 92 HB ILE 92 2.728 -6.098 8.768 545 HG12 ILE 92 1HG1 ILE 92 2.906 -6.715 11.146 546 HG13 ILE 92 2HG1 ILE 92 1.588 -5.638 11.571 547 HG21 ILE 92 1HG2 ILE 92 3.765 -3.688 9.393 548 HG22 ILE 92 2HG2 ILE 92 3.576 -4.280 11.045 549 HG23 ILE 92 3HG2 ILE 92 4.559 -5.179 9.894 550 HD11 ILE 92 3HD1 ILE 92 1.113 -8.114 11.456 551 HD12 ILE 92 1HD1 ILE 92 0.026 -7.167 10.481 552 HD13 ILE 92 2HD1 ILE 92 1.367 -8.045 9.699 553 H ILE 93 H ILE 93 1.034 -2.015 8.589 554 HA ILE 93 HA ILE 93 2.177 -2.045 5.848 555 HB ILE 93 HB ILE 93 1.259 0.452 7.284 556 HG12 ILE 93 1HG1 ILE 93 -0.561 -1.207 5.500 557 HG13 ILE 93 2HG1 ILE 93 -0.742 -1.127 7.258 558 HG21 ILE 93 1HG2 ILE 93 2.704 0.526 5.198 559 HG22 ILE 93 2HG2 ILE 93 1.401 -0.285 4.323 560 HG23 ILE 93 3HG2 ILE 93 1.154 1.325 4.996 561 HD11 ILE 93 3HD1 ILE 93 -1.220 1.222 7.213 562 HD12 ILE 93 1HD1 ILE 93 -0.960 1.313 5.459 563 HD13 ILE 93 2HD1 ILE 93 -2.299 0.365 6.095 564 H LYS 94 H LYS 94 4.292 -1.622 5.649 565 HA LYS 94 HA LYS 94 5.859 -0.453 7.907 566 HB2 LYS 94 1HB LYS 94 6.464 -2.719 5.976 567 HB3 LYS 94 2HB LYS 94 7.716 -1.853 6.788 568 HG2 LYS 94 1HG LYS 94 6.658 -2.413 8.998 569 HG3 LYS 94 2HG LYS 94 5.557 -3.490 8.111 570 HD2 LYS 94 1HD LYS 94 7.345 -4.902 7.392 571 HD3 LYS 94 2HD LYS 94 8.580 -3.693 7.832 572 HE2 LYS 94 1HE LYS 94 7.849 -3.913 10.219 573 HE3 LYS 94 2HE LYS 94 6.821 -5.280 9.746 574 HZ1 LYS 94 3HZ LYS 94 9.753 -5.209 9.320 575 HZ2 LYS 94 1HZ LYS 94 8.751 -6.463 9.034 576 HZ3 LYS 94 2HZ LYS 94 9.002 -5.963 10.576 577 H TYR 95 H TYR 95 6.188 1.681 7.250 578 HA TYR 95 HA TYR 95 7.112 2.148 4.461 579 HB2 TYR 95 1HB TYR 95 5.922 4.303 4.578 580 HB3 TYR 95 2HB TYR 95 4.889 2.890 4.589 581 HD1 TYR 95 1HD TYR 95 3.728 2.116 6.565 582 HD2 TYR 95 2HD TYR 95 5.959 5.795 6.547 583 HE1 TYR 95 1HE TYR 95 2.734 2.723 8.748 584 HE2 TYR 95 2HE TYR 95 4.861 6.488 8.669 585 HH TYR 95 HH TYR 95 2.908 5.943 10.046 586 H THR 96 H THR 96 8.330 4.351 4.306 587 HA THR 96 HA THR 96 9.604 5.360 6.684 588 HB THR 96 HB THR 96 10.929 3.299 6.279 589 HG1 THR 96 1HG THR 96 12.895 4.297 6.235 590 HG21 THR 96 3HG2 THR 96 10.652 3.059 3.836 591 HG22 THR 96 1HG2 THR 96 12.351 3.087 4.297 592 HG23 THR 96 2HG2 THR 96 11.601 4.518 3.563 593 H SER 97 H SER 97 10.984 7.204 6.041 594 HA SER 97 HA SER 97 9.995 8.503 3.596 595 HB2 SER 97 1HB SER 97 11.310 10.445 4.378 596 HB3 SER 97 2HB SER 97 10.063 9.920 5.510 597 HG SER 97 HG SER 97 12.831 9.890 5.754 598 H GLN 98 H GLN 98 12.533 6.520 4.469 599 HA GLN 98 HA GLN 98 13.764 7.014 1.850 600 HB2 GLN 98 1HB GLN 98 15.319 7.488 4.418 601 HB3 GLN 98 2HB GLN 98 16.127 6.932 2.940 602 HG2 GLN 98 1HG GLN 98 14.995 8.815 1.718 603 HG3 GLN 98 2HG GLN 98 14.544 9.497 3.282 604 HE21 GLN 98 1HE2 GLN 98 16.227 10.580 1.175 605 HE22 GLN 98 2HE2 GLN 98 17.810 10.883 1.857 606 H ARG 99 H ARG 99 14.498 5.400 0.879 607 HA ARG 99 HA ARG 99 13.876 2.771 1.338 608 HB2 ARG 99 1HB ARG 99 14.694 4.231 -0.710 609 HB3 ARG 99 2HB ARG 99 16.285 3.653 -0.305 610 HG2 ARG 99 1HG ARG 99 13.998 1.711 -0.831 611 HG3 ARG 99 2HG ARG 99 14.739 2.608 -2.146 612 HD2 ARG 99 1HD ARG 99 17.007 1.674 -1.345 613 HD3 ARG 99 2HD ARG 99 16.061 0.526 -0.399 614 HE ARG 99 HE ARG 99 15.240 -0.471 -2.385 615 HH11 ARG 99 1HH1 ARG 99 17.359 2.316 -3.269 616 HH12 ARG 99 2HH1 ARG 99 17.494 1.779 -4.890 617 HH21 ARG 99 1HH2 ARG 99 15.303 -0.983 -4.500 618 HH22 ARG 99 2HH2 ARG 99 16.318 -0.189 -5.658 619 H ASN 100 H ASN 100 16.820 4.427 2.121 620 HA ASN 100 HA ASN 100 18.189 2.050 3.002 621 HB2 ASN 100 1HB ASN 100 19.115 4.931 3.160 622 HB3 ASN 100 2HB ASN 100 20.075 3.565 3.670 623 HD21 ASN 100 1HD2 ASN 100 18.536 4.960 0.864 624 HD22 ASN 100 2HD2 ASN 100 19.994 4.725 -0.059 625 H THR 101 H THR 101 15.801 3.325 4.611 626 HA THR 101 HA THR 101 17.106 3.150 7.300 627 HB THR 101 HB THR 101 16.050 5.175 8.078 628 HG1 THR 101 1HG THR 101 14.965 5.243 5.510 629 HG21 THR 101 3HG2 THR 101 18.354 5.299 7.159 630 HG22 THR 101 1HG2 THR 101 17.484 6.819 6.980 631 HG23 THR 101 2HG2 THR 101 17.692 5.768 5.576 632 H LYS 102 H LYS 102 16.035 2.118 8.817 633 HA LYS 102 HA LYS 102 14.226 0.294 8.081 634 HB2 LYS 102 1HB LYS 102 15.548 0.928 10.478 635 HB3 LYS 102 2HB LYS 102 13.867 0.882 10.959 636 HG2 LYS 102 1HG LYS 102 15.429 -1.317 9.552 637 HG3 LYS 102 2HG LYS 102 15.023 -1.279 11.264 638 HD2 LYS 102 1HD LYS 102 13.075 -1.612 8.956 639 HD3 LYS 102 2HD LYS 102 13.672 -2.888 9.973 640 HE2 LYS 102 1HE LYS 102 12.328 -0.644 11.443 641 HE3 LYS 102 2HE LYS 102 11.297 -1.575 10.360 642 HZ1 LYS 102 3HZ LYS 102 12.063 -3.602 11.510 643 HZ2 LYS 102 1HZ LYS 102 11.249 -2.549 12.496 644 HZ3 LYS 102 2HZ LYS 102 12.891 -2.700 12.574 645 H LEU 103 H LEU 103 12.134 -0.209 8.390 646 HA LEU 103 HA LEU 103 10.305 1.843 7.750 647 HB2 LEU 103 1HB LEU 103 9.725 -1.071 8.452 648 HB3 LEU 103 2HB LEU 103 8.648 0.013 7.608 649 HG LEU 103 HG LEU 103 9.500 -1.284 5.904 650 HD11 LEU 103 1HD1 LEU 103 10.674 0.083 4.442 651 HD12 LEU 103 2HD1 LEU 103 11.434 1.030 5.746 652 HD13 LEU 103 3HD1 LEU 103 9.684 1.157 5.429 653 HD21 LEU 103 3HD2 LEU 103 12.411 -0.976 6.595 654 HD22 LEU 103 1HD2 LEU 103 11.580 -2.128 5.545 655 HD23 LEU 103 2HD2 LEU 103 11.398 -2.271 7.294 656 H LYS 104 H LYS 104 8.205 2.175 8.721 657 HA LYS 104 HA LYS 104 8.099 2.389 11.668 658 HB2 LYS 104 1HB LYS 104 6.286 3.283 9.358 659 HB3 LYS 104 2HB LYS 104 5.748 3.335 11.023 660 HG2 LYS 104 1HG LYS 104 6.426 5.472 10.745 661 HG3 LYS 104 2HG LYS 104 7.810 4.739 11.558 662 HD2 LYS 104 1HD LYS 104 8.948 4.553 9.304 663 HD3 LYS 104 2HD LYS 104 7.527 5.296 8.560 664 HE2 LYS 104 1HE LYS 104 9.241 6.971 8.864 665 HE3 LYS 104 2HE LYS 104 7.889 7.341 9.935 666 HZ1 LYS 104 3HZ LYS 104 9.113 6.501 11.775 667 HZ2 LYS 104 1HZ LYS 104 10.141 7.473 10.961 668 HZ3 LYS 104 2HZ LYS 104 10.276 5.841 10.834 669 H ALA 105 H ALA 105 5.771 1.808 12.498 670 HA ALA 105 HA ALA 105 4.788 -0.784 11.432 671 HB1 ALA 105 1HB ALA 105 6.040 -1.259 13.481 672 HB2 ALA 105 2HB ALA 105 5.222 0.071 14.339 673 HB3 ALA 105 3HB ALA 105 4.305 -1.352 13.849 674 H LYS 106 H LYS 106 2.777 -0.356 10.634 675 HA LYS 106 HA LYS 106 0.781 1.086 12.309 676 HB2 LYS 106 1HB LYS 106 1.343 2.522 10.399 677 HB3 LYS 106 2HB LYS 106 1.091 1.163 9.307 678 HG2 LYS 106 1HG LYS 106 -0.760 2.521 9.077 679 HG3 LYS 106 2HG LYS 106 -1.344 1.150 10.017 680 HD2 LYS 106 1HD LYS 106 -1.615 2.465 11.963 681 HD3 LYS 106 2HD LYS 106 -0.392 3.649 11.449 682 HE2 LYS 106 1HE LYS 106 -1.880 4.409 9.615 683 HE3 LYS 106 2HE LYS 106 -3.146 3.298 10.170 684 HZ1 LYS 106 3HZ LYS 106 -2.018 5.542 11.749 685 HZ2 LYS 106 1HZ LYS 106 -3.192 4.511 12.263 686 HZ3 LYS 106 2HZ LYS 106 -3.505 5.497 11.020 687 H ALA 107 H ALA 107 -0.844 -0.516 12.811 688 HA ALA 107 HA ALA 107 -0.840 -2.877 11.030 689 HB1 ALA 107 1HB ALA 107 -1.034 -2.971 14.066 690 HB2 ALA 107 2HB ALA 107 -1.384 -4.333 12.980 691 HB3 ALA 107 3HB ALA 107 0.248 -3.688 13.058 692 H LEU 108 H LEU 108 -3.055 -3.466 10.266 693 HA LEU 108 HA LEU 108 -5.195 -1.991 11.775 694 HB2 LEU 108 1HB LEU 108 -4.652 -1.942 8.792 695 HB3 LEU 108 2HB LEU 108 -6.060 -1.210 9.583 696 HG LEU 108 HG LEU 108 -3.166 -0.391 10.151 697 HD11 LEU 108 1HD1 LEU 108 -3.645 -0.059 7.802 698 HD12 LEU 108 2HD1 LEU 108 -3.395 1.454 8.684 699 HD13 LEU 108 3HD1 LEU 108 -5.049 0.962 8.228 700 HD21 LEU 108 3HD2 LEU 108 -4.105 1.666 11.040 701 HD22 LEU 108 1HD2 LEU 108 -4.787 0.294 11.892 702 HD23 LEU 108 2HD2 LEU 108 -5.750 1.133 10.651 703 H THR 109 H THR 109 -7.376 -3.147 11.510 704 HA THR 109 HA THR 109 -6.967 -5.894 10.556 705 HB THR 109 HB THR 109 -9.446 -6.195 11.191 706 HG1 THR 109 1HG THR 109 -10.068 -4.794 12.863 707 HG21 THR 109 3HG2 THR 109 -7.443 -5.413 13.399 708 HG22 THR 109 1HG2 THR 109 -7.435 -6.970 12.562 709 HG23 THR 109 2HG2 THR 109 -8.817 -6.528 13.561 710 H LEU 110 H LEU 110 -8.042 -6.833 8.752 711 HA LEU 110 HA LEU 110 -8.237 -5.218 6.523 712 HB2 LEU 110 1HB LEU 110 -9.520 -7.906 7.229 713 HB3 LEU 110 2HB LEU 110 -9.771 -7.157 5.673 714 HG LEU 110 HG LEU 110 -7.068 -7.988 6.785 715 HD11 LEU 110 1HD1 LEU 110 -8.494 -9.871 6.041 716 HD12 LEU 110 2HD1 LEU 110 -7.096 -9.646 4.992 717 HD13 LEU 110 3HD1 LEU 110 -8.698 -9.102 4.458 718 HD21 LEU 110 3HD2 LEU 110 -7.836 -6.711 4.117 719 HD22 LEU 110 1HD2 LEU 110 -6.277 -7.497 4.467 720 HD23 LEU 110 2HD2 LEU 110 -6.723 -6.046 5.333 721 H SER 111 H SER 111 -10.792 -6.144 8.712 722 HA SER 111 HA SER 111 -12.958 -4.970 7.352 723 HB2 SER 111 1HB SER 111 -12.598 -6.613 9.467 724 HB3 SER 111 2HB SER 111 -12.810 -5.137 10.368 725 HG SER 111 HG SER 111 -14.827 -6.009 10.075 726 H GLN 112 H GLN 112 -10.575 -3.557 9.731 727 HA GLN 112 HA GLN 112 -11.693 -1.083 10.088 728 HB2 GLN 112 1HB GLN 112 -9.471 -2.447 10.914 729 HB3 GLN 112 2HB GLN 112 -8.710 -1.277 9.871 730 HG2 GLN 112 1HG GLN 112 -10.754 -0.428 11.919 731 HG3 GLN 112 2HG GLN 112 -9.118 -0.855 12.429 732 HE21 GLN 112 1HE2 GLN 112 -10.590 1.232 9.763 733 HE22 GLN 112 2HE2 GLN 112 -9.234 2.339 9.881 734 H LEU 113 H LEU 113 -9.203 -2.006 7.600 735 HA LEU 113 HA LEU 113 -9.080 0.589 6.365 736 HB2 LEU 113 1HB LEU 113 -8.563 -2.244 5.375 737 HB3 LEU 113 2HB LEU 113 -8.575 -0.926 4.225 738 HG LEU 113 HG LEU 113 -6.736 -0.958 6.610 739 HD11 LEU 113 1HD1 LEU 113 -6.100 -1.711 3.712 740 HD12 LEU 113 2HD1 LEU 113 -6.317 -2.884 4.993 741 HD13 LEU 113 3HD1 LEU 113 -4.975 -1.720 5.082 742 HD21 LEU 113 3HD2 LEU 113 -5.735 0.936 5.820 743 HD22 LEU 113 1HD2 LEU 113 -7.311 1.246 5.104 744 HD23 LEU 113 2HD2 LEU 113 -6.013 0.556 4.135 745 H LYS 114 H LYS 114 -11.381 -2.067 5.992 746 HA LYS 114 HA LYS 114 -12.783 -0.948 3.735 747 HB2 LYS 114 1HB LYS 114 -12.652 -3.393 4.548 748 HB3 LYS 114 2HB LYS 114 -13.868 -2.957 5.756 749 HG2 LYS 114 1HG LYS 114 -15.474 -2.348 3.975 750 HG3 LYS 114 2HG LYS 114 -14.211 -2.475 2.772 751 HD2 LYS 114 1HD LYS 114 -15.208 -4.703 4.637 752 HD3 LYS 114 2HD LYS 114 -15.933 -4.391 3.049 753 HE2 LYS 114 1HE LYS 114 -13.224 -4.551 2.433 754 HE3 LYS 114 2HE LYS 114 -13.393 -5.770 3.713 755 HZ1 LYS 114 3HZ LYS 114 -15.154 -6.783 2.378 756 HZ2 LYS 114 1HZ LYS 114 -13.751 -6.650 1.492 757 HZ3 LYS 114 2HZ LYS 114 -14.957 -5.616 1.212 758 H LYS 115 H LYS 115 -12.563 0.432 6.608 759 HA LYS 115 HA LYS 115 -15.322 1.553 6.609 760 HB2 LYS 115 1HB LYS 115 -13.798 0.042 8.629 761 HB3 LYS 115 2HB LYS 115 -13.968 1.668 9.172 762 HG2 LYS 115 1HG LYS 115 -16.030 1.103 9.896 763 HG3 LYS 115 2HG LYS 115 -16.560 1.003 8.230 764 HD2 LYS 115 1HD LYS 115 -15.342 -1.287 9.840 765 HD3 LYS 115 2HD LYS 115 -17.068 -1.037 9.601 766 HE2 LYS 115 1HE LYS 115 -15.072 -1.518 7.346 767 HE3 LYS 115 2HE LYS 115 -16.027 -2.787 8.069 768 HZ1 LYS 115 3HZ LYS 115 -17.635 -0.573 7.245 769 HZ2 LYS 115 1HZ LYS 115 -17.807 -2.166 6.921 770 HZ3 LYS 115 2HZ LYS 115 -16.781 -1.184 6.016 771 H GLU 116 H GLU 116 -11.868 2.161 7.149 772 HA GLU 116 HA GLU 116 -12.111 5.034 6.956 773 HB2 GLU 116 1HB GLU 116 -9.692 4.725 6.092 774 HB3 GLU 116 2HB GLU 116 -9.999 4.509 7.690 775 HG2 GLU 116 1HG GLU 116 -10.110 2.163 7.536 776 HG3 GLU 116 2HG GLU 116 -9.445 2.389 5.906 777 H PHE 117 H PHE 117 -10.503 3.029 4.533 778 HA PHE 117 HA PHE 117 -11.281 5.107 2.657 779 HB2 PHE 117 1HB PHE 117 -9.308 2.814 2.563 780 HB3 PHE 117 2HB PHE 117 -9.508 4.031 1.310 781 HD1 PHE 117 1HD PHE 117 -8.960 6.434 1.777 782 HD2 PHE 117 2HD PHE 117 -8.273 3.449 4.821 783 HE1 PHE 117 1HE PHE 117 -7.456 7.969 2.994 784 HE2 PHE 117 2HE PHE 117 -6.680 4.876 5.885 785 HZ PHE 117 HZ PHE 117 -6.284 7.208 5.034 786 H TYR 118 H TYR 118 -13.138 3.005 3.600 787 HA TYR 118 HA TYR 118 -14.326 2.595 0.969 788 HB2 TYR 118 1HB TYR 118 -12.834 0.487 1.624 789 HB3 TYR 118 2HB TYR 118 -14.320 0.012 2.438 790 HD1 TYR 118 1HD TYR 118 -12.970 1.136 -0.909 791 HD2 TYR 118 2HD TYR 118 -16.144 -0.953 1.153 792 HE1 TYR 118 1HE TYR 118 -13.661 0.078 -3.086 793 HE2 TYR 118 2HE TYR 118 -16.778 -2.039 -0.944 794 HH TYR 118 HH TYR 118 -14.677 -2.037 -3.730 795 H GLN 119 H GLN 119 -15.947 3.898 1.589 796 HA GLN 119 HA GLN 119 -17.872 2.890 3.620 797 HB2 GLN 119 1HB GLN 119 -18.352 5.244 4.189 798 HB3 GLN 119 2HB GLN 119 -16.697 4.736 4.515 799 HG2 GLN 119 1HG GLN 119 -16.721 5.860 1.873 800 HG3 GLN 119 2HG GLN 119 -17.566 6.967 2.951 801 HE21 GLN 119 1HE2 GLN 119 -14.513 6.356 1.664 802 HE22 GLN 119 2HE2 GLN 119 -13.552 6.586 3.125 803 H THR 120 H THR 120 -17.684 4.518 0.396 804 HA THR 120 HA THR 120 -20.656 4.338 0.248 805 HB THR 120 HB THR 120 -20.057 6.573 0.798 806 HG1 THR 120 1HG THR 120 -20.915 7.639 -0.922 807 HG21 THR 120 3HG2 THR 120 -17.712 6.688 0.218 808 HG22 THR 120 1HG2 THR 120 -18.576 7.996 -0.571 809 HG23 THR 120 2HG2 THR 120 -18.097 6.580 -1.519 810 H ARG 121 H ARG 121 -21.559 3.901 -1.814 811 HA ARG 121 HA ARG 121 -20.033 1.947 -3.267 812 HB2 ARG 121 1HB ARG 121 -22.709 3.298 -3.747 813 HB3 ARG 121 2HB ARG 121 -22.085 2.020 -4.807 814 HG2 ARG 121 1HG ARG 121 -22.236 0.364 -3.187 815 HG3 ARG 121 2HG ARG 121 -22.004 1.470 -1.839 816 HD2 ARG 121 1HD ARG 121 -24.188 0.797 -1.640 817 HD3 ARG 121 2HD ARG 121 -24.309 2.426 -2.310 818 HE ARG 121 HE ARG 121 -24.449 1.133 -4.578 819 HH11 ARG 121 1HH1 ARG 121 -25.998 0.014 -1.528 820 HH12 ARG 121 2HH1 ARG 121 -27.215 -0.865 -2.364 821 HH21 ARG 121 1HH2 ARG 121 -25.974 -0.009 -5.600 822 HH22 ARG 121 2HH2 ARG 121 -27.093 -1.060 -4.742 823 H SER 122 H SER 122 -20.750 5.371 -4.108 824 HA SER 122 HA SER 122 -19.619 5.185 -6.689 825 HB2 SER 122 1HB SER 122 -20.986 7.086 -5.838 826 HB3 SER 122 2HB SER 122 -19.630 7.568 -4.790 827 HG SER 122 HG SER 122 -18.554 7.318 -7.121 828 H GLN 123 H GLN 123 -17.855 5.022 -3.606 829 HA GLN 123 HA GLN 123 -15.411 6.128 -4.636 830 HB2 GLN 123 1HB GLN 123 -14.464 5.437 -2.644 831 HB3 GLN 123 2HB GLN 123 -16.153 5.605 -2.228 832 HG2 GLN 123 1HG GLN 123 -16.113 2.945 -2.897 833 HG3 GLN 123 2HG GLN 123 -14.430 3.138 -2.397 834 HE21 GLN 123 1HE2 GLN 123 -16.297 1.449 -1.065 835 HE22 GLN 123 2HE2 GLN 123 -16.851 2.188 0.414 836 H LYS 124 H LYS 124 -17.022 3.132 -5.115 837 HA LYS 124 HA LYS 124 -14.926 1.270 -5.550 838 HB2 LYS 124 1HB LYS 124 -17.733 1.490 -6.734 839 HB3 LYS 124 2HB LYS 124 -16.698 0.085 -6.928 840 HG2 LYS 124 1HG LYS 124 -16.584 -0.281 -4.579 841 HG3 LYS 124 2HG LYS 124 -17.540 1.152 -4.191 842 HD2 LYS 124 1HD LYS 124 -19.530 0.200 -4.879 843 HD3 LYS 124 2HD LYS 124 -18.747 -0.766 -6.145 844 HE2 LYS 124 1HE LYS 124 -17.745 -2.229 -4.407 845 HE3 LYS 124 2HE LYS 124 -18.647 -1.364 -3.156 846 HZ1 LYS 124 3HZ LYS 124 -19.735 -3.418 -4.061 847 HZ2 LYS 124 1HZ LYS 124 -19.868 -2.697 -5.511 848 HZ3 LYS 124 2HZ LYS 124 -20.699 -2.113 -4.179 849 H ARG 125 H ARG 125 -15.651 3.990 -7.435 850 HA ARG 125 HA ARG 125 -14.689 2.794 -9.957 851 HB2 ARG 125 1HB ARG 125 -15.927 4.508 -10.920 852 HB3 ARG 125 2HB ARG 125 -16.715 4.269 -9.321 853 HG2 ARG 125 1HG ARG 125 -15.527 6.126 -8.361 854 HG3 ARG 125 2HG ARG 125 -14.759 6.457 -9.908 855 HD2 ARG 125 1HD ARG 125 -16.817 6.787 -10.993 856 HD3 ARG 125 2HD ARG 125 -17.713 6.326 -9.536 857 HE ARG 125 HE ARG 125 -15.783 8.449 -9.049 858 HH11 ARG 125 1HH1 ARG 125 -18.664 8.381 -10.933 859 HH12 ARG 125 2HH1 ARG 125 -19.655 9.412 -9.942 860 HH21 ARG 125 1HH2 ARG 125 -16.922 10.072 -7.708 861 HH22 ARG 125 2HH2 ARG 125 -18.487 10.620 -8.238 862 H GLU 126 H GLU 126 -13.706 4.515 -7.516 863 HA GLU 126 HA GLU 126 -11.132 5.513 -8.760 864 HB2 GLU 126 1HB GLU 126 -12.861 6.529 -6.493 865 HB3 GLU 126 2HB GLU 126 -11.131 6.774 -6.408 866 HG2 GLU 126 1HG GLU 126 -11.297 8.523 -7.694 867 HG3 GLU 126 2HG GLU 126 -11.742 7.522 -9.060 868 H VAL 127 H VAL 127 -12.248 4.336 -5.583 869 HA VAL 127 HA VAL 127 -9.730 3.472 -4.675 870 HB VAL 127 HB VAL 127 -12.456 2.394 -3.889 871 HG11 VAL 127 1HG1 VAL 127 -10.756 0.969 -2.946 872 HG12 VAL 127 2HG1 VAL 127 -9.704 2.352 -2.564 873 HG13 VAL 127 3HG1 VAL 127 -11.193 2.095 -1.653 874 HG21 VAL 127 3HG2 VAL 127 -10.736 4.735 -2.844 875 HG22 VAL 127 1HG2 VAL 127 -12.328 4.892 -3.602 876 HG23 VAL 127 2HG2 VAL 127 -12.189 4.126 -2.014 877 H ASP 128 H ASP 128 -12.285 1.468 -6.315 878 HA ASP 128 HA ASP 128 -10.484 -0.779 -6.619 879 HB2 ASP 128 1HB ASP 128 -13.174 -0.321 -6.848 880 HB3 ASP 128 2HB ASP 128 -12.727 -0.470 -8.545 881 H ASP 129 H ASP 129 -10.565 2.227 -8.261 882 HA ASP 129 HA ASP 129 -9.715 1.264 -10.870 883 HB2 ASP 129 1HB ASP 129 -10.974 3.501 -10.100 884 HB3 ASP 129 2HB ASP 129 -9.340 4.125 -9.990 885 H TYR 130 H TYR 130 -8.163 2.867 -8.072 886 HA TYR 130 HA TYR 130 -5.555 3.082 -9.164 887 HB2 TYR 130 1HB TYR 130 -6.325 2.509 -6.304 888 HB3 TYR 130 2HB TYR 130 -4.783 3.182 -6.836 889 HD1 TYR 130 2HD TYR 130 -5.043 5.495 -8.287 890 HD2 TYR 130 1HD TYR 130 -7.911 4.021 -5.435 891 HE1 TYR 130 2HE TYR 130 -6.125 7.679 -8.288 892 HE2 TYR 130 1HE TYR 130 -9.029 6.225 -5.456 893 HH TYR 130 HH TYR 130 -8.199 8.807 -7.700 894 H VAL 131 H VAL 131 -7.281 0.256 -7.925 895 HA VAL 131 HA VAL 131 -5.001 -1.445 -7.612 896 HB VAL 131 HB VAL 131 -7.883 -2.271 -8.206 897 HG11 VAL 131 1HG1 VAL 131 -7.242 -4.240 -6.765 898 HG12 VAL 131 2HG1 VAL 131 -6.230 -4.128 -8.200 899 HG13 VAL 131 3HG1 VAL 131 -5.607 -3.564 -6.640 900 HG21 VAL 131 3HG2 VAL 131 -7.959 -0.707 -6.318 901 HG22 VAL 131 1HG2 VAL 131 -8.305 -2.354 -5.808 902 HG23 VAL 131 2HG2 VAL 131 -6.708 -1.643 -5.478 903 H ALA 132 H ALA 132 -6.845 -0.424 -10.464 904 HA ALA 132 HA ALA 132 -5.505 -2.506 -12.120 905 HB1 ALA 132 1HB ALA 132 -7.015 -1.675 -13.896 906 HB2 ALA 132 2HB ALA 132 -7.894 -2.254 -12.471 907 HB3 ALA 132 3HB ALA 132 -7.710 -0.506 -12.751 908 H GLY 133 H GLY 133 -5.190 0.815 -11.155 909 HA2 GLY 133 1HA GLY 133 -3.747 1.664 -13.574 910 HA3 GLY 133 2HA GLY 133 -4.079 2.613 -12.130 911 H LEU 134 H LEU 134 -2.914 -0.105 -10.829 912 HA LEU 134 HA LEU 134 -0.071 0.696 -10.832 913 HB2 LEU 134 1HB LEU 134 0.200 -0.872 -8.980 914 HB3 LEU 134 2HB LEU 134 -1.059 0.310 -8.677 915 HG LEU 134 HG LEU 134 -2.753 -1.458 -9.365 916 HD11 LEU 134 1HD1 LEU 134 -1.387 -3.202 -10.361 917 HD12 LEU 134 2HD1 LEU 134 -2.052 -3.811 -8.853 918 HD13 LEU 134 3HD1 LEU 134 -0.350 -3.288 -8.916 919 HD21 LEU 134 3HD2 LEU 134 -2.473 -0.696 -7.077 920 HD22 LEU 134 1HD2 LEU 134 -1.120 -1.831 -6.827 921 HD23 LEU 134 2HD2 LEU 134 -2.773 -2.439 -7.100 922 H ARG 135 H ARG 135 1.391 -1.347 -10.807 923 HA ARG 135 HA ARG 135 0.777 -3.192 -13.056 924 HB2 ARG 135 1HB ARG 135 3.151 -1.320 -12.582 925 HB3 ARG 135 2HB ARG 135 3.210 -2.650 -13.741 926 HG2 ARG 135 1HG ARG 135 1.546 -1.682 -15.132 927 HG3 ARG 135 2HG ARG 135 1.082 -0.478 -13.926 928 HD2 ARG 135 1HD ARG 135 2.725 0.934 -14.449 929 HD3 ARG 135 2HD ARG 135 3.944 -0.324 -14.513 930 HE ARG 135 HE ARG 135 2.291 0.688 -16.717 931 HH11 ARG 135 1HH1 ARG 135 4.869 -1.608 -15.686 932 HH12 ARG 135 2HH1 ARG 135 5.179 -2.152 -17.279 933 HH21 ARG 135 1HH2 ARG 135 2.909 0.035 -18.845 934 HH22 ARG 135 2HH2 ARG 135 3.882 -1.406 -19.055 935 H THR 136 H THR 136 2.387 -5.038 -13.025 936 HA THR 136 HA THR 136 3.617 -5.471 -10.347 937 HB THR 136 HB THR 136 2.590 -7.685 -12.064 938 HG1 THR 136 1HG THR 136 0.809 -6.898 -10.149 939 HG21 THR 136 3HG2 THR 136 2.140 -8.723 -9.773 940 HG22 THR 136 1HG2 THR 136 2.936 -7.300 -9.050 941 HG23 THR 136 2HG2 THR 136 3.846 -8.388 -10.083 942 H GLU 137 H GLU 137 4.568 -4.465 -12.914 943 HA GLU 137 HA GLU 137 6.297 -4.385 -14.312 944 HB2 GLU 137 1HB GLU 137 7.649 -5.788 -12.571 945 HB3 GLU 137 2HB GLU 137 7.343 -7.120 -13.691 946 HG2 GLU 137 1HG GLU 137 9.423 -6.217 -14.343 947 HG3 GLU 137 2HG GLU 137 8.298 -5.577 -15.535 Start of MODEL 16 1 H1 GLY 19 H GLY 19 -13.488 -18.773 2.798 2 HA2 GLY 19 1HA GLY 19 -11.914 -20.596 2.958 3 HA3 GLY 19 2HA GLY 19 -10.891 -19.769 1.763 4 H HIS 20 H HIS 20 -9.129 -19.789 3.362 5 HA HIS 20 HA HIS 20 -9.290 -18.958 5.997 6 HB2 HIS 20 1HB HIS 20 -7.001 -18.931 4.013 7 HB3 HIS 20 2HB HIS 20 -6.793 -18.301 5.644 8 HD1 HIS 20 1HD HIS 20 -7.811 -21.675 3.988 9 HD2 HIS 20 2HD HIS 20 -6.275 -19.976 7.540 10 HE1 HIS 20 1HE HIS 20 -7.103 -23.610 5.473 11 H MET 21 H MET 21 -7.815 -16.756 3.504 12 HA MET 21 HA MET 21 -8.218 -14.558 5.372 13 HB2 MET 21 1HB MET 21 -6.987 -14.699 2.608 14 HB3 MET 21 2HB MET 21 -7.138 -13.216 3.546 15 HG2 MET 21 1HG MET 21 -5.819 -14.156 5.371 16 HG3 MET 21 2HG MET 21 -5.664 -15.686 4.517 17 HE1 MET 21 3HE MET 21 -3.824 -11.840 2.642 18 HE2 MET 21 1HE MET 21 -5.499 -12.352 2.358 19 HE3 MET 21 2HE MET 21 -5.016 -11.761 3.965 20 H LYS 22 H LYS 22 -8.945 -12.370 4.250 21 HA LYS 22 HA LYS 22 -11.064 -12.728 2.256 22 HB2 LYS 22 1HB LYS 22 -11.197 -11.186 4.857 23 HB3 LYS 22 2HB LYS 22 -11.864 -10.395 3.459 24 HG2 LYS 22 1HG LYS 22 -12.805 -13.136 4.371 25 HG3 LYS 22 2HG LYS 22 -13.479 -11.613 4.932 26 HD2 LYS 22 1HD LYS 22 -14.970 -11.964 3.293 27 HD3 LYS 22 2HD LYS 22 -13.747 -11.136 2.319 28 HE2 LYS 22 1HE LYS 22 -12.812 -13.467 1.772 29 HE3 LYS 22 2HE LYS 22 -14.231 -14.143 2.577 30 HZ1 LYS 22 3HZ LYS 22 -14.250 -12.313 0.266 31 HZ2 LYS 22 1HZ LYS 22 -15.605 -12.978 0.946 32 HZ3 LYS 22 2HZ LYS 22 -14.468 -13.936 0.187 33 H PHE 23 H PHE 23 -11.339 -10.690 1.018 34 HA PHE 23 HA PHE 23 -10.522 -9.216 -0.411 35 HB2 PHE 23 1HB PHE 23 -9.020 -8.375 2.048 36 HB3 PHE 23 2HB PHE 23 -8.553 -7.711 0.500 37 HD1 PHE 23 2HD PHE 23 -12.063 -8.495 1.694 38 HD2 PHE 23 1HD PHE 23 -9.172 -5.462 0.597 39 HE1 PHE 23 2HE PHE 23 -13.808 -6.815 1.710 40 HE2 PHE 23 1HE PHE 23 -10.969 -3.764 0.677 41 HZ PHE 23 HZ PHE 23 -13.292 -4.419 1.214 42 H THR 24 H THR 24 -7.974 -8.466 -1.217 43 HA THR 24 HA THR 24 -6.219 -10.791 -1.397 44 HB THR 24 HB THR 24 -5.954 -9.829 -3.884 45 HG1 THR 24 1HG THR 24 -7.959 -9.275 -4.750 46 HG21 THR 24 3HG2 THR 24 -6.690 -12.143 -3.188 47 HG22 THR 24 1HG2 THR 24 -7.499 -11.575 -4.659 48 HG23 THR 24 2HG2 THR 24 -8.357 -11.509 -3.109 49 H ASP 25 H ASP 25 -4.015 -10.081 -1.508 50 HA ASP 25 HA ASP 25 -3.472 -7.885 0.125 51 HB2 ASP 25 1HB ASP 25 -1.761 -9.414 -1.828 52 HB3 ASP 25 2HB ASP 25 -1.129 -8.028 -0.933 53 H GLN 26 H GLN 26 -3.409 -7.983 -3.487 54 HA GLN 26 HA GLN 26 -2.281 -5.470 -3.858 55 HB2 GLN 26 1HB GLN 26 -4.379 -6.110 -5.831 56 HB3 GLN 26 2HB GLN 26 -2.725 -5.598 -6.028 57 HG2 GLN 26 1HG GLN 26 -2.371 -7.667 -6.778 58 HG3 GLN 26 2HG GLN 26 -2.254 -8.144 -5.122 59 HE21 GLN 26 1HE2 GLN 26 -4.948 -7.383 -7.391 60 HE22 GLN 26 2HE2 GLN 26 -5.851 -8.867 -7.181 61 H GLN 27 H GLN 27 -5.700 -6.327 -3.469 62 HA GLN 27 HA GLN 27 -6.879 -3.734 -3.794 63 HB2 GLN 27 1HB GLN 27 -7.796 -6.202 -2.275 64 HB3 GLN 27 2HB GLN 27 -8.798 -4.805 -2.539 65 HG2 GLN 27 1HG GLN 27 -7.589 -6.366 -4.872 66 HG3 GLN 27 2HG GLN 27 -9.067 -6.870 -4.059 67 HE21 GLN 27 1HE2 GLN 27 -8.665 -5.986 -6.883 68 HE22 GLN 27 2HE2 GLN 27 -9.778 -4.645 -7.105 69 H ILE 28 H ILE 28 -5.403 -5.424 -1.078 70 HA ILE 28 HA ILE 28 -6.324 -3.558 0.947 71 HB ILE 28 HB ILE 28 -4.263 -5.801 0.895 72 HG12 ILE 28 1HG1 ILE 28 -7.002 -5.652 2.220 73 HG13 ILE 28 2HG1 ILE 28 -6.722 -6.378 0.661 74 HG21 ILE 28 1HG2 ILE 28 -5.205 -4.233 3.309 75 HG22 ILE 28 2HG2 ILE 28 -4.122 -5.662 3.286 76 HG23 ILE 28 3HG2 ILE 28 -3.581 -4.155 2.592 77 HD11 ILE 28 3HD1 ILE 28 -6.759 -8.173 2.213 78 HD12 ILE 28 1HD1 ILE 28 -5.068 -7.962 1.751 79 HD13 ILE 28 2HD1 ILE 28 -5.661 -7.345 3.319 80 H GLY 29 H GLY 29 -3.328 -4.025 -0.973 81 HA2 GLY 29 1HA GLY 29 -1.594 -2.308 0.345 82 HA3 GLY 29 2HA GLY 29 -1.563 -2.658 -1.391 83 H VAL 30 H VAL 30 -3.936 -1.508 -2.261 84 HA VAL 30 HA VAL 30 -3.266 1.250 -2.446 85 HB VAL 30 HB VAL 30 -5.855 -0.256 -3.019 86 HG11 VAL 30 1HG1 VAL 30 -5.016 2.521 -3.934 87 HG12 VAL 30 2HG1 VAL 30 -6.517 1.645 -4.372 88 HG13 VAL 30 3HG1 VAL 30 -6.276 2.205 -2.724 89 HG21 VAL 30 3HG2 VAL 30 -3.498 0.653 -4.746 90 HG22 VAL 30 1HG2 VAL 30 -3.994 -1.022 -4.424 91 HG23 VAL 30 2HG2 VAL 30 -5.012 0.042 -5.404 92 H LEU 31 H LEU 31 -5.601 -0.429 -0.284 93 HA LEU 31 HA LEU 31 -6.690 2.007 0.838 94 HB2 LEU 31 1HB LEU 31 -6.477 -0.727 2.170 95 HB3 LEU 31 2HB LEU 31 -7.538 0.603 2.636 96 HG LEU 31 HG LEU 31 -7.746 -0.834 -0.033 97 HD11 LEU 31 1HD1 LEU 31 -9.664 -2.020 0.953 98 HD12 LEU 31 2HD1 LEU 31 -9.310 -1.318 2.541 99 HD13 LEU 31 3HD1 LEU 31 -8.156 -2.443 1.769 100 HD21 LEU 31 3HD2 LEU 31 -9.749 0.873 1.463 101 HD22 LEU 31 1HD2 LEU 31 -9.951 0.155 -0.138 102 HD23 LEU 31 2HD2 LEU 31 -8.753 1.443 0.095 103 H ALA 32 H ALA 32 -4.145 -0.226 1.782 104 HA ALA 32 HA ALA 32 -3.275 0.986 4.195 105 HB1 ALA 32 1HB ALA 32 -1.054 -0.118 3.611 106 HB2 ALA 32 2HB ALA 32 -2.462 -1.209 3.583 107 HB3 ALA 32 3HB ALA 32 -1.752 -0.599 2.076 108 H GLY 33 H GLY 33 -2.200 1.615 0.797 109 HA2 GLY 33 1HA GLY 33 -0.427 3.767 1.562 110 HA3 GLY 33 2HA GLY 33 -0.971 3.367 -0.050 111 H LEU 34 H LEU 34 -3.983 3.706 0.824 112 HA LEU 34 HA LEU 34 -4.024 6.480 0.485 113 HB2 LEU 34 1HB LEU 34 -5.817 4.431 0.288 114 HB3 LEU 34 2HB LEU 34 -6.451 5.314 1.668 115 HG LEU 34 HG LEU 34 -6.500 7.392 0.268 116 HD11 LEU 34 1HD1 LEU 34 -4.732 6.863 -1.441 117 HD12 LEU 34 2HD1 LEU 34 -6.281 7.214 -2.198 118 HD13 LEU 34 3HD1 LEU 34 -5.737 5.532 -2.036 119 HD21 LEU 34 3HD2 LEU 34 -8.363 6.552 -1.235 120 HD22 LEU 34 1HD2 LEU 34 -8.478 6.016 0.444 121 HD23 LEU 34 2HD2 LEU 34 -7.874 4.893 -0.801 122 H ALA 35 H ALA 35 -3.548 4.652 3.341 123 HA ALA 35 HA ALA 35 -4.110 6.962 5.123 124 HB1 ALA 35 1HB ALA 35 -3.355 4.062 5.614 125 HB2 ALA 35 2HB ALA 35 -3.132 5.302 6.866 126 HB3 ALA 35 3HB ALA 35 -4.733 5.000 6.264 127 H ILE 36 H ILE 36 -1.384 5.696 3.294 128 HA ILE 36 HA ILE 36 0.436 7.365 4.858 129 HB ILE 36 HB ILE 36 1.090 4.529 4.050 130 HG12 ILE 36 1HG1 ILE 36 1.916 4.419 6.490 131 HG13 ILE 36 2HG1 ILE 36 1.007 5.892 6.822 132 HG21 ILE 36 1HG2 ILE 36 2.972 6.114 3.551 133 HG22 ILE 36 2HG2 ILE 36 2.890 6.729 5.206 134 HG23 ILE 36 3HG2 ILE 36 3.369 5.051 4.876 135 HD11 ILE 36 3HD1 ILE 36 -0.262 3.378 5.716 136 HD12 ILE 36 1HD1 ILE 36 -0.056 3.700 7.460 137 HD13 ILE 36 2HD1 ILE 36 -1.023 4.798 6.470 138 H SER 37 H SER 37 0.679 8.819 3.317 139 HA SER 37 HA SER 37 1.127 9.914 1.438 140 HB2 SER 37 1HB SER 37 2.926 8.826 -0.086 141 HB3 SER 37 2HB SER 37 3.274 9.404 1.546 142 HG SER 37 HG SER 37 4.006 7.201 0.724 143 HA PRO 38 HA PRO 38 -2.204 7.689 -0.997 144 HB2 PRO 38 1HB PRO 38 -4.061 9.756 -0.739 145 HB3 PRO 38 2HB PRO 38 -3.934 8.448 0.448 146 HG2 PRO 38 1HG PRO 38 -2.754 11.207 0.645 147 HG3 PRO 38 2HG PRO 38 -3.624 10.271 1.891 148 HD2 PRO 38 1HD PRO 38 -0.942 10.374 1.865 149 HD3 PRO 38 2HD PRO 38 -1.794 8.853 2.273 150 H GLU 39 H GLU 39 -1.247 11.179 -0.763 151 HA GLU 39 HA GLU 39 -2.193 11.876 -3.349 152 HB2 GLU 39 1HB GLU 39 -0.327 13.132 -1.315 153 HB3 GLU 39 2HB GLU 39 -0.591 13.895 -2.899 154 HG2 GLU 39 1HG GLU 39 -2.988 13.968 -2.569 155 HG3 GLU 39 2HG GLU 39 -2.898 12.995 -1.109 156 H TRP 40 H TRP 40 1.151 11.178 -2.235 157 HA TRP 40 HA TRP 40 2.494 10.988 -4.662 158 HB2 TRP 40 1HB TRP 40 3.626 10.674 -2.561 159 HB3 TRP 40 2HB TRP 40 2.598 9.304 -2.151 160 HD1 TRP 40 HD TRP 40 5.504 10.193 -4.497 161 HE1 TRP 40 1HE TRP 40 6.775 8.066 -5.134 162 HE3 TRP 40 3HE TRP 40 2.366 6.722 -2.408 163 HZ2 TRP 40 2HZ TRP 40 6.493 5.258 -4.783 164 HZ3 TRP 40 3HZ TRP 40 2.881 4.304 -2.640 165 HH2 TRP 40 HH TRP 40 4.926 3.557 -3.801 166 H LEU 41 H LEU 41 0.373 8.454 -3.161 167 HA LEU 41 HA LEU 41 0.936 6.533 -5.166 168 HB2 LEU 41 1HB LEU 41 -0.251 5.198 -3.861 169 HB3 LEU 41 2HB LEU 41 -0.387 6.523 -2.800 170 HG LEU 41 HG LEU 41 -2.716 6.940 -3.571 171 HD11 LEU 41 1HD1 LEU 41 -3.844 5.061 -4.803 172 HD12 LEU 41 2HD1 LEU 41 -2.242 4.412 -5.214 173 HD13 LEU 41 3HD1 LEU 41 -2.777 5.980 -5.839 174 HD21 LEU 41 3HD2 LEU 41 -3.571 4.882 -2.460 175 HD22 LEU 41 1HD2 LEU 41 -2.156 5.542 -1.628 176 HD23 LEU 41 2HD2 LEU 41 -1.984 4.122 -2.666 177 H LYS 42 H LYS 42 -1.764 8.847 -4.830 178 HA LYS 42 HA LYS 42 -3.110 8.089 -7.235 179 HB2 LYS 42 1HB LYS 42 -3.175 10.559 -5.460 180 HB3 LYS 42 2HB LYS 42 -4.221 10.373 -6.872 181 HG2 LYS 42 1HG LYS 42 -5.226 8.344 -5.963 182 HG3 LYS 42 2HG LYS 42 -4.096 8.327 -4.614 183 HD2 LYS 42 1HD LYS 42 -6.241 9.131 -3.870 184 HD3 LYS 42 2HD LYS 42 -5.033 10.428 -3.738 185 HE2 LYS 42 1HE LYS 42 -5.849 11.461 -5.799 186 HE3 LYS 42 2HE LYS 42 -6.915 10.086 -6.109 187 HZ1 LYS 42 3HZ LYS 42 -8.118 10.699 -4.068 188 HZ2 LYS 42 1HZ LYS 42 -8.137 11.887 -5.202 189 HZ3 LYS 42 2HZ LYS 42 -7.154 12.032 -3.912 190 H GLN 43 H GLN 43 -0.420 10.433 -6.725 191 HA GLN 43 HA GLN 43 -0.726 11.730 -9.278 192 HB2 GLN 43 1HB GLN 43 1.678 11.288 -7.445 193 HB3 GLN 43 2HB GLN 43 1.733 12.233 -8.934 194 HG2 GLN 43 1HG GLN 43 -0.276 13.556 -7.878 195 HG3 GLN 43 2HG GLN 43 0.244 12.859 -6.375 196 HE21 GLN 43 1HE2 GLN 43 3.239 12.975 -6.992 197 HE22 GLN 43 2HE2 GLN 43 3.515 14.718 -6.817 198 H ASN 44 H ASN 44 1.249 9.005 -8.088 199 HA ASN 44 HA ASN 44 2.423 8.444 -10.624 200 HB2 ASN 44 1HB ASN 44 2.147 6.780 -8.104 201 HB3 ASN 44 2HB ASN 44 3.066 6.281 -9.547 202 HD21 ASN 44 1HD2 ASN 44 3.288 8.155 -6.604 203 HD22 ASN 44 2HD2 ASN 44 4.884 8.704 -6.947 204 H ILE 45 H ILE 45 -0.535 7.036 -9.030 205 HA ILE 45 HA ILE 45 -1.063 5.126 -11.061 206 HB ILE 45 HB ILE 45 -2.919 6.716 -9.263 207 HG12 ILE 45 1HG1 ILE 45 -1.458 5.145 -8.058 208 HG13 ILE 45 2HG1 ILE 45 -3.141 4.739 -7.940 209 HG21 ILE 45 1HG2 ILE 45 -4.291 6.065 -11.142 210 HG22 ILE 45 2HG2 ILE 45 -3.643 4.422 -11.136 211 HG23 ILE 45 3HG2 ILE 45 -4.667 4.998 -9.802 212 HD11 ILE 45 3HD1 ILE 45 -1.789 2.733 -8.190 213 HD12 ILE 45 1HD1 ILE 45 -2.795 2.917 -9.632 214 HD13 ILE 45 2HD1 ILE 45 -1.070 3.342 -9.690 215 H ALA 46 H ALA 46 -2.145 8.598 -10.837 216 HA ALA 46 HA ALA 46 -3.522 8.551 -13.317 217 HB1 ALA 46 1HB ALA 46 -3.955 10.351 -11.886 218 HB2 ALA 46 2HB ALA 46 -2.241 10.766 -11.677 219 HB3 ALA 46 3HB ALA 46 -3.071 11.086 -13.220 220 H ALA 47 H ALA 47 -0.082 9.153 -12.600 221 HA ALA 47 HA ALA 47 0.669 9.728 -15.319 222 HB1 ALA 47 1HB ALA 47 2.393 8.853 -12.981 223 HB2 ALA 47 2HB ALA 47 2.929 9.634 -14.489 224 HB3 ALA 47 3HB ALA 47 1.937 10.533 -13.341 225 H ASN 48 H ASN 48 -0.277 6.803 -13.927 226 HA ASN 48 HA ASN 48 0.144 4.666 -14.179 227 HB2 ASN 48 1HB ASN 48 -0.928 5.142 -16.360 228 HB3 ASN 48 2HB ASN 48 0.680 5.302 -17.084 229 HD21 ASN 48 1HD2 ASN 48 -0.669 2.793 -14.728 230 HD22 ASN 48 2HD2 ASN 48 -0.298 1.476 -15.796 231 H GLN 49 H GLN 49 2.158 6.057 -13.079 232 HA GLN 49 HA GLN 49 4.709 4.923 -14.144 233 HB2 GLN 49 1HB GLN 49 4.034 7.275 -12.362 234 HB3 GLN 49 2HB GLN 49 5.653 6.630 -12.401 235 HG2 GLN 49 1HG GLN 49 4.407 7.290 -15.070 236 HG3 GLN 49 2HG GLN 49 4.882 8.604 -13.991 237 HE21 GLN 49 1HE2 GLN 49 6.608 5.436 -14.424 238 HE22 GLN 49 2HE2 GLN 49 8.126 6.308 -14.628 239 H LEU 50 H LEU 50 2.363 4.145 -11.877 240 HA LEU 50 HA LEU 50 4.218 3.555 -9.661 241 HB2 LEU 50 1HB LEU 50 1.634 4.489 -9.723 242 HB3 LEU 50 2HB LEU 50 1.349 2.800 -9.479 243 HG LEU 50 HG LEU 50 3.118 4.654 -7.796 244 HD11 LEU 50 1HD1 LEU 50 0.685 4.981 -7.596 245 HD12 LEU 50 2HD1 LEU 50 1.420 4.415 -6.088 246 HD13 LEU 50 3HD1 LEU 50 0.506 3.276 -7.110 247 HD21 LEU 50 3HD2 LEU 50 2.504 1.744 -7.191 248 HD22 LEU 50 1HD2 LEU 50 3.281 2.929 -6.099 249 HD23 LEU 50 2HD2 LEU 50 4.084 2.456 -7.583 250 H VAL 51 H VAL 51 4.965 1.520 -9.242 251 HA VAL 51 HA VAL 51 3.793 -0.776 -10.716 252 HB VAL 51 HB VAL 51 6.705 -0.387 -9.941 253 HG11 VAL 51 1HG1 VAL 51 7.083 -2.454 -11.358 254 HG12 VAL 51 2HG1 VAL 51 6.198 -2.773 -9.877 255 HG13 VAL 51 3HG1 VAL 51 5.336 -2.690 -11.437 256 HG21 VAL 51 3HG2 VAL 51 6.135 0.976 -11.934 257 HG22 VAL 51 1HG2 VAL 51 7.201 -0.372 -12.345 258 HG23 VAL 51 2HG2 VAL 51 5.489 -0.486 -12.739 259 H TYR 52 H TYR 52 3.839 -2.703 -9.514 260 HA TYR 52 HA TYR 52 3.973 -2.516 -6.556 261 HB2 TYR 52 1HB TYR 52 1.664 -2.608 -7.131 262 HB3 TYR 52 2HB TYR 52 1.942 -3.655 -8.507 263 HD1 TYR 52 1HD TYR 52 2.169 -3.681 -4.765 264 HD2 TYR 52 2HD TYR 52 1.732 -5.926 -8.407 265 HE1 TYR 52 1HE TYR 52 2.184 -5.771 -3.487 266 HE2 TYR 52 2HE TYR 52 1.805 -8.041 -7.160 267 HH TYR 52 HH TYR 52 1.876 -9.013 -4.992 268 H GLY 53 H GLY 53 4.955 -4.423 -5.591 269 HA2 GLY 53 1HA GLY 53 5.774 -6.605 -7.354 270 HA3 GLY 53 2HA GLY 53 7.096 -5.570 -6.821 271 H ILE 54 H ILE 54 7.318 -8.100 -6.193 272 HA ILE 54 HA ILE 54 6.929 -8.306 -3.210 273 HB ILE 54 HB ILE 54 6.770 -10.354 -5.492 274 HG12 ILE 54 1HG1 ILE 54 4.653 -9.095 -4.818 275 HG13 ILE 54 2HG1 ILE 54 4.583 -10.830 -4.868 276 HG21 ILE 54 1HG2 ILE 54 8.159 -11.345 -3.855 277 HG22 ILE 54 2HG2 ILE 54 7.071 -10.917 -2.510 278 HG23 ILE 54 3HG2 ILE 54 6.579 -12.114 -3.718 279 HD11 ILE 54 3HD1 ILE 54 3.422 -9.795 -2.884 280 HD12 ILE 54 1HD1 ILE 54 4.643 -10.995 -2.442 281 HD13 ILE 54 2HD1 ILE 54 5.009 -9.265 -2.293 282 H VAL 55 H VAL 55 8.289 -8.670 -2.154 283 HA VAL 55 HA VAL 55 10.973 -7.937 -2.648 284 HB VAL 55 HB VAL 55 10.765 -8.654 -0.086 285 HG11 VAL 55 1HG1 VAL 55 8.901 -6.400 -0.712 286 HG12 VAL 55 2HG1 VAL 55 10.244 -6.452 0.425 287 HG13 VAL 55 3HG1 VAL 55 10.560 -6.218 -1.305 288 HG21 VAL 55 3HG2 VAL 55 8.845 -8.454 0.987 289 HG22 VAL 55 1HG2 VAL 55 7.873 -8.553 -0.510 290 HG23 VAL 55 2HG2 VAL 55 8.937 -9.906 -0.011 291 H LYS 56 H LYS 56 9.496 -10.989 -1.396 292 HA LYS 56 HA LYS 56 10.177 -13.061 -1.148 293 HB2 LYS 56 1HB LYS 56 11.458 -12.371 -3.781 294 HB3 LYS 56 2HB LYS 56 11.829 -13.911 -3.057 295 HG2 LYS 56 1HG LYS 56 8.917 -13.199 -3.134 296 HG3 LYS 56 2HG LYS 56 9.712 -13.449 -4.702 297 HD2 LYS 56 1HD LYS 56 10.554 -15.632 -3.829 298 HD3 LYS 56 2HD LYS 56 9.521 -15.401 -2.386 299 HE2 LYS 56 1HE LYS 56 7.535 -15.235 -3.874 300 HE3 LYS 56 2HE LYS 56 8.590 -15.482 -5.281 301 HZ1 LYS 56 3HZ LYS 56 7.987 -17.397 -3.133 302 HZ2 LYS 56 1HZ LYS 56 9.272 -17.603 -4.137 303 HZ3 LYS 56 2HZ LYS 56 7.734 -17.572 -4.760 304 HA PRO 57 HA PRO 57 14.416 -13.249 0.539 305 HB2 PRO 57 1HB PRO 57 14.921 -15.928 0.438 306 HB3 PRO 57 2HB PRO 57 13.888 -15.208 1.697 307 HG2 PRO 57 1HG PRO 57 13.038 -16.667 -0.787 308 HG3 PRO 57 2HG PRO 57 12.339 -16.733 0.861 309 HD2 PRO 57 1HD PRO 57 11.316 -15.218 -1.215 310 HD3 PRO 57 2HD PRO 57 11.089 -14.817 0.508 311 H SER 58 H SER 58 14.807 -12.053 -1.456 312 HA SER 58 HA SER 58 16.997 -13.315 -2.714 313 HB2 SER 58 1HB SER 58 15.109 -14.072 -4.291 314 HB3 SER 58 2HB SER 58 14.960 -12.378 -4.756 315 HG SER 58 HG SER 58 17.306 -12.525 -5.208 316 H ASP 59 H ASP 59 14.800 -10.618 -3.656 317 HA ASP 59 HA ASP 59 16.877 -8.979 -4.375 318 HB2 ASP 59 1HB ASP 59 13.956 -8.681 -3.979 319 HB3 ASP 59 2HB ASP 59 14.806 -7.191 -3.651 320 H THR 60 H THR 60 17.523 -6.788 -3.544 321 HA THR 60 HA THR 60 18.280 -6.890 -0.764 322 HB THR 60 HB THR 60 18.208 -4.456 -2.591 323 HG1 THR 60 1HG THR 60 20.085 -6.588 -2.461 324 HG21 THR 60 3HG2 THR 60 20.028 -5.220 -0.268 325 HG22 THR 60 1HG2 THR 60 18.657 -4.100 -0.166 326 HG23 THR 60 2HG2 THR 60 20.039 -3.685 -1.175 327 H VAL 61 H VAL 61 16.764 -6.709 0.843 328 HA VAL 61 HA VAL 61 14.821 -4.487 0.711 329 HB VAL 61 HB VAL 61 13.131 -6.033 1.692 330 HG11 VAL 61 1HG1 VAL 61 12.481 -7.047 -0.482 331 HG12 VAL 61 2HG1 VAL 61 12.879 -5.306 -0.583 332 HG13 VAL 61 3HG1 VAL 61 14.001 -6.561 -1.163 333 HG21 VAL 61 3HG2 VAL 61 13.176 -8.402 1.379 334 HG22 VAL 61 1HG2 VAL 61 14.765 -8.338 0.608 335 HG23 VAL 61 2HG2 VAL 61 14.604 -7.941 2.337 336 HA PRO 62 HA PRO 62 16.196 -4.184 4.969 337 HB2 PRO 62 1HB PRO 62 13.811 -3.378 6.233 338 HB3 PRO 62 2HB PRO 62 14.983 -2.292 5.397 339 HG2 PRO 62 1HG PRO 62 12.393 -3.413 4.484 340 HG3 PRO 62 2HG PRO 62 13.078 -1.848 4.082 341 HD2 PRO 62 1HD PRO 62 13.036 -4.031 2.410 342 HD3 PRO 62 2HD PRO 62 14.282 -2.765 2.295 343 H ALA 63 H ALA 63 15.713 -5.087 7.188 344 HA ALA 63 HA ALA 63 14.882 -7.843 7.100 345 HB1 ALA 63 1HB ALA 63 16.552 -7.057 8.725 346 HB2 ALA 63 2HB ALA 63 15.371 -5.930 9.439 347 HB3 ALA 63 3HB ALA 63 15.131 -7.679 9.584 348 H GLY 64 H GLY 64 12.870 -8.684 7.353 349 HA2 GLY 64 1HA GLY 64 10.849 -8.937 8.493 350 HA3 GLY 64 2HA GLY 64 10.820 -7.190 8.887 351 H VAL 65 H VAL 65 11.296 -8.828 5.806 352 HA VAL 65 HA VAL 65 8.733 -8.389 4.755 353 HB VAL 65 HB VAL 65 8.863 -6.189 5.025 354 HG11 VAL 65 1HG1 VAL 65 11.414 -5.972 5.733 355 HG12 VAL 65 2HG1 VAL 65 11.766 -6.066 3.992 356 HG13 VAL 65 3HG1 VAL 65 10.821 -4.712 4.669 357 HG21 VAL 65 3HG2 VAL 65 10.154 -5.383 2.655 358 HG22 VAL 65 1HG2 VAL 65 9.086 -6.762 2.430 359 HG23 VAL 65 2HG2 VAL 65 8.490 -5.314 3.318 360 H ASP 66 H ASP 66 10.038 -10.522 4.804 361 HA ASP 66 HA ASP 66 11.650 -11.018 2.434 362 HB2 ASP 66 1HB ASP 66 11.714 -12.060 4.814 363 HB3 ASP 66 2HB ASP 66 10.326 -13.012 4.309 364 H ASP 67 H ASP 67 8.504 -10.459 2.784 365 HA ASP 67 HA ASP 67 7.633 -11.476 0.291 366 HB2 ASP 67 1HB ASP 67 7.529 -13.634 1.751 367 HB3 ASP 67 2HB ASP 67 6.079 -12.914 2.441 368 H TYR 68 H TYR 68 7.676 -9.132 2.040 369 HA TYR 68 HA TYR 68 4.893 -8.288 2.564 370 HB2 TYR 68 1HB TYR 68 7.456 -7.431 3.409 371 HB3 TYR 68 2HB TYR 68 6.244 -6.171 3.168 372 HD1 TYR 68 2HD TYR 68 6.167 -9.729 4.560 373 HD2 TYR 68 1HD TYR 68 5.359 -5.518 5.181 374 HE1 TYR 68 2HE TYR 68 5.367 -10.243 6.721 375 HE2 TYR 68 1HE TYR 68 4.397 -6.014 7.328 376 HH TYR 68 HH TYR 68 3.810 -9.404 8.362 377 H SER 69 H SER 69 4.038 -8.047 0.547 378 HA SER 69 HA SER 69 4.989 -7.144 -1.842 379 HB2 SER 69 1HB SER 69 2.433 -5.986 -1.417 380 HB3 SER 69 2HB SER 69 2.820 -7.525 -2.185 381 HG SER 69 HG SER 69 2.301 -7.045 0.572 382 H TYR 70 H TYR 70 5.354 -5.138 -2.867 383 HA TYR 70 HA TYR 70 5.333 -2.739 -1.126 384 HB2 TYR 70 1HB TYR 70 7.483 -2.036 -1.936 385 HB3 TYR 70 2HB TYR 70 7.643 -3.592 -1.199 386 HD1 TYR 70 1HD TYR 70 7.703 -1.712 -4.418 387 HD2 TYR 70 2HD TYR 70 8.263 -5.547 -2.540 388 HE1 TYR 70 1HE TYR 70 8.878 -2.544 -6.443 389 HE2 TYR 70 2HE TYR 70 9.548 -6.320 -4.509 390 HH TYR 70 HH TYR 70 10.409 -5.766 -6.591 391 H LEU 71 H LEU 71 5.713 -0.723 -2.336 392 HA LEU 71 HA LEU 71 4.482 -0.584 -5.032 393 HB2 LEU 71 1HB LEU 71 3.623 0.867 -2.481 394 HB3 LEU 71 2HB LEU 71 3.156 1.395 -4.087 395 HG LEU 71 HG LEU 71 2.542 -1.435 -3.186 396 HD11 LEU 71 1HD1 LEU 71 1.640 -0.029 -1.407 397 HD12 LEU 71 2HD1 LEU 71 0.349 -0.761 -2.372 398 HD13 LEU 71 3HD1 LEU 71 0.759 0.946 -2.585 399 HD21 LEU 71 3HD2 LEU 71 2.263 -0.873 -5.570 400 HD22 LEU 71 1HD2 LEU 71 1.153 0.434 -5.139 401 HD23 LEU 71 2HD2 LEU 71 0.720 -1.266 -4.796 402 H VAL 72 H VAL 72 5.802 0.747 -6.264 403 HA VAL 72 HA VAL 72 7.235 3.000 -5.107 404 HB VAL 72 HB VAL 72 8.773 1.151 -4.678 405 HG11 VAL 72 1HG1 VAL 72 9.778 -0.219 -6.400 406 HG12 VAL 72 2HG1 VAL 72 8.017 -0.425 -6.454 407 HG13 VAL 72 3HG1 VAL 72 8.822 0.587 -7.660 408 HG21 VAL 72 3HG2 VAL 72 9.703 3.404 -5.462 409 HG22 VAL 72 1HG2 VAL 72 10.779 2.002 -5.567 410 HG23 VAL 72 2HG2 VAL 72 10.027 2.615 -7.026 411 H ALA 73 H ALA 73 7.683 4.538 -6.871 412 HA ALA 73 HA ALA 73 6.205 3.953 -9.355 413 HB1 ALA 73 1HB ALA 73 6.214 6.258 -8.199 414 HB2 ALA 73 2HB ALA 73 7.875 6.422 -8.809 415 HB3 ALA 73 3HB ALA 73 6.545 6.205 -9.947 416 H ALA 74 H ALA 74 7.356 4.024 -11.421 417 HA ALA 74 HA ALA 74 9.547 2.271 -11.392 418 HB1 ALA 74 1HB ALA 74 9.759 2.733 -13.812 419 HB2 ALA 74 2HB ALA 74 8.065 2.529 -13.335 420 HB3 ALA 74 3HB ALA 74 8.720 4.159 -13.635 421 H ASP 75 H ASP 75 9.548 5.665 -11.192 422 HA ASP 75 HA ASP 75 12.485 5.901 -11.565 423 HB2 ASP 75 1HB ASP 75 10.491 8.175 -11.483 424 HB3 ASP 75 2HB ASP 75 12.143 8.191 -12.084 425 H ASP 76 H ASP 76 10.518 5.354 -8.989 426 HA ASP 76 HA ASP 76 11.725 7.354 -7.131 427 HB2 ASP 76 1HB ASP 76 9.170 5.753 -7.144 428 HB3 ASP 76 2HB ASP 76 9.864 6.112 -5.595 429 H GLN 77 H GLN 77 12.984 4.897 -8.286 430 HA GLN 77 HA GLN 77 13.041 2.627 -6.822 431 HB2 GLN 77 1HB GLN 77 15.331 4.077 -8.185 432 HB3 GLN 77 2HB GLN 77 15.495 2.430 -7.558 433 HG2 GLN 77 1HG GLN 77 13.933 1.537 -9.057 434 HG3 GLN 77 2HG GLN 77 13.195 3.099 -9.421 435 HE21 GLN 77 1HE2 GLN 77 13.527 3.464 -11.481 436 HE22 GLN 77 2HE2 GLN 77 15.044 3.343 -12.380 437 H ASP 78 H ASP 78 15.036 5.504 -5.954 438 HA ASP 78 HA ASP 78 15.160 4.411 -3.201 439 HB2 ASP 78 1HB ASP 78 17.346 4.941 -2.839 440 HB3 ASP 78 2HB ASP 78 17.400 4.244 -4.450 441 H GLY 79 H GLY 79 13.499 6.390 -4.850 442 HA2 GLY 79 1HA GLY 79 13.768 8.957 -3.483 443 HA3 GLY 79 2HA GLY 79 12.493 8.464 -4.608 444 H THR 80 H THR 80 11.064 6.528 -3.679 445 HA THR 80 HA THR 80 10.751 6.592 -0.771 446 HB THR 80 HB THR 80 8.385 7.283 -2.555 447 HG1 THR 80 1HG THR 80 9.623 9.119 -2.732 448 HG21 THR 80 3HG2 THR 80 8.885 7.638 0.438 449 HG22 THR 80 1HG2 THR 80 7.784 6.467 -0.327 450 HG23 THR 80 2HG2 THR 80 7.451 8.204 -0.444 451 H ILE 81 H ILE 81 9.292 4.767 -0.068 452 HA ILE 81 HA ILE 81 8.069 3.153 -2.080 453 HB ILE 81 HB ILE 81 10.336 2.254 -2.252 454 HG12 ILE 81 1HG1 ILE 81 8.942 0.175 -0.550 455 HG13 ILE 81 2HG1 ILE 81 8.327 0.634 -2.128 456 HG21 ILE 81 1HG2 ILE 81 11.544 1.243 -0.313 457 HG22 ILE 81 2HG2 ILE 81 11.322 2.975 -0.128 458 HG23 ILE 81 3HG2 ILE 81 10.277 1.845 0.773 459 HD11 ILE 81 3HD1 ILE 81 10.481 0.029 -3.185 460 HD12 ILE 81 1HD1 ILE 81 11.113 -0.472 -1.602 461 HD13 ILE 81 2HD1 ILE 81 9.750 -1.337 -2.321 462 H ILE 82 H ILE 82 6.690 1.472 -1.011 463 HA ILE 82 HA ILE 82 6.605 1.577 1.917 464 HB ILE 82 HB ILE 82 4.065 1.582 0.266 465 HG12 ILE 82 1HG1 ILE 82 4.823 4.027 1.911 466 HG13 ILE 82 2HG1 ILE 82 5.273 3.895 0.210 467 HG21 ILE 82 1HG2 ILE 82 3.358 0.654 2.237 468 HG22 ILE 82 2HG2 ILE 82 4.685 1.338 3.187 469 HG23 ILE 82 3HG2 ILE 82 3.295 2.327 2.802 470 HD11 ILE 82 3HD1 ILE 82 2.948 3.469 -0.426 471 HD12 ILE 82 1HD1 ILE 82 2.434 3.763 1.257 472 HD13 ILE 82 2HD1 ILE 82 3.196 5.053 0.314 473 H PHE 83 H PHE 83 5.661 -0.423 2.788 474 HA PHE 83 HA PHE 83 5.556 -2.746 0.992 475 HB2 PHE 83 1HB PHE 83 7.008 -2.462 3.647 476 HB3 PHE 83 2HB PHE 83 6.815 -3.940 2.812 477 HD1 PHE 83 2HD PHE 83 8.486 -0.619 2.810 478 HD2 PHE 83 1HD PHE 83 8.344 -4.510 0.979 479 HE1 PHE 83 2HE PHE 83 10.718 -0.225 1.797 480 HE2 PHE 83 1HE PHE 83 10.568 -4.086 -0.063 481 HZ PHE 83 HZ PHE 83 11.754 -1.959 0.352 482 H PHE 84 H PHE 84 4.115 -4.464 1.979 483 HA PHE 84 HA PHE 84 2.886 -4.063 4.565 484 HB2 PHE 84 1HB PHE 84 0.530 -3.938 3.751 485 HB3 PHE 84 2HB PHE 84 1.441 -2.500 3.297 486 HD1 PHE 84 1HD PHE 84 2.224 -2.202 0.895 487 HD2 PHE 84 2HD PHE 84 -0.352 -5.464 2.076 488 HE1 PHE 84 1HE PHE 84 1.758 -2.707 -1.478 489 HE2 PHE 84 2HE PHE 84 -0.819 -5.932 -0.298 490 HZ PHE 84 HZ PHE 84 0.221 -4.577 -2.086 491 H LYS 85 H LYS 85 1.529 -5.938 5.128 492 HA LYS 85 HA LYS 85 1.199 -8.001 3.083 493 HB2 LYS 85 1HB LYS 85 3.299 -8.136 4.956 494 HB3 LYS 85 2HB LYS 85 2.115 -9.201 5.640 495 HG2 LYS 85 1HG LYS 85 3.107 -9.385 2.742 496 HG3 LYS 85 2HG LYS 85 3.901 -10.190 4.094 497 HD2 LYS 85 1HD LYS 85 2.617 -11.880 3.249 498 HD3 LYS 85 2HD LYS 85 1.666 -11.264 4.600 499 HE2 LYS 85 1HE LYS 85 0.457 -9.777 2.861 500 HE3 LYS 85 2HE LYS 85 1.382 -10.606 1.610 501 HZ1 LYS 85 3HZ LYS 85 0.255 -12.644 2.287 502 HZ2 LYS 85 1HZ LYS 85 -0.738 -11.460 1.747 503 HZ3 LYS 85 2HZ LYS 85 -0.665 -11.774 3.377 504 H ALA 86 H ALA 86 -0.985 -8.703 3.298 505 HA ALA 86 HA ALA 86 -2.340 -8.217 5.844 506 HB1 ALA 86 1HB ALA 86 -3.502 -8.016 3.641 507 HB2 ALA 86 2HB ALA 86 -3.253 -9.745 3.369 508 HB3 ALA 86 3HB ALA 86 -4.264 -9.203 4.729 509 H GLU 87 H GLU 87 -2.046 -9.558 7.474 510 HA GLU 87 HA GLU 87 -0.976 -12.303 7.057 511 HB2 GLU 87 1HB GLU 87 -1.117 -10.615 9.571 512 HB3 GLU 87 2HB GLU 87 -0.261 -12.143 9.390 513 HG2 GLU 87 1HG GLU 87 0.471 -9.597 7.850 514 HG3 GLU 87 2HG GLU 87 1.144 -10.082 9.407 515 H GLY 88 H GLY 88 -3.797 -11.342 6.715 516 HA2 GLY 88 1HA GLY 88 -5.841 -12.498 6.878 517 HA3 GLY 88 2HA GLY 88 -5.190 -13.475 8.192 518 H GLN 89 H GLN 89 -7.492 -11.345 7.567 519 HA GLN 89 HA GLN 89 -8.583 -9.583 8.411 520 HB2 GLN 89 1HB GLN 89 -8.003 -10.955 11.025 521 HB3 GLN 89 2HB GLN 89 -9.230 -9.714 10.743 522 HG2 GLN 89 1HG GLN 89 -9.881 -11.407 8.729 523 HG3 GLN 89 2HG GLN 89 -9.229 -12.575 9.885 524 HE21 GLN 89 1HE2 GLN 89 -11.924 -10.691 8.926 525 HE22 GLN 89 2HE2 GLN 89 -12.927 -11.096 10.340 526 H THR 90 H THR 90 -5.360 -9.332 8.703 527 HA THR 90 HA THR 90 -5.345 -6.781 10.120 528 HB THR 90 HB THR 90 -3.343 -8.920 10.877 529 HG1 THR 90 1HG THR 90 -5.164 -10.044 11.260 530 HG21 THR 90 3HG2 THR 90 -3.043 -6.638 11.725 531 HG22 THR 90 1HG2 THR 90 -3.454 -7.732 13.058 532 HG23 THR 90 2HG2 THR 90 -4.691 -6.644 12.383 533 H VAL 91 H VAL 91 -3.586 -5.509 9.448 534 HA VAL 91 HA VAL 91 -1.748 -6.587 7.354 535 HB VAL 91 HB VAL 91 -3.372 -4.001 7.249 536 HG11 VAL 91 1HG1 VAL 91 -1.395 -5.159 5.223 537 HG12 VAL 91 2HG1 VAL 91 -2.412 -3.722 4.974 538 HG13 VAL 91 3HG1 VAL 91 -1.143 -3.700 6.198 539 HG21 VAL 91 3HG2 VAL 91 -4.518 -4.887 5.387 540 HG22 VAL 91 1HG2 VAL 91 -3.519 -6.354 5.371 541 HG23 VAL 91 2HG2 VAL 91 -4.709 -6.065 6.676 542 H ILE 92 H ILE 92 0.278 -6.385 8.452 543 HA ILE 92 HA ILE 92 0.899 -3.880 9.812 544 HB ILE 92 HB ILE 92 2.712 -6.167 8.955 545 HG12 ILE 92 1HG1 ILE 92 2.564 -6.379 11.636 546 HG13 ILE 92 2HG1 ILE 92 0.950 -5.739 11.387 547 HG21 ILE 92 1HG2 ILE 92 3.100 -3.918 11.005 548 HG22 ILE 92 2HG2 ILE 92 4.278 -5.181 10.573 549 HG23 ILE 92 3HG2 ILE 92 3.833 -3.949 9.389 550 HD11 ILE 92 3HD1 ILE 92 2.210 -8.225 10.172 551 HD12 ILE 92 1HD1 ILE 92 1.003 -8.186 11.473 552 HD13 ILE 92 2HD1 ILE 92 0.540 -7.689 9.840 553 H ILE 93 H ILE 93 0.841 -2.193 8.504 554 HA ILE 93 HA ILE 93 1.991 -2.196 5.800 555 HB ILE 93 HB ILE 93 1.174 0.127 7.575 556 HG12 ILE 93 1HG1 ILE 93 -0.563 -1.282 5.509 557 HG13 ILE 93 2HG1 ILE 93 -0.799 -1.353 7.254 558 HG21 ILE 93 1HG2 ILE 93 1.436 -0.021 4.545 559 HG22 ILE 93 2HG2 ILE 93 1.167 1.428 5.537 560 HG23 ILE 93 3HG2 ILE 93 2.703 0.602 5.612 561 HD11 ILE 93 3HD1 ILE 93 -1.110 1.099 7.344 562 HD12 ILE 93 1HD1 ILE 93 -1.064 1.152 5.568 563 HD13 ILE 93 2HD1 ILE 93 -2.339 0.244 6.384 564 H LYS 94 H LYS 94 4.105 -1.727 5.470 565 HA LYS 94 HA LYS 94 5.773 -0.709 7.696 566 HB2 LYS 94 1HB LYS 94 6.299 -2.901 5.649 567 HB3 LYS 94 2HB LYS 94 7.559 -2.174 6.608 568 HG2 LYS 94 1HG LYS 94 6.137 -2.803 8.671 569 HG3 LYS 94 2HG LYS 94 5.218 -3.820 7.561 570 HD2 LYS 94 1HD LYS 94 6.791 -5.438 7.657 571 HD3 LYS 94 2HD LYS 94 8.059 -4.343 7.140 572 HE2 LYS 94 1HE LYS 94 8.368 -3.574 9.467 573 HE3 LYS 94 2HE LYS 94 6.953 -4.515 9.986 574 HZ1 LYS 94 3HZ LYS 94 8.990 -6.038 8.660 575 HZ2 LYS 94 1HZ LYS 94 8.083 -6.402 9.959 576 HZ3 LYS 94 2HZ LYS 94 9.427 -5.436 10.144 577 H TYR 95 H TYR 95 6.188 1.471 7.102 578 HA TYR 95 HA TYR 95 6.857 1.959 4.221 579 HB2 TYR 95 1HB TYR 95 5.846 4.167 4.475 580 HB3 TYR 95 2HB TYR 95 4.687 2.883 4.715 581 HD1 TYR 95 2HD TYR 95 3.825 2.288 6.915 582 HD2 TYR 95 1HD TYR 95 6.250 5.775 6.241 583 HE1 TYR 95 2HE TYR 95 2.996 3.274 9.051 584 HE2 TYR 95 1HE TYR 95 5.380 6.797 8.326 585 HH TYR 95 HH TYR 95 3.890 6.595 10.075 586 H THR 96 H THR 96 8.180 3.969 3.860 587 HA THR 96 HA THR 96 9.626 5.109 6.032 588 HB THR 96 HB THR 96 10.932 3.029 5.727 589 HG1 THR 96 1HG THR 96 12.724 4.094 5.964 590 HG21 THR 96 3HG2 THR 96 11.540 4.080 2.912 591 HG22 THR 96 1HG2 THR 96 10.586 2.632 3.278 592 HG23 THR 96 2HG2 THR 96 12.299 2.692 3.702 593 H SER 97 H SER 97 11.134 6.749 5.083 594 HA SER 97 HA SER 97 10.147 7.833 2.501 595 HB2 SER 97 1HB SER 97 11.523 9.402 4.686 596 HB3 SER 97 2HB SER 97 10.529 10.016 3.348 597 HG SER 97 HG SER 97 8.721 9.001 4.352 598 H GLN 98 H GLN 98 12.670 6.229 3.955 599 HA GLN 98 HA GLN 98 14.507 6.859 1.722 600 HB2 GLN 98 1HB GLN 98 15.222 7.163 4.628 601 HB3 GLN 98 2HB GLN 98 16.362 6.394 3.547 602 HG2 GLN 98 1HG GLN 98 15.779 8.631 2.076 603 HG3 GLN 98 2HG GLN 98 15.595 9.251 3.712 604 HE21 GLN 98 1HE2 GLN 98 17.870 8.908 1.281 605 HE22 GLN 98 2HE2 GLN 98 19.317 8.814 2.259 606 H ARG 99 H ARG 99 14.523 4.990 0.706 607 HA ARG 99 HA ARG 99 13.948 2.430 1.562 608 HB2 ARG 99 1HB ARG 99 14.129 3.141 -0.741 609 HB3 ARG 99 2HB ARG 99 15.891 3.247 -0.607 610 HG2 ARG 99 1HG ARG 99 16.134 0.897 -0.403 611 HG3 ARG 99 2HG ARG 99 14.421 0.652 0.019 612 HD2 ARG 99 1HD ARG 99 13.734 1.304 -2.205 613 HD3 ARG 99 2HD ARG 99 15.417 1.632 -2.675 614 HE ARG 99 HE ARG 99 15.275 -1.042 -1.741 615 HH11 ARG 99 1HH1 ARG 99 14.309 0.899 -4.563 616 HH12 ARG 99 2HH1 ARG 99 14.097 -0.445 -5.619 617 HH21 ARG 99 1HH2 ARG 99 15.056 -2.879 -3.161 618 HH22 ARG 99 2HH2 ARG 99 14.566 -2.641 -4.804 619 H ASN 100 H ASN 100 16.979 4.093 1.923 620 HA ASN 100 HA ASN 100 18.286 1.714 2.936 621 HB2 ASN 100 1HB ASN 100 20.303 2.628 3.053 622 HB3 ASN 100 2HB ASN 100 19.579 3.523 1.719 623 HD21 ASN 100 1HD2 ASN 100 18.212 5.343 2.707 624 HD22 ASN 100 2HD2 ASN 100 19.001 6.481 3.826 625 H THR 101 H THR 101 16.028 3.229 4.512 626 HA THR 101 HA THR 101 17.351 2.793 7.169 627 HB THR 101 HB THR 101 15.982 4.574 8.114 628 HG1 THR 101 1HG THR 101 15.072 4.815 5.447 629 HG21 THR 101 3HG2 THR 101 18.306 5.003 7.239 630 HG22 THR 101 1HG2 THR 101 17.262 6.424 7.285 631 HG23 THR 101 2HG2 THR 101 17.582 5.623 5.745 632 H LYS 102 H LYS 102 15.746 2.342 8.988 633 HA LYS 102 HA LYS 102 14.459 -0.045 8.202 634 HB2 LYS 102 1HB LYS 102 15.535 0.595 10.467 635 HB3 LYS 102 2HB LYS 102 14.010 1.385 10.857 636 HG2 LYS 102 1HG LYS 102 13.539 -1.327 9.831 637 HG3 LYS 102 2HG LYS 102 14.747 -1.381 11.102 638 HD2 LYS 102 1HD LYS 102 13.263 -0.510 12.736 639 HD3 LYS 102 2HD LYS 102 12.121 0.070 11.529 640 HE2 LYS 102 1HE LYS 102 11.646 -2.268 10.829 641 HE3 LYS 102 2HE LYS 102 12.814 -2.867 12.024 642 HZ1 LYS 102 3HZ LYS 102 10.515 -3.003 12.794 643 HZ2 LYS 102 1HZ LYS 102 10.316 -1.396 12.650 644 HZ3 LYS 102 2HZ LYS 102 11.369 -1.992 13.765 645 H LEU 103 H LEU 103 12.181 -0.619 8.598 646 HA LEU 103 HA LEU 103 10.400 1.448 7.482 647 HB2 LEU 103 1HB LEU 103 9.945 -1.517 8.010 648 HB3 LEU 103 2HB LEU 103 8.852 -0.436 7.136 649 HG LEU 103 HG LEU 103 11.633 -1.332 6.252 650 HD11 LEU 103 1HD1 LEU 103 10.433 -2.398 4.408 651 HD12 LEU 103 2HD1 LEU 103 8.903 -1.782 4.991 652 HD13 LEU 103 3HD1 LEU 103 9.809 -2.984 5.959 653 HD21 LEU 103 3HD2 LEU 103 9.728 0.656 4.935 654 HD22 LEU 103 1HD2 LEU 103 11.116 -0.110 4.126 655 HD23 LEU 103 2HD2 LEU 103 11.405 0.936 5.496 656 H LYS 104 H LYS 104 8.595 2.189 8.521 657 HA LYS 104 HA LYS 104 8.217 1.921 11.399 658 HB2 LYS 104 1HB LYS 104 6.442 2.939 9.119 659 HB3 LYS 104 2HB LYS 104 5.883 2.851 10.774 660 HG2 LYS 104 1HG LYS 104 6.446 5.036 10.550 661 HG3 LYS 104 2HG LYS 104 7.788 4.368 11.462 662 HD2 LYS 104 1HD LYS 104 9.284 4.563 9.624 663 HD3 LYS 104 2HD LYS 104 7.958 4.686 8.450 664 HE2 LYS 104 1HE LYS 104 7.841 6.905 8.616 665 HE3 LYS 104 2HE LYS 104 7.625 6.805 10.361 666 HZ1 LYS 104 3HZ LYS 104 9.559 8.104 9.765 667 HZ2 LYS 104 1HZ LYS 104 10.287 6.818 9.052 668 HZ3 LYS 104 2HZ LYS 104 9.980 6.792 10.653 669 H ALA 105 H ALA 105 5.973 1.082 12.171 670 HA ALA 105 HA ALA 105 4.934 -1.196 10.605 671 HB1 ALA 105 1HB ALA 105 4.799 -2.611 12.626 672 HB2 ALA 105 2HB ALA 105 6.476 -2.271 12.168 673 HB3 ALA 105 3HB ALA 105 5.737 -1.411 13.539 674 H LYS 106 H LYS 106 2.911 -0.564 10.239 675 HA LYS 106 HA LYS 106 1.252 0.666 12.414 676 HB2 LYS 106 1HB LYS 106 1.949 2.221 10.560 677 HB3 LYS 106 2HB LYS 106 1.157 1.160 9.415 678 HG2 LYS 106 1HG LYS 106 -0.437 2.749 9.646 679 HG3 LYS 106 2HG LYS 106 -0.994 1.606 10.880 680 HD2 LYS 106 1HD LYS 106 -0.068 2.908 12.634 681 HD3 LYS 106 2HD LYS 106 0.866 3.926 11.511 682 HE2 LYS 106 1HE LYS 106 -1.211 4.858 10.576 683 HE3 LYS 106 2HE LYS 106 -2.166 3.851 11.693 684 HZ1 LYS 106 3HZ LYS 106 -0.362 6.071 12.372 685 HZ2 LYS 106 1HZ LYS 106 -0.851 4.963 13.496 686 HZ3 LYS 106 2HZ LYS 106 -1.979 5.894 12.749 687 H ALA 107 H ALA 107 0.199 -1.206 13.082 688 HA ALA 107 HA ALA 107 -0.670 -3.174 11.048 689 HB1 ALA 107 1HB ALA 107 -1.190 -4.621 12.932 690 HB2 ALA 107 2HB ALA 107 0.488 -4.059 13.039 691 HB3 ALA 107 3HB ALA 107 -0.758 -3.337 14.080 692 H LEU 108 H LEU 108 -2.760 -3.091 10.325 693 HA LEU 108 HA LEU 108 -4.840 -1.734 11.990 694 HB2 LEU 108 1HB LEU 108 -4.683 -1.763 8.943 695 HB3 LEU 108 2HB LEU 108 -6.020 -1.166 9.894 696 HG LEU 108 HG LEU 108 -4.938 0.705 9.078 697 HD11 LEU 108 1HD1 LEU 108 -4.190 1.971 11.009 698 HD12 LEU 108 2HD1 LEU 108 -3.906 0.493 11.936 699 HD13 LEU 108 3HD1 LEU 108 -5.563 0.942 11.467 700 HD21 LEU 108 3HD2 LEU 108 -2.774 -0.468 8.546 701 HD22 LEU 108 1HD2 LEU 108 -2.262 -0.151 10.205 702 HD23 LEU 108 2HD2 LEU 108 -2.633 1.205 9.126 703 H THR 109 H THR 109 -7.015 -2.762 11.708 704 HA THR 109 HA THR 109 -6.933 -5.568 10.837 705 HB THR 109 HB THR 109 -9.600 -4.997 11.050 706 HG1 THR 109 1HG THR 109 -8.498 -3.563 13.220 707 HG21 THR 109 3HG2 THR 109 -8.612 -6.851 12.182 708 HG22 THR 109 1HG2 THR 109 -9.395 -5.872 13.420 709 HG23 THR 109 2HG2 THR 109 -7.632 -5.815 13.204 710 H LEU 110 H LEU 110 -8.189 -6.388 9.029 711 HA LEU 110 HA LEU 110 -8.370 -5.035 6.573 712 HB2 LEU 110 1HB LEU 110 -10.085 -7.177 7.924 713 HB3 LEU 110 2HB LEU 110 -10.491 -6.557 6.348 714 HG LEU 110 HG LEU 110 -7.941 -8.049 7.014 715 HD11 LEU 110 1HD1 LEU 110 -8.937 -9.850 5.669 716 HD12 LEU 110 2HD1 LEU 110 -10.342 -8.831 5.284 717 HD13 LEU 110 3HD1 LEU 110 -10.099 -9.403 6.932 718 HD21 LEU 110 3HD2 LEU 110 -7.446 -6.541 5.205 719 HD22 LEU 110 1HD2 LEU 110 -8.972 -6.989 4.376 720 HD23 LEU 110 2HD2 LEU 110 -7.662 -8.177 4.557 721 H SER 111 H SER 111 -10.894 -5.340 9.101 722 HA SER 111 HA SER 111 -12.764 -3.797 7.745 723 HB2 SER 111 1HB SER 111 -12.911 -5.299 9.939 724 HB3 SER 111 2HB SER 111 -12.775 -3.734 10.746 725 HG SER 111 HG SER 111 -14.821 -4.889 9.364 726 H GLN 112 H GLN 112 -10.045 -2.586 9.773 727 HA GLN 112 HA GLN 112 -11.104 0.087 9.959 728 HB2 GLN 112 1HB GLN 112 -8.405 -1.205 10.419 729 HB3 GLN 112 2HB GLN 112 -8.410 0.501 10.000 730 HG2 GLN 112 1HG GLN 112 -9.733 -0.782 12.386 731 HG3 GLN 112 2HG GLN 112 -8.397 0.380 12.364 732 HE21 GLN 112 1HE2 GLN 112 -8.865 2.657 11.636 733 HE22 GLN 112 2HE2 GLN 112 -10.518 3.212 11.535 734 H LEU 113 H LEU 113 -8.705 -1.391 7.716 735 HA LEU 113 HA LEU 113 -8.423 0.943 6.095 736 HB2 LEU 113 1HB LEU 113 -8.246 -2.030 5.436 737 HB3 LEU 113 2HB LEU 113 -7.738 -0.762 4.337 738 HG LEU 113 HG LEU 113 -6.527 -1.260 7.088 739 HD11 LEU 113 1HD1 LEU 113 -4.610 -2.136 5.830 740 HD12 LEU 113 2HD1 LEU 113 -5.466 -1.870 4.296 741 HD13 LEU 113 3HD1 LEU 113 -6.081 -3.059 5.478 742 HD21 LEU 113 3HD2 LEU 113 -5.708 0.669 4.865 743 HD22 LEU 113 1HD2 LEU 113 -4.725 0.282 6.293 744 HD23 LEU 113 2HD2 LEU 113 -6.269 1.104 6.490 745 H LYS 114 H LYS 114 -10.945 -1.539 6.104 746 HA LYS 114 HA LYS 114 -12.210 -0.585 3.690 747 HB2 LYS 114 1HB LYS 114 -12.477 -2.889 4.785 748 HB3 LYS 114 2HB LYS 114 -13.502 -2.098 5.994 749 HG2 LYS 114 1HG LYS 114 -14.726 -1.118 3.845 750 HG3 LYS 114 2HG LYS 114 -13.962 -2.475 3.021 751 HD2 LYS 114 1HD LYS 114 -15.086 -4.047 4.527 752 HD3 LYS 114 2HD LYS 114 -15.725 -2.715 5.506 753 HE2 LYS 114 1HE LYS 114 -16.374 -3.235 2.566 754 HE3 LYS 114 2HE LYS 114 -17.432 -3.604 3.933 755 HZ1 LYS 114 3HZ LYS 114 -16.583 -0.891 3.086 756 HZ2 LYS 114 1HZ LYS 114 -17.475 -1.237 4.446 757 HZ3 LYS 114 2HZ LYS 114 -18.079 -1.571 2.963 758 H LYS 115 H LYS 115 -12.729 0.070 7.215 759 HA LYS 115 HA LYS 115 -15.062 1.700 6.907 760 HB2 LYS 115 1HB LYS 115 -13.442 0.824 9.115 761 HB3 LYS 115 2HB LYS 115 -13.259 2.544 9.084 762 HG2 LYS 115 1HG LYS 115 -15.137 2.559 10.324 763 HG3 LYS 115 2HG LYS 115 -15.976 2.420 8.785 764 HD2 LYS 115 1HD LYS 115 -15.307 0.254 10.805 765 HD3 LYS 115 2HD LYS 115 -16.908 0.793 10.274 766 HE2 LYS 115 1HE LYS 115 -16.339 -0.130 7.963 767 HE3 LYS 115 2HE LYS 115 -14.849 -0.790 8.672 768 HZ1 LYS 115 3HZ LYS 115 -16.401 -2.502 8.766 769 HZ2 LYS 115 1HZ LYS 115 -17.623 -1.513 9.286 770 HZ3 LYS 115 2HZ LYS 115 -16.375 -1.927 10.299 771 H GLU 116 H GLU 116 -11.608 2.465 7.175 772 HA GLU 116 HA GLU 116 -11.756 5.242 6.854 773 HB2 GLU 116 1HB GLU 116 -9.574 3.267 6.065 774 HB3 GLU 116 2HB GLU 116 -9.378 5.007 6.103 775 HG2 GLU 116 1HG GLU 116 -9.788 3.151 8.460 776 HG3 GLU 116 2HG GLU 116 -8.395 4.145 8.094 777 H PHE 117 H PHE 117 -10.915 2.822 4.290 778 HA PHE 117 HA PHE 117 -11.471 4.984 2.323 779 HB2 PHE 117 1HB PHE 117 -9.394 2.817 2.242 780 HB3 PHE 117 2HB PHE 117 -9.518 4.203 1.177 781 HD1 PHE 117 1HD PHE 117 -9.800 6.527 2.959 782 HD2 PHE 117 2HD PHE 117 -7.557 2.879 3.536 783 HE1 PHE 117 1HE PHE 117 -8.216 7.714 4.476 784 HE2 PHE 117 2HE PHE 117 -5.977 4.046 4.905 785 HZ PHE 117 HZ PHE 117 -6.325 6.515 5.470 786 H TYR 118 H TYR 118 -13.094 2.250 3.073 787 HA TYR 118 HA TYR 118 -13.847 2.087 0.233 788 HB2 TYR 118 1HB TYR 118 -12.063 0.249 0.961 789 HB3 TYR 118 2HB TYR 118 -13.445 -0.549 1.663 790 HD1 TYR 118 1HD TYR 118 -12.323 1.141 -1.544 791 HD2 TYR 118 2HD TYR 118 -14.704 -1.998 0.261 792 HE1 TYR 118 1HE TYR 118 -12.805 0.189 -3.792 793 HE2 TYR 118 2HE TYR 118 -15.231 -2.896 -1.984 794 HH TYR 118 HH TYR 118 -13.521 -2.170 -4.725 795 H GLN 119 H GLN 119 -15.277 3.561 1.699 796 HA GLN 119 HA GLN 119 -17.255 1.933 3.097 797 HB2 GLN 119 1HB GLN 119 -17.376 3.524 4.603 798 HB3 GLN 119 2HB GLN 119 -15.714 3.767 4.113 799 HG2 GLN 119 1HG GLN 119 -17.981 5.427 3.054 800 HG3 GLN 119 2HG GLN 119 -17.200 5.795 4.589 801 HE21 GLN 119 1HE2 GLN 119 -14.367 5.344 3.700 802 HE22 GLN 119 2HE2 GLN 119 -14.131 6.751 2.716 803 H THR 120 H THR 120 -16.931 4.308 0.523 804 HA THR 120 HA THR 120 -19.861 4.431 0.167 805 HB THR 120 HB THR 120 -18.868 6.546 0.570 806 HG1 THR 120 1HG THR 120 -19.656 7.573 -1.079 807 HG21 THR 120 3HG2 THR 120 -16.974 6.147 -1.781 808 HG22 THR 120 1HG2 THR 120 -16.494 6.022 -0.074 809 HG23 THR 120 2HG2 THR 120 -17.082 7.553 -0.717 810 H ARG 121 H ARG 121 -20.798 4.130 -1.970 811 HA ARG 121 HA ARG 121 -19.506 2.091 -3.600 812 HB2 ARG 121 1HB ARG 121 -21.892 3.905 -4.111 813 HB3 ARG 121 2HB ARG 121 -21.239 2.843 -5.346 814 HG2 ARG 121 1HG ARG 121 -21.514 0.874 -3.802 815 HG3 ARG 121 2HG ARG 121 -22.416 1.937 -2.694 816 HD2 ARG 121 1HD ARG 121 -24.086 2.380 -4.431 817 HD3 ARG 121 2HD ARG 121 -23.125 1.507 -5.636 818 HE ARG 121 HE ARG 121 -23.579 -0.385 -3.679 819 HH11 ARG 121 1HH1 ARG 121 -25.708 1.557 -5.851 820 HH12 ARG 121 2HH1 ARG 121 -26.996 0.394 -5.714 821 HH21 ARG 121 1HH2 ARG 121 -25.303 -1.945 -3.795 822 HH22 ARG 121 2HH2 ARG 121 -26.792 -1.483 -4.566 823 H SER 122 H SER 122 -19.415 5.678 -3.696 824 HA SER 122 HA SER 122 -18.355 5.918 -6.308 825 HB2 SER 122 1HB SER 122 -18.742 7.605 -3.997 826 HB3 SER 122 2HB SER 122 -17.102 7.870 -4.625 827 HG SER 122 HG SER 122 -17.981 8.965 -6.136 828 H GLN 123 H GLN 123 -16.686 5.065 -3.271 829 HA GLN 123 HA GLN 123 -14.062 5.245 -4.319 830 HB2 GLN 123 1HB GLN 123 -15.356 4.382 -1.861 831 HB3 GLN 123 2HB GLN 123 -14.313 3.085 -2.366 832 HG2 GLN 123 1HG GLN 123 -12.553 4.108 -1.639 833 HG3 GLN 123 2HG GLN 123 -12.808 5.544 -2.651 834 HE21 GLN 123 1HE2 GLN 123 -13.450 4.063 0.392 835 HE22 GLN 123 2HE2 GLN 123 -14.106 5.453 1.261 836 H LYS 124 H LYS 124 -16.518 2.958 -5.133 837 HA LYS 124 HA LYS 124 -14.649 0.769 -5.724 838 HB2 LYS 124 1HB LYS 124 -17.580 1.085 -6.525 839 HB3 LYS 124 2HB LYS 124 -16.625 -0.390 -6.538 840 HG2 LYS 124 1HG LYS 124 -16.365 -0.108 -3.991 841 HG3 LYS 124 2HG LYS 124 -17.552 1.183 -4.105 842 HD2 LYS 124 1HD LYS 124 -19.013 -0.481 -3.666 843 HD3 LYS 124 2HD LYS 124 -18.954 -0.739 -5.406 844 HE2 LYS 124 1HE LYS 124 -17.327 -2.174 -3.266 845 HE3 LYS 124 2HE LYS 124 -18.737 -2.822 -4.115 846 HZ1 LYS 124 3HZ LYS 124 -16.797 -3.709 -5.136 847 HZ2 LYS 124 1HZ LYS 124 -16.090 -2.241 -5.322 848 HZ3 LYS 124 2HZ LYS 124 -17.452 -2.663 -6.187 849 H ARG 125 H ARG 125 -15.308 3.723 -7.209 850 HA ARG 125 HA ARG 125 -14.269 2.638 -9.791 851 HB2 ARG 125 1HB ARG 125 -15.294 5.343 -8.871 852 HB3 ARG 125 2HB ARG 125 -14.072 5.270 -10.125 853 HG2 ARG 125 1HG ARG 125 -16.680 5.324 -10.615 854 HG3 ARG 125 2HG ARG 125 -15.488 4.630 -11.713 855 HD2 ARG 125 1HD ARG 125 -17.078 2.958 -9.729 856 HD3 ARG 125 2HD ARG 125 -17.700 3.392 -11.310 857 HE ARG 125 HE ARG 125 -15.680 1.390 -10.727 858 HH11 ARG 125 1HH1 ARG 125 -16.469 3.634 -13.452 859 HH12 ARG 125 2HH1 ARG 125 -16.554 2.330 -14.573 860 HH21 ARG 125 1HH2 ARG 125 -15.330 -0.073 -12.305 861 HH22 ARG 125 2HH2 ARG 125 -15.522 0.269 -13.986 862 H GLU 126 H GLU 126 -13.294 5.397 -7.770 863 HA GLU 126 HA GLU 126 -10.818 5.343 -8.677 864 HB2 GLU 126 1HB GLU 126 -12.010 6.269 -6.025 865 HB3 GLU 126 2HB GLU 126 -10.277 6.391 -6.210 866 HG2 GLU 126 1HG GLU 126 -11.387 8.473 -6.863 867 HG3 GLU 126 2HG GLU 126 -10.467 7.743 -8.179 868 H VAL 127 H VAL 127 -11.360 3.918 -5.444 869 HA VAL 127 HA VAL 127 -8.675 3.065 -5.132 870 HB VAL 127 HB VAL 127 -11.271 1.924 -4.009 871 HG11 VAL 127 1HG1 VAL 127 -10.017 0.861 -2.237 872 HG12 VAL 127 2HG1 VAL 127 -9.528 0.180 -3.787 873 HG13 VAL 127 3HG1 VAL 127 -8.475 1.353 -2.957 874 HG21 VAL 127 3HG2 VAL 127 -10.769 4.268 -3.353 875 HG22 VAL 127 1HG2 VAL 127 -10.506 3.201 -1.960 876 HG23 VAL 127 2HG2 VAL 127 -9.126 3.808 -2.885 877 H ASP 128 H ASP 128 -11.315 1.549 -6.906 878 HA ASP 128 HA ASP 128 -10.024 -1.054 -7.214 879 HB2 ASP 128 1HB ASP 128 -12.509 -0.570 -6.971 880 HB3 ASP 128 2HB ASP 128 -12.456 0.157 -8.572 881 H ASP 129 H ASP 129 -10.403 1.944 -9.023 882 HA ASP 129 HA ASP 129 -9.113 1.185 -11.479 883 HB2 ASP 129 1HB ASP 129 -10.230 3.160 -11.743 884 HB3 ASP 129 2HB ASP 129 -9.763 3.790 -10.176 885 H TYR 130 H TYR 130 -7.956 2.691 -8.414 886 HA TYR 130 HA TYR 130 -5.274 2.906 -9.185 887 HB2 TYR 130 1HB TYR 130 -6.212 2.277 -6.399 888 HB3 TYR 130 2HB TYR 130 -4.706 3.058 -6.827 889 HD1 TYR 130 1HD TYR 130 -6.743 4.924 -8.902 890 HD2 TYR 130 2HD TYR 130 -6.335 4.078 -4.689 891 HE1 TYR 130 1HE TYR 130 -7.866 7.036 -8.351 892 HE2 TYR 130 2HE TYR 130 -7.439 6.176 -4.138 893 HH TYR 130 HH TYR 130 -8.354 8.585 -6.641 894 H VAL 131 H VAL 131 -6.945 0.067 -7.729 895 HA VAL 131 HA VAL 131 -4.580 -1.552 -7.495 896 HB VAL 131 HB VAL 131 -7.493 -2.385 -7.872 897 HG11 VAL 131 1HG1 VAL 131 -6.129 -4.324 -8.398 898 HG12 VAL 131 2HG1 VAL 131 -5.047 -4.009 -7.033 899 HG13 VAL 131 3HG1 VAL 131 -6.710 -4.548 -6.748 900 HG21 VAL 131 3HG2 VAL 131 -6.965 -1.061 -5.752 901 HG22 VAL 131 1HG2 VAL 131 -7.629 -2.665 -5.514 902 HG23 VAL 131 2HG2 VAL 131 -5.879 -2.373 -5.295 903 H ALA 132 H ALA 132 -6.665 -0.780 -10.282 904 HA ALA 132 HA ALA 132 -5.465 -2.961 -11.861 905 HB1 ALA 132 1HB ALA 132 -7.872 -2.472 -12.065 906 HB2 ALA 132 2HB ALA 132 -7.486 -0.813 -12.601 907 HB3 ALA 132 3HB ALA 132 -7.005 -2.210 -13.593 908 H GLY 133 H GLY 133 -5.072 0.483 -11.359 909 HA2 GLY 133 1HA GLY 133 -3.571 0.963 -13.801 910 HA3 GLY 133 2HA GLY 133 -3.883 2.095 -12.479 911 H LEU 134 H LEU 134 -2.761 0.313 -10.366 912 HA LEU 134 HA LEU 134 0.055 0.825 -10.662 913 HB2 LEU 134 1HB LEU 134 0.439 -0.655 -8.765 914 HB3 LEU 134 2HB LEU 134 -0.791 0.566 -8.474 915 HG LEU 134 HG LEU 134 -2.478 -1.337 -9.079 916 HD11 LEU 134 1HD1 LEU 134 -0.445 -3.139 -7.758 917 HD12 LEU 134 2HD1 LEU 134 -0.500 -3.058 -9.519 918 HD13 LEU 134 3HD1 LEU 134 -1.943 -3.529 -8.602 919 HD21 LEU 134 3HD2 LEU 134 -0.935 -1.150 -6.484 920 HD22 LEU 134 1HD2 LEU 134 -2.504 -1.979 -6.658 921 HD23 LEU 134 2HD2 LEU 134 -2.392 -0.228 -6.949 922 H ARG 135 H ARG 135 1.513 -0.213 -11.694 923 HA ARG 135 HA ARG 135 0.767 -2.422 -13.531 924 HB2 ARG 135 1HB ARG 135 3.279 -0.720 -13.193 925 HB3 ARG 135 2HB ARG 135 3.132 -2.002 -14.398 926 HG2 ARG 135 1HG ARG 135 1.468 -0.834 -15.637 927 HG3 ARG 135 2HG ARG 135 1.069 0.218 -14.286 928 HD2 ARG 135 1HD ARG 135 2.189 1.666 -15.632 929 HD3 ARG 135 2HD ARG 135 3.451 1.173 -14.505 930 HE ARG 135 HE ARG 135 3.478 -0.521 -16.811 931 HH11 ARG 135 1HH1 ARG 135 4.103 2.887 -16.041 932 HH12 ARG 135 2HH1 ARG 135 5.360 3.097 -17.186 933 HH21 ARG 135 1HH2 ARG 135 5.037 -0.257 -18.417 934 HH22 ARG 135 2HH2 ARG 135 5.821 1.287 -18.680 935 H THR 136 H THR 136 2.380 -4.376 -13.553 936 HA THR 136 HA THR 136 3.508 -4.872 -10.860 937 HB THR 136 HB THR 136 1.747 -6.787 -12.396 938 HG1 THR 136 1HG THR 136 1.185 -4.767 -10.679 939 HG21 THR 136 3HG2 THR 136 3.030 -8.181 -11.042 940 HG22 THR 136 1HG2 THR 136 1.600 -7.904 -10.062 941 HG23 THR 136 2HG2 THR 136 3.110 -7.016 -9.713 942 H GLU 137 H GLU 137 4.327 -4.343 -13.867 943 HA GLU 137 HA GLU 137 6.865 -5.107 -13.504 944 HB2 GLU 137 1HB GLU 137 5.508 -7.362 -14.480 945 HB3 GLU 137 2HB GLU 137 5.992 -6.641 -15.969 946 HG2 GLU 137 1HG GLU 137 8.003 -7.611 -15.722 947 HG3 GLU 137 2HG GLU 137 8.335 -6.550 -14.358 Start of MODEL 17 1 H1 GLY 19 H GLY 19 -12.390 -19.847 0.432 2 HA2 GLY 19 1HA GLY 19 -11.390 -18.117 1.740 3 HA3 GLY 19 2HA GLY 19 -13.116 -18.178 2.160 4 H HIS 20 H HIS 20 -9.851 -19.255 3.133 5 HA HIS 20 HA HIS 20 -10.629 -19.496 5.978 6 HB2 HIS 20 1HB HIS 20 -8.808 -20.924 4.636 7 HB3 HIS 20 2HB HIS 20 -7.805 -19.508 4.887 8 HD1 HIS 20 1HD HIS 20 -9.030 -22.641 6.648 9 HD2 HIS 20 2HD HIS 20 -7.270 -18.902 7.566 10 HE1 HIS 20 1HE HIS 20 -8.073 -22.840 8.965 11 H MET 21 H MET 21 -8.805 -17.596 3.571 12 HA MET 21 HA MET 21 -9.282 -15.090 5.086 13 HB2 MET 21 1HB MET 21 -7.414 -14.158 3.680 14 HB3 MET 21 2HB MET 21 -6.959 -15.283 4.939 15 HG2 MET 21 1HG MET 21 -6.719 -17.102 3.314 16 HG3 MET 21 2HG MET 21 -7.246 -16.039 1.999 17 HE1 MET 21 3HE MET 21 -5.771 -14.389 0.775 18 HE2 MET 21 1HE MET 21 -5.807 -13.388 2.241 19 HE3 MET 21 2HE MET 21 -4.262 -13.708 1.429 20 H LYS 22 H LYS 22 -9.340 -13.206 3.269 21 HA LYS 22 HA LYS 22 -10.846 -13.948 0.883 22 HB2 LYS 22 1HB LYS 22 -11.974 -12.017 2.970 23 HB3 LYS 22 2HB LYS 22 -12.605 -12.274 1.340 24 HG2 LYS 22 1HG LYS 22 -12.922 -14.722 1.943 25 HG3 LYS 22 2HG LYS 22 -12.610 -14.268 3.632 26 HD2 LYS 22 1HD LYS 22 -14.531 -12.702 3.566 27 HD3 LYS 22 2HD LYS 22 -14.781 -13.086 1.844 28 HE2 LYS 22 1HE LYS 22 -14.960 -15.549 2.585 29 HE3 LYS 22 2HE LYS 22 -15.110 -14.935 4.238 30 HZ1 LYS 22 3HZ LYS 22 -17.254 -15.300 3.147 31 HZ2 LYS 22 1HZ LYS 22 -16.859 -14.253 1.957 32 HZ3 LYS 22 2HZ LYS 22 -17.057 -13.705 3.516 33 H PHE 23 H PHE 23 -11.435 -11.292 0.100 34 HA PHE 23 HA PHE 23 -10.476 -9.710 -1.146 35 HB2 PHE 23 1HB PHE 23 -8.973 -9.393 1.435 36 HB3 PHE 23 2HB PHE 23 -8.476 -8.479 0.034 37 HD1 PHE 23 2HD PHE 23 -11.915 -9.317 1.325 38 HD2 PHE 23 1HD PHE 23 -9.077 -6.235 0.303 39 HE1 PHE 23 2HE PHE 23 -13.697 -7.617 1.404 40 HE2 PHE 23 1HE PHE 23 -10.810 -4.514 0.684 41 HZ PHE 23 HZ PHE 23 -13.154 -5.209 1.078 42 H THR 24 H THR 24 -7.956 -8.885 -1.868 43 HA THR 24 HA THR 24 -6.193 -11.147 -2.308 44 HB THR 24 HB THR 24 -5.956 -10.127 -4.732 45 HG1 THR 24 1HG THR 24 -7.682 -9.293 -5.597 46 HG21 THR 24 3HG2 THR 24 -7.639 -11.688 -5.616 47 HG22 THR 24 1HG2 THR 24 -8.518 -11.662 -4.081 48 HG23 THR 24 2HG2 THR 24 -6.917 -12.434 -4.180 49 H ASP 25 H ASP 25 -3.995 -10.412 -2.469 50 HA ASP 25 HA ASP 25 -3.393 -8.282 -0.792 51 HB2 ASP 25 1HB ASP 25 -1.618 -9.539 -2.919 52 HB3 ASP 25 2HB ASP 25 -1.053 -8.438 -1.665 53 H GLN 26 H GLN 26 -3.392 -8.371 -4.329 54 HA GLN 26 HA GLN 26 -2.724 -5.816 -5.125 55 HB2 GLN 26 1HB GLN 26 -4.703 -7.936 -5.985 56 HB3 GLN 26 2HB GLN 26 -4.809 -6.395 -6.774 57 HG2 GLN 26 1HG GLN 26 -2.144 -7.848 -6.557 58 HG3 GLN 26 2HG GLN 26 -3.294 -8.275 -7.808 59 HE21 GLN 26 1HE2 GLN 26 -4.192 -5.317 -8.197 60 HE22 GLN 26 2HE2 GLN 26 -2.885 -4.675 -9.125 61 H GLN 27 H GLN 27 -5.973 -6.878 -4.019 62 HA GLN 27 HA GLN 27 -7.215 -4.302 -4.379 63 HB2 GLN 27 1HB GLN 27 -8.002 -6.856 -2.914 64 HB3 GLN 27 2HB GLN 27 -9.068 -5.481 -3.068 65 HG2 GLN 27 1HG GLN 27 -7.852 -6.861 -5.497 66 HG3 GLN 27 2HG GLN 27 -9.343 -7.414 -4.741 67 HE21 GLN 27 1HE2 GLN 27 -8.521 -5.969 -7.417 68 HE22 GLN 27 2HE2 GLN 27 -9.687 -4.653 -7.525 69 H ILE 28 H ILE 28 -5.654 -5.912 -1.615 70 HA ILE 28 HA ILE 28 -6.690 -3.991 0.313 71 HB ILE 28 HB ILE 28 -4.456 -6.059 0.533 72 HG12 ILE 28 1HG1 ILE 28 -7.267 -6.318 1.666 73 HG13 ILE 28 2HG1 ILE 28 -6.889 -6.866 0.040 74 HG21 ILE 28 1HG2 ILE 28 -5.731 -4.152 2.495 75 HG22 ILE 28 2HG2 ILE 28 -5.239 -5.745 3.082 76 HG23 ILE 28 3HG2 ILE 28 -4.044 -4.656 2.343 77 HD11 ILE 28 3HD1 ILE 28 -6.673 -8.790 1.386 78 HD12 ILE 28 1HD1 ILE 28 -5.024 -8.286 1.018 79 HD13 ILE 28 2HD1 ILE 28 -5.750 -7.935 2.608 80 H GLY 29 H GLY 29 -3.739 -4.388 -1.608 81 HA2 GLY 29 1HA GLY 29 -1.972 -2.763 -0.242 82 HA3 GLY 29 2HA GLY 29 -1.959 -3.027 -1.989 83 H VAL 30 H VAL 30 -4.349 -1.708 -2.754 84 HA VAL 30 HA VAL 30 -3.612 1.039 -2.795 85 HB VAL 30 HB VAL 30 -6.293 -0.307 -3.273 86 HG11 VAL 30 1HG1 VAL 30 -6.882 1.738 -4.502 87 HG12 VAL 30 2HG1 VAL 30 -6.552 2.149 -2.827 88 HG13 VAL 30 3HG1 VAL 30 -5.332 2.480 -4.070 89 HG21 VAL 30 3HG2 VAL 30 -5.648 -0.006 -5.674 90 HG22 VAL 30 1HG2 VAL 30 -4.075 0.629 -5.172 91 HG23 VAL 30 2HG2 VAL 30 -4.504 -1.066 -4.833 92 H LEU 31 H LEU 31 -6.001 -0.678 -0.666 93 HA LEU 31 HA LEU 31 -6.830 1.663 0.720 94 HB2 LEU 31 1HB LEU 31 -6.665 -1.165 1.846 95 HB3 LEU 31 2HB LEU 31 -7.704 0.151 2.397 96 HG LEU 31 HG LEU 31 -7.938 -1.217 -0.325 97 HD11 LEU 31 1HD1 LEU 31 -10.055 -2.143 0.622 98 HD12 LEU 31 2HD1 LEU 31 -9.564 -1.557 2.224 99 HD13 LEU 31 3HD1 LEU 31 -8.594 -2.794 1.356 100 HD21 LEU 31 3HD2 LEU 31 -10.074 -0.017 -0.471 101 HD22 LEU 31 1HD2 LEU 31 -8.735 1.128 -0.301 102 HD23 LEU 31 2HD2 LEU 31 -9.771 0.750 1.097 103 H ALA 32 H ALA 32 -4.133 -0.535 1.260 104 HA ALA 32 HA ALA 32 -3.275 0.612 3.772 105 HB1 ALA 32 1HB ALA 32 -1.163 -0.549 3.408 106 HB2 ALA 32 2HB ALA 32 -2.528 -1.630 3.029 107 HB3 ALA 32 3HB ALA 32 -1.576 -0.880 1.725 108 H GLY 33 H GLY 33 -2.230 1.288 0.367 109 HA2 GLY 33 1HA GLY 33 -0.318 3.303 1.157 110 HA3 GLY 33 2HA GLY 33 -0.928 3.066 -0.470 111 H LEU 34 H LEU 34 -3.837 3.443 0.405 112 HA LEU 34 HA LEU 34 -3.935 6.296 0.422 113 HB2 LEU 34 1HB LEU 34 -6.068 4.296 1.283 114 HB3 LEU 34 2HB LEU 34 -6.322 6.036 1.228 115 HG LEU 34 HG LEU 34 -5.720 4.246 -1.147 116 HD11 LEU 34 1HD1 LEU 34 -7.950 3.978 -0.477 117 HD12 LEU 34 2HD1 LEU 34 -7.955 4.980 -1.917 118 HD13 LEU 34 3HD1 LEU 34 -8.216 5.736 -0.330 119 HD21 LEU 34 3HD2 LEU 34 -6.058 7.270 -1.033 120 HD22 LEU 34 1HD2 LEU 34 -6.098 6.300 -2.529 121 HD23 LEU 34 2HD2 LEU 34 -4.617 6.358 -1.593 122 H ALA 35 H ALA 35 -3.519 4.014 3.024 123 HA ALA 35 HA ALA 35 -4.108 5.941 5.120 124 HB1 ALA 35 1HB ALA 35 -3.820 4.173 6.584 125 HB2 ALA 35 2HB ALA 35 -4.303 3.302 5.121 126 HB3 ALA 35 3HB ALA 35 -2.595 3.372 5.563 127 H ILE 36 H ILE 36 -1.343 5.477 3.061 128 HA ILE 36 HA ILE 36 0.427 6.962 4.898 129 HB ILE 36 HB ILE 36 1.085 4.283 3.599 130 HG12 ILE 36 1HG1 ILE 36 -0.043 3.960 5.755 131 HG13 ILE 36 2HG1 ILE 36 1.624 3.429 5.774 132 HG21 ILE 36 1HG2 ILE 36 3.361 4.558 4.604 133 HG22 ILE 36 2HG2 ILE 36 3.032 5.700 3.316 134 HG23 ILE 36 3HG2 ILE 36 2.960 6.244 4.997 135 HD11 ILE 36 3HD1 ILE 36 2.319 5.411 7.049 136 HD12 ILE 36 1HD1 ILE 36 0.651 6.014 7.033 137 HD13 ILE 36 2HD1 ILE 36 1.047 4.496 7.865 138 H SER 37 H SER 37 0.351 8.745 3.552 139 HA SER 37 HA SER 37 0.719 10.093 1.829 140 HB2 SER 37 1HB SER 37 3.018 8.985 2.064 141 HB3 SER 37 2HB SER 37 2.635 8.189 0.518 142 HG SER 37 HG SER 37 3.661 10.457 0.623 143 HA PRO 38 HA PRO 38 -2.361 7.741 -0.753 144 HB2 PRO 38 1HB PRO 38 -4.310 9.727 -0.648 145 HB3 PRO 38 2HB PRO 38 -4.187 8.399 0.529 146 HG2 PRO 38 1HG PRO 38 -3.120 11.213 0.783 147 HG3 PRO 38 2HG PRO 38 -4.025 10.258 1.995 148 HD2 PRO 38 1HD PRO 38 -1.345 10.467 2.108 149 HD3 PRO 38 2HD PRO 38 -2.132 8.901 2.460 150 H GLU 39 H GLU 39 -1.251 11.142 -0.648 151 HA GLU 39 HA GLU 39 -2.130 11.833 -3.263 152 HB2 GLU 39 1HB GLU 39 -0.859 13.855 -2.936 153 HB3 GLU 39 2HB GLU 39 -1.839 13.443 -1.547 154 HG2 GLU 39 1HG GLU 39 -0.062 13.879 -0.285 155 HG3 GLU 39 2HG GLU 39 0.584 12.325 -0.790 156 H TRP 40 H TRP 40 1.165 10.853 -2.090 157 HA TRP 40 HA TRP 40 2.487 10.923 -4.545 158 HB2 TRP 40 1HB TRP 40 3.703 10.498 -2.525 159 HB3 TRP 40 2HB TRP 40 2.728 9.092 -2.137 160 HD1 TRP 40 HD TRP 40 5.583 10.156 -4.460 161 HE1 TRP 40 1HE TRP 40 6.866 8.093 -5.303 162 HE3 TRP 40 3HE TRP 40 2.530 6.570 -2.519 163 HZ2 TRP 40 2HZ TRP 40 6.499 5.256 -5.222 164 HZ3 TRP 40 3HZ TRP 40 2.933 4.175 -3.005 165 HH2 TRP 40 HH TRP 40 4.921 3.493 -4.363 166 H LEU 41 H LEU 41 0.597 8.173 -3.130 167 HA LEU 41 HA LEU 41 0.929 6.472 -5.378 168 HB2 LEU 41 1HB LEU 41 0.149 5.650 -3.283 169 HB3 LEU 41 2HB LEU 41 -1.313 6.628 -3.325 170 HG LEU 41 HG LEU 41 -0.876 4.859 -5.713 171 HD11 LEU 41 1HD1 LEU 41 -0.094 3.310 -4.149 172 HD12 LEU 41 2HD1 LEU 41 -1.787 2.880 -4.399 173 HD13 LEU 41 3HD1 LEU 41 -1.262 3.778 -2.933 174 HD21 LEU 41 3HD2 LEU 41 -3.283 5.687 -4.088 175 HD22 LEU 41 1HD2 LEU 41 -3.348 4.357 -5.263 176 HD23 LEU 41 2HD2 LEU 41 -2.942 5.977 -5.796 177 H LYS 42 H LYS 42 -1.763 8.744 -4.623 178 HA LYS 42 HA LYS 42 -3.327 8.137 -6.896 179 HB2 LYS 42 1HB LYS 42 -3.101 10.617 -5.158 180 HB3 LYS 42 2HB LYS 42 -4.295 10.473 -6.448 181 HG2 LYS 42 1HG LYS 42 -5.405 8.650 -5.426 182 HG3 LYS 42 2HG LYS 42 -4.129 8.369 -4.252 183 HD2 LYS 42 1HD LYS 42 -4.643 10.446 -3.079 184 HD3 LYS 42 2HD LYS 42 -5.738 10.943 -4.372 185 HE2 LYS 42 1HE LYS 42 -6.745 8.451 -3.687 186 HE3 LYS 42 2HE LYS 42 -6.185 9.053 -2.111 187 HZ1 LYS 42 3HZ LYS 42 -7.641 10.919 -2.338 188 HZ2 LYS 42 1HZ LYS 42 -8.534 9.617 -2.727 189 HZ3 LYS 42 2HZ LYS 42 -7.959 10.557 -3.931 190 H GLN 43 H GLN 43 -0.473 10.338 -6.648 191 HA GLN 43 HA GLN 43 -0.934 11.596 -9.214 192 HB2 GLN 43 1HB GLN 43 1.392 11.289 -7.289 193 HB3 GLN 43 2HB GLN 43 1.576 12.124 -8.842 194 HG2 GLN 43 1HG GLN 43 0.039 13.840 -8.256 195 HG3 GLN 43 2HG GLN 43 -0.586 12.941 -6.875 196 HE21 GLN 43 1HE2 GLN 43 2.870 12.608 -6.812 197 HE22 GLN 43 2HE2 GLN 43 3.070 13.822 -5.571 198 H ASN 44 H ASN 44 1.168 9.005 -7.913 199 HA ASN 44 HA ASN 44 2.419 8.315 -10.336 200 HB2 ASN 44 1HB ASN 44 1.865 6.704 -7.818 201 HB3 ASN 44 2HB ASN 44 2.672 6.036 -9.244 202 HD21 ASN 44 1HD2 ASN 44 3.138 8.456 -6.621 203 HD22 ASN 44 2HD2 ASN 44 4.810 8.532 -6.898 204 H ILE 45 H ILE 45 -0.706 7.050 -9.009 205 HA ILE 45 HA ILE 45 -1.162 5.130 -11.077 206 HB ILE 45 HB ILE 45 -3.060 6.763 -9.351 207 HG12 ILE 45 1HG1 ILE 45 -1.688 5.160 -8.087 208 HG13 ILE 45 2HG1 ILE 45 -3.386 4.791 -8.037 209 HG21 ILE 45 1HG2 ILE 45 -4.801 5.026 -9.987 210 HG22 ILE 45 2HG2 ILE 45 -4.382 6.163 -11.262 211 HG23 ILE 45 3HG2 ILE 45 -3.732 4.520 -11.302 212 HD11 ILE 45 3HD1 ILE 45 -3.034 2.957 -9.701 213 HD12 ILE 45 1HD1 ILE 45 -1.296 3.343 -9.723 214 HD13 ILE 45 2HD1 ILE 45 -2.070 2.751 -8.240 215 H ALA 46 H ALA 46 -2.195 8.600 -10.821 216 HA ALA 46 HA ALA 46 -3.485 8.678 -13.333 217 HB1 ALA 46 1HB ALA 46 -3.162 11.153 -13.138 218 HB2 ALA 46 2HB ALA 46 -3.810 10.412 -11.667 219 HB3 ALA 46 3HB ALA 46 -2.094 10.882 -11.732 220 H ALA 47 H ALA 47 -0.103 9.311 -12.430 221 HA ALA 47 HA ALA 47 0.881 9.959 -15.028 222 HB1 ALA 47 1HB ALA 47 2.372 8.879 -12.627 223 HB2 ALA 47 2HB ALA 47 3.042 9.772 -13.988 224 HB3 ALA 47 3HB ALA 47 1.957 10.571 -12.867 225 H ASN 48 H ASN 48 -0.022 6.871 -13.693 226 HA ASN 48 HA ASN 48 0.293 4.757 -14.250 227 HB2 ASN 48 1HB ASN 48 -0.398 5.698 -16.532 228 HB3 ASN 48 2HB ASN 48 1.295 5.509 -16.998 229 HD21 ASN 48 1HD2 ASN 48 2.167 3.231 -16.926 230 HD22 ASN 48 2HD2 ASN 48 1.017 1.924 -17.269 231 H GLN 49 H GLN 49 2.322 6.198 -12.904 232 HA GLN 49 HA GLN 49 4.954 5.206 -13.943 233 HB2 GLN 49 1HB GLN 49 4.139 7.283 -11.860 234 HB3 GLN 49 2HB GLN 49 5.782 6.680 -11.935 235 HG2 GLN 49 1HG GLN 49 4.512 7.899 -14.396 236 HG3 GLN 49 2HG GLN 49 5.258 8.888 -13.136 237 HE21 GLN 49 1HE2 GLN 49 5.971 6.036 -15.172 238 HE22 GLN 49 2HE2 GLN 49 7.675 6.313 -15.353 239 H LEU 50 H LEU 50 2.567 4.300 -11.766 240 HA LEU 50 HA LEU 50 4.293 3.511 -9.529 241 HB2 LEU 50 1HB LEU 50 1.608 4.301 -9.789 242 HB3 LEU 50 2HB LEU 50 1.442 2.591 -9.668 243 HG LEU 50 HG LEU 50 2.815 4.470 -7.674 244 HD11 LEU 50 1HD1 LEU 50 0.387 4.506 -7.667 245 HD12 LEU 50 2HD1 LEU 50 1.025 3.782 -6.179 246 HD13 LEU 50 3HD1 LEU 50 0.336 2.736 -7.447 247 HD21 LEU 50 3HD2 LEU 50 2.572 1.468 -7.343 248 HD22 LEU 50 1HD2 LEU 50 3.087 2.680 -6.123 249 HD23 LEU 50 2HD2 LEU 50 4.060 2.422 -7.538 250 H VAL 51 H VAL 51 5.011 1.416 -9.156 251 HA VAL 51 HA VAL 51 3.763 -0.805 -10.671 252 HB VAL 51 HB VAL 51 6.651 -0.541 -9.858 253 HG11 VAL 51 1HG1 VAL 51 5.226 -2.719 -11.451 254 HG12 VAL 51 2HG1 VAL 51 6.978 -2.600 -11.253 255 HG13 VAL 51 3HG1 VAL 51 5.971 -2.881 -9.840 256 HG21 VAL 51 3HG2 VAL 51 7.208 -0.453 -12.268 257 HG22 VAL 51 1HG2 VAL 51 5.498 -0.444 -12.686 258 HG23 VAL 51 2HG2 VAL 51 6.221 0.927 -11.808 259 H TYR 52 H TYR 52 3.417 -2.624 -9.502 260 HA TYR 52 HA TYR 52 3.542 -2.575 -6.526 261 HB2 TYR 52 1HB TYR 52 1.277 -2.716 -7.353 262 HB3 TYR 52 2HB TYR 52 1.735 -3.828 -8.617 263 HD1 TYR 52 1HD TYR 52 1.269 -3.585 -4.917 264 HD2 TYR 52 2HD TYR 52 1.688 -6.176 -8.333 265 HE1 TYR 52 1HE TYR 52 0.661 -5.565 -3.529 266 HE2 TYR 52 2HE TYR 52 1.239 -8.123 -6.940 267 HH TYR 52 HH TYR 52 0.673 -8.903 -4.735 268 H GLY 53 H GLY 53 4.834 -4.298 -5.617 269 HA2 GLY 53 1HA GLY 53 5.530 -6.541 -7.342 270 HA3 GLY 53 2HA GLY 53 6.875 -5.475 -6.923 271 H ILE 54 H ILE 54 7.345 -7.820 -6.199 272 HA ILE 54 HA ILE 54 6.726 -8.412 -3.310 273 HB ILE 54 HB ILE 54 6.858 -10.200 -5.823 274 HG12 ILE 54 1HG1 ILE 54 4.669 -9.041 -5.630 275 HG13 ILE 54 2HG1 ILE 54 4.605 -10.776 -5.551 276 HG21 ILE 54 1HG2 ILE 54 6.214 -12.025 -4.117 277 HG22 ILE 54 2HG2 ILE 54 7.869 -11.440 -4.094 278 HG23 ILE 54 3HG2 ILE 54 6.694 -10.904 -2.860 279 HD11 ILE 54 3HD1 ILE 54 4.451 -8.937 -3.110 280 HD12 ILE 54 1HD1 ILE 54 3.079 -9.721 -3.933 281 HD13 ILE 54 2HD1 ILE 54 4.291 -10.691 -3.087 282 H VAL 55 H VAL 55 7.990 -8.920 -2.216 283 HA VAL 55 HA VAL 55 10.715 -8.402 -2.553 284 HB VAL 55 HB VAL 55 10.357 -9.143 -0.007 285 HG11 VAL 55 1HG1 VAL 55 9.775 -6.938 0.558 286 HG12 VAL 55 2HG1 VAL 55 10.419 -6.733 -1.090 287 HG13 VAL 55 3HG1 VAL 55 8.684 -6.770 -0.830 288 HG21 VAL 55 3HG2 VAL 55 8.386 -10.303 -0.135 289 HG22 VAL 55 1HG2 VAL 55 8.503 -8.996 1.022 290 HG23 VAL 55 2HG2 VAL 55 7.525 -8.765 -0.467 291 H LYS 56 H LYS 56 9.180 -11.398 -1.166 292 HA LYS 56 HA LYS 56 9.854 -13.507 -1.094 293 HB2 LYS 56 1HB LYS 56 10.354 -12.783 -3.982 294 HB3 LYS 56 2HB LYS 56 10.885 -14.343 -3.439 295 HG2 LYS 56 1HG LYS 56 8.051 -13.440 -2.754 296 HG3 LYS 56 2HG LYS 56 8.414 -13.868 -4.410 297 HD2 LYS 56 1HD LYS 56 9.228 -16.121 -3.631 298 HD3 LYS 56 2HD LYS 56 8.847 -15.653 -1.982 299 HE2 LYS 56 1HE LYS 56 7.077 -17.019 -2.678 300 HE3 LYS 56 2HE LYS 56 6.429 -15.383 -2.636 301 HZ1 LYS 56 3HZ LYS 56 5.864 -16.815 -4.604 302 HZ2 LYS 56 1HZ LYS 56 7.413 -16.649 -5.138 303 HZ3 LYS 56 2HZ LYS 56 6.444 -15.330 -4.995 304 HA PRO 57 HA PRO 57 14.281 -13.747 -0.242 305 HB2 PRO 57 1HB PRO 57 14.977 -16.309 -0.777 306 HB3 PRO 57 2HB PRO 57 14.000 -15.871 0.648 307 HG2 PRO 57 1HG PRO 57 12.996 -16.909 -2.023 308 HG3 PRO 57 2HG PRO 57 12.554 -17.461 -0.379 309 HD2 PRO 57 1HD PRO 57 11.023 -15.709 -1.751 310 HD3 PRO 57 2HD PRO 57 11.219 -15.542 0.013 311 H SER 58 H SER 58 14.207 -12.274 -2.161 312 HA SER 58 HA SER 58 16.223 -13.181 -4.069 313 HB2 SER 58 1HB SER 58 13.891 -13.710 -5.011 314 HB3 SER 58 2HB SER 58 13.736 -11.968 -5.296 315 HG SER 58 HG SER 58 15.228 -12.052 -6.761 316 H ASP 59 H ASP 59 13.999 -10.233 -3.597 317 HA ASP 59 HA ASP 59 16.185 -8.601 -4.648 318 HB2 ASP 59 1HB ASP 59 13.443 -8.179 -4.519 319 HB3 ASP 59 2HB ASP 59 14.049 -7.147 -3.253 320 H THR 60 H THR 60 16.510 -6.417 -3.318 321 HA THR 60 HA THR 60 17.714 -7.303 -0.754 322 HB THR 60 HB THR 60 18.952 -6.222 -2.754 323 HG1 THR 60 1HG THR 60 19.746 -6.577 -0.687 324 HG21 THR 60 3HG2 THR 60 17.344 -4.314 -2.972 325 HG22 THR 60 1HG2 THR 60 19.038 -3.780 -2.781 326 HG23 THR 60 2HG2 THR 60 17.913 -3.714 -1.407 327 H VAL 61 H VAL 61 16.584 -6.816 1.101 328 HA VAL 61 HA VAL 61 14.991 -4.369 1.292 329 HB VAL 61 HB VAL 61 13.010 -5.750 2.092 330 HG11 VAL 61 1HG1 VAL 61 13.486 -6.091 -0.885 331 HG12 VAL 61 2HG1 VAL 61 11.975 -5.862 0.014 332 HG13 VAL 61 3HG1 VAL 61 13.113 -4.526 -0.123 333 HG21 VAL 61 3HG2 VAL 61 12.674 -7.999 1.155 334 HG22 VAL 61 1HG2 VAL 61 14.361 -7.943 0.487 335 HG23 VAL 61 2HG2 VAL 61 14.090 -7.961 2.232 336 HA PRO 62 HA PRO 62 16.432 -4.716 5.412 337 HB2 PRO 62 1HB PRO 62 14.402 -3.638 6.969 338 HB3 PRO 62 2HB PRO 62 15.491 -2.664 5.926 339 HG2 PRO 62 1HG PRO 62 12.703 -3.656 5.341 340 HG3 PRO 62 2HG PRO 62 13.403 -2.036 5.016 341 HD2 PRO 62 1HD PRO 62 13.177 -3.918 3.085 342 HD3 PRO 62 2HD PRO 62 14.562 -2.805 3.136 343 H ALA 63 H ALA 63 16.272 -5.944 7.384 344 HA ALA 63 HA ALA 63 14.925 -8.395 7.354 345 HB1 ALA 63 1HB ALA 63 16.811 -7.909 8.851 346 HB2 ALA 63 2HB ALA 63 15.805 -6.772 9.783 347 HB3 ALA 63 3HB ALA 63 15.424 -8.507 9.769 348 H GLY 64 H GLY 64 12.925 -9.069 7.820 349 HA2 GLY 64 1HA GLY 64 10.921 -9.137 8.918 350 HA3 GLY 64 2HA GLY 64 11.020 -7.438 9.339 351 H VAL 65 H VAL 65 11.440 -8.434 5.918 352 HA VAL 65 HA VAL 65 8.593 -8.105 5.341 353 HB VAL 65 HB VAL 65 9.118 -6.549 3.409 354 HG11 VAL 65 1HG1 VAL 65 8.766 -4.547 4.666 355 HG12 VAL 65 2HG1 VAL 65 7.924 -5.859 5.499 356 HG13 VAL 65 3HG1 VAL 65 9.450 -5.261 6.131 357 HG21 VAL 65 3HG2 VAL 65 11.509 -5.667 5.074 358 HG22 VAL 65 1HG2 VAL 65 11.659 -6.681 3.631 359 HG23 VAL 65 2HG2 VAL 65 10.975 -5.043 3.496 360 H ASP 66 H ASP 66 9.195 -10.432 5.230 361 HA ASP 66 HA ASP 66 10.848 -11.389 3.027 362 HB2 ASP 66 1HB ASP 66 10.512 -12.298 5.460 363 HB3 ASP 66 2HB ASP 66 8.988 -12.944 4.877 364 H ASP 67 H ASP 67 7.870 -10.333 2.991 365 HA ASP 67 HA ASP 67 6.872 -11.564 0.694 366 HB2 ASP 67 1HB ASP 67 5.481 -13.263 1.239 367 HB3 ASP 67 2HB ASP 67 6.806 -13.596 2.340 368 H TYR 68 H TYR 68 7.111 -9.034 1.962 369 HA TYR 68 HA TYR 68 4.339 -8.073 2.490 370 HB2 TYR 68 1HB TYR 68 7.084 -6.985 3.037 371 HB3 TYR 68 2HB TYR 68 5.688 -5.930 2.951 372 HD1 TYR 68 1HD TYR 68 5.886 -9.347 4.609 373 HD2 TYR 68 2HD TYR 68 5.255 -5.096 5.053 374 HE1 TYR 68 1HE TYR 68 5.278 -9.680 6.921 375 HE2 TYR 68 2HE TYR 68 4.730 -5.426 7.433 376 HH TYR 68 HH TYR 68 4.711 -8.680 8.948 377 H SER 69 H SER 69 3.456 -7.709 0.371 378 HA SER 69 HA SER 69 4.888 -6.989 -1.921 379 HB2 SER 69 1HB SER 69 2.535 -5.755 -2.311 380 HB3 SER 69 2HB SER 69 2.764 -7.493 -2.493 381 HG SER 69 HG SER 69 1.802 -6.205 -0.147 382 H TYR 70 H TYR 70 5.190 -4.947 -2.952 383 HA TYR 70 HA TYR 70 5.191 -2.621 -1.112 384 HB2 TYR 70 1HB TYR 70 7.387 -1.987 -1.813 385 HB3 TYR 70 2HB TYR 70 7.456 -3.590 -1.149 386 HD1 TYR 70 2HD TYR 70 7.547 -1.650 -4.382 387 HD2 TYR 70 1HD TYR 70 8.186 -5.457 -2.466 388 HE1 TYR 70 2HE TYR 70 8.758 -2.478 -6.386 389 HE2 TYR 70 1HE TYR 70 9.400 -6.255 -4.448 390 HH TYR 70 HH TYR 70 10.429 -5.610 -6.432 391 H LEU 71 H LEU 71 5.276 -0.573 -2.122 392 HA LEU 71 HA LEU 71 4.343 -0.400 -4.946 393 HB2 LEU 71 1HB LEU 71 3.769 1.491 -2.606 394 HB3 LEU 71 2HB LEU 71 3.178 1.622 -4.237 395 HG LEU 71 HG LEU 71 1.353 0.922 -3.159 396 HD11 LEU 71 1HD1 LEU 71 0.727 -1.274 -3.828 397 HD12 LEU 71 2HD1 LEU 71 2.409 -1.816 -3.863 398 HD13 LEU 71 3HD1 LEU 71 1.842 -0.633 -5.054 399 HD21 LEU 71 3HD2 LEU 71 1.083 -0.628 -1.380 400 HD22 LEU 71 1HD2 LEU 71 2.157 0.679 -0.982 401 HD23 LEU 71 2HD2 LEU 71 2.849 -0.934 -1.349 402 H VAL 72 H VAL 72 5.807 0.791 -6.222 403 HA VAL 72 HA VAL 72 7.233 3.027 -5.067 404 HB VAL 72 HB VAL 72 8.738 1.160 -4.487 405 HG11 VAL 72 1HG1 VAL 72 9.903 -0.156 -6.120 406 HG12 VAL 72 2HG1 VAL 72 8.158 -0.346 -6.395 407 HG13 VAL 72 3HG1 VAL 72 9.112 0.696 -7.461 408 HG21 VAL 72 3HG2 VAL 72 10.042 2.798 -6.689 409 HG22 VAL 72 1HG2 VAL 72 9.648 3.446 -5.082 410 HG23 VAL 72 2HG2 VAL 72 10.787 2.096 -5.245 411 H ALA 73 H ALA 73 8.309 4.295 -6.953 412 HA ALA 73 HA ALA 73 6.626 3.979 -9.363 413 HB1 ALA 73 1HB ALA 73 6.931 6.239 -8.140 414 HB2 ALA 73 2HB ALA 73 8.575 6.236 -8.808 415 HB3 ALA 73 3HB ALA 73 7.187 6.216 -9.895 416 H ALA 74 H ALA 74 7.628 4.107 -11.428 417 HA ALA 74 HA ALA 74 9.975 2.574 -11.904 418 HB1 ALA 74 1HB ALA 74 9.802 3.477 -14.197 419 HB2 ALA 74 2HB ALA 74 8.260 2.857 -13.591 420 HB3 ALA 74 3HB ALA 74 8.573 4.615 -13.644 421 H ASP 75 H ASP 75 9.858 5.695 -10.625 422 HA ASP 75 HA ASP 75 12.614 6.232 -11.486 423 HB2 ASP 75 1HB ASP 75 10.490 7.478 -12.714 424 HB3 ASP 75 2HB ASP 75 10.920 8.650 -11.495 425 H ASP 76 H ASP 76 11.236 5.292 -8.998 426 HA ASP 76 HA ASP 76 12.316 7.272 -7.052 427 HB2 ASP 76 1HB ASP 76 9.652 5.790 -6.942 428 HB3 ASP 76 2HB ASP 76 10.462 6.273 -5.477 429 H GLN 77 H GLN 77 13.713 4.902 -8.297 430 HA GLN 77 HA GLN 77 13.418 2.633 -6.530 431 HB2 GLN 77 1HB GLN 77 15.693 3.301 -8.444 432 HB3 GLN 77 2HB GLN 77 15.574 1.848 -7.468 433 HG2 GLN 77 1HG GLN 77 13.221 1.563 -8.570 434 HG3 GLN 77 2HG GLN 77 13.873 2.629 -9.825 435 HE21 GLN 77 1HE2 GLN 77 13.110 -0.174 -10.166 436 HE22 GLN 77 2HE2 GLN 77 14.534 -1.089 -10.580 437 H ASP 78 H ASP 78 14.888 5.631 -5.874 438 HA ASP 78 HA ASP 78 15.434 4.492 -3.249 439 HB2 ASP 78 1HB ASP 78 17.536 5.424 -2.857 440 HB3 ASP 78 2HB ASP 78 17.665 4.522 -4.348 441 H GLY 79 H GLY 79 13.412 6.198 -4.687 442 HA2 GLY 79 1HA GLY 79 13.611 8.856 -3.516 443 HA3 GLY 79 2HA GLY 79 12.311 8.222 -4.519 444 H THR 80 H THR 80 10.902 6.496 -3.430 445 HA THR 80 HA THR 80 10.681 6.609 -0.506 446 HB THR 80 HB THR 80 8.317 7.198 -2.349 447 HG1 THR 80 1HG THR 80 9.543 9.048 -2.438 448 HG21 THR 80 3HG2 THR 80 7.730 6.329 -0.060 449 HG22 THR 80 1HG2 THR 80 7.170 7.962 -0.375 450 HG23 THR 80 2HG2 THR 80 8.621 7.671 0.661 451 H ILE 81 H ILE 81 9.162 4.744 0.210 452 HA ILE 81 HA ILE 81 8.090 3.072 -1.834 453 HB ILE 81 HB ILE 81 10.397 2.167 -1.731 454 HG12 ILE 81 1HG1 ILE 81 8.793 0.083 -0.233 455 HG13 ILE 81 2HG1 ILE 81 8.255 0.619 -1.810 456 HG21 ILE 81 1HG2 ILE 81 9.932 1.552 1.226 457 HG22 ILE 81 2HG2 ILE 81 11.387 1.199 0.268 458 HG23 ILE 81 3HG2 ILE 81 10.946 2.867 0.631 459 HD11 ILE 81 3HD1 ILE 81 11.025 -0.522 -1.224 460 HD12 ILE 81 1HD1 ILE 81 9.687 -1.383 -1.999 461 HD13 ILE 81 2HD1 ILE 81 10.428 0.003 -2.815 462 H ILE 82 H ILE 82 6.464 1.619 -0.882 463 HA ILE 82 HA ILE 82 6.246 1.734 2.063 464 HB ILE 82 HB ILE 82 3.843 1.881 0.208 465 HG12 ILE 82 1HG1 ILE 82 4.555 4.112 2.130 466 HG13 ILE 82 2HG1 ILE 82 5.257 4.094 0.534 467 HG21 ILE 82 1HG2 ILE 82 4.026 1.955 3.280 468 HG22 ILE 82 2HG2 ILE 82 2.555 2.269 2.354 469 HG23 ILE 82 3HG2 ILE 82 3.301 0.678 2.279 470 HD11 ILE 82 3HD1 ILE 82 3.062 4.019 -0.539 471 HD12 ILE 82 1HD1 ILE 82 2.273 4.077 1.049 472 HD13 ILE 82 2HD1 ILE 82 3.258 5.448 0.486 473 H PHE 83 H PHE 83 5.780 -0.178 2.953 474 HA PHE 83 HA PHE 83 5.458 -2.602 1.211 475 HB2 PHE 83 1HB PHE 83 6.819 -2.176 3.896 476 HB3 PHE 83 2HB PHE 83 6.520 -3.752 3.246 477 HD1 PHE 83 2HD PHE 83 7.791 -4.545 1.208 478 HD2 PHE 83 1HD PHE 83 8.585 -0.720 3.050 479 HE1 PHE 83 2HE PHE 83 10.007 -4.452 0.095 480 HE2 PHE 83 1HE PHE 83 10.812 -0.666 1.953 481 HZ PHE 83 HZ PHE 83 11.523 -2.525 0.481 482 H PHE 84 H PHE 84 3.789 -4.128 1.864 483 HA PHE 84 HA PHE 84 2.514 -3.771 4.475 484 HB2 PHE 84 1HB PHE 84 0.268 -3.517 3.643 485 HB3 PHE 84 2HB PHE 84 1.234 -2.212 2.977 486 HD1 PHE 84 2HD PHE 84 1.781 -2.189 0.435 487 HD2 PHE 84 1HD PHE 84 -0.679 -5.269 2.274 488 HE1 PHE 84 2HE PHE 84 1.115 -3.016 -1.775 489 HE2 PHE 84 1HE PHE 84 -1.385 -6.000 0.011 490 HZ PHE 84 HZ PHE 84 -0.521 -4.898 -1.975 491 H LYS 85 H LYS 85 1.275 -5.594 5.100 492 HA LYS 85 HA LYS 85 1.189 -7.968 3.364 493 HB2 LYS 85 1HB LYS 85 3.274 -7.966 4.945 494 HB3 LYS 85 2HB LYS 85 2.248 -8.194 6.239 495 HG2 LYS 85 1HG LYS 85 3.130 -10.330 5.441 496 HG3 LYS 85 2HG LYS 85 1.396 -10.258 5.716 497 HD2 LYS 85 1HD LYS 85 2.504 -9.907 2.967 498 HD3 LYS 85 2HD LYS 85 2.351 -11.526 3.690 499 HE2 LYS 85 1HE LYS 85 -0.129 -10.892 4.086 500 HE3 LYS 85 2HE LYS 85 0.172 -9.563 2.962 501 HZ1 LYS 85 3HZ LYS 85 -0.480 -11.049 1.472 502 HZ2 LYS 85 1HZ LYS 85 -0.093 -12.366 2.368 503 HZ3 LYS 85 2HZ LYS 85 1.073 -11.568 1.519 504 H ALA 86 H ALA 86 -1.143 -7.839 3.372 505 HA ALA 86 HA ALA 86 -2.483 -7.659 5.946 506 HB1 ALA 86 1HB ALA 86 -4.527 -8.090 4.658 507 HB2 ALA 86 2HB ALA 86 -3.539 -6.829 3.865 508 HB3 ALA 86 3HB ALA 86 -3.574 -8.487 3.215 509 H GLU 87 H GLU 87 -2.028 -9.378 7.310 510 HA GLU 87 HA GLU 87 -2.309 -12.122 6.287 511 HB2 GLU 87 1HB GLU 87 -0.286 -10.856 7.839 512 HB3 GLU 87 2HB GLU 87 -1.251 -11.738 9.020 513 HG2 GLU 87 1HG GLU 87 -0.125 -12.942 6.458 514 HG3 GLU 87 2HG GLU 87 0.623 -13.011 8.046 515 H GLY 88 H GLY 88 -4.011 -13.252 7.042 516 HA2 GLY 88 1HA GLY 88 -6.030 -13.730 7.998 517 HA3 GLY 88 2HA GLY 88 -5.325 -13.080 9.486 518 H GLN 89 H GLN 89 -5.641 -10.868 10.000 519 HA GLN 89 HA GLN 89 -7.825 -9.371 8.714 520 HB2 GLN 89 1HB GLN 89 -7.801 -10.628 11.437 521 HB3 GLN 89 2HB GLN 89 -8.587 -9.079 11.233 522 HG2 GLN 89 1HG GLN 89 -10.268 -10.653 11.056 523 HG3 GLN 89 2HG GLN 89 -10.022 -9.990 9.454 524 HE21 GLN 89 1HE2 GLN 89 -10.622 -11.590 8.127 525 HE22 GLN 89 2HE2 GLN 89 -10.296 -13.306 8.330 526 H THR 90 H THR 90 -4.730 -9.089 9.214 527 HA THR 90 HA THR 90 -4.779 -6.370 10.404 528 HB THR 90 HB THR 90 -2.830 -8.641 11.015 529 HG1 THR 90 1HG THR 90 -4.612 -9.040 12.182 530 HG21 THR 90 3HG2 THR 90 -3.013 -5.812 12.143 531 HG22 THR 90 1HG2 THR 90 -1.691 -6.468 11.149 532 HG23 THR 90 2HG2 THR 90 -1.971 -7.117 12.761 533 H VAL 91 H VAL 91 -3.364 -4.909 9.419 534 HA VAL 91 HA VAL 91 -1.495 -5.875 7.349 535 HB VAL 91 HB VAL 91 -3.062 -3.279 7.076 536 HG11 VAL 91 1HG1 VAL 91 -2.291 -3.429 4.760 537 HG12 VAL 91 2HG1 VAL 91 -0.908 -3.551 5.847 538 HG13 VAL 91 3HG1 VAL 91 -1.547 -5.012 5.072 539 HG21 VAL 91 3HG2 VAL 91 -4.851 -4.791 6.923 540 HG22 VAL 91 1HG2 VAL 91 -4.331 -4.545 5.237 541 HG23 VAL 91 2HG2 VAL 91 -3.873 -6.018 6.100 542 H ILE 92 H ILE 92 0.238 -5.648 8.348 543 HA ILE 92 HA ILE 92 1.188 -3.479 10.085 544 HB ILE 92 HB ILE 92 2.802 -5.800 8.904 545 HG12 ILE 92 1HG1 ILE 92 2.516 -6.748 11.311 546 HG13 ILE 92 2HG1 ILE 92 1.047 -5.785 11.408 547 HG21 ILE 92 1HG2 ILE 92 3.952 -3.794 9.863 548 HG22 ILE 92 2HG2 ILE 92 3.159 -4.114 11.420 549 HG23 ILE 92 3HG2 ILE 92 4.296 -5.304 10.717 550 HD11 ILE 92 3HD1 ILE 92 1.652 -7.971 9.345 551 HD12 ILE 92 1HD1 ILE 92 0.675 -8.169 10.815 552 HD13 ILE 92 2HD1 ILE 92 0.094 -7.133 9.531 553 H ILE 93 H ILE 93 0.887 -1.812 8.613 554 HA ILE 93 HA ILE 93 2.130 -1.734 5.963 555 HB ILE 93 HB ILE 93 1.282 0.770 7.433 556 HG12 ILE 93 1HG1 ILE 93 -0.666 -1.070 5.985 557 HG13 ILE 93 2HG1 ILE 93 -0.660 -0.748 7.731 558 HG21 ILE 93 1HG2 ILE 93 2.480 0.915 5.273 559 HG22 ILE 93 2HG2 ILE 93 1.280 -0.147 4.511 560 HG23 ILE 93 3HG2 ILE 93 0.819 1.465 5.059 561 HD11 ILE 93 3HD1 ILE 93 -1.333 1.230 5.563 562 HD12 ILE 93 1HD1 ILE 93 -2.372 0.528 6.812 563 HD13 ILE 93 2HD1 ILE 93 -1.071 1.647 7.282 564 H LYS 94 H LYS 94 4.197 -1.171 5.622 565 HA LYS 94 HA LYS 94 5.801 -0.169 7.893 566 HB2 LYS 94 1HB LYS 94 6.311 -2.507 6.025 567 HB3 LYS 94 2HB LYS 94 7.627 -1.678 6.781 568 HG2 LYS 94 1HG LYS 94 6.491 -2.118 9.038 569 HG3 LYS 94 2HG LYS 94 5.405 -3.204 8.163 570 HD2 LYS 94 1HD LYS 94 7.295 -4.582 7.451 571 HD3 LYS 94 2HD LYS 94 8.446 -3.411 8.142 572 HE2 LYS 94 1HE LYS 94 7.484 -3.811 10.397 573 HE3 LYS 94 2HE LYS 94 6.412 -5.048 9.711 574 HZ1 LYS 94 3HZ LYS 94 8.310 -6.049 10.658 575 HZ2 LYS 94 1HZ LYS 94 9.360 -5.121 9.768 576 HZ3 LYS 94 2HZ LYS 94 8.420 -6.261 9.035 577 H TYR 95 H TYR 95 6.838 1.753 7.323 578 HA TYR 95 HA TYR 95 7.329 2.326 4.443 579 HB2 TYR 95 1HB TYR 95 6.068 4.429 4.709 580 HB3 TYR 95 2HB TYR 95 5.069 3.022 4.881 581 HD1 TYR 95 1HD TYR 95 6.624 5.862 6.711 582 HD2 TYR 95 2HD TYR 95 4.020 2.437 6.924 583 HE1 TYR 95 1HE TYR 95 5.884 6.606 8.946 584 HE2 TYR 95 2HE TYR 95 3.294 3.153 9.194 585 HH TYR 95 HH TYR 95 4.019 6.298 10.553 586 H THR 96 H THR 96 8.392 4.578 4.240 587 HA THR 96 HA THR 96 10.171 5.276 6.467 588 HB THR 96 HB THR 96 11.085 3.165 5.587 589 HG1 THR 96 1HG THR 96 13.206 4.158 4.942 590 HG21 THR 96 3HG2 THR 96 12.099 3.041 3.359 591 HG22 THR 96 1HG2 THR 96 11.503 4.656 2.950 592 HG23 THR 96 2HG2 THR 96 10.366 3.320 3.218 593 H SER 97 H SER 97 11.909 6.876 5.621 594 HA SER 97 HA SER 97 10.882 8.546 3.394 595 HB2 SER 97 1HB SER 97 12.411 10.288 4.450 596 HB3 SER 97 2HB SER 97 10.909 9.934 5.309 597 HG SER 97 HG SER 97 13.236 9.900 6.381 598 H GLN 98 H GLN 98 13.120 6.209 4.172 599 HA GLN 98 HA GLN 98 14.870 6.991 1.933 600 HB2 GLN 98 1HB GLN 98 15.718 6.936 4.818 601 HB3 GLN 98 2HB GLN 98 16.813 6.178 3.676 602 HG2 GLN 98 1HG GLN 98 15.854 9.050 3.563 603 HG3 GLN 98 2HG GLN 98 17.466 8.446 4.014 604 HE21 GLN 98 1HE2 GLN 98 17.158 10.389 1.967 605 HE22 GLN 98 2HE2 GLN 98 17.564 9.668 0.440 606 H ARG 99 H ARG 99 15.887 5.364 0.932 607 HA ARG 99 HA ARG 99 15.020 2.621 1.470 608 HB2 ARG 99 1HB ARG 99 15.398 3.814 -0.830 609 HB3 ARG 99 2HB ARG 99 17.040 3.197 -0.663 610 HG2 ARG 99 1HG ARG 99 16.230 0.905 -0.530 611 HG3 ARG 99 2HG ARG 99 14.565 1.428 -0.230 612 HD2 ARG 99 1HD ARG 99 14.593 2.507 -2.465 613 HD3 ARG 99 2HD ARG 99 16.107 1.663 -2.820 614 HE ARG 99 HE ARG 99 13.373 0.590 -2.532 615 HH11 ARG 99 1HH1 ARG 99 16.794 -0.312 -3.213 616 HH12 ARG 99 2HH1 ARG 99 16.292 -1.735 -4.097 617 HH21 ARG 99 1HH2 ARG 99 12.881 -1.490 -3.631 618 HH22 ARG 99 2HH2 ARG 99 14.223 -2.426 -4.138 619 H ASN 100 H ASN 100 17.103 4.285 3.174 620 HA ASN 100 HA ASN 100 19.200 2.214 3.332 621 HB2 ASN 100 1HB ASN 100 19.447 5.164 3.200 622 HB3 ASN 100 2HB ASN 100 20.404 4.416 4.467 623 HD21 ASN 100 1HD2 ASN 100 20.186 4.902 1.112 624 HD22 ASN 100 2HD2 ASN 100 21.478 3.824 0.589 625 H THR 101 H THR 101 16.579 2.953 4.912 626 HA THR 101 HA THR 101 17.771 2.694 7.647 627 HB THR 101 HB THR 101 15.982 4.309 8.372 628 HG1 THR 101 1HG THR 101 14.720 5.198 6.967 629 HG21 THR 101 3HG2 THR 101 18.353 5.005 7.995 630 HG22 THR 101 1HG2 THR 101 17.177 6.297 7.735 631 HG23 THR 101 2HG2 THR 101 17.913 5.481 6.347 632 H LYS 102 H LYS 102 15.969 2.309 9.351 633 HA LYS 102 HA LYS 102 14.591 -0.157 8.776 634 HB2 LYS 102 1HB LYS 102 15.617 0.581 11.009 635 HB3 LYS 102 2HB LYS 102 14.300 1.732 11.148 636 HG2 LYS 102 1HG LYS 102 13.633 0.032 12.506 637 HG3 LYS 102 2HG LYS 102 12.674 -0.261 11.080 638 HD2 LYS 102 1HD LYS 102 15.324 -1.673 11.258 639 HD3 LYS 102 2HD LYS 102 14.109 -2.137 12.436 640 HE2 LYS 102 1HE LYS 102 12.533 -2.809 10.759 641 HE3 LYS 102 2HE LYS 102 13.520 -2.142 9.451 642 HZ1 LYS 102 3HZ LYS 102 15.185 -3.726 9.849 643 HZ2 LYS 102 1HZ LYS 102 13.780 -4.612 9.805 644 HZ3 LYS 102 2HZ LYS 102 14.540 -4.257 11.234 645 H LEU 103 H LEU 103 12.333 -0.437 8.770 646 HA LEU 103 HA LEU 103 10.682 1.740 7.699 647 HB2 LEU 103 1HB LEU 103 10.172 -1.224 8.222 648 HB3 LEU 103 2HB LEU 103 9.068 -0.152 7.338 649 HG LEU 103 HG LEU 103 11.868 -1.007 6.466 650 HD11 LEU 103 1HD1 LEU 103 10.170 -2.806 6.347 651 HD12 LEU 103 2HD1 LEU 103 10.796 -2.328 4.765 652 HD13 LEU 103 3HD1 LEU 103 9.189 -1.771 5.263 653 HD21 LEU 103 3HD2 LEU 103 11.548 1.131 5.536 654 HD22 LEU 103 1HD2 LEU 103 9.828 0.828 5.148 655 HD23 LEU 103 2HD2 LEU 103 11.126 0.018 4.257 656 H LYS 104 H LYS 104 8.836 2.537 8.832 657 HA LYS 104 HA LYS 104 8.582 2.208 11.694 658 HB2 LYS 104 1HB LYS 104 6.989 3.450 9.407 659 HB3 LYS 104 2HB LYS 104 6.269 3.261 10.968 660 HG2 LYS 104 1HG LYS 104 7.061 5.485 10.879 661 HG3 LYS 104 2HG LYS 104 8.064 4.596 12.025 662 HD2 LYS 104 1HD LYS 104 9.899 4.472 10.514 663 HD3 LYS 104 2HD LYS 104 8.904 4.981 9.161 664 HE2 LYS 104 1HE LYS 104 10.369 6.790 9.959 665 HE3 LYS 104 2HE LYS 104 8.665 7.230 10.100 666 HZ1 LYS 104 3HZ LYS 104 10.243 6.172 12.361 667 HZ2 LYS 104 1HZ LYS 104 8.787 6.917 12.440 668 HZ3 LYS 104 2HZ LYS 104 10.121 7.780 12.017 669 H ALA 105 H ALA 105 6.442 1.484 12.563 670 HA ALA 105 HA ALA 105 5.339 -0.915 11.155 671 HB1 ALA 105 1HB ALA 105 5.274 -2.030 13.356 672 HB2 ALA 105 2HB ALA 105 6.933 -1.606 12.905 673 HB3 ALA 105 3HB ALA 105 6.063 -0.623 14.098 674 H LYS 106 H LYS 106 3.328 -0.135 10.534 675 HA LYS 106 HA LYS 106 1.545 1.033 12.645 676 HB2 LYS 106 1HB LYS 106 2.187 2.698 10.989 677 HB3 LYS 106 2HB LYS 106 1.818 1.575 9.678 678 HG2 LYS 106 1HG LYS 106 0.077 2.986 9.574 679 HG3 LYS 106 2HG LYS 106 -0.640 1.673 10.491 680 HD2 LYS 106 1HD LYS 106 -0.731 2.952 12.472 681 HD3 LYS 106 2HD LYS 106 0.589 4.029 11.951 682 HE2 LYS 106 1HE LYS 106 -0.879 4.856 10.109 683 HE3 LYS 106 2HE LYS 106 -2.242 3.973 10.799 684 HZ1 LYS 106 3HZ LYS 106 -2.100 5.411 12.719 685 HZ2 LYS 106 1HZ LYS 106 -2.107 6.331 11.357 686 HZ3 LYS 106 2HZ LYS 106 -0.688 6.106 12.126 687 H ALA 107 H ALA 107 0.711 -1.007 13.254 688 HA ALA 107 HA ALA 107 -0.459 -2.750 11.178 689 HB1 ALA 107 1HB ALA 107 0.622 -3.788 13.152 690 HB2 ALA 107 2HB ALA 107 -0.521 -2.942 14.224 691 HB3 ALA 107 3HB ALA 107 -1.110 -4.154 13.067 692 H LEU 108 H LEU 108 -2.383 -2.287 10.386 693 HA LEU 108 HA LEU 108 -4.549 -1.118 12.082 694 HB2 LEU 108 1HB LEU 108 -3.843 -0.733 9.145 695 HB3 LEU 108 2HB LEU 108 -5.498 -0.620 9.665 696 HG LEU 108 HG LEU 108 -5.347 1.463 10.320 697 HD11 LEU 108 1HD1 LEU 108 -3.645 2.507 11.722 698 HD12 LEU 108 2HD1 LEU 108 -2.672 1.027 11.696 699 HD13 LEU 108 3HD1 LEU 108 -4.285 1.048 12.468 700 HD21 LEU 108 3HD2 LEU 108 -2.555 1.311 9.118 701 HD22 LEU 108 1HD2 LEU 108 -3.502 2.802 9.370 702 HD23 LEU 108 2HD2 LEU 108 -4.079 1.580 8.239 703 H THR 109 H THR 109 -6.462 -2.352 11.975 704 HA THR 109 HA THR 109 -6.271 -5.043 11.011 705 HB THR 109 HB THR 109 -8.849 -4.885 11.461 706 HG1 THR 109 1HG THR 109 -7.958 -2.632 12.906 707 HG21 THR 109 3HG2 THR 109 -7.332 -6.092 12.895 708 HG22 THR 109 1HG2 THR 109 -8.371 -5.081 13.923 709 HG23 THR 109 2HG2 THR 109 -6.695 -4.602 13.593 710 H LEU 110 H LEU 110 -7.525 -6.098 9.344 711 HA LEU 110 HA LEU 110 -7.812 -4.839 6.822 712 HB2 LEU 110 1HB LEU 110 -9.130 -7.219 8.187 713 HB3 LEU 110 2HB LEU 110 -9.730 -6.672 6.649 714 HG LEU 110 HG LEU 110 -6.921 -7.686 7.193 715 HD11 LEU 110 1HD1 LEU 110 -8.989 -9.303 6.991 716 HD12 LEU 110 2HD1 LEU 110 -7.599 -9.589 5.935 717 HD13 LEU 110 3HD1 LEU 110 -9.038 -8.769 5.312 718 HD21 LEU 110 3HD2 LEU 110 -6.715 -6.034 5.404 719 HD22 LEU 110 1HD2 LEU 110 -8.180 -6.666 4.601 720 HD23 LEU 110 2HD2 LEU 110 -6.726 -7.650 4.681 721 H SER 111 H SER 111 -10.222 -5.210 9.487 722 HA SER 111 HA SER 111 -12.297 -3.932 8.061 723 HB2 SER 111 1HB SER 111 -12.241 -5.288 10.362 724 HB3 SER 111 2HB SER 111 -12.170 -3.652 11.036 725 HG SER 111 HG SER 111 -14.046 -4.583 9.115 726 H GLN 112 H GLN 112 -9.765 -2.481 10.229 727 HA GLN 112 HA GLN 112 -10.665 0.165 10.228 728 HB2 GLN 112 1HB GLN 112 -8.099 -1.214 10.659 729 HB3 GLN 112 2HB GLN 112 -7.838 0.327 9.894 730 HG2 GLN 112 1HG GLN 112 -9.640 0.186 12.312 731 HG3 GLN 112 2HG GLN 112 -7.894 0.097 12.504 732 HE21 GLN 112 1HE2 GLN 112 -9.667 2.210 10.073 733 HE22 GLN 112 2HE2 GLN 112 -9.050 3.664 10.768 734 H LEU 113 H LEU 113 -8.341 -1.275 7.878 735 HA LEU 113 HA LEU 113 -8.263 1.039 6.220 736 HB2 LEU 113 1HB LEU 113 -7.741 -1.909 5.639 737 HB3 LEU 113 2HB LEU 113 -7.452 -0.638 4.458 738 HG LEU 113 HG LEU 113 -6.054 -0.863 7.154 739 HD11 LEU 113 1HD1 LEU 113 -5.084 -1.339 4.300 740 HD12 LEU 113 2HD1 LEU 113 -5.453 -2.590 5.508 741 HD13 LEU 113 3HD1 LEU 113 -4.106 -1.466 5.781 742 HD21 LEU 113 3HD2 LEU 113 -6.128 1.486 6.598 743 HD22 LEU 113 1HD2 LEU 113 -5.816 1.156 4.883 744 HD23 LEU 113 2HD2 LEU 113 -4.540 0.909 6.080 745 H LYS 114 H LYS 114 -10.470 -1.766 6.099 746 HA LYS 114 HA LYS 114 -11.673 -1.095 3.557 747 HB2 LYS 114 1HB LYS 114 -11.884 -3.262 4.584 748 HB3 LYS 114 2HB LYS 114 -12.832 -2.585 5.927 749 HG2 LYS 114 1HG LYS 114 -14.552 -1.814 4.274 750 HG3 LYS 114 2HG LYS 114 -13.615 -2.498 2.948 751 HD2 LYS 114 1HD LYS 114 -14.872 -3.927 5.339 752 HD3 LYS 114 2HD LYS 114 -15.477 -3.944 3.683 753 HE2 LYS 114 1HE LYS 114 -14.445 -5.893 3.464 754 HE3 LYS 114 2HE LYS 114 -13.004 -4.918 3.171 755 HZ1 LYS 114 3HZ LYS 114 -13.098 -6.841 4.938 756 HZ2 LYS 114 1HZ LYS 114 -13.568 -5.618 5.946 757 HZ3 LYS 114 2HZ LYS 114 -12.107 -5.546 5.094 758 H LYS 115 H LYS 115 -12.385 -0.127 7.018 759 HA LYS 115 HA LYS 115 -14.792 1.253 6.268 760 HB2 LYS 115 1HB LYS 115 -13.621 0.517 8.702 761 HB3 LYS 115 2HB LYS 115 -13.355 2.242 8.658 762 HG2 LYS 115 1HG LYS 115 -15.433 2.402 9.506 763 HG3 LYS 115 2HG LYS 115 -16.004 2.119 7.867 764 HD2 LYS 115 1HD LYS 115 -15.601 0.052 10.065 765 HD3 LYS 115 2HD LYS 115 -17.147 0.692 9.509 766 HE2 LYS 115 1HE LYS 115 -16.761 -0.364 7.253 767 HE3 LYS 115 2HE LYS 115 -15.240 -1.056 7.874 768 HZ1 LYS 115 3HZ LYS 115 -17.971 -1.650 8.845 769 HZ2 LYS 115 1HZ LYS 115 -16.601 -2.133 9.604 770 HZ3 LYS 115 2HZ LYS 115 -16.939 -2.677 8.086 771 H GLU 116 H GLU 116 -11.494 2.390 7.069 772 HA GLU 116 HA GLU 116 -11.815 5.092 6.718 773 HB2 GLU 116 1HB GLU 116 -9.448 3.311 6.046 774 HB3 GLU 116 2HB GLU 116 -9.346 5.066 6.071 775 HG2 GLU 116 1HG GLU 116 -10.050 3.305 8.425 776 HG3 GLU 116 2HG GLU 116 -8.461 3.992 8.120 777 H PHE 117 H PHE 117 -11.058 2.703 4.162 778 HA PHE 117 HA PHE 117 -11.329 4.864 2.126 779 HB2 PHE 117 1HB PHE 117 -9.340 2.582 2.199 780 HB3 PHE 117 2HB PHE 117 -9.457 3.912 1.038 781 HD1 PHE 117 2HD PHE 117 -9.340 6.331 2.123 782 HD2 PHE 117 1HD PHE 117 -7.749 2.765 3.926 783 HE1 PHE 117 2HE PHE 117 -7.891 7.722 3.606 784 HE2 PHE 117 1HE PHE 117 -6.347 4.150 5.425 785 HZ PHE 117 HZ PHE 117 -6.407 6.637 5.255 786 H TYR 118 H TYR 118 -13.247 2.557 3.066 787 HA TYR 118 HA TYR 118 -14.247 2.202 0.389 788 HB2 TYR 118 1HB TYR 118 -12.379 0.303 1.068 789 HB3 TYR 118 2HB TYR 118 -13.770 -0.464 1.730 790 HD1 TYR 118 1HD TYR 118 -12.467 1.135 -1.414 791 HD2 TYR 118 2HD TYR 118 -15.167 -1.773 0.291 792 HE1 TYR 118 1HE TYR 118 -12.567 -0.075 -3.590 793 HE2 TYR 118 2HE TYR 118 -15.395 -2.848 -1.930 794 HH TYR 118 HH TYR 118 -13.100 -2.232 -4.484 795 H GLN 119 H GLN 119 -15.599 3.598 1.915 796 HA GLN 119 HA GLN 119 -17.534 1.923 3.402 797 HB2 GLN 119 1HB GLN 119 -18.003 3.643 4.762 798 HB3 GLN 119 2HB GLN 119 -16.282 3.677 4.612 799 HG2 GLN 119 1HG GLN 119 -18.186 5.571 3.323 800 HG3 GLN 119 2HG GLN 119 -17.287 5.853 4.791 801 HE21 GLN 119 1HE2 GLN 119 -14.627 4.753 3.460 802 HE22 GLN 119 2HE2 GLN 119 -14.168 6.275 2.790 803 H THR 120 H THR 120 -17.410 4.556 0.916 804 HA THR 120 HA THR 120 -20.289 4.176 0.394 805 HB THR 120 HB THR 120 -19.970 6.039 -1.177 806 HG1 THR 120 1HG THR 120 -18.047 6.987 -1.403 807 HG21 THR 120 3HG2 THR 120 -18.678 6.552 1.531 808 HG22 THR 120 1HG2 THR 120 -20.409 6.615 1.174 809 HG23 THR 120 2HG2 THR 120 -19.311 7.796 0.456 810 H ARG 121 H ARG 121 -21.004 3.848 -1.904 811 HA ARG 121 HA ARG 121 -19.437 1.658 -3.090 812 HB2 ARG 121 1HB ARG 121 -22.072 2.899 -3.923 813 HB3 ARG 121 2HB ARG 121 -21.361 1.420 -4.593 814 HG2 ARG 121 1HG ARG 121 -21.502 0.318 -2.363 815 HG3 ARG 121 2HG ARG 121 -22.167 1.824 -1.669 816 HD2 ARG 121 1HD ARG 121 -23.925 1.648 -3.540 817 HD3 ARG 121 2HD ARG 121 -23.467 -0.077 -3.598 818 HE ARG 121 HE ARG 121 -23.914 0.387 -0.937 819 HH11 ARG 121 1HH1 ARG 121 -25.818 0.926 -3.902 820 HH12 ARG 121 2HH1 ARG 121 -27.356 0.838 -3.142 821 HH21 ARG 121 1HH2 ARG 121 -25.932 0.430 0.135 822 HH22 ARG 121 2HH2 ARG 121 -27.412 0.706 -0.772 823 H SER 122 H SER 122 -20.238 5.066 -3.786 824 HA SER 122 HA SER 122 -19.343 5.136 -6.466 825 HB2 SER 122 1HB SER 122 -20.556 6.846 -4.787 826 HB3 SER 122 2HB SER 122 -18.919 7.522 -4.694 827 HG SER 122 HG SER 122 -19.032 8.137 -6.685 828 H GLN 123 H GLN 123 -17.396 5.407 -3.381 829 HA GLN 123 HA GLN 123 -15.007 6.146 -4.732 830 HB2 GLN 123 1HB GLN 123 -13.988 6.043 -2.689 831 HB3 GLN 123 2HB GLN 123 -15.643 6.074 -2.136 832 HG2 GLN 123 1HG GLN 123 -15.515 3.564 -1.916 833 HG3 GLN 123 2HG GLN 123 -13.783 3.664 -2.243 834 HE21 GLN 123 1HE2 GLN 123 -16.317 4.974 -0.275 835 HE22 GLN 123 2HE2 GLN 123 -15.258 5.375 1.092 836 H LYS 124 H LYS 124 -16.552 3.037 -4.354 837 HA LYS 124 HA LYS 124 -14.336 1.311 -4.475 838 HB2 LYS 124 1HB LYS 124 -17.067 0.772 -5.739 839 HB3 LYS 124 2HB LYS 124 -15.817 -0.418 -5.410 840 HG2 LYS 124 1HG LYS 124 -15.992 0.186 -2.950 841 HG3 LYS 124 2HG LYS 124 -17.403 1.147 -3.355 842 HD2 LYS 124 1HD LYS 124 -18.533 -0.869 -4.285 843 HD3 LYS 124 2HD LYS 124 -17.065 -1.824 -3.991 844 HE2 LYS 124 1HE LYS 124 -17.278 -1.280 -1.542 845 HE3 LYS 124 2HE LYS 124 -18.870 -0.571 -1.876 846 HZ1 LYS 124 3HZ LYS 124 -18.088 -3.378 -2.455 847 HZ2 LYS 124 1HZ LYS 124 -19.580 -2.768 -2.653 848 HZ3 LYS 124 2HZ LYS 124 -18.963 -2.916 -1.152 849 H ARG 125 H ARG 125 -15.907 2.997 -7.094 850 HA ARG 125 HA ARG 125 -14.798 1.646 -9.366 851 HB2 ARG 125 1HB ARG 125 -16.315 4.072 -8.687 852 HB3 ARG 125 2HB ARG 125 -15.066 4.476 -9.822 853 HG2 ARG 125 1HG ARG 125 -17.421 3.946 -10.560 854 HG3 ARG 125 2HG ARG 125 -16.023 3.467 -11.554 855 HD2 ARG 125 1HD ARG 125 -16.305 1.146 -10.962 856 HD3 ARG 125 2HD ARG 125 -17.538 1.556 -9.731 857 HE ARG 125 HE ARG 125 -18.272 2.669 -12.220 858 HH11 ARG 125 1HH1 ARG 125 -17.687 -0.743 -11.417 859 HH12 ARG 125 2HH1 ARG 125 -19.121 -1.252 -12.176 860 HH21 ARG 125 1HH2 ARG 125 -20.105 1.831 -13.412 861 HH22 ARG 125 2HH2 ARG 125 -20.519 0.182 -13.185 862 H GLU 126 H GLU 126 -13.775 4.830 -8.070 863 HA GLU 126 HA GLU 126 -11.258 4.956 -9.219 864 HB2 GLU 126 1HB GLU 126 -12.561 5.998 -6.706 865 HB3 GLU 126 2HB GLU 126 -10.824 6.197 -6.814 866 HG2 GLU 126 1HG GLU 126 -10.912 7.569 -8.655 867 HG3 GLU 126 2HG GLU 126 -12.550 7.086 -9.128 868 H VAL 127 H VAL 127 -11.881 3.744 -5.940 869 HA VAL 127 HA VAL 127 -9.189 3.119 -5.349 870 HB VAL 127 HB VAL 127 -11.727 1.767 -4.369 871 HG11 VAL 127 1HG1 VAL 127 -8.937 1.761 -3.139 872 HG12 VAL 127 2HG1 VAL 127 -10.398 1.185 -2.330 873 HG13 VAL 127 3HG1 VAL 127 -9.813 0.354 -3.770 874 HG21 VAL 127 3HG2 VAL 127 -10.035 4.044 -3.171 875 HG22 VAL 127 1HG2 VAL 127 -11.643 4.250 -3.876 876 HG23 VAL 127 2HG2 VAL 127 -11.448 3.321 -2.383 877 H ASP 128 H ASP 128 -11.629 1.032 -7.022 878 HA ASP 128 HA ASP 128 -9.775 -1.215 -7.149 879 HB2 ASP 128 1HB ASP 128 -12.254 -1.359 -6.942 880 HB3 ASP 128 2HB ASP 128 -12.403 -0.705 -8.578 881 H ASP 129 H ASP 129 -10.696 1.518 -9.252 882 HA ASP 129 HA ASP 129 -9.369 0.654 -11.633 883 HB2 ASP 129 1HB ASP 129 -9.593 3.458 -10.515 884 HB3 ASP 129 2HB ASP 129 -8.928 3.065 -12.066 885 H TYR 130 H TYR 130 -8.194 2.353 -8.692 886 HA TYR 130 HA TYR 130 -5.507 2.675 -9.499 887 HB2 TYR 130 1HB TYR 130 -6.400 2.106 -6.680 888 HB3 TYR 130 2HB TYR 130 -4.950 2.945 -7.176 889 HD1 TYR 130 2HD TYR 130 -6.903 4.621 -9.353 890 HD2 TYR 130 1HD TYR 130 -6.753 3.965 -5.086 891 HE1 TYR 130 2HE TYR 130 -8.085 6.749 -8.965 892 HE2 TYR 130 1HE TYR 130 -7.895 6.098 -4.698 893 HH TYR 130 HH TYR 130 -9.063 7.937 -5.725 894 H VAL 131 H VAL 131 -7.166 -0.227 -8.385 895 HA VAL 131 HA VAL 131 -4.761 -1.741 -7.801 896 HB VAL 131 HB VAL 131 -7.540 -2.821 -8.436 897 HG11 VAL 131 1HG1 VAL 131 -5.103 -3.999 -7.097 898 HG12 VAL 131 2HG1 VAL 131 -6.709 -4.696 -6.877 899 HG13 VAL 131 3HG1 VAL 131 -6.021 -4.632 -8.499 900 HG21 VAL 131 3HG2 VAL 131 -8.016 -2.888 -6.077 901 HG22 VAL 131 1HG2 VAL 131 -6.385 -2.319 -5.661 902 HG23 VAL 131 2HG2 VAL 131 -7.543 -1.240 -6.448 903 H ALA 132 H ALA 132 -6.183 -0.743 -10.801 904 HA ALA 132 HA ALA 132 -4.520 -2.749 -12.266 905 HB1 ALA 132 1HB ALA 132 -6.930 -3.190 -12.556 906 HB2 ALA 132 2HB ALA 132 -7.174 -1.504 -13.079 907 HB3 ALA 132 3HB ALA 132 -6.191 -2.613 -14.064 908 H GLY 133 H GLY 133 -5.156 0.634 -11.714 909 HA2 GLY 133 1HA GLY 133 -3.613 1.581 -13.998 910 HA3 GLY 133 2HA GLY 133 -4.087 2.497 -12.560 911 H LEU 134 H LEU 134 -2.856 0.222 -10.867 912 HA LEU 134 HA LEU 134 -0.041 1.044 -10.932 913 HB2 LEU 134 1HB LEU 134 0.310 -0.560 -9.168 914 HB3 LEU 134 2HB LEU 134 -1.054 0.479 -8.811 915 HG LEU 134 HG LEU 134 -2.562 -1.457 -9.645 916 HD11 LEU 134 1HD1 LEU 134 0.069 -2.790 -9.787 917 HD12 LEU 134 2HD1 LEU 134 -1.475 -3.260 -10.495 918 HD13 LEU 134 3HD1 LEU 134 -1.093 -3.680 -8.817 919 HD21 LEU 134 3HD2 LEU 134 -2.402 -0.730 -7.329 920 HD22 LEU 134 1HD2 LEU 134 -0.936 -1.719 -7.088 921 HD23 LEU 134 2HD2 LEU 134 -2.510 -2.489 -7.410 922 H ARG 135 H ARG 135 1.607 -0.108 -11.869 923 HA ARG 135 HA ARG 135 0.903 -2.275 -13.772 924 HB2 ARG 135 1HB ARG 135 3.398 -0.635 -13.206 925 HB3 ARG 135 2HB ARG 135 3.398 -1.971 -14.347 926 HG2 ARG 135 1HG ARG 135 1.983 -0.879 -15.862 927 HG3 ARG 135 2HG ARG 135 1.398 0.285 -14.669 928 HD2 ARG 135 1HD ARG 135 2.920 1.756 -15.281 929 HD3 ARG 135 2HD ARG 135 4.211 0.675 -14.769 930 HE ARG 135 HE ARG 135 3.603 -0.290 -17.253 931 HH11 ARG 135 1HH1 ARG 135 4.435 2.929 -16.039 932 HH12 ARG 135 2HH1 ARG 135 5.151 3.498 -17.500 933 HH21 ARG 135 1HH2 ARG 135 4.892 0.303 -19.059 934 HH22 ARG 135 2HH2 ARG 135 5.581 1.897 -19.199 935 H THR 136 H THR 136 2.472 -4.261 -13.673 936 HA THR 136 HA THR 136 3.607 -4.687 -10.968 937 HB THR 136 HB THR 136 2.069 -6.725 -12.562 938 HG1 THR 136 1HG THR 136 1.314 -4.878 -10.630 939 HG21 THR 136 3HG2 THR 136 3.262 -6.841 -9.788 940 HG22 THR 136 1HG2 THR 136 3.442 -7.961 -11.156 941 HG23 THR 136 2HG2 THR 136 1.905 -7.881 -10.295 942 H GLU 137 H GLU 137 4.411 -3.978 -13.922 943 HA GLU 137 HA GLU 137 7.063 -5.012 -13.781 944 HB2 GLU 137 1HB GLU 137 5.938 -6.933 -14.956 945 HB3 GLU 137 2HB GLU 137 5.233 -5.798 -16.117 946 HG2 GLU 137 1HG GLU 137 8.040 -5.284 -16.179 947 HG3 GLU 137 2HG GLU 137 7.944 -7.011 -15.987 Start of MODEL 18 1 H1 GLY 19 H GLY 19 -14.676 -20.188 0.486 2 HA2 GLY 19 1HA GLY 19 -12.937 -20.551 -1.166 3 HA3 GLY 19 2HA GLY 19 -14.338 -19.763 -1.915 4 H HIS 20 H HIS 20 -13.178 -18.715 -3.554 5 HA HIS 20 HA HIS 20 -10.748 -17.272 -3.147 6 HB2 HIS 20 1HB HIS 20 -12.830 -17.211 -5.364 7 HB3 HIS 20 2HB HIS 20 -11.283 -16.372 -5.442 8 HD1 HIS 20 1HD HIS 20 -9.064 -17.948 -5.623 9 HD2 HIS 20 2HD HIS 20 -12.849 -19.805 -5.907 10 HE1 HIS 20 1HE HIS 20 -8.669 -20.254 -6.582 11 H MET 21 H MET 21 -14.049 -16.348 -2.571 12 HA MET 21 HA MET 21 -13.776 -13.576 -3.171 13 HB2 MET 21 1HB MET 21 -15.905 -15.018 -3.191 14 HB3 MET 21 2HB MET 21 -15.926 -14.857 -1.449 15 HG2 MET 21 1HG MET 21 -17.301 -13.150 -1.955 16 HG3 MET 21 2HG MET 21 -15.802 -12.242 -2.035 17 HE1 MET 21 3HE MET 21 -15.289 -11.727 -5.863 18 HE2 MET 21 1HE MET 21 -14.590 -11.598 -4.238 19 HE3 MET 21 2HE MET 21 -14.640 -13.171 -5.079 20 H LYS 22 H LYS 22 -11.708 -13.450 -1.892 21 HA LYS 22 HA LYS 22 -12.202 -12.137 0.723 22 HB2 LYS 22 1HB LYS 22 -10.010 -14.077 -0.117 23 HB3 LYS 22 2HB LYS 22 -9.681 -12.846 1.090 24 HG2 LYS 22 1HG LYS 22 -11.162 -13.736 2.665 25 HG3 LYS 22 2HG LYS 22 -12.042 -14.706 1.473 26 HD2 LYS 22 1HD LYS 22 -10.303 -16.267 1.240 27 HD3 LYS 22 2HD LYS 22 -9.099 -15.227 1.996 28 HE2 LYS 22 1HE LYS 22 -11.402 -15.849 3.750 29 HE3 LYS 22 2HE LYS 22 -10.517 -17.289 3.220 30 HZ1 LYS 22 3HZ LYS 22 -8.540 -16.458 4.130 31 HZ2 LYS 22 1HZ LYS 22 -9.708 -16.243 5.300 32 HZ3 LYS 22 2HZ LYS 22 -9.187 -14.962 4.429 33 H PHE 23 H PHE 23 -10.394 -10.508 1.036 34 HA PHE 23 HA PHE 23 -9.820 -9.009 -1.435 35 HB2 PHE 23 1HB PHE 23 -9.040 -8.642 1.479 36 HB3 PHE 23 2HB PHE 23 -8.328 -7.693 0.195 37 HD1 PHE 23 2HD PHE 23 -11.726 -8.144 -0.835 38 HD2 PHE 23 1HD PHE 23 -9.193 -5.911 1.887 39 HE1 PHE 23 2HE PHE 23 -13.376 -6.357 -0.743 40 HE2 PHE 23 1HE PHE 23 -10.903 -4.163 2.019 41 HZ PHE 23 HZ PHE 23 -13.005 -4.352 0.701 42 H THR 24 H THR 24 -7.482 -8.376 -1.730 43 HA THR 24 HA THR 24 -5.654 -10.683 -1.645 44 HB THR 24 HB THR 24 -5.306 -9.667 -4.171 45 HG1 THR 24 1HG THR 24 -7.510 -9.302 -4.959 46 HG21 THR 24 3HG2 THR 24 -7.570 -11.551 -3.269 47 HG22 THR 24 1HG2 THR 24 -5.873 -12.021 -3.572 48 HG23 THR 24 2HG2 THR 24 -6.904 -11.476 -4.902 49 H ASP 25 H ASP 25 -3.425 -10.023 -1.943 50 HA ASP 25 HA ASP 25 -2.559 -7.800 -0.514 51 HB2 ASP 25 1HB ASP 25 -0.388 -8.153 -1.861 52 HB3 ASP 25 2HB ASP 25 -0.984 -9.468 -0.848 53 H GLN 26 H GLN 26 -2.775 -8.068 -4.084 54 HA GLN 26 HA GLN 26 -2.266 -5.563 -4.972 55 HB2 GLN 26 1HB GLN 26 -4.595 -7.406 -5.681 56 HB3 GLN 26 2HB GLN 26 -4.131 -6.011 -6.650 57 HG2 GLN 26 1HG GLN 26 -1.925 -6.980 -7.064 58 HG3 GLN 26 2HG GLN 26 -2.257 -8.313 -5.988 59 HE21 GLN 26 1HE2 GLN 26 -4.163 -6.803 -8.713 60 HE22 GLN 26 2HE2 GLN 26 -4.275 -8.318 -9.584 61 H GLN 27 H GLN 27 -5.472 -6.527 -3.725 62 HA GLN 27 HA GLN 27 -6.653 -3.935 -4.156 63 HB2 GLN 27 1HB GLN 27 -7.520 -6.440 -2.645 64 HB3 GLN 27 2HB GLN 27 -8.584 -5.076 -2.927 65 HG2 GLN 27 1HG GLN 27 -7.196 -6.593 -5.200 66 HG3 GLN 27 2HG GLN 27 -8.747 -7.050 -4.552 67 HE21 GLN 27 1HE2 GLN 27 -8.408 -6.328 -7.348 68 HE22 GLN 27 2HE2 GLN 27 -9.238 -4.827 -7.569 69 H ILE 28 H ILE 28 -5.341 -5.646 -1.318 70 HA ILE 28 HA ILE 28 -6.043 -3.656 0.640 71 HB ILE 28 HB ILE 28 -4.003 -5.909 0.490 72 HG12 ILE 28 1HG1 ILE 28 -6.555 -5.565 2.140 73 HG13 ILE 28 2HG1 ILE 28 -6.492 -6.394 0.596 74 HG21 ILE 28 1HG2 ILE 28 -3.069 -4.207 2.035 75 HG22 ILE 28 2HG2 ILE 28 -4.591 -4.207 2.948 76 HG23 ILE 28 3HG2 ILE 28 -3.556 -5.661 2.875 77 HD11 ILE 28 3HD1 ILE 28 -5.152 -7.274 3.161 78 HD12 ILE 28 1HD1 ILE 28 -6.454 -8.072 2.274 79 HD13 ILE 28 2HD1 ILE 28 -4.825 -8.016 1.571 80 H GLY 29 H GLY 29 -3.388 -4.035 -1.674 81 HA2 GLY 29 1HA GLY 29 -1.434 -2.387 -0.777 82 HA3 GLY 29 2HA GLY 29 -1.871 -2.555 -2.478 83 H VAL 30 H VAL 30 -4.249 -1.351 -2.769 84 HA VAL 30 HA VAL 30 -3.364 1.388 -2.790 85 HB VAL 30 HB VAL 30 -5.965 0.041 -3.608 86 HG11 VAL 30 1HG1 VAL 30 -5.127 2.919 -4.189 87 HG12 VAL 30 2HG1 VAL 30 -6.534 2.064 -4.856 88 HG13 VAL 30 3HG1 VAL 30 -6.469 2.418 -3.124 89 HG21 VAL 30 3HG2 VAL 30 -3.594 1.166 -5.192 90 HG22 VAL 30 1HG2 VAL 30 -3.968 -0.552 -4.964 91 HG23 VAL 30 2HG2 VAL 30 -5.060 0.472 -5.903 92 H LEU 31 H LEU 31 -5.677 -0.412 -0.751 93 HA LEU 31 HA LEU 31 -6.688 1.892 0.665 94 HB2 LEU 31 1HB LEU 31 -6.754 -1.083 0.966 95 HB3 LEU 31 2HB LEU 31 -6.799 -0.179 2.478 96 HG LEU 31 HG LEU 31 -8.789 0.879 2.051 97 HD11 LEU 31 1HD1 LEU 31 -8.604 1.588 -0.295 98 HD12 LEU 31 2HD1 LEU 31 -10.083 0.670 -0.068 99 HD13 LEU 31 3HD1 LEU 31 -8.681 -0.110 -0.837 100 HD21 LEU 31 3HD2 LEU 31 -9.088 -1.892 0.874 101 HD22 LEU 31 1HD2 LEU 31 -10.343 -0.968 1.720 102 HD23 LEU 31 2HD2 LEU 31 -8.919 -1.573 2.597 103 H ALA 32 H ALA 32 -4.017 -0.396 1.522 104 HA ALA 32 HA ALA 32 -3.378 1.083 3.904 105 HB1 ALA 32 1HB ALA 32 -1.177 -0.176 3.730 106 HB2 ALA 32 2HB ALA 32 -2.650 -1.174 3.796 107 HB3 ALA 32 3HB ALA 32 -1.826 -0.925 2.252 108 H GLY 33 H GLY 33 -2.364 1.501 0.492 109 HA2 GLY 33 1HA GLY 33 -0.359 3.474 0.972 110 HA3 GLY 33 2HA GLY 33 -1.305 3.274 -0.505 111 H LEU 34 H LEU 34 -3.943 3.745 1.069 112 HA LEU 34 HA LEU 34 -3.848 6.632 0.860 113 HB2 LEU 34 1HB LEU 34 -6.002 4.786 1.917 114 HB3 LEU 34 2HB LEU 34 -6.201 6.524 1.731 115 HG LEU 34 HG LEU 34 -5.507 4.694 -0.599 116 HD11 LEU 34 1HD1 LEU 34 -7.615 4.080 0.471 117 HD12 LEU 34 2HD1 LEU 34 -7.865 4.684 -1.139 118 HD13 LEU 34 3HD1 LEU 34 -8.214 5.752 0.251 119 HD21 LEU 34 3HD2 LEU 34 -6.417 6.674 -1.906 120 HD22 LEU 34 1HD2 LEU 34 -4.860 6.893 -1.132 121 HD23 LEU 34 2HD2 LEU 34 -6.332 7.606 -0.405 122 H ALA 35 H ALA 35 -3.548 4.356 3.488 123 HA ALA 35 HA ALA 35 -3.780 6.368 5.593 124 HB1 ALA 35 1HB ALA 35 -4.045 3.972 6.116 125 HB2 ALA 35 2HB ALA 35 -2.361 3.665 5.624 126 HB3 ALA 35 3HB ALA 35 -2.708 4.688 7.035 127 H ILE 36 H ILE 36 -1.266 5.499 3.263 128 HA ILE 36 HA ILE 36 0.748 7.070 4.781 129 HB ILE 36 HB ILE 36 1.226 4.482 3.277 130 HG12 ILE 36 1HG1 ILE 36 0.015 3.805 5.242 131 HG13 ILE 36 2HG1 ILE 36 1.700 3.350 5.332 132 HG21 ILE 36 1HG2 ILE 36 3.065 6.117 5.097 133 HG22 ILE 36 2HG2 ILE 36 3.451 4.575 4.299 134 HG23 ILE 36 3HG2 ILE 36 3.168 6.017 3.334 135 HD11 ILE 36 3HD1 ILE 36 2.116 5.212 6.948 136 HD12 ILE 36 1HD1 ILE 36 0.390 5.576 6.932 137 HD13 ILE 36 2HD1 ILE 36 0.956 4.005 7.519 138 H SER 37 H SER 37 0.266 8.859 3.449 139 HA SER 37 HA SER 37 0.816 10.301 1.846 140 HB2 SER 37 1HB SER 37 2.994 8.821 2.118 141 HB3 SER 37 2HB SER 37 2.646 8.351 0.457 142 HG SER 37 HG SER 37 2.842 10.482 -0.144 143 HA PRO 38 HA PRO 38 -2.253 8.001 -0.934 144 HB2 PRO 38 1HB PRO 38 -4.238 9.956 -0.805 145 HB3 PRO 38 2HB PRO 38 -4.140 8.556 0.287 146 HG2 PRO 38 1HG PRO 38 -3.149 11.341 0.767 147 HG3 PRO 38 2HG PRO 38 -4.067 10.273 1.874 148 HD2 PRO 38 1HD PRO 38 -1.391 10.515 2.134 149 HD3 PRO 38 2HD PRO 38 -2.156 8.907 2.294 150 H GLU 39 H GLU 39 -1.344 11.467 -0.694 151 HA GLU 39 HA GLU 39 -2.003 12.218 -3.337 152 HB2 GLU 39 1HB GLU 39 -0.019 13.257 -1.293 153 HB3 GLU 39 2HB GLU 39 -0.191 14.027 -2.875 154 HG2 GLU 39 1HG GLU 39 -2.444 14.632 -2.525 155 HG3 GLU 39 2HG GLU 39 -2.649 13.511 -1.175 156 H TRP 40 H TRP 40 0.996 10.725 -2.084 157 HA TRP 40 HA TRP 40 2.487 10.957 -4.543 158 HB2 TRP 40 1HB TRP 40 3.746 10.535 -2.589 159 HB3 TRP 40 2HB TRP 40 2.707 9.222 -2.075 160 HD1 TRP 40 HD TRP 40 5.450 9.924 -4.698 161 HE1 TRP 40 1HE TRP 40 6.710 7.730 -5.123 162 HE3 TRP 40 3HE TRP 40 2.312 6.703 -2.245 163 HZ2 TRP 40 2HZ TRP 40 6.307 4.924 -4.601 164 HZ3 TRP 40 3HZ TRP 40 2.651 4.266 -2.410 165 HH2 TRP 40 HH TRP 40 4.680 3.349 -3.526 166 H LEU 41 H LEU 41 0.676 8.203 -3.081 167 HA LEU 41 HA LEU 41 0.827 6.434 -5.233 168 HB2 LEU 41 1HB LEU 41 0.015 5.760 -3.105 169 HB3 LEU 41 2HB LEU 41 -1.360 6.854 -3.161 170 HG LEU 41 HG LEU 41 -1.090 4.664 -5.260 171 HD11 LEU 41 1HD1 LEU 41 -2.321 3.132 -3.800 172 HD12 LEU 41 2HD1 LEU 41 -2.296 4.322 -2.477 173 HD13 LEU 41 3HD1 LEU 41 -0.784 3.577 -3.051 174 HD21 LEU 41 3HD2 LEU 41 -3.654 4.695 -5.026 175 HD22 LEU 41 1HD2 LEU 41 -2.996 6.180 -5.655 176 HD23 LEU 41 2HD2 LEU 41 -3.430 6.080 -3.926 177 H LYS 42 H LYS 42 -1.634 8.969 -4.679 178 HA LYS 42 HA LYS 42 -3.158 8.384 -7.005 179 HB2 LYS 42 1HB LYS 42 -2.944 10.798 -5.176 180 HB3 LYS 42 2HB LYS 42 -4.031 10.772 -6.562 181 HG2 LYS 42 1HG LYS 42 -5.231 8.849 -5.746 182 HG3 LYS 42 2HG LYS 42 -4.038 8.571 -4.473 183 HD2 LYS 42 1HD LYS 42 -5.891 9.453 -3.374 184 HD3 LYS 42 2HD LYS 42 -4.735 10.785 -3.472 185 HE2 LYS 42 1HE LYS 42 -6.017 11.506 -5.607 186 HE3 LYS 42 2HE LYS 42 -7.233 10.300 -5.175 187 HZ1 LYS 42 3HZ LYS 42 -6.397 12.567 -3.477 188 HZ2 LYS 42 1HZ LYS 42 -7.580 11.480 -3.083 189 HZ3 LYS 42 2HZ LYS 42 -7.796 12.508 -4.337 190 H GLN 43 H GLN 43 -0.488 10.778 -6.542 191 HA GLN 43 HA GLN 43 -0.543 11.787 -9.221 192 HB2 GLN 43 1HB GLN 43 1.716 11.459 -7.197 193 HB3 GLN 43 2HB GLN 43 1.912 12.165 -8.797 194 HG2 GLN 43 1HG GLN 43 0.345 13.972 -8.247 195 HG3 GLN 43 2HG GLN 43 0.118 13.312 -6.636 196 HE21 GLN 43 1HE2 GLN 43 3.407 12.930 -7.799 197 HE22 GLN 43 2HE2 GLN 43 4.088 14.320 -7.016 198 H ASN 44 H ASN 44 1.096 8.951 -7.734 199 HA ASN 44 HA ASN 44 2.634 8.264 -10.018 200 HB2 ASN 44 1HB ASN 44 1.467 6.220 -8.109 201 HB3 ASN 44 2HB ASN 44 2.910 6.065 -9.094 202 HD21 ASN 44 1HD2 ASN 44 4.031 8.929 -7.929 203 HD22 ASN 44 2HD2 ASN 44 4.414 8.317 -6.363 204 H ILE 45 H ILE 45 -0.545 6.957 -8.896 205 HA ILE 45 HA ILE 45 -1.100 5.294 -11.120 206 HB ILE 45 HB ILE 45 -2.911 6.836 -9.232 207 HG12 ILE 45 1HG1 ILE 45 -1.611 5.063 -8.098 208 HG13 ILE 45 2HG1 ILE 45 -3.330 4.796 -8.067 209 HG21 ILE 45 1HG2 ILE 45 -4.693 5.184 -9.971 210 HG22 ILE 45 2HG2 ILE 45 -4.290 6.434 -11.145 211 HG23 ILE 45 3HG2 ILE 45 -3.657 4.801 -11.357 212 HD11 ILE 45 3HD1 ILE 45 -3.023 3.139 -9.961 213 HD12 ILE 45 1HD1 ILE 45 -1.269 3.371 -9.775 214 HD13 ILE 45 2HD1 ILE 45 -2.245 2.708 -8.443 215 H ALA 46 H ALA 46 -1.732 8.803 -10.626 216 HA ALA 46 HA ALA 46 -3.166 9.146 -13.092 217 HB1 ALA 46 1HB ALA 46 -3.411 10.623 -11.119 218 HB2 ALA 46 2HB ALA 46 -1.716 11.149 -11.334 219 HB3 ALA 46 3HB ALA 46 -2.939 11.520 -12.569 220 H ALA 47 H ALA 47 0.003 8.289 -12.879 221 HA ALA 47 HA ALA 47 0.179 9.152 -15.652 222 HB1 ALA 47 1HB ALA 47 1.603 10.775 -14.607 223 HB2 ALA 47 2HB ALA 47 2.473 9.529 -13.712 224 HB3 ALA 47 3HB ALA 47 2.628 9.632 -15.487 225 H ASN 48 H ASN 48 -0.538 6.728 -14.064 226 HA ASN 48 HA ASN 48 -0.167 4.522 -13.773 227 HB2 ASN 48 1HB ASN 48 -0.735 4.808 -16.169 228 HB3 ASN 48 2HB ASN 48 0.980 4.721 -16.568 229 HD21 ASN 48 1HD2 ASN 48 1.792 2.657 -16.991 230 HD22 ASN 48 2HD2 ASN 48 0.940 1.177 -16.618 231 H GLN 49 H GLN 49 2.074 6.185 -12.804 232 HA GLN 49 HA GLN 49 4.556 4.756 -13.516 233 HB2 GLN 49 1HB GLN 49 4.048 6.945 -11.449 234 HB3 GLN 49 2HB GLN 49 5.632 6.313 -11.892 235 HG2 GLN 49 1HG GLN 49 3.746 7.806 -13.726 236 HG3 GLN 49 2HG GLN 49 5.211 8.443 -12.996 237 HE21 GLN 49 1HE2 GLN 49 3.900 6.323 -15.477 238 HE22 GLN 49 2HE2 GLN 49 5.422 6.044 -16.337 239 H LEU 50 H LEU 50 2.083 4.158 -11.217 240 HA LEU 50 HA LEU 50 3.835 3.403 -9.024 241 HB2 LEU 50 1HB LEU 50 1.450 4.103 -8.744 242 HB3 LEU 50 2HB LEU 50 0.946 2.654 -9.583 243 HG LEU 50 HG LEU 50 1.878 1.251 -7.744 244 HD11 LEU 50 1HD1 LEU 50 2.713 3.911 -6.498 245 HD12 LEU 50 2HD1 LEU 50 3.789 2.587 -6.992 246 HD13 LEU 50 3HD1 LEU 50 2.690 2.365 -5.650 247 HD21 LEU 50 3HD2 LEU 50 0.375 2.120 -5.880 248 HD22 LEU 50 1HD2 LEU 50 -0.402 1.957 -7.450 249 HD23 LEU 50 2HD2 LEU 50 0.098 3.563 -6.871 250 H VAL 51 H VAL 51 4.829 1.399 -8.658 251 HA VAL 51 HA VAL 51 4.061 -0.878 -10.376 252 HB VAL 51 HB VAL 51 6.786 -0.228 -9.169 253 HG11 VAL 51 1HG1 VAL 51 7.600 -2.192 -10.491 254 HG12 VAL 51 2HG1 VAL 51 6.473 -2.667 -9.227 255 HG13 VAL 51 3HG1 VAL 51 5.918 -2.587 -10.904 256 HG21 VAL 51 3HG2 VAL 51 6.048 -0.428 -12.127 257 HG22 VAL 51 1HG2 VAL 51 6.234 1.109 -11.243 258 HG23 VAL 51 2HG2 VAL 51 7.610 0.016 -11.436 259 H TYR 52 H TYR 52 3.984 -2.862 -9.223 260 HA TYR 52 HA TYR 52 3.845 -2.830 -6.258 261 HB2 TYR 52 1HB TYR 52 1.595 -3.056 -7.148 262 HB3 TYR 52 2HB TYR 52 2.130 -4.147 -8.413 263 HD1 TYR 52 1HD TYR 52 1.970 -3.881 -4.681 264 HD2 TYR 52 2HD TYR 52 1.949 -6.495 -8.129 265 HE1 TYR 52 1HE TYR 52 1.540 -5.827 -3.215 266 HE2 TYR 52 2HE TYR 52 1.588 -8.440 -6.658 267 HH TYR 52 HH TYR 52 0.489 -8.746 -4.155 268 H GLY 53 H GLY 53 4.874 -4.750 -5.305 269 HA2 GLY 53 1HA GLY 53 5.863 -6.819 -7.099 270 HA3 GLY 53 2HA GLY 53 7.136 -5.716 -6.546 271 H ILE 54 H ILE 54 7.433 -8.238 -6.038 272 HA ILE 54 HA ILE 54 6.911 -8.723 -3.105 273 HB ILE 54 HB ILE 54 7.300 -10.647 -5.446 274 HG12 ILE 54 1HG1 ILE 54 4.997 -9.688 -5.434 275 HG13 ILE 54 2HG1 ILE 54 5.052 -11.410 -5.146 276 HG21 ILE 54 1HG2 ILE 54 6.888 -11.230 -2.489 277 HG22 ILE 54 2HG2 ILE 54 6.814 -12.435 -3.793 278 HG23 ILE 54 3HG2 ILE 54 8.307 -11.571 -3.466 279 HD11 ILE 54 3HD1 ILE 54 4.715 -9.331 -2.942 280 HD12 ILE 54 1HD1 ILE 54 3.407 -10.289 -3.694 281 HD13 ILE 54 2HD1 ILE 54 4.658 -11.100 -2.747 282 H VAL 55 H VAL 55 8.255 -8.822 -1.999 283 HA VAL 55 HA VAL 55 10.855 -8.030 -1.977 284 HB VAL 55 HB VAL 55 10.463 -9.511 0.266 285 HG11 VAL 55 1HG1 VAL 55 9.119 -7.602 1.155 286 HG12 VAL 55 2HG1 VAL 55 10.542 -7.105 0.255 287 HG13 VAL 55 3HG1 VAL 55 8.937 -6.996 -0.506 288 HG21 VAL 55 3HG2 VAL 55 8.607 -10.797 -0.646 289 HG22 VAL 55 1HG2 VAL 55 8.437 -10.019 0.908 290 HG23 VAL 55 2HG2 VAL 55 7.604 -9.315 -0.477 291 H LYS 56 H LYS 56 9.685 -11.459 -2.021 292 HA LYS 56 HA LYS 56 10.591 -13.361 -2.652 293 HB2 LYS 56 1HB LYS 56 12.197 -11.514 -4.461 294 HB3 LYS 56 2HB LYS 56 12.402 -13.232 -4.505 295 HG2 LYS 56 1HG LYS 56 9.589 -12.915 -4.610 296 HG3 LYS 56 2HG LYS 56 10.207 -11.580 -5.593 297 HD2 LYS 56 1HD LYS 56 11.532 -13.219 -6.914 298 HD3 LYS 56 2HD LYS 56 10.982 -14.485 -5.804 299 HE2 LYS 56 1HE LYS 56 8.600 -13.948 -6.522 300 HE3 LYS 56 2HE LYS 56 9.321 -12.993 -7.834 301 HZ1 LYS 56 3HZ LYS 56 10.548 -15.051 -8.447 302 HZ2 LYS 56 1HZ LYS 56 8.909 -15.196 -8.623 303 HZ3 LYS 56 2HZ LYS 56 9.683 -15.895 -7.345 304 HA PRO 57 HA PRO 57 13.852 -14.393 0.031 305 HB2 PRO 57 1HB PRO 57 14.962 -16.666 -1.008 306 HB3 PRO 57 2HB PRO 57 13.299 -16.562 -0.358 307 HG2 PRO 57 1HG PRO 57 14.131 -16.282 -3.264 308 HG3 PRO 57 2HG PRO 57 12.920 -17.421 -2.593 309 HD2 PRO 57 1HD PRO 57 12.085 -15.107 -3.590 310 HD3 PRO 57 2HD PRO 57 11.439 -15.639 -2.013 311 H SER 58 H SER 58 14.620 -13.480 -3.114 312 HA SER 58 HA SER 58 17.128 -12.320 -2.233 313 HB2 SER 58 1HB SER 58 17.165 -14.231 -4.613 314 HB3 SER 58 2HB SER 58 18.503 -13.189 -4.078 315 HG SER 58 HG SER 58 17.646 -14.468 -1.959 316 H ASP 59 H ASP 59 15.938 -10.443 -2.433 317 HA ASP 59 HA ASP 59 16.470 -9.364 -5.036 318 HB2 ASP 59 1HB ASP 59 13.830 -9.713 -4.837 319 HB3 ASP 59 2HB ASP 59 13.946 -8.193 -3.939 320 H THR 60 H THR 60 15.784 -6.640 -4.325 321 HA THR 60 HA THR 60 17.963 -6.263 -2.439 322 HB THR 60 HB THR 60 17.984 -5.369 -4.764 323 HG1 THR 60 1HG THR 60 18.775 -3.413 -4.324 324 HG21 THR 60 3HG2 THR 60 15.610 -4.765 -4.946 325 HG22 THR 60 1HG2 THR 60 16.655 -3.401 -5.363 326 HG23 THR 60 2HG2 THR 60 15.836 -3.454 -3.792 327 H VAL 61 H VAL 61 15.769 -7.084 -1.166 328 HA VAL 61 HA VAL 61 14.441 -4.667 -0.059 329 HB VAL 61 HB VAL 61 12.735 -6.353 0.636 330 HG11 VAL 61 1HG1 VAL 61 12.884 -4.920 -1.545 331 HG12 VAL 61 2HG1 VAL 61 13.138 -6.467 -2.361 332 HG13 VAL 61 3HG1 VAL 61 11.653 -6.169 -1.440 333 HG21 VAL 61 3HG2 VAL 61 14.258 -8.275 -1.195 334 HG22 VAL 61 1HG2 VAL 61 14.155 -8.415 0.567 335 HG23 VAL 61 2HG2 VAL 61 12.672 -8.581 -0.389 336 HA PRO 62 HA PRO 62 16.465 -5.133 3.743 337 HB2 PRO 62 1HB PRO 62 14.650 -4.190 5.601 338 HB3 PRO 62 2HB PRO 62 15.512 -3.169 4.417 339 HG2 PRO 62 1HG PRO 62 12.709 -4.259 4.251 340 HG3 PRO 62 2HG PRO 62 13.289 -2.624 3.833 341 HD2 PRO 62 1HD PRO 62 12.869 -4.551 1.941 342 HD3 PRO 62 2HD PRO 62 14.160 -3.341 1.773 343 H ALA 63 H ALA 63 16.084 -6.007 6.168 344 HA ALA 63 HA ALA 63 15.108 -8.770 5.863 345 HB1 ALA 63 1HB ALA 63 15.979 -9.008 8.188 346 HB2 ALA 63 2HB ALA 63 17.218 -8.440 7.050 347 HB3 ALA 63 3HB ALA 63 16.432 -7.303 8.170 348 H GLY 64 H GLY 64 13.546 -9.601 7.464 349 HA2 GLY 64 1HA GLY 64 11.632 -9.490 8.778 350 HA3 GLY 64 2HA GLY 64 12.031 -7.814 9.147 351 H VAL 65 H VAL 65 11.567 -9.053 5.856 352 HA VAL 65 HA VAL 65 8.812 -8.090 5.635 353 HB VAL 65 HB VAL 65 9.422 -6.780 3.528 354 HG11 VAL 65 1HG1 VAL 65 8.816 -5.663 5.647 355 HG12 VAL 65 2HG1 VAL 65 10.550 -5.523 6.032 356 HG13 VAL 65 3HG1 VAL 65 9.890 -4.726 4.594 357 HG21 VAL 65 3HG2 VAL 65 11.752 -7.716 3.311 358 HG22 VAL 65 1HG2 VAL 65 11.579 -5.971 3.142 359 HG23 VAL 65 2HG2 VAL 65 12.202 -6.646 4.666 360 H ASP 66 H ASP 66 10.229 -10.733 5.533 361 HA ASP 66 HA ASP 66 11.088 -11.587 3.057 362 HB2 ASP 66 1HB ASP 66 10.973 -12.579 5.556 363 HB3 ASP 66 2HB ASP 66 9.683 -13.536 4.881 364 H ASP 67 H ASP 67 8.069 -10.692 3.329 365 HA ASP 67 HA ASP 67 6.958 -12.063 1.097 366 HB2 ASP 67 1HB ASP 67 6.651 -13.897 2.769 367 HB3 ASP 67 2HB ASP 67 5.743 -12.804 3.792 368 H TYR 68 H TYR 68 7.412 -9.349 2.498 369 HA TYR 68 HA TYR 68 4.636 -8.351 2.915 370 HB2 TYR 68 1HB TYR 68 7.397 -7.283 3.480 371 HB3 TYR 68 2HB TYR 68 6.037 -6.188 3.320 372 HD1 TYR 68 1HD TYR 68 6.398 -9.529 5.128 373 HD2 TYR 68 2HD TYR 68 5.292 -5.358 5.304 374 HE1 TYR 68 1HE TYR 68 5.784 -9.810 7.469 375 HE2 TYR 68 2HE TYR 68 4.554 -5.648 7.623 376 HH TYR 68 HH TYR 68 4.559 -8.843 9.236 377 H SER 69 H SER 69 3.812 -8.162 0.738 378 HA SER 69 HA SER 69 5.287 -7.428 -1.509 379 HB2 SER 69 1HB SER 69 2.532 -6.364 -1.322 380 HB3 SER 69 2HB SER 69 3.279 -7.441 -2.514 381 HG SER 69 HG SER 69 2.931 -9.194 -1.011 382 H TYR 70 H TYR 70 5.534 -5.362 -2.599 383 HA TYR 70 HA TYR 70 5.335 -2.989 -0.837 384 HB2 TYR 70 1HB TYR 70 7.460 -2.177 -1.535 385 HB3 TYR 70 2HB TYR 70 7.693 -3.743 -0.861 386 HD1 TYR 70 2HD TYR 70 8.218 -5.713 -2.397 387 HD2 TYR 70 1HD TYR 70 8.055 -1.633 -3.821 388 HE1 TYR 70 2HE TYR 70 9.660 -6.313 -4.335 389 HE2 TYR 70 1HE TYR 70 9.472 -2.242 -5.737 390 HH TYR 70 HH TYR 70 10.621 -3.918 -6.840 391 H LEU 71 H LEU 71 5.578 -0.968 -2.038 392 HA LEU 71 HA LEU 71 4.505 -0.930 -4.785 393 HB2 LEU 71 1HB LEU 71 3.435 0.457 -2.286 394 HB3 LEU 71 2HB LEU 71 3.142 1.106 -3.884 395 HG LEU 71 HG LEU 71 2.334 -1.734 -3.157 396 HD11 LEU 71 1HD1 LEU 71 0.713 0.828 -2.825 397 HD12 LEU 71 2HD1 LEU 71 1.275 -0.288 -1.572 398 HD13 LEU 71 3HD1 LEU 71 0.060 -0.828 -2.746 399 HD21 LEU 71 3HD2 LEU 71 1.362 0.178 -5.318 400 HD22 LEU 71 1HD2 LEU 71 0.723 -1.451 -5.012 401 HD23 LEU 71 2HD2 LEU 71 2.383 -1.239 -5.567 402 H VAL 72 H VAL 72 5.748 0.523 -5.947 403 HA VAL 72 HA VAL 72 7.010 2.772 -4.606 404 HB VAL 72 HB VAL 72 8.573 0.760 -4.375 405 HG11 VAL 72 1HG1 VAL 72 9.956 0.098 -6.238 406 HG12 VAL 72 2HG1 VAL 72 8.259 -0.212 -6.637 407 HG13 VAL 72 3HG1 VAL 72 9.093 1.189 -7.341 408 HG21 VAL 72 3HG2 VAL 72 9.608 3.208 -5.818 409 HG22 VAL 72 1HG2 VAL 72 9.297 3.057 -4.079 410 HG23 VAL 72 2HG2 VAL 72 10.564 2.081 -4.823 411 H ALA 73 H ALA 73 7.660 4.431 -6.311 412 HA ALA 73 HA ALA 73 6.018 3.992 -8.745 413 HB1 ALA 73 1HB ALA 73 6.321 6.352 -9.184 414 HB2 ALA 73 2HB ALA 73 5.738 6.107 -7.523 415 HB3 ALA 73 3HB ALA 73 7.431 6.501 -7.818 416 H ALA 74 H ALA 74 6.870 3.915 -10.734 417 HA ALA 74 HA ALA 74 9.163 2.498 -11.214 418 HB1 ALA 74 1HB ALA 74 7.621 4.295 -13.142 419 HB2 ALA 74 2HB ALA 74 8.642 2.928 -13.595 420 HB3 ALA 74 3HB ALA 74 7.155 2.629 -12.695 421 H ASP 75 H ASP 75 9.165 5.817 -10.591 422 HA ASP 75 HA ASP 75 11.793 6.190 -11.916 423 HB2 ASP 75 1HB ASP 75 9.382 7.424 -12.751 424 HB3 ASP 75 2HB ASP 75 10.204 8.670 -11.843 425 H ASP 76 H ASP 76 10.436 5.859 -9.036 426 HA ASP 76 HA ASP 76 12.167 7.839 -7.646 427 HB2 ASP 76 1HB ASP 76 9.847 8.721 -7.805 428 HB3 ASP 76 2HB ASP 76 9.246 7.229 -7.115 429 H GLN 77 H GLN 77 12.575 5.135 -8.447 430 HA GLN 77 HA GLN 77 11.567 3.183 -6.653 431 HB2 GLN 77 1HB GLN 77 13.980 2.952 -8.469 432 HB3 GLN 77 2HB GLN 77 13.065 1.624 -7.761 433 HG2 GLN 77 1HG GLN 77 11.028 2.428 -8.995 434 HG3 GLN 77 2HG GLN 77 12.040 3.619 -9.827 435 HE21 GLN 77 1HE2 GLN 77 10.931 0.330 -9.828 436 HE22 GLN 77 2HE2 GLN 77 11.972 -0.228 -11.129 437 H ASP 78 H ASP 78 14.322 5.232 -6.370 438 HA ASP 78 HA ASP 78 15.176 3.851 -3.857 439 HB2 ASP 78 1HB ASP 78 16.704 4.384 -6.142 440 HB3 ASP 78 2HB ASP 78 17.118 5.714 -5.098 441 H GLY 79 H GLY 79 13.016 5.915 -4.464 442 HA2 GLY 79 1HA GLY 79 13.957 8.273 -2.906 443 HA3 GLY 79 2HA GLY 79 12.619 8.234 -4.054 444 H THR 80 H THR 80 10.589 7.527 -3.369 445 HA THR 80 HA THR 80 10.080 7.076 -0.520 446 HB THR 80 HB THR 80 8.051 6.666 -2.741 447 HG1 THR 80 1HG THR 80 8.894 8.525 -3.352 448 HG21 THR 80 3HG2 THR 80 6.519 7.675 -1.089 449 HG22 THR 80 1HG2 THR 80 7.867 7.898 0.052 450 HG23 THR 80 2HG2 THR 80 7.326 6.262 -0.399 451 H ILE 81 H ILE 81 8.963 4.927 0.186 452 HA ILE 81 HA ILE 81 8.260 3.108 -1.771 453 HB ILE 81 HB ILE 81 10.643 2.367 -1.718 454 HG12 ILE 81 1HG1 ILE 81 9.108 0.134 -0.394 455 HG13 ILE 81 2HG1 ILE 81 8.512 0.792 -1.894 456 HG21 ILE 81 1HG2 ILE 81 11.592 1.222 0.221 457 HG22 ILE 81 2HG2 ILE 81 11.224 2.907 0.635 458 HG23 ILE 81 3HG2 ILE 81 10.162 1.590 1.187 459 HD11 ILE 81 3HD1 ILE 81 9.939 -1.083 -2.398 460 HD12 ILE 81 1HD1 ILE 81 10.767 0.375 -2.951 461 HD13 ILE 81 2HD1 ILE 81 11.275 -0.420 -1.440 462 H ILE 82 H ILE 82 6.816 1.462 -0.869 463 HA ILE 82 HA ILE 82 6.438 1.603 2.028 464 HB ILE 82 HB ILE 82 4.019 1.690 0.200 465 HG12 ILE 82 1HG1 ILE 82 5.436 4.168 1.313 466 HG13 ILE 82 2HG1 ILE 82 5.267 3.755 -0.389 467 HG21 ILE 82 1HG2 ILE 82 2.859 2.377 2.198 468 HG22 ILE 82 2HG2 ILE 82 3.968 1.131 2.774 469 HG23 ILE 82 3HG2 ILE 82 4.352 2.854 2.970 470 HD11 ILE 82 3HD1 ILE 82 3.030 4.576 1.479 471 HD12 ILE 82 1HD1 ILE 82 3.708 5.469 0.110 472 HD13 ILE 82 2HD1 ILE 82 2.793 3.970 -0.174 473 H PHE 83 H PHE 83 5.515 -0.311 2.919 474 HA PHE 83 HA PHE 83 5.465 -2.761 1.227 475 HB2 PHE 83 1HB PHE 83 6.928 -2.153 3.822 476 HB3 PHE 83 2HB PHE 83 6.605 -3.776 3.336 477 HD1 PHE 83 2HD PHE 83 8.475 -0.668 2.470 478 HD2 PHE 83 1HD PHE 83 8.036 -4.899 1.719 479 HE1 PHE 83 2HE PHE 83 10.758 -0.747 1.488 480 HE2 PHE 83 1HE PHE 83 10.315 -4.941 0.740 481 HZ PHE 83 HZ PHE 83 11.677 -2.866 0.639 482 H PHE 84 H PHE 84 4.065 -4.490 2.217 483 HA PHE 84 HA PHE 84 2.821 -3.975 4.788 484 HB2 PHE 84 1HB PHE 84 0.509 -3.937 3.951 485 HB3 PHE 84 2HB PHE 84 1.391 -2.538 3.416 486 HD1 PHE 84 1HD PHE 84 2.347 -2.532 0.938 487 HD2 PHE 84 2HD PHE 84 -0.602 -5.349 2.403 488 HE1 PHE 84 1HE PHE 84 1.742 -3.114 -1.374 489 HE2 PHE 84 2HE PHE 84 -1.225 -5.866 0.077 490 HZ PHE 84 HZ PHE 84 -0.071 -4.772 -1.819 491 H LYS 85 H LYS 85 1.548 -5.832 5.533 492 HA LYS 85 HA LYS 85 1.458 -8.250 3.813 493 HB2 LYS 85 1HB LYS 85 3.566 -8.307 5.047 494 HB3 LYS 85 2HB LYS 85 2.722 -8.104 6.575 495 HG2 LYS 85 1HG LYS 85 3.440 -10.360 6.314 496 HG3 LYS 85 2HG LYS 85 1.674 -10.336 6.283 497 HD2 LYS 85 1HD LYS 85 2.830 -10.123 3.589 498 HD3 LYS 85 2HD LYS 85 3.533 -11.500 4.427 499 HE2 LYS 85 1HE LYS 85 0.605 -11.344 4.801 500 HE3 LYS 85 2HE LYS 85 1.071 -11.386 3.082 501 HZ1 LYS 85 3HZ LYS 85 1.965 -13.393 5.072 502 HZ2 LYS 85 1HZ LYS 85 2.257 -13.412 3.469 503 HZ3 LYS 85 2HZ LYS 85 0.726 -13.612 4.044 504 H ALA 86 H ALA 86 -0.719 -8.734 3.846 505 HA ALA 86 HA ALA 86 -2.394 -8.366 6.153 506 HB1 ALA 86 1HB ALA 86 -2.756 -10.130 3.693 507 HB2 ALA 86 2HB ALA 86 -4.002 -9.728 4.896 508 HB3 ALA 86 3HB ALA 86 -3.316 -8.460 3.865 509 H GLU 87 H GLU 87 -1.529 -9.312 7.951 510 HA GLU 87 HA GLU 87 -0.858 -12.136 8.049 511 HB2 GLU 87 1HB GLU 87 -1.272 -9.914 10.030 512 HB3 GLU 87 2HB GLU 87 -1.622 -11.534 10.616 513 HG2 GLU 87 1HG GLU 87 1.006 -10.816 9.256 514 HG3 GLU 87 2HG GLU 87 0.743 -10.765 11.006 515 H GLY 88 H GLY 88 -3.773 -10.327 7.808 516 HA2 GLY 88 1HA GLY 88 -5.761 -11.446 6.973 517 HA3 GLY 88 2HA GLY 88 -5.348 -12.864 7.946 518 H GLN 89 H GLN 89 -7.515 -10.469 7.867 519 HA GLN 89 HA GLN 89 -8.708 -9.129 9.207 520 HB2 GLN 89 1HB GLN 89 -7.771 -10.575 11.662 521 HB3 GLN 89 2HB GLN 89 -9.222 -9.620 11.453 522 HG2 GLN 89 1HG GLN 89 -8.713 -12.324 10.147 523 HG3 GLN 89 2HG GLN 89 -9.725 -12.023 11.551 524 HE21 GLN 89 1HE2 GLN 89 -9.750 -12.209 8.110 525 HE22 GLN 89 2HE2 GLN 89 -11.239 -11.281 7.831 526 H THR 90 H THR 90 -5.351 -9.217 9.413 527 HA THR 90 HA THR 90 -5.198 -6.511 10.476 528 HB THR 90 HB THR 90 -2.884 -8.191 11.179 529 HG1 THR 90 1HG THR 90 -5.251 -8.742 12.637 530 HG21 THR 90 3HG2 THR 90 -3.126 -5.904 11.977 531 HG22 THR 90 1HG2 THR 90 -3.076 -7.034 13.341 532 HG23 THR 90 2HG2 THR 90 -4.623 -6.325 12.836 533 H VAL 91 H VAL 91 -3.612 -5.304 9.407 534 HA VAL 91 HA VAL 91 -1.794 -6.692 7.526 535 HB VAL 91 HB VAL 91 -3.506 -4.288 6.922 536 HG11 VAL 91 1HG1 VAL 91 -1.052 -5.211 5.378 537 HG12 VAL 91 2HG1 VAL 91 -2.243 -4.021 4.801 538 HG13 VAL 91 3HG1 VAL 91 -1.250 -3.653 6.208 539 HG21 VAL 91 3HG2 VAL 91 -4.133 -6.827 6.315 540 HG22 VAL 91 1HG2 VAL 91 -4.438 -5.484 5.192 541 HG23 VAL 91 2HG2 VAL 91 -3.017 -6.513 4.987 542 H ILE 92 H ILE 92 0.178 -6.353 8.312 543 HA ILE 92 HA ILE 92 0.814 -4.026 9.986 544 HB ILE 92 HB ILE 92 2.520 -6.331 8.941 545 HG12 ILE 92 1HG1 ILE 92 2.540 -7.046 11.343 546 HG13 ILE 92 2HG1 ILE 92 1.261 -5.895 11.705 547 HG21 ILE 92 1HG2 ILE 92 3.091 -4.212 11.083 548 HG22 ILE 92 2HG2 ILE 92 4.166 -5.552 10.624 549 HG23 ILE 92 3HG2 ILE 92 3.820 -4.263 9.465 550 HD11 ILE 92 3HD1 ILE 92 0.586 -8.322 11.443 551 HD12 ILE 92 1HD1 ILE 92 -0.335 -7.224 10.445 552 HD13 ILE 92 2HD1 ILE 92 0.972 -8.192 9.718 553 H ILE 93 H ILE 93 0.956 -2.195 8.837 554 HA ILE 93 HA ILE 93 1.947 -2.136 6.056 555 HB ILE 93 HB ILE 93 1.465 0.331 7.739 556 HG12 ILE 93 1HG1 ILE 93 -0.770 -1.225 6.362 557 HG13 ILE 93 2HG1 ILE 93 -0.666 -0.896 8.101 558 HG21 ILE 93 1HG2 ILE 93 2.517 0.405 5.450 559 HG22 ILE 93 2HG2 ILE 93 1.040 -0.327 4.807 560 HG23 ILE 93 3HG2 ILE 93 1.001 1.282 5.515 561 HD11 ILE 93 3HD1 ILE 93 -1.167 1.157 5.916 562 HD12 ILE 93 1HD1 ILE 93 -2.268 0.607 7.169 563 HD13 ILE 93 2HD1 ILE 93 -0.836 1.555 7.623 564 H LYS 94 H LYS 94 4.116 -1.452 5.620 565 HA LYS 94 HA LYS 94 5.773 -0.450 7.883 566 HB2 LYS 94 1HB LYS 94 6.549 -2.622 5.926 567 HB3 LYS 94 2HB LYS 94 7.678 -1.747 6.906 568 HG2 LYS 94 1HG LYS 94 6.363 -2.478 8.965 569 HG3 LYS 94 2HG LYS 94 5.409 -3.512 7.892 570 HD2 LYS 94 1HD LYS 94 7.490 -4.714 7.233 571 HD3 LYS 94 2HD LYS 94 8.418 -3.670 8.334 572 HE2 LYS 94 1HE LYS 94 6.864 -4.466 10.196 573 HE3 LYS 94 2HE LYS 94 6.223 -5.665 9.076 574 HZ1 LYS 94 3HZ LYS 94 9.045 -5.473 9.923 575 HZ2 LYS 94 1HZ LYS 94 8.461 -6.601 8.893 576 HZ3 LYS 94 2HZ LYS 94 7.946 -6.585 10.451 577 H TYR 95 H TYR 95 6.541 1.623 7.315 578 HA TYR 95 HA TYR 95 7.105 2.143 4.439 579 HB2 TYR 95 1HB TYR 95 5.831 4.236 4.612 580 HB3 TYR 95 2HB TYR 95 4.842 2.802 4.918 581 HD1 TYR 95 2HD TYR 95 6.444 5.652 6.708 582 HD2 TYR 95 1HD TYR 95 3.710 2.344 6.842 583 HE1 TYR 95 2HE TYR 95 5.700 6.394 8.951 584 HE2 TYR 95 1HE TYR 95 2.941 3.072 9.071 585 HH TYR 95 HH TYR 95 3.525 6.215 10.348 586 H THR 96 H THR 96 8.275 4.331 4.179 587 HA THR 96 HA THR 96 9.971 5.146 6.431 588 HB THR 96 HB THR 96 10.952 3.035 5.751 589 HG1 THR 96 1HG THR 96 13.017 4.109 4.994 590 HG21 THR 96 3HG2 THR 96 11.307 4.208 2.976 591 HG22 THR 96 1HG2 THR 96 10.185 2.902 3.386 592 HG23 THR 96 2HG2 THR 96 11.922 2.649 3.563 593 H SER 97 H SER 97 11.666 6.693 5.471 594 HA SER 97 HA SER 97 10.632 8.117 3.098 595 HB2 SER 97 1HB SER 97 11.296 10.237 3.980 596 HB3 SER 97 2HB SER 97 10.076 9.497 5.026 597 HG SER 97 HG SER 97 12.821 9.936 5.430 598 H GLN 98 H GLN 98 12.942 6.122 4.158 599 HA GLN 98 HA GLN 98 14.358 6.856 1.727 600 HB2 GLN 98 1HB GLN 98 16.012 6.201 4.191 601 HB3 GLN 98 2HB GLN 98 16.606 6.266 2.552 602 HG2 GLN 98 1HG GLN 98 16.011 8.685 2.447 603 HG3 GLN 98 2HG GLN 98 15.469 8.594 4.134 604 HE21 GLN 98 1HE2 GLN 98 17.030 10.241 4.752 605 HE22 GLN 98 2HE2 GLN 98 18.744 9.902 4.748 606 H ARG 99 H ARG 99 14.879 5.028 0.551 607 HA ARG 99 HA ARG 99 13.629 2.531 1.008 608 HB2 ARG 99 1HB ARG 99 14.607 3.415 -1.160 609 HB3 ARG 99 2HB ARG 99 16.231 3.073 -0.509 610 HG2 ARG 99 1HG ARG 99 15.912 0.723 -0.700 611 HG3 ARG 99 2HG ARG 99 14.172 0.878 -0.514 612 HD2 ARG 99 1HD ARG 99 14.345 0.124 -2.641 613 HD3 ARG 99 2HD ARG 99 14.035 1.844 -2.835 614 HE ARG 99 HE ARG 99 16.667 1.920 -3.072 615 HH11 ARG 99 1HH1 ARG 99 14.351 -0.246 -4.699 616 HH12 ARG 99 2HH1 ARG 99 15.449 -0.702 -5.931 617 HH21 ARG 99 1HH2 ARG 99 18.005 1.492 -4.899 618 HH22 ARG 99 2HH2 ARG 99 17.611 0.255 -6.028 619 H ASN 100 H ASN 100 16.785 3.682 1.741 620 HA ASN 100 HA ASN 100 17.767 1.277 3.047 621 HB2 ASN 100 1HB ASN 100 19.936 2.482 2.850 622 HB3 ASN 100 2HB ASN 100 19.098 2.356 1.313 623 HD21 ASN 100 1HD2 ASN 100 19.157 4.464 4.045 624 HD22 ASN 100 2HD2 ASN 100 19.059 6.032 3.206 625 H THR 101 H THR 101 15.667 3.019 4.557 626 HA THR 101 HA THR 101 17.321 3.021 7.016 627 HB THR 101 HB THR 101 16.049 4.912 7.947 628 HG1 THR 101 1HG THR 101 14.912 6.255 6.529 629 HG21 THR 101 3HG2 THR 101 17.747 5.437 5.481 630 HG22 THR 101 1HG2 THR 101 18.179 5.574 7.195 631 HG23 THR 101 2HG2 THR 101 17.103 6.744 6.452 632 H LYS 102 H LYS 102 16.029 2.585 8.972 633 HA LYS 102 HA LYS 102 14.473 0.282 8.472 634 HB2 LYS 102 1HB LYS 102 15.763 0.426 10.491 635 HB3 LYS 102 2HB LYS 102 14.947 1.915 10.977 636 HG2 LYS 102 1HG LYS 102 14.174 0.098 12.341 637 HG3 LYS 102 2HG LYS 102 12.873 0.715 11.379 638 HD2 LYS 102 1HD LYS 102 13.258 -1.296 9.801 639 HD3 LYS 102 2HD LYS 102 14.361 -1.908 11.042 640 HE2 LYS 102 1HE LYS 102 12.468 -1.665 12.714 641 HE3 LYS 102 2HE LYS 102 11.406 -1.206 11.393 642 HZ1 LYS 102 3HZ LYS 102 11.886 -3.442 10.420 643 HZ2 LYS 102 1HZ LYS 102 11.119 -3.493 11.872 644 HZ3 LYS 102 2HZ LYS 102 12.726 -3.818 11.780 645 H LEU 103 H LEU 103 12.436 -0.028 8.115 646 HA LEU 103 HA LEU 103 10.497 1.971 7.673 647 HB2 LEU 103 1HB LEU 103 10.177 -1.011 8.289 648 HB3 LEU 103 2HB LEU 103 8.922 -0.045 7.540 649 HG LEU 103 HG LEU 103 11.610 -0.168 6.162 650 HD11 LEU 103 1HD1 LEU 103 11.207 -2.518 6.720 651 HD12 LEU 103 2HD1 LEU 103 11.043 -2.213 4.989 652 HD13 LEU 103 3HD1 LEU 103 9.591 -2.434 5.976 653 HD21 LEU 103 3HD2 LEU 103 8.795 -0.243 5.019 654 HD22 LEU 103 1HD2 LEU 103 10.325 0.022 4.156 655 HD23 LEU 103 2HD2 LEU 103 9.737 1.243 5.291 656 H LYS 104 H LYS 104 8.581 2.457 8.749 657 HA LYS 104 HA LYS 104 8.531 2.452 11.687 658 HB2 LYS 104 1HB LYS 104 6.959 3.616 9.398 659 HB3 LYS 104 2HB LYS 104 6.010 3.235 10.805 660 HG2 LYS 104 1HG LYS 104 6.675 5.525 10.923 661 HG3 LYS 104 2HG LYS 104 7.435 4.623 12.234 662 HD2 LYS 104 1HD LYS 104 9.563 4.732 11.276 663 HD3 LYS 104 2HD LYS 104 8.945 5.055 9.669 664 HE2 LYS 104 1HE LYS 104 9.882 7.127 10.534 665 HE3 LYS 104 2HE LYS 104 8.133 7.298 10.475 666 HZ1 LYS 104 3HZ LYS 104 9.802 6.904 12.888 667 HZ2 LYS 104 1HZ LYS 104 8.168 6.757 12.929 668 HZ3 LYS 104 2HZ LYS 104 8.850 8.174 12.485 669 H ALA 105 H ALA 105 6.282 1.822 12.606 670 HA ALA 105 HA ALA 105 5.272 -0.736 11.478 671 HB1 ALA 105 1HB ALA 105 5.666 -0.023 14.415 672 HB2 ALA 105 2HB ALA 105 4.816 -1.450 13.809 673 HB3 ALA 105 3HB ALA 105 6.551 -1.271 13.493 674 H LYS 106 H LYS 106 3.104 -0.524 10.935 675 HA LYS 106 HA LYS 106 1.318 0.883 12.776 676 HB2 LYS 106 1HB LYS 106 2.018 2.322 10.740 677 HB3 LYS 106 2HB LYS 106 1.141 1.153 9.756 678 HG2 LYS 106 1HG LYS 106 -0.593 2.527 10.008 679 HG3 LYS 106 2HG LYS 106 -0.770 1.792 11.594 680 HD2 LYS 106 1HD LYS 106 -0.556 3.825 12.506 681 HD3 LYS 106 2HD LYS 106 1.123 3.878 11.968 682 HE2 LYS 106 1HE LYS 106 0.166 4.700 9.677 683 HE3 LYS 106 2HE LYS 106 -1.359 4.908 10.545 684 HZ1 LYS 106 3HZ LYS 106 -0.300 6.974 10.636 685 HZ2 LYS 106 1HZ LYS 106 1.175 6.376 10.993 686 HZ3 LYS 106 2HZ LYS 106 -0.063 6.357 12.106 687 H ALA 107 H ALA 107 -0.506 -0.510 13.113 688 HA ALA 107 HA ALA 107 -0.687 -2.924 11.353 689 HB1 ALA 107 1HB ALA 107 -0.602 -4.355 13.373 690 HB2 ALA 107 2HB ALA 107 0.925 -3.490 13.088 691 HB3 ALA 107 3HB ALA 107 -0.193 -2.927 14.353 692 H LEU 108 H LEU 108 -2.707 -2.414 10.615 693 HA LEU 108 HA LEU 108 -4.840 -1.834 12.631 694 HB2 LEU 108 1HB LEU 108 -4.638 -1.019 9.701 695 HB3 LEU 108 2HB LEU 108 -5.999 -0.708 10.762 696 HG LEU 108 HG LEU 108 -5.064 1.328 10.828 697 HD11 LEU 108 1HD1 LEU 108 -3.263 0.167 12.967 698 HD12 LEU 108 2HD1 LEU 108 -4.979 0.587 13.187 699 HD13 LEU 108 3HD1 LEU 108 -3.791 1.835 12.782 700 HD21 LEU 108 3HD2 LEU 108 -2.289 0.122 10.558 701 HD22 LEU 108 1HD2 LEU 108 -2.731 1.840 10.500 702 HD23 LEU 108 2HD2 LEU 108 -3.311 0.767 9.240 703 H THR 109 H THR 109 -7.014 -2.577 11.860 704 HA THR 109 HA THR 109 -6.802 -5.333 10.895 705 HB THR 109 HB THR 109 -9.291 -5.385 11.406 706 HG1 THR 109 1HG THR 109 -8.802 -2.821 12.484 707 HG21 THR 109 3HG2 THR 109 -9.037 -5.325 13.833 708 HG22 THR 109 1HG2 THR 109 -7.563 -4.363 13.705 709 HG23 THR 109 2HG2 THR 109 -7.585 -6.024 13.100 710 H LEU 110 H LEU 110 -8.158 -6.250 9.183 711 HA LEU 110 HA LEU 110 -8.261 -4.795 6.797 712 HB2 LEU 110 1HB LEU 110 -9.942 -7.119 7.882 713 HB3 LEU 110 2HB LEU 110 -10.149 -6.503 6.262 714 HG LEU 110 HG LEU 110 -7.535 -7.646 7.301 715 HD11 LEU 110 1HD1 LEU 110 -9.568 -8.952 5.464 716 HD12 LEU 110 2HD1 LEU 110 -9.377 -9.340 7.161 717 HD13 LEU 110 3HD1 LEU 110 -8.040 -9.646 6.033 718 HD21 LEU 110 3HD2 LEU 110 -7.242 -6.070 5.387 719 HD22 LEU 110 1HD2 LEU 110 -8.465 -6.945 4.470 720 HD23 LEU 110 2HD2 LEU 110 -6.919 -7.734 4.888 721 H SER 111 H SER 111 -10.658 -5.112 9.352 722 HA SER 111 HA SER 111 -12.692 -3.714 8.007 723 HB2 SER 111 1HB SER 111 -12.631 -5.332 10.082 724 HB3 SER 111 2HB SER 111 -12.532 -3.839 11.013 725 HG SER 111 HG SER 111 -14.642 -4.715 10.624 726 H GLN 112 H GLN 112 -10.043 -2.410 10.238 727 HA GLN 112 HA GLN 112 -10.863 0.246 10.370 728 HB2 GLN 112 1HB GLN 112 -8.314 -1.272 10.569 729 HB3 GLN 112 2HB GLN 112 -8.098 0.313 9.867 730 HG2 GLN 112 1HG GLN 112 -7.899 1.023 11.954 731 HG3 GLN 112 2HG GLN 112 -9.669 1.005 11.916 732 HE21 GLN 112 1HE2 GLN 112 -10.278 0.351 13.873 733 HE22 GLN 112 2HE2 GLN 112 -9.638 -0.982 14.797 734 H LEU 113 H LEU 113 -8.646 -1.136 7.877 735 HA LEU 113 HA LEU 113 -8.554 1.174 6.294 736 HB2 LEU 113 1HB LEU 113 -8.255 -1.781 5.618 737 HB3 LEU 113 2HB LEU 113 -8.096 -0.558 4.379 738 HG LEU 113 HG LEU 113 -6.353 -0.713 6.851 739 HD11 LEU 113 1HD1 LEU 113 -4.615 -1.550 5.364 740 HD12 LEU 113 2HD1 LEU 113 -5.662 -1.400 3.945 741 HD13 LEU 113 3HD1 LEU 113 -6.029 -2.595 5.200 742 HD21 LEU 113 3HD2 LEU 113 -6.500 1.599 5.969 743 HD22 LEU 113 1HD2 LEU 113 -6.075 1.028 4.358 744 HD23 LEU 113 2HD2 LEU 113 -4.905 0.907 5.685 745 H LYS 114 H LYS 114 -10.999 -1.334 6.369 746 HA LYS 114 HA LYS 114 -12.329 -0.494 3.937 747 HB2 LYS 114 1HB LYS 114 -12.389 -2.801 4.921 748 HB3 LYS 114 2HB LYS 114 -13.355 -2.176 6.268 749 HG2 LYS 114 1HG LYS 114 -15.124 -1.494 4.654 750 HG3 LYS 114 2HG LYS 114 -14.139 -2.150 3.322 751 HD2 LYS 114 1HD LYS 114 -14.181 -4.382 4.386 752 HD3 LYS 114 2HD LYS 114 -15.185 -3.746 5.703 753 HE2 LYS 114 1HE LYS 114 -15.956 -3.694 2.745 754 HE3 LYS 114 2HE LYS 114 -16.415 -4.972 3.864 755 HZ1 LYS 114 3HZ LYS 114 -17.229 -2.126 4.100 756 HZ2 LYS 114 1HZ LYS 114 -17.519 -3.283 5.228 757 HZ3 LYS 114 2HZ LYS 114 -18.176 -3.437 3.736 758 H LYS 115 H LYS 115 -12.706 0.263 7.425 759 HA LYS 115 HA LYS 115 -15.122 1.856 7.065 760 HB2 LYS 115 1HB LYS 115 -13.497 0.774 9.264 761 HB3 LYS 115 2HB LYS 115 -13.635 2.472 9.466 762 HG2 LYS 115 1HG LYS 115 -15.405 1.314 10.646 763 HG3 LYS 115 2HG LYS 115 -16.093 2.347 9.393 764 HD2 LYS 115 1HD LYS 115 -17.216 0.162 9.611 765 HD3 LYS 115 2HD LYS 115 -16.579 0.414 7.982 766 HE2 LYS 115 1HE LYS 115 -14.796 -1.136 8.301 767 HE3 LYS 115 2HE LYS 115 -14.958 -1.063 10.060 768 HZ1 LYS 115 3HZ LYS 115 -16.794 -2.468 8.211 769 HZ2 LYS 115 1HZ LYS 115 -17.140 -2.136 9.782 770 HZ3 LYS 115 2HZ LYS 115 -15.835 -3.068 9.424 771 H GLU 116 H GLU 116 -11.738 2.385 6.631 772 HA GLU 116 HA GLU 116 -11.986 5.294 6.989 773 HB2 GLU 116 1HB GLU 116 -9.716 3.315 6.601 774 HB3 GLU 116 2HB GLU 116 -9.447 5.069 6.570 775 HG2 GLU 116 1HG GLU 116 -10.220 5.370 8.802 776 HG3 GLU 116 2HG GLU 116 -11.100 3.867 8.794 777 H PHE 117 H PHE 117 -11.201 2.988 4.368 778 HA PHE 117 HA PHE 117 -11.415 5.256 2.434 779 HB2 PHE 117 1HB PHE 117 -9.651 2.826 2.308 780 HB3 PHE 117 2HB PHE 117 -9.636 4.245 1.278 781 HD1 PHE 117 2HD PHE 117 -9.467 6.576 2.855 782 HD2 PHE 117 1HD PHE 117 -7.804 2.686 3.756 783 HE1 PHE 117 2HE PHE 117 -7.833 7.628 4.375 784 HE2 PHE 117 1HE PHE 117 -6.170 3.766 5.278 785 HZ PHE 117 HZ PHE 117 -6.192 6.227 5.609 786 H TYR 118 H TYR 118 -13.081 2.490 3.305 787 HA TYR 118 HA TYR 118 -13.983 2.144 0.522 788 HB2 TYR 118 1HB TYR 118 -12.202 0.460 1.283 789 HB3 TYR 118 2HB TYR 118 -13.520 -0.296 2.151 790 HD1 TYR 118 2HD TYR 118 -12.568 0.968 -1.288 791 HD2 TYR 118 1HD TYR 118 -14.874 -1.842 1.022 792 HE1 TYR 118 2HE TYR 118 -12.925 -0.373 -3.359 793 HE2 TYR 118 1HE TYR 118 -15.273 -3.193 -1.002 794 HH TYR 118 HH TYR 118 -13.548 -2.643 -4.012 795 H GLN 119 H GLN 119 -15.345 3.684 1.876 796 HA GLN 119 HA GLN 119 -17.603 2.449 3.336 797 HB2 GLN 119 1HB GLN 119 -18.293 4.867 3.580 798 HB3 GLN 119 2HB GLN 119 -16.858 4.346 4.437 799 HG2 GLN 119 1HG GLN 119 -16.360 5.550 1.727 800 HG3 GLN 119 2HG GLN 119 -17.036 6.630 2.928 801 HE21 GLN 119 1HE2 GLN 119 -14.143 5.982 1.558 802 HE22 GLN 119 2HE2 GLN 119 -13.150 6.213 2.976 803 H THR 120 H THR 120 -17.200 4.589 0.396 804 HA THR 120 HA THR 120 -20.059 4.671 0.066 805 HB THR 120 HB THR 120 -19.691 6.369 -1.481 806 HG1 THR 120 1HG THR 120 -17.136 6.604 -1.939 807 HG21 THR 120 3HG2 THR 120 -18.900 6.944 0.894 808 HG22 THR 120 1HG2 THR 120 -18.402 8.008 -0.434 809 HG23 THR 120 2HG2 THR 120 -17.255 6.848 0.230 810 H ARG 121 H ARG 121 -20.248 4.855 -2.755 811 HA ARG 121 HA ARG 121 -20.052 1.970 -3.518 812 HB2 ARG 121 1HB ARG 121 -22.043 3.971 -4.647 813 HB3 ARG 121 2HB ARG 121 -22.038 2.217 -4.768 814 HG2 ARG 121 1HG ARG 121 -23.701 2.499 -3.220 815 HG3 ARG 121 2HG ARG 121 -22.320 2.297 -2.141 816 HD2 ARG 121 1HD ARG 121 -22.185 4.889 -2.098 817 HD3 ARG 121 2HD ARG 121 -23.715 4.891 -2.964 818 HE ARG 121 HE ARG 121 -23.887 3.214 -0.673 819 HH11 ARG 121 1HH1 ARG 121 -24.018 6.691 -1.546 820 HH12 ARG 121 2HH1 ARG 121 -24.238 7.221 0.088 821 HH21 ARG 121 1HH2 ARG 121 -24.441 3.965 1.447 822 HH22 ARG 121 2HH2 ARG 121 -24.759 5.640 1.745 823 H SER 122 H SER 122 -20.003 5.300 -4.764 824 HA SER 122 HA SER 122 -18.816 4.850 -7.303 825 HB2 SER 122 1HB SER 122 -20.020 6.871 -6.452 826 HB3 SER 122 2HB SER 122 -18.642 7.216 -5.391 827 HG SER 122 HG SER 122 -17.369 7.503 -7.160 828 H GLN 123 H GLN 123 -17.214 5.127 -4.031 829 HA GLN 123 HA GLN 123 -14.643 5.584 -4.869 830 HB2 GLN 123 1HB GLN 123 -13.875 4.570 -2.810 831 HB3 GLN 123 2HB GLN 123 -15.437 5.261 -2.475 832 HG2 GLN 123 1HG GLN 123 -16.364 2.866 -3.084 833 HG3 GLN 123 2HG GLN 123 -14.672 2.353 -2.848 834 HE21 GLN 123 1HE2 GLN 123 -16.409 1.140 -1.424 835 HE22 GLN 123 2HE2 GLN 123 -16.559 1.708 0.204 836 H LYS 124 H LYS 124 -16.448 2.590 -5.255 837 HA LYS 124 HA LYS 124 -14.218 0.807 -5.794 838 HB2 LYS 124 1HB LYS 124 -17.222 0.719 -6.269 839 HB3 LYS 124 2HB LYS 124 -16.159 -0.614 -6.725 840 HG2 LYS 124 1HG LYS 124 -15.964 -1.366 -4.682 841 HG3 LYS 124 2HG LYS 124 -15.532 0.185 -3.986 842 HD2 LYS 124 1HD LYS 124 -17.699 0.729 -3.393 843 HD3 LYS 124 2HD LYS 124 -18.438 -0.298 -4.618 844 HE2 LYS 124 1HE LYS 124 -16.847 -1.432 -2.278 845 HE3 LYS 124 2HE LYS 124 -18.591 -1.128 -2.206 846 HZ1 LYS 124 3HZ LYS 124 -18.153 -3.370 -2.785 847 HZ2 LYS 124 1HZ LYS 124 -17.279 -2.959 -4.133 848 HZ3 LYS 124 2HZ LYS 124 -18.879 -2.612 -4.071 849 H ARG 125 H ARG 125 -15.298 3.406 -7.577 850 HA ARG 125 HA ARG 125 -14.448 2.181 -10.124 851 HB2 ARG 125 1HB ARG 125 -16.751 3.514 -9.578 852 HB3 ARG 125 2HB ARG 125 -15.722 4.930 -9.604 853 HG2 ARG 125 1HG ARG 125 -16.854 4.795 -11.605 854 HG3 ARG 125 2HG ARG 125 -15.182 4.405 -12.015 855 HD2 ARG 125 1HD ARG 125 -15.682 2.204 -12.549 856 HD3 ARG 125 2HD ARG 125 -16.988 2.103 -11.377 857 HE ARG 125 HE ARG 125 -18.447 3.302 -12.790 858 HH11 ARG 125 1HH1 ARG 125 -15.394 2.709 -14.505 859 HH12 ARG 125 2HH1 ARG 125 -16.150 2.541 -16.072 860 HH21 ARG 125 1HH2 ARG 125 -19.433 3.156 -14.867 861 HH22 ARG 125 2HH2 ARG 125 -18.472 2.906 -16.270 862 H GLU 126 H GLU 126 -13.138 3.787 -7.577 863 HA GLU 126 HA GLU 126 -10.995 4.991 -9.247 864 HB2 GLU 126 1HB GLU 126 -12.355 6.002 -6.720 865 HB3 GLU 126 2HB GLU 126 -10.651 6.289 -6.973 866 HG2 GLU 126 1HG GLU 126 -11.271 8.120 -8.048 867 HG3 GLU 126 2HG GLU 126 -11.550 7.071 -9.420 868 H VAL 127 H VAL 127 -11.657 3.856 -5.926 869 HA VAL 127 HA VAL 127 -9.083 3.039 -5.283 870 HB VAL 127 HB VAL 127 -11.683 1.762 -4.342 871 HG11 VAL 127 1HG1 VAL 127 -9.596 0.596 -3.566 872 HG12 VAL 127 2HG1 VAL 127 -9.029 2.110 -2.861 873 HG13 VAL 127 3HG1 VAL 127 -10.508 1.324 -2.258 874 HG21 VAL 127 3HG2 VAL 127 -10.219 4.236 -3.287 875 HG22 VAL 127 1HG2 VAL 127 -11.821 4.226 -4.034 876 HG23 VAL 127 2HG2 VAL 127 -11.582 3.452 -2.472 877 H ASP 128 H ASP 128 -11.721 0.933 -6.686 878 HA ASP 128 HA ASP 128 -10.057 -1.369 -7.044 879 HB2 ASP 128 1HB ASP 128 -12.667 -0.968 -7.201 880 HB3 ASP 128 2HB ASP 128 -12.325 -0.588 -8.880 881 H ASP 129 H ASP 129 -10.427 1.527 -8.928 882 HA ASP 129 HA ASP 129 -9.610 0.453 -11.501 883 HB2 ASP 129 1HB ASP 129 -11.315 2.281 -11.034 884 HB3 ASP 129 2HB ASP 129 -9.977 3.364 -10.638 885 H TYR 130 H TYR 130 -8.199 2.357 -8.884 886 HA TYR 130 HA TYR 130 -5.577 2.938 -9.845 887 HB2 TYR 130 1HB TYR 130 -6.545 2.312 -7.078 888 HB3 TYR 130 2HB TYR 130 -5.068 3.159 -7.510 889 HD1 TYR 130 2HD TYR 130 -6.824 4.805 -9.864 890 HD2 TYR 130 1HD TYR 130 -7.117 4.176 -5.592 891 HE1 TYR 130 2HE TYR 130 -7.802 7.047 -9.586 892 HE2 TYR 130 1HE TYR 130 -8.125 6.363 -5.361 893 HH TYR 130 HH TYR 130 -8.707 8.348 -6.348 894 H VAL 131 H VAL 131 -6.970 -0.087 -8.458 895 HA VAL 131 HA VAL 131 -4.391 -1.349 -8.151 896 HB VAL 131 HB VAL 131 -7.188 -2.563 -8.415 897 HG11 VAL 131 1HG1 VAL 131 -5.425 -4.303 -8.729 898 HG12 VAL 131 2HG1 VAL 131 -4.712 -3.806 -7.174 899 HG13 VAL 131 3HG1 VAL 131 -6.321 -4.529 -7.231 900 HG21 VAL 131 3HG2 VAL 131 -7.249 -2.660 -5.997 901 HG22 VAL 131 1HG2 VAL 131 -5.608 -2.001 -5.873 902 HG23 VAL 131 2HG2 VAL 131 -6.937 -0.991 -6.462 903 H ALA 132 H ALA 132 -6.385 -0.732 -10.966 904 HA ALA 132 HA ALA 132 -4.711 -2.534 -12.628 905 HB1 ALA 132 1HB ALA 132 -7.199 -0.915 -13.323 906 HB2 ALA 132 2HB ALA 132 -6.321 -1.999 -14.415 907 HB3 ALA 132 3HB ALA 132 -7.152 -2.663 -12.999 908 H GLY 133 H GLY 133 -4.836 0.705 -11.524 909 HA2 GLY 133 1HA GLY 133 -3.626 1.955 -13.916 910 HA3 GLY 133 2HA GLY 133 -4.107 2.739 -12.404 911 H LEU 134 H LEU 134 -2.362 -0.146 -11.850 912 HA LEU 134 HA LEU 134 0.227 1.237 -11.671 913 HB2 LEU 134 1HB LEU 134 0.693 0.144 -9.614 914 HB3 LEU 134 2HB LEU 134 -0.842 0.983 -9.486 915 HG LEU 134 HG LEU 134 -1.961 -1.297 -9.905 916 HD11 LEU 134 1HD1 LEU 134 -0.169 -2.745 -10.552 917 HD12 LEU 134 2HD1 LEU 134 -0.462 -3.168 -8.879 918 HD13 LEU 134 3HD1 LEU 134 0.900 -2.122 -9.276 919 HD21 LEU 134 3HD2 LEU 134 -0.414 -0.757 -7.333 920 HD22 LEU 134 1HD2 LEU 134 -1.859 -1.773 -7.495 921 HD23 LEU 134 2HD2 LEU 134 -1.990 -0.045 -7.782 922 H ARG 135 H ARG 135 1.932 -0.629 -11.360 923 HA ARG 135 HA ARG 135 1.648 -2.523 -13.654 924 HB2 ARG 135 1HB ARG 135 3.937 -0.681 -12.833 925 HB3 ARG 135 2HB ARG 135 3.975 -1.788 -14.199 926 HG2 ARG 135 1HG ARG 135 2.204 -0.449 -15.334 927 HG3 ARG 135 2HG ARG 135 2.051 0.583 -13.914 928 HD2 ARG 135 1HD ARG 135 3.366 1.723 -15.528 929 HD3 ARG 135 2HD ARG 135 4.367 1.317 -14.123 930 HE ARG 135 HE ARG 135 4.449 -0.596 -16.345 931 HH11 ARG 135 1HH1 ARG 135 5.820 2.340 -14.987 932 HH12 ARG 135 2HH1 ARG 135 7.120 2.522 -16.110 933 HH21 ARG 135 1HH2 ARG 135 6.048 -0.363 -17.999 934 HH22 ARG 135 2HH2 ARG 135 7.277 0.869 -17.866 935 H THR 136 H THR 136 3.685 -4.128 -13.572 936 HA THR 136 HA THR 136 4.216 -4.745 -10.689 937 HB THR 136 HB THR 136 4.060 -7.207 -11.820 938 HG1 THR 136 1HG THR 136 3.196 -6.616 -13.800 939 HG21 THR 136 3HG2 THR 136 1.897 -7.384 -10.766 940 HG22 THR 136 1HG2 THR 136 1.722 -5.609 -10.760 941 HG23 THR 136 2HG2 THR 136 3.022 -6.384 -9.831 942 H GLU 137 H GLU 137 5.583 -4.036 -13.441 943 HA GLU 137 HA GLU 137 7.583 -4.126 -14.514 944 HB2 GLU 137 1HB GLU 137 8.591 -5.534 -12.043 945 HB3 GLU 137 2HB GLU 137 9.415 -5.781 -13.559 946 HG2 GLU 137 1HG GLU 137 8.875 -2.925 -13.169 947 HG3 GLU 137 2HG GLU 137 9.737 -3.621 -11.798 Start of MODEL 19 1 H1 GLY 19 H GLY 19 -7.205 -17.875 -5.465 2 HA2 GLY 19 1HA GLY 19 -6.984 -15.907 -3.267 3 HA3 GLY 19 2HA GLY 19 -7.152 -15.513 -4.988 4 H HIS 20 H HIS 20 -9.123 -14.655 -5.299 5 HA HIS 20 HA HIS 20 -11.268 -14.158 -5.194 6 HB2 HIS 20 1HB HIS 20 -12.595 -15.661 -6.307 7 HB3 HIS 20 2HB HIS 20 -10.969 -15.996 -6.851 8 HD1 HIS 20 1HD HIS 20 -13.977 -17.654 -5.399 9 HD2 HIS 20 2HD HIS 20 -9.849 -18.377 -5.808 10 HE1 HIS 20 1HE HIS 20 -13.642 -20.154 -5.052 11 H MET 21 H MET 21 -10.353 -14.578 -2.472 12 HA MET 21 HA MET 21 -12.904 -14.276 -1.214 13 HB2 MET 21 1HB MET 21 -12.041 -16.859 -1.122 14 HB3 MET 21 2HB MET 21 -11.110 -16.250 0.229 15 HG2 MET 21 1HG MET 21 -14.119 -15.949 -0.078 16 HG3 MET 21 2HG MET 21 -13.350 -17.309 0.719 17 HE1 MET 21 3HE MET 21 -15.075 -15.754 3.732 18 HE2 MET 21 1HE MET 21 -15.700 -15.864 2.069 19 HE3 MET 21 2HE MET 21 -14.772 -17.213 2.765 20 H LYS 22 H LYS 22 -12.281 -13.575 1.204 21 HA LYS 22 HA LYS 22 -11.233 -12.143 2.559 22 HB2 LYS 22 1HB LYS 22 -9.071 -12.934 3.371 23 HB3 LYS 22 2HB LYS 22 -10.291 -14.184 3.244 24 HG2 LYS 22 1HG LYS 22 -9.240 -15.250 1.432 25 HG3 LYS 22 2HG LYS 22 -8.255 -13.841 1.023 26 HD2 LYS 22 1HD LYS 22 -7.762 -14.860 3.766 27 HD3 LYS 22 2HD LYS 22 -7.405 -16.042 2.497 28 HE2 LYS 22 1HE LYS 22 -5.757 -14.744 1.500 29 HE3 LYS 22 2HE LYS 22 -6.461 -13.222 2.060 30 HZ1 LYS 22 3HZ LYS 22 -4.418 -13.714 3.164 31 HZ2 LYS 22 1HZ LYS 22 -4.987 -15.091 3.830 32 HZ3 LYS 22 2HZ LYS 22 -5.656 -13.593 4.196 33 H PHE 23 H PHE 23 -11.175 -11.097 -0.134 34 HA PHE 23 HA PHE 23 -10.523 -9.348 -1.330 35 HB2 PHE 23 1HB PHE 23 -8.954 -8.629 1.124 36 HB3 PHE 23 2HB PHE 23 -8.793 -7.725 -0.363 37 HD1 PHE 23 2HD PHE 23 -12.229 -8.894 0.211 38 HD2 PHE 23 1HD PHE 23 -9.346 -5.768 1.042 39 HE1 PHE 23 2HE PHE 23 -14.023 -7.399 0.783 40 HE2 PHE 23 1HE PHE 23 -11.198 -4.242 1.617 41 HZ PHE 23 HZ PHE 23 -13.550 -5.028 1.499 42 H THR 24 H THR 24 -8.366 -8.410 -2.446 43 HA THR 24 HA THR 24 -6.425 -10.644 -2.739 44 HB THR 24 HB THR 24 -6.088 -9.479 -5.018 45 HG1 THR 24 1HG THR 24 -7.691 -8.359 -5.819 46 HG21 THR 24 3HG2 THR 24 -7.183 -11.700 -4.738 47 HG22 THR 24 1HG2 THR 24 -7.954 -10.742 -6.025 48 HG23 THR 24 2HG2 THR 24 -8.738 -10.896 -4.439 49 H ASP 25 H ASP 25 -4.266 -10.162 -2.693 50 HA ASP 25 HA ASP 25 -3.270 -8.320 -1.023 51 HB2 ASP 25 1HB ASP 25 -1.933 -9.498 -3.487 52 HB3 ASP 25 2HB ASP 25 -1.053 -8.668 -2.193 53 H GLN 26 H GLN 26 -3.929 -7.891 -4.373 54 HA GLN 26 HA GLN 26 -2.741 -5.433 -5.109 55 HB2 GLN 26 1HB GLN 26 -5.411 -6.647 -5.971 56 HB3 GLN 26 2HB GLN 26 -4.425 -5.519 -6.894 57 HG2 GLN 26 1HG GLN 26 -2.988 -7.157 -7.636 58 HG3 GLN 26 2HG GLN 26 -3.249 -8.203 -6.232 59 HE21 GLN 26 1HE2 GLN 26 -5.175 -6.773 -8.974 60 HE22 GLN 26 2HE2 GLN 26 -5.988 -8.278 -9.317 61 H GLN 27 H GLN 27 -6.081 -6.175 -4.045 62 HA GLN 27 HA GLN 27 -6.990 -3.444 -4.117 63 HB2 GLN 27 1HB GLN 27 -8.191 -5.966 -2.914 64 HB3 GLN 27 2HB GLN 27 -9.077 -4.476 -3.160 65 HG2 GLN 27 1HG GLN 27 -7.784 -5.898 -5.534 66 HG3 GLN 27 2HG GLN 27 -9.257 -6.516 -4.828 67 HE21 GLN 27 1HE2 GLN 27 -8.790 -5.398 -7.628 68 HE22 GLN 27 2HE2 GLN 27 -9.915 -4.094 -7.757 69 H ILE 28 H ILE 28 -5.874 -5.685 -1.596 70 HA ILE 28 HA ILE 28 -6.314 -3.949 0.655 71 HB ILE 28 HB ILE 28 -4.264 -6.160 0.197 72 HG12 ILE 28 1HG1 ILE 28 -6.877 -6.298 1.774 73 HG13 ILE 28 2HG1 ILE 28 -6.749 -6.807 0.100 74 HG21 ILE 28 1HG2 ILE 28 -4.112 -6.209 2.706 75 HG22 ILE 28 2HG2 ILE 28 -3.531 -4.699 2.033 76 HG23 ILE 28 3HG2 ILE 28 -5.148 -4.765 2.755 77 HD11 ILE 28 3HD1 ILE 28 -4.958 -8.440 0.746 78 HD12 ILE 28 1HD1 ILE 28 -5.299 -8.071 2.445 79 HD13 ILE 28 2HD1 ILE 28 -6.558 -8.773 1.431 80 H GLY 29 H GLY 29 -3.676 -4.306 -1.751 81 HA2 GLY 29 1HA GLY 29 -1.723 -2.702 -0.623 82 HA3 GLY 29 2HA GLY 29 -1.990 -2.933 -2.370 83 H VAL 30 H VAL 30 -4.263 -1.621 -2.964 84 HA VAL 30 HA VAL 30 -3.540 1.125 -2.767 85 HB VAL 30 HB VAL 30 -6.083 -0.279 -3.617 86 HG11 VAL 30 1HG1 VAL 30 -6.875 1.775 -4.639 87 HG12 VAL 30 2HG1 VAL 30 -6.728 2.016 -2.902 88 HG13 VAL 30 3HG1 VAL 30 -5.484 2.682 -3.993 89 HG21 VAL 30 3HG2 VAL 30 -3.813 1.110 -5.118 90 HG22 VAL 30 1HG2 VAL 30 -4.098 -0.639 -5.047 91 HG23 VAL 30 2HG2 VAL 30 -5.248 0.419 -5.883 92 H LEU 31 H LEU 31 -5.851 -0.773 -0.802 93 HA LEU 31 HA LEU 31 -6.926 1.507 0.584 94 HB2 LEU 31 1HB LEU 31 -6.664 -1.468 1.311 95 HB3 LEU 31 2HB LEU 31 -7.435 -0.310 2.386 96 HG LEU 31 HG LEU 31 -8.366 -0.657 -0.469 97 HD11 LEU 31 1HD1 LEU 31 -9.403 -2.105 2.005 98 HD12 LEU 31 2HD1 LEU 31 -8.651 -2.853 0.575 99 HD13 LEU 31 3HD1 LEU 31 -10.226 -2.046 0.432 100 HD21 LEU 31 3HD2 LEU 31 -8.990 1.367 0.776 101 HD22 LEU 31 1HD2 LEU 31 -9.764 0.378 2.021 102 HD23 LEU 31 2HD2 LEU 31 -10.390 0.383 0.339 103 H ALA 32 H ALA 32 -4.281 -0.706 1.486 104 HA ALA 32 HA ALA 32 -3.549 0.723 3.888 105 HB1 ALA 32 1HB ALA 32 -2.721 -1.531 3.558 106 HB2 ALA 32 2HB ALA 32 -1.909 -1.069 2.041 107 HB3 ALA 32 3HB ALA 32 -1.336 -0.414 3.584 108 H GLY 33 H GLY 33 -2.587 1.093 0.452 109 HA2 GLY 33 1HA GLY 33 -0.507 2.984 0.919 110 HA3 GLY 33 2HA GLY 33 -1.359 2.733 -0.610 111 H LEU 34 H LEU 34 -4.091 3.439 0.531 112 HA LEU 34 HA LEU 34 -3.778 6.250 0.306 113 HB2 LEU 34 1HB LEU 34 -6.081 4.495 1.134 114 HB3 LEU 34 2HB LEU 34 -6.056 6.234 1.543 115 HG LEU 34 HG LEU 34 -5.879 6.977 -0.606 116 HD11 LEU 34 1HD1 LEU 34 -6.033 4.138 -1.648 117 HD12 LEU 34 2HD1 LEU 34 -4.614 5.167 -1.666 118 HD13 LEU 34 3HD1 LEU 34 -6.005 5.632 -2.619 119 HD21 LEU 34 3HD2 LEU 34 -8.124 6.325 -1.347 120 HD22 LEU 34 1HD2 LEU 34 -8.106 6.393 0.418 121 HD23 LEU 34 2HD2 LEU 34 -7.997 4.811 -0.417 122 H ALA 35 H ALA 35 -3.725 4.199 3.104 123 HA ALA 35 HA ALA 35 -3.957 6.293 5.086 124 HB1 ALA 35 1HB ALA 35 -3.022 4.725 6.686 125 HB2 ALA 35 2HB ALA 35 -4.145 3.838 5.640 126 HB3 ALA 35 3HB ALA 35 -2.394 3.686 5.398 127 H ILE 36 H ILE 36 -1.327 5.466 2.893 128 HA ILE 36 HA ILE 36 0.660 6.960 4.491 129 HB ILE 36 HB ILE 36 1.091 4.301 3.081 130 HG12 ILE 36 1HG1 ILE 36 -0.033 3.735 5.096 131 HG13 ILE 36 2HG1 ILE 36 1.686 3.370 5.201 132 HG21 ILE 36 1HG2 ILE 36 3.370 4.504 3.755 133 HG22 ILE 36 2HG2 ILE 36 2.990 6.078 3.086 134 HG23 ILE 36 3HG2 ILE 36 3.048 5.902 4.822 135 HD11 ILE 36 3HD1 ILE 36 0.809 4.173 7.331 136 HD12 ILE 36 1HD1 ILE 36 2.018 5.300 6.703 137 HD13 ILE 36 2HD1 ILE 36 0.301 5.695 6.578 138 H SER 37 H SER 37 0.577 8.679 3.206 139 HA SER 37 HA SER 37 1.007 10.035 1.433 140 HB2 SER 37 1HB SER 37 3.001 9.141 -0.028 141 HB3 SER 37 2HB SER 37 3.145 9.617 1.675 142 HG SER 37 HG SER 37 4.020 7.488 0.664 143 HA PRO 38 HA PRO 38 -2.089 7.630 -1.246 144 HB2 PRO 38 1HB PRO 38 -4.052 9.591 -1.110 145 HB3 PRO 38 2HB PRO 38 -3.941 8.226 0.014 146 HG2 PRO 38 1HG PRO 38 -2.975 11.034 0.416 147 HG3 PRO 38 2HG PRO 38 -3.845 9.980 1.569 148 HD2 PRO 38 1HD PRO 38 -1.167 10.317 1.700 149 HD3 PRO 38 2HD PRO 38 -1.891 8.719 2.030 150 H GLU 39 H GLU 39 -1.182 11.131 -0.939 151 HA GLU 39 HA GLU 39 -1.907 11.920 -3.568 152 HB2 GLU 39 1HB GLU 39 -0.151 13.061 -1.378 153 HB3 GLU 39 2HB GLU 39 -0.218 13.854 -2.969 154 HG2 GLU 39 1HG GLU 39 -2.540 14.242 -2.847 155 HG3 GLU 39 2HG GLU 39 -2.784 13.073 -1.547 156 H TRP 40 H TRP 40 1.273 10.845 -2.277 157 HA TRP 40 HA TRP 40 2.702 10.987 -4.733 158 HB2 TRP 40 1HB TRP 40 3.990 10.612 -2.786 159 HB3 TRP 40 2HB TRP 40 2.929 9.334 -2.216 160 HD1 TRP 40 HD TRP 40 5.702 9.891 -4.785 161 HE1 TRP 40 1HE TRP 40 6.857 7.716 -5.303 162 HE3 TRP 40 3HE TRP 40 2.493 6.803 -2.276 163 HZ2 TRP 40 2HZ TRP 40 6.076 4.770 -5.045 164 HZ3 TRP 40 3HZ TRP 40 2.721 4.350 -2.437 165 HH2 TRP 40 HH TRP 40 4.651 3.345 -3.696 166 H LEU 41 H LEU 41 0.663 8.405 -3.277 167 HA LEU 41 HA LEU 41 1.321 6.486 -5.247 168 HB2 LEU 41 1HB LEU 41 0.168 5.134 -3.883 169 HB3 LEU 41 2HB LEU 41 -0.089 6.483 -2.898 170 HG LEU 41 HG LEU 41 -2.376 6.788 -3.762 171 HD11 LEU 41 1HD1 LEU 41 -2.321 5.823 -6.048 172 HD12 LEU 41 2HD1 LEU 41 -3.417 4.907 -5.056 173 HD13 LEU 41 3HD1 LEU 41 -1.797 4.261 -5.382 174 HD21 LEU 41 3HD2 LEU 41 -2.148 5.491 -1.806 175 HD22 LEU 41 1HD2 LEU 41 -1.387 4.137 -2.660 176 HD23 LEU 41 2HD2 LEU 41 -3.092 4.419 -2.881 177 H LYS 42 H LYS 42 -1.453 8.716 -4.983 178 HA LYS 42 HA LYS 42 -2.713 8.014 -7.433 179 HB2 LYS 42 1HB LYS 42 -2.860 10.483 -5.648 180 HB3 LYS 42 2HB LYS 42 -3.902 10.229 -7.058 181 HG2 LYS 42 1HG LYS 42 -4.825 8.199 -6.135 182 HG3 LYS 42 2HG LYS 42 -3.713 8.207 -4.779 183 HD2 LYS 42 1HD LYS 42 -4.748 10.226 -3.861 184 HD3 LYS 42 2HD LYS 42 -5.858 10.298 -5.256 185 HE2 LYS 42 1HE LYS 42 -6.696 8.034 -4.661 186 HE3 LYS 42 2HE LYS 42 -5.680 8.024 -3.213 187 HZ1 LYS 42 3HZ LYS 42 -8.132 8.722 -3.092 188 HZ2 LYS 42 1HZ LYS 42 -7.641 10.183 -3.661 189 HZ3 LYS 42 2HZ LYS 42 -7.061 9.590 -2.218 190 H GLN 43 H GLN 43 -0.147 10.511 -6.760 191 HA GLN 43 HA GLN 43 -0.254 11.743 -9.338 192 HB2 GLN 43 1HB GLN 43 1.917 11.355 -7.226 193 HB3 GLN 43 2HB GLN 43 2.290 12.086 -8.792 194 HG2 GLN 43 1HG GLN 43 0.750 13.896 -8.421 195 HG3 GLN 43 2HG GLN 43 0.134 13.168 -6.949 196 HE21 GLN 43 1HE2 GLN 43 3.731 13.199 -7.638 197 HE22 GLN 43 2HE2 GLN 43 4.056 14.433 -6.482 198 H ASN 44 H ASN 44 1.367 8.816 -8.128 199 HA ASN 44 HA ASN 44 2.752 8.483 -10.664 200 HB2 ASN 44 1HB ASN 44 2.611 6.838 -8.149 201 HB3 ASN 44 2HB ASN 44 3.445 6.289 -9.617 202 HD21 ASN 44 1HD2 ASN 44 3.596 8.616 -6.948 203 HD22 ASN 44 2HD2 ASN 44 5.225 9.121 -7.329 204 H ILE 45 H ILE 45 -0.180 6.878 -9.134 205 HA ILE 45 HA ILE 45 -0.557 5.030 -11.266 206 HB ILE 45 HB ILE 45 -2.679 6.512 -9.637 207 HG12 ILE 45 1HG1 ILE 45 -1.221 5.036 -8.259 208 HG13 ILE 45 2HG1 ILE 45 -2.895 4.618 -8.247 209 HG21 ILE 45 1HG2 ILE 45 -3.784 5.755 -11.591 210 HG22 ILE 45 2HG2 ILE 45 -2.897 4.221 -11.629 211 HG23 ILE 45 3HG2 ILE 45 -4.131 4.502 -10.414 212 HD11 ILE 45 3HD1 ILE 45 -1.422 2.652 -8.318 213 HD12 ILE 45 1HD1 ILE 45 -2.491 2.703 -9.726 214 HD13 ILE 45 2HD1 ILE 45 -0.777 3.171 -9.886 215 H ALA 46 H ALA 46 -1.646 8.477 -10.930 216 HA ALA 46 HA ALA 46 -3.057 8.561 -13.372 217 HB1 ALA 46 1HB ALA 46 -3.295 10.118 -11.449 218 HB2 ALA 46 2HB ALA 46 -1.681 10.780 -11.825 219 HB3 ALA 46 3HB ALA 46 -3.020 10.955 -12.989 220 H ALA 47 H ALA 47 0.291 8.232 -12.996 221 HA ALA 47 HA ALA 47 0.744 9.116 -15.788 222 HB1 ALA 47 1HB ALA 47 2.662 9.394 -13.435 223 HB2 ALA 47 2HB ALA 47 3.043 9.757 -15.138 224 HB3 ALA 47 3HB ALA 47 1.825 10.721 -14.273 225 H ASN 48 H ASN 48 0.103 6.486 -14.306 226 HA ASN 48 HA ASN 48 0.509 4.305 -14.632 227 HB2 ASN 48 1HB ASN 48 0.671 3.761 -16.727 228 HB3 ASN 48 2HB ASN 48 0.958 5.433 -17.099 229 HD21 ASN 48 1HD2 ASN 48 2.319 2.221 -17.337 230 HD22 ASN 48 2HD2 ASN 48 3.882 2.768 -17.883 231 H GLN 49 H GLN 49 2.556 5.990 -13.046 232 HA GLN 49 HA GLN 49 5.155 4.841 -13.790 233 HB2 GLN 49 1HB GLN 49 4.110 7.002 -11.917 234 HB3 GLN 49 2HB GLN 49 5.760 6.473 -11.770 235 HG2 GLN 49 1HG GLN 49 5.005 7.037 -14.596 236 HG3 GLN 49 2HG GLN 49 4.766 8.419 -13.525 237 HE21 GLN 49 1HE2 GLN 49 7.219 5.967 -13.063 238 HE22 GLN 49 2HE2 GLN 49 8.572 7.085 -13.177 239 H LEU 50 H LEU 50 2.723 3.924 -11.661 240 HA LEU 50 HA LEU 50 4.533 3.424 -9.417 241 HB2 LEU 50 1HB LEU 50 2.112 4.591 -9.505 242 HB3 LEU 50 2HB LEU 50 1.574 2.991 -9.261 243 HG LEU 50 HG LEU 50 3.174 4.855 -7.488 244 HD11 LEU 50 1HD1 LEU 50 0.960 2.883 -6.869 245 HD12 LEU 50 2HD1 LEU 50 0.741 4.610 -7.221 246 HD13 LEU 50 3HD1 LEU 50 1.609 4.112 -5.757 247 HD21 LEU 50 3HD2 LEU 50 3.452 1.903 -7.068 248 HD22 LEU 50 1HD2 LEU 50 3.723 3.130 -5.840 249 HD23 LEU 50 2HD2 LEU 50 4.714 3.140 -7.274 250 H VAL 51 H VAL 51 5.380 1.429 -8.976 251 HA VAL 51 HA VAL 51 4.226 -0.950 -10.316 252 HB VAL 51 HB VAL 51 7.049 -0.462 -9.267 253 HG11 VAL 51 1HG1 VAL 51 5.972 -2.781 -10.959 254 HG12 VAL 51 2HG1 VAL 51 7.677 -2.483 -10.547 255 HG13 VAL 51 3HG1 VAL 51 6.561 -2.897 -9.287 256 HG21 VAL 51 3HG2 VAL 51 7.713 -0.395 -11.641 257 HG22 VAL 51 1HG2 VAL 51 6.027 -0.565 -12.143 258 HG23 VAL 51 2HG2 VAL 51 6.577 0.903 -11.297 259 H TYR 52 H TYR 52 4.443 -2.983 -8.985 260 HA TYR 52 HA TYR 52 4.051 -2.742 -6.090 261 HB2 TYR 52 1HB TYR 52 1.784 -2.557 -6.939 262 HB3 TYR 52 2HB TYR 52 2.157 -3.602 -8.273 263 HD1 TYR 52 2HD TYR 52 2.669 -4.529 -4.646 264 HD2 TYR 52 1HD TYR 52 0.495 -5.077 -8.329 265 HE1 TYR 52 2HE TYR 52 1.601 -6.577 -3.727 266 HE2 TYR 52 1HE TYR 52 -0.688 -6.991 -7.392 267 HH TYR 52 HH TYR 52 -0.791 -8.453 -5.682 268 H GLY 53 H GLY 53 4.963 -4.636 -5.106 269 HA2 GLY 53 1HA GLY 53 5.174 -7.049 -6.663 270 HA3 GLY 53 2HA GLY 53 6.751 -6.314 -6.325 271 H ILE 54 H ILE 54 6.579 -8.699 -5.344 272 HA ILE 54 HA ILE 54 6.110 -8.414 -2.427 273 HB ILE 54 HB ILE 54 6.396 -10.831 -4.239 274 HG12 ILE 54 1HG1 ILE 54 4.130 -9.801 -3.947 275 HG13 ILE 54 2HG1 ILE 54 4.233 -11.472 -3.527 276 HG21 ILE 54 1HG2 ILE 54 7.795 -11.391 -2.386 277 HG22 ILE 54 2HG2 ILE 54 6.620 -10.804 -1.207 278 HG23 ILE 54 3HG2 ILE 54 6.277 -12.260 -2.171 279 HD11 ILE 54 3HD1 ILE 54 2.872 -10.429 -1.861 280 HD12 ILE 54 1HD1 ILE 54 4.388 -10.764 -1.052 281 HD13 ILE 54 2HD1 ILE 54 4.033 -9.119 -1.652 282 H VAL 55 H VAL 55 7.895 -8.405 -1.177 283 HA VAL 55 HA VAL 55 10.343 -7.550 -1.934 284 HB VAL 55 HB VAL 55 9.253 -9.108 0.429 285 HG11 VAL 55 1HG1 VAL 55 11.546 -9.723 0.591 286 HG12 VAL 55 2HG1 VAL 55 12.074 -8.116 0.073 287 HG13 VAL 55 3HG1 VAL 55 11.350 -8.349 1.674 288 HG21 VAL 55 3HG2 VAL 55 10.194 -6.237 -0.012 289 HG22 VAL 55 1HG2 VAL 55 8.508 -6.758 0.077 290 HG23 VAL 55 2HG2 VAL 55 9.535 -6.873 1.514 291 H LYS 56 H LYS 56 9.727 -11.028 -1.158 292 HA LYS 56 HA LYS 56 10.861 -12.888 -1.546 293 HB2 LYS 56 1HB LYS 56 11.542 -11.473 -4.151 294 HB3 LYS 56 2HB LYS 56 11.895 -13.158 -3.860 295 HG2 LYS 56 1HG LYS 56 9.191 -13.012 -3.174 296 HG3 LYS 56 2HG LYS 56 9.333 -11.822 -4.479 297 HD2 LYS 56 1HD LYS 56 10.512 -13.700 -5.809 298 HD3 LYS 56 2HD LYS 56 9.995 -14.787 -4.518 299 HE2 LYS 56 1HE LYS 56 7.615 -14.074 -4.899 300 HE3 LYS 56 2HE LYS 56 8.176 -13.026 -6.224 301 HZ1 LYS 56 3HZ LYS 56 8.411 -15.976 -6.144 302 HZ2 LYS 56 1HZ LYS 56 8.977 -14.996 -7.356 303 HZ3 LYS 56 2HZ LYS 56 7.367 -15.109 -7.058 304 HA PRO 57 HA PRO 57 15.051 -12.286 -0.204 305 HB2 PRO 57 1HB PRO 57 16.375 -14.567 -0.915 306 HB3 PRO 57 2HB PRO 57 15.094 -14.499 0.330 307 HG2 PRO 57 1HG PRO 57 14.853 -15.328 -2.567 308 HG3 PRO 57 2HG PRO 57 14.247 -16.189 -1.114 309 HD2 PRO 57 1HD PRO 57 12.649 -14.583 -2.602 310 HD3 PRO 57 2HD PRO 57 12.462 -14.664 -0.844 311 H SER 58 H SER 58 14.391 -12.578 -3.495 312 HA SER 58 HA SER 58 17.126 -12.448 -4.479 313 HB2 SER 58 1HB SER 58 14.514 -12.622 -6.014 314 HB3 SER 58 2HB SER 58 16.139 -13.105 -6.561 315 HG SER 58 HG SER 58 16.144 -14.595 -4.741 316 H ASP 59 H ASP 59 15.986 -10.006 -3.202 317 HA ASP 59 HA ASP 59 16.805 -8.051 -5.204 318 HB2 ASP 59 1HB ASP 59 14.021 -8.302 -4.179 319 HB3 ASP 59 2HB ASP 59 14.709 -6.667 -4.064 320 H THR 60 H THR 60 16.356 -5.805 -3.408 321 HA THR 60 HA THR 60 18.378 -6.521 -1.330 322 HB THR 60 HB THR 60 18.301 -4.071 -3.124 323 HG1 THR 60 1HG THR 60 19.849 -6.462 -3.272 324 HG21 THR 60 3HG2 THR 60 19.470 -3.706 -1.011 325 HG22 THR 60 1HG2 THR 60 20.661 -3.854 -2.322 326 HG23 THR 60 2HG2 THR 60 20.390 -5.210 -1.215 327 H VAL 61 H VAL 61 17.122 -6.480 0.532 328 HA VAL 61 HA VAL 61 15.505 -4.053 1.038 329 HB VAL 61 HB VAL 61 13.844 -5.686 2.068 330 HG11 VAL 61 1HG1 VAL 61 14.125 -5.701 -0.956 331 HG12 VAL 61 2HG1 VAL 61 12.643 -6.032 -0.036 332 HG13 VAL 61 3HG1 VAL 61 13.380 -4.431 0.025 333 HG21 VAL 61 3HG2 VAL 61 15.219 -7.705 0.239 334 HG22 VAL 61 1HG2 VAL 61 15.429 -7.663 1.990 335 HG23 VAL 61 2HG2 VAL 61 13.839 -7.991 1.322 336 HA PRO 62 HA PRO 62 16.915 -4.240 5.252 337 HB2 PRO 62 1HB PRO 62 14.687 -3.308 6.599 338 HB3 PRO 62 2HB PRO 62 15.764 -2.252 5.632 339 HG2 PRO 62 1HG PRO 62 13.152 -3.522 4.827 340 HG3 PRO 62 2HG PRO 62 13.685 -1.827 4.581 341 HD2 PRO 62 1HD PRO 62 13.828 -3.685 2.633 342 HD3 PRO 62 2HD PRO 62 15.099 -2.465 2.797 343 H ALA 63 H ALA 63 16.194 -5.207 7.425 344 HA ALA 63 HA ALA 63 15.391 -7.942 6.922 345 HB1 ALA 63 1HB ALA 63 17.099 -7.388 8.565 346 HB2 ALA 63 2HB ALA 63 15.944 -6.422 9.511 347 HB3 ALA 63 3HB ALA 63 15.730 -8.185 9.350 348 H GLY 64 H GLY 64 13.693 -9.061 8.010 349 HA2 GLY 64 1HA GLY 64 11.652 -9.429 8.956 350 HA3 GLY 64 2HA GLY 64 11.746 -7.795 9.615 351 H VAL 65 H VAL 65 11.759 -8.464 6.125 352 HA VAL 65 HA VAL 65 8.879 -7.835 5.918 353 HB VAL 65 HB VAL 65 9.349 -6.401 3.913 354 HG11 VAL 65 1HG1 VAL 65 8.628 -5.484 6.056 355 HG12 VAL 65 2HG1 VAL 65 10.323 -5.291 6.567 356 HG13 VAL 65 3HG1 VAL 65 9.694 -4.372 5.182 357 HG21 VAL 65 3HG2 VAL 65 12.150 -6.075 5.101 358 HG22 VAL 65 1HG2 VAL 65 11.809 -7.021 3.628 359 HG23 VAL 65 2HG2 VAL 65 11.486 -5.281 3.663 360 H ASP 66 H ASP 66 10.402 -10.330 5.809 361 HA ASP 66 HA ASP 66 11.541 -10.879 3.402 362 HB2 ASP 66 1HB ASP 66 10.464 -12.724 5.556 363 HB3 ASP 66 2HB ASP 66 11.332 -13.356 4.188 364 H ASP 67 H ASP 67 8.317 -10.748 3.622 365 HA ASP 67 HA ASP 67 7.794 -11.882 1.038 366 HB2 ASP 67 1HB ASP 67 7.635 -13.975 2.378 367 HB3 ASP 67 2HB ASP 67 6.373 -13.235 3.361 368 H TYR 68 H TYR 68 7.741 -9.332 2.426 369 HA TYR 68 HA TYR 68 4.898 -8.614 2.796 370 HB2 TYR 68 1HB TYR 68 7.518 -7.129 2.905 371 HB3 TYR 68 2HB TYR 68 6.026 -6.266 2.663 372 HD1 TYR 68 2HD TYR 68 6.870 -9.167 4.981 373 HD2 TYR 68 1HD TYR 68 5.331 -5.168 4.531 374 HE1 TYR 68 2HE TYR 68 6.373 -9.090 7.404 375 HE2 TYR 68 1HE TYR 68 4.738 -5.125 6.922 376 HH TYR 68 HH TYR 68 5.755 -7.686 9.180 377 H SER 69 H SER 69 3.823 -7.097 1.294 378 HA SER 69 HA SER 69 4.627 -7.114 -1.479 379 HB2 SER 69 1HB SER 69 2.422 -5.819 0.179 380 HB3 SER 69 2HB SER 69 2.596 -5.739 -1.563 381 HG SER 69 HG SER 69 2.449 -8.206 -0.238 382 H TYR 70 H TYR 70 5.224 -5.060 -2.430 383 HA TYR 70 HA TYR 70 5.497 -2.772 -0.664 384 HB2 TYR 70 1HB TYR 70 7.688 -2.159 -1.390 385 HB3 TYR 70 2HB TYR 70 7.786 -3.745 -0.684 386 HD1 TYR 70 1HD TYR 70 7.997 -5.790 -2.222 387 HD2 TYR 70 2HD TYR 70 8.275 -1.749 -3.744 388 HE1 TYR 70 1HE TYR 70 9.209 -6.595 -4.238 389 HE2 TYR 70 2HE TYR 70 9.515 -2.562 -5.690 390 HH TYR 70 HH TYR 70 10.623 -5.926 -5.993 391 H LEU 71 H LEU 71 5.880 -0.795 -1.946 392 HA LEU 71 HA LEU 71 4.888 -0.778 -4.728 393 HB2 LEU 71 1HB LEU 71 3.745 0.726 -2.335 394 HB3 LEU 71 2HB LEU 71 3.513 1.276 -3.980 395 HG LEU 71 HG LEU 71 2.670 -1.536 -3.216 396 HD11 LEU 71 1HD1 LEU 71 0.390 -0.595 -2.771 397 HD12 LEU 71 2HD1 LEU 71 1.109 1.044 -2.825 398 HD13 LEU 71 3HD1 LEU 71 1.621 -0.111 -1.593 399 HD21 LEU 71 3HD2 LEU 71 2.675 -1.047 -5.543 400 HD22 LEU 71 1HD2 LEU 71 1.710 0.428 -5.295 401 HD23 LEU 71 2HD2 LEU 71 1.012 -1.191 -4.994 402 H VAL 72 H VAL 72 6.263 0.532 -5.833 403 HA VAL 72 HA VAL 72 7.456 2.881 -4.675 404 HB VAL 72 HB VAL 72 9.113 1.182 -4.050 405 HG11 VAL 72 1HG1 VAL 72 10.399 -0.104 -5.683 406 HG12 VAL 72 2HG1 VAL 72 8.668 -0.518 -5.759 407 HG13 VAL 72 3HG1 VAL 72 9.376 0.521 -7.000 408 HG21 VAL 72 3HG2 VAL 72 11.101 2.186 -4.966 409 HG22 VAL 72 1HG2 VAL 72 10.220 2.801 -6.376 410 HG23 VAL 72 2HG2 VAL 72 9.895 3.456 -4.765 411 H ALA 73 H ALA 73 8.121 4.260 -6.518 412 HA ALA 73 HA ALA 73 6.581 3.463 -8.944 413 HB1 ALA 73 1HB ALA 73 7.751 6.149 -8.256 414 HB2 ALA 73 2HB ALA 73 6.626 5.747 -9.564 415 HB3 ALA 73 3HB ALA 73 6.096 5.649 -7.878 416 H ALA 74 H ALA 74 7.501 3.826 -11.011 417 HA ALA 74 HA ALA 74 9.814 2.256 -11.227 418 HB1 ALA 74 1HB ALA 74 9.507 2.602 -13.687 419 HB2 ALA 74 2HB ALA 74 7.969 2.220 -12.881 420 HB3 ALA 74 3HB ALA 74 8.341 3.895 -13.351 421 H ASP 75 H ASP 75 9.605 5.637 -10.947 422 HA ASP 75 HA ASP 75 12.365 5.986 -12.032 423 HB2 ASP 75 1HB ASP 75 10.524 7.452 -12.930 424 HB3 ASP 75 2HB ASP 75 10.420 8.181 -11.322 425 H ASP 76 H ASP 76 10.358 6.238 -9.142 426 HA ASP 76 HA ASP 76 12.033 7.657 -7.387 427 HB2 ASP 76 1HB ASP 76 9.720 5.704 -7.075 428 HB3 ASP 76 2HB ASP 76 10.485 6.446 -5.699 429 H GLN 77 H GLN 77 13.078 4.885 -8.712 430 HA GLN 77 HA GLN 77 12.715 2.858 -6.866 431 HB2 GLN 77 1HB GLN 77 15.128 3.112 -8.666 432 HB3 GLN 77 2HB GLN 77 14.586 1.645 -7.917 433 HG2 GLN 77 1HG GLN 77 12.731 3.144 -9.804 434 HG3 GLN 77 2HG GLN 77 13.999 2.076 -10.406 435 HE21 GLN 77 1HE2 GLN 77 10.835 2.129 -8.787 436 HE22 GLN 77 2HE2 GLN 77 10.691 0.370 -8.758 437 H ASP 78 H ASP 78 15.134 5.419 -6.513 438 HA ASP 78 HA ASP 78 16.215 3.947 -4.145 439 HB2 ASP 78 1HB ASP 78 18.273 4.738 -4.380 440 HB3 ASP 78 2HB ASP 78 17.837 4.652 -6.072 441 H GLY 79 H GLY 79 13.990 6.294 -4.913 442 HA2 GLY 79 1HA GLY 79 14.588 8.130 -2.697 443 HA3 GLY 79 2HA GLY 79 13.288 8.244 -3.880 444 H THR 80 H THR 80 11.300 7.054 -3.568 445 HA THR 80 HA THR 80 10.809 6.702 -0.709 446 HB THR 80 HB THR 80 8.543 6.574 -2.641 447 HG1 THR 80 1HG THR 80 9.136 8.260 -3.752 448 HG21 THR 80 3HG2 THR 80 7.586 8.200 -1.041 449 HG22 THR 80 1HG2 THR 80 9.132 8.245 -0.166 450 HG23 THR 80 2HG2 THR 80 8.170 6.749 -0.213 451 H ILE 81 H ILE 81 9.075 4.922 -0.141 452 HA ILE 81 HA ILE 81 8.304 2.952 -1.888 453 HB ILE 81 HB ILE 81 10.640 2.022 -1.706 454 HG12 ILE 81 1HG1 ILE 81 8.992 0.117 -0.063 455 HG13 ILE 81 2HG1 ILE 81 8.517 0.498 -1.708 456 HG21 ILE 81 1HG2 ILE 81 11.510 1.186 0.444 457 HG22 ILE 81 2HG2 ILE 81 11.235 2.936 0.519 458 HG23 ILE 81 3HG2 ILE 81 10.093 1.809 1.281 459 HD11 ILE 81 3HD1 ILE 81 11.247 -0.586 -0.913 460 HD12 ILE 81 1HD1 ILE 81 9.929 -1.519 -1.633 461 HD13 ILE 81 2HD1 ILE 81 10.708 -0.225 -2.569 462 H ILE 82 H ILE 82 6.803 1.505 -0.783 463 HA ILE 82 HA ILE 82 6.599 1.845 2.135 464 HB ILE 82 HB ILE 82 4.218 1.827 0.260 465 HG12 ILE 82 1HG1 ILE 82 5.036 4.331 1.856 466 HG13 ILE 82 2HG1 ILE 82 5.485 4.053 0.179 467 HG21 ILE 82 1HG2 ILE 82 2.988 2.416 2.464 468 HG22 ILE 82 2HG2 ILE 82 3.626 0.785 2.303 469 HG23 ILE 82 3HG2 ILE 82 4.487 1.958 3.282 470 HD11 ILE 82 3HD1 ILE 82 3.556 5.376 0.148 471 HD12 ILE 82 1HD1 ILE 82 3.136 3.765 -0.439 472 HD13 ILE 82 2HD1 ILE 82 2.662 4.254 1.200 473 H PHE 83 H PHE 83 6.087 -0.142 3.174 474 HA PHE 83 HA PHE 83 5.787 -2.535 1.428 475 HB2 PHE 83 1HB PHE 83 7.078 -2.377 4.173 476 HB3 PHE 83 2HB PHE 83 6.847 -3.814 3.223 477 HD1 PHE 83 2HD PHE 83 8.662 -0.523 3.257 478 HD2 PHE 83 1HD PHE 83 8.519 -4.553 1.714 479 HE1 PHE 83 2HE PHE 83 10.967 -0.273 2.354 480 HE2 PHE 83 1HE PHE 83 10.841 -4.294 0.876 481 HZ PHE 83 HZ PHE 83 12.050 -2.182 1.183 482 H PHE 84 H PHE 84 4.312 -4.170 2.297 483 HA PHE 84 HA PHE 84 2.750 -3.641 4.674 484 HB2 PHE 84 1HB PHE 84 0.560 -3.744 3.375 485 HB3 PHE 84 2HB PHE 84 1.432 -2.227 3.335 486 HD1 PHE 84 2HD PHE 84 3.028 -1.800 1.202 487 HD2 PHE 84 1HD PHE 84 -0.274 -4.565 1.307 488 HE1 PHE 84 2HE PHE 84 3.111 -1.959 -1.190 489 HE2 PHE 84 1HE PHE 84 -0.266 -4.639 -1.173 490 HZ PHE 84 HZ PHE 84 1.444 -3.369 -2.447 491 H LYS 85 H LYS 85 1.685 -5.622 5.350 492 HA LYS 85 HA LYS 85 1.599 -7.811 3.375 493 HB2 LYS 85 1HB LYS 85 3.686 -8.199 4.662 494 HB3 LYS 85 2HB LYS 85 2.774 -8.193 6.177 495 HG2 LYS 85 1HG LYS 85 1.544 -10.172 5.536 496 HG3 LYS 85 2HG LYS 85 2.121 -10.070 3.860 497 HD2 LYS 85 1HD LYS 85 4.401 -10.524 4.616 498 HD3 LYS 85 2HD LYS 85 3.822 -10.699 6.304 499 HE2 LYS 85 1HE LYS 85 2.188 -12.455 5.392 500 HE3 LYS 85 2HE LYS 85 3.084 -12.381 3.864 501 HZ1 LYS 85 3HZ LYS 85 3.903 -14.181 5.105 502 HZ2 LYS 85 1HZ LYS 85 4.070 -13.299 6.479 503 HZ3 LYS 85 2HZ LYS 85 5.082 -13.030 5.203 504 H ALA 86 H ALA 86 -0.202 -9.029 3.620 505 HA ALA 86 HA ALA 86 -2.178 -8.177 5.689 506 HB1 ALA 86 1HB ALA 86 -3.056 -8.281 3.390 507 HB2 ALA 86 2HB ALA 86 -2.527 -9.971 3.240 508 HB3 ALA 86 3HB ALA 86 -3.792 -9.533 4.400 509 H GLU 87 H GLU 87 -2.665 -9.471 7.331 510 HA GLU 87 HA GLU 87 -1.853 -12.290 7.389 511 HB2 GLU 87 1HB GLU 87 -1.523 -11.797 9.957 512 HB3 GLU 87 2HB GLU 87 -0.250 -11.758 8.792 513 HG2 GLU 87 1HG GLU 87 -0.071 -9.485 8.697 514 HG3 GLU 87 2HG GLU 87 -1.483 -9.230 9.745 515 H GLY 88 H GLY 88 -3.931 -12.776 6.807 516 HA2 GLY 88 1HA GLY 88 -5.968 -13.674 7.288 517 HA3 GLY 88 2HA GLY 88 -5.636 -13.349 8.995 518 H GLN 89 H GLN 89 -6.159 -11.295 9.852 519 HA GLN 89 HA GLN 89 -8.272 -9.729 8.426 520 HB2 GLN 89 1HB GLN 89 -8.164 -10.686 11.304 521 HB3 GLN 89 2HB GLN 89 -9.302 -9.466 10.752 522 HG2 GLN 89 1HG GLN 89 -9.216 -12.298 9.637 523 HG3 GLN 89 2HG GLN 89 -10.241 -11.781 10.969 524 HE21 GLN 89 1HE2 GLN 89 -9.783 -11.592 7.471 525 HE22 GLN 89 2HE2 GLN 89 -11.294 -10.767 7.135 526 H THR 90 H THR 90 -5.174 -9.505 9.236 527 HA THR 90 HA THR 90 -5.299 -6.705 10.143 528 HB THR 90 HB THR 90 -3.049 -8.645 10.847 529 HG1 THR 90 1HG THR 90 -4.465 -8.078 12.966 530 HG21 THR 90 3HG2 THR 90 -4.006 -6.030 12.122 531 HG22 THR 90 1HG2 THR 90 -2.586 -6.201 11.079 532 HG23 THR 90 2HG2 THR 90 -2.623 -7.018 12.639 533 H VAL 91 H VAL 91 -3.589 -5.348 9.248 534 HA VAL 91 HA VAL 91 -1.924 -6.485 7.123 535 HB VAL 91 HB VAL 91 -3.501 -3.879 6.970 536 HG11 VAL 91 1HG1 VAL 91 -1.336 -4.937 5.080 537 HG12 VAL 91 2HG1 VAL 91 -2.370 -3.529 4.778 538 HG13 VAL 91 3HG1 VAL 91 -1.210 -3.496 6.108 539 HG21 VAL 91 3HG2 VAL 91 -4.416 -4.795 4.921 540 HG22 VAL 91 1HG2 VAL 91 -3.421 -6.256 5.068 541 HG23 VAL 91 2HG2 VAL 91 -4.732 -5.936 6.237 542 H ILE 92 H ILE 92 0.144 -5.991 7.540 543 HA ILE 92 HA ILE 92 0.775 -4.040 9.696 544 HB ILE 92 HB ILE 92 2.562 -6.220 8.546 545 HG12 ILE 92 1HG1 ILE 92 0.709 -7.417 9.443 546 HG13 ILE 92 2HG1 ILE 92 2.031 -7.525 10.571 547 HG21 ILE 92 1HG2 ILE 92 2.658 -4.597 11.131 548 HG22 ILE 92 2HG2 ILE 92 3.802 -5.880 10.671 549 HG23 ILE 92 3HG2 ILE 92 3.719 -4.392 9.724 550 HD11 ILE 92 3HD1 ILE 92 0.975 -5.954 12.100 551 HD12 ILE 92 1HD1 ILE 92 -0.339 -5.667 10.938 552 HD13 ILE 92 2HD1 ILE 92 -0.155 -7.251 11.675 553 H ILE 93 H ILE 93 0.930 -2.135 8.703 554 HA ILE 93 HA ILE 93 2.056 -1.820 6.015 555 HB ILE 93 HB ILE 93 0.893 0.164 8.002 556 HG12 ILE 93 1HG1 ILE 93 -0.482 -1.314 5.739 557 HG13 ILE 93 2HG1 ILE 93 -0.951 -1.271 7.457 558 HG21 ILE 93 1HG2 ILE 93 2.487 0.952 6.087 559 HG22 ILE 93 2HG2 ILE 93 1.127 0.587 5.042 560 HG23 ILE 93 3HG2 ILE 93 0.931 1.755 6.359 561 HD11 ILE 93 3HD1 ILE 93 -2.466 0.057 6.183 562 HD12 ILE 93 1HD1 ILE 93 -1.520 1.099 7.275 563 HD13 ILE 93 2HD1 ILE 93 -1.180 1.058 5.527 564 H LYS 94 H LYS 94 4.133 -1.181 5.753 565 HA LYS 94 HA LYS 94 5.774 -0.296 8.068 566 HB2 LYS 94 1HB LYS 94 6.183 -2.658 6.203 567 HB3 LYS 94 2HB LYS 94 7.557 -1.840 6.891 568 HG2 LYS 94 1HG LYS 94 6.545 -2.174 9.176 569 HG3 LYS 94 2HG LYS 94 5.350 -3.237 8.419 570 HD2 LYS 94 1HD LYS 94 7.170 -4.728 7.650 571 HD3 LYS 94 2HD LYS 94 8.388 -3.601 8.280 572 HE2 LYS 94 1HE LYS 94 7.520 -3.867 10.543 573 HE3 LYS 94 2HE LYS 94 6.261 -4.978 9.988 574 HZ1 LYS 94 3HZ LYS 94 7.821 -6.642 9.662 575 HZ2 LYS 94 1HZ LYS 94 8.446 -5.884 10.963 576 HZ3 LYS 94 2HZ LYS 94 9.089 -5.617 9.492 577 H TYR 95 H TYR 95 5.842 1.886 7.276 578 HA TYR 95 HA TYR 95 6.744 2.283 4.463 579 HB2 TYR 95 1HB TYR 95 5.734 4.525 4.739 580 HB3 TYR 95 2HB TYR 95 4.603 3.200 4.915 581 HD1 TYR 95 1HD TYR 95 3.568 2.560 6.890 582 HD2 TYR 95 2HD TYR 95 6.217 5.944 6.801 583 HE1 TYR 95 1HE TYR 95 2.691 3.287 9.089 584 HE2 TYR 95 2HE TYR 95 5.306 6.714 8.980 585 HH TYR 95 HH TYR 95 3.073 6.383 10.355 586 H THR 96 H THR 96 8.002 4.423 4.122 587 HA THR 96 HA THR 96 9.734 5.264 6.264 588 HB THR 96 HB THR 96 10.706 3.115 5.706 589 HG1 THR 96 1HG THR 96 12.764 4.013 5.072 590 HG21 THR 96 3HG2 THR 96 11.700 2.656 3.507 591 HG22 THR 96 1HG2 THR 96 11.052 4.181 2.855 592 HG23 THR 96 2HG2 THR 96 9.953 2.871 3.338 593 H SER 97 H SER 97 11.394 6.752 5.255 594 HA SER 97 HA SER 97 10.598 8.123 2.749 595 HB2 SER 97 1HB SER 97 11.414 9.333 5.406 596 HB3 SER 97 2HB SER 97 11.580 10.216 3.882 597 HG SER 97 HG SER 97 9.506 10.322 3.635 598 H GLN 98 H GLN 98 12.674 5.983 3.880 599 HA GLN 98 HA GLN 98 14.434 6.714 1.681 600 HB2 GLN 98 1HB GLN 98 15.496 6.289 4.492 601 HB3 GLN 98 2HB GLN 98 16.408 5.699 3.097 602 HG2 GLN 98 1HG GLN 98 16.356 8.061 2.187 603 HG3 GLN 98 2HG GLN 98 15.742 8.575 3.766 604 HE21 GLN 98 1HE2 GLN 98 18.500 7.232 1.989 605 HE22 GLN 98 2HE2 GLN 98 19.643 7.221 3.287 606 H ARG 99 H ARG 99 14.475 4.916 0.421 607 HA ARG 99 HA ARG 99 13.364 2.399 1.050 608 HB2 ARG 99 1HB ARG 99 14.204 3.505 -1.215 609 HB3 ARG 99 2HB ARG 99 15.706 2.693 -0.828 610 HG2 ARG 99 1HG ARG 99 13.560 0.787 -0.473 611 HG3 ARG 99 2HG ARG 99 13.271 1.619 -1.995 612 HD2 ARG 99 1HD ARG 99 15.909 0.343 -1.180 613 HD3 ARG 99 2HD ARG 99 14.657 -0.479 -2.133 614 HE ARG 99 HE ARG 99 14.982 1.664 -3.674 615 HH11 ARG 99 1HH1 ARG 99 17.103 -0.951 -2.765 616 HH12 ARG 99 2HH1 ARG 99 18.297 -0.520 -3.920 617 HH21 ARG 99 1HH2 ARG 99 16.462 2.097 -5.240 618 HH22 ARG 99 2HH2 ARG 99 18.076 1.408 -5.206 619 H ASN 100 H ASN 100 16.560 3.651 1.458 620 HA ASN 100 HA ASN 100 17.720 1.205 2.446 621 HB2 ASN 100 1HB ASN 100 18.737 4.038 2.126 622 HB3 ASN 100 2HB ASN 100 19.723 2.796 2.881 623 HD21 ASN 100 1HD2 ASN 100 18.156 3.687 -0.141 624 HD22 ASN 100 2HD2 ASN 100 19.220 2.691 -1.145 625 H THR 101 H THR 101 15.453 2.094 4.257 626 HA THR 101 HA THR 101 17.066 2.179 6.720 627 HB THR 101 HB THR 101 15.569 3.894 7.745 628 HG1 THR 101 1HG THR 101 14.795 4.205 5.050 629 HG21 THR 101 3HG2 THR 101 17.249 4.914 5.417 630 HG22 THR 101 1HG2 THR 101 17.718 4.703 7.123 631 HG23 THR 101 2HG2 THR 101 16.526 5.914 6.693 632 H LYS 102 H LYS 102 15.943 1.602 8.632 633 HA LYS 102 HA LYS 102 14.059 -0.462 8.465 634 HB2 LYS 102 1HB LYS 102 15.589 0.151 10.416 635 HB3 LYS 102 2HB LYS 102 14.519 1.484 10.768 636 HG2 LYS 102 1HG LYS 102 13.964 -0.122 12.317 637 HG3 LYS 102 2HG LYS 102 12.652 -0.260 11.163 638 HD2 LYS 102 1HD LYS 102 15.120 -2.055 11.209 639 HD3 LYS 102 2HD LYS 102 13.646 -2.384 12.130 640 HE2 LYS 102 1HE LYS 102 12.358 -2.740 10.116 641 HE3 LYS 102 2HE LYS 102 13.655 -2.154 9.074 642 HZ1 LYS 102 3HZ LYS 102 13.510 -4.620 9.248 643 HZ2 LYS 102 1HZ LYS 102 13.986 -4.512 10.848 644 HZ3 LYS 102 2HZ LYS 102 14.951 -3.991 9.622 645 H LEU 103 H LEU 103 11.789 -0.490 9.179 646 HA LEU 103 HA LEU 103 10.309 1.772 7.963 647 HB2 LEU 103 1HB LEU 103 9.652 -1.167 8.469 648 HB3 LEU 103 2HB LEU 103 8.578 -0.012 7.650 649 HG LEU 103 HG LEU 103 9.393 -1.242 5.902 650 HD11 LEU 103 1HD1 LEU 103 10.990 0.068 4.605 651 HD12 LEU 103 2HD1 LEU 103 11.434 0.997 6.029 652 HD13 LEU 103 3HD1 LEU 103 9.767 1.092 5.379 653 HD21 LEU 103 3HD2 LEU 103 11.477 -2.206 5.589 654 HD22 LEU 103 1HD2 LEU 103 11.057 -2.538 7.264 655 HD23 LEU 103 2HD2 LEU 103 12.253 -1.266 6.871 656 H LYS 104 H LYS 104 8.290 2.386 8.820 657 HA LYS 104 HA LYS 104 8.062 2.509 11.691 658 HB2 LYS 104 1HB LYS 104 6.550 3.459 9.253 659 HB3 LYS 104 2HB LYS 104 5.614 3.291 10.711 660 HG2 LYS 104 1HG LYS 104 6.392 5.541 10.683 661 HG3 LYS 104 2HG LYS 104 7.271 4.700 11.953 662 HD2 LYS 104 1HD LYS 104 9.224 4.480 10.626 663 HD3 LYS 104 2HD LYS 104 8.396 5.048 9.182 664 HE2 LYS 104 1HE LYS 104 8.039 7.276 10.294 665 HE3 LYS 104 2HE LYS 104 8.869 6.663 11.739 666 HZ1 LYS 104 3HZ LYS 104 10.023 7.116 9.076 667 HZ2 LYS 104 1HZ LYS 104 10.827 6.309 10.284 668 HZ3 LYS 104 2HZ LYS 104 10.418 7.885 10.466 669 H ALA 105 H ALA 105 5.704 2.074 12.586 670 HA ALA 105 HA ALA 105 4.703 -0.568 11.716 671 HB1 ALA 105 1HB ALA 105 5.808 -1.021 13.792 672 HB2 ALA 105 2HB ALA 105 5.140 0.451 14.557 673 HB3 ALA 105 3HB ALA 105 4.079 -0.905 14.161 674 H LYS 106 H LYS 106 2.719 -0.327 10.902 675 HA LYS 106 HA LYS 106 0.728 1.144 12.493 676 HB2 LYS 106 1HB LYS 106 1.483 2.689 10.780 677 HB3 LYS 106 2HB LYS 106 1.384 1.461 9.549 678 HG2 LYS 106 1HG LYS 106 -0.473 2.615 9.041 679 HG3 LYS 106 2HG LYS 106 -1.211 1.477 10.167 680 HD2 LYS 106 1HD LYS 106 -1.287 3.139 11.918 681 HD3 LYS 106 2HD LYS 106 -0.131 4.190 11.058 682 HE2 LYS 106 1HE LYS 106 -1.803 4.414 9.179 683 HE3 LYS 106 2HE LYS 106 -2.994 3.599 10.216 684 HZ1 LYS 106 3HZ LYS 106 -2.623 5.384 11.848 685 HZ2 LYS 106 1HZ LYS 106 -3.247 5.915 10.466 686 HZ3 LYS 106 2HZ LYS 106 -1.651 6.184 10.760 687 H ALA 107 H ALA 107 -0.548 -0.643 13.077 688 HA ALA 107 HA ALA 107 -0.700 -2.941 11.151 689 HB1 ALA 107 1HB ALA 107 -0.463 -3.105 14.180 690 HB2 ALA 107 2HB ALA 107 -0.830 -4.454 13.080 691 HB3 ALA 107 3HB ALA 107 0.744 -3.635 12.984 692 H LEU 108 H LEU 108 -2.740 -2.944 10.414 693 HA LEU 108 HA LEU 108 -4.936 -1.802 12.113 694 HB2 LEU 108 1HB LEU 108 -4.564 -1.586 9.103 695 HB3 LEU 108 2HB LEU 108 -5.791 -0.776 10.072 696 HG LEU 108 HG LEU 108 -2.787 -0.213 10.259 697 HD11 LEU 108 1HD1 LEU 108 -4.962 1.255 8.732 698 HD12 LEU 108 2HD1 LEU 108 -3.614 0.286 8.069 699 HD13 LEU 108 3HD1 LEU 108 -3.276 1.791 8.927 700 HD21 LEU 108 3HD2 LEU 108 -5.178 1.322 11.359 701 HD22 LEU 108 1HD2 LEU 108 -3.485 1.853 11.430 702 HD23 LEU 108 2HD2 LEU 108 -3.988 0.409 12.309 703 H THR 109 H THR 109 -6.940 -2.962 11.923 704 HA THR 109 HA THR 109 -6.770 -5.573 10.726 705 HB THR 109 HB THR 109 -9.275 -5.657 11.142 706 HG1 THR 109 1HG THR 109 -8.648 -3.320 12.644 707 HG21 THR 109 3HG2 THR 109 -7.577 -6.690 12.620 708 HG22 THR 109 1HG2 THR 109 -8.935 -6.044 13.546 709 HG23 THR 109 2HG2 THR 109 -7.394 -5.159 13.493 710 H LEU 110 H LEU 110 -7.804 -6.391 8.848 711 HA LEU 110 HA LEU 110 -8.037 -4.746 6.552 712 HB2 LEU 110 1HB LEU 110 -9.220 -7.434 7.386 713 HB3 LEU 110 2HB LEU 110 -9.632 -6.716 5.841 714 HG LEU 110 HG LEU 110 -6.788 -7.359 6.701 715 HD11 LEU 110 1HD1 LEU 110 -8.514 -8.785 4.639 716 HD12 LEU 110 2HD1 LEU 110 -8.292 -9.366 6.292 717 HD13 LEU 110 3HD1 LEU 110 -6.891 -9.238 5.209 718 HD21 LEU 110 3HD2 LEU 110 -6.315 -7.021 4.268 719 HD22 LEU 110 1HD2 LEU 110 -6.855 -5.533 5.039 720 HD23 LEU 110 2HD2 LEU 110 -7.994 -6.459 4.044 721 H SER 111 H SER 111 -10.399 -5.507 9.072 722 HA SER 111 HA SER 111 -12.677 -4.346 7.780 723 HB2 SER 111 1HB SER 111 -12.628 -5.870 9.824 724 HB3 SER 111 2HB SER 111 -11.976 -4.521 10.749 725 HG SER 111 HG SER 111 -13.893 -3.984 11.082 726 H GLN 112 H GLN 112 -10.098 -2.983 9.951 727 HA GLN 112 HA GLN 112 -11.132 -0.416 10.223 728 HB2 GLN 112 1HB GLN 112 -8.851 -1.777 11.050 729 HB3 GLN 112 2HB GLN 112 -8.168 -0.587 9.979 730 HG2 GLN 112 1HG GLN 112 -10.169 0.107 12.156 731 HG3 GLN 112 2HG GLN 112 -8.449 -0.006 12.461 732 HE21 GLN 112 1HE2 GLN 112 -10.863 2.231 11.642 733 HE22 GLN 112 2HE2 GLN 112 -9.774 3.435 10.969 734 H LEU 113 H LEU 113 -8.629 -1.504 7.874 735 HA LEU 113 HA LEU 113 -8.495 0.906 6.410 736 HB2 LEU 113 1HB LEU 113 -8.066 -2.003 5.604 737 HB3 LEU 113 2HB LEU 113 -7.786 -0.679 4.487 738 HG LEU 113 HG LEU 113 -6.347 -0.947 7.153 739 HD11 LEU 113 1HD1 LEU 113 -5.778 -2.792 5.623 740 HD12 LEU 113 2HD1 LEU 113 -4.417 -1.675 5.800 741 HD13 LEU 113 3HD1 LEU 113 -5.412 -1.625 4.329 742 HD21 LEU 113 3HD2 LEU 113 -4.777 0.722 6.053 743 HD22 LEU 113 1HD2 LEU 113 -6.368 1.378 6.433 744 HD23 LEU 113 2HD2 LEU 113 -5.971 0.921 4.764 745 H LYS 114 H LYS 114 -10.904 -1.660 6.147 746 HA LYS 114 HA LYS 114 -12.041 -0.690 3.647 747 HB2 LYS 114 1HB LYS 114 -12.184 -3.029 4.551 748 HB3 LYS 114 2HB LYS 114 -13.255 -2.473 5.836 749 HG2 LYS 114 1HG LYS 114 -13.884 -2.208 2.862 750 HG3 LYS 114 2HG LYS 114 -14.271 -3.631 3.823 751 HD2 LYS 114 1HD LYS 114 -15.642 -2.259 5.366 752 HD3 LYS 114 2HD LYS 114 -15.418 -0.848 4.294 753 HE2 LYS 114 1HE LYS 114 -16.193 -3.027 2.617 754 HE3 LYS 114 2HE LYS 114 -17.245 -3.090 4.027 755 HZ1 LYS 114 3HZ LYS 114 -16.909 -0.689 2.313 756 HZ2 LYS 114 1HZ LYS 114 -17.943 -0.842 3.584 757 HZ3 LYS 114 2HZ LYS 114 -18.169 -1.765 2.288 758 H LYS 115 H LYS 115 -12.647 -0.125 7.156 759 HA LYS 115 HA LYS 115 -15.006 1.514 6.679 760 HB2 LYS 115 1HB LYS 115 -13.565 0.256 8.934 761 HB3 LYS 115 2HB LYS 115 -13.833 1.930 9.246 762 HG2 LYS 115 1HG LYS 115 -15.730 0.675 10.085 763 HG3 LYS 115 2HG LYS 115 -16.267 1.673 8.737 764 HD2 LYS 115 1HD LYS 115 -17.285 -0.547 8.622 765 HD3 LYS 115 2HD LYS 115 -16.221 -0.317 7.245 766 HE2 LYS 115 1HE LYS 115 -15.092 -2.193 7.783 767 HE3 LYS 115 2HE LYS 115 -14.600 -1.450 9.297 768 HZ1 LYS 115 3HZ LYS 115 -17.129 -2.966 9.002 769 HZ2 LYS 115 1HZ LYS 115 -16.570 -2.265 10.340 770 HZ3 LYS 115 2HZ LYS 115 -15.719 -3.513 9.688 771 H GLU 116 H GLU 116 -11.498 2.092 6.952 772 HA GLU 116 HA GLU 116 -11.788 4.969 7.026 773 HB2 GLU 116 1HB GLU 116 -9.507 3.233 6.018 774 HB3 GLU 116 2HB GLU 116 -9.433 4.963 6.274 775 HG2 GLU 116 1HG GLU 116 -9.646 2.776 8.354 776 HG3 GLU 116 2HG GLU 116 -8.285 3.810 8.023 777 H PHE 117 H PHE 117 -10.748 2.833 4.281 778 HA PHE 117 HA PHE 117 -11.470 5.118 2.538 779 HB2 PHE 117 1HB PHE 117 -9.458 2.944 2.069 780 HB3 PHE 117 2HB PHE 117 -9.595 4.490 1.238 781 HD1 PHE 117 1HD PHE 117 -9.319 6.639 2.859 782 HD2 PHE 117 2HD PHE 117 -7.847 2.661 3.691 783 HE1 PHE 117 1HE PHE 117 -7.708 7.566 4.495 784 HE2 PHE 117 2HE PHE 117 -6.276 3.591 5.334 785 HZ PHE 117 HZ PHE 117 -6.203 6.053 5.757 786 H TYR 118 H TYR 118 -13.282 2.658 3.179 787 HA TYR 118 HA TYR 118 -14.108 2.356 0.360 788 HB2 TYR 118 1HB TYR 118 -12.442 0.499 1.234 789 HB3 TYR 118 2HB TYR 118 -13.848 -0.126 2.044 790 HD1 TYR 118 2HD TYR 118 -12.974 1.249 -1.379 791 HD2 TYR 118 1HD TYR 118 -14.925 -1.871 0.891 792 HE1 TYR 118 2HE TYR 118 -13.329 -0.043 -3.466 793 HE2 TYR 118 1HE TYR 118 -15.404 -3.098 -1.189 794 HH TYR 118 HH TYR 118 -14.309 -1.993 -4.385 795 H GLN 119 H GLN 119 -15.272 3.687 2.863 796 HA GLN 119 HA GLN 119 -17.291 2.125 3.951 797 HB2 GLN 119 1HB GLN 119 -17.971 5.003 3.834 798 HB3 GLN 119 2HB GLN 119 -17.697 3.894 5.135 799 HG2 GLN 119 1HG GLN 119 -16.108 5.326 5.716 800 HG3 GLN 119 2HG GLN 119 -15.136 4.290 4.666 801 HE21 GLN 119 1HE2 GLN 119 -13.750 5.822 3.646 802 HE22 GLN 119 2HE2 GLN 119 -14.320 7.213 2.784 803 H THR 120 H THR 120 -17.481 4.749 1.538 804 HA THR 120 HA THR 120 -20.283 4.325 0.992 805 HB THR 120 HB THR 120 -20.161 6.252 -0.403 806 HG1 THR 120 1HG THR 120 -18.203 7.117 -1.086 807 HG21 THR 120 3HG2 THR 120 -19.773 6.719 2.052 808 HG22 THR 120 1HG2 THR 120 -19.055 7.926 0.964 809 HG23 THR 120 2HG2 THR 120 -18.027 6.716 1.702 810 H ARG 121 H ARG 121 -21.027 4.322 -1.459 811 HA ARG 121 HA ARG 121 -19.696 2.027 -2.782 812 HB2 ARG 121 1HB ARG 121 -21.565 2.532 -4.549 813 HB3 ARG 121 2HB ARG 121 -21.900 1.558 -3.136 814 HG2 ARG 121 1HG ARG 121 -22.501 4.535 -3.037 815 HG3 ARG 121 2HG ARG 121 -23.487 3.487 -4.049 816 HD2 ARG 121 1HD ARG 121 -23.762 1.956 -1.978 817 HD3 ARG 121 2HD ARG 121 -23.115 3.299 -1.033 818 HE ARG 121 HE ARG 121 -25.131 4.382 -1.234 819 HH11 ARG 121 1HH1 ARG 121 -25.052 1.764 -3.668 820 HH12 ARG 121 2HH1 ARG 121 -26.619 2.129 -4.289 821 HH21 ARG 121 1HH2 ARG 121 -27.267 4.708 -1.936 822 HH22 ARG 121 2HH2 ARG 121 -27.943 3.748 -3.228 823 H SER 122 H SER 122 -20.472 5.482 -3.591 824 HA SER 122 HA SER 122 -19.492 5.462 -6.199 825 HB2 SER 122 1HB SER 122 -19.115 7.990 -5.406 826 HB3 SER 122 2HB SER 122 -20.724 7.255 -5.617 827 HG SER 122 HG SER 122 -19.456 8.010 -3.236 828 H GLN 123 H GLN 123 -17.729 5.844 -3.130 829 HA GLN 123 HA GLN 123 -15.216 6.661 -3.996 830 HB2 GLN 123 1HB GLN 123 -15.766 6.490 -1.728 831 HB3 GLN 123 2HB GLN 123 -16.231 4.781 -1.854 832 HG2 GLN 123 1HG GLN 123 -13.987 4.023 -1.795 833 HG3 GLN 123 2HG GLN 123 -13.362 5.663 -2.145 834 HE21 GLN 123 1HE2 GLN 123 -16.019 5.011 0.107 835 HE22 GLN 123 2HE2 GLN 123 -15.068 5.535 1.529 836 H LYS 124 H LYS 124 -16.612 3.415 -4.059 837 HA LYS 124 HA LYS 124 -14.256 1.932 -4.383 838 HB2 LYS 124 1HB LYS 124 -17.049 1.198 -5.349 839 HB3 LYS 124 2HB LYS 124 -15.742 0.085 -4.958 840 HG2 LYS 124 1HG LYS 124 -15.821 0.941 -2.567 841 HG3 LYS 124 2HG LYS 124 -17.220 1.895 -2.998 842 HD2 LYS 124 1HD LYS 124 -18.481 -0.063 -3.612 843 HD3 LYS 124 2HD LYS 124 -17.083 -1.125 -3.353 844 HE2 LYS 124 1HE LYS 124 -16.992 -0.394 -0.959 845 HE3 LYS 124 2HE LYS 124 -18.408 0.631 -1.245 846 HZ1 LYS 124 3HZ LYS 124 -18.285 -2.236 -0.959 847 HZ2 LYS 124 1HZ LYS 124 -19.375 -1.644 -2.069 848 HZ3 LYS 124 2HZ LYS 124 -19.422 -1.143 -0.487 849 H ARG 125 H ARG 125 -15.906 3.830 -6.758 850 HA ARG 125 HA ARG 125 -15.079 2.447 -9.176 851 HB2 ARG 125 1HB ARG 125 -16.087 5.181 -8.380 852 HB3 ARG 125 2HB ARG 125 -15.042 5.117 -9.777 853 HG2 ARG 125 1HG ARG 125 -17.369 5.018 -10.394 854 HG3 ARG 125 2HG ARG 125 -16.401 3.617 -10.937 855 HD2 ARG 125 1HD ARG 125 -17.421 2.276 -9.084 856 HD3 ARG 125 2HD ARG 125 -18.439 3.675 -8.669 857 HE ARG 125 HE ARG 125 -18.726 3.235 -11.417 858 HH11 ARG 125 1HH1 ARG 125 -19.503 1.303 -8.498 859 HH12 ARG 125 2HH1 ARG 125 -20.431 0.148 -9.413 860 HH21 ARG 125 1HH2 ARG 125 -20.343 2.012 -12.401 861 HH22 ARG 125 2HH2 ARG 125 -21.071 0.648 -11.583 862 H GLU 126 H GLU 126 -13.690 5.393 -7.718 863 HA GLU 126 HA GLU 126 -11.328 5.282 -9.141 864 HB2 GLU 126 1HB GLU 126 -11.852 6.384 -6.345 865 HB3 GLU 126 2HB GLU 126 -10.358 6.649 -7.237 866 HG2 GLU 126 1HG GLU 126 -11.545 8.527 -7.590 867 HG3 GLU 126 2HG GLU 126 -11.718 7.638 -9.098 868 H VAL 127 H VAL 127 -11.990 4.045 -5.952 869 HA VAL 127 HA VAL 127 -9.465 3.095 -5.242 870 HB VAL 127 HB VAL 127 -11.974 1.550 -4.561 871 HG11 VAL 127 1HG1 VAL 127 -9.812 0.434 -4.002 872 HG12 VAL 127 2HG1 VAL 127 -9.265 1.892 -3.172 873 HG13 VAL 127 3HG1 VAL 127 -10.645 0.951 -2.526 874 HG21 VAL 127 3HG2 VAL 127 -12.149 2.935 -2.553 875 HG22 VAL 127 1HG2 VAL 127 -10.741 3.877 -3.043 876 HG23 VAL 127 2HG2 VAL 127 -12.181 4.000 -3.960 877 H ASP 128 H ASP 128 -11.972 1.038 -6.813 878 HA ASP 128 HA ASP 128 -10.205 -1.095 -7.473 879 HB2 ASP 128 1HB ASP 128 -12.901 -0.613 -7.871 880 HB3 ASP 128 2HB ASP 128 -12.332 -0.529 -9.502 881 H ASP 129 H ASP 129 -10.818 1.972 -9.124 882 HA ASP 129 HA ASP 129 -9.557 1.383 -11.585 883 HB2 ASP 129 1HB ASP 129 -11.074 3.407 -10.695 884 HB3 ASP 129 2HB ASP 129 -9.544 4.230 -10.529 885 H TYR 130 H TYR 130 -8.192 2.811 -8.561 886 HA TYR 130 HA TYR 130 -5.481 3.118 -9.477 887 HB2 TYR 130 1HB TYR 130 -6.458 2.396 -6.715 888 HB3 TYR 130 2HB TYR 130 -4.852 2.976 -7.120 889 HD1 TYR 130 2HD TYR 130 -5.062 5.282 -8.714 890 HD2 TYR 130 1HD TYR 130 -7.707 4.076 -5.531 891 HE1 TYR 130 2HE TYR 130 -5.806 7.577 -8.478 892 HE2 TYR 130 1HE TYR 130 -8.555 6.371 -5.393 893 HH TYR 130 HH TYR 130 -7.276 9.017 -7.445 894 H VAL 131 H VAL 131 -7.212 0.306 -8.032 895 HA VAL 131 HA VAL 131 -4.907 -1.398 -8.057 896 HB VAL 131 HB VAL 131 -7.829 -2.268 -8.154 897 HG11 VAL 131 1HG1 VAL 131 -6.805 -4.219 -6.815 898 HG12 VAL 131 2HG1 VAL 131 -6.363 -4.151 -8.521 899 HG13 VAL 131 3HG1 VAL 131 -5.230 -3.565 -7.284 900 HG21 VAL 131 3HG2 VAL 131 -6.153 -1.893 -5.646 901 HG22 VAL 131 1HG2 VAL 131 -7.334 -0.693 -6.190 902 HG23 VAL 131 2HG2 VAL 131 -7.886 -2.300 -5.772 903 H ALA 132 H ALA 132 -7.321 -0.588 -10.507 904 HA ALA 132 HA ALA 132 -6.464 -2.679 -12.346 905 HB1 ALA 132 1HB ALA 132 -8.122 -1.741 -13.815 906 HB2 ALA 132 2HB ALA 132 -8.829 -1.844 -12.192 907 HB3 ALA 132 3HB ALA 132 -8.272 -0.273 -12.827 908 H GLY 133 H GLY 133 -5.353 0.509 -11.635 909 HA2 GLY 133 1HA GLY 133 -4.201 0.967 -14.331 910 HA3 GLY 133 2HA GLY 133 -4.232 2.086 -12.971 911 H LEU 134 H LEU 134 -3.208 0.106 -11.013 912 HA LEU 134 HA LEU 134 -0.531 0.873 -11.243 913 HB2 LEU 134 1HB LEU 134 -0.064 -0.473 -9.342 914 HB3 LEU 134 2HB LEU 134 -1.571 0.408 -9.139 915 HG LEU 134 HG LEU 134 -2.726 -1.841 -9.747 916 HD11 LEU 134 1HD1 LEU 134 -1.387 -3.839 -8.954 917 HD12 LEU 134 2HD1 LEU 134 0.075 -2.829 -9.026 918 HD13 LEU 134 3HD1 LEU 134 -0.834 -3.221 -10.493 919 HD21 LEU 134 3HD2 LEU 134 -2.595 -2.548 -7.393 920 HD22 LEU 134 1HD2 LEU 134 -2.694 -0.788 -7.499 921 HD23 LEU 134 2HD2 LEU 134 -1.123 -1.581 -7.162 922 H ARG 135 H ARG 135 1.433 -0.298 -11.446 923 HA ARG 135 HA ARG 135 1.327 -2.449 -13.510 924 HB2 ARG 135 1HB ARG 135 3.600 -0.749 -12.359 925 HB3 ARG 135 2HB ARG 135 3.789 -2.001 -13.585 926 HG2 ARG 135 1HG ARG 135 2.407 -0.694 -15.151 927 HG3 ARG 135 2HG ARG 135 2.126 0.542 -13.922 928 HD2 ARG 135 1HD ARG 135 3.917 1.213 -15.505 929 HD3 ARG 135 2HD ARG 135 4.468 1.140 -13.829 930 HE ARG 135 HE ARG 135 6.053 -0.358 -14.488 931 HH11 ARG 135 1HH1 ARG 135 3.485 -0.384 -16.954 932 HH12 ARG 135 2HH1 ARG 135 4.324 -1.453 -17.996 933 HH21 ARG 135 1HH2 ARG 135 6.928 -2.162 -15.633 934 HH22 ARG 135 2HH2 ARG 135 6.111 -2.737 -17.066 935 H THR 136 H THR 136 2.404 -4.419 -13.075 936 HA THR 136 HA THR 136 3.478 -4.863 -10.330 937 HB THR 136 HB THR 136 2.005 -6.970 -11.853 938 HG1 THR 136 1HG THR 136 0.137 -6.457 -10.880 939 HG21 THR 136 3HG2 THR 136 2.476 -6.523 -8.864 940 HG22 THR 136 1HG2 THR 136 3.315 -7.695 -9.861 941 HG23 THR 136 2HG2 THR 136 1.584 -7.895 -9.559 942 H GLU 137 H GLU 137 4.487 -4.199 -12.927 943 HA GLU 137 HA GLU 137 5.979 -4.500 -14.525 944 HB2 GLU 137 1HB GLU 137 8.069 -5.580 -14.202 945 HB3 GLU 137 2HB GLU 137 7.651 -4.574 -12.818 946 HG2 GLU 137 1HG GLU 137 7.290 -6.439 -11.406 947 HG3 GLU 137 2HG GLU 137 7.169 -7.568 -12.764 Start of MODEL 20 1 H1 GLY 19 H GLY 19 -9.490 -17.981 5.763 2 HA2 GLY 19 1HA GLY 19 -8.807 -19.865 4.283 3 HA3 GLY 19 2HA GLY 19 -10.352 -19.623 3.465 4 H HIS 20 H HIS 20 -10.582 -17.872 2.042 5 HA HIS 20 HA HIS 20 -8.422 -15.953 1.614 6 HB2 HIS 20 1HB HIS 20 -8.145 -16.786 -0.798 7 HB3 HIS 20 2HB HIS 20 -7.324 -17.634 0.488 8 HD1 HIS 20 1HD HIS 20 -10.689 -18.167 -1.477 9 HD2 HIS 20 2HD HIS 20 -7.538 -20.195 0.490 10 HE1 HIS 20 1HE HIS 20 -10.999 -20.609 -1.990 11 H MET 21 H MET 21 -11.294 -15.928 2.278 12 HA MET 21 HA MET 21 -12.282 -14.252 0.007 13 HB2 MET 21 1HB MET 21 -13.807 -16.072 0.833 14 HB3 MET 21 2HB MET 21 -13.817 -15.287 2.410 15 HG2 MET 21 1HG MET 21 -14.431 -13.152 0.863 16 HG3 MET 21 2HG MET 21 -15.034 -14.419 -0.199 17 HE1 MET 21 3HE MET 21 -17.995 -12.459 1.695 18 HE2 MET 21 1HE MET 21 -16.353 -11.839 1.379 19 HE3 MET 21 2HE MET 21 -17.225 -12.738 0.109 20 H LYS 22 H LYS 22 -10.355 -12.832 0.803 21 HA LYS 22 HA LYS 22 -11.228 -11.095 3.033 22 HB2 LYS 22 1HB LYS 22 -9.129 -11.212 4.203 23 HB3 LYS 22 2HB LYS 22 -9.890 -12.790 4.181 24 HG2 LYS 22 1HG LYS 22 -8.252 -13.729 2.817 25 HG3 LYS 22 2HG LYS 22 -7.788 -12.190 2.069 26 HD2 LYS 22 1HD LYS 22 -6.680 -11.446 4.140 27 HD3 LYS 22 2HD LYS 22 -7.244 -12.902 4.986 28 HE2 LYS 22 1HE LYS 22 -5.299 -13.877 4.398 29 HE3 LYS 22 2HE LYS 22 -5.995 -14.002 2.791 30 HZ1 LYS 22 3HZ LYS 22 -4.011 -12.057 3.734 31 HZ2 LYS 22 1HZ LYS 22 -4.934 -11.766 2.370 32 HZ3 LYS 22 2HZ LYS 22 -3.995 -13.067 2.440 33 H PHE 23 H PHE 23 -11.231 -10.582 0.269 34 HA PHE 23 HA PHE 23 -10.519 -9.336 -1.402 35 HB2 PHE 23 1HB PHE 23 -9.155 -7.741 0.754 36 HB3 PHE 23 2HB PHE 23 -9.207 -7.246 -0.928 37 HD1 PHE 23 2HD PHE 23 -11.905 -7.697 -1.837 38 HD2 PHE 23 1HD PHE 23 -10.432 -6.174 1.923 39 HE1 PHE 23 2HE PHE 23 -13.959 -6.434 -1.563 40 HE2 PHE 23 1HE PHE 23 -12.498 -4.801 2.176 41 HZ PHE 23 HZ PHE 23 -14.276 -4.937 0.452 42 H THR 24 H THR 24 -8.064 -8.279 -2.166 43 HA THR 24 HA THR 24 -6.239 -10.614 -2.113 44 HB THR 24 HB THR 24 -5.826 -9.553 -4.558 45 HG1 THR 24 1HG THR 24 -7.810 -9.100 -5.504 46 HG21 THR 24 3HG2 THR 24 -6.404 -11.901 -4.023 47 HG22 THR 24 1HG2 THR 24 -7.307 -11.300 -5.429 48 HG23 THR 24 2HG2 THR 24 -8.105 -11.439 -3.849 49 H ASP 25 H ASP 25 -4.056 -10.139 -2.366 50 HA ASP 25 HA ASP 25 -2.935 -8.103 -0.915 51 HB2 ASP 25 1HB ASP 25 -0.863 -8.572 -2.482 52 HB3 ASP 25 2HB ASP 25 -1.510 -9.880 -1.471 53 H GLN 26 H GLN 26 -3.038 -8.086 -4.498 54 HA GLN 26 HA GLN 26 -2.348 -5.568 -5.149 55 HB2 GLN 26 1HB GLN 26 -4.511 -7.412 -6.176 56 HB3 GLN 26 2HB GLN 26 -4.437 -5.806 -6.826 57 HG2 GLN 26 1HG GLN 26 -1.807 -7.204 -6.752 58 HG3 GLN 26 2HG GLN 26 -2.997 -7.953 -7.775 59 HE21 GLN 26 1HE2 GLN 26 -4.349 -6.041 -9.220 60 HE22 GLN 26 2HE2 GLN 26 -3.196 -4.980 -9.968 61 H GLN 27 H GLN 27 -5.749 -6.391 -4.356 62 HA GLN 27 HA GLN 27 -6.769 -3.753 -4.473 63 HB2 GLN 27 1HB GLN 27 -7.742 -6.189 -2.928 64 HB3 GLN 27 2HB GLN 27 -8.693 -4.740 -3.150 65 HG2 GLN 27 1HG GLN 27 -7.629 -6.373 -5.497 66 HG3 GLN 27 2HG GLN 27 -9.128 -6.743 -4.703 67 HE21 GLN 27 1HE2 GLN 27 -8.396 -5.655 -7.579 68 HE22 GLN 27 2HE2 GLN 27 -9.429 -4.285 -7.721 69 H ILE 28 H ILE 28 -5.885 -5.696 -1.589 70 HA ILE 28 HA ILE 28 -6.559 -3.794 0.351 71 HB ILE 28 HB ILE 28 -4.463 -5.992 0.479 72 HG12 ILE 28 1HG1 ILE 28 -7.286 -6.246 1.565 73 HG13 ILE 28 2HG1 ILE 28 -7.000 -6.588 -0.113 74 HG21 ILE 28 1HG2 ILE 28 -5.054 -5.978 2.957 75 HG22 ILE 28 2HG2 ILE 28 -4.176 -4.545 2.401 76 HG23 ILE 28 3HG2 ILE 28 -5.924 -4.467 2.676 77 HD11 ILE 28 3HD1 ILE 28 -5.126 -8.205 0.682 78 HD12 ILE 28 1HD1 ILE 28 -5.874 -8.034 2.288 79 HD13 ILE 28 2HD1 ILE 28 -6.809 -8.678 0.938 80 H GLY 29 H GLY 29 -3.500 -4.169 -1.458 81 HA2 GLY 29 1HA GLY 29 -1.879 -2.529 0.149 82 HA3 GLY 29 2HA GLY 29 -1.679 -2.811 -1.581 83 H VAL 30 H VAL 30 -4.384 -1.535 -2.200 84 HA VAL 30 HA VAL 30 -3.332 1.189 -2.449 85 HB VAL 30 HB VAL 30 -6.004 -0.089 -3.190 86 HG11 VAL 30 1HG1 VAL 30 -6.338 2.348 -2.769 87 HG12 VAL 30 2HG1 VAL 30 -5.044 2.708 -3.933 88 HG13 VAL 30 3HG1 VAL 30 -6.548 1.899 -4.454 89 HG21 VAL 30 3HG2 VAL 30 -4.095 -0.851 -4.514 90 HG22 VAL 30 1HG2 VAL 30 -5.114 0.191 -5.524 91 HG23 VAL 30 2HG2 VAL 30 -3.601 0.817 -4.849 92 H LEU 31 H LEU 31 -5.737 -0.538 -0.461 93 HA LEU 31 HA LEU 31 -6.732 1.806 0.917 94 HB2 LEU 31 1HB LEU 31 -7.009 -1.148 1.058 95 HB3 LEU 31 2HB LEU 31 -6.867 -0.439 2.649 96 HG LEU 31 HG LEU 31 -8.785 0.847 2.454 97 HD11 LEU 31 1HD1 LEU 31 -8.712 1.725 0.150 98 HD12 LEU 31 2HD1 LEU 31 -10.245 0.888 0.384 99 HD13 LEU 31 3HD1 LEU 31 -8.928 0.104 -0.507 100 HD21 LEU 31 3HD2 LEU 31 -9.702 -1.659 1.069 101 HD22 LEU 31 1HD2 LEU 31 -10.441 -0.779 2.411 102 HD23 LEU 31 2HD2 LEU 31 -8.975 -1.743 2.682 103 H ALA 32 H ALA 32 -4.099 -0.522 1.614 104 HA ALA 32 HA ALA 32 -3.251 0.772 4.033 105 HB1 ALA 32 1HB ALA 32 -1.065 -0.420 3.535 106 HB2 ALA 32 2HB ALA 32 -2.503 -1.473 3.609 107 HB3 ALA 32 3HB ALA 32 -1.800 -1.021 2.040 108 H GLY 33 H GLY 33 -2.291 1.227 0.580 109 HA2 GLY 33 1HA GLY 33 -0.191 3.068 1.120 110 HA3 GLY 33 2HA GLY 33 -1.001 2.828 -0.438 111 H LEU 34 H LEU 34 -3.732 3.523 0.647 112 HA LEU 34 HA LEU 34 -3.532 6.301 0.301 113 HB2 LEU 34 1HB LEU 34 -5.511 4.444 0.185 114 HB3 LEU 34 2HB LEU 34 -5.956 5.243 1.680 115 HG LEU 34 HG LEU 34 -6.005 7.425 0.385 116 HD11 LEU 34 1HD1 LEU 34 -4.461 6.835 -1.509 117 HD12 LEU 34 2HD1 LEU 34 -6.056 7.274 -2.117 118 HD13 LEU 34 3HD1 LEU 34 -5.572 5.561 -2.013 119 HD21 LEU 34 3HD2 LEU 34 -8.061 6.751 -0.890 120 HD22 LEU 34 1HD2 LEU 34 -8.023 6.114 0.745 121 HD23 LEU 34 2HD2 LEU 34 -7.634 5.036 -0.615 122 H ALA 35 H ALA 35 -3.309 4.407 3.196 123 HA ALA 35 HA ALA 35 -3.737 6.624 5.048 124 HB1 ALA 35 1HB ALA 35 -3.991 4.233 5.729 125 HB2 ALA 35 2HB ALA 35 -2.290 3.955 5.405 126 HB3 ALA 35 3HB ALA 35 -2.759 5.068 6.704 127 H ILE 36 H ILE 36 -1.165 5.762 2.860 128 HA ILE 36 HA ILE 36 0.931 7.086 4.478 129 HB ILE 36 HB ILE 36 1.086 4.414 3.004 130 HG12 ILE 36 1HG1 ILE 36 -0.123 3.803 4.885 131 HG13 ILE 36 2HG1 ILE 36 1.535 3.325 5.142 132 HG21 ILE 36 1HG2 ILE 36 3.205 5.767 3.042 133 HG22 ILE 36 2HG2 ILE 36 3.174 5.713 4.810 134 HG23 ILE 36 3HG2 ILE 36 3.306 4.221 3.849 135 HD11 ILE 36 3HD1 ILE 36 0.007 5.532 6.545 136 HD12 ILE 36 1HD1 ILE 36 0.732 4.089 7.219 137 HD13 ILE 36 2HD1 ILE 36 1.766 5.408 6.626 138 H SER 37 H SER 37 0.837 8.908 3.038 139 HA SER 37 HA SER 37 1.445 10.097 1.184 140 HB2 SER 37 1HB SER 37 3.071 7.645 0.618 141 HB3 SER 37 2HB SER 37 3.214 9.076 -0.331 142 HG SER 37 HG SER 37 4.717 8.845 1.405 143 HA PRO 38 HA PRO 38 -1.951 7.714 -1.211 144 HB2 PRO 38 1HB PRO 38 -3.875 9.713 -0.967 145 HB3 PRO 38 2HB PRO 38 -3.698 8.367 0.175 146 HG2 PRO 38 1HG PRO 38 -2.606 11.166 0.448 147 HG3 PRO 38 2HG PRO 38 -3.452 10.175 1.677 148 HD2 PRO 38 1HD PRO 38 -0.790 10.363 1.684 149 HD3 PRO 38 2HD PRO 38 -1.583 8.791 2.010 150 H GLU 39 H GLU 39 -0.995 11.191 -1.111 151 HA GLU 39 HA GLU 39 -1.828 12.017 -3.664 152 HB2 GLU 39 1HB GLU 39 0.587 12.812 -1.977 153 HB3 GLU 39 2HB GLU 39 0.063 13.717 -3.395 154 HG2 GLU 39 1HG GLU 39 -1.784 13.216 -1.018 155 HG3 GLU 39 2HG GLU 39 -0.630 14.547 -1.056 156 H TRP 40 H TRP 40 1.326 10.720 -2.636 157 HA TRP 40 HA TRP 40 2.540 10.582 -5.196 158 HB2 TRP 40 1HB TRP 40 3.875 10.562 -3.214 159 HB3 TRP 40 2HB TRP 40 2.965 9.243 -2.507 160 HD1 TRP 40 HD TRP 40 5.848 9.870 -4.884 161 HE1 TRP 40 1HE TRP 40 7.172 7.651 -5.154 162 HE3 TRP 40 3HE TRP 40 2.531 6.652 -2.671 163 HZ2 TRP 40 2HZ TRP 40 6.697 4.914 -4.760 164 HZ3 TRP 40 3HZ TRP 40 2.944 4.229 -2.683 165 HH2 TRP 40 HH TRP 40 5.049 3.317 -3.709 166 H LEU 41 H LEU 41 0.524 8.244 -3.375 167 HA LEU 41 HA LEU 41 1.031 6.115 -5.228 168 HB2 LEU 41 1HB LEU 41 -0.160 4.874 -3.834 169 HB3 LEU 41 2HB LEU 41 -0.235 6.258 -2.838 170 HG LEU 41 HG LEU 41 -2.547 6.760 -3.667 171 HD11 LEU 41 1HD1 LEU 41 -3.828 4.924 -4.758 172 HD12 LEU 41 2HD1 LEU 41 -2.317 4.026 -5.040 173 HD13 LEU 41 3HD1 LEU 41 -2.648 5.557 -5.868 174 HD21 LEU 41 3HD2 LEU 41 -2.103 5.539 -1.617 175 HD22 LEU 41 1HD2 LEU 41 -1.899 4.016 -2.494 176 HD23 LEU 41 2HD2 LEU 41 -3.490 4.779 -2.412 177 H LYS 42 H LYS 42 -1.655 8.471 -5.020 178 HA LYS 42 HA LYS 42 -3.015 7.616 -7.360 179 HB2 LYS 42 1HB LYS 42 -2.946 10.303 -5.935 180 HB3 LYS 42 2HB LYS 42 -4.064 9.895 -7.243 181 HG2 LYS 42 1HG LYS 42 -5.101 8.142 -5.932 182 HG3 LYS 42 2HG LYS 42 -3.895 8.281 -4.659 183 HD2 LYS 42 1HD LYS 42 -5.892 9.370 -3.910 184 HD3 LYS 42 2HD LYS 42 -4.644 10.594 -4.182 185 HE2 LYS 42 1HE LYS 42 -5.683 10.999 -6.484 186 HE3 LYS 42 2HE LYS 42 -6.984 9.904 -6.008 187 HZ1 LYS 42 3HZ LYS 42 -7.474 11.418 -4.174 188 HZ2 LYS 42 1HZ LYS 42 -7.622 12.148 -5.638 189 HZ3 LYS 42 2HZ LYS 42 -6.281 12.444 -4.728 190 H GLN 43 H GLN 43 -0.371 10.119 -7.022 191 HA GLN 43 HA GLN 43 -0.771 11.125 -9.608 192 HB2 GLN 43 1HB GLN 43 1.281 12.238 -9.496 193 HB3 GLN 43 2HB GLN 43 0.431 12.368 -7.925 194 HG2 GLN 43 1HG GLN 43 1.657 10.385 -7.320 195 HG3 GLN 43 2HG GLN 43 2.817 10.658 -8.655 196 HE21 GLN 43 1HE2 GLN 43 4.727 11.349 -7.586 197 HE22 GLN 43 2HE2 GLN 43 4.742 12.743 -6.531 198 H ASN 44 H ASN 44 1.316 8.641 -8.359 199 HA ASN 44 HA ASN 44 2.601 8.072 -10.835 200 HB2 ASN 44 1HB ASN 44 2.362 6.489 -8.270 201 HB3 ASN 44 2HB ASN 44 3.206 5.882 -9.718 202 HD21 ASN 44 1HD2 ASN 44 3.543 7.970 -6.976 203 HD22 ASN 44 2HD2 ASN 44 5.013 8.720 -7.519 204 H ILE 45 H ILE 45 -0.375 6.593 -9.384 205 HA ILE 45 HA ILE 45 -0.729 4.675 -11.453 206 HB ILE 45 HB ILE 45 -2.752 6.253 -9.833 207 HG12 ILE 45 1HG1 ILE 45 -1.377 4.744 -8.469 208 HG13 ILE 45 2HG1 ILE 45 -3.046 4.267 -8.511 209 HG21 ILE 45 1HG2 ILE 45 -3.938 5.630 -11.776 210 HG22 ILE 45 2HG2 ILE 45 -3.155 4.050 -11.857 211 HG23 ILE 45 3HG2 ILE 45 -4.354 4.393 -10.608 212 HD11 ILE 45 3HD1 ILE 45 -1.656 2.303 -8.639 213 HD12 ILE 45 1HD1 ILE 45 -2.444 2.497 -10.207 214 HD13 ILE 45 2HD1 ILE 45 -0.736 2.951 -10.009 215 H ALA 46 H ALA 46 -1.878 8.093 -11.239 216 HA ALA 46 HA ALA 46 -3.003 8.060 -13.835 217 HB1 ALA 46 1HB ALA 46 -3.190 10.465 -13.503 218 HB2 ALA 46 2HB ALA 46 -3.631 9.610 -12.023 219 HB3 ALA 46 3HB ALA 46 -2.038 10.400 -12.130 220 H ALA 47 H ALA 47 0.299 8.579 -12.816 221 HA ALA 47 HA ALA 47 1.274 9.391 -15.445 222 HB1 ALA 47 1HB ALA 47 2.802 8.566 -12.980 223 HB2 ALA 47 2HB ALA 47 3.466 9.374 -14.417 224 HB3 ALA 47 3HB ALA 47 2.325 10.237 -13.357 225 H ASN 48 H ASN 48 0.273 6.496 -14.177 226 HA ASN 48 HA ASN 48 0.705 4.382 -14.362 227 HB2 ASN 48 1HB ASN 48 -0.121 5.164 -16.688 228 HB3 ASN 48 2HB ASN 48 1.517 4.736 -17.224 229 HD21 ASN 48 1HD2 ASN 48 2.199 2.443 -16.259 230 HD22 ASN 48 2HD2 ASN 48 1.009 1.202 -16.697 231 H GLN 49 H GLN 49 2.696 5.689 -13.186 232 HA GLN 49 HA GLN 49 5.347 4.676 -14.151 233 HB2 GLN 49 1HB GLN 49 4.416 6.895 -12.333 234 HB3 GLN 49 2HB GLN 49 5.988 6.285 -12.049 235 HG2 GLN 49 1HG GLN 49 5.133 7.278 -14.786 236 HG3 GLN 49 2HG GLN 49 5.928 8.282 -13.566 237 HE21 GLN 49 1HE2 GLN 49 7.604 5.742 -12.746 238 HE22 GLN 49 2HE2 GLN 49 8.889 5.770 -13.947 239 H LEU 50 H LEU 50 3.106 3.354 -12.191 240 HA LEU 50 HA LEU 50 4.768 3.139 -9.737 241 HB2 LEU 50 1HB LEU 50 2.161 3.960 -10.119 242 HB3 LEU 50 2HB LEU 50 1.902 2.293 -9.721 243 HG LEU 50 HG LEU 50 3.365 4.427 -8.081 244 HD11 LEU 50 1HD1 LEU 50 0.817 2.901 -7.459 245 HD12 LEU 50 2HD1 LEU 50 0.869 4.499 -8.211 246 HD13 LEU 50 3HD1 LEU 50 1.492 4.307 -6.579 247 HD21 LEU 50 3HD2 LEU 50 3.562 2.976 -6.207 248 HD22 LEU 50 1HD2 LEU 50 4.518 2.435 -7.558 249 HD23 LEU 50 2HD2 LEU 50 3.002 1.576 -7.188 250 H VAL 51 H VAL 51 5.443 1.112 -8.915 251 HA VAL 51 HA VAL 51 4.627 -1.298 -10.466 252 HB VAL 51 HB VAL 51 7.357 -0.455 -9.408 253 HG11 VAL 51 1HG1 VAL 51 8.190 -2.595 -10.353 254 HG12 VAL 51 2HG1 VAL 51 7.100 -2.853 -9.000 255 HG13 VAL 51 3HG1 VAL 51 6.519 -3.123 -10.658 256 HG21 VAL 51 3HG2 VAL 51 6.742 0.532 -11.601 257 HG22 VAL 51 1HG2 VAL 51 8.026 -0.677 -11.788 258 HG23 VAL 51 2HG2 VAL 51 6.349 -1.078 -12.230 259 H TYR 52 H TYR 52 3.555 -2.643 -9.300 260 HA TYR 52 HA TYR 52 3.703 -2.866 -6.348 261 HB2 TYR 52 1HB TYR 52 1.476 -3.046 -7.236 262 HB3 TYR 52 2HB TYR 52 2.004 -4.059 -8.573 263 HD1 TYR 52 1HD TYR 52 2.057 -4.210 -4.787 264 HD2 TYR 52 2HD TYR 52 1.293 -6.268 -8.503 265 HE1 TYR 52 1HE TYR 52 1.446 -6.280 -3.557 266 HE2 TYR 52 2HE TYR 52 0.817 -8.347 -7.278 267 HH TYR 52 HH TYR 52 0.740 -9.378 -5.133 268 H GLY 53 H GLY 53 4.552 -4.878 -5.404 269 HA2 GLY 53 1HA GLY 53 5.212 -7.091 -6.990 270 HA3 GLY 53 2HA GLY 53 6.695 -6.190 -6.633 271 H ILE 54 H ILE 54 6.415 -8.741 -5.643 272 HA ILE 54 HA ILE 54 6.010 -8.314 -2.726 273 HB ILE 54 HB ILE 54 6.176 -10.896 -4.317 274 HG12 ILE 54 1HG1 ILE 54 3.980 -9.792 -4.640 275 HG13 ILE 54 2HG1 ILE 54 3.876 -11.314 -3.767 276 HG21 ILE 54 1HG2 ILE 54 5.848 -10.419 -1.325 277 HG22 ILE 54 2HG2 ILE 54 5.462 -11.948 -2.105 278 HG23 ILE 54 3HG2 ILE 54 7.132 -11.317 -2.130 279 HD11 ILE 54 3HD1 ILE 54 3.685 -10.010 -1.593 280 HD12 ILE 54 1HD1 ILE 54 3.596 -8.538 -2.600 281 HD13 ILE 54 2HD1 ILE 54 2.359 -9.793 -2.736 282 H VAL 55 H VAL 55 7.742 -8.590 -1.423 283 HA VAL 55 HA VAL 55 10.114 -7.642 -2.157 284 HB VAL 55 HB VAL 55 9.221 -9.303 0.197 285 HG11 VAL 55 1HG1 VAL 55 12.026 -8.247 -0.270 286 HG12 VAL 55 2HG1 VAL 55 11.347 -8.465 1.366 287 HG13 VAL 55 3HG1 VAL 55 11.543 -9.852 0.297 288 HG21 VAL 55 3HG2 VAL 55 9.482 -7.057 1.279 289 HG22 VAL 55 1HG2 VAL 55 10.100 -6.411 -0.251 290 HG23 VAL 55 2HG2 VAL 55 8.429 -6.938 -0.130 291 H LYS 56 H LYS 56 9.992 -11.234 -1.520 292 HA LYS 56 HA LYS 56 11.543 -12.806 -1.869 293 HB2 LYS 56 1HB LYS 56 11.227 -11.379 -4.511 294 HB3 LYS 56 2HB LYS 56 12.423 -12.640 -4.404 295 HG2 LYS 56 1HG LYS 56 10.096 -13.234 -5.166 296 HG3 LYS 56 2HG LYS 56 10.785 -14.274 -3.986 297 HD2 LYS 56 1HD LYS 56 9.394 -13.284 -2.243 298 HD3 LYS 56 2HD LYS 56 8.773 -12.095 -3.457 299 HE2 LYS 56 1HE LYS 56 7.684 -13.885 -4.679 300 HE3 LYS 56 2HE LYS 56 8.531 -15.110 -3.735 301 HZ1 LYS 56 3HZ LYS 56 6.310 -14.943 -2.967 302 HZ2 LYS 56 1HZ LYS 56 6.389 -13.346 -2.732 303 HZ3 LYS 56 2HZ LYS 56 7.292 -14.328 -1.772 304 HA PRO 57 HA PRO 57 15.682 -11.630 -1.045 305 HB2 PRO 57 1HB PRO 57 17.236 -13.621 -2.061 306 HB3 PRO 57 2HB PRO 57 16.163 -13.837 -0.674 307 HG2 PRO 57 1HG PRO 57 15.591 -14.497 -3.574 308 HG3 PRO 57 2HG PRO 57 15.362 -15.542 -2.132 309 HD2 PRO 57 1HD PRO 57 13.318 -14.151 -3.216 310 HD3 PRO 57 2HD PRO 57 13.449 -14.314 -1.450 311 H SER 58 H SER 58 14.492 -11.383 -4.207 312 HA SER 58 HA SER 58 16.666 -11.232 -5.861 313 HB2 SER 58 1HB SER 58 14.877 -9.610 -7.071 314 HB3 SER 58 2HB SER 58 14.668 -11.362 -7.013 315 HG SER 58 HG SER 58 12.818 -10.032 -6.312 316 H ASP 59 H ASP 59 14.869 -8.395 -4.656 317 HA ASP 59 HA ASP 59 17.160 -6.655 -5.278 318 HB2 ASP 59 1HB ASP 59 14.253 -6.344 -4.729 319 HB3 ASP 59 2HB ASP 59 15.252 -5.090 -4.012 320 H THR 60 H THR 60 17.719 -4.953 -3.506 321 HA THR 60 HA THR 60 18.391 -6.232 -0.998 322 HB THR 60 HB THR 60 19.636 -4.328 -2.112 323 HG1 THR 60 1HG THR 60 20.014 -3.353 -0.031 324 HG21 THR 60 3HG2 THR 60 17.510 -2.595 -0.767 325 HG22 THR 60 1HG2 THR 60 17.560 -2.899 -2.519 326 HG23 THR 60 2HG2 THR 60 18.894 -2.057 -1.730 327 H VAL 61 H VAL 61 17.307 -6.041 0.958 328 HA VAL 61 HA VAL 61 15.150 -4.183 1.279 329 HB VAL 61 HB VAL 61 13.662 -6.089 2.276 330 HG11 VAL 61 1HG1 VAL 61 13.637 -5.868 -0.740 331 HG12 VAL 61 2HG1 VAL 61 12.291 -6.154 0.374 332 HG13 VAL 61 3HG1 VAL 61 13.079 -4.585 0.349 333 HG21 VAL 61 3HG2 VAL 61 15.399 -7.892 1.815 334 HG22 VAL 61 1HG2 VAL 61 13.764 -8.257 1.267 335 HG23 VAL 61 2HG2 VAL 61 14.994 -7.724 0.099 336 HA PRO 62 HA PRO 62 16.473 -4.662 5.556 337 HB2 PRO 62 1HB PRO 62 14.205 -3.802 6.857 338 HB3 PRO 62 2HB PRO 62 15.310 -2.701 5.967 339 HG2 PRO 62 1HG PRO 62 12.700 -3.891 5.055 340 HG3 PRO 62 2HG PRO 62 13.293 -2.194 4.877 341 HD2 PRO 62 1HD PRO 62 13.420 -4.072 2.909 342 HD3 PRO 62 2HD PRO 62 14.615 -2.779 3.048 343 H ALA 63 H ALA 63 15.356 -5.668 7.677 344 HA ALA 63 HA ALA 63 14.775 -8.443 7.009 345 HB1 ALA 63 1HB ALA 63 16.218 -7.645 8.919 346 HB2 ALA 63 2HB ALA 63 14.742 -7.052 9.721 347 HB3 ALA 63 3HB ALA 63 14.945 -8.785 9.386 348 H GLY 64 H GLY 64 12.953 -9.581 8.170 349 HA2 GLY 64 1HA GLY 64 10.852 -9.883 8.931 350 HA3 GLY 64 2HA GLY 64 10.852 -8.186 9.386 351 H VAL 65 H VAL 65 11.269 -8.839 5.973 352 HA VAL 65 HA VAL 65 8.406 -8.261 5.459 353 HB VAL 65 HB VAL 65 9.134 -6.693 3.667 354 HG11 VAL 65 1HG1 VAL 65 9.932 -5.851 6.468 355 HG12 VAL 65 2HG1 VAL 65 9.450 -4.800 5.122 356 HG13 VAL 65 3HG1 VAL 65 8.276 -5.924 5.827 357 HG21 VAL 65 3HG2 VAL 65 11.321 -5.692 3.668 358 HG22 VAL 65 1HG2 VAL 65 11.832 -6.602 5.092 359 HG23 VAL 65 2HG2 VAL 65 11.570 -7.436 3.542 360 H ASP 66 H ASP 66 10.149 -10.788 5.216 361 HA ASP 66 HA ASP 66 11.060 -11.386 2.817 362 HB2 ASP 66 1HB ASP 66 9.423 -13.151 4.705 363 HB3 ASP 66 2HB ASP 66 10.255 -13.824 3.327 364 H ASP 67 H ASP 67 7.841 -11.023 3.178 365 HA ASP 67 HA ASP 67 7.144 -11.952 0.470 366 HB2 ASP 67 1HB ASP 67 6.901 -13.974 1.951 367 HB3 ASP 67 2HB ASP 67 5.762 -13.089 2.944 368 H TYR 68 H TYR 68 7.300 -9.462 2.138 369 HA TYR 68 HA TYR 68 4.541 -8.483 2.385 370 HB2 TYR 68 1HB TYR 68 7.265 -7.221 2.712 371 HB3 TYR 68 2HB TYR 68 5.806 -6.267 2.577 372 HD1 TYR 68 1HD TYR 68 6.098 -9.534 4.495 373 HD2 TYR 68 2HD TYR 68 5.481 -5.261 4.653 374 HE1 TYR 68 1HE TYR 68 5.317 -9.752 6.733 375 HE2 TYR 68 2HE TYR 68 4.834 -5.462 7.029 376 HH TYR 68 HH TYR 68 4.822 -8.660 8.684 377 H SER 69 H SER 69 3.702 -6.991 0.974 378 HA SER 69 HA SER 69 4.706 -6.900 -1.781 379 HB2 SER 69 1HB SER 69 2.374 -6.761 -1.611 380 HB3 SER 69 2HB SER 69 2.432 -5.623 -0.249 381 HG SER 69 HG SER 69 1.921 -4.467 -2.001 382 H TYR 70 H TYR 70 5.231 -4.865 -2.587 383 HA TYR 70 HA TYR 70 5.767 -2.709 -0.777 384 HB2 TYR 70 1HB TYR 70 7.973 -2.158 -1.421 385 HB3 TYR 70 2HB TYR 70 7.966 -3.765 -0.757 386 HD1 TYR 70 1HD TYR 70 7.899 -5.781 -2.514 387 HD2 TYR 70 2HD TYR 70 8.946 -1.718 -3.534 388 HE1 TYR 70 1HE TYR 70 9.141 -6.586 -4.513 389 HE2 TYR 70 2HE TYR 70 10.218 -2.524 -5.466 390 HH TYR 70 HH TYR 70 11.388 -4.472 -6.143 391 H LEU 71 H LEU 71 5.437 -0.738 -1.733 392 HA LEU 71 HA LEU 71 4.839 -0.722 -4.662 393 HB2 LEU 71 1HB LEU 71 3.885 1.298 -2.591 394 HB3 LEU 71 2HB LEU 71 3.471 1.180 -4.287 395 HG LEU 71 HG LEU 71 1.592 0.409 -3.376 396 HD11 LEU 71 1HD1 LEU 71 1.264 -1.931 -3.653 397 HD12 LEU 71 2HD1 LEU 71 2.979 -2.274 -3.429 398 HD13 LEU 71 3HD1 LEU 71 2.429 -1.384 -4.865 399 HD21 LEU 71 3HD2 LEU 71 2.158 0.639 -1.104 400 HD22 LEU 71 1HD2 LEU 71 2.981 -0.955 -1.109 401 HD23 LEU 71 2HD2 LEU 71 1.220 -0.826 -1.401 402 H VAL 72 H VAL 72 6.174 0.567 -5.867 403 HA VAL 72 HA VAL 72 7.424 2.918 -4.759 404 HB VAL 72 HB VAL 72 8.973 1.145 -4.041 405 HG11 VAL 72 1HG1 VAL 72 8.538 -0.593 -5.686 406 HG12 VAL 72 2HG1 VAL 72 9.242 0.412 -6.956 407 HG13 VAL 72 3HG1 VAL 72 10.260 -0.173 -5.623 408 HG21 VAL 72 3HG2 VAL 72 10.263 2.655 -6.318 409 HG22 VAL 72 1HG2 VAL 72 9.767 3.437 -4.816 410 HG23 VAL 72 2HG2 VAL 72 10.962 2.142 -4.758 411 H ALA 73 H ALA 73 8.133 4.338 -6.661 412 HA ALA 73 HA ALA 73 6.674 3.617 -9.103 413 HB1 ALA 73 1HB ALA 73 6.789 5.970 -8.176 414 HB2 ALA 73 2HB ALA 73 8.504 5.991 -8.633 415 HB3 ALA 73 3HB ALA 73 7.253 5.798 -9.875 416 H ALA 74 H ALA 74 7.950 3.896 -11.222 417 HA ALA 74 HA ALA 74 10.087 1.921 -11.105 418 HB1 ALA 74 1HB ALA 74 10.232 2.174 -13.553 419 HB2 ALA 74 2HB ALA 74 8.544 1.992 -13.035 420 HB3 ALA 74 3HB ALA 74 9.177 3.598 -13.476 421 H ASP 75 H ASP 75 9.995 5.323 -11.188 422 HA ASP 75 HA ASP 75 12.863 5.689 -11.660 423 HB2 ASP 75 1HB ASP 75 12.272 8.087 -11.685 424 HB3 ASP 75 2HB ASP 75 11.321 7.185 -12.840 425 H ASP 76 H ASP 76 10.472 5.937 -9.012 426 HA ASP 76 HA ASP 76 12.524 7.289 -7.416 427 HB2 ASP 76 1HB ASP 76 11.010 8.362 -6.336 428 HB3 ASP 76 2HB ASP 76 9.949 7.905 -7.612 429 H GLN 77 H GLN 77 12.976 4.568 -8.093 430 HA GLN 77 HA GLN 77 12.519 2.650 -6.166 431 HB2 GLN 77 1HB GLN 77 15.087 3.070 -7.705 432 HB3 GLN 77 2HB GLN 77 14.742 1.648 -6.701 433 HG2 GLN 77 1HG GLN 77 12.680 1.280 -8.069 434 HG3 GLN 77 2HG GLN 77 13.185 2.553 -9.156 435 HE21 GLN 77 1HE2 GLN 77 13.514 -0.813 -8.404 436 HE22 GLN 77 2HE2 GLN 77 14.741 -1.179 -9.606 437 H ASP 78 H ASP 78 15.264 4.957 -5.995 438 HA ASP 78 HA ASP 78 15.858 4.134 -3.242 439 HB2 ASP 78 1HB ASP 78 17.819 5.453 -3.443 440 HB3 ASP 78 2HB ASP 78 17.646 4.515 -4.932 441 H GLY 79 H GLY 79 13.415 5.924 -4.315 442 HA2 GLY 79 1HA GLY 79 13.692 8.333 -2.644 443 HA3 GLY 79 2HA GLY 79 12.454 7.979 -3.862 444 H THR 80 H THR 80 10.517 6.998 -3.206 445 HA THR 80 HA THR 80 10.096 6.705 -0.293 446 HB THR 80 HB THR 80 8.115 6.798 -2.602 447 HG1 THR 80 1HG THR 80 9.044 8.773 -2.485 448 HG21 THR 80 3HG2 THR 80 6.493 7.453 -0.826 449 HG22 THR 80 1HG2 THR 80 7.719 7.085 0.414 450 HG23 THR 80 2HG2 THR 80 7.076 5.801 -0.644 451 H ILE 81 H ILE 81 9.038 4.652 0.495 452 HA ILE 81 HA ILE 81 8.202 2.800 -1.460 453 HB ILE 81 HB ILE 81 10.510 2.044 -1.491 454 HG12 ILE 81 1HG1 ILE 81 9.204 -0.082 0.218 455 HG13 ILE 81 2HG1 ILE 81 8.480 0.341 -1.316 456 HG21 ILE 81 1HG2 ILE 81 11.682 1.123 0.472 457 HG22 ILE 81 2HG2 ILE 81 11.304 2.818 0.716 458 HG23 ILE 81 3HG2 ILE 81 10.310 1.569 1.504 459 HD11 ILE 81 3HD1 ILE 81 11.428 -0.480 -0.986 460 HD12 ILE 81 1HD1 ILE 81 10.141 -1.569 -1.464 461 HD13 ILE 81 2HD1 ILE 81 10.571 -0.199 -2.512 462 H ILE 82 H ILE 82 6.655 1.393 -0.615 463 HA ILE 82 HA ILE 82 6.099 1.633 2.292 464 HB ILE 82 HB ILE 82 3.992 1.540 0.105 465 HG12 ILE 82 1HG1 ILE 82 4.713 4.102 1.617 466 HG13 ILE 82 2HG1 ILE 82 5.197 3.723 -0.037 467 HG21 ILE 82 1HG2 ILE 82 2.397 2.060 1.934 468 HG22 ILE 82 2HG2 ILE 82 3.287 0.586 2.265 469 HG23 ILE 82 3HG2 ILE 82 3.734 2.085 3.097 470 HD11 ILE 82 3HD1 ILE 82 2.788 3.439 -0.641 471 HD12 ILE 82 1HD1 ILE 82 2.361 4.045 0.967 472 HD13 ILE 82 2HD1 ILE 82 3.262 5.081 -0.159 473 H PHE 83 H PHE 83 6.377 -0.392 3.164 474 HA PHE 83 HA PHE 83 5.937 -2.773 1.481 475 HB2 PHE 83 1HB PHE 83 7.131 -2.372 4.251 476 HB3 PHE 83 2HB PHE 83 6.910 -3.918 3.567 477 HD1 PHE 83 2HD PHE 83 8.311 -4.643 1.585 478 HD2 PHE 83 1HD PHE 83 8.885 -0.830 3.526 479 HE1 PHE 83 2HE PHE 83 10.543 -4.403 0.503 480 HE2 PHE 83 1HE PHE 83 11.137 -0.637 2.455 481 HZ PHE 83 HZ PHE 83 11.940 -2.429 0.953 482 H PHE 84 H PHE 84 4.198 -4.277 2.028 483 HA PHE 84 HA PHE 84 2.834 -3.887 4.568 484 HB2 PHE 84 1HB PHE 84 0.629 -3.563 3.802 485 HB3 PHE 84 2HB PHE 84 1.591 -2.347 2.991 486 HD1 PHE 84 2HD PHE 84 -0.257 -5.570 2.557 487 HD2 PHE 84 1HD PHE 84 1.732 -2.292 0.538 488 HE1 PHE 84 2HE PHE 84 -1.121 -6.375 0.381 489 HE2 PHE 84 1HE PHE 84 0.774 -3.068 -1.604 490 HZ PHE 84 HZ PHE 84 -0.571 -5.146 -1.704 491 H LYS 85 H LYS 85 1.412 -5.731 5.144 492 HA LYS 85 HA LYS 85 1.279 -8.001 3.267 493 HB2 LYS 85 1HB LYS 85 3.292 -7.933 5.133 494 HB3 LYS 85 2HB LYS 85 2.086 -8.921 5.926 495 HG2 LYS 85 1HG LYS 85 2.535 -9.561 3.003 496 HG3 LYS 85 2HG LYS 85 3.936 -9.756 4.021 497 HD2 LYS 85 1HD LYS 85 2.701 -11.158 5.544 498 HD3 LYS 85 2HD LYS 85 1.304 -11.092 4.489 499 HE2 LYS 85 1HE LYS 85 2.678 -11.927 2.578 500 HE3 LYS 85 2HE LYS 85 4.099 -11.942 3.602 501 HZ1 LYS 85 3HZ LYS 85 3.109 -13.737 4.880 502 HZ2 LYS 85 1HZ LYS 85 3.258 -14.068 3.272 503 HZ3 LYS 85 2HZ LYS 85 1.777 -13.750 3.851 504 H ALA 86 H ALA 86 -0.709 -8.881 3.364 505 HA ALA 86 HA ALA 86 -2.505 -7.916 5.521 506 HB1 ALA 86 1HB ALA 86 -3.183 -9.022 2.775 507 HB2 ALA 86 2HB ALA 86 -4.292 -8.273 3.943 508 HB3 ALA 86 3HB ALA 86 -3.021 -7.302 3.158 509 H GLU 87 H GLU 87 -2.984 -9.294 7.070 510 HA GLU 87 HA GLU 87 -2.699 -12.206 6.690 511 HB2 GLU 87 1HB GLU 87 -1.239 -10.233 8.287 512 HB3 GLU 87 2HB GLU 87 -2.013 -11.390 9.344 513 HG2 GLU 87 1HG GLU 87 -0.280 -12.189 6.961 514 HG3 GLU 87 2HG GLU 87 0.310 -11.988 8.623 515 H GLY 88 H GLY 88 -4.774 -12.863 6.680 516 HA2 GLY 88 1HA GLY 88 -6.821 -13.490 7.462 517 HA3 GLY 88 2HA GLY 88 -6.209 -13.055 9.062 518 H GLN 89 H GLN 89 -6.508 -10.896 9.792 519 HA GLN 89 HA GLN 89 -8.579 -9.202 8.532 520 HB2 GLN 89 1HB GLN 89 -8.785 -10.339 11.350 521 HB3 GLN 89 2HB GLN 89 -9.591 -8.854 10.857 522 HG2 GLN 89 1HG GLN 89 -10.596 -10.258 8.913 523 HG3 GLN 89 2HG GLN 89 -10.169 -11.648 9.917 524 HE21 GLN 89 1HE2 GLN 89 -12.183 -8.607 9.763 525 HE22 GLN 89 2HE2 GLN 89 -13.221 -9.107 11.067 526 H THR 90 H THR 90 -5.552 -9.136 8.971 527 HA THR 90 HA THR 90 -5.369 -6.519 10.299 528 HB THR 90 HB THR 90 -3.231 -8.589 10.768 529 HG1 THR 90 1HG THR 90 -4.922 -9.724 11.491 530 HG21 THR 90 3HG2 THR 90 -2.877 -6.237 11.491 531 HG22 THR 90 1HG2 THR 90 -2.938 -7.347 12.873 532 HG23 THR 90 2HG2 THR 90 -4.344 -6.332 12.495 533 H VAL 91 H VAL 91 -3.677 -5.168 9.335 534 HA VAL 91 HA VAL 91 -1.973 -6.425 7.282 535 HB VAL 91 HB VAL 91 -3.367 -3.763 6.843 536 HG11 VAL 91 1HG1 VAL 91 -1.037 -3.640 6.065 537 HG12 VAL 91 2HG1 VAL 91 -1.269 -5.118 5.112 538 HG13 VAL 91 3HG1 VAL 91 -2.168 -3.640 4.712 539 HG21 VAL 91 3HG2 VAL 91 -4.172 -6.399 6.017 540 HG22 VAL 91 1HG2 VAL 91 -4.852 -4.824 5.526 541 HG23 VAL 91 2HG2 VAL 91 -3.556 -5.579 4.602 542 H ILE 92 H ILE 92 0.045 -6.058 7.758 543 HA ILE 92 HA ILE 92 0.791 -4.045 9.774 544 HB ILE 92 HB ILE 92 2.473 -6.247 8.491 545 HG12 ILE 92 1HG1 ILE 92 2.217 -7.419 10.697 546 HG13 ILE 92 2HG1 ILE 92 0.868 -6.370 11.096 547 HG21 ILE 92 1HG2 ILE 92 3.901 -5.862 10.475 548 HG22 ILE 92 2HG2 ILE 92 3.676 -4.350 9.577 549 HG23 ILE 92 3HG2 ILE 92 2.754 -4.638 11.060 550 HD11 ILE 92 3HD1 ILE 92 0.880 -8.113 8.596 551 HD12 ILE 92 1HD1 ILE 92 0.415 -8.757 10.177 552 HD13 ILE 92 2HD1 ILE 92 -0.524 -7.443 9.483 553 H ILE 93 H ILE 93 0.969 -2.099 8.755 554 HA ILE 93 HA ILE 93 2.133 -1.971 6.025 555 HB ILE 93 HB ILE 93 1.078 0.446 7.490 556 HG12 ILE 93 1HG1 ILE 93 -0.699 -1.380 5.820 557 HG13 ILE 93 2HG1 ILE 93 -0.816 -1.228 7.581 558 HG21 ILE 93 1HG2 ILE 93 1.260 -0.364 4.547 559 HG22 ILE 93 2HG2 ILE 93 0.762 1.217 5.143 560 HG23 ILE 93 3HG2 ILE 93 2.419 0.671 5.395 561 HD11 ILE 93 3HD1 ILE 93 -1.334 1.179 7.365 562 HD12 ILE 93 1HD1 ILE 93 -1.365 1.001 5.598 563 HD13 ILE 93 2HD1 ILE 93 -2.524 0.115 6.584 564 H LYS 94 H LYS 94 4.266 -1.526 5.858 565 HA LYS 94 HA LYS 94 5.799 -0.409 8.181 566 HB2 LYS 94 1HB LYS 94 6.448 -2.677 6.288 567 HB3 LYS 94 2HB LYS 94 7.641 -1.934 7.259 568 HG2 LYS 94 1HG LYS 94 6.288 -2.527 9.330 569 HG3 LYS 94 2HG LYS 94 5.205 -3.433 8.258 570 HD2 LYS 94 1HD LYS 94 7.188 -4.793 7.504 571 HD3 LYS 94 2HD LYS 94 8.184 -3.933 8.682 572 HE2 LYS 94 1HE LYS 94 6.761 -4.794 10.524 573 HE3 LYS 94 2HE LYS 94 5.720 -5.614 9.348 574 HZ1 LYS 94 3HZ LYS 94 7.303 -7.139 10.330 575 HZ2 LYS 94 1HZ LYS 94 8.584 -6.238 9.756 576 HZ3 LYS 94 2HZ LYS 94 7.596 -7.006 8.731 577 H TYR 95 H TYR 95 5.974 1.750 7.410 578 HA TYR 95 HA TYR 95 6.890 2.069 4.561 579 HB2 TYR 95 1HB TYR 95 5.804 4.266 4.616 580 HB3 TYR 95 2HB TYR 95 4.709 2.910 4.843 581 HD1 TYR 95 2HD TYR 95 6.436 5.696 6.707 582 HD2 TYR 95 1HD TYR 95 3.313 2.722 6.671 583 HE1 TYR 95 2HE TYR 95 5.528 6.647 8.797 584 HE2 TYR 95 1HE TYR 95 2.430 3.634 8.810 585 HH TYR 95 HH TYR 95 3.738 6.589 10.359 586 H THR 96 H THR 96 8.092 4.138 4.164 587 HA THR 96 HA THR 96 9.631 5.303 6.299 588 HB THR 96 HB THR 96 10.830 3.204 6.019 589 HG1 THR 96 1HG THR 96 12.825 4.198 5.679 590 HG21 THR 96 3HG2 THR 96 10.236 2.720 3.624 591 HG22 THR 96 1HG2 THR 96 11.963 2.605 3.968 592 HG23 THR 96 2HG2 THR 96 11.319 4.031 3.142 593 H SER 97 H SER 97 11.282 6.723 5.095 594 HA SER 97 HA SER 97 10.192 7.887 2.599 595 HB2 SER 97 1HB SER 97 11.206 10.071 3.634 596 HB3 SER 97 2HB SER 97 9.605 9.533 4.109 597 HG SER 97 HG SER 97 11.867 9.789 5.567 598 H GLN 98 H GLN 98 12.551 6.032 3.875 599 HA GLN 98 HA GLN 98 14.163 6.697 1.530 600 HB2 GLN 98 1HB GLN 98 15.411 6.668 4.303 601 HB3 GLN 98 2HB GLN 98 16.313 6.210 2.853 602 HG2 GLN 98 1HG GLN 98 15.451 8.482 1.874 603 HG3 GLN 98 2HG GLN 98 15.195 8.921 3.570 604 HE21 GLN 98 1HE2 GLN 98 17.450 8.656 1.007 605 HE22 GLN 98 2HE2 GLN 98 18.938 8.534 1.942 606 H ARG 99 H ARG 99 14.635 4.983 0.465 607 HA ARG 99 HA ARG 99 13.853 2.321 1.053 608 HB2 ARG 99 1HB ARG 99 14.221 3.696 -1.188 609 HB3 ARG 99 2HB ARG 99 15.839 3.010 -1.065 610 HG2 ARG 99 1HG ARG 99 14.040 0.835 -0.589 611 HG3 ARG 99 2HG ARG 99 13.276 1.794 -1.855 612 HD2 ARG 99 1HD ARG 99 15.784 1.758 -2.828 613 HD3 ARG 99 2HD ARG 99 15.872 0.317 -1.796 614 HE ARG 99 HE ARG 99 13.595 0.370 -3.637 615 HH11 ARG 99 1HH1 ARG 99 17.084 -0.104 -3.596 616 HH12 ARG 99 2HH1 ARG 99 17.151 -1.055 -5.032 617 HH21 ARG 99 1HH2 ARG 99 13.640 -1.043 -5.624 618 HH22 ARG 99 2HH2 ARG 99 15.134 -1.787 -6.002 619 H ASN 100 H ASN 100 16.440 3.934 2.328 620 HA ASN 100 HA ASN 100 18.085 1.482 2.618 621 HB2 ASN 100 1HB ASN 100 19.191 4.274 2.279 622 HB3 ASN 100 2HB ASN 100 20.117 2.843 2.734 623 HD21 ASN 100 1HD2 ASN 100 18.080 4.176 0.189 624 HD22 ASN 100 2HD2 ASN 100 18.556 3.025 -1.072 625 H THR 101 H THR 101 15.889 2.339 4.379 626 HA THR 101 HA THR 101 17.488 2.660 6.876 627 HB THR 101 HB THR 101 15.761 4.169 7.827 628 HG1 THR 101 1HG THR 101 14.861 4.239 5.137 629 HG21 THR 101 3HG2 THR 101 17.171 5.319 5.395 630 HG22 THR 101 1HG2 THR 101 17.846 5.118 7.031 631 HG23 THR 101 2HG2 THR 101 16.490 6.216 6.764 632 H LYS 102 H LYS 102 15.292 2.626 8.682 633 HA LYS 102 HA LYS 102 14.250 -0.130 8.364 634 HB2 LYS 102 1HB LYS 102 15.763 0.260 10.302 635 HB3 LYS 102 2HB LYS 102 14.688 1.515 10.906 636 HG2 LYS 102 1HG LYS 102 13.376 -1.106 10.335 637 HG3 LYS 102 2HG LYS 102 14.613 -1.187 11.573 638 HD2 LYS 102 1HD LYS 102 13.491 0.288 13.030 639 HD3 LYS 102 2HD LYS 102 12.486 0.950 11.735 640 HE2 LYS 102 1HE LYS 102 11.460 -1.349 11.446 641 HE3 LYS 102 2HE LYS 102 12.343 -1.875 12.892 642 HZ1 LYS 102 3HZ LYS 102 10.302 0.258 12.752 643 HZ2 LYS 102 1HZ LYS 102 11.094 -0.189 14.144 644 HZ3 LYS 102 2HZ LYS 102 10.071 -1.223 13.377 645 H LEU 103 H LEU 103 11.965 -0.375 8.977 646 HA LEU 103 HA LEU 103 10.415 1.904 7.917 647 HB2 LEU 103 1HB LEU 103 9.569 -0.937 8.676 648 HB3 LEU 103 2HB LEU 103 8.580 0.181 7.787 649 HG LEU 103 HG LEU 103 9.256 -1.136 6.096 650 HD11 LEU 103 1HD1 LEU 103 11.534 0.876 6.057 651 HD12 LEU 103 2HD1 LEU 103 9.866 1.120 5.462 652 HD13 LEU 103 3HD1 LEU 103 10.929 -0.071 4.701 653 HD21 LEU 103 3HD2 LEU 103 12.121 -1.420 7.029 654 HD22 LEU 103 1HD2 LEU 103 11.194 -2.350 5.829 655 HD23 LEU 103 2HD2 LEU 103 10.809 -2.511 7.533 656 H LYS 104 H LYS 104 8.432 2.568 8.853 657 HA LYS 104 HA LYS 104 8.247 2.696 11.746 658 HB2 LYS 104 1HB LYS 104 6.706 3.685 9.342 659 HB3 LYS 104 2HB LYS 104 5.866 3.548 10.866 660 HG2 LYS 104 1HG LYS 104 6.645 5.788 10.690 661 HG3 LYS 104 2HG LYS 104 7.555 4.993 11.966 662 HD2 LYS 104 1HD LYS 104 9.489 4.763 10.622 663 HD3 LYS 104 2HD LYS 104 8.626 5.246 9.163 664 HE2 LYS 104 1HE LYS 104 8.184 7.508 10.375 665 HE3 LYS 104 2HE LYS 104 9.302 6.939 11.627 666 HZ1 LYS 104 3HZ LYS 104 9.897 7.541 8.803 667 HZ2 LYS 104 1HZ LYS 104 10.919 6.647 9.744 668 HZ3 LYS 104 2HZ LYS 104 10.588 8.198 10.151 669 H ALA 105 H ALA 105 5.681 2.087 12.325 670 HA ALA 105 HA ALA 105 5.117 -0.643 11.408 671 HB1 ALA 105 1HB ALA 105 6.645 -1.088 13.254 672 HB2 ALA 105 2HB ALA 105 5.776 0.047 14.311 673 HB3 ALA 105 3HB ALA 105 4.988 -1.442 13.793 674 H LYS 106 H LYS 106 3.134 0.064 10.572 675 HA LYS 106 HA LYS 106 1.141 0.795 12.682 676 HB2 LYS 106 1HB LYS 106 1.094 1.087 9.659 677 HB3 LYS 106 2HB LYS 106 -0.370 0.768 10.555 678 HG2 LYS 106 1HG LYS 106 0.443 2.907 11.999 679 HG3 LYS 106 2HG LYS 106 1.265 3.270 10.489 680 HD2 LYS 106 1HD LYS 106 -1.020 2.688 9.377 681 HD3 LYS 106 2HD LYS 106 -1.684 2.863 11.004 682 HE2 LYS 106 1HE LYS 106 -0.131 5.043 9.532 683 HE3 LYS 106 2HE LYS 106 -1.880 4.812 9.380 684 HZ1 LYS 106 3HZ LYS 106 -1.418 6.485 10.950 685 HZ2 LYS 106 1HZ LYS 106 -0.537 5.512 11.913 686 HZ3 LYS 106 2HZ LYS 106 -2.159 5.222 11.675 687 H ALA 107 H ALA 107 -0.722 -0.681 12.740 688 HA ALA 107 HA ALA 107 -0.698 -3.086 11.113 689 HB1 ALA 107 1HB ALA 107 -0.256 -3.253 14.110 690 HB2 ALA 107 2HB ALA 107 -0.796 -4.612 13.078 691 HB3 ALA 107 3HB ALA 107 0.798 -3.880 12.823 692 H LEU 108 H LEU 108 -2.719 -2.392 10.382 693 HA LEU 108 HA LEU 108 -4.839 -1.648 12.384 694 HB2 LEU 108 1HB LEU 108 -4.709 -1.348 9.337 695 HB3 LEU 108 2HB LEU 108 -6.124 -0.993 10.307 696 HG LEU 108 HG LEU 108 -5.325 1.073 9.911 697 HD11 LEU 108 1HD1 LEU 108 -5.618 0.837 12.368 698 HD12 LEU 108 2HD1 LEU 108 -4.356 2.010 11.967 699 HD13 LEU 108 3HD1 LEU 108 -3.896 0.414 12.545 700 HD21 LEU 108 3HD2 LEU 108 -3.176 0.204 8.888 701 HD22 LEU 108 1HD2 LEU 108 -2.471 0.311 10.518 702 HD23 LEU 108 2HD2 LEU 108 -3.118 1.764 9.697 703 H THR 109 H THR 109 -7.005 -2.608 12.020 704 HA THR 109 HA THR 109 -6.883 -5.327 10.938 705 HB THR 109 HB THR 109 -9.352 -5.353 11.547 706 HG1 THR 109 1HG THR 109 -8.746 -2.894 12.787 707 HG21 THR 109 3HG2 THR 109 -7.534 -6.178 13.083 708 HG22 THR 109 1HG2 THR 109 -8.929 -5.547 13.956 709 HG23 THR 109 2HG2 THR 109 -7.453 -4.569 13.822 710 H LEU 110 H LEU 110 -8.330 -6.142 9.244 711 HA LEU 110 HA LEU 110 -8.666 -4.635 6.920 712 HB2 LEU 110 1HB LEU 110 -10.163 -6.998 8.117 713 HB3 LEU 110 2HB LEU 110 -10.751 -6.245 6.663 714 HG LEU 110 HG LEU 110 -8.074 -7.614 6.955 715 HD11 LEU 110 1HD1 LEU 110 -10.514 -8.346 5.305 716 HD12 LEU 110 2HD1 LEU 110 -10.094 -9.048 6.883 717 HD13 LEU 110 3HD1 LEU 110 -9.005 -9.275 5.496 718 HD21 LEU 110 3HD2 LEU 110 -7.843 -5.780 5.285 719 HD22 LEU 110 1HD2 LEU 110 -9.346 -6.296 4.494 720 HD23 LEU 110 2HD2 LEU 110 -7.905 -7.337 4.465 721 H SER 111 H SER 111 -10.857 -5.040 9.674 722 HA SER 111 HA SER 111 -13.031 -3.647 8.563 723 HB2 SER 111 1HB SER 111 -12.744 -5.200 10.687 724 HB3 SER 111 2HB SER 111 -12.553 -3.669 11.540 725 HG SER 111 HG SER 111 -14.629 -3.117 10.919 726 H GLN 112 H GLN 112 -10.271 -2.368 10.545 727 HA GLN 112 HA GLN 112 -11.030 0.321 10.628 728 HB2 GLN 112 1HB GLN 112 -8.470 -1.202 10.753 729 HB3 GLN 112 2HB GLN 112 -8.312 0.427 10.094 730 HG2 GLN 112 1HG GLN 112 -8.072 1.058 12.213 731 HG3 GLN 112 2HG GLN 112 -9.824 1.016 12.244 732 HE21 GLN 112 1HE2 GLN 112 -10.465 0.119 14.122 733 HE22 GLN 112 2HE2 GLN 112 -9.672 -1.211 14.974 734 H LEU 113 H LEU 113 -8.958 -1.217 8.088 735 HA LEU 113 HA LEU 113 -8.811 1.015 6.355 736 HB2 LEU 113 1HB LEU 113 -8.818 -1.945 5.650 737 HB3 LEU 113 2HB LEU 113 -8.370 -0.640 4.562 738 HG LEU 113 HG LEU 113 -6.886 -1.299 7.119 739 HD11 LEU 113 1HD1 LEU 113 -5.177 -2.227 5.588 740 HD12 LEU 113 2HD1 LEU 113 -6.213 -1.889 4.192 741 HD13 LEU 113 3HD1 LEU 113 -6.721 -3.076 5.407 742 HD21 LEU 113 3HD2 LEU 113 -6.226 0.642 4.855 743 HD22 LEU 113 1HD2 LEU 113 -5.114 0.172 6.153 744 HD23 LEU 113 2HD2 LEU 113 -6.586 1.066 6.541 745 H LYS 114 H LYS 114 -11.508 -1.278 6.713 746 HA LYS 114 HA LYS 114 -12.682 -0.730 4.138 747 HB2 LYS 114 1HB LYS 114 -13.124 -2.729 5.593 748 HB3 LYS 114 2HB LYS 114 -14.035 -1.695 6.689 749 HG2 LYS 114 1HG LYS 114 -15.550 -1.090 4.763 750 HG3 LYS 114 2HG LYS 114 -14.646 -2.203 3.720 751 HD2 LYS 114 1HD LYS 114 -15.166 -4.005 5.545 752 HD3 LYS 114 2HD LYS 114 -16.217 -2.786 6.272 753 HE2 LYS 114 1HE LYS 114 -17.323 -2.727 3.875 754 HE3 LYS 114 2HE LYS 114 -16.501 -4.268 3.639 755 HZ1 LYS 114 3HZ LYS 114 -18.741 -4.610 4.509 756 HZ2 LYS 114 1HZ LYS 114 -18.416 -3.671 5.824 757 HZ3 LYS 114 2HZ LYS 114 -17.650 -5.093 5.607 758 H LYS 115 H LYS 115 -13.144 0.555 7.522 759 HA LYS 115 HA LYS 115 -15.044 2.638 6.610 760 HB2 LYS 115 1HB LYS 115 -14.268 1.190 9.089 761 HB3 LYS 115 2HB LYS 115 -14.120 2.899 9.332 762 HG2 LYS 115 1HG LYS 115 -16.334 2.325 9.906 763 HG3 LYS 115 2HG LYS 115 -16.455 3.188 8.377 764 HD2 LYS 115 1HD LYS 115 -17.909 1.332 8.109 765 HD3 LYS 115 2HD LYS 115 -16.475 0.867 7.223 766 HE2 LYS 115 1HE LYS 115 -17.320 -1.000 8.544 767 HE3 LYS 115 2HE LYS 115 -15.725 -0.531 9.148 768 HZ1 LYS 115 3HZ LYS 115 -16.674 0.390 11.039 769 HZ2 LYS 115 1HZ LYS 115 -17.584 -0.955 10.807 770 HZ3 LYS 115 2HZ LYS 115 -18.180 0.524 10.398 771 H GLU 116 H GLU 116 -11.570 2.389 6.799 772 HA GLU 116 HA GLU 116 -11.227 5.301 6.929 773 HB2 GLU 116 1HB GLU 116 -9.452 3.132 5.757 774 HB3 GLU 116 2HB GLU 116 -9.029 4.829 5.970 775 HG2 GLU 116 1HG GLU 116 -9.564 2.907 8.250 776 HG3 GLU 116 2HG GLU 116 -7.990 3.244 7.583 777 H PHE 117 H PHE 117 -10.919 2.843 4.262 778 HA PHE 117 HA PHE 117 -11.468 5.073 2.371 779 HB2 PHE 117 1HB PHE 117 -9.572 2.779 2.082 780 HB3 PHE 117 2HB PHE 117 -9.619 4.240 1.131 781 HD1 PHE 117 2HD PHE 117 -9.422 6.490 2.760 782 HD2 PHE 117 1HD PHE 117 -7.768 2.572 3.589 783 HE1 PHE 117 2HE PHE 117 -7.630 7.514 4.107 784 HE2 PHE 117 1HE PHE 117 -5.952 3.615 4.848 785 HZ PHE 117 HZ PHE 117 -5.892 6.111 5.145 786 H TYR 118 H TYR 118 -13.144 2.405 3.220 787 HA TYR 118 HA TYR 118 -14.126 2.053 0.458 788 HB2 TYR 118 1HB TYR 118 -12.423 0.207 1.569 789 HB3 TYR 118 2HB TYR 118 -13.964 -0.442 2.077 790 HD1 TYR 118 2HD TYR 118 -12.777 1.253 -1.142 791 HD2 TYR 118 1HD TYR 118 -14.328 -2.325 0.724 792 HE1 TYR 118 2HE TYR 118 -12.669 0.050 -3.324 793 HE2 TYR 118 1HE TYR 118 -14.280 -3.480 -1.495 794 HH TYR 118 HH TYR 118 -12.667 -2.156 -4.282 795 H GLN 119 H GLN 119 -14.992 3.439 2.904 796 HA GLN 119 HA GLN 119 -16.926 1.955 4.299 797 HB2 GLN 119 1HB GLN 119 -17.643 4.792 4.331 798 HB3 GLN 119 2HB GLN 119 -17.119 3.756 5.553 799 HG2 GLN 119 1HG GLN 119 -15.517 5.310 5.776 800 HG3 GLN 119 2HG GLN 119 -14.692 4.232 4.625 801 HE21 GLN 119 1HE2 GLN 119 -13.511 5.901 3.575 802 HE22 GLN 119 2HE2 GLN 119 -14.231 7.158 2.660 803 H THR 120 H THR 120 -17.173 4.413 1.569 804 HA THR 120 HA THR 120 -20.079 3.739 1.295 805 HB THR 120 HB THR 120 -19.693 6.083 1.255 806 HG1 THR 120 1HG THR 120 -20.676 6.542 -0.604 807 HG21 THR 120 3HG2 THR 120 -17.327 6.242 0.734 808 HG22 THR 120 1HG2 THR 120 -18.222 7.154 -0.490 809 HG23 THR 120 2HG2 THR 120 -17.622 5.530 -0.870 810 H ARG 121 H ARG 121 -20.919 2.965 -0.687 811 HA ARG 121 HA ARG 121 -19.220 1.008 -2.072 812 HB2 ARG 121 1HB ARG 121 -22.134 1.919 -2.512 813 HB3 ARG 121 2HB ARG 121 -21.341 0.612 -3.385 814 HG2 ARG 121 1HG ARG 121 -20.968 -0.559 -1.187 815 HG3 ARG 121 2HG ARG 121 -22.010 0.639 -0.415 816 HD2 ARG 121 1HD ARG 121 -22.984 -0.848 -2.873 817 HD3 ARG 121 2HD ARG 121 -22.950 -1.685 -1.327 818 HE ARG 121 HE ARG 121 -24.333 0.232 -0.437 819 HH11 ARG 121 1HH1 ARG 121 -24.682 -0.735 -3.867 820 HH12 ARG 121 2HH1 ARG 121 -26.374 -0.957 -3.772 821 HH21 ARG 121 1HH2 ARG 121 -26.652 0.285 -0.455 822 HH22 ARG 121 2HH2 ARG 121 -27.513 -0.167 -1.871 823 H SER 122 H SER 122 -20.085 4.367 -2.695 824 HA SER 122 HA SER 122 -19.623 4.048 -5.602 825 HB2 SER 122 1HB SER 122 -21.215 5.715 -4.377 826 HB3 SER 122 2HB SER 122 -19.751 6.658 -4.056 827 HG SER 122 HG SER 122 -20.635 5.776 -6.630 828 H GLN 123 H GLN 123 -17.609 4.933 -2.772 829 HA GLN 123 HA GLN 123 -15.611 6.213 -4.370 830 HB2 GLN 123 1HB GLN 123 -14.262 6.273 -2.529 831 HB3 GLN 123 2HB GLN 123 -15.842 6.160 -1.765 832 HG2 GLN 123 1HG GLN 123 -15.464 3.718 -1.449 833 HG3 GLN 123 2HG GLN 123 -13.793 3.923 -1.950 834 HE21 GLN 123 1HE2 GLN 123 -15.883 4.085 0.574 835 HE22 GLN 123 2HE2 GLN 123 -14.897 5.132 1.672 836 H LYS 124 H LYS 124 -16.354 2.904 -3.855 837 HA LYS 124 HA LYS 124 -14.059 1.471 -4.369 838 HB2 LYS 124 1HB LYS 124 -16.815 0.910 -5.555 839 HB3 LYS 124 2HB LYS 124 -15.496 -0.235 -5.324 840 HG2 LYS 124 1HG LYS 124 -15.732 0.048 -2.836 841 HG3 LYS 124 2HG LYS 124 -17.115 1.096 -3.133 842 HD2 LYS 124 1HD LYS 124 -17.961 -1.133 -2.737 843 HD3 LYS 124 2HD LYS 124 -18.198 -0.806 -4.467 844 HE2 LYS 124 1HE LYS 124 -15.563 -1.952 -3.798 845 HE3 LYS 124 2HE LYS 124 -16.886 -2.990 -3.289 846 HZ1 LYS 124 3HZ LYS 124 -17.655 -3.056 -5.581 847 HZ2 LYS 124 1HZ LYS 124 -16.105 -3.523 -5.509 848 HZ3 LYS 124 2HZ LYS 124 -16.440 -2.052 -6.090 849 H ARG 125 H ARG 125 -15.918 3.325 -6.688 850 HA ARG 125 HA ARG 125 -15.053 2.304 -9.151 851 HB2 ARG 125 1HB ARG 125 -15.915 4.236 -10.044 852 HB3 ARG 125 2HB ARG 125 -16.850 3.886 -8.570 853 HG2 ARG 125 1HG ARG 125 -15.559 5.595 -7.350 854 HG3 ARG 125 2HG ARG 125 -14.811 6.074 -8.904 855 HD2 ARG 125 1HD ARG 125 -16.990 6.488 -9.841 856 HD3 ARG 125 2HD ARG 125 -17.747 5.986 -8.306 857 HE ARG 125 HE ARG 125 -15.773 7.858 -7.653 858 HH11 ARG 125 1HH1 ARG 125 -18.689 8.247 -9.674 859 HH12 ARG 125 2HH1 ARG 125 -18.945 9.868 -9.142 860 HH21 ARG 125 1HH2 ARG 125 -16.061 9.881 -7.061 861 HH22 ARG 125 2HH2 ARG 125 -17.472 10.819 -7.451 862 H GLU 126 H GLU 126 -13.776 4.946 -7.282 863 HA GLU 126 HA GLU 126 -11.404 5.420 -8.872 864 HB2 GLU 126 1HB GLU 126 -12.432 6.338 -6.140 865 HB3 GLU 126 2HB GLU 126 -10.748 6.559 -6.539 866 HG2 GLU 126 1HG GLU 126 -11.419 8.496 -7.217 867 HG3 GLU 126 2HG GLU 126 -11.625 7.649 -8.747 868 H VAL 127 H VAL 127 -11.878 3.970 -5.711 869 HA VAL 127 HA VAL 127 -9.252 3.197 -5.212 870 HB VAL 127 HB VAL 127 -11.567 1.439 -4.431 871 HG11 VAL 127 1HG1 VAL 127 -9.265 0.534 -3.943 872 HG12 VAL 127 2HG1 VAL 127 -8.913 2.013 -3.024 873 HG13 VAL 127 3HG1 VAL 127 -10.170 0.889 -2.471 874 HG21 VAL 127 3HG2 VAL 127 -11.551 2.805 -2.271 875 HG22 VAL 127 1HG2 VAL 127 -10.546 3.974 -3.135 876 HG23 VAL 127 2HG2 VAL 127 -12.181 3.654 -3.684 877 H ASP 128 H ASP 128 -11.696 1.038 -6.826 878 HA ASP 128 HA ASP 128 -9.720 -0.926 -7.503 879 HB2 ASP 128 1HB ASP 128 -12.346 -1.090 -7.505 880 HB3 ASP 128 2HB ASP 128 -12.221 -0.479 -9.151 881 H ASP 129 H ASP 129 -10.598 2.118 -9.129 882 HA ASP 129 HA ASP 129 -9.233 1.475 -11.586 883 HB2 ASP 129 1HB ASP 129 -10.052 4.100 -10.341 884 HB3 ASP 129 2HB ASP 129 -9.007 4.031 -11.748 885 H TYR 130 H TYR 130 -8.055 2.707 -8.433 886 HA TYR 130 HA TYR 130 -5.363 3.077 -9.395 887 HB2 TYR 130 1HB TYR 130 -6.223 2.383 -6.577 888 HB3 TYR 130 2HB TYR 130 -4.666 3.030 -7.052 889 HD1 TYR 130 1HD TYR 130 -5.173 5.258 -8.804 890 HD2 TYR 130 2HD TYR 130 -7.363 4.065 -5.277 891 HE1 TYR 130 1HE TYR 130 -6.129 7.480 -8.668 892 HE2 TYR 130 2HE TYR 130 -8.450 6.289 -5.245 893 HH TYR 130 HH TYR 130 -7.778 8.798 -7.679 894 H VAL 131 H VAL 131 -7.120 0.210 -8.265 895 HA VAL 131 HA VAL 131 -4.725 -1.450 -8.211 896 HB VAL 131 HB VAL 131 -7.639 -2.327 -8.349 897 HG11 VAL 131 1HG1 VAL 131 -5.022 -3.688 -7.669 898 HG12 VAL 131 2HG1 VAL 131 -6.523 -4.268 -6.927 899 HG13 VAL 131 3HG1 VAL 131 -6.357 -4.255 -8.679 900 HG21 VAL 131 3HG2 VAL 131 -6.024 -1.958 -5.804 901 HG22 VAL 131 1HG2 VAL 131 -7.236 -0.793 -6.365 902 HG23 VAL 131 2HG2 VAL 131 -7.730 -2.421 -5.967 903 H ALA 132 H ALA 132 -6.622 -0.172 -10.754 904 HA ALA 132 HA ALA 132 -5.674 -2.238 -12.682 905 HB1 ALA 132 1HB ALA 132 -8.136 -2.172 -12.276 906 HB2 ALA 132 2HB ALA 132 -8.141 -0.473 -12.828 907 HB3 ALA 132 3HB ALA 132 -7.676 -1.774 -13.940 908 H GLY 133 H GLY 133 -4.379 0.416 -11.722 909 HA2 GLY 133 1HA GLY 133 -3.738 1.367 -14.492 910 HA3 GLY 133 2HA GLY 133 -3.999 2.514 -13.195 911 H LEU 134 H LEU 134 -2.620 -0.184 -11.855 912 HA LEU 134 HA LEU 134 0.054 0.962 -11.590 913 HB2 LEU 134 1HB LEU 134 0.385 -0.901 -10.018 914 HB3 LEU 134 2HB LEU 134 -1.002 0.104 -9.667 915 HG LEU 134 HG LEU 134 -2.426 -1.727 -10.925 916 HD11 LEU 134 1HD1 LEU 134 -1.535 -4.001 -10.673 917 HD12 LEU 134 2HD1 LEU 134 0.054 -3.368 -10.212 918 HD13 LEU 134 3HD1 LEU 134 -0.602 -3.121 -11.857 919 HD21 LEU 134 3HD2 LEU 134 -2.521 -1.186 -8.566 920 HD22 LEU 134 1HD2 LEU 134 -1.067 -2.158 -8.258 921 HD23 LEU 134 2HD2 LEU 134 -2.585 -2.935 -8.793 922 H ARG 135 H ARG 135 1.794 -0.940 -11.593 923 HA ARG 135 HA ARG 135 1.460 -2.859 -13.800 924 HB2 ARG 135 1HB ARG 135 3.773 -0.910 -13.357 925 HB3 ARG 135 2HB ARG 135 4.010 -2.427 -14.199 926 HG2 ARG 135 1HG ARG 135 2.417 -1.851 -15.912 927 HG3 ARG 135 2HG ARG 135 1.880 -0.416 -15.054 928 HD2 ARG 135 1HD ARG 135 3.438 0.857 -15.995 929 HD3 ARG 135 2HD ARG 135 4.721 -0.157 -15.400 930 HE ARG 135 HE ARG 135 3.425 -0.127 -18.047 931 HH11 ARG 135 1HH1 ARG 135 5.675 -1.984 -15.996 932 HH12 ARG 135 2HH1 ARG 135 5.918 -3.215 -17.185 933 HH21 ARG 135 1HH2 ARG 135 3.925 -1.514 -19.629 934 HH22 ARG 135 2HH2 ARG 135 5.039 -2.837 -19.432 935 H THR 136 H THR 136 3.030 -4.682 -13.395 936 HA THR 136 HA THR 136 3.758 -4.938 -10.501 937 HB THR 136 HB THR 136 2.966 -7.238 -12.301 938 HG1 THR 136 1HG THR 136 1.218 -5.650 -10.755 939 HG21 THR 136 3HG2 THR 136 2.200 -8.140 -9.992 940 HG22 THR 136 1HG2 THR 136 3.248 -6.854 -9.324 941 HG23 THR 136 2HG2 THR 136 3.934 -8.103 -10.352 942 H GLU 137 H GLU 137 4.949 -4.493 -13.400 943 HA GLU 137 HA GLU 137 6.740 -4.957 -14.707 944 HB2 GLU 137 1HB GLU 137 8.202 -5.183 -12.710 945 HB3 GLU 137 2HB GLU 137 7.830 -6.905 -12.640 946 HG2 GLU 137 1HG GLU 137 8.781 -7.275 -14.844 947 HG3 GLU 137 2HG GLU 137 8.986 -5.533 -15.103
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