NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
498237 | 2l8o | 17420 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 GLY 1 1HT GLY 1 -3.026 -18.495 -6.146 2 H2 GLY 1 2HT GLY 1 -3.214 -20.127 -6.582 3 H3 GLY 1 3HT GLY 1 -1.756 -19.592 -5.893 4 HA2 GLY 1 2HA GLY 1 -4.397 -19.666 -4.534 5 HA3 GLY 1 1HA GLY 1 -3.065 -20.790 -4.263 6 H ASN 2 H ASN 2 -1.127 -20.024 -3.293 7 HA ASN 2 HA ASN 2 -1.498 -18.144 -1.197 8 HB2 ASN 2 2HB ASN 2 0.939 -18.448 -0.817 9 HB3 ASN 2 1HB ASN 2 0.106 -19.988 -1.018 10 HD21 ASN 2 1HD2 ASN 2 0.778 -21.337 -2.731 11 HD22 ASN 2 2HD2 ASN 2 1.942 -20.889 -3.882 12 H LYS 3 H LYS 3 -0.400 -17.852 -4.480 13 HA LYS 3 HA LYS 3 0.947 -15.324 -4.210 14 HB2 LYS 3 2HB LYS 3 -0.243 -16.695 -6.646 15 HB3 LYS 3 1HB LYS 3 0.801 -15.272 -6.690 16 HG2 LYS 3 2HG LYS 3 2.601 -16.558 -5.577 17 HG3 LYS 3 1HG LYS 3 1.562 -17.983 -5.551 18 HD2 LYS 3 2HD LYS 3 1.453 -17.957 -8.021 19 HD3 LYS 3 1HD LYS 3 2.490 -16.531 -8.050 20 HE2 LYS 3 2HE LYS 3 4.292 -17.815 -6.946 21 HE3 LYS 3 1HE LYS 3 3.256 -19.241 -6.921 22 HZ1 LYS 3 3HZ LYS 3 4.960 -18.757 -8.869 23 HZ2 LYS 3 1HZ LYS 3 3.623 -17.918 -9.491 24 HZ3 LYS 3 2HZ LYS 3 3.492 -19.572 -9.129 25 H ILE 4 H ILE 4 -1.218 -14.832 -2.766 26 HA ILE 4 HA ILE 4 -3.582 -14.013 -3.992 27 HB ILE 4 HB ILE 4 -2.214 -12.769 -1.574 28 HG12 ILE 4 2HG1 ILE 4 -4.356 -14.950 -1.663 29 HG13 ILE 4 1HG1 ILE 4 -2.638 -15.285 -1.457 30 HG21 ILE 4 1HG2 ILE 4 -4.618 -12.149 -0.949 31 HG22 ILE 4 2HG2 ILE 4 -5.100 -12.655 -2.565 32 HG23 ILE 4 3HG2 ILE 4 -4.004 -11.294 -2.357 33 HD11 ILE 4 3HD1 ILE 4 -4.378 -13.635 0.401 34 HD12 ILE 4 1HD1 ILE 4 -2.637 -13.839 0.583 35 HD13 ILE 4 2HD1 ILE 4 -3.707 -15.232 0.733 36 H THR 5 H THR 5 -4.130 -12.311 -5.209 37 HA THR 5 HA THR 5 -2.270 -10.006 -5.517 38 HB THR 5 HB THR 5 -1.949 -11.391 -7.483 39 HG1 THR 5 1HG THR 5 -2.927 -8.968 -7.506 40 HG21 THR 5 3HG2 THR 5 -3.815 -12.095 -8.907 41 HG22 THR 5 1HG2 THR 5 -4.970 -11.359 -7.803 42 HG23 THR 5 2HG2 THR 5 -4.023 -12.753 -7.287 43 H VAL 6 H VAL 6 -3.226 -8.072 -5.577 44 HA VAL 6 HA VAL 6 -6.187 -7.852 -5.744 45 HB VAL 6 HB VAL 6 -6.111 -6.231 -3.851 46 HG11 VAL 6 1HG1 VAL 6 -5.080 -9.003 -3.170 47 HG12 VAL 6 2HG1 VAL 6 -6.768 -8.577 -3.455 48 HG13 VAL 6 3HG1 VAL 6 -5.918 -7.918 -2.060 49 HG21 VAL 6 3HG2 VAL 6 -4.100 -6.254 -2.358 50 HG22 VAL 6 1HG2 VAL 6 -3.724 -5.609 -3.953 51 HG23 VAL 6 2HG2 VAL 6 -3.259 -7.255 -3.537 52 H GLU 7 H GLU 7 -6.898 -5.747 -6.338 53 HA GLU 7 HA GLU 7 -4.866 -3.873 -7.400 54 HB2 GLU 7 2HB GLU 7 -7.136 -4.966 -9.131 55 HB3 GLU 7 1HB GLU 7 -5.879 -3.822 -9.614 56 HG2 GLU 7 2HG GLU 7 -4.166 -5.632 -9.130 57 HG3 GLU 7 1HG GLU 7 -5.500 -6.746 -8.863 58 H VAL 8 H VAL 8 -5.766 -1.786 -7.931 59 HA VAL 8 HA VAL 8 -8.533 -1.219 -7.078 60 HB VAL 8 HB VAL 8 -7.300 -0.981 -4.993 61 HG11 VAL 8 1HG1 VAL 8 -5.398 0.636 -4.817 62 HG12 VAL 8 2HG1 VAL 8 -5.428 0.828 -6.560 63 HG13 VAL 8 3HG1 VAL 8 -5.045 -0.743 -5.854 64 HG21 VAL 8 3HG2 VAL 8 -7.836 1.327 -4.437 65 HG22 VAL 8 1HG2 VAL 8 -9.055 0.746 -5.570 66 HG23 VAL 8 2HG2 VAL 8 -7.764 1.812 -6.127 67 H THR 9 H THR 9 -9.402 0.549 -8.104 68 HA THR 9 HA THR 9 -7.828 1.740 -10.307 69 HB THR 9 HB THR 9 -10.006 2.439 -11.157 70 HG1 THR 9 1HG THR 9 -10.852 2.678 -8.959 71 HG21 THR 9 3HG2 THR 9 -10.039 -0.445 -10.233 72 HG22 THR 9 1HG2 THR 9 -9.238 0.157 -11.686 73 HG23 THR 9 2HG2 THR 9 -10.996 0.222 -11.555 74 H VAL 10 H VAL 10 -6.903 3.641 -9.881 75 HA VAL 10 HA VAL 10 -8.201 5.584 -8.009 76 HB VAL 10 HB VAL 10 -5.238 5.246 -8.626 77 HG11 VAL 10 1HG1 VAL 10 -5.821 7.559 -8.019 78 HG12 VAL 10 2HG1 VAL 10 -4.978 6.799 -6.673 79 HG13 VAL 10 3HG1 VAL 10 -6.730 6.983 -6.621 80 HG21 VAL 10 3HG2 VAL 10 -6.109 3.340 -7.322 81 HG22 VAL 10 1HG2 VAL 10 -6.849 4.453 -6.171 82 HG23 VAL 10 2HG2 VAL 10 -5.093 4.362 -6.310 83 H TYR 11 H TYR 11 -8.853 7.414 -8.960 84 HA TYR 11 HA TYR 11 -8.036 8.022 -11.739 85 HB2 TYR 11 2HB TYR 11 -10.448 8.015 -11.117 86 HB3 TYR 11 1HB TYR 11 -10.150 9.327 -9.982 87 HD1 TYR 11 2HD TYR 11 -10.011 8.365 -13.591 88 HD2 TYR 11 1HD TYR 11 -9.934 11.631 -10.786 89 HE1 TYR 11 2HE TYR 11 -10.208 9.981 -15.459 90 HE2 TYR 11 1HE TYR 11 -10.128 13.238 -12.660 91 HH TYR 11 HH TYR 11 -10.348 12.111 -16.039 92 H ALA 12 H ALA 12 -5.936 8.751 -11.345 93 HA ALA 12 HA ALA 12 -5.682 11.554 -10.820 94 HB1 ALA 12 1HB ALA 12 -5.823 10.764 -8.484 95 HB2 ALA 12 2HB ALA 12 -4.218 11.397 -8.845 96 HB3 ALA 12 3HB ALA 12 -4.487 9.653 -8.779 97 H ALA 13 H ALA 13 -3.585 12.339 -11.358 98 HA ALA 13 HA ALA 13 -2.241 10.903 -13.386 99 HB1 ALA 13 1HB ALA 13 -0.576 12.717 -13.269 100 HB2 ALA 13 2HB ALA 13 -1.272 13.258 -11.740 101 HB3 ALA 13 3HB ALA 13 -2.217 13.361 -13.224 102 H ILE 14 H ILE 14 -0.421 9.614 -13.364 103 HA ILE 14 HA ILE 14 0.190 8.113 -11.172 104 HB ILE 14 HB ILE 14 0.837 7.555 -13.506 105 HG12 ILE 14 2HG1 ILE 14 3.051 6.506 -12.962 106 HG13 ILE 14 1HG1 ILE 14 3.136 7.475 -11.499 107 HG21 ILE 14 1HG2 ILE 14 2.833 8.495 -14.520 108 HG22 ILE 14 2HG2 ILE 14 3.197 9.435 -13.076 109 HG23 ILE 14 3HG2 ILE 14 1.782 9.834 -14.057 110 HD11 ILE 14 3HD1 ILE 14 1.497 6.235 -10.420 111 HD12 ILE 14 1HD1 ILE 14 2.242 5.011 -11.422 112 HD13 ILE 14 2HD1 ILE 14 0.719 5.718 -11.922 113 H GLU 15 H GLU 15 1.653 11.139 -12.132 114 HA GLU 15 HA GLU 15 3.827 11.136 -10.298 115 HB2 GLU 15 2HB GLU 15 3.664 12.551 -12.342 116 HB3 GLU 15 1HB GLU 15 2.401 13.498 -11.565 117 HG2 GLU 15 2HG GLU 15 3.969 14.159 -9.778 118 HG3 GLU 15 1HG GLU 15 5.229 13.164 -10.502 119 H LYS 16 H LYS 16 0.443 12.165 -10.010 120 HA LYS 16 HA LYS 16 0.783 13.658 -7.586 121 HB2 LYS 16 2HB LYS 16 -1.129 13.812 -9.305 122 HB3 LYS 16 1HB LYS 16 -1.788 12.363 -8.561 123 HG2 LYS 16 2HG LYS 16 -2.927 14.014 -7.310 124 HG3 LYS 16 1HG LYS 16 -1.514 13.780 -6.283 125 HD2 LYS 16 2HD LYS 16 -0.418 15.734 -7.452 126 HD3 LYS 16 1HD LYS 16 -1.911 15.981 -8.357 127 HE2 LYS 16 2HE LYS 16 -1.603 16.111 -5.337 128 HE3 LYS 16 1HE LYS 16 -1.860 17.481 -6.420 129 HZ1 LYS 16 3HZ LYS 16 -3.975 16.455 -7.089 130 HZ2 LYS 16 1HZ LYS 16 -3.934 16.834 -5.438 131 HZ3 LYS 16 2HZ LYS 16 -3.732 15.224 -5.943 132 H VAL 17 H VAL 17 -0.536 10.395 -8.222 133 HA VAL 17 HA VAL 17 -0.964 9.728 -5.492 134 HB VAL 17 HB VAL 17 -2.097 8.595 -7.361 135 HG11 VAL 17 1HG1 VAL 17 -0.927 7.010 -8.781 136 HG12 VAL 17 2HG1 VAL 17 0.587 7.279 -7.927 137 HG13 VAL 17 3HG1 VAL 17 -0.126 8.571 -8.890 138 HG21 VAL 17 3HG2 VAL 17 -0.389 6.657 -5.739 139 HG22 VAL 17 1HG2 VAL 17 -1.940 6.305 -6.499 140 HG23 VAL 17 2HG2 VAL 17 -1.857 7.439 -5.152 141 H TRP 18 H TRP 18 1.806 9.326 -7.663 142 HA TRP 18 HA TRP 18 3.355 7.568 -6.154 143 HB2 TRP 18 2HB TRP 18 3.973 8.346 -8.422 144 HB3 TRP 18 1HB TRP 18 4.304 9.954 -7.783 145 HD1 TRP 18 HD TRP 18 6.374 10.154 -6.021 146 HE1 TRP 18 1HE TRP 18 8.524 8.747 -5.812 147 HE3 TRP 18 3HE TRP 18 5.023 6.067 -8.755 148 HZ2 TRP 18 2HZ TRP 18 9.533 6.224 -6.678 149 HZ3 TRP 18 3HZ TRP 18 6.596 4.176 -9.050 150 HH2 TRP 18 HH TRP 18 8.848 4.250 -8.010 151 H LYS 19 H LYS 19 3.051 11.085 -5.888 152 HA LYS 19 HA LYS 19 4.995 11.387 -3.790 153 HB2 LYS 19 2HB LYS 19 2.716 13.181 -4.694 154 HB3 LYS 19 1HB LYS 19 3.912 13.646 -3.483 155 HG2 LYS 19 2HG LYS 19 5.721 13.309 -5.136 156 HG3 LYS 19 1HG LYS 19 4.527 12.856 -6.351 157 HD2 LYS 19 2HD LYS 19 3.476 15.084 -6.159 158 HD3 LYS 19 1HD LYS 19 4.662 15.541 -4.937 159 HE2 LYS 19 2HE LYS 19 6.481 15.228 -6.575 160 HE3 LYS 19 1HE LYS 19 5.300 14.765 -7.802 161 HZ1 LYS 19 3HZ LYS 19 6.057 17.360 -6.920 162 HZ2 LYS 19 1HZ LYS 19 4.383 17.138 -6.773 163 HZ3 LYS 19 2HZ LYS 19 5.140 16.909 -8.277 164 H TYR 20 H TYR 20 1.422 11.113 -3.806 165 HA TYR 20 HA TYR 20 1.089 11.423 -1.002 166 HB2 TYR 20 2HB TYR 20 -0.724 11.717 -2.659 167 HB3 TYR 20 1HB TYR 20 -0.671 9.996 -3.023 168 HD1 TYR 20 1HD TYR 20 -1.338 8.306 -1.287 169 HD2 TYR 20 2HD TYR 20 -1.782 12.532 -0.599 170 HE1 TYR 20 1HE TYR 20 -2.853 7.842 0.619 171 HE2 TYR 20 2HE TYR 20 -3.297 12.059 1.303 172 HH TYR 20 HH TYR 20 -4.115 10.470 2.649 173 H TRP 21 H TRP 21 1.371 8.549 -3.066 174 HA TRP 21 HA TRP 21 0.961 6.633 -1.018 175 HB2 TRP 21 2HB TRP 21 0.750 6.218 -3.490 176 HB3 TRP 21 1HB TRP 21 2.504 6.309 -3.637 177 HD1 TRP 21 HD TRP 21 3.800 4.095 -3.175 178 HE1 TRP 21 1HE TRP 21 3.174 1.780 -2.241 179 HE3 TRP 21 3HE TRP 21 -0.990 5.023 -1.702 180 HZ2 TRP 21 2HZ TRP 21 0.922 0.486 -1.025 181 HZ3 TRP 21 3HZ TRP 21 -2.357 3.239 -0.669 182 HH2 TRP 21 HH TRP 21 -1.412 0.973 -0.328 183 H ASN 22 H ASN 22 3.693 8.565 -1.884 184 HA ASN 22 HA ASN 22 5.622 6.870 -0.383 185 HB2 ASN 22 2HB ASN 22 6.041 9.283 -2.168 186 HB3 ASN 22 1HB ASN 22 7.325 8.357 -1.394 187 HD21 ASN 22 1HD2 ASN 22 5.781 5.758 -1.893 188 HD22 ASN 22 2HD2 ASN 22 6.023 5.445 -3.544 189 H GLU 23 H GLU 23 3.841 9.862 -0.166 190 HA GLU 23 HA GLU 23 5.539 11.249 1.612 191 HB2 GLU 23 2HB GLU 23 3.585 12.264 0.372 192 HB3 GLU 23 1HB GLU 23 2.509 11.468 1.507 193 HG2 GLU 23 2HG GLU 23 2.840 13.749 2.272 194 HG3 GLU 23 1HG GLU 23 3.715 12.698 3.377 195 HA PRO 24 HA PRO 24 4.676 8.384 5.067 196 HB2 PRO 24 2HB PRO 24 6.186 9.508 7.060 197 HB3 PRO 24 1HB PRO 24 6.922 8.660 5.689 198 HG2 PRO 24 2HG PRO 24 6.524 11.620 6.057 199 HG3 PRO 24 1HG PRO 24 7.987 10.753 5.535 200 HD2 PRO 24 2HD PRO 24 6.298 11.934 3.737 201 HD3 PRO 24 1HD PRO 24 7.170 10.435 3.334 202 H ALA 25 H ALA 25 4.465 11.901 5.597 203 HA ALA 25 HA ALA 25 2.900 11.902 7.905 204 HB1 ALA 25 1HB ALA 25 2.765 13.860 5.592 205 HB2 ALA 25 2HB ALA 25 3.910 13.935 6.929 206 HB3 ALA 25 3HB ALA 25 2.188 14.158 7.233 207 H HIS 26 H HIS 26 1.922 11.590 4.515 208 HA HIS 26 HA HIS 26 -0.891 11.722 4.963 209 HB2 HIS 26 2HB HIS 26 0.676 10.397 2.727 210 HB3 HIS 26 1HB HIS 26 -1.062 10.678 2.711 211 HD2 HIS 26 2HD HIS 26 0.250 13.794 4.272 212 HE1 HIS 26 1HE HIS 26 0.502 14.549 0.127 213 HE2 HIS 26 2HE HIS 26 0.581 15.614 2.431 214 H ILE 27 H ILE 27 1.394 8.963 4.791 215 HA ILE 27 HA ILE 27 -0.580 6.931 4.982 216 HB ILE 27 HB ILE 27 2.350 6.928 5.815 217 HG12 ILE 27 2HG1 ILE 27 0.997 5.803 3.313 218 HG13 ILE 27 1HG1 ILE 27 1.784 7.379 3.364 219 HG21 ILE 27 1HG2 ILE 27 2.119 4.398 5.609 220 HG22 ILE 27 2HG2 ILE 27 0.377 4.620 5.482 221 HG23 ILE 27 3HG2 ILE 27 1.220 5.069 6.962 222 HD11 ILE 27 3HD1 ILE 27 3.115 4.699 3.859 223 HD12 ILE 27 1HD1 ILE 27 3.913 6.263 4.032 224 HD13 ILE 27 2HD1 ILE 27 3.334 5.737 2.451 225 H MET 28 H MET 28 1.296 8.653 7.488 226 HA MET 28 HA MET 28 0.371 7.224 9.713 227 HB2 MET 28 2HB MET 28 1.269 10.118 9.450 228 HB3 MET 28 1HB MET 28 1.008 9.312 10.997 229 HG2 MET 28 2HG MET 28 2.747 7.705 10.526 230 HG3 MET 28 1HG MET 28 2.923 8.286 8.877 231 HE1 MET 28 3HE MET 28 3.025 9.019 12.551 232 HE2 MET 28 1HE MET 28 2.592 10.708 12.245 233 HE3 MET 28 2HE MET 28 4.216 10.292 12.775 234 H LYS 29 H LYS 29 -1.401 9.294 7.623 235 HA LYS 29 HA LYS 29 -3.356 10.139 9.626 236 HB2 LYS 29 2HB LYS 29 -2.702 11.545 7.635 237 HB3 LYS 29 1HB LYS 29 -3.512 10.375 6.597 238 HG2 LYS 29 2HG LYS 29 -5.643 10.775 7.776 239 HG3 LYS 29 1HG LYS 29 -4.840 11.919 8.850 240 HD2 LYS 29 2HD LYS 29 -4.263 13.334 6.896 241 HD3 LYS 29 1HD LYS 29 -5.092 12.194 5.836 242 HE2 LYS 29 2HE LYS 29 -7.210 12.616 7.039 243 HE3 LYS 29 1HE LYS 29 -6.379 13.757 8.099 244 HZ1 LYS 29 3HZ LYS 29 -6.249 15.309 6.486 245 HZ2 LYS 29 1HZ LYS 29 -7.613 14.498 5.884 246 HZ3 LYS 29 2HZ LYS 29 -6.078 14.174 5.233 247 H TRP 30 H TRP 30 -3.110 7.750 7.005 248 HA TRP 30 HA TRP 30 -5.660 6.472 7.914 249 HB2 TRP 30 2HB TRP 30 -6.034 5.734 5.601 250 HB3 TRP 30 1HB TRP 30 -5.950 7.492 5.685 251 HD1 TRP 30 HD TRP 30 -3.754 8.667 4.704 252 HE1 TRP 30 1HE TRP 30 -1.983 7.875 2.991 253 HE3 TRP 30 3HE TRP 30 -4.798 3.653 4.574 254 HZ2 TRP 30 2HZ TRP 30 -1.132 5.455 1.748 255 HZ3 TRP 30 3HZ TRP 30 -3.491 2.143 3.135 256 HH2 TRP 30 HH TRP 30 -1.666 3.030 1.718 257 H CYS 31 H CYS 31 -2.695 5.955 8.657 258 HA CYS 31 HA CYS 31 -1.768 3.629 7.453 259 HB2 CYS 31 2HB CYS 31 -0.546 5.006 9.150 260 HB3 CYS 31 1HB CYS 31 -1.577 4.309 10.394 261 HG CYS 31 HG CYS 31 0.670 2.890 10.115 262 H GLN 32 H GLN 32 -2.427 1.562 7.439 263 HA GLN 32 HA GLN 32 -3.548 -0.357 7.891 264 HB2 GLN 32 2HB GLN 32 -2.675 0.174 10.292 265 HB3 GLN 32 1HB GLN 32 -4.316 0.710 10.633 266 HG2 GLN 32 2HG GLN 32 -4.194 -1.606 11.315 267 HG3 GLN 32 1HG GLN 32 -5.131 -1.572 9.824 268 HE21 GLN 32 1HE2 GLN 32 -4.561 -3.478 8.730 269 HE22 GLN 32 2HE2 GLN 32 -2.965 -3.992 8.459 270 H ALA 33 H ALA 33 -5.127 2.665 8.566 271 HA ALA 33 HA ALA 33 -7.248 3.439 8.236 272 HB1 ALA 33 1HB ALA 33 -6.654 2.745 5.916 273 HB2 ALA 33 2HB ALA 33 -8.384 2.612 6.242 274 HB3 ALA 33 3HB ALA 33 -7.373 1.169 6.235 275 H SER 34 H SER 34 -6.909 1.622 10.392 276 HA SER 34 HA SER 34 -9.631 0.453 10.580 277 HB2 SER 34 2HB SER 34 -8.678 -1.498 11.736 278 HB3 SER 34 1HB SER 34 -8.031 -1.350 10.105 279 HG SER 34 HG SER 34 -6.373 -1.710 11.621 280 HA PRO 35 HA PRO 35 -9.391 2.788 14.444 281 HB2 PRO 35 2HB PRO 35 -11.612 1.921 15.762 282 HB3 PRO 35 1HB PRO 35 -11.748 2.862 14.254 283 HG2 PRO 35 2HG PRO 35 -11.838 -0.134 14.596 284 HG3 PRO 35 1HG PRO 35 -12.989 0.913 13.736 285 HD2 PRO 35 2HD PRO 35 -11.011 -0.406 12.391 286 HD3 PRO 35 1HD PRO 35 -11.527 1.227 11.897 287 H GLU 36 H GLU 36 -9.195 -0.658 14.319 288 HA GLU 36 HA GLU 36 -8.625 -1.049 17.165 289 HB2 GLU 36 2HB GLU 36 -8.438 -2.926 14.783 290 HB3 GLU 36 1HB GLU 36 -8.198 -3.411 16.461 291 HG2 GLU 36 2HG GLU 36 -10.756 -2.186 15.365 292 HG3 GLU 36 1HG GLU 36 -10.506 -3.907 15.630 293 H TRP 37 H TRP 37 -6.961 0.588 15.072 294 HA TRP 37 HA TRP 37 -4.355 -0.163 16.187 295 HB2 TRP 37 2HB TRP 37 -4.946 -0.223 13.206 296 HB3 TRP 37 1HB TRP 37 -3.314 -0.172 13.870 297 HD1 TRP 37 HD TRP 37 -6.351 -2.481 13.574 298 HE1 TRP 37 1HE TRP 37 -5.616 -4.882 14.155 299 HE3 TRP 37 3HE TRP 37 -1.600 -1.574 15.196 300 HZ2 TRP 37 2HZ TRP 37 -3.311 -6.238 15.175 301 HZ3 TRP 37 3HZ TRP 37 -0.157 -3.434 15.965 302 HH2 TRP 37 HH TRP 37 -1.006 -5.764 15.956 303 H HIS 38 H HIS 38 -2.764 1.432 15.938 304 HA HIS 38 HA HIS 38 -3.583 4.064 14.869 305 HB2 HIS 38 2HB HIS 38 -4.223 4.027 17.287 306 HB3 HIS 38 1HB HIS 38 -2.555 3.644 17.705 307 HD2 HIS 38 2HD HIS 38 -1.242 5.967 18.385 308 HE1 HIS 38 1HE HIS 38 -3.278 8.615 15.803 309 HE2 HIS 38 2HE HIS 38 -1.459 8.437 17.566 310 H VAL 39 H VAL 39 -1.733 5.538 14.759 311 HA VAL 39 HA VAL 39 0.904 4.176 14.487 312 HB VAL 39 HB VAL 39 -0.135 4.446 12.314 313 HG11 VAL 39 1HG1 VAL 39 -0.073 7.474 12.418 314 HG12 VAL 39 2HG1 VAL 39 -1.440 6.673 13.185 315 HG13 VAL 39 3HG1 VAL 39 -1.109 6.407 11.484 316 HG21 VAL 39 3HG2 VAL 39 2.346 4.753 12.590 317 HG22 VAL 39 1HG2 VAL 39 2.084 6.497 12.675 318 HG23 VAL 39 2HG2 VAL 39 1.691 5.615 11.201 319 HA PRO 40 HA PRO 40 1.282 7.972 17.135 320 HB2 PRO 40 2HB PRO 40 3.104 7.072 18.960 321 HB3 PRO 40 1HB PRO 40 1.385 6.619 19.052 322 HG2 PRO 40 2HG PRO 40 3.685 5.037 17.923 323 HG3 PRO 40 1HG PRO 40 2.375 4.489 18.991 324 HD2 PRO 40 2HD PRO 40 2.334 4.089 16.272 325 HD3 PRO 40 1HD PRO 40 0.839 4.281 17.218 326 H ALA 41 H ALA 41 3.443 6.213 15.156 327 HA ALA 41 HA ALA 41 4.874 8.543 14.371 328 HB1 ALA 41 1HB ALA 41 7.124 7.895 15.161 329 HB2 ALA 41 2HB ALA 41 6.420 6.546 16.053 330 HB3 ALA 41 3HB ALA 41 6.043 8.201 16.517 331 H ALA 42 H ALA 42 6.256 8.160 12.607 332 HA ALA 42 HA ALA 42 6.781 5.482 11.654 333 HB1 ALA 42 1HB ALA 42 4.388 5.927 10.906 334 HB2 ALA 42 2HB ALA 42 5.517 5.539 9.609 335 HB3 ALA 42 3HB ALA 42 5.030 7.209 9.879 336 H GLN 43 H GLN 43 8.279 5.409 9.968 337 HA GLN 43 HA GLN 43 9.486 7.970 9.065 338 HB2 GLN 43 2HB GLN 43 11.042 5.599 10.182 339 HB3 GLN 43 1HB GLN 43 11.731 7.086 9.532 340 HG2 GLN 43 2HG GLN 43 9.941 6.903 11.979 341 HG3 GLN 43 1HG GLN 43 11.689 7.103 12.009 342 HE21 GLN 43 1HE2 GLN 43 9.105 8.907 12.615 343 HE22 GLN 43 2HE2 GLN 43 9.575 10.399 11.955 344 H ASN 44 H ASN 44 10.405 7.888 7.057 345 HA ASN 44 HA ASN 44 10.793 5.419 5.603 346 HB2 ASN 44 2HB ASN 44 8.311 5.721 5.446 347 HB3 ASN 44 1HB ASN 44 8.578 7.278 4.675 348 HD21 ASN 44 1HD2 ASN 44 7.798 6.764 2.575 349 HD22 ASN 44 2HD2 ASN 44 8.509 5.579 1.590 350 H ASP 45 H ASP 45 12.336 5.720 4.122 351 HA ASP 45 HA ASP 45 12.959 8.462 3.107 352 HB2 ASP 45 2HB ASP 45 14.912 6.316 4.012 353 HB3 ASP 45 1HB ASP 45 15.347 7.860 3.282 354 H LEU 46 H LEU 46 12.008 8.110 1.094 355 HA LEU 46 HA LEU 46 12.278 5.723 -0.405 356 HB2 LEU 46 2HB LEU 46 10.492 7.392 -0.798 357 HB3 LEU 46 1HB LEU 46 11.698 8.557 -1.330 358 HG LEU 46 HG LEU 46 12.290 7.040 -3.233 359 HD11 LEU 46 1HD1 LEU 46 10.528 5.179 -3.728 360 HD12 LEU 46 2HD1 LEU 46 10.123 5.289 -2.014 361 HD13 LEU 46 3HD1 LEU 46 11.751 4.830 -2.515 362 HD21 LEU 46 3HD2 LEU 46 9.343 7.722 -3.035 363 HD22 LEU 46 1HD2 LEU 46 10.230 7.421 -4.531 364 HD23 LEU 46 2HD2 LEU 46 10.626 8.824 -3.538 365 H LYS 47 H LYS 47 14.405 5.054 -0.613 366 HA LYS 47 HA LYS 47 15.973 6.278 -2.677 367 HB2 LYS 47 2HB LYS 47 16.501 7.778 -0.740 368 HB3 LYS 47 1HB LYS 47 17.114 6.383 0.145 369 HG2 LYS 47 2HG LYS 47 18.828 6.005 -1.589 370 HG3 LYS 47 1HG LYS 47 18.188 7.351 -2.533 371 HD2 LYS 47 2HD LYS 47 18.724 8.898 -0.673 372 HD3 LYS 47 1HD LYS 47 19.374 7.546 0.256 373 HE2 LYS 47 2HE LYS 47 21.187 8.782 -0.863 374 HE3 LYS 47 1HE LYS 47 21.062 7.146 -1.512 375 HZ1 LYS 47 3HZ LYS 47 19.491 9.239 -2.809 376 HZ2 LYS 47 1HZ LYS 47 20.262 7.888 -3.485 377 HZ3 LYS 47 2HZ LYS 47 21.171 9.261 -3.061 378 H ALA 48 H ALA 48 17.461 4.835 -3.507 379 HA ALA 48 HA ALA 48 17.157 2.088 -2.889 380 HB1 ALA 48 1HB ALA 48 17.857 2.903 -5.107 381 HB2 ALA 48 2HB ALA 48 19.018 1.743 -4.460 382 HB3 ALA 48 3HB ALA 48 19.379 3.472 -4.422 383 H GLY 49 H GLY 49 18.333 0.719 -1.619 384 HA2 GLY 49 2HA GLY 49 19.910 -0.036 -0.110 385 HA3 GLY 49 1HA GLY 49 20.922 1.348 -0.523 386 H GLY 50 H GLY 50 17.897 2.485 0.188 387 HA2 GLY 50 2HA GLY 50 18.698 3.472 2.840 388 HA3 GLY 50 1HA GLY 50 17.293 3.972 1.900 389 H THR 51 H THR 51 17.014 3.405 4.595 390 HA THR 51 HA THR 51 15.380 0.904 4.588 391 HB THR 51 HB THR 51 16.063 0.450 6.858 392 HG1 THR 51 1HG THR 51 17.446 1.830 7.942 393 HG21 THR 51 3HG2 THR 51 17.592 -0.353 5.081 394 HG22 THR 51 1HG2 THR 51 18.460 0.018 6.571 395 HG23 THR 51 2HG2 THR 51 18.517 1.144 5.216 396 H PHE 52 H PHE 52 13.714 0.915 6.282 397 HA PHE 52 HA PHE 52 12.736 3.598 7.092 398 HB2 PHE 52 2HB PHE 52 10.495 3.070 6.248 399 HB3 PHE 52 1HB PHE 52 11.664 3.051 4.929 400 HD1 PHE 52 1HD PHE 52 12.407 0.894 3.919 401 HD2 PHE 52 2HD PHE 52 9.436 0.984 7.029 402 HE1 PHE 52 1HE PHE 52 11.798 -1.454 3.410 403 HE2 PHE 52 2HE PHE 52 8.828 -1.368 6.515 404 HZ PHE 52 HZ PHE 52 10.011 -2.583 4.705 405 H THR 53 H THR 53 10.942 3.444 8.637 406 HA THR 53 HA THR 53 10.612 0.923 10.091 407 HB THR 53 HB THR 53 11.697 3.405 11.480 408 HG1 THR 53 1HG THR 53 13.255 1.250 11.638 409 HG21 THR 53 3HG2 THR 53 11.951 1.847 13.399 410 HG22 THR 53 1HG2 THR 53 11.173 0.577 12.458 411 HG23 THR 53 2HG2 THR 53 10.264 2.014 12.924 412 H THR 54 H THR 54 8.504 0.766 10.523 413 HA THR 54 HA THR 54 6.848 3.223 10.881 414 HB THR 54 HB THR 54 5.972 0.505 9.838 415 HG1 THR 54 1HG THR 54 6.776 2.890 8.574 416 HG21 THR 54 3HG2 THR 54 4.154 1.790 10.892 417 HG22 THR 54 1HG2 THR 54 3.949 1.765 9.143 418 HG23 THR 54 2HG2 THR 54 4.583 3.207 9.934 419 H THR 55 H THR 55 6.285 3.478 12.988 420 HA THR 55 HA THR 55 6.172 1.135 14.790 421 HB THR 55 HB THR 55 5.931 4.111 15.405 422 HG1 THR 55 1HG THR 55 7.959 3.937 14.793 423 HG21 THR 55 3HG2 THR 55 4.995 2.686 17.176 424 HG22 THR 55 1HG2 THR 55 6.534 3.364 17.704 425 HG23 THR 55 2HG2 THR 55 6.450 1.687 17.167 426 H MET 56 H MET 56 4.235 0.166 15.094 427 HA MET 56 HA MET 56 1.778 1.792 15.301 428 HB2 MET 56 2HB MET 56 0.592 0.167 13.785 429 HB3 MET 56 1HB MET 56 1.774 1.169 12.953 430 HG2 MET 56 2HG MET 56 3.426 -0.644 13.023 431 HG3 MET 56 1HG MET 56 2.307 -1.667 13.920 432 HE1 MET 56 3HE MET 56 -0.246 -2.894 11.477 433 HE2 MET 56 1HE MET 56 -0.274 -1.941 12.964 434 HE3 MET 56 2HE MET 56 0.804 -3.327 12.823 435 H ALA 57 H ALA 57 0.257 0.894 16.631 436 HA ALA 57 HA ALA 57 0.589 -1.830 17.689 437 HB1 ALA 57 1HB ALA 57 2.057 -0.448 19.120 438 HB2 ALA 57 2HB ALA 57 0.669 -1.059 20.021 439 HB3 ALA 57 3HB ALA 57 0.701 0.619 19.478 440 H ALA 58 H ALA 58 -1.196 -2.545 18.897 441 HA ALA 58 HA ALA 58 -3.715 -1.758 17.880 442 HB1 ALA 58 1HB ALA 58 -3.113 -3.347 20.384 443 HB2 ALA 58 2HB ALA 58 -3.260 -4.010 18.756 444 HB3 ALA 58 3HB ALA 58 -4.662 -3.284 19.540 445 H LYS 59 H LYS 59 -5.440 -0.603 18.861 446 HA LYS 59 HA LYS 59 -4.770 1.727 20.208 447 HB2 LYS 59 2HB LYS 59 -6.842 1.334 18.871 448 HB3 LYS 59 1HB LYS 59 -7.460 0.309 20.165 449 HG2 LYS 59 2HG LYS 59 -7.361 2.218 21.728 450 HG3 LYS 59 1HG LYS 59 -6.715 3.234 20.443 451 HD2 LYS 59 2HD LYS 59 -8.788 2.885 19.134 452 HD3 LYS 59 1HD LYS 59 -9.430 1.875 20.430 453 HE2 LYS 59 2HE LYS 59 -9.295 3.794 21.990 454 HE3 LYS 59 1HE LYS 59 -8.666 4.803 20.686 455 HZ1 LYS 59 3HZ LYS 59 -10.919 5.251 20.671 456 HZ2 LYS 59 1HZ LYS 59 -11.359 3.646 20.998 457 HZ3 LYS 59 2HZ LYS 59 -10.779 4.069 19.458 458 H ASP 60 H ASP 60 -5.926 -1.386 21.464 459 HA ASP 60 HA ASP 60 -6.108 -0.483 24.213 460 HB2 ASP 60 2HB ASP 60 -6.443 -2.901 24.688 461 HB3 ASP 60 1HB ASP 60 -7.518 -2.317 23.420 462 H GLY 61 H GLY 61 -3.559 -1.182 22.150 463 HA2 GLY 61 2HA GLY 61 -1.285 -1.327 22.504 464 HA3 GLY 61 1HA GLY 61 -1.578 -1.024 24.214 465 H SER 62 H SER 62 -3.440 -3.594 23.017 466 HA SER 62 HA SER 62 -2.238 -5.526 24.684 467 HB2 SER 62 2HB SER 62 -4.578 -5.658 23.967 468 HB3 SER 62 1HB SER 62 -4.065 -5.902 22.299 469 HG SER 62 HG SER 62 -3.357 -7.562 24.495 470 H MET 63 H MET 63 -1.945 -4.889 21.205 471 HA MET 63 HA MET 63 0.385 -6.757 21.053 472 HB2 MET 63 2HB MET 63 -1.631 -7.529 19.765 473 HB3 MET 63 1HB MET 63 -1.567 -6.043 18.821 474 HG2 MET 63 2HG MET 63 0.677 -6.634 18.000 475 HG3 MET 63 1HG MET 63 0.688 -8.079 19.011 476 HE1 MET 63 3HE MET 63 1.187 -9.677 17.019 477 HE2 MET 63 1HE MET 63 1.361 -8.188 16.080 478 HE3 MET 63 2HE MET 63 0.407 -9.527 15.447 479 H SER 64 H SER 64 2.177 -6.036 19.933 480 HA SER 64 HA SER 64 2.201 -3.324 18.769 481 HB2 SER 64 2HB SER 64 2.828 -3.012 21.132 482 HB3 SER 64 1HB SER 64 4.083 -4.235 20.967 483 HG SER 64 HG SER 64 4.465 -1.774 20.595 484 H PHE 65 H PHE 65 3.664 -3.117 17.113 485 HA PHE 65 HA PHE 65 5.843 -4.991 16.738 486 HB2 PHE 65 2HB PHE 65 3.830 -6.278 15.912 487 HB3 PHE 65 1HB PHE 65 3.572 -5.024 14.704 488 HD1 PHE 65 1HD PHE 65 5.832 -7.752 15.810 489 HD2 PHE 65 2HD PHE 65 5.113 -4.786 12.777 490 HE1 PHE 65 1HE PHE 65 7.519 -8.828 14.353 491 HE2 PHE 65 2HE PHE 65 6.802 -5.872 11.323 492 HZ PHE 65 HZ PHE 65 8.004 -7.892 12.112 493 H ASP 66 H ASP 66 7.108 -4.450 14.816 494 HA ASP 66 HA ASP 66 6.641 -1.740 13.688 495 HB2 ASP 66 2HB ASP 66 8.151 -1.544 15.660 496 HB3 ASP 66 1HB ASP 66 9.258 -2.689 14.910 497 H PHE 67 H PHE 67 6.883 -1.771 11.540 498 HA PHE 67 HA PHE 67 8.128 -4.112 10.216 499 HB2 PHE 67 2HB PHE 67 6.379 -1.827 9.222 500 HB3 PHE 67 1HB PHE 67 7.094 -3.023 8.145 501 HD1 PHE 67 2HD PHE 67 6.395 -5.398 8.234 502 HD2 PHE 67 1HD PHE 67 4.538 -2.446 10.752 503 HE1 PHE 67 2HE PHE 67 4.552 -6.979 8.735 504 HE2 PHE 67 1HE PHE 67 2.698 -4.032 11.248 505 HZ PHE 67 HZ PHE 67 2.705 -6.297 10.239 506 H GLY 68 H GLY 68 9.991 -3.982 9.108 507 HA2 GLY 68 2HA GLY 68 11.139 -1.434 8.235 508 HA3 GLY 68 1HA GLY 68 12.028 -2.284 9.501 509 H GLY 69 H GLY 69 12.927 -1.713 6.851 510 HA2 GLY 69 2HA GLY 69 14.087 -4.189 6.133 511 HA3 GLY 69 1HA GLY 69 12.748 -3.840 5.039 512 H VAL 70 H VAL 70 14.728 -3.870 3.541 513 HA VAL 70 HA VAL 70 15.801 -1.102 3.243 514 HB VAL 70 HB VAL 70 17.516 -2.684 4.120 515 HG11 VAL 70 1HG1 VAL 70 16.603 -4.748 3.030 516 HG12 VAL 70 2HG1 VAL 70 18.330 -4.531 2.753 517 HG13 VAL 70 3HG1 VAL 70 17.181 -4.152 1.474 518 HG21 VAL 70 3HG2 VAL 70 19.241 -2.160 2.444 519 HG22 VAL 70 1HG2 VAL 70 18.175 -0.780 2.691 520 HG23 VAL 70 2HG2 VAL 70 17.996 -1.790 1.254 521 H TYR 71 H TYR 71 15.733 -0.263 1.212 522 HA TYR 71 HA TYR 71 14.039 -1.571 -0.753 523 HB2 TYR 71 2HB TYR 71 15.596 1.037 -0.861 524 HB3 TYR 71 1HB TYR 71 14.430 0.508 -2.068 525 HD1 TYR 71 2HD TYR 71 12.022 0.003 -1.329 526 HD2 TYR 71 1HD TYR 71 14.802 2.167 1.149 527 HE1 TYR 71 2HE TYR 71 10.142 0.901 0.008 528 HE2 TYR 71 1HE TYR 71 12.912 3.059 2.477 529 HH TYR 71 HH TYR 71 9.567 2.507 1.522 530 H ASP 72 H ASP 72 14.722 -2.877 -2.345 531 HA ASP 72 HA ASP 72 17.537 -3.397 -2.793 532 HB2 ASP 72 2HB ASP 72 15.800 -5.174 -2.917 533 HB3 ASP 72 1HB ASP 72 15.097 -4.375 -4.320 534 H GLN 73 H GLN 73 14.909 -1.774 -4.515 535 HA GLN 73 HA GLN 73 16.779 -0.134 -6.025 536 HB2 GLN 73 2HB GLN 73 16.700 -2.258 -7.346 537 HB3 GLN 73 1HB GLN 73 14.960 -2.052 -7.531 538 HG2 GLN 73 2HG GLN 73 15.330 0.100 -8.698 539 HG3 GLN 73 1HG GLN 73 17.070 -0.085 -8.487 540 HE21 GLN 73 1HE2 GLN 73 18.064 -0.914 -10.324 541 HE22 GLN 73 2HE2 GLN 73 17.335 -1.973 -11.433 542 H VAL 74 H VAL 74 15.809 1.707 -6.856 543 HA VAL 74 HA VAL 74 12.871 2.039 -6.545 544 HB VAL 74 HB VAL 74 14.959 4.033 -5.576 545 HG11 VAL 74 1HG1 VAL 74 12.973 5.188 -4.620 546 HG12 VAL 74 2HG1 VAL 74 11.923 4.001 -5.386 547 HG13 VAL 74 3HG1 VAL 74 12.881 5.102 -6.373 548 HG21 VAL 74 3HG2 VAL 74 13.117 2.180 -4.014 549 HG22 VAL 74 1HG2 VAL 74 14.119 3.448 -3.305 550 HG23 VAL 74 2HG2 VAL 74 14.875 2.069 -4.094 551 H LYS 75 H LYS 75 11.980 2.985 -8.292 552 HA LYS 75 HA LYS 75 13.534 4.801 -10.017 553 HB2 LYS 75 2HB LYS 75 12.333 2.155 -10.889 554 HB3 LYS 75 1HB LYS 75 12.599 3.460 -12.048 555 HG2 LYS 75 2HG LYS 75 15.012 3.463 -11.442 556 HG3 LYS 75 1HG LYS 75 14.723 2.136 -10.318 557 HD2 LYS 75 2HD LYS 75 13.937 0.717 -12.175 558 HD3 LYS 75 1HD LYS 75 14.211 2.038 -13.309 559 HE2 LYS 75 2HE LYS 75 16.337 0.686 -11.617 560 HE3 LYS 75 1HE LYS 75 16.102 0.466 -13.351 561 HZ1 LYS 75 3HZ LYS 75 17.206 2.744 -11.898 562 HZ2 LYS 75 1HZ LYS 75 16.280 3.085 -13.278 563 HZ3 LYS 75 2HZ LYS 75 17.653 2.092 -13.401 564 H THR 76 H THR 76 12.319 6.523 -10.383 565 HA THR 76 HA THR 76 9.740 6.914 -9.463 566 HB THR 76 HB THR 76 11.040 8.392 -11.774 567 HG1 THR 76 1HG THR 76 11.194 9.268 -9.143 568 HG21 THR 76 3HG2 THR 76 8.989 9.244 -9.698 569 HG22 THR 76 1HG2 THR 76 8.688 9.025 -11.421 570 HG23 THR 76 2HG2 THR 76 9.749 10.318 -10.870 571 H ASN 77 H ASN 77 7.806 6.201 -10.104 572 HA ASN 77 HA ASN 77 6.117 5.311 -11.373 573 HB2 ASN 77 2HB ASN 77 7.426 6.957 -13.554 574 HB3 ASN 77 1HB ASN 77 5.773 6.351 -13.562 575 HD21 ASN 77 1HD2 ASN 77 5.472 6.898 -10.589 576 HD22 ASN 77 2HD2 ASN 77 5.287 8.579 -10.474 577 H ASP 78 H ASP 78 7.713 3.327 -11.014 578 HA ASP 78 HA ASP 78 7.714 1.835 -13.529 579 HB2 ASP 78 2HB ASP 78 10.263 2.435 -12.013 580 HB3 ASP 78 1HB ASP 78 10.144 1.185 -13.247 581 H LEU 79 H LEU 79 9.676 1.216 -10.638 582 HA LEU 79 HA LEU 79 7.749 -0.793 -9.649 583 HB2 LEU 79 2HB LEU 79 9.137 -1.997 -11.300 584 HB3 LEU 79 1HB LEU 79 10.598 -1.449 -10.485 585 HG LEU 79 HG LEU 79 9.959 -2.745 -8.453 586 HD11 LEU 79 1HD1 LEU 79 8.031 -4.482 -8.829 587 HD12 LEU 79 2HD1 LEU 79 7.459 -3.345 -10.053 588 HD13 LEU 79 3HD1 LEU 79 7.622 -2.836 -8.375 589 HD21 LEU 79 3HD2 LEU 79 11.339 -3.809 -10.195 590 HD22 LEU 79 1HD2 LEU 79 9.883 -4.371 -11.018 591 HD23 LEU 79 2HD2 LEU 79 10.291 -4.996 -9.420 592 H ILE 80 H ILE 80 7.809 -1.016 -7.485 593 HA ILE 80 HA ILE 80 10.114 0.068 -5.924 594 HB ILE 80 HB ILE 80 7.166 0.428 -5.231 595 HG12 ILE 80 2HG1 ILE 80 9.242 2.483 -6.107 596 HG13 ILE 80 1HG1 ILE 80 7.941 1.884 -7.126 597 HG21 ILE 80 1HG2 ILE 80 8.629 0.184 -3.238 598 HG22 ILE 80 2HG2 ILE 80 8.075 1.839 -3.378 599 HG23 ILE 80 3HG2 ILE 80 9.710 1.417 -3.878 600 HD11 ILE 80 3HD1 ILE 80 7.861 4.050 -5.257 601 HD12 ILE 80 1HD1 ILE 80 6.739 2.821 -4.670 602 HD13 ILE 80 2HD1 ILE 80 6.573 3.468 -6.295 603 H GLU 81 H GLU 81 10.895 -1.446 -4.563 604 HA GLU 81 HA GLU 81 9.130 -3.371 -3.261 605 HB2 GLU 81 2HB GLU 81 10.456 -5.336 -4.063 606 HB3 GLU 81 1HB GLU 81 9.551 -4.547 -5.355 607 HG2 GLU 81 2HG GLU 81 11.583 -3.331 -6.049 608 HG3 GLU 81 1HG GLU 81 12.501 -4.113 -4.765 609 H TYR 82 H TYR 82 10.353 -4.687 -1.682 610 HA TYR 82 HA TYR 82 13.022 -3.786 -0.920 611 HB2 TYR 82 2HB TYR 82 12.276 -3.074 1.365 612 HB3 TYR 82 1HB TYR 82 11.701 -2.006 0.085 613 HD1 TYR 82 2HD TYR 82 9.329 -2.163 -0.738 614 HD2 TYR 82 1HD TYR 82 10.677 -4.385 2.694 615 HE1 TYR 82 2HE TYR 82 6.979 -2.549 -0.057 616 HE2 TYR 82 1HE TYR 82 8.318 -4.758 3.366 617 HH TYR 82 HH TYR 82 5.896 -4.716 1.671 618 H THR 83 H THR 83 13.963 -5.087 0.738 619 HA THR 83 HA THR 83 12.918 -7.824 0.734 620 HB THR 83 HB THR 83 15.485 -6.705 1.932 621 HG1 THR 83 1HG THR 83 14.743 -7.511 -0.642 622 HG21 THR 83 3HG2 THR 83 14.865 -8.928 2.800 623 HG22 THR 83 1HG2 THR 83 16.253 -9.053 1.720 624 HG23 THR 83 2HG2 THR 83 14.652 -9.520 1.152 625 H ILE 84 H ILE 84 11.867 -8.716 2.410 626 HA ILE 84 HA ILE 84 11.507 -7.173 4.910 627 HB ILE 84 HB ILE 84 10.011 -9.657 3.961 628 HG12 ILE 84 2HG1 ILE 84 8.208 -7.568 3.623 629 HG13 ILE 84 1HG1 ILE 84 9.703 -6.738 3.214 630 HG21 ILE 84 1HG2 ILE 84 8.312 -8.853 5.606 631 HG22 ILE 84 2HG2 ILE 84 9.414 -7.573 6.098 632 HG23 ILE 84 3HG2 ILE 84 9.845 -9.261 6.373 633 HD11 ILE 84 3HD1 ILE 84 8.566 -9.223 1.911 634 HD12 ILE 84 1HD1 ILE 84 10.179 -8.605 1.567 635 HD13 ILE 84 2HD1 ILE 84 8.763 -7.629 1.188 636 H GLY 85 H GLY 85 12.128 -7.946 6.876 637 HA2 GLY 85 2HA GLY 85 14.311 -9.642 7.147 638 HA3 GLY 85 1HA GLY 85 13.204 -9.249 8.456 639 H ASP 86 H ASP 86 10.844 -10.444 7.516 640 HA ASP 86 HA ASP 86 11.149 -13.100 8.344 641 HB2 ASP 86 2HB ASP 86 9.036 -11.796 8.425 642 HB3 ASP 86 1HB ASP 86 8.930 -11.881 6.671 643 H GLY 87 H GLY 87 11.726 -11.643 5.280 644 HA2 GLY 87 2HA GLY 87 12.890 -12.680 3.507 645 HA3 GLY 87 1HA GLY 87 12.386 -14.264 4.081 646 H ARG 88 H ARG 88 9.699 -12.306 4.186 647 HA ARG 88 HA ARG 88 8.350 -13.621 2.078 648 HB2 ARG 88 2HB ARG 88 7.736 -11.018 3.520 649 HB3 ARG 88 1HB ARG 88 6.620 -11.790 2.393 650 HG2 ARG 88 2HG ARG 88 6.559 -13.807 3.799 651 HG3 ARG 88 1HG ARG 88 7.708 -13.080 4.920 652 HD2 ARG 88 2HD ARG 88 4.985 -11.892 4.267 653 HD3 ARG 88 1HD ARG 88 5.326 -12.878 5.689 654 HE ARG 88 HE ARG 88 7.201 -10.785 5.616 655 HH11 ARG 88 1HH2 ARG 88 3.788 -11.296 6.028 656 HH12 ARG 88 2HH2 ARG 88 3.568 -9.898 7.026 657 HH21 ARG 88 1HH1 ARG 88 6.904 -8.963 6.920 658 HH22 ARG 88 2HH1 ARG 88 5.328 -8.579 7.529 659 H LYS 89 H LYS 89 7.302 -12.403 0.227 660 HA LYS 89 HA LYS 89 9.194 -10.502 -1.084 661 HB2 LYS 89 2HB LYS 89 7.617 -12.752 -2.380 662 HB3 LYS 89 1HB LYS 89 8.679 -11.623 -3.214 663 HG2 LYS 89 2HG LYS 89 9.650 -13.491 -1.014 664 HG3 LYS 89 1HG LYS 89 9.692 -13.918 -2.720 665 HD2 LYS 89 2HD LYS 89 11.146 -11.937 -3.158 666 HD3 LYS 89 1HD LYS 89 11.150 -11.572 -1.438 667 HE2 LYS 89 2HE LYS 89 12.157 -13.763 -0.950 668 HE3 LYS 89 1HE LYS 89 12.172 -14.132 -2.677 669 HZ1 LYS 89 3HZ LYS 89 14.076 -12.728 -1.213 670 HZ2 LYS 89 1HZ LYS 89 13.340 -11.611 -2.257 671 HZ3 LYS 89 2HZ LYS 89 14.053 -13.019 -2.886 672 H VAL 90 H VAL 90 8.292 -8.636 -1.369 673 HA VAL 90 HA VAL 90 5.429 -8.402 -2.161 674 HB VAL 90 HB VAL 90 6.910 -6.590 -0.205 675 HG11 VAL 90 1HG1 VAL 90 5.198 -5.387 -1.506 676 HG12 VAL 90 2HG1 VAL 90 4.627 -5.617 0.143 677 HG13 VAL 90 3HG1 VAL 90 4.014 -6.648 -1.153 678 HG21 VAL 90 3HG2 VAL 90 4.727 -8.655 0.280 679 HG22 VAL 90 1HG2 VAL 90 5.371 -7.548 1.491 680 HG23 VAL 90 2HG2 VAL 90 6.407 -8.792 0.799 681 H ARG 91 H ARG 91 5.264 -7.340 -4.035 682 HA ARG 91 HA ARG 91 7.259 -5.260 -4.799 683 HB2 ARG 91 2HB ARG 91 6.203 -7.467 -6.608 684 HB3 ARG 91 1HB ARG 91 7.252 -6.135 -7.100 685 HG2 ARG 91 2HG ARG 91 8.989 -6.932 -5.515 686 HG3 ARG 91 1HG ARG 91 7.942 -8.274 -5.057 687 HD2 ARG 91 2HD ARG 91 8.961 -7.764 -7.874 688 HD3 ARG 91 1HD ARG 91 9.647 -8.936 -6.753 689 HE ARG 91 HE ARG 91 6.902 -9.477 -6.971 690 HH11 ARG 91 1HH2 ARG 91 9.777 -9.506 -8.924 691 HH12 ARG 91 2HH2 ARG 91 9.215 -10.771 -9.964 692 HH21 ARG 91 1HH1 ARG 91 6.177 -11.130 -8.341 693 HH22 ARG 91 2HH1 ARG 91 7.185 -11.687 -9.634 694 H ILE 92 H ILE 92 6.337 -3.470 -5.682 695 HA ILE 92 HA ILE 92 3.376 -3.478 -6.164 696 HB ILE 92 HB ILE 92 5.221 -1.193 -5.345 697 HG12 ILE 92 2HG1 ILE 92 3.075 -2.619 -3.698 698 HG13 ILE 92 1HG1 ILE 92 4.795 -2.959 -3.551 699 HG21 ILE 92 1HG2 ILE 92 3.302 -0.404 -6.681 700 HG22 ILE 92 2HG2 ILE 92 3.042 0.031 -5.002 701 HG23 ILE 92 3HG2 ILE 92 2.194 -1.349 -5.693 702 HD11 ILE 92 3HD1 ILE 92 4.136 -1.386 -1.814 703 HD12 ILE 92 1HD1 ILE 92 3.454 -0.292 -3.019 704 HD13 ILE 92 2HD1 ILE 92 5.196 -0.571 -2.964 705 H VAL 93 H VAL 93 3.037 -3.600 -8.338 706 HA VAL 93 HA VAL 93 4.948 -2.331 -10.215 707 HB VAL 93 HB VAL 93 2.577 -4.151 -10.812 708 HG11 VAL 93 1HG1 VAL 93 4.969 -3.287 -12.481 709 HG12 VAL 93 2HG1 VAL 93 3.305 -2.762 -12.726 710 HG13 VAL 93 3HG1 VAL 93 3.741 -4.447 -12.989 711 HG21 VAL 93 3HG2 VAL 93 4.247 -5.325 -9.427 712 HG22 VAL 93 1HG2 VAL 93 5.531 -4.807 -10.519 713 HG23 VAL 93 2HG2 VAL 93 4.290 -5.929 -11.080 714 H PHE 94 H PHE 94 4.465 -0.454 -11.157 715 HA PHE 94 HA PHE 94 1.797 0.781 -10.729 716 HB2 PHE 94 2HB PHE 94 4.550 1.828 -11.477 717 HB3 PHE 94 1HB PHE 94 3.114 2.837 -11.522 718 HD1 PHE 94 1HD PHE 94 5.364 0.880 -9.305 719 HD2 PHE 94 2HD PHE 94 2.022 3.587 -9.445 720 HE1 PHE 94 1HE PHE 94 5.548 1.253 -6.866 721 HE2 PHE 94 2HE PHE 94 2.222 3.955 -7.005 722 HZ PHE 94 HZ PHE 94 3.984 2.788 -5.715 723 H THR 95 H THR 95 0.376 0.760 -12.324 724 HA THR 95 HA THR 95 1.207 1.032 -15.142 725 HB THR 95 HB THR 95 -0.673 -1.159 -14.166 726 HG1 THR 95 1HG THR 95 1.604 -1.903 -15.439 727 HG21 THR 95 3HG2 THR 95 -0.464 -1.956 -16.516 728 HG22 THR 95 1HG2 THR 95 0.484 -0.521 -16.905 729 HG23 THR 95 2HG2 THR 95 -1.208 -0.360 -16.428 730 H HIS 96 H HIS 96 -0.408 1.942 -16.446 731 HA HIS 96 HA HIS 96 -2.959 2.764 -15.185 732 HB2 HIS 96 2HB HIS 96 -2.595 5.094 -15.961 733 HB3 HIS 96 1HB HIS 96 -1.398 4.611 -14.759 734 HD2 HIS 96 2HD HIS 96 -1.484 5.938 -18.366 735 HE1 HIS 96 1HE HIS 96 2.450 4.563 -17.692 736 HE2 HIS 96 2HE HIS 96 0.963 5.879 -19.276 737 H THR 97 H THR 97 -4.614 2.515 -16.554 738 HA THR 97 HA THR 97 -4.245 1.441 -19.154 739 HB THR 97 HB THR 97 -6.765 2.762 -18.069 740 HG1 THR 97 1HG THR 97 -6.168 1.286 -16.576 741 HG21 THR 97 3HG2 THR 97 -7.888 1.103 -19.527 742 HG22 THR 97 1HG2 THR 97 -6.317 0.531 -20.086 743 HG23 THR 97 2HG2 THR 97 -6.844 2.171 -20.464 744 H GLY 98 H GLY 98 -5.160 4.669 -18.004 745 HA2 GLY 98 2HA GLY 98 -3.824 6.089 -20.009 746 HA3 GLY 98 1HA GLY 98 -5.493 5.887 -20.539 747 H ASP 99 H ASP 99 -7.158 6.419 -18.806 748 HA ASP 99 HA ASP 99 -6.482 9.035 -17.564 749 HB2 ASP 99 2HB ASP 99 -8.938 9.376 -17.564 750 HB3 ASP 99 1HB ASP 99 -8.316 9.059 -19.180 751 H THR 100 H THR 100 -6.331 5.972 -16.546 752 HA THR 100 HA THR 100 -7.115 6.669 -13.785 753 HB THR 100 HB THR 100 -8.113 4.153 -15.180 754 HG1 THR 100 1HG THR 100 -9.115 6.261 -15.684 755 HG21 THR 100 3HG2 THR 100 -8.567 5.264 -12.385 756 HG22 THR 100 1HG2 THR 100 -7.705 3.778 -12.790 757 HG23 THR 100 2HG2 THR 100 -9.439 3.898 -13.075 758 H THR 101 H THR 101 -5.595 5.986 -12.390 759 HA THR 101 HA THR 101 -3.385 4.318 -13.349 760 HB THR 101 HB THR 101 -3.791 5.636 -10.637 761 HG1 THR 101 1HG THR 101 -3.560 7.310 -11.917 762 HG21 THR 101 3HG2 THR 101 -2.128 3.848 -10.523 763 HG22 THR 101 1HG2 THR 101 -1.286 5.392 -10.543 764 HG23 THR 101 2HG2 THR 101 -1.356 4.417 -12.002 765 H ASN 102 H ASN 102 -2.926 2.273 -12.647 766 HA ASN 102 HA ASN 102 -4.861 0.944 -10.789 767 HB2 ASN 102 2HB ASN 102 -5.075 0.221 -13.175 768 HB3 ASN 102 1HB ASN 102 -3.391 -0.295 -13.148 769 HD21 ASN 102 1HD2 ASN 102 -4.006 -2.570 -13.447 770 HD22 ASN 102 2HD2 ASN 102 -4.728 -3.454 -12.192 771 H ILE 103 H ILE 103 -3.887 0.476 -8.930 772 HA ILE 103 HA ILE 103 -0.954 0.052 -8.791 773 HB ILE 103 HB ILE 103 -3.023 0.307 -6.577 774 HG12 ILE 103 2HG1 ILE 103 -1.031 2.403 -7.544 775 HG13 ILE 103 1HG1 ILE 103 -2.727 2.394 -8.013 776 HG21 ILE 103 1HG2 ILE 103 0.017 0.334 -6.528 777 HG22 ILE 103 2HG2 ILE 103 -1.024 -0.908 -5.834 778 HG23 ILE 103 3HG2 ILE 103 -1.001 0.704 -5.139 779 HD11 ILE 103 3HD1 ILE 103 -3.372 2.518 -5.601 780 HD12 ILE 103 1HD1 ILE 103 -2.431 3.914 -6.132 781 HD13 ILE 103 2HD1 ILE 103 -1.659 2.643 -5.185 782 H VAL 104 H VAL 104 -0.187 -1.989 -8.740 783 HA VAL 104 HA VAL 104 -1.969 -4.245 -7.912 784 HB VAL 104 HB VAL 104 0.311 -4.307 -9.929 785 HG11 VAL 104 1HG1 VAL 104 -0.674 -6.534 -10.500 786 HG12 VAL 104 2HG1 VAL 104 -1.809 -6.350 -9.164 787 HG13 VAL 104 3HG1 VAL 104 -0.080 -6.472 -8.843 788 HG21 VAL 104 3HG2 VAL 104 -2.692 -4.196 -10.383 789 HG22 VAL 104 1HG2 VAL 104 -1.500 -4.517 -11.638 790 HG23 VAL 104 2HG2 VAL 104 -1.527 -2.956 -10.824 791 H GLU 105 H GLU 105 -1.248 -5.373 -6.198 792 HA GLU 105 HA GLU 105 1.657 -5.484 -5.584 793 HB2 GLU 105 2HB GLU 105 0.691 -3.598 -4.273 794 HB3 GLU 105 1HB GLU 105 -0.461 -4.713 -3.540 795 HG2 GLU 105 2HG GLU 105 1.374 -6.008 -2.534 796 HG3 GLU 105 1HG GLU 105 2.565 -5.001 -3.350 797 H SER 106 H SER 106 2.242 -7.494 -5.198 798 HA SER 106 HA SER 106 0.255 -9.609 -4.622 799 HB2 SER 106 2HB SER 106 2.037 -11.139 -5.257 800 HB3 SER 106 1HB SER 106 1.922 -9.878 -6.484 801 HG SER 106 HG SER 106 3.611 -8.789 -5.227 802 H PHE 107 H PHE 107 0.552 -11.046 -2.808 803 HA PHE 107 HA PHE 107 2.497 -10.164 -0.724 804 HB2 PHE 107 2HB PHE 107 0.237 -9.183 -0.267 805 HB3 PHE 107 1HB PHE 107 -0.432 -10.810 -0.214 806 HD1 PHE 107 2HD PHE 107 2.170 -8.595 1.322 807 HD2 PHE 107 1HD PHE 107 -0.290 -12.090 1.858 808 HE1 PHE 107 2HE PHE 107 2.889 -8.748 3.688 809 HE2 PHE 107 1HE PHE 107 0.436 -12.229 4.222 810 HZ PHE 107 HZ PHE 107 2.023 -10.562 5.135 811 H ASP 108 H ASP 108 3.168 -11.773 0.674 812 HA ASP 108 HA ASP 108 2.847 -14.542 -0.316 813 HB2 ASP 108 2HB ASP 108 5.124 -13.571 -0.169 814 HB3 ASP 108 1HB ASP 108 4.917 -13.383 1.569 815 HA PRO 109 HA PRO 109 0.482 -14.635 3.704 816 HB2 PRO 109 2HB PRO 109 -1.349 -16.551 3.125 817 HB3 PRO 109 1HB PRO 109 -1.472 -14.927 2.410 818 HG2 PRO 109 2HG PRO 109 -0.285 -17.417 1.199 819 HG3 PRO 109 1HG PRO 109 -1.471 -16.298 0.487 820 HD2 PRO 109 2HD PRO 109 1.201 -16.115 -0.068 821 HD3 PRO 109 1HD PRO 109 0.168 -14.666 0.003 822 H GLU 110 H GLU 110 0.405 -16.109 5.430 823 HA GLU 110 HA GLU 110 2.552 -18.082 5.467 824 HB2 GLU 110 2HB GLU 110 0.574 -17.187 7.591 825 HB3 GLU 110 1HB GLU 110 1.936 -18.272 7.871 826 HG2 GLU 110 2HG GLU 110 3.497 -16.500 7.127 827 HG3 GLU 110 1HG GLU 110 2.134 -15.414 6.861 828 H GLU 111 H GLU 111 2.235 -20.244 6.170 829 HA GLU 111 HA GLU 111 -0.056 -21.548 4.923 830 HB2 GLU 111 2HB GLU 111 1.099 -23.640 5.545 831 HB3 GLU 111 1HB GLU 111 2.170 -22.532 4.690 832 HG2 GLU 111 2HG GLU 111 3.082 -21.774 6.902 833 HG3 GLU 111 1HG GLU 111 2.078 -22.983 7.697 834 H THR 112 H THR 112 1.098 -20.888 8.191 835 HA THR 112 HA THR 112 -0.678 -22.575 9.607 836 HB THR 112 HB THR 112 -0.104 -21.197 11.556 837 HG1 THR 112 1HG THR 112 -0.186 -19.227 10.140 838 HG21 THR 112 3HG2 THR 112 1.567 -22.823 10.717 839 HG22 THR 112 1HG2 THR 112 2.342 -21.413 11.437 840 HG23 THR 112 2HG2 THR 112 2.254 -21.569 9.685 841 H ASN 113 H ASN 113 -0.951 -19.129 8.691 842 HA ASN 113 HA ASN 113 -3.604 -18.916 9.878 843 HB2 ASN 113 2HB ASN 113 -1.950 -16.941 8.281 844 HB3 ASN 113 1HB ASN 113 -3.477 -16.561 9.076 845 HD21 ASN 113 1HD2 ASN 113 -2.966 -15.356 10.912 846 HD22 ASN 113 2HD2 ASN 113 -1.745 -15.750 12.021 847 HA PRO 114 HA PRO 114 -5.641 -19.984 6.000 848 HB2 PRO 114 2HB PRO 114 -8.154 -18.946 6.372 849 HB3 PRO 114 1HB PRO 114 -7.567 -20.342 7.310 850 HG2 PRO 114 2HG PRO 114 -7.553 -17.430 8.098 851 HG3 PRO 114 1HG PRO 114 -8.170 -18.816 9.021 852 HD2 PRO 114 2HD PRO 114 -5.702 -17.812 9.511 853 HD3 PRO 114 1HD PRO 114 -5.983 -19.569 9.571 854 H ARG 115 H ARG 115 -5.725 -19.121 3.998 855 HA ARG 115 HA ARG 115 -4.806 -16.496 3.482 856 HB2 ARG 115 2HB ARG 115 -6.135 -18.521 1.657 857 HB3 ARG 115 1HB ARG 115 -5.365 -17.037 1.091 858 HG2 ARG 115 2HG ARG 115 -3.220 -17.758 2.077 859 HG3 ARG 115 1HG ARG 115 -3.977 -19.243 2.654 860 HD2 ARG 115 2HD ARG 115 -3.800 -18.417 -0.266 861 HD3 ARG 115 1HD ARG 115 -2.735 -19.582 0.517 862 HE ARG 115 HE ARG 115 -5.384 -20.396 0.974 863 HH11 ARG 115 1HH2 ARG 115 -3.140 -20.000 -1.651 864 HH12 ARG 115 2HH2 ARG 115 -3.846 -21.257 -2.610 865 HH21 ARG 115 1HH1 ARG 115 -6.299 -22.029 -0.294 866 HH22 ARG 115 2HH1 ARG 115 -5.628 -22.399 -1.846 867 H GLU 116 H GLU 116 -8.077 -17.887 3.374 868 HA GLU 116 HA GLU 116 -9.475 -15.902 2.099 869 HB2 GLU 116 2HB GLU 116 -10.378 -18.084 2.875 870 HB3 GLU 116 1HB GLU 116 -10.436 -17.457 4.518 871 HG2 GLU 116 2HG GLU 116 -12.023 -15.696 3.798 872 HG3 GLU 116 1HG GLU 116 -11.935 -16.292 2.143 873 H LEU 117 H LEU 117 -8.729 -15.944 5.606 874 HA LEU 117 HA LEU 117 -10.177 -13.602 6.256 875 HB2 LEU 117 2HB LEU 117 -7.871 -15.086 7.519 876 HB3 LEU 117 1HB LEU 117 -8.428 -13.591 8.248 877 HG LEU 117 HG LEU 117 -9.462 -15.672 9.245 878 HD11 LEU 117 1HD1 LEU 117 -10.649 -13.279 9.042 879 HD12 LEU 117 2HD1 LEU 117 -11.507 -14.678 9.665 880 HD13 LEU 117 3HD1 LEU 117 -11.769 -14.165 8.003 881 HD21 LEU 117 3HD2 LEU 117 -11.032 -15.907 6.648 882 HD22 LEU 117 1HD2 LEU 117 -11.024 -17.016 8.018 883 HD23 LEU 117 2HD2 LEU 117 -9.609 -16.888 6.979 884 H GLN 118 H GLN 118 -6.693 -13.989 5.585 885 HA GLN 118 HA GLN 118 -6.151 -11.170 5.745 886 HB2 GLN 118 2HB GLN 118 -3.907 -11.825 4.781 887 HB3 GLN 118 1HB GLN 118 -4.351 -12.684 6.255 888 HG2 GLN 118 2HG GLN 118 -5.120 -14.601 4.917 889 HG3 GLN 118 1HG GLN 118 -4.684 -13.754 3.435 890 HE21 GLN 118 1HE2 GLN 118 -2.176 -12.634 4.301 891 HE22 GLN 118 2HE2 GLN 118 -1.095 -13.915 4.571 892 H GLN 119 H GLN 119 -6.980 -13.362 3.084 893 HA GLN 119 HA GLN 119 -6.248 -11.722 0.927 894 HB2 GLN 119 2HB GLN 119 -6.898 -14.082 0.700 895 HB3 GLN 119 1HB GLN 119 -8.544 -13.692 1.193 896 HG2 GLN 119 2HG GLN 119 -8.868 -12.320 -0.813 897 HG3 GLN 119 1HG GLN 119 -7.180 -12.540 -1.271 898 HE21 GLN 119 1HE2 GLN 119 -9.290 -13.334 -3.029 899 HE22 GLN 119 2HE2 GLN 119 -9.289 -15.029 -3.139 900 H SER 120 H SER 120 -9.314 -11.963 2.734 901 HA SER 120 HA SER 120 -10.646 -9.892 1.278 902 HB2 SER 120 2HB SER 120 -11.866 -11.609 2.561 903 HB3 SER 120 1HB SER 120 -11.208 -10.960 4.061 904 HG SER 120 HG SER 120 -13.301 -10.129 3.536 905 H GLY 121 H GLY 121 -8.407 -9.939 3.937 906 HA2 GLY 121 2HA GLY 121 -8.999 -7.426 5.105 907 HA3 GLY 121 1HA GLY 121 -7.462 -8.275 5.212 908 H TRP 122 H TRP 122 -6.508 -8.341 2.697 909 HA TRP 122 HA TRP 122 -5.521 -5.719 2.281 910 HB2 TRP 122 2HB TRP 122 -5.526 -8.100 0.390 911 HB3 TRP 122 1HB TRP 122 -4.561 -6.641 0.175 912 HD1 TRP 122 HD TRP 122 -4.360 -9.982 1.721 913 HE1 TRP 122 1HE TRP 122 -2.353 -10.133 3.329 914 HE3 TRP 122 3HE TRP 122 -3.152 -5.031 2.094 915 HZ2 TRP 122 2HZ TRP 122 -0.479 -8.389 4.602 916 HZ3 TRP 122 3HZ TRP 122 -1.249 -4.308 3.507 917 HH2 TRP 122 HH TRP 122 0.088 -5.978 4.761 918 H GLN 123 H GLN 123 -8.150 -7.523 0.742 919 HA GLN 123 HA GLN 123 -8.665 -5.576 -1.303 920 HB2 GLN 123 2HB GLN 123 -9.352 -7.988 -1.409 921 HB3 GLN 123 1HB GLN 123 -10.562 -7.665 -0.168 922 HG2 GLN 123 2HG GLN 123 -11.648 -6.005 -1.639 923 HG3 GLN 123 1HG GLN 123 -10.419 -6.279 -2.871 924 HE21 GLN 123 1HE2 GLN 123 -11.605 -7.326 -4.510 925 HE22 GLN 123 2HE2 GLN 123 -12.505 -8.745 -4.267 926 H ALA 124 H ALA 124 -9.895 -6.127 1.973 927 HA ALA 124 HA ALA 124 -12.082 -4.377 1.946 928 HB1 ALA 124 1HB ALA 124 -10.240 -5.046 4.253 929 HB2 ALA 124 2HB ALA 124 -11.654 -5.977 3.759 930 HB3 ALA 124 3HB ALA 124 -11.854 -4.348 4.399 931 H ILE 125 H ILE 125 -8.730 -3.702 3.014 932 HA ILE 125 HA ILE 125 -9.174 -0.965 3.592 933 HB ILE 125 HB ILE 125 -7.287 -2.158 4.534 934 HG12 ILE 125 2HG1 ILE 125 -6.138 -0.112 2.574 935 HG13 ILE 125 1HG1 ILE 125 -7.062 0.346 4.000 936 HG21 ILE 125 1HG2 ILE 125 -6.894 -3.722 2.674 937 HG22 ILE 125 2HG2 ILE 125 -5.403 -2.931 3.154 938 HG23 ILE 125 3HG2 ILE 125 -6.242 -2.412 1.699 939 HD11 ILE 125 3HD1 ILE 125 -5.432 -0.847 5.434 940 HD12 ILE 125 1HD1 ILE 125 -4.652 0.410 4.473 941 HD13 ILE 125 2HD1 ILE 125 -4.505 -1.283 3.997 942 H LEU 126 H LEU 126 -8.191 -2.643 0.644 943 HA LEU 126 HA LEU 126 -7.525 -0.343 -0.872 944 HB2 LEU 126 2HB LEU 126 -8.390 -3.152 -1.583 945 HB3 LEU 126 1HB LEU 126 -8.093 -1.968 -2.851 946 HG LEU 126 HG LEU 126 -6.047 -2.721 -0.717 947 HD11 LEU 126 1HD1 LEU 126 -6.332 -3.695 -3.575 948 HD12 LEU 126 2HD1 LEU 126 -6.465 -4.647 -2.094 949 HD13 LEU 126 3HD1 LEU 126 -4.910 -3.962 -2.563 950 HD21 LEU 126 3HD2 LEU 126 -6.057 -0.697 -2.926 951 HD22 LEU 126 1HD2 LEU 126 -4.583 -1.654 -2.795 952 HD23 LEU 126 2HD2 LEU 126 -5.160 -0.723 -1.422 953 H ASN 127 H ASN 127 -10.599 -1.986 -0.264 954 HA ASN 127 HA ASN 127 -12.158 -0.638 -2.195 955 HB2 ASN 127 2HB ASN 127 -13.025 -1.683 0.519 956 HB3 ASN 127 1HB ASN 127 -14.093 -1.296 -0.830 957 HD21 ASN 127 1HD2 ASN 127 -13.353 -3.971 0.565 958 HD22 ASN 127 2HD2 ASN 127 -12.951 -4.989 -0.731 959 H SER 128 H SER 128 -11.052 0.336 0.993 960 HA SER 128 HA SER 128 -12.803 2.441 1.531 961 HB2 SER 128 2HB SER 128 -9.833 2.393 2.151 962 HB3 SER 128 1HB SER 128 -11.061 3.348 2.978 963 HG SER 128 HG SER 128 -12.064 1.327 3.529 964 H PHE 129 H PHE 129 -9.990 2.361 -0.589 965 HA PHE 129 HA PHE 129 -9.763 5.148 -1.091 966 HB2 PHE 129 2HB PHE 129 -9.036 2.719 -2.766 967 HB3 PHE 129 1HB PHE 129 -8.664 4.361 -3.281 968 HD1 PHE 129 1HD PHE 129 -8.175 1.944 -0.457 969 HD2 PHE 129 2HD PHE 129 -6.672 5.461 -2.434 970 HE1 PHE 129 1HE PHE 129 -6.142 1.876 0.952 971 HE2 PHE 129 2HE PHE 129 -4.649 5.384 -1.015 972 HZ PHE 129 HZ PHE 129 -4.384 3.596 0.676 973 H LYS 130 H LYS 130 -11.652 2.593 -2.715 974 HA LYS 130 HA LYS 130 -12.714 4.219 -4.782 975 HB2 LYS 130 2HB LYS 130 -13.849 1.740 -3.439 976 HB3 LYS 130 1HB LYS 130 -14.477 2.444 -4.931 977 HG2 LYS 130 2HG LYS 130 -12.286 2.116 -6.020 978 HG3 LYS 130 1HG LYS 130 -11.646 1.419 -4.531 979 HD2 LYS 130 2HD LYS 130 -13.345 -0.387 -4.660 980 HD3 LYS 130 1HD LYS 130 -13.949 0.303 -6.166 981 HE2 LYS 130 2HE LYS 130 -11.136 -0.736 -5.703 982 HE3 LYS 130 1HE LYS 130 -12.397 -1.553 -6.627 983 HZ1 LYS 130 3HZ LYS 130 -10.925 0.913 -7.278 984 HZ2 LYS 130 1HZ LYS 130 -12.467 0.647 -7.937 985 HZ3 LYS 130 2HZ LYS 130 -11.210 -0.453 -8.247 986 H SER 131 H SER 131 -13.936 3.403 -1.539 987 HA SER 131 HA SER 131 -16.385 4.787 -1.703 988 HB2 SER 131 2HB SER 131 -14.666 4.267 0.737 989 HB3 SER 131 1HB SER 131 -16.372 4.711 0.753 990 HG SER 131 HG SER 131 -16.854 2.792 -0.266 991 H TYR 132 H TYR 132 -13.129 5.862 -0.818 992 HA TYR 132 HA TYR 132 -13.817 8.410 0.188 993 HB2 TYR 132 2HB TYR 132 -11.582 7.381 0.469 994 HB3 TYR 132 1HB TYR 132 -11.283 7.562 -1.256 995 HD1 TYR 132 2HD TYR 132 -11.665 9.374 1.957 996 HD2 TYR 132 1HD TYR 132 -10.861 9.788 -2.249 997 HE1 TYR 132 2HE TYR 132 -10.901 11.702 2.328 998 HE2 TYR 132 1HE TYR 132 -10.101 12.117 -1.871 999 HH TYR 132 HH TYR 132 -10.116 13.833 -0.367 1000 H THR 133 H THR 133 -12.903 7.385 -3.119 1001 HA THR 133 HA THR 133 -13.089 9.940 -4.313 1002 HB THR 133 HB THR 133 -13.220 8.658 -6.440 1003 HG1 THR 133 1HG THR 133 -14.392 6.909 -6.020 1004 HG21 THR 133 3HG2 THR 133 -11.235 7.563 -4.433 1005 HG22 THR 133 1HG2 THR 133 -11.030 9.030 -5.390 1006 HG23 THR 133 2HG2 THR 133 -11.080 7.457 -6.186 1007 H GLU 134 H GLU 134 -15.503 7.475 -3.613 1008 HA GLU 134 HA GLU 134 -17.575 8.358 -5.286 1009 HB2 GLU 134 2HB GLU 134 -17.523 6.218 -3.953 1010 HB3 GLU 134 1HB GLU 134 -17.888 7.156 -2.512 1011 HG2 GLU 134 2HG GLU 134 -20.011 7.903 -3.493 1012 HG3 GLU 134 1HG GLU 134 -19.640 7.062 -4.994 1013 H ASN 135 H ASN 135 -16.113 9.901 -2.648 1014 HA ASN 135 HA ASN 135 -18.231 11.346 -1.496 1015 HB2 ASN 135 2HB ASN 135 -16.534 12.839 -0.623 1016 HB3 ASN 135 1HB ASN 135 -15.891 11.197 -0.597 1017 HD21 ASN 135 1HD2 ASN 135 -15.390 11.200 -3.567 1018 HD22 ASN 135 2HD2 ASN 135 -14.032 12.192 -3.790 1019 H ASN 136 H ASN 136 -17.234 11.412 -4.672 1020 HA ASN 136 HA ASN 136 -17.301 14.149 -5.337 1021 HB2 ASN 136 2HB ASN 136 -18.106 11.765 -7.034 1022 HB3 ASN 136 1HB ASN 136 -17.690 13.372 -7.631 1023 HD21 ASN 136 1HD2 ASN 136 -15.466 13.722 -5.655 1024 HD22 ASN 136 2HD2 ASN 136 -14.218 12.705 -6.191 1025 H LEU 137 H LEU 137 -19.767 12.027 -4.315 1026 HA LEU 137 HA LEU 137 -22.013 12.163 -4.102 1027 HB2 LEU 137 2HB LEU 137 -21.470 14.234 -2.900 1028 HB3 LEU 137 1HB LEU 137 -21.427 15.125 -4.413 1029 HG LEU 137 HG LEU 137 -23.852 14.628 -4.751 1030 HD11 LEU 137 1HD1 LEU 137 -25.107 13.825 -2.623 1031 HD12 LEU 137 2HD1 LEU 137 -23.545 13.206 -2.089 1032 HD13 LEU 137 3HD1 LEU 137 -24.276 12.606 -3.578 1033 HD21 LEU 137 3HD2 LEU 137 -23.148 16.726 -3.672 1034 HD22 LEU 137 1HD2 LEU 137 -23.177 15.929 -2.098 1035 HD23 LEU 137 2HD2 LEU 137 -24.676 16.161 -2.995 1036 H GLU 138 H GLU 138 -21.648 14.897 -6.331 1037 HA GLU 138 HA GLU 138 -23.772 14.172 -8.016 1038 HB2 GLU 138 2HB GLU 138 -21.309 15.835 -8.638 1039 HB3 GLU 138 1HB GLU 138 -22.791 15.813 -9.595 1040 HG2 GLU 138 2HG GLU 138 -24.070 16.641 -7.660 1041 HG3 GLU 138 1HG GLU 138 -22.607 16.642 -6.680 1042 H HIS 139 H HIS 139 -20.298 13.503 -8.213 1043 HA HIS 139 HA HIS 139 -19.060 12.098 -9.533 1044 HB2 HIS 139 2HB HIS 139 -20.486 10.448 -8.307 1045 HB3 HIS 139 1HB HIS 139 -21.646 10.500 -9.632 1046 HD2 HIS 139 2HD HIS 139 -17.929 9.258 -9.023 1047 HE1 HIS 139 1HE HIS 139 -19.363 7.522 -12.593 1048 HE2 HIS 139 2HE HIS 139 -17.432 7.565 -10.947 1049 H HIS 140 H HIS 140 -20.954 14.184 -10.772 1050 HA HIS 140 HA HIS 140 -21.846 13.275 -13.283 1051 HB2 HIS 140 2HB HIS 140 -22.508 15.447 -12.253 1052 HB3 HIS 140 1HB HIS 140 -20.884 16.065 -12.544 1053 HD2 HIS 140 2HD HIS 140 -20.570 17.178 -15.072 1054 HE1 HIS 140 1HE HIS 140 -24.018 15.533 -16.868 1055 HE2 HIS 140 2HE HIS 140 -22.056 17.106 -17.219 1056 H HIS 141 H HIS 141 -20.912 13.290 -15.316 1057 HA HIS 141 HA HIS 141 -18.139 14.115 -15.730 1058 HB2 HIS 141 2HB HIS 141 -17.433 11.842 -16.473 1059 HB3 HIS 141 1HB HIS 141 -17.824 11.887 -14.755 1060 HD2 HIS 141 2HD HIS 141 -19.351 10.429 -18.086 1061 HE1 HIS 141 1HE HIS 141 -21.514 8.845 -14.825 1062 HE2 HIS 141 2HE HIS 141 -21.184 8.726 -17.341 1063 H HIS 142 H HIS 142 -17.638 14.369 -17.899 1064 HA HIS 142 HA HIS 142 -19.911 14.590 -19.720 1065 HB2 HIS 142 2HB HIS 142 -16.955 15.159 -20.147 1066 HB3 HIS 142 1HB HIS 142 -18.270 15.623 -21.228 1067 HD2 HIS 142 2HD HIS 142 -16.428 17.048 -18.197 1068 HE1 HIS 142 1HE HIS 142 -20.041 19.212 -18.474 1069 HE2 HIS 142 2HE HIS 142 -17.764 19.126 -17.354 1070 H HIS 143 H HIS 143 -20.559 12.912 -20.932 1071 HA HIS 143 HA HIS 143 -20.580 10.920 -22.076 1072 HB2 HIS 143 2HB HIS 143 -17.815 11.901 -22.864 1073 HB3 HIS 143 1HB HIS 143 -18.687 10.599 -23.672 1074 HD2 HIS 143 2HD HIS 143 -20.867 11.453 -25.296 1075 HE1 HIS 143 1HE HIS 143 -20.140 15.587 -24.847 1076 HE2 HIS 143 2HE HIS 143 -21.480 13.851 -26.129 1077 H HIS 144 H HIS 144 -17.089 10.709 -21.618 1078 HA HIS 144 HA HIS 144 -17.185 8.056 -20.641 1079 HB2 HIS 144 2HB HIS 144 -14.958 10.105 -20.367 1080 HB3 HIS 144 1HB HIS 144 -14.789 8.357 -20.195 1081 HD2 HIS 144 2HD HIS 144 -14.956 6.899 -22.658 1082 HE1 HIS 144 1HE HIS 144 -14.929 10.311 -25.146 1083 HE2 HIS 144 2HE HIS 144 -14.755 7.777 -25.110 Start of MODEL 2 1 H1 GLY 1 1HT GLY 1 -4.394 -17.246 -5.152 2 H2 GLY 1 2HT GLY 1 -5.687 -18.340 -5.026 3 H3 GLY 1 3HT GLY 1 -4.319 -18.742 -5.949 4 HA2 GLY 1 2HA GLY 1 -4.447 -18.425 -2.996 5 HA3 GLY 1 1HA GLY 1 -4.205 -19.927 -3.887 6 H ASN 2 H ASN 2 -2.414 -18.853 -1.919 7 HA ASN 2 HA ASN 2 -0.190 -18.442 -1.555 8 HB2 ASN 2 2HB ASN 2 0.056 -20.514 -2.864 9 HB3 ASN 2 1HB ASN 2 0.088 -19.579 -4.350 10 HD21 ASN 2 1HD2 ASN 2 2.102 -20.999 -2.044 11 HD22 ASN 2 2HD2 ASN 2 3.509 -20.103 -2.356 12 H LYS 3 H LYS 3 -0.044 -17.837 -5.041 13 HA LYS 3 HA LYS 3 1.277 -15.305 -4.659 14 HB2 LYS 3 2HB LYS 3 0.133 -16.603 -7.156 15 HB3 LYS 3 1HB LYS 3 1.172 -15.175 -7.131 16 HG2 LYS 3 2HG LYS 3 2.964 -16.485 -6.051 17 HG3 LYS 3 1HG LYS 3 1.931 -17.917 -6.065 18 HD2 LYS 3 2HD LYS 3 1.838 -17.811 -8.546 19 HD3 LYS 3 1HD LYS 3 2.900 -16.401 -8.514 20 HE2 LYS 3 2HE LYS 3 3.593 -19.166 -7.468 21 HE3 LYS 3 1HE LYS 3 4.200 -18.444 -8.959 22 HZ1 LYS 3 3HZ LYS 3 5.871 -17.873 -7.558 23 HZ2 LYS 3 1HZ LYS 3 4.877 -17.832 -6.184 24 HZ3 LYS 3 2HZ LYS 3 4.857 -16.538 -7.285 25 H ILE 4 H ILE 4 -0.961 -14.955 -3.235 26 HA ILE 4 HA ILE 4 -3.336 -14.174 -4.390 27 HB ILE 4 HB ILE 4 -1.946 -12.778 -2.072 28 HG12 ILE 4 2HG1 ILE 4 -3.960 -15.079 -2.009 29 HG13 ILE 4 1HG1 ILE 4 -2.223 -15.319 -1.860 30 HG21 ILE 4 1HG2 ILE 4 -3.877 -11.463 -2.874 31 HG22 ILE 4 2HG2 ILE 4 -4.339 -12.257 -1.378 32 HG23 ILE 4 3HG2 ILE 4 -4.877 -12.911 -2.922 33 HD11 ILE 4 3HD1 ILE 4 -3.221 -15.247 0.364 34 HD12 ILE 4 1HD1 ILE 4 -3.963 -13.689 0.013 35 HD13 ILE 4 2HD1 ILE 4 -2.211 -13.823 0.137 36 H THR 5 H THR 5 -4.086 -12.413 -5.485 37 HA THR 5 HA THR 5 -2.279 -10.110 -5.999 38 HB THR 5 HB THR 5 -2.027 -11.550 -7.937 39 HG1 THR 5 1HG THR 5 -2.401 -9.284 -8.276 40 HG21 THR 5 3HG2 THR 5 -5.057 -11.577 -8.118 41 HG22 THR 5 1HG2 THR 5 -4.061 -12.941 -7.615 42 HG23 THR 5 2HG2 THR 5 -3.944 -12.318 -9.258 43 H VAL 6 H VAL 6 -3.288 -8.200 -6.049 44 HA VAL 6 HA VAL 6 -6.243 -8.044 -6.130 45 HB VAL 6 HB VAL 6 -6.157 -6.418 -4.212 46 HG11 VAL 6 1HG1 VAL 6 -6.028 -8.121 -2.445 47 HG12 VAL 6 2HG1 VAL 6 -5.178 -9.211 -3.542 48 HG13 VAL 6 3HG1 VAL 6 -6.854 -8.767 -3.864 49 HG21 VAL 6 3HG2 VAL 6 -3.756 -5.845 -4.310 50 HG22 VAL 6 1HG2 VAL 6 -3.330 -7.503 -3.898 51 HG23 VAL 6 2HG2 VAL 6 -4.157 -6.488 -2.718 52 H GLU 7 H GLU 7 -6.998 -5.931 -6.637 53 HA GLU 7 HA GLU 7 -5.053 -3.976 -7.657 54 HB2 GLU 7 2HB GLU 7 -6.182 -3.903 -9.881 55 HB3 GLU 7 1HB GLU 7 -5.382 -5.445 -9.582 56 HG2 GLU 7 2HG GLU 7 -7.544 -6.440 -8.897 57 HG3 GLU 7 1HG GLU 7 -8.353 -4.909 -9.216 58 H VAL 8 H VAL 8 -6.060 -1.926 -8.239 59 HA VAL 8 HA VAL 8 -8.832 -1.493 -7.345 60 HB VAL 8 HB VAL 8 -7.579 -1.159 -5.284 61 HG11 VAL 8 1HG1 VAL 8 -5.760 0.505 -5.133 62 HG12 VAL 8 2HG1 VAL 8 -5.853 0.761 -6.872 63 HG13 VAL 8 3HG1 VAL 8 -5.358 -0.806 -6.236 64 HG21 VAL 8 3HG2 VAL 8 -9.424 0.481 -5.892 65 HG22 VAL 8 1HG2 VAL 8 -8.172 1.599 -6.432 66 HG23 VAL 8 2HG2 VAL 8 -8.245 1.103 -4.743 67 H THR 9 H THR 9 -9.803 0.218 -8.397 68 HA THR 9 HA THR 9 -8.287 1.432 -10.642 69 HB THR 9 HB THR 9 -11.282 1.428 -10.067 70 HG1 THR 9 1HG THR 9 -11.076 -0.076 -11.964 71 HG21 THR 9 3HG2 THR 9 -11.446 2.027 -12.466 72 HG22 THR 9 1HG2 THR 9 -9.691 2.110 -12.559 73 HG23 THR 9 2HG2 THR 9 -10.578 3.261 -11.558 74 H VAL 10 H VAL 10 -7.447 3.429 -10.291 75 HA VAL 10 HA VAL 10 -8.882 5.322 -8.468 76 HB VAL 10 HB VAL 10 -5.888 5.089 -8.965 77 HG11 VAL 10 1HG1 VAL 10 -6.535 7.400 -8.464 78 HG12 VAL 10 2HG1 VAL 10 -5.788 6.713 -7.025 79 HG13 VAL 10 3HG1 VAL 10 -7.541 6.866 -7.119 80 HG21 VAL 10 3HG2 VAL 10 -6.741 3.202 -7.629 81 HG22 VAL 10 1HG2 VAL 10 -7.579 4.322 -6.553 82 HG23 VAL 10 2HG2 VAL 10 -5.817 4.296 -6.604 83 H TYR 11 H TYR 11 -9.543 7.149 -9.444 84 HA TYR 11 HA TYR 11 -8.690 7.701 -12.224 85 HB2 TYR 11 2HB TYR 11 -10.843 8.994 -10.524 86 HB3 TYR 11 1HB TYR 11 -10.562 9.277 -12.243 87 HD1 TYR 11 2HD TYR 11 -11.794 6.841 -9.734 88 HD2 TYR 11 1HD TYR 11 -11.131 7.546 -13.928 89 HE1 TYR 11 2HE TYR 11 -13.204 4.880 -10.292 90 HE2 TYR 11 1HE TYR 11 -12.543 5.580 -14.475 91 HH TYR 11 HH TYR 11 -13.696 3.396 -11.988 92 H ALA 12 H ALA 12 -6.561 8.428 -11.701 93 HA ALA 12 HA ALA 12 -6.347 11.252 -11.344 94 HB1 ALA 12 1HB ALA 12 -6.682 10.653 -8.974 95 HB2 ALA 12 2HB ALA 12 -5.046 11.245 -9.246 96 HB3 ALA 12 3HB ALA 12 -5.339 9.514 -9.068 97 H ALA 13 H ALA 13 -4.208 12.000 -11.749 98 HA ALA 13 HA ALA 13 -2.678 10.367 -13.497 99 HB1 ALA 13 1HB ALA 13 -1.919 12.925 -12.054 100 HB2 ALA 13 2HB ALA 13 -2.697 12.822 -13.633 101 HB3 ALA 13 3HB ALA 13 -1.050 12.225 -13.422 102 H ILE 14 H ILE 14 -0.948 9.043 -13.114 103 HA ILE 14 HA ILE 14 -0.451 7.958 -10.604 104 HB ILE 14 HB ILE 14 0.184 6.889 -12.730 105 HG12 ILE 14 2HG1 ILE 14 2.609 7.257 -10.906 106 HG13 ILE 14 1HG1 ILE 14 1.243 6.218 -10.511 107 HG21 ILE 14 1HG2 ILE 14 2.163 7.580 -13.967 108 HG22 ILE 14 2HG2 ILE 14 2.545 8.819 -12.777 109 HG23 ILE 14 3HG2 ILE 14 1.119 8.991 -13.804 110 HD11 ILE 14 3HD1 ILE 14 3.076 4.938 -11.495 111 HD12 ILE 14 1HD1 ILE 14 3.020 5.939 -12.940 112 HD13 ILE 14 2HD1 ILE 14 1.653 4.903 -12.537 113 H GLU 15 H GLU 15 0.999 10.773 -12.124 114 HA GLU 15 HA GLU 15 3.263 11.076 -10.499 115 HB2 GLU 15 2HB GLU 15 2.772 12.316 -12.629 116 HB3 GLU 15 1HB GLU 15 1.561 13.255 -11.767 117 HG2 GLU 15 2HG GLU 15 3.614 14.562 -11.852 118 HG3 GLU 15 1HG GLU 15 3.379 14.041 -10.191 119 H LYS 16 H LYS 16 -0.106 12.122 -10.050 120 HA LYS 16 HA LYS 16 0.400 13.590 -7.622 121 HB2 LYS 16 2HB LYS 16 -1.545 14.047 -9.122 122 HB3 LYS 16 1HB LYS 16 -2.221 12.476 -8.694 123 HG2 LYS 16 2HG LYS 16 -2.356 13.146 -6.331 124 HG3 LYS 16 1HG LYS 16 -1.597 14.694 -6.704 125 HD2 LYS 16 2HD LYS 16 -3.506 15.256 -8.184 126 HD3 LYS 16 1HD LYS 16 -4.267 13.717 -7.773 127 HE2 LYS 16 2HE LYS 16 -3.546 15.870 -5.747 128 HE3 LYS 16 1HE LYS 16 -5.158 15.623 -6.415 129 HZ1 LYS 16 3HZ LYS 16 -3.663 13.462 -5.050 130 HZ2 LYS 16 1HZ LYS 16 -5.314 13.514 -5.429 131 HZ3 LYS 16 2HZ LYS 16 -4.689 14.526 -4.217 132 H VAL 17 H VAL 17 -0.978 10.381 -8.384 133 HA VAL 17 HA VAL 17 -1.479 9.586 -5.720 134 HB VAL 17 HB VAL 17 -0.838 7.840 -8.121 135 HG11 VAL 17 1HG1 VAL 17 -0.740 6.539 -6.045 136 HG12 VAL 17 2HG1 VAL 17 -2.240 6.158 -6.878 137 HG13 VAL 17 3HG1 VAL 17 -2.259 7.246 -5.492 138 HG21 VAL 17 3HG2 VAL 17 -3.308 7.754 -8.400 139 HG22 VAL 17 1HG2 VAL 17 -2.690 9.397 -8.582 140 HG23 VAL 17 2HG2 VAL 17 -3.491 8.914 -7.084 141 H TRP 18 H TRP 18 1.354 9.132 -7.822 142 HA TRP 18 HA TRP 18 2.880 7.485 -6.177 143 HB2 TRP 18 2HB TRP 18 3.489 8.071 -8.510 144 HB3 TRP 18 1HB TRP 18 3.868 9.713 -7.994 145 HD1 TRP 18 HD TRP 18 5.915 9.944 -6.170 146 HE1 TRP 18 1HE TRP 18 8.045 8.512 -5.906 147 HE3 TRP 18 3HE TRP 18 4.515 5.810 -8.808 148 HZ2 TRP 18 2HZ TRP 18 9.020 5.941 -6.716 149 HZ3 TRP 18 3HZ TRP 18 6.055 3.885 -9.046 150 HH2 TRP 18 HH TRP 18 8.298 3.946 -8.000 151 H LYS 19 H LYS 19 2.456 11.008 -6.083 152 HA LYS 19 HA LYS 19 4.501 11.587 -4.230 153 HB2 LYS 19 2HB LYS 19 3.299 13.272 -5.629 154 HB3 LYS 19 1HB LYS 19 1.866 13.052 -4.628 155 HG2 LYS 19 2HG LYS 19 3.146 13.782 -2.637 156 HG3 LYS 19 1HG LYS 19 4.580 13.980 -3.639 157 HD2 LYS 19 2HD LYS 19 3.401 15.692 -4.981 158 HD3 LYS 19 1HD LYS 19 1.969 15.493 -3.970 159 HE2 LYS 19 2HE LYS 19 3.265 16.201 -1.987 160 HE3 LYS 19 1HE LYS 19 4.699 16.401 -2.994 161 HZ1 LYS 19 3HZ LYS 19 2.141 17.875 -3.308 162 HZ2 LYS 19 1HZ LYS 19 3.516 18.067 -4.282 163 HZ3 LYS 19 2HZ LYS 19 3.573 18.499 -2.640 164 H TYR 20 H TYR 20 0.971 11.095 -3.692 165 HA TYR 20 HA TYR 20 1.183 11.205 -0.837 166 HB2 TYR 20 2HB TYR 20 -1.005 10.134 -2.642 167 HB3 TYR 20 1HB TYR 20 -1.160 10.320 -0.898 168 HD1 TYR 20 1HD TYR 20 -0.619 12.669 0.112 169 HD2 TYR 20 2HD TYR 20 -1.558 12.042 -4.043 170 HE1 TYR 20 1HE TYR 20 -1.203 15.065 -0.127 171 HE2 TYR 20 2HE TYR 20 -2.131 14.442 -4.266 172 HH TYR 20 HH TYR 20 -2.763 16.314 -2.941 173 H TRP 21 H TRP 21 1.075 8.539 -3.177 174 HA TRP 21 HA TRP 21 0.813 6.431 -1.362 175 HB2 TRP 21 2HB TRP 21 0.576 6.298 -3.872 176 HB3 TRP 21 1HB TRP 21 2.332 6.361 -4.004 177 HD1 TRP 21 HD TRP 21 3.542 4.059 -3.822 178 HE1 TRP 21 1HE TRP 21 2.854 1.700 -3.046 179 HE3 TRP 21 3HE TRP 21 -1.147 5.052 -2.105 180 HZ2 TRP 21 2HZ TRP 21 0.586 0.404 -1.843 181 HZ3 TRP 21 3HZ TRP 21 -2.557 3.255 -1.155 182 HH2 TRP 21 HH TRP 21 -1.700 0.932 -1.021 183 H ASN 22 H ASN 22 3.437 8.529 -1.931 184 HA ASN 22 HA ASN 22 5.383 6.757 -0.519 185 HB2 ASN 22 2HB ASN 22 5.894 9.057 -2.429 186 HB3 ASN 22 1HB ASN 22 7.142 8.123 -1.603 187 HD21 ASN 22 1HD2 ASN 22 4.134 7.059 -3.305 188 HD22 ASN 22 2HD2 ASN 22 4.951 6.022 -4.372 189 H GLU 23 H GLU 23 3.841 9.933 -0.533 190 HA GLU 23 HA GLU 23 5.549 11.356 1.147 191 HB2 GLU 23 2HB GLU 23 3.577 12.322 -0.004 192 HB3 GLU 23 1HB GLU 23 2.538 11.514 1.148 193 HG2 GLU 23 2HG GLU 23 2.851 13.848 1.808 194 HG3 GLU 23 1HG GLU 23 3.631 12.806 2.992 195 HA PRO 24 HA PRO 24 5.009 8.410 4.671 196 HB2 PRO 24 2HB PRO 24 6.738 10.455 6.089 197 HB3 PRO 24 1HB PRO 24 6.905 8.683 6.045 198 HG2 PRO 24 2HG PRO 24 8.547 10.165 4.591 199 HG3 PRO 24 1HG PRO 24 7.824 8.713 3.870 200 HD2 PRO 24 2HD PRO 24 6.975 11.593 3.484 201 HD3 PRO 24 1HD PRO 24 7.205 10.315 2.272 202 H ALA 25 H ALA 25 4.903 11.931 5.101 203 HA ALA 25 HA ALA 25 3.420 12.037 7.461 204 HB1 ALA 25 1HB ALA 25 4.582 13.967 6.474 205 HB2 ALA 25 2HB ALA 25 2.893 14.342 6.828 206 HB3 ALA 25 3HB ALA 25 3.396 14.013 5.169 207 H HIS 26 H HIS 26 2.357 11.458 4.168 208 HA HIS 26 HA HIS 26 -0.455 11.935 4.747 209 HB2 HIS 26 2HB HIS 26 0.589 12.229 2.475 210 HB3 HIS 26 1HB HIS 26 0.756 10.479 2.376 211 HD2 HIS 26 2HD HIS 26 -1.522 9.180 1.494 212 HE1 HIS 26 1HE HIS 26 -4.207 12.415 1.872 213 HE2 HIS 26 2HE HIS 26 -3.957 10.019 1.066 214 H ILE 27 H ILE 27 1.660 9.068 4.508 215 HA ILE 27 HA ILE 27 -0.382 7.110 4.536 216 HB ILE 27 HB ILE 27 2.480 6.972 5.566 217 HG12 ILE 27 2HG1 ILE 27 1.267 6.066 2.910 218 HG13 ILE 27 1HG1 ILE 27 2.151 7.575 3.121 219 HG21 ILE 27 1HG2 ILE 27 0.484 4.747 4.937 220 HG22 ILE 27 2HG2 ILE 27 1.204 5.085 6.508 221 HG23 ILE 27 3HG2 ILE 27 2.199 4.470 5.207 222 HD11 ILE 27 3HD1 ILE 27 3.239 4.764 3.466 223 HD12 ILE 27 1HD1 ILE 27 4.137 6.216 3.918 224 HD13 ILE 27 2HD1 ILE 27 3.695 5.937 2.231 225 H MET 28 H MET 28 1.410 8.612 7.242 226 HA MET 28 HA MET 28 0.373 7.084 9.315 227 HB2 MET 28 2HB MET 28 0.804 9.166 10.760 228 HB3 MET 28 1HB MET 28 2.179 8.552 9.838 229 HG2 MET 28 2HG MET 28 1.916 10.257 8.159 230 HG3 MET 28 1HG MET 28 0.353 10.755 8.810 231 HE1 MET 28 3HE MET 28 4.014 10.205 9.431 232 HE2 MET 28 1HE MET 28 3.677 9.984 11.154 233 HE3 MET 28 2HE MET 28 4.519 11.425 10.596 234 H LYS 29 H LYS 29 -1.287 9.444 7.389 235 HA LYS 29 HA LYS 29 -3.361 10.099 9.280 236 HB2 LYS 29 2HB LYS 29 -3.385 10.295 6.250 237 HB3 LYS 29 1HB LYS 29 -4.496 11.098 7.361 238 HG2 LYS 29 2HG LYS 29 -2.561 12.277 8.413 239 HG3 LYS 29 1HG LYS 29 -1.493 11.519 7.229 240 HD2 LYS 29 2HD LYS 29 -2.733 12.606 5.396 241 HD3 LYS 29 1HD LYS 29 -3.815 13.358 6.569 242 HE2 LYS 29 2HE LYS 29 -1.881 14.531 7.589 243 HE3 LYS 29 1HE LYS 29 -0.817 13.799 6.386 244 HZ1 LYS 29 3HZ LYS 29 -3.116 15.093 5.252 245 HZ2 LYS 29 1HZ LYS 29 -1.478 15.234 4.835 246 HZ3 LYS 29 2HZ LYS 29 -2.111 16.158 6.113 247 H TRP 30 H TRP 30 -3.026 7.719 6.672 248 HA TRP 30 HA TRP 30 -5.564 6.394 7.548 249 HB2 TRP 30 2HB TRP 30 -5.989 5.778 5.232 250 HB3 TRP 30 1HB TRP 30 -5.800 7.525 5.342 251 HD1 TRP 30 HD TRP 30 -3.464 8.568 4.426 252 HE1 TRP 30 1HE TRP 30 -1.811 7.684 2.659 253 HE3 TRP 30 3HE TRP 30 -4.973 3.681 4.149 254 HZ2 TRP 30 2HZ TRP 30 -1.211 5.233 1.306 255 HZ3 TRP 30 3HZ TRP 30 -3.844 2.106 2.627 256 HH2 TRP 30 HH TRP 30 -1.967 2.870 1.199 257 H CYS 31 H CYS 31 -2.547 5.883 8.210 258 HA CYS 31 HA CYS 31 -1.768 3.518 6.899 259 HB2 CYS 31 2HB CYS 31 -0.332 4.963 8.398 260 HB3 CYS 31 1HB CYS 31 -1.124 4.232 9.784 261 HG CYS 31 HG CYS 31 0.923 2.868 7.936 262 H GLN 32 H GLN 32 -2.311 1.439 7.139 263 HA GLN 32 HA GLN 32 -3.347 -0.474 7.821 264 HB2 GLN 32 2HB GLN 32 -3.877 0.913 10.477 265 HB3 GLN 32 1HB GLN 32 -3.971 -0.809 10.152 266 HG2 GLN 32 2HG GLN 32 -1.576 -0.882 9.634 267 HG3 GLN 32 1HG GLN 32 -1.454 0.855 9.884 268 HE21 GLN 32 1HE2 GLN 32 -1.110 -2.137 11.463 269 HE22 GLN 32 2HE2 GLN 32 -1.135 -1.561 13.059 270 H ALA 33 H ALA 33 -4.990 2.563 8.418 271 HA ALA 33 HA ALA 33 -7.170 3.248 8.158 272 HB1 ALA 33 1HB ALA 33 -7.255 0.936 6.203 273 HB2 ALA 33 2HB ALA 33 -6.656 2.549 5.824 274 HB3 ALA 33 3HB ALA 33 -8.357 2.311 6.233 275 H SER 34 H SER 34 -6.435 1.013 10.066 276 HA SER 34 HA SER 34 -9.049 -0.362 10.408 277 HB2 SER 34 2HB SER 34 -6.320 -0.959 11.538 278 HB3 SER 34 1HB SER 34 -7.787 -1.885 11.851 279 HG SER 34 HG SER 34 -6.144 -2.242 9.889 280 HA PRO 35 HA PRO 35 -9.484 2.884 13.739 281 HB2 PRO 35 2HB PRO 35 -11.808 1.046 14.408 282 HB3 PRO 35 1HB PRO 35 -11.773 2.826 14.352 283 HG2 PRO 35 2HG PRO 35 -12.865 1.485 12.347 284 HG3 PRO 35 1HG PRO 35 -11.800 2.867 12.001 285 HD2 PRO 35 2HD PRO 35 -11.153 -0.091 11.799 286 HD3 PRO 35 1HD PRO 35 -10.692 1.253 10.713 287 H GLU 36 H GLU 36 -9.437 -0.582 14.101 288 HA GLU 36 HA GLU 36 -9.089 -0.673 16.962 289 HB2 GLU 36 2HB GLU 36 -8.710 -2.690 14.727 290 HB3 GLU 36 1HB GLU 36 -8.508 -3.108 16.432 291 HG2 GLU 36 2HG GLU 36 -11.052 -1.983 15.197 292 HG3 GLU 36 1HG GLU 36 -10.777 -3.685 15.550 293 H TRP 37 H TRP 37 -7.136 0.598 14.734 294 HA TRP 37 HA TRP 37 -4.710 0.125 16.342 295 HB2 TRP 37 2HB TRP 37 -4.807 -0.334 13.336 296 HB3 TRP 37 1HB TRP 37 -3.338 -0.287 14.306 297 HD1 TRP 37 HD TRP 37 -6.474 -2.407 13.765 298 HE1 TRP 37 1HE TRP 37 -6.051 -4.763 14.703 299 HE3 TRP 37 3HE TRP 37 -1.949 -1.645 15.966 300 HZ2 TRP 37 2HZ TRP 37 -4.044 -6.144 16.209 301 HZ3 TRP 37 3HZ TRP 37 -0.802 -3.493 17.152 302 HH2 TRP 37 HH TRP 37 -1.844 -5.740 17.276 303 H HIS 38 H HIS 38 -3.089 1.714 15.992 304 HA HIS 38 HA HIS 38 -3.816 4.106 14.407 305 HB2 HIS 38 2HB HIS 38 -3.498 5.600 16.312 306 HB3 HIS 38 1HB HIS 38 -4.755 4.436 16.716 307 HD2 HIS 38 2HD HIS 38 -1.442 5.682 18.147 308 HE1 HIS 38 1HE HIS 38 -2.198 2.012 20.074 309 HE2 HIS 38 2HE HIS 38 -0.739 4.083 20.083 310 H VAL 39 H VAL 39 -1.948 5.615 14.295 311 HA VAL 39 HA VAL 39 0.685 4.220 14.522 312 HB VAL 39 HB VAL 39 -0.042 4.344 12.223 313 HG11 VAL 39 1HG1 VAL 39 -0.891 6.229 11.142 314 HG12 VAL 39 2HG1 VAL 39 -0.046 7.372 12.164 315 HG13 VAL 39 3HG1 VAL 39 -1.492 6.575 12.749 316 HG21 VAL 39 3HG2 VAL 39 1.889 5.474 11.261 317 HG22 VAL 39 1HG2 VAL 39 2.391 4.764 12.795 318 HG23 VAL 39 2HG2 VAL 39 2.071 6.496 12.686 319 HA PRO 40 HA PRO 40 0.960 8.179 16.917 320 HB2 PRO 40 2HB PRO 40 2.605 7.399 18.940 321 HB3 PRO 40 1HB PRO 40 0.885 6.947 18.914 322 HG2 PRO 40 2HG PRO 40 3.277 5.295 18.132 323 HG3 PRO 40 1HG PRO 40 1.844 4.809 19.062 324 HD2 PRO 40 2HD PRO 40 2.162 4.295 16.343 325 HD3 PRO 40 1HD PRO 40 0.571 4.416 17.128 326 H ALA 41 H ALA 41 3.218 6.349 15.161 327 HA ALA 41 HA ALA 41 4.818 8.636 14.519 328 HB1 ALA 41 1HB ALA 41 5.819 8.128 16.722 329 HB2 ALA 41 2HB ALA 41 6.964 7.817 15.420 330 HB3 ALA 41 3HB ALA 41 6.132 6.472 16.200 331 H ALA 42 H ALA 42 6.326 8.180 12.789 332 HA ALA 42 HA ALA 42 6.697 5.526 11.795 333 HB1 ALA 42 1HB ALA 42 4.360 5.794 11.081 334 HB2 ALA 42 2HB ALA 42 5.428 5.805 9.678 335 HB3 ALA 42 3HB ALA 42 4.767 7.320 10.294 336 H GLN 43 H GLN 43 8.169 5.463 10.061 337 HA GLN 43 HA GLN 43 9.183 8.007 9.018 338 HB2 GLN 43 2HB GLN 43 10.404 7.349 11.213 339 HB3 GLN 43 1HB GLN 43 11.097 6.008 10.303 340 HG2 GLN 43 2HG GLN 43 11.951 7.664 8.621 341 HG3 GLN 43 1HG GLN 43 11.333 8.961 9.644 342 HE21 GLN 43 1HE2 GLN 43 14.124 8.742 9.026 343 HE22 GLN 43 2HE2 GLN 43 14.957 8.366 10.456 344 H ASN 44 H ASN 44 10.237 7.801 7.094 345 HA ASN 44 HA ASN 44 10.948 5.285 5.905 346 HB2 ASN 44 2HB ASN 44 8.502 5.113 5.685 347 HB3 ASN 44 1HB ASN 44 8.458 6.659 4.860 348 HD21 ASN 44 1HD2 ASN 44 7.627 5.671 2.859 349 HD22 ASN 44 2HD2 ASN 44 8.626 4.704 1.884 350 H ASP 45 H ASP 45 12.386 5.614 4.308 351 HA ASP 45 HA ASP 45 12.735 8.348 3.157 352 HB2 ASP 45 2HB ASP 45 14.880 6.377 4.027 353 HB3 ASP 45 1HB ASP 45 15.169 7.917 3.221 354 H LEU 46 H LEU 46 11.845 7.969 1.136 355 HA LEU 46 HA LEU 46 12.040 5.513 -0.275 356 HB2 LEU 46 2HB LEU 46 10.330 7.356 -0.641 357 HB3 LEU 46 1HB LEU 46 11.588 8.287 -1.438 358 HG LEU 46 HG LEU 46 11.858 6.063 -2.934 359 HD11 LEU 46 1HD1 LEU 46 9.714 4.891 -3.298 360 HD12 LEU 46 2HD1 LEU 46 8.960 5.858 -2.033 361 HD13 LEU 46 3HD1 LEU 46 10.225 4.710 -1.621 362 HD21 LEU 46 3HD2 LEU 46 9.542 7.992 -3.288 363 HD22 LEU 46 1HD2 LEU 46 10.205 6.963 -4.560 364 HD23 LEU 46 2HD2 LEU 46 11.194 8.240 -3.853 365 H LYS 47 H LYS 47 14.169 4.798 -0.455 366 HA LYS 47 HA LYS 47 15.725 5.871 -2.605 367 HB2 LYS 47 2HB LYS 47 16.273 7.510 -0.778 368 HB3 LYS 47 1HB LYS 47 16.895 6.174 0.185 369 HG2 LYS 47 2HG LYS 47 18.618 5.700 -1.492 370 HG3 LYS 47 1HG LYS 47 17.940 6.901 -2.586 371 HD2 LYS 47 2HD LYS 47 19.901 7.823 -1.452 372 HD3 LYS 47 1HD LYS 47 18.453 8.686 -0.939 373 HE2 LYS 47 2HE LYS 47 19.410 6.336 0.728 374 HE3 LYS 47 1HE LYS 47 20.210 7.897 0.896 375 HZ1 LYS 47 3HZ LYS 47 17.566 8.519 0.907 376 HZ2 LYS 47 1HZ LYS 47 18.572 8.411 2.269 377 HZ3 LYS 47 2HZ LYS 47 17.629 7.076 1.803 378 H ALA 48 H ALA 48 17.191 4.358 -3.352 379 HA ALA 48 HA ALA 48 16.901 1.673 -2.565 380 HB1 ALA 48 1HB ALA 48 17.654 2.374 -4.807 381 HB2 ALA 48 2HB ALA 48 18.798 1.248 -4.078 382 HB3 ALA 48 3HB ALA 48 19.160 2.974 -4.115 383 H GLY 49 H GLY 49 18.040 0.372 -1.178 384 HA2 GLY 49 2HA GLY 49 19.589 -0.283 0.420 385 HA3 GLY 49 1HA GLY 49 20.611 1.059 -0.078 386 H GLY 50 H GLY 50 17.628 2.332 0.512 387 HA2 GLY 50 2HA GLY 50 18.450 3.563 3.020 388 HA3 GLY 50 1HA GLY 50 16.973 3.882 2.116 389 H THR 51 H THR 51 17.241 3.446 4.979 390 HA THR 51 HA THR 51 15.795 0.875 5.402 391 HB THR 51 HB THR 51 16.464 1.007 7.695 392 HG1 THR 51 1HG THR 51 17.732 3.048 8.219 393 HG21 THR 51 3HG2 THR 51 18.315 0.434 6.089 394 HG22 THR 51 1HG2 THR 51 18.892 1.160 7.588 395 HG23 THR 51 2HG2 THR 51 18.806 2.126 6.117 396 H PHE 52 H PHE 52 13.951 0.897 6.803 397 HA PHE 52 HA PHE 52 12.588 3.477 7.262 398 HB2 PHE 52 2HB PHE 52 10.523 2.685 6.206 399 HB3 PHE 52 1HB PHE 52 11.831 2.726 5.027 400 HD1 PHE 52 1HD PHE 52 9.717 0.510 7.131 401 HD2 PHE 52 2HD PHE 52 12.754 0.647 4.085 402 HE1 PHE 52 1HE PHE 52 9.385 -1.908 6.691 403 HE2 PHE 52 2HE PHE 52 12.415 -1.766 3.646 404 HZ PHE 52 HZ PHE 52 10.734 -3.042 4.945 405 H THR 53 H THR 53 10.888 3.337 8.801 406 HA THR 53 HA THR 53 10.435 0.804 10.201 407 HB THR 53 HB THR 53 11.597 3.199 11.683 408 HG1 THR 53 1HG THR 53 12.712 0.765 10.787 409 HG21 THR 53 3HG2 THR 53 10.908 0.375 12.575 410 HG22 THR 53 1HG2 THR 53 10.063 1.847 13.056 411 HG23 THR 53 2HG2 THR 53 11.726 1.578 13.569 412 H THR 54 H THR 54 8.353 0.719 10.839 413 HA THR 54 HA THR 54 6.804 3.250 11.135 414 HB THR 54 HB THR 54 5.699 0.619 10.070 415 HG1 THR 54 1HG THR 54 6.724 1.134 8.326 416 HG21 THR 54 3HG2 THR 54 3.821 2.006 9.352 417 HG22 THR 54 1HG2 THR 54 4.667 3.470 9.847 418 HG23 THR 54 2HG2 THR 54 4.109 2.327 11.060 419 H THR 55 H THR 55 6.065 3.497 13.189 420 HA THR 55 HA THR 55 5.998 1.164 15.002 421 HB THR 55 HB THR 55 5.591 4.133 15.592 422 HG1 THR 55 1HG THR 55 7.646 4.071 15.061 423 HG21 THR 55 3HG2 THR 55 6.162 3.429 17.911 424 HG22 THR 55 1HG2 THR 55 6.206 1.749 17.382 425 HG23 THR 55 2HG2 THR 55 4.689 2.647 17.347 426 H MET 56 H MET 56 4.090 0.086 15.180 427 HA MET 56 HA MET 56 1.535 1.632 15.104 428 HB2 MET 56 2HB MET 56 2.076 -1.071 13.844 429 HB3 MET 56 1HB MET 56 0.513 -0.262 13.908 430 HG2 MET 56 2HG MET 56 1.466 1.651 12.629 431 HG3 MET 56 1HG MET 56 2.994 0.782 12.522 432 HE1 MET 56 3HE MET 56 2.831 -1.953 11.758 433 HE2 MET 56 1HE MET 56 3.604 -0.761 10.710 434 HE3 MET 56 2HE MET 56 2.517 -1.968 10.029 435 H ALA 57 H ALA 57 0.063 1.057 16.630 436 HA ALA 57 HA ALA 57 0.445 -1.382 18.236 437 HB1 ALA 57 1HB ALA 57 0.390 -0.126 20.347 438 HB2 ALA 57 2HB ALA 57 0.393 1.393 19.449 439 HB3 ALA 57 3HB ALA 57 1.795 0.326 19.382 440 H ALA 58 H ALA 58 -1.375 -2.089 19.270 441 HA ALA 58 HA ALA 58 -3.892 -1.333 18.131 442 HB1 ALA 58 1HB ALA 58 -3.432 -3.622 18.908 443 HB2 ALA 58 2HB ALA 58 -4.851 -2.949 19.710 444 HB3 ALA 58 3HB ALA 58 -3.312 -3.038 20.567 445 H LYS 59 H LYS 59 -5.668 -0.253 19.147 446 HA LYS 59 HA LYS 59 -5.060 2.005 20.646 447 HB2 LYS 59 2HB LYS 59 -7.115 1.658 19.271 448 HB3 LYS 59 1HB LYS 59 -7.717 0.535 20.489 449 HG2 LYS 59 2HG LYS 59 -7.675 2.333 22.175 450 HG3 LYS 59 1HG LYS 59 -7.038 3.448 20.969 451 HD2 LYS 59 2HD LYS 59 -9.090 3.148 19.615 452 HD3 LYS 59 1HD LYS 59 -9.724 2.038 20.831 453 HE2 LYS 59 2HE LYS 59 -9.658 3.840 22.521 454 HE3 LYS 59 1HE LYS 59 -9.016 4.952 21.313 455 HZ1 LYS 59 3HZ LYS 59 -11.138 5.434 20.919 456 HZ2 LYS 59 1HZ LYS 59 -11.712 4.062 21.735 457 HZ3 LYS 59 2HZ LYS 59 -11.221 3.940 20.113 458 H ASP 60 H ASP 60 -6.163 -1.211 21.688 459 HA ASP 60 HA ASP 60 -6.388 -0.511 24.489 460 HB2 ASP 60 2HB ASP 60 -6.228 -3.201 23.090 461 HB3 ASP 60 1HB ASP 60 -6.638 -2.967 24.789 462 H GLY 61 H GLY 61 -3.806 -1.120 22.387 463 HA2 GLY 61 2HA GLY 61 -1.540 -1.353 22.710 464 HA3 GLY 61 1HA GLY 61 -1.812 -0.856 24.377 465 H SER 62 H SER 62 -3.551 -3.611 23.209 466 HA SER 62 HA SER 62 -2.251 -5.368 25.130 467 HB2 SER 62 2HB SER 62 -4.430 -5.891 23.089 468 HB3 SER 62 1HB SER 62 -3.930 -7.008 24.358 469 HG SER 62 HG SER 62 -5.726 -5.155 24.553 470 H MET 63 H MET 63 -1.744 -4.505 21.883 471 HA MET 63 HA MET 63 0.356 -6.486 21.560 472 HB2 MET 63 2HB MET 63 -1.696 -7.751 20.857 473 HB3 MET 63 1HB MET 63 -1.996 -6.531 19.620 474 HG2 MET 63 2HG MET 63 0.162 -7.061 18.549 475 HG3 MET 63 1HG MET 63 0.525 -8.228 19.821 476 HE1 MET 63 3HE MET 63 1.026 -9.589 17.551 477 HE2 MET 63 1HE MET 63 0.199 -8.483 16.444 478 HE3 MET 63 2HE MET 63 -0.220 -10.194 16.464 479 H SER 64 H SER 64 1.938 -5.687 20.284 480 HA SER 64 HA SER 64 1.386 -3.583 18.303 481 HB2 SER 64 2HB SER 64 3.108 -2.110 19.201 482 HB3 SER 64 1HB SER 64 1.897 -2.406 20.447 483 HG SER 64 HG SER 64 4.547 -3.107 20.339 484 H PHE 65 H PHE 65 3.258 -3.169 16.925 485 HA PHE 65 HA PHE 65 5.484 -5.023 16.975 486 HB2 PHE 65 2HB PHE 65 3.594 -6.383 15.970 487 HB3 PHE 65 1HB PHE 65 3.523 -5.221 14.649 488 HD1 PHE 65 1HD PHE 65 5.574 -7.861 16.261 489 HD2 PHE 65 2HD PHE 65 5.346 -5.089 12.978 490 HE1 PHE 65 1HE PHE 65 7.459 -9.021 15.145 491 HE2 PHE 65 2HE PHE 65 7.227 -6.257 11.868 492 HZ PHE 65 HZ PHE 65 8.282 -8.221 12.948 493 H ASP 66 H ASP 66 6.963 -4.608 15.128 494 HA ASP 66 HA ASP 66 6.637 -1.930 13.870 495 HB2 ASP 66 2HB ASP 66 9.078 -2.892 15.400 496 HB3 ASP 66 1HB ASP 66 8.964 -1.389 14.483 497 H PHE 67 H PHE 67 6.984 -2.102 11.748 498 HA PHE 67 HA PHE 67 8.417 -4.465 10.655 499 HB2 PHE 67 2HB PHE 67 6.586 -2.366 9.431 500 HB3 PHE 67 1HB PHE 67 7.500 -3.498 8.435 501 HD1 PHE 67 1HD PHE 67 4.747 -3.174 10.889 502 HD2 PHE 67 2HD PHE 67 6.982 -5.907 8.440 503 HE1 PHE 67 1HE PHE 67 3.025 -4.918 11.266 504 HE2 PHE 67 2HE PHE 67 5.257 -7.651 8.822 505 HZ PHE 67 HZ PHE 67 3.279 -7.155 10.230 506 H GLY 68 H GLY 68 10.256 -4.313 9.485 507 HA2 GLY 68 2HA GLY 68 11.399 -1.732 8.698 508 HA3 GLY 68 1HA GLY 68 12.284 -2.629 9.935 509 H GLY 69 H GLY 69 13.114 -1.952 7.242 510 HA2 GLY 69 2HA GLY 69 14.327 -4.375 6.449 511 HA3 GLY 69 1HA GLY 69 12.932 -4.066 5.413 512 H VAL 70 H VAL 70 14.865 -3.995 3.842 513 HA VAL 70 HA VAL 70 15.807 -1.174 3.564 514 HB VAL 70 HB VAL 70 17.364 -3.696 2.869 515 HG11 VAL 70 1HG1 VAL 70 18.111 -0.745 2.823 516 HG12 VAL 70 2HG1 VAL 70 17.924 -1.790 1.415 517 HG13 VAL 70 3HG1 VAL 70 19.241 -2.070 2.548 518 HG21 VAL 70 3HG2 VAL 70 17.199 -3.435 5.308 519 HG22 VAL 70 1HG2 VAL 70 17.675 -1.742 5.181 520 HG23 VAL 70 2HG2 VAL 70 18.827 -3.013 4.781 521 H TYR 71 H TYR 71 15.543 -0.298 1.564 522 HA TYR 71 HA TYR 71 13.843 -1.620 -0.348 523 HB2 TYR 71 2HB TYR 71 15.438 0.966 -0.489 524 HB3 TYR 71 1HB TYR 71 14.328 0.433 -1.752 525 HD1 TYR 71 1HD TYR 71 11.892 -0.061 -1.132 526 HD2 TYR 71 2HD TYR 71 14.550 2.097 1.481 527 HE1 TYR 71 1HE TYR 71 9.949 0.814 0.129 528 HE2 TYR 71 2HE TYR 71 12.597 2.974 2.724 529 HH TYR 71 HH TYR 71 9.293 2.361 1.637 530 H ASP 72 H ASP 72 14.475 -3.089 -1.841 531 HA ASP 72 HA ASP 72 17.265 -3.644 -2.352 532 HB2 ASP 72 2HB ASP 72 15.527 -5.416 -2.338 533 HB3 ASP 72 1HB ASP 72 14.772 -4.681 -3.749 534 H GLN 73 H GLN 73 14.583 -2.113 -4.082 535 HA GLN 73 HA GLN 73 16.366 -0.457 -5.636 536 HB2 GLN 73 2HB GLN 73 16.509 -2.633 -6.868 537 HB3 GLN 73 1HB GLN 73 14.770 -2.570 -7.134 538 HG2 GLN 73 2HG GLN 73 15.021 -0.456 -8.384 539 HG3 GLN 73 1HG GLN 73 16.758 -0.473 -8.081 540 HE21 GLN 73 1HE2 GLN 73 17.920 -1.289 -9.827 541 HE22 GLN 73 2HE2 GLN 73 17.342 -2.449 -10.924 542 H VAL 74 H VAL 74 15.277 1.241 -6.656 543 HA VAL 74 HA VAL 74 12.334 1.324 -6.596 544 HB VAL 74 HB VAL 74 13.056 2.187 -4.389 545 HG11 VAL 74 1HG1 VAL 74 15.314 3.032 -5.160 546 HG12 VAL 74 2HG1 VAL 74 14.422 4.194 -4.181 547 HG13 VAL 74 3HG1 VAL 74 14.495 4.390 -5.930 548 HG21 VAL 74 3HG2 VAL 74 12.060 4.427 -6.200 549 HG22 VAL 74 1HG2 VAL 74 11.802 4.274 -4.469 550 HG23 VAL 74 2HG2 VAL 74 11.043 3.138 -5.562 551 H LYS 75 H LYS 75 11.507 2.536 -8.231 552 HA LYS 75 HA LYS 75 13.224 4.405 -9.751 553 HB2 LYS 75 2HB LYS 75 11.887 1.920 -10.870 554 HB3 LYS 75 1HB LYS 75 12.345 3.273 -11.906 555 HG2 LYS 75 2HG LYS 75 14.702 3.020 -11.137 556 HG3 LYS 75 1HG LYS 75 14.221 1.644 -10.147 557 HD2 LYS 75 2HD LYS 75 13.467 0.435 -12.156 558 HD3 LYS 75 1HD LYS 75 13.925 1.808 -13.162 559 HE2 LYS 75 2HE LYS 75 16.273 1.557 -12.451 560 HE3 LYS 75 1HE LYS 75 15.825 0.187 -11.434 561 HZ1 LYS 75 3HZ LYS 75 16.564 0.074 -14.060 562 HZ2 LYS 75 1HZ LYS 75 14.877 -0.092 -14.117 563 HZ3 LYS 75 2HZ LYS 75 15.804 -1.165 -13.181 564 H THR 76 H THR 76 12.106 6.180 -10.281 565 HA THR 76 HA THR 76 9.557 6.733 -9.337 566 HB THR 76 HB THR 76 10.890 8.052 -11.730 567 HG1 THR 76 1HG THR 76 12.028 9.206 -10.267 568 HG21 THR 76 3HG2 THR 76 9.725 10.069 -10.899 569 HG22 THR 76 1HG2 THR 76 8.978 9.112 -9.622 570 HG23 THR 76 2HG2 THR 76 8.571 8.802 -11.310 571 H ASN 77 H ASN 77 7.586 6.022 -9.951 572 HA ASN 77 HA ASN 77 5.889 5.091 -11.192 573 HB2 ASN 77 2HB ASN 77 7.164 6.789 -13.350 574 HB3 ASN 77 1HB ASN 77 5.517 6.159 -13.375 575 HD21 ASN 77 1HD2 ASN 77 5.119 6.631 -10.437 576 HD22 ASN 77 2HD2 ASN 77 4.949 8.311 -10.268 577 H ASP 78 H ASP 78 7.116 2.983 -10.960 578 HA ASP 78 HA ASP 78 7.169 1.605 -13.479 579 HB2 ASP 78 2HB ASP 78 9.359 2.699 -13.641 580 HB3 ASP 78 1HB ASP 78 9.801 2.077 -12.061 581 H LEU 79 H LEU 79 9.200 0.998 -10.628 582 HA LEU 79 HA LEU 79 7.318 -1.025 -9.605 583 HB2 LEU 79 2HB LEU 79 8.832 -2.086 -11.366 584 HB3 LEU 79 1HB LEU 79 10.184 -1.764 -10.296 585 HG LEU 79 HG LEU 79 8.632 -3.072 -8.487 586 HD11 LEU 79 1HD1 LEU 79 7.310 -4.865 -9.522 587 HD12 LEU 79 2HD1 LEU 79 7.709 -4.263 -11.130 588 HD13 LEU 79 3HD1 LEU 79 6.709 -3.299 -10.056 589 HD21 LEU 79 3HD2 LEU 79 10.176 -4.506 -10.681 590 HD22 LEU 79 1HD2 LEU 79 9.748 -5.206 -9.119 591 HD23 LEU 79 2HD2 LEU 79 10.865 -3.844 -9.201 592 H ILE 80 H ILE 80 7.416 -1.243 -7.444 593 HA ILE 80 HA ILE 80 9.732 -0.115 -5.927 594 HB ILE 80 HB ILE 80 6.790 0.216 -5.188 595 HG12 ILE 80 2HG1 ILE 80 8.823 2.307 -6.075 596 HG13 ILE 80 1HG1 ILE 80 7.554 1.673 -7.106 597 HG21 ILE 80 1HG2 ILE 80 8.268 0.011 -3.200 598 HG22 ILE 80 2HG2 ILE 80 7.734 1.676 -3.361 599 HG23 ILE 80 3HG2 ILE 80 9.356 1.220 -3.873 600 HD11 ILE 80 3HD1 ILE 80 6.360 2.612 -4.622 601 HD12 ILE 80 1HD1 ILE 80 6.087 3.170 -6.275 602 HD13 ILE 80 2HD1 ILE 80 7.381 3.865 -5.316 603 H GLU 81 H GLU 81 10.524 -1.555 -4.482 604 HA GLU 81 HA GLU 81 8.810 -3.544 -3.214 605 HB2 GLU 81 2HB GLU 81 10.263 -5.455 -3.952 606 HB3 GLU 81 1HB GLU 81 9.343 -4.741 -5.273 607 HG2 GLU 81 2HG GLU 81 11.315 -3.434 -5.958 608 HG3 GLU 81 1HG GLU 81 12.247 -4.125 -4.637 609 H TYR 82 H TYR 82 10.093 -4.790 -1.593 610 HA TYR 82 HA TYR 82 12.686 -3.711 -0.801 611 HB2 TYR 82 2HB TYR 82 11.870 -3.052 1.477 612 HB3 TYR 82 1HB TYR 82 11.234 -2.026 0.193 613 HD1 TYR 82 1HD TYR 82 8.896 -2.424 -0.707 614 HD2 TYR 82 2HD TYR 82 10.345 -4.408 2.830 615 HE1 TYR 82 1HE TYR 82 6.569 -2.994 -0.063 616 HE2 TYR 82 2HE TYR 82 8.011 -4.957 3.464 617 HH TYR 82 HH TYR 82 5.721 -5.268 1.914 618 H THR 83 H THR 83 13.687 -4.966 0.887 619 HA THR 83 HA THR 83 12.800 -7.758 0.832 620 HB THR 83 HB THR 83 15.265 -6.494 2.097 621 HG1 THR 83 1HG THR 83 15.862 -7.843 -0.047 622 HG21 THR 83 3HG2 THR 83 16.168 -8.800 1.922 623 HG22 THR 83 1HG2 THR 83 14.607 -9.359 1.329 624 HG23 THR 83 2HG2 THR 83 14.757 -8.744 2.975 625 H ILE 84 H ILE 84 11.742 -8.716 2.483 626 HA ILE 84 HA ILE 84 11.277 -7.207 4.988 627 HB ILE 84 HB ILE 84 9.870 -9.721 3.990 628 HG12 ILE 84 2HG1 ILE 84 8.034 -7.666 3.590 629 HG13 ILE 84 1HG1 ILE 84 9.524 -6.820 3.201 630 HG21 ILE 84 1HG2 ILE 84 8.111 -8.975 5.567 631 HG22 ILE 84 2HG2 ILE 84 9.132 -7.633 6.070 632 HG23 ILE 84 3HG2 ILE 84 9.635 -9.292 6.394 633 HD11 ILE 84 3HD1 ILE 84 8.466 -9.350 1.930 634 HD12 ILE 84 1HD1 ILE 84 10.066 -8.690 1.601 635 HD13 ILE 84 2HD1 ILE 84 8.629 -7.764 1.179 636 H GLY 85 H GLY 85 11.891 -7.994 6.973 637 HA2 GLY 85 2HA GLY 85 14.100 -9.667 7.234 638 HA3 GLY 85 1HA GLY 85 12.980 -9.315 8.545 639 H ASP 86 H ASP 86 10.649 -10.513 7.472 640 HA ASP 86 HA ASP 86 10.940 -13.179 8.292 641 HB2 ASP 86 2HB ASP 86 8.806 -11.833 6.601 642 HB3 ASP 86 1HB ASP 86 8.639 -13.445 7.296 643 H GLY 87 H GLY 87 11.652 -11.675 5.281 644 HA2 GLY 87 2HA GLY 87 12.867 -12.641 3.519 645 HA3 GLY 87 1HA GLY 87 12.433 -14.249 4.087 646 H ARG 88 H ARG 88 9.691 -12.354 4.118 647 HA ARG 88 HA ARG 88 8.424 -13.761 1.999 648 HB2 ARG 88 2HB ARG 88 7.649 -11.199 3.434 649 HB3 ARG 88 1HB ARG 88 6.586 -12.072 2.328 650 HG2 ARG 88 2HG ARG 88 6.689 -14.065 3.764 651 HG3 ARG 88 1HG ARG 88 7.794 -13.240 4.863 652 HD2 ARG 88 2HD ARG 88 4.973 -12.300 4.237 653 HD3 ARG 88 1HD ARG 88 5.432 -13.206 5.676 654 HE ARG 88 HE ARG 88 7.092 -10.935 5.479 655 HH11 ARG 88 1HH2 ARG 88 3.782 -11.811 6.091 656 HH12 ARG 88 2HH2 ARG 88 3.457 -10.408 7.054 657 HH21 ARG 88 1HH1 ARG 88 6.649 -9.112 6.742 658 HH22 ARG 88 2HH1 ARG 88 5.071 -8.889 7.417 659 H LYS 89 H LYS 89 7.399 -12.660 0.113 660 HA LYS 89 HA LYS 89 9.188 -10.631 -1.145 661 HB2 LYS 89 2HB LYS 89 7.745 -12.953 -2.467 662 HB3 LYS 89 1HB LYS 89 8.759 -11.767 -3.288 663 HG2 LYS 89 2HG LYS 89 9.794 -13.585 -1.074 664 HG3 LYS 89 1HG LYS 89 9.897 -13.999 -2.780 665 HD2 LYS 89 2HD LYS 89 11.240 -11.945 -3.188 666 HD3 LYS 89 1HD LYS 89 11.183 -11.567 -1.474 667 HE2 LYS 89 2HE LYS 89 12.317 -13.679 -0.941 668 HE3 LYS 89 1HE LYS 89 12.393 -14.066 -2.660 669 HZ1 LYS 89 3HZ LYS 89 13.554 -11.607 -1.478 670 HZ2 LYS 89 1HZ LYS 89 13.775 -12.194 -3.054 671 HZ3 LYS 89 2HZ LYS 89 14.439 -13.034 -1.735 672 H VAL 90 H VAL 90 8.215 -8.806 -1.562 673 HA VAL 90 HA VAL 90 5.347 -8.746 -2.346 674 HB VAL 90 HB VAL 90 6.662 -6.799 -0.400 675 HG11 VAL 90 1HG1 VAL 90 4.309 -6.013 -0.083 676 HG12 VAL 90 2HG1 VAL 90 3.786 -7.121 -1.349 677 HG13 VAL 90 3HG1 VAL 90 4.858 -5.778 -1.742 678 HG21 VAL 90 3HG2 VAL 90 5.153 -7.872 1.288 679 HG22 VAL 90 1HG2 VAL 90 6.362 -8.992 0.661 680 HG23 VAL 90 2HG2 VAL 90 4.701 -9.076 0.081 681 H ARG 91 H ARG 91 5.066 -7.606 -4.169 682 HA ARG 91 HA ARG 91 7.024 -5.500 -4.951 683 HB2 ARG 91 2HB ARG 91 5.960 -7.723 -6.735 684 HB3 ARG 91 1HB ARG 91 6.924 -6.349 -7.281 685 HG2 ARG 91 2HG ARG 91 8.777 -7.066 -5.804 686 HG3 ARG 91 1HG ARG 91 7.818 -8.444 -5.271 687 HD2 ARG 91 2HD ARG 91 7.728 -9.275 -7.606 688 HD3 ARG 91 1HD ARG 91 8.712 -7.908 -8.120 689 HE ARG 91 HE ARG 91 10.093 -9.233 -6.063 690 HH11 ARG 91 1HH2 ARG 91 9.007 -9.788 -9.316 691 HH12 ARG 91 2HH2 ARG 91 10.285 -10.894 -9.694 692 HH21 ARG 91 1HH1 ARG 91 11.761 -10.678 -6.563 693 HH22 ARG 91 2HH1 ARG 91 11.843 -11.397 -8.136 694 H ILE 92 H ILE 92 6.071 -3.736 -5.847 695 HA ILE 92 HA ILE 92 3.105 -3.763 -6.215 696 HB ILE 92 HB ILE 92 4.936 -1.435 -5.482 697 HG12 ILE 92 2HG1 ILE 92 2.942 -2.946 -3.716 698 HG13 ILE 92 1HG1 ILE 92 4.684 -3.189 -3.649 699 HG21 ILE 92 1HG2 ILE 92 2.857 -0.796 -6.728 700 HG22 ILE 92 2HG2 ILE 92 2.770 -0.263 -5.057 701 HG23 ILE 92 3HG2 ILE 92 1.897 -1.702 -5.566 702 HD11 ILE 92 3HD1 ILE 92 4.035 -1.623 -1.897 703 HD12 ILE 92 1HD1 ILE 92 3.218 -0.597 -3.073 704 HD13 ILE 92 2HD1 ILE 92 4.972 -0.761 -3.116 705 H VAL 93 H VAL 93 2.559 -3.685 -8.333 706 HA VAL 93 HA VAL 93 4.435 -2.477 -10.303 707 HB VAL 93 HB VAL 93 2.076 -4.335 -10.842 708 HG11 VAL 93 1HG1 VAL 93 4.489 -3.542 -12.523 709 HG12 VAL 93 2HG1 VAL 93 2.852 -2.939 -12.757 710 HG13 VAL 93 3HG1 VAL 93 3.207 -4.643 -13.020 711 HG21 VAL 93 3HG2 VAL 93 5.027 -5.000 -10.538 712 HG22 VAL 93 1HG2 VAL 93 3.791 -6.121 -11.099 713 HG23 VAL 93 2HG2 VAL 93 3.739 -5.508 -9.448 714 H PHE 94 H PHE 94 3.892 -0.516 -11.058 715 HA PHE 94 HA PHE 94 1.121 0.503 -10.675 716 HB2 PHE 94 2HB PHE 94 3.722 1.917 -11.362 717 HB3 PHE 94 1HB PHE 94 2.159 2.708 -11.157 718 HD1 PHE 94 1HD PHE 94 4.877 0.883 -9.402 719 HD2 PHE 94 2HD PHE 94 1.135 2.955 -8.927 720 HE1 PHE 94 1HE PHE 94 5.218 0.955 -6.948 721 HE2 PHE 94 2HE PHE 94 1.492 3.027 -6.472 722 HZ PHE 94 HZ PHE 94 3.534 2.030 -5.486 723 H THR 95 H THR 95 -0.218 0.581 -12.345 724 HA THR 95 HA THR 95 0.826 0.767 -15.131 725 HB THR 95 HB THR 95 -0.959 -0.811 -15.813 726 HG1 THR 95 1HG THR 95 -1.289 -1.269 -13.045 727 HG21 THR 95 3HG2 THR 95 0.812 -1.926 -13.621 728 HG22 THR 95 1HG2 THR 95 1.322 -1.667 -15.288 729 HG23 THR 95 2HG2 THR 95 0.069 -2.854 -14.922 730 H HIS 96 H HIS 96 -0.520 1.856 -16.572 731 HA HIS 96 HA HIS 96 -3.030 3.048 -15.669 732 HB2 HIS 96 2HB HIS 96 -2.223 5.368 -16.083 733 HB3 HIS 96 1HB HIS 96 -1.387 4.612 -14.727 734 HD2 HIS 96 2HD HIS 96 -0.517 6.268 -18.079 735 HE1 HIS 96 1HE HIS 96 2.966 4.240 -16.821 736 HE2 HIS 96 2HE HIS 96 2.036 5.911 -18.492 737 H THR 97 H THR 97 -4.285 3.777 -17.390 738 HA THR 97 HA THR 97 -3.334 2.992 -20.109 739 HB THR 97 HB THR 97 -5.725 2.823 -20.658 740 HG1 THR 97 1HG THR 97 -6.194 3.333 -17.919 741 HG21 THR 97 3HG2 THR 97 -5.010 1.381 -18.084 742 HG22 THR 97 1HG2 THR 97 -4.571 0.849 -19.707 743 HG23 THR 97 2HG2 THR 97 -6.266 0.893 -19.221 744 H GLY 98 H GLY 98 -4.273 5.632 -18.122 745 HA2 GLY 98 2HA GLY 98 -3.423 7.659 -19.792 746 HA3 GLY 98 1HA GLY 98 -5.135 7.456 -20.159 747 H ASP 99 H ASP 99 -6.586 8.443 -18.871 748 HA ASP 99 HA ASP 99 -5.683 10.126 -16.677 749 HB2 ASP 99 2HB ASP 99 -8.451 9.639 -17.824 750 HB3 ASP 99 1HB ASP 99 -8.026 10.905 -16.673 751 H THR 100 H THR 100 -6.160 6.933 -16.747 752 HA THR 100 HA THR 100 -7.303 6.808 -13.996 753 HB THR 100 HB THR 100 -7.738 4.755 -16.199 754 HG1 THR 100 1HG THR 100 -9.593 6.557 -15.051 755 HG21 THR 100 3HG2 THR 100 -8.897 5.044 -13.401 756 HG22 THR 100 1HG2 THR 100 -7.777 3.788 -13.932 757 HG23 THR 100 2HG2 THR 100 -9.410 3.849 -14.589 758 H THR 101 H THR 101 -5.924 5.984 -12.585 759 HA THR 101 HA THR 101 -3.551 4.451 -13.519 760 HB THR 101 HB THR 101 -4.088 5.815 -10.856 761 HG1 THR 101 1HG THR 101 -3.108 7.483 -11.700 762 HG21 THR 101 3HG2 THR 101 -1.610 4.466 -12.005 763 HG22 THR 101 1HG2 THR 101 -2.508 3.967 -10.569 764 HG23 THR 101 2HG2 THR 101 -1.605 5.478 -10.564 765 H ASN 102 H ASN 102 -3.262 2.383 -12.945 766 HA ASN 102 HA ASN 102 -5.201 1.070 -11.088 767 HB2 ASN 102 2HB ASN 102 -3.832 -0.022 -13.568 768 HB3 ASN 102 1HB ASN 102 -4.872 -0.947 -12.486 769 HD21 ASN 102 1HD2 ASN 102 -5.195 -0.008 -15.441 770 HD22 ASN 102 2HD2 ASN 102 -6.736 0.704 -15.460 771 H ILE 103 H ILE 103 -4.226 0.440 -9.275 772 HA ILE 103 HA ILE 103 -1.290 -0.012 -9.198 773 HB ILE 103 HB ILE 103 -3.311 0.233 -6.936 774 HG12 ILE 103 2HG1 ILE 103 -1.297 2.330 -7.877 775 HG13 ILE 103 1HG1 ILE 103 -2.995 2.357 -8.344 776 HG21 ILE 103 1HG2 ILE 103 -1.235 0.587 -5.543 777 HG22 ILE 103 2HG2 ILE 103 -0.266 0.220 -6.964 778 HG23 ILE 103 3HG2 ILE 103 -1.304 -1.018 -6.264 779 HD11 ILE 103 3HD1 ILE 103 -1.935 2.482 -5.504 780 HD12 ILE 103 1HD1 ILE 103 -3.645 2.431 -5.937 781 HD13 ILE 103 2HD1 ILE 103 -2.652 3.813 -6.403 782 H VAL 104 H VAL 104 -0.542 -2.081 -9.116 783 HA VAL 104 HA VAL 104 -2.362 -4.261 -8.186 784 HB VAL 104 HB VAL 104 -0.377 -4.419 -10.486 785 HG11 VAL 104 1HG1 VAL 104 -1.488 -6.631 -10.878 786 HG12 VAL 104 2HG1 VAL 104 -2.421 -6.397 -9.402 787 HG13 VAL 104 3HG1 VAL 104 -0.669 -6.572 -9.317 788 HG21 VAL 104 3HG2 VAL 104 -2.328 -3.038 -11.087 789 HG22 VAL 104 1HG2 VAL 104 -3.417 -4.285 -10.480 790 HG23 VAL 104 2HG2 VAL 104 -2.426 -4.596 -11.904 791 H GLU 105 H GLU 105 -1.507 -5.485 -6.618 792 HA GLU 105 HA GLU 105 1.430 -5.702 -6.305 793 HB2 GLU 105 2HB GLU 105 1.223 -5.243 -3.865 794 HB3 GLU 105 1HB GLU 105 0.823 -3.836 -4.848 795 HG2 GLU 105 2HG GLU 105 -1.591 -4.356 -4.604 796 HG3 GLU 105 1HG GLU 105 -1.193 -5.740 -3.592 797 H SER 106 H SER 106 2.098 -7.581 -5.400 798 HA SER 106 HA SER 106 0.054 -9.692 -4.898 799 HB2 SER 106 2HB SER 106 1.493 -10.152 -6.841 800 HB3 SER 106 1HB SER 106 2.926 -9.948 -5.837 801 HG SER 106 HG SER 106 1.450 -12.121 -6.179 802 H PHE 107 H PHE 107 0.364 -11.083 -3.106 803 HA PHE 107 HA PHE 107 2.522 -10.442 -1.187 804 HB2 PHE 107 2HB PHE 107 0.583 -9.013 -0.558 805 HB3 PHE 107 1HB PHE 107 -0.431 -10.447 -0.453 806 HD1 PHE 107 1HD PHE 107 2.507 -8.704 1.038 807 HD2 PHE 107 2HD PHE 107 -0.270 -11.958 1.465 808 HE1 PHE 107 1HE PHE 107 3.328 -9.109 3.342 809 HE2 PHE 107 2HE PHE 107 0.540 -12.340 3.769 810 HZ PHE 107 HZ PHE 107 2.336 -10.925 4.705 811 H ASP 108 H ASP 108 3.133 -12.210 -0.013 812 HA ASP 108 HA ASP 108 2.009 -14.815 -0.824 813 HB2 ASP 108 2HB ASP 108 4.440 -14.433 -1.024 814 HB3 ASP 108 1HB ASP 108 4.537 -14.185 0.716 815 HA PRO 109 HA PRO 109 0.201 -14.739 3.400 816 HB2 PRO 109 2HB PRO 109 -1.373 -16.943 3.318 817 HB3 PRO 109 1HB PRO 109 -1.778 -15.500 2.358 818 HG2 PRO 109 2HG PRO 109 -0.326 -17.991 1.464 819 HG3 PRO 109 1HG PRO 109 -1.714 -17.187 0.695 820 HD2 PRO 109 2HD PRO 109 0.846 -16.739 -0.155 821 HD3 PRO 109 1HD PRO 109 -0.382 -15.445 -0.192 822 H GLU 110 H GLU 110 0.611 -15.807 5.370 823 HA GLU 110 HA GLU 110 2.977 -17.512 5.428 824 HB2 GLU 110 2HB GLU 110 1.206 -16.490 7.676 825 HB3 GLU 110 1HB GLU 110 2.726 -17.348 7.892 826 HG2 GLU 110 2HG GLU 110 3.211 -14.980 8.086 827 HG3 GLU 110 1HG GLU 110 3.874 -15.525 6.549 828 H GLU 111 H GLU 111 2.953 -19.500 6.874 829 HA GLU 111 HA GLU 111 0.981 -21.360 5.897 830 HB2 GLU 111 2HB GLU 111 3.356 -21.955 6.370 831 HB3 GLU 111 1HB GLU 111 3.049 -21.740 8.090 832 HG2 GLU 111 2HG GLU 111 1.354 -23.536 8.028 833 HG3 GLU 111 1HG GLU 111 1.600 -23.721 6.294 834 H THR 112 H THR 112 1.714 -20.036 9.151 835 HA THR 112 HA THR 112 -0.398 -21.348 10.490 836 HB THR 112 HB THR 112 0.842 -18.676 11.248 837 HG1 THR 112 1HG THR 112 1.841 -21.254 11.220 838 HG21 THR 112 3HG2 THR 112 -1.120 -19.316 12.599 839 HG22 THR 112 1HG2 THR 112 0.356 -19.444 13.553 840 HG23 THR 112 2HG2 THR 112 -0.403 -20.896 12.906 841 H ASN 113 H ASN 113 -0.250 -18.063 9.060 842 HA ASN 113 HA ASN 113 -2.980 -17.468 9.793 843 HB2 ASN 113 2HB ASN 113 -1.188 -15.726 9.603 844 HB3 ASN 113 1HB ASN 113 -1.157 -15.995 7.867 845 HD21 ASN 113 1HD2 ASN 113 -3.551 -15.931 6.892 846 HD22 ASN 113 2HD2 ASN 113 -4.498 -14.625 7.423 847 HA PRO 114 HA PRO 114 -4.517 -19.449 5.999 848 HB2 PRO 114 2HB PRO 114 -7.154 -18.736 6.058 849 HB3 PRO 114 1HB PRO 114 -6.474 -19.891 7.231 850 HG2 PRO 114 2HG PRO 114 -6.936 -16.925 7.578 851 HG3 PRO 114 1HG PRO 114 -7.411 -18.255 8.661 852 HD2 PRO 114 2HD PRO 114 -5.142 -16.811 9.110 853 HD3 PRO 114 1HD PRO 114 -5.200 -18.557 9.471 854 H ARG 115 H ARG 115 -4.833 -18.907 3.874 855 HA ARG 115 HA ARG 115 -4.010 -16.353 2.988 856 HB2 ARG 115 2HB ARG 115 -4.650 -17.193 0.727 857 HB3 ARG 115 1HB ARG 115 -3.655 -18.338 1.625 858 HG2 ARG 115 2HG ARG 115 -5.706 -19.580 2.284 859 HG3 ARG 115 1HG ARG 115 -6.677 -18.458 1.335 860 HD2 ARG 115 2HD ARG 115 -6.243 -20.486 0.038 861 HD3 ARG 115 1HD ARG 115 -5.434 -19.106 -0.704 862 HE ARG 115 HE ARG 115 -3.654 -20.364 1.097 863 HH11 ARG 115 1HH2 ARG 115 -5.258 -20.918 -1.937 864 HH12 ARG 115 2HH2 ARG 115 -4.007 -21.943 -2.557 865 HH21 ARG 115 1HH1 ARG 115 -2.028 -21.696 0.278 866 HH22 ARG 115 2HH1 ARG 115 -2.182 -22.383 -1.304 867 H GLU 116 H GLU 116 -7.221 -17.807 3.343 868 HA GLU 116 HA GLU 116 -8.818 -15.999 2.024 869 HB2 GLU 116 2HB GLU 116 -9.355 -17.376 4.672 870 HB3 GLU 116 1HB GLU 116 -10.586 -16.666 3.631 871 HG2 GLU 116 2HG GLU 116 -9.964 -18.227 1.819 872 HG3 GLU 116 1HG GLU 116 -8.724 -18.934 2.851 873 H LEU 117 H LEU 117 -7.628 -15.720 5.401 874 HA LEU 117 HA LEU 117 -8.933 -13.277 5.985 875 HB2 LEU 117 2HB LEU 117 -8.029 -14.724 7.741 876 HB3 LEU 117 1HB LEU 117 -6.398 -14.506 7.123 877 HG LEU 117 HG LEU 117 -6.489 -12.086 7.712 878 HD11 LEU 117 1HD1 LEU 117 -8.489 -11.399 9.249 879 HD12 LEU 117 2HD1 LEU 117 -9.327 -12.779 8.545 880 HD13 LEU 117 3HD1 LEU 117 -8.778 -11.460 7.513 881 HD21 LEU 117 3HD2 LEU 117 -6.491 -12.361 10.166 882 HD22 LEU 117 1HD2 LEU 117 -5.665 -13.706 9.378 883 HD23 LEU 117 2HD2 LEU 117 -7.305 -13.916 9.992 884 H GLN 118 H GLN 118 -5.686 -14.017 4.708 885 HA GLN 118 HA GLN 118 -4.700 -11.373 4.665 886 HB2 GLN 118 2HB GLN 118 -4.019 -13.691 2.826 887 HB3 GLN 118 1HB GLN 118 -3.055 -12.227 3.017 888 HG2 GLN 118 2HG GLN 118 -3.709 -14.161 5.263 889 HG3 GLN 118 1HG GLN 118 -2.196 -14.151 4.370 890 HE21 GLN 118 1HE2 GLN 118 -3.469 -13.121 7.243 891 HE22 GLN 118 2HE2 GLN 118 -2.487 -11.764 7.517 892 H GLN 119 H GLN 119 -6.175 -13.278 1.978 893 HA GLN 119 HA GLN 119 -6.138 -11.244 0.070 894 HB2 GLN 119 2HB GLN 119 -6.749 -13.718 -0.204 895 HB3 GLN 119 1HB GLN 119 -8.364 -13.305 0.355 896 HG2 GLN 119 2HG GLN 119 -6.997 -12.058 -2.064 897 HG3 GLN 119 1HG GLN 119 -8.168 -13.365 -2.149 898 HE21 GLN 119 1HE2 GLN 119 -8.129 -10.314 -2.933 899 HE22 GLN 119 2HE2 GLN 119 -9.632 -9.768 -2.362 900 H SER 120 H SER 120 -8.666 -12.058 2.440 901 HA SER 120 HA SER 120 -10.481 -10.009 1.744 902 HB2 SER 120 2HB SER 120 -11.100 -11.926 3.172 903 HB3 SER 120 1HB SER 120 -10.048 -11.316 4.446 904 HG SER 120 HG SER 120 -12.522 -10.414 3.561 905 H GLY 121 H GLY 121 -7.774 -10.101 4.087 906 HA2 GLY 121 2HA GLY 121 -8.215 -7.555 5.232 907 HA3 GLY 121 1HA GLY 121 -6.668 -8.393 5.179 908 H TRP 122 H TRP 122 -6.011 -8.487 2.557 909 HA TRP 122 HA TRP 122 -5.119 -5.849 2.004 910 HB2 TRP 122 2HB TRP 122 -5.223 -8.331 0.238 911 HB3 TRP 122 1HB TRP 122 -4.457 -6.824 -0.263 912 HD1 TRP 122 HD TRP 122 -3.622 -9.988 1.439 913 HE1 TRP 122 1HE TRP 122 -1.378 -9.793 2.683 914 HE3 TRP 122 3HE TRP 122 -2.965 -4.926 1.286 915 HZ2 TRP 122 2HZ TRP 122 0.462 -7.758 3.504 916 HZ3 TRP 122 3HZ TRP 122 -0.960 -3.888 2.297 917 HH2 TRP 122 HH TRP 122 0.756 -5.294 3.404 918 H GLN 123 H GLN 123 -7.866 -7.716 0.741 919 HA GLN 123 HA GLN 123 -8.610 -5.744 -1.211 920 HB2 GLN 123 2HB GLN 123 -9.241 -8.274 -1.079 921 HB3 GLN 123 1HB GLN 123 -10.535 -7.760 0.006 922 HG2 GLN 123 2HG GLN 123 -10.105 -6.747 -2.839 923 HG3 GLN 123 1HG GLN 123 -11.307 -7.934 -2.354 924 HE21 GLN 123 1HE2 GLN 123 -11.234 -4.842 -3.259 925 HE22 GLN 123 2HE2 GLN 123 -12.414 -4.172 -2.240 926 H ALA 124 H ALA 124 -9.488 -6.382 2.160 927 HA ALA 124 HA ALA 124 -11.696 -4.708 2.428 928 HB1 ALA 124 1HB ALA 124 -9.548 -5.300 4.464 929 HB2 ALA 124 2HB ALA 124 -11.004 -6.254 4.185 930 HB3 ALA 124 3HB ALA 124 -11.132 -4.620 4.829 931 H ILE 125 H ILE 125 -8.273 -3.899 3.075 932 HA ILE 125 HA ILE 125 -8.749 -1.151 3.651 933 HB ILE 125 HB ILE 125 -6.781 -2.328 4.469 934 HG12 ILE 125 2HG1 ILE 125 -5.843 -0.206 2.480 935 HG13 ILE 125 1HG1 ILE 125 -6.660 0.184 3.987 936 HG21 ILE 125 1HG2 ILE 125 -4.968 -3.016 2.960 937 HG22 ILE 125 2HG2 ILE 125 -5.902 -2.493 1.564 938 HG23 ILE 125 3HG2 ILE 125 -6.461 -3.841 2.548 939 HD11 ILE 125 3HD1 ILE 125 -4.053 -1.345 3.728 940 HD12 ILE 125 1HD1 ILE 125 -4.880 -1.002 5.247 941 HD13 ILE 125 2HD1 ILE 125 -4.229 0.321 4.281 942 H LEU 126 H LEU 126 -7.956 -2.852 0.644 943 HA LEU 126 HA LEU 126 -7.332 -0.590 -0.923 944 HB2 LEU 126 2HB LEU 126 -8.371 -3.355 -1.528 945 HB3 LEU 126 1HB LEU 126 -8.248 -2.197 -2.842 946 HG LEU 126 HG LEU 126 -5.917 -2.959 -1.025 947 HD11 LEU 126 1HD1 LEU 126 -6.666 -3.967 -3.796 948 HD12 LEU 126 2HD1 LEU 126 -6.552 -4.918 -2.312 949 HD13 LEU 126 3HD1 LEU 126 -5.097 -4.239 -3.039 950 HD21 LEU 126 3HD2 LEU 126 -5.106 -0.983 -1.914 951 HD22 LEU 126 1HD2 LEU 126 -6.236 -0.971 -3.254 952 HD23 LEU 126 2HD2 LEU 126 -4.782 -1.949 -3.345 953 H ASN 127 H ASN 127 -10.527 -2.102 -0.247 954 HA ASN 127 HA ASN 127 -11.945 -0.397 -2.066 955 HB2 ASN 127 2HB ASN 127 -13.979 -1.124 -0.906 956 HB3 ASN 127 1HB ASN 127 -12.926 -2.496 -1.254 957 HD21 ASN 127 1HD2 ASN 127 -13.140 -3.904 0.453 958 HD22 ASN 127 2HD2 ASN 127 -13.071 -3.470 2.090 959 H SER 128 H SER 128 -10.877 -0.002 1.258 960 HA SER 128 HA SER 128 -12.505 2.179 1.999 961 HB2 SER 128 2HB SER 128 -11.004 2.487 3.823 962 HB3 SER 128 1HB SER 128 -10.868 0.768 3.448 963 HG SER 128 HG SER 128 -8.810 1.419 3.472 964 H PHE 129 H PHE 129 -9.454 2.035 0.217 965 HA PHE 129 HA PHE 129 -8.849 4.778 0.180 966 HB2 PHE 129 2HB PHE 129 -7.311 2.937 -0.587 967 HB3 PHE 129 1HB PHE 129 -8.280 2.787 -2.052 968 HD1 PHE 129 1HD PHE 129 -5.905 4.936 -0.194 969 HD2 PHE 129 2HD PHE 129 -8.300 4.598 -3.752 970 HE1 PHE 129 1HE PHE 129 -4.694 6.851 -1.195 971 HE2 PHE 129 2HE PHE 129 -7.079 6.507 -4.745 972 HZ PHE 129 HZ PHE 129 -5.279 7.634 -3.472 973 H LYS 130 H LYS 130 -10.889 2.832 -1.978 974 HA LYS 130 HA LYS 130 -11.448 4.789 -3.920 975 HB2 LYS 130 2HB LYS 130 -13.235 2.534 -2.940 976 HB3 LYS 130 1HB LYS 130 -13.446 3.440 -4.440 977 HG2 LYS 130 2HG LYS 130 -11.290 2.633 -5.278 978 HG3 LYS 130 1HG LYS 130 -10.977 1.806 -3.755 979 HD2 LYS 130 2HD LYS 130 -11.779 0.155 -5.353 980 HD3 LYS 130 1HD LYS 130 -13.033 0.398 -4.143 981 HE2 LYS 130 2HE LYS 130 -14.408 1.633 -5.676 982 HE3 LYS 130 1HE LYS 130 -13.062 1.930 -6.779 983 HZ1 LYS 130 3HZ LYS 130 -13.091 -0.231 -7.523 984 HZ2 LYS 130 1HZ LYS 130 -14.740 0.123 -7.350 985 HZ3 LYS 130 2HZ LYS 130 -13.945 -0.807 -6.172 986 H SER 131 H SER 131 -13.128 4.005 -0.871 987 HA SER 131 HA SER 131 -15.298 5.783 -1.182 988 HB2 SER 131 2HB SER 131 -15.631 5.535 1.219 989 HB3 SER 131 1HB SER 131 -15.168 3.976 0.542 990 HG SER 131 HG SER 131 -13.380 4.046 1.650 991 H TYR 132 H TYR 132 -12.049 6.233 0.152 992 HA TYR 132 HA TYR 132 -12.415 8.828 1.210 993 HB2 TYR 132 2HB TYR 132 -10.465 7.386 1.736 994 HB3 TYR 132 1HB TYR 132 -9.888 7.575 0.082 995 HD1 TYR 132 2HD TYR 132 -10.430 9.311 3.318 996 HD2 TYR 132 1HD TYR 132 -8.935 9.714 -0.697 997 HE1 TYR 132 2HE TYR 132 -9.354 11.457 3.930 998 HE2 TYR 132 1HE TYR 132 -7.867 11.863 -0.079 999 HH TYR 132 HH TYR 132 -7.178 13.118 1.757 1000 H THR 133 H THR 133 -11.305 7.723 -1.991 1001 HA THR 133 HA THR 133 -10.724 10.227 -3.126 1002 HB THR 133 HB THR 133 -11.757 7.695 -4.447 1003 HG1 THR 133 1HG THR 133 -9.736 7.738 -3.170 1004 HG21 THR 133 3HG2 THR 133 -10.435 10.173 -5.618 1005 HG22 THR 133 1HG2 THR 133 -12.014 9.504 -6.044 1006 HG23 THR 133 2HG2 THR 133 -10.539 8.634 -6.470 1007 H GLU 134 H GLU 134 -13.733 8.328 -3.246 1008 HA GLU 134 HA GLU 134 -15.229 10.240 -4.725 1009 HB2 GLU 134 2HB GLU 134 -16.141 8.067 -2.819 1010 HB3 GLU 134 1HB GLU 134 -17.190 8.926 -3.945 1011 HG2 GLU 134 2HG GLU 134 -14.784 7.255 -4.763 1012 HG3 GLU 134 1HG GLU 134 -16.451 6.695 -4.814 1013 H ASN 135 H ASN 135 -14.682 9.719 -1.270 1014 HA ASN 135 HA ASN 135 -16.624 11.553 -0.301 1015 HB2 ASN 135 2HB ASN 135 -15.540 9.852 1.130 1016 HB3 ASN 135 1HB ASN 135 -14.004 10.696 0.967 1017 HD21 ASN 135 1HD2 ASN 135 -17.359 11.167 2.185 1018 HD22 ASN 135 2HD2 ASN 135 -16.930 12.317 3.357 1019 H ASN 136 H ASN 136 -13.267 11.920 -1.349 1020 HA ASN 136 HA ASN 136 -12.848 14.564 -0.430 1021 HB2 ASN 136 2HB ASN 136 -11.020 13.086 -1.194 1022 HB3 ASN 136 1HB ASN 136 -11.641 13.168 -2.838 1023 HD21 ASN 136 1HD2 ASN 136 -10.017 15.057 -0.298 1024 HD22 ASN 136 2HD2 ASN 136 -9.534 16.326 -1.317 1025 H LEU 137 H LEU 137 -14.331 13.254 -3.353 1026 HA LEU 137 HA LEU 137 -15.512 14.221 -5.071 1027 HB2 LEU 137 2HB LEU 137 -15.947 16.461 -3.070 1028 HB3 LEU 137 1HB LEU 137 -16.872 16.208 -4.540 1029 HG LEU 137 HG LEU 137 -16.725 14.081 -2.355 1030 HD11 LEU 137 1HD1 LEU 137 -18.927 14.918 -1.564 1031 HD12 LEU 137 2HD1 LEU 137 -18.811 16.266 -2.696 1032 HD13 LEU 137 3HD1 LEU 137 -17.664 16.134 -1.365 1033 HD21 LEU 137 3HD2 LEU 137 -17.552 13.219 -4.506 1034 HD22 LEU 137 1HD2 LEU 137 -18.654 14.578 -4.671 1035 HD23 LEU 137 2HD2 LEU 137 -18.922 13.365 -3.423 1036 H GLU 138 H GLU 138 -15.796 16.712 -6.089 1037 HA GLU 138 HA GLU 138 -14.713 18.208 -7.469 1038 HB2 GLU 138 2HB GLU 138 -12.790 18.340 -5.122 1039 HB3 GLU 138 1HB GLU 138 -12.900 19.518 -6.429 1040 HG2 GLU 138 2HG GLU 138 -15.223 20.026 -5.810 1041 HG3 GLU 138 1HG GLU 138 -15.167 18.817 -4.532 1042 H HIS 139 H HIS 139 -13.792 15.250 -7.210 1043 HA HIS 139 HA HIS 139 -11.047 15.154 -7.980 1044 HB2 HIS 139 2HB HIS 139 -11.563 12.817 -8.637 1045 HB3 HIS 139 1HB HIS 139 -12.187 13.201 -7.034 1046 HD2 HIS 139 2HD HIS 139 -13.512 11.946 -10.429 1047 HE1 HIS 139 1HE HIS 139 -16.896 12.973 -8.122 1048 HE2 HIS 139 2HE HIS 139 -16.114 11.825 -10.248 1049 H HIS 140 H HIS 140 -10.095 15.155 -9.979 1050 HA HIS 140 HA HIS 140 -11.458 16.416 -12.147 1051 HB2 HIS 140 2HB HIS 140 -9.013 16.635 -11.764 1052 HB3 HIS 140 1HB HIS 140 -8.805 14.927 -12.143 1053 HD2 HIS 140 2HD HIS 140 -9.618 18.296 -14.025 1054 HE1 HIS 140 1HE HIS 140 -9.033 15.275 -16.916 1055 HE2 HIS 140 2HE HIS 140 -9.408 17.763 -16.573 1056 H HIS 141 H HIS 141 -12.253 15.559 -14.039 1057 HA HIS 141 HA HIS 141 -11.960 12.791 -14.774 1058 HB2 HIS 141 2HB HIS 141 -13.651 12.626 -12.922 1059 HB3 HIS 141 1HB HIS 141 -14.716 13.693 -13.834 1060 HD2 HIS 141 2HD HIS 141 -13.640 9.955 -13.785 1061 HE1 HIS 141 1HE HIS 141 -16.125 10.483 -17.157 1062 HE2 HIS 141 2HE HIS 141 -14.935 8.764 -15.715 1063 H HIS 142 H HIS 142 -12.393 12.527 -16.911 1064 HA HIS 142 HA HIS 142 -14.167 14.246 -18.405 1065 HB2 HIS 142 2HB HIS 142 -12.170 15.726 -18.179 1066 HB3 HIS 142 1HB HIS 142 -11.175 14.474 -18.924 1067 HD2 HIS 142 2HD HIS 142 -11.100 14.671 -21.689 1068 HE1 HIS 142 1HE HIS 142 -14.572 17.014 -22.219 1069 HE2 HIS 142 2HE HIS 142 -12.621 15.911 -23.412 1070 H HIS 143 H HIS 143 -14.430 13.533 -20.575 1071 HA HIS 143 HA HIS 143 -14.756 11.873 -22.122 1072 HB2 HIS 143 2HB HIS 143 -12.396 12.497 -22.611 1073 HB3 HIS 143 1HB HIS 143 -11.850 11.256 -21.485 1074 HD2 HIS 143 2HD HIS 143 -13.122 11.540 -25.147 1075 HE1 HIS 143 1HE HIS 143 -12.695 7.427 -24.295 1076 HE2 HIS 143 2HE HIS 143 -13.134 9.123 -26.135 1077 H HIS 144 H HIS 144 -16.255 10.718 -20.807 1078 HA HIS 144 HA HIS 144 -15.571 8.719 -18.932 1079 HB2 HIS 144 2HB HIS 144 -17.907 7.915 -19.291 1080 HB3 HIS 144 1HB HIS 144 -17.825 9.659 -19.045 1081 HD2 HIS 144 2HD HIS 144 -18.652 7.123 -21.931 1082 HE1 HIS 144 1HE HIS 144 -19.420 11.024 -23.351 1083 HE2 HIS 144 2HE HIS 144 -19.642 8.551 -23.881 Start of MODEL 3 1 H1 GLY 1 1HT GLY 1 -4.437 -18.605 -2.603 2 H2 GLY 1 2HT GLY 1 -4.436 -20.300 -2.719 3 H3 GLY 1 3HT GLY 1 -4.830 -19.353 -4.073 4 HA2 GLY 1 2HA GLY 1 -2.379 -20.376 -3.522 5 HA3 GLY 1 1HA GLY 1 -2.714 -19.056 -4.646 6 H ASN 2 H ASN 2 -0.454 -19.638 -2.676 7 HA ASN 2 HA ASN 2 -0.520 -17.740 -0.576 8 HB2 ASN 2 2HB ASN 2 1.103 -19.606 -0.689 9 HB3 ASN 2 1HB ASN 2 1.879 -18.847 -2.074 10 HD21 ASN 2 1HD2 ASN 2 3.737 -17.739 -1.458 11 HD22 ASN 2 2HD2 ASN 2 3.942 -16.921 0.015 12 H LYS 3 H LYS 3 0.589 -17.548 -3.937 13 HA LYS 3 HA LYS 3 1.634 -14.876 -3.728 14 HB2 LYS 3 2HB LYS 3 0.800 -16.504 -6.154 15 HB3 LYS 3 1HB LYS 3 1.707 -14.991 -6.207 16 HG2 LYS 3 2HG LYS 3 3.516 -16.025 -4.876 17 HG3 LYS 3 1HG LYS 3 2.614 -17.542 -4.830 18 HD2 LYS 3 2HD LYS 3 2.719 -17.685 -7.294 19 HD3 LYS 3 1HD LYS 3 3.608 -16.164 -7.349 20 HE2 LYS 3 2HE LYS 3 5.149 -18.088 -7.497 21 HE3 LYS 3 1HE LYS 3 5.427 -17.176 -6.013 22 HZ1 LYS 3 3HZ LYS 3 3.735 -19.608 -6.211 23 HZ2 LYS 3 1HZ LYS 3 4.126 -18.765 -4.793 24 HZ3 LYS 3 2HZ LYS 3 5.338 -19.590 -5.651 25 H ILE 4 H ILE 4 -0.740 -14.631 -2.515 26 HA ILE 4 HA ILE 4 -3.052 -14.124 -3.955 27 HB ILE 4 HB ILE 4 -2.022 -12.503 -1.588 28 HG12 ILE 4 2HG1 ILE 4 -3.807 -14.985 -1.582 29 HG13 ILE 4 1HG1 ILE 4 -2.081 -15.030 -1.232 30 HG21 ILE 4 1HG2 ILE 4 -4.501 -12.162 -1.158 31 HG22 ILE 4 2HG2 ILE 4 -4.829 -12.946 -2.701 32 HG23 ILE 4 3HG2 ILE 4 -3.957 -11.418 -2.653 33 HD11 ILE 4 3HD1 ILE 4 -4.198 -13.522 0.333 34 HD12 ILE 4 1HD1 ILE 4 -2.464 -13.400 0.639 35 HD13 ILE 4 2HD1 ILE 4 -3.293 -14.935 0.867 36 H THR 5 H THR 5 -3.860 -12.379 -5.091 37 HA THR 5 HA THR 5 -2.074 -10.058 -5.629 38 HB THR 5 HB THR 5 -1.789 -11.521 -7.538 39 HG1 THR 5 1HG THR 5 -2.586 -9.159 -7.716 40 HG21 THR 5 3HG2 THR 5 -4.817 -11.651 -7.692 41 HG22 THR 5 1HG2 THR 5 -3.760 -12.974 -7.192 42 HG23 THR 5 2HG2 THR 5 -3.692 -12.363 -8.842 43 H VAL 6 H VAL 6 -3.098 -8.156 -5.772 44 HA VAL 6 HA VAL 6 -6.060 -8.041 -5.853 45 HB VAL 6 HB VAL 6 -5.992 -6.350 -4.003 46 HG11 VAL 6 1HG1 VAL 6 -6.628 -8.697 -3.551 47 HG12 VAL 6 2HG1 VAL 6 -5.803 -7.976 -2.171 48 HG13 VAL 6 3HG1 VAL 6 -4.938 -9.090 -3.231 49 HG21 VAL 6 3HG2 VAL 6 -3.612 -5.716 -4.147 50 HG22 VAL 6 1HG2 VAL 6 -3.132 -7.346 -3.679 51 HG23 VAL 6 2HG2 VAL 6 -3.974 -6.310 -2.529 52 H GLU 7 H GLU 7 -6.845 -5.916 -6.371 53 HA GLU 7 HA GLU 7 -4.935 -3.996 -7.526 54 HB2 GLU 7 2HB GLU 7 -6.172 -3.981 -9.699 55 HB3 GLU 7 1HB GLU 7 -5.352 -5.511 -9.395 56 HG2 GLU 7 2HG GLU 7 -7.477 -6.492 -8.580 57 HG3 GLU 7 1HG GLU 7 -8.306 -4.973 -8.903 58 H VAL 8 H VAL 8 -5.900 -1.951 -8.044 59 HA VAL 8 HA VAL 8 -8.660 -1.454 -7.144 60 HB VAL 8 HB VAL 8 -7.320 -1.203 -5.098 61 HG11 VAL 8 1HG1 VAL 8 -5.574 0.548 -4.954 62 HG12 VAL 8 2HG1 VAL 8 -5.721 0.837 -6.680 63 HG13 VAL 8 3HG1 VAL 8 -5.161 -0.729 -6.093 64 HG21 VAL 8 3HG2 VAL 8 -9.254 0.329 -5.528 65 HG22 VAL 8 1HG2 VAL 8 -8.129 1.527 -6.172 66 HG23 VAL 8 2HG2 VAL 8 -8.030 1.039 -4.479 67 H THR 9 H THR 9 -9.586 0.334 -8.128 68 HA THR 9 HA THR 9 -8.023 1.568 -10.344 69 HB THR 9 HB THR 9 -11.030 1.531 -9.856 70 HG1 THR 9 1HG THR 9 -11.067 -0.212 -11.074 71 HG21 THR 9 3HG2 THR 9 -11.108 2.204 -12.260 72 HG22 THR 9 1HG2 THR 9 -9.350 2.341 -12.262 73 HG23 THR 9 2HG2 THR 9 -10.321 3.425 -11.266 74 H VAL 10 H VAL 10 -7.221 3.568 -9.943 75 HA VAL 10 HA VAL 10 -8.733 5.419 -8.138 76 HB VAL 10 HB VAL 10 -5.715 5.168 -8.435 77 HG11 VAL 10 1HG1 VAL 10 -6.373 7.476 -7.931 78 HG12 VAL 10 2HG1 VAL 10 -5.728 6.750 -6.462 79 HG13 VAL 10 3HG1 VAL 10 -7.470 6.924 -6.666 80 HG21 VAL 10 3HG2 VAL 10 -5.814 4.320 -6.101 81 HG22 VAL 10 1HG2 VAL 10 -6.689 3.264 -7.205 82 HG23 VAL 10 2HG2 VAL 10 -7.576 4.375 -6.162 83 H TYR 11 H TYR 11 -9.235 7.333 -9.026 84 HA TYR 11 HA TYR 11 -8.305 7.944 -11.765 85 HB2 TYR 11 2HB TYR 11 -10.416 9.299 -10.053 86 HB3 TYR 11 1HB TYR 11 -10.097 9.599 -11.763 87 HD1 TYR 11 1HD TYR 11 -10.647 7.878 -13.485 88 HD2 TYR 11 2HD TYR 11 -11.557 7.237 -9.327 89 HE1 TYR 11 1HE TYR 11 -12.138 5.990 -14.094 90 HE2 TYR 11 2HE TYR 11 -13.047 5.354 -9.948 91 HH TYR 11 HH TYR 11 -13.089 3.688 -12.124 92 H ALA 12 H ALA 12 -6.186 8.610 -11.317 93 HA ALA 12 HA ALA 12 -5.866 11.389 -10.718 94 HB1 ALA 12 1HB ALA 12 -4.465 11.156 -8.705 95 HB2 ALA 12 2HB ALA 12 -4.781 9.420 -8.682 96 HB3 ALA 12 3HB ALA 12 -6.096 10.560 -8.405 97 H ALA 13 H ALA 13 -3.761 12.139 -11.209 98 HA ALA 13 HA ALA 13 -2.379 10.667 -13.196 99 HB1 ALA 13 1HB ALA 13 -1.446 13.033 -11.541 100 HB2 ALA 13 2HB ALA 13 -2.341 13.127 -13.057 101 HB3 ALA 13 3HB ALA 13 -0.704 12.470 -13.040 102 H ILE 14 H ILE 14 -0.803 9.158 -13.021 103 HA ILE 14 HA ILE 14 -0.134 7.870 -10.664 104 HB ILE 14 HB ILE 14 0.226 6.897 -12.876 105 HG12 ILE 14 2HG1 ILE 14 2.893 7.092 -11.391 106 HG13 ILE 14 1HG1 ILE 14 1.550 6.100 -10.835 107 HG21 ILE 14 1HG2 ILE 14 1.059 8.994 -13.979 108 HG22 ILE 14 2HG2 ILE 14 2.081 7.595 -14.304 109 HG23 ILE 14 3HG2 ILE 14 2.592 8.800 -13.125 110 HD11 ILE 14 3HD1 ILE 14 3.210 4.822 -12.140 111 HD12 ILE 14 1HD1 ILE 14 2.878 5.833 -13.542 112 HD13 ILE 14 2HD1 ILE 14 1.610 4.801 -12.880 113 H GLU 15 H GLU 15 1.400 10.684 -12.127 114 HA GLU 15 HA GLU 15 3.790 10.699 -10.673 115 HB2 GLU 15 2HB GLU 15 3.225 12.118 -12.677 116 HB3 GLU 15 1HB GLU 15 2.190 13.098 -11.643 117 HG2 GLU 15 2HG GLU 15 4.335 14.225 -11.835 118 HG3 GLU 15 1HG GLU 15 4.219 13.591 -10.196 119 H LYS 16 H LYS 16 0.584 12.027 -9.887 120 HA LYS 16 HA LYS 16 1.425 13.243 -7.412 121 HB2 LYS 16 2HB LYS 16 -0.588 13.977 -8.720 122 HB3 LYS 16 1HB LYS 16 -1.384 12.464 -8.290 123 HG2 LYS 16 2HG LYS 16 -1.212 13.029 -5.893 124 HG3 LYS 16 1HG LYS 16 -0.350 14.514 -6.293 125 HD2 LYS 16 2HD LYS 16 -2.337 15.316 -7.545 126 HD3 LYS 16 1HD LYS 16 -3.193 13.834 -7.118 127 HE2 LYS 16 2HE LYS 16 -3.807 15.672 -5.587 128 HE3 LYS 16 1HE LYS 16 -2.962 14.390 -4.719 129 HZ1 LYS 16 3HZ LYS 16 -1.262 15.733 -4.259 130 HZ2 LYS 16 1HZ LYS 16 -2.281 17.013 -4.702 131 HZ3 LYS 16 2HZ LYS 16 -1.198 16.359 -5.836 132 H VAL 17 H VAL 17 -0.279 10.239 -8.285 133 HA VAL 17 HA VAL 17 -0.673 9.287 -5.657 134 HB VAL 17 HB VAL 17 -0.368 7.687 -8.216 135 HG11 VAL 17 1HG1 VAL 17 -1.806 6.026 -6.986 136 HG12 VAL 17 2HG1 VAL 17 -1.625 7.001 -5.528 137 HG13 VAL 17 3HG1 VAL 17 -0.219 6.222 -6.255 138 HG21 VAL 17 3HG2 VAL 17 -2.843 7.831 -8.299 139 HG22 VAL 17 1HG2 VAL 17 -2.110 9.430 -8.381 140 HG23 VAL 17 2HG2 VAL 17 -2.829 8.867 -6.870 141 H TRP 18 H TRP 18 1.997 8.768 -7.964 142 HA TRP 18 HA TRP 18 3.426 6.856 -6.523 143 HB2 TRP 18 2HB TRP 18 3.938 7.572 -8.850 144 HB3 TRP 18 1HB TRP 18 4.541 9.107 -8.235 145 HD1 TRP 18 HD TRP 18 5.314 5.349 -8.171 146 HE1 TRP 18 1HE TRP 18 7.803 5.028 -7.593 147 HE3 TRP 18 3HE TRP 18 6.647 10.187 -7.161 148 HZ2 TRP 18 2HZ TRP 18 10.046 6.579 -6.821 149 HZ3 TRP 18 3HZ TRP 18 8.980 10.726 -6.504 150 HH2 TRP 18 HH TRP 18 10.682 8.918 -6.332 151 H LYS 19 H LYS 19 3.527 10.405 -6.290 152 HA LYS 19 HA LYS 19 5.589 10.524 -4.326 153 HB2 LYS 19 2HB LYS 19 4.944 12.434 -5.801 154 HB3 LYS 19 1HB LYS 19 3.416 12.566 -4.932 155 HG2 LYS 19 2HG LYS 19 4.629 13.016 -2.833 156 HG3 LYS 19 1HG LYS 19 6.165 12.822 -3.674 157 HD2 LYS 19 2HD LYS 19 5.612 14.750 -5.120 158 HD3 LYS 19 1HD LYS 19 4.077 14.943 -4.276 159 HE2 LYS 19 2HE LYS 19 5.284 15.342 -2.157 160 HE3 LYS 19 1HE LYS 19 6.825 15.138 -2.990 161 HZ1 LYS 19 3HZ LYS 19 5.500 17.477 -2.664 162 HZ2 LYS 19 1HZ LYS 19 5.093 17.045 -4.253 163 HZ3 LYS 19 2HZ LYS 19 6.726 17.188 -3.804 164 H TYR 20 H TYR 20 2.015 10.679 -4.119 165 HA TYR 20 HA TYR 20 1.884 11.009 -1.303 166 HB2 TYR 20 2HB TYR 20 -0.043 10.228 -3.486 167 HB3 TYR 20 1HB TYR 20 -0.548 9.949 -1.824 168 HD1 TYR 20 2HD TYR 20 1.289 12.695 -3.674 169 HD2 TYR 20 1HD TYR 20 -1.930 11.715 -0.993 170 HE1 TYR 20 2HE TYR 20 0.703 15.092 -3.484 171 HE2 TYR 20 1HE TYR 20 -2.501 14.110 -0.807 172 HH TYR 20 HH TYR 20 -1.017 16.520 -2.846 173 H TRP 21 H TRP 21 1.758 8.107 -3.332 174 HA TRP 21 HA TRP 21 1.176 6.248 -1.292 175 HB2 TRP 21 2HB TRP 21 1.039 5.797 -3.752 176 HB3 TRP 21 1HB TRP 21 2.801 5.836 -3.850 177 HD1 TRP 21 HD TRP 21 3.964 3.552 -3.462 178 HE1 TRP 21 1HE TRP 21 3.260 1.284 -2.457 179 HE3 TRP 21 3HE TRP 21 -0.712 4.752 -1.848 180 HZ2 TRP 21 2HZ TRP 21 0.980 0.136 -1.137 181 HZ3 TRP 21 3HZ TRP 21 -2.137 3.067 -0.730 182 HH2 TRP 21 HH TRP 21 -1.298 0.759 -0.374 183 H ASN 22 H ASN 22 4.039 8.009 -2.070 184 HA ASN 22 HA ASN 22 5.786 6.289 -0.379 185 HB2 ASN 22 2HB ASN 22 6.486 8.505 -2.327 186 HB3 ASN 22 1HB ASN 22 7.629 7.500 -1.434 187 HD21 ASN 22 1HD2 ASN 22 5.994 5.007 -1.809 188 HD22 ASN 22 2HD2 ASN 22 6.196 4.577 -3.439 189 H GLU 23 H GLU 23 4.242 9.417 -0.562 190 HA GLU 23 HA GLU 23 5.939 10.877 1.121 191 HB2 GLU 23 2HB GLU 23 4.077 11.823 -0.288 192 HB3 GLU 23 1HB GLU 23 2.935 11.222 0.897 193 HG2 GLU 23 2HG GLU 23 3.352 13.563 1.381 194 HG3 GLU 23 1HG GLU 23 4.136 12.618 2.647 195 HA PRO 24 HA PRO 24 4.836 8.480 4.836 196 HB2 PRO 24 2HB PRO 24 6.311 9.781 6.754 197 HB3 PRO 24 1HB PRO 24 7.065 8.738 5.531 198 HG2 PRO 24 2HG PRO 24 6.789 11.735 5.515 199 HG3 PRO 24 1HG PRO 24 8.228 10.750 5.172 200 HD2 PRO 24 2HD PRO 24 6.683 11.763 3.162 201 HD3 PRO 24 1HD PRO 24 7.482 10.184 2.993 202 H ALA 25 H ALA 25 4.715 12.033 4.899 203 HA ALA 25 HA ALA 25 3.036 12.343 7.123 204 HB1 ALA 25 1HB ALA 25 4.218 14.216 6.045 205 HB2 ALA 25 2HB ALA 25 2.493 14.551 6.198 206 HB3 ALA 25 3HB ALA 25 3.166 14.073 4.638 207 H HIS 26 H HIS 26 2.257 11.715 3.728 208 HA HIS 26 HA HIS 26 -0.560 12.042 3.965 209 HB2 HIS 26 2HB HIS 26 0.621 12.026 1.780 210 HB3 HIS 26 1HB HIS 26 0.992 10.317 2.003 211 HD2 HIS 26 2HD HIS 26 -0.822 8.875 0.525 212 HE1 HIS 26 1HE HIS 26 -4.240 11.242 1.259 213 HE2 HIS 26 2HE HIS 26 -3.389 9.133 0.126 214 H ILE 27 H ILE 27 1.549 9.167 4.234 215 HA ILE 27 HA ILE 27 -0.534 7.276 4.539 216 HB ILE 27 HB ILE 27 2.346 7.239 5.539 217 HG12 ILE 27 2HG1 ILE 27 1.089 5.874 3.104 218 HG13 ILE 27 1HG1 ILE 27 1.931 7.419 3.017 219 HG21 ILE 27 1HG2 ILE 27 1.080 5.577 6.825 220 HG22 ILE 27 2HG2 ILE 27 2.008 4.717 5.610 221 HG23 ILE 27 3HG2 ILE 27 0.289 4.991 5.359 222 HD11 ILE 27 3HD1 ILE 27 3.462 5.609 2.410 223 HD12 ILE 27 1HD1 ILE 27 3.134 4.789 3.937 224 HD13 ILE 27 2HD1 ILE 27 3.979 6.338 3.932 225 H MET 28 H MET 28 1.320 9.138 6.961 226 HA MET 28 HA MET 28 0.141 7.970 9.234 227 HB2 MET 28 2HB MET 28 1.348 10.725 8.952 228 HB3 MET 28 1HB MET 28 1.023 9.901 10.476 229 HG2 MET 28 2HG MET 28 2.544 8.032 8.936 230 HG3 MET 28 1HG MET 28 3.343 9.575 8.694 231 HE1 MET 28 3HE MET 28 4.714 10.858 10.533 232 HE2 MET 28 1HE MET 28 4.211 10.768 12.227 233 HE3 MET 28 2HE MET 28 3.051 11.226 10.982 234 H LYS 29 H LYS 29 -1.446 9.648 6.910 235 HA LYS 29 HA LYS 29 -3.312 11.061 8.721 236 HB2 LYS 29 2HB LYS 29 -2.309 12.152 6.653 237 HB3 LYS 29 1HB LYS 29 -3.274 11.048 5.679 238 HG2 LYS 29 2HG LYS 29 -5.342 11.922 6.726 239 HG3 LYS 29 1HG LYS 29 -4.376 13.024 7.707 240 HD2 LYS 29 2HD LYS 29 -3.498 14.081 5.638 241 HD3 LYS 29 1HD LYS 29 -4.497 12.996 4.674 242 HE2 LYS 29 2HE LYS 29 -6.530 13.934 5.722 243 HE3 LYS 29 1HE LYS 29 -5.528 15.020 6.684 244 HZ1 LYS 29 3HZ LYS 29 -4.964 15.104 3.857 245 HZ2 LYS 29 1HZ LYS 29 -5.203 16.378 4.951 246 HZ3 LYS 29 2HZ LYS 29 -6.541 15.601 4.249 247 H TRP 30 H TRP 30 -3.435 8.717 6.005 248 HA TRP 30 HA TRP 30 -6.228 7.983 6.733 249 HB2 TRP 30 2HB TRP 30 -6.360 6.981 4.489 250 HB3 TRP 30 1HB TRP 30 -5.913 8.684 4.421 251 HD1 TRP 30 HD TRP 30 -3.531 9.305 3.536 252 HE1 TRP 30 1HE TRP 30 -1.670 7.976 2.355 253 HE3 TRP 30 3HE TRP 30 -5.197 4.500 4.344 254 HZ2 TRP 30 2HZ TRP 30 -0.970 5.272 1.796 255 HZ3 TRP 30 3HZ TRP 30 -3.904 2.596 3.467 256 HH2 TRP 30 HH TRP 30 -1.799 2.961 2.203 257 H CYS 31 H CYS 31 -3.139 6.768 7.354 258 HA CYS 31 HA CYS 31 -3.587 3.979 6.901 259 HB2 CYS 31 2HB CYS 31 -1.688 3.698 8.487 260 HB3 CYS 31 1HB CYS 31 -1.334 4.883 7.226 261 HG CYS 31 HG CYS 31 -2.117 5.646 10.156 262 H GLN 32 H GLN 32 -5.862 4.097 7.714 263 HA GLN 32 HA GLN 32 -6.001 3.035 10.426 264 HB2 GLN 32 2HB GLN 32 -7.894 4.592 11.033 265 HB3 GLN 32 1HB GLN 32 -6.332 5.403 10.919 266 HG2 GLN 32 2HG GLN 32 -6.873 6.181 8.648 267 HG3 GLN 32 1HG GLN 32 -8.420 5.349 8.714 268 HE21 GLN 32 1HE2 GLN 32 -7.800 8.323 8.516 269 HE22 GLN 32 2HE2 GLN 32 -8.649 9.016 9.812 270 H ALA 33 H ALA 33 -6.150 1.739 8.178 271 HA ALA 33 HA ALA 33 -8.665 1.524 6.923 272 HB1 ALA 33 1HB ALA 33 -6.532 -0.593 7.284 273 HB2 ALA 33 2HB ALA 33 -6.518 0.668 6.046 274 HB3 ALA 33 3HB ALA 33 -7.784 -0.572 6.040 275 H SER 34 H SER 34 -7.818 0.848 10.120 276 HA SER 34 HA SER 34 -10.329 -0.613 10.596 277 HB2 SER 34 2HB SER 34 -8.680 -2.411 10.383 278 HB3 SER 34 1HB SER 34 -7.599 -1.583 11.496 279 HG SER 34 HG SER 34 -8.647 -2.546 13.027 280 HA PRO 35 HA PRO 35 -9.983 2.389 13.993 281 HB2 PRO 35 2HB PRO 35 -12.135 1.734 15.535 282 HB3 PRO 35 1HB PRO 35 -12.345 2.414 13.902 283 HG2 PRO 35 2HG PRO 35 -12.380 -0.488 14.729 284 HG3 PRO 35 1HG PRO 35 -13.580 0.399 13.762 285 HD2 PRO 35 2HD PRO 35 -11.652 -1.104 12.555 286 HD3 PRO 35 1HD PRO 35 -12.193 0.423 11.829 287 H GLU 36 H GLU 36 -9.601 -1.005 14.391 288 HA GLU 36 HA GLU 36 -9.027 -0.922 17.260 289 HB2 GLU 36 2HB GLU 36 -10.078 -2.889 15.890 290 HB3 GLU 36 1HB GLU 36 -8.429 -3.261 15.405 291 HG2 GLU 36 2HG GLU 36 -7.796 -3.445 17.826 292 HG3 GLU 36 1HG GLU 36 -9.466 -3.115 18.265 293 H TRP 37 H TRP 37 -7.424 0.497 14.972 294 HA TRP 37 HA TRP 37 -4.776 -0.036 16.153 295 HB2 TRP 37 2HB TRP 37 -5.362 -0.272 13.172 296 HB3 TRP 37 1HB TRP 37 -3.738 -0.144 13.850 297 HD1 TRP 37 HD TRP 37 -6.687 -2.550 13.587 298 HE1 TRP 37 1HE TRP 37 -5.926 -4.890 14.344 299 HE3 TRP 37 3HE TRP 37 -2.033 -1.428 15.367 300 HZ2 TRP 37 2HZ TRP 37 -3.641 -6.125 15.552 301 HZ3 TRP 37 3HZ TRP 37 -0.595 -3.209 16.319 302 HH2 TRP 37 HH TRP 37 -1.389 -5.549 16.410 303 H HIS 38 H HIS 38 -3.376 1.663 16.060 304 HA HIS 38 HA HIS 38 -4.322 4.239 14.887 305 HB2 HIS 38 2HB HIS 38 -4.737 4.162 17.366 306 HB3 HIS 38 1HB HIS 38 -3.016 3.876 17.618 307 HD2 HIS 38 2HD HIS 38 -5.402 6.820 16.596 308 HE1 HIS 38 1HE HIS 38 -1.477 8.359 16.839 309 HE2 HIS 38 2HE HIS 38 -3.921 8.969 16.506 310 H VAL 39 H VAL 39 -2.510 5.787 14.606 311 HA VAL 39 HA VAL 39 0.049 4.411 13.944 312 HB VAL 39 HB VAL 39 -1.213 5.196 12.015 313 HG11 VAL 39 1HG1 VAL 39 -2.184 7.283 13.495 314 HG12 VAL 39 2HG1 VAL 39 -2.116 7.344 11.739 315 HG13 VAL 39 3HG1 VAL 39 -0.862 8.127 12.687 316 HG21 VAL 39 3HG2 VAL 39 0.583 6.410 10.939 317 HG22 VAL 39 1HG2 VAL 39 1.329 5.298 12.075 318 HG23 VAL 39 2HG2 VAL 39 1.188 7.013 12.473 319 HA PRO 40 HA PRO 40 1.143 7.586 17.138 320 HB2 PRO 40 2HB PRO 40 3.179 6.297 18.407 321 HB3 PRO 40 1HB PRO 40 1.481 5.853 18.699 322 HG2 PRO 40 2HG PRO 40 3.499 4.505 16.922 323 HG3 PRO 40 1HG PRO 40 2.333 3.773 18.044 324 HD2 PRO 40 2HD PRO 40 1.885 3.988 15.312 325 HD3 PRO 40 1HD PRO 40 0.562 3.914 16.492 326 H ALA 41 H ALA 41 2.985 6.025 14.656 327 HA ALA 41 HA ALA 41 4.302 8.374 13.819 328 HB1 ALA 41 1HB ALA 41 5.724 8.134 15.810 329 HB2 ALA 41 2HB ALA 41 6.671 7.736 14.384 330 HB3 ALA 41 3HB ALA 41 6.038 6.449 15.412 331 H ALA 42 H ALA 42 5.773 7.968 12.017 332 HA ALA 42 HA ALA 42 6.119 5.266 11.037 333 HB1 ALA 42 1HB ALA 42 3.736 6.108 10.293 334 HB2 ALA 42 2HB ALA 42 4.774 5.329 9.098 335 HB3 ALA 42 3HB ALA 42 4.634 7.081 9.133 336 H GLN 43 H GLN 43 7.664 5.106 9.404 337 HA GLN 43 HA GLN 43 9.014 7.595 8.503 338 HB2 GLN 43 2HB GLN 43 10.407 5.148 9.656 339 HB3 GLN 43 1HB GLN 43 11.206 6.560 8.968 340 HG2 GLN 43 2HG GLN 43 9.394 6.596 11.407 341 HG3 GLN 43 1HG GLN 43 11.155 6.639 11.452 342 HE21 GLN 43 1HE2 GLN 43 11.955 8.524 9.702 343 HE22 GLN 43 2HE2 GLN 43 11.196 10.019 9.974 344 H ASN 44 H ASN 44 9.962 7.459 6.505 345 HA ASN 44 HA ASN 44 10.078 4.939 5.030 346 HB2 ASN 44 2HB ASN 44 7.701 5.646 4.774 347 HB3 ASN 44 1HB ASN 44 8.244 7.178 4.107 348 HD21 ASN 44 1HD2 ASN 44 7.564 6.956 1.933 349 HD22 ASN 44 2HD2 ASN 44 8.078 5.701 0.912 350 H ASP 45 H ASP 45 12.166 5.201 4.477 351 HA ASP 45 HA ASP 45 13.133 7.773 3.348 352 HB2 ASP 45 2HB ASP 45 14.618 5.259 4.181 353 HB3 ASP 45 1HB ASP 45 15.362 6.745 3.595 354 H LEU 46 H LEU 46 12.005 7.558 1.318 355 HA LEU 46 HA LEU 46 12.199 5.272 -0.340 356 HB2 LEU 46 2HB LEU 46 10.492 7.048 -0.634 357 HB3 LEU 46 1HB LEU 46 11.757 8.179 -1.106 358 HG LEU 46 HG LEU 46 12.313 6.660 -3.049 359 HD11 LEU 46 1HD1 LEU 46 11.564 4.489 -2.508 360 HD12 LEU 46 2HD1 LEU 46 10.340 5.015 -3.652 361 HD13 LEU 46 3HD1 LEU 46 9.997 5.054 -1.923 362 HD21 LEU 46 3HD2 LEU 46 10.367 7.274 -4.403 363 HD22 LEU 46 1HD2 LEU 46 10.853 8.605 -3.361 364 HD23 LEU 46 2HD2 LEU 46 9.451 7.625 -2.951 365 H LYS 47 H LYS 47 14.353 4.562 -0.472 366 HA LYS 47 HA LYS 47 15.922 5.748 -2.542 367 HB2 LYS 47 2HB LYS 47 16.459 7.290 -0.630 368 HB3 LYS 47 1HB LYS 47 17.070 5.909 0.278 369 HG2 LYS 47 2HG LYS 47 18.786 5.498 -1.437 370 HG3 LYS 47 1HG LYS 47 18.136 6.807 -2.428 371 HD2 LYS 47 2HD LYS 47 18.661 8.424 -0.627 372 HD3 LYS 47 1HD LYS 47 19.328 7.114 0.349 373 HE2 LYS 47 2HE LYS 47 20.344 7.989 -2.375 374 HE3 LYS 47 1HE LYS 47 21.128 8.317 -0.830 375 HZ1 LYS 47 3HZ LYS 47 22.148 6.376 -1.043 376 HZ2 LYS 47 1HZ LYS 47 21.253 5.984 -2.429 377 HZ3 LYS 47 2HZ LYS 47 20.647 5.597 -0.890 378 H ALA 48 H ALA 48 17.446 4.294 -3.310 379 HA ALA 48 HA ALA 48 17.111 1.566 -2.732 380 HB1 ALA 48 1HB ALA 48 18.017 2.415 -4.860 381 HB2 ALA 48 2HB ALA 48 19.115 1.241 -4.134 382 HB3 ALA 48 3HB ALA 48 19.470 2.965 -4.027 383 H GLY 49 H GLY 49 18.132 0.166 -1.347 384 HA2 GLY 49 2HA GLY 49 19.522 -0.611 0.319 385 HA3 GLY 49 1HA GLY 49 20.631 0.707 -0.054 386 H GLY 50 H GLY 50 17.648 2.068 0.417 387 HA2 GLY 50 2HA GLY 50 18.366 3.157 3.022 388 HA3 GLY 50 1HA GLY 50 16.953 3.570 2.052 389 H THR 51 H THR 51 16.888 3.077 4.858 390 HA THR 51 HA THR 51 15.274 0.561 5.017 391 HB THR 51 HB THR 51 16.847 1.933 7.218 392 HG1 THR 51 1HG THR 51 18.225 0.932 5.777 393 HG21 THR 51 3HG2 THR 51 14.936 0.750 8.152 394 HG22 THR 51 1HG2 THR 51 16.377 -0.222 8.437 395 HG23 THR 51 2HG2 THR 51 15.264 -0.661 7.144 396 H PHE 52 H PHE 52 13.445 0.627 6.378 397 HA PHE 52 HA PHE 52 12.366 3.306 7.102 398 HB2 PHE 52 2HB PHE 52 10.203 2.728 6.139 399 HB3 PHE 52 1HB PHE 52 11.444 2.649 4.891 400 HD1 PHE 52 2HD PHE 52 12.206 0.463 3.989 401 HD2 PHE 52 1HD PHE 52 9.140 0.670 7.003 402 HE1 PHE 52 2HE PHE 52 11.616 -1.907 3.561 403 HE2 PHE 52 1HE PHE 52 8.558 -1.705 6.575 404 HZ PHE 52 HZ PHE 52 9.797 -2.987 4.851 405 H THR 53 H THR 53 10.509 3.156 8.557 406 HA THR 53 HA THR 53 10.155 0.660 10.050 407 HB THR 53 HB THR 53 11.155 3.177 11.444 408 HG1 THR 53 1HG THR 53 12.794 2.153 10.255 409 HG21 THR 53 3HG2 THR 53 9.684 1.796 12.853 410 HG22 THR 53 1HG2 THR 53 11.353 1.644 13.396 411 HG23 THR 53 2HG2 THR 53 10.619 0.357 12.443 412 H THR 54 H THR 54 8.004 0.492 10.153 413 HA THR 54 HA THR 54 6.328 2.921 10.595 414 HB THR 54 HB THR 54 5.526 0.312 9.255 415 HG1 THR 54 1HG THR 54 6.805 1.260 7.816 416 HG21 THR 54 3HG2 THR 54 3.619 1.483 10.253 417 HG22 THR 54 1HG2 THR 54 3.573 1.697 8.503 418 HG23 THR 54 2HG2 THR 54 4.136 3.007 9.535 419 H THR 55 H THR 55 5.491 3.014 12.608 420 HA THR 55 HA THR 55 5.395 0.565 14.265 421 HB THR 55 HB THR 55 4.900 3.476 15.019 422 HG1 THR 55 1HG THR 55 7.143 2.120 14.433 423 HG21 THR 55 3HG2 THR 55 5.357 2.644 17.315 424 HG22 THR 55 1HG2 THR 55 5.473 0.999 16.689 425 HG23 THR 55 2HG2 THR 55 3.936 1.864 16.624 426 H MET 56 H MET 56 3.518 -0.520 14.548 427 HA MET 56 HA MET 56 0.908 0.896 14.246 428 HB2 MET 56 2HB MET 56 1.673 -1.854 13.191 429 HB3 MET 56 1HB MET 56 0.037 -1.192 13.193 430 HG2 MET 56 2HG MET 56 0.837 0.713 11.795 431 HG3 MET 56 1HG MET 56 2.433 -0.037 11.739 432 HE1 MET 56 3HE MET 56 1.124 -0.546 8.164 433 HE2 MET 56 1HE MET 56 2.642 -0.481 9.070 434 HE3 MET 56 2HE MET 56 1.424 0.772 9.295 435 H ALA 57 H ALA 57 0.259 0.968 16.324 436 HA ALA 57 HA ALA 57 0.364 -1.545 17.959 437 HB1 ALA 57 1HB ALA 57 1.797 0.243 18.859 438 HB2 ALA 57 2HB ALA 57 0.436 -0.091 19.932 439 HB3 ALA 57 3HB ALA 57 0.415 1.338 18.895 440 H ALA 58 H ALA 58 -1.438 -2.160 19.063 441 HA ALA 58 HA ALA 58 -3.983 -1.370 18.012 442 HB1 ALA 58 1HB ALA 58 -4.906 -2.918 19.676 443 HB2 ALA 58 2HB ALA 58 -3.326 -3.036 20.455 444 HB3 ALA 58 3HB ALA 58 -3.552 -3.654 18.818 445 H LYS 59 H LYS 59 -5.670 -0.207 19.078 446 HA LYS 59 HA LYS 59 -4.901 2.055 20.517 447 HB2 LYS 59 2HB LYS 59 -6.995 1.807 19.184 448 HB3 LYS 59 1HB LYS 59 -7.633 0.721 20.418 449 HG2 LYS 59 2HG LYS 59 -7.483 2.516 22.097 450 HG3 LYS 59 1HG LYS 59 -6.796 3.596 20.885 451 HD2 LYS 59 2HD LYS 59 -8.875 3.400 19.547 452 HD3 LYS 59 1HD LYS 59 -9.556 2.335 20.778 453 HE2 LYS 59 2HE LYS 59 -8.699 5.218 21.199 454 HE3 LYS 59 1HE LYS 59 -10.362 4.637 21.100 455 HZ1 LYS 59 3HZ LYS 59 -9.532 3.055 22.993 456 HZ2 LYS 59 1HZ LYS 59 -10.053 4.631 23.343 457 HZ3 LYS 59 2HZ LYS 59 -8.391 4.290 23.240 458 H ASP 60 H ASP 60 -6.161 -1.077 21.609 459 HA ASP 60 HA ASP 60 -6.288 -0.350 24.406 460 HB2 ASP 60 2HB ASP 60 -6.333 -3.052 23.020 461 HB3 ASP 60 1HB ASP 60 -6.707 -2.775 24.721 462 H GLY 61 H GLY 61 -3.777 -1.061 22.272 463 HA2 GLY 61 2HA GLY 61 -1.521 -1.384 22.580 464 HA3 GLY 61 1HA GLY 61 -1.769 -1.042 24.291 465 H SER 62 H SER 62 -3.765 -3.532 23.076 466 HA SER 62 HA SER 62 -2.656 -5.513 24.784 467 HB2 SER 62 2HB SER 62 -5.019 -5.496 24.091 468 HB3 SER 62 1HB SER 62 -4.539 -5.822 22.428 469 HG SER 62 HG SER 62 -5.098 -7.616 24.099 470 H MET 63 H MET 63 -1.884 -4.468 21.605 471 HA MET 63 HA MET 63 0.226 -6.513 21.393 472 HB2 MET 63 2HB MET 63 -1.796 -7.431 20.199 473 HB3 MET 63 1HB MET 63 -1.767 -6.027 19.132 474 HG2 MET 63 2HG MET 63 0.503 -6.647 18.368 475 HG3 MET 63 1HG MET 63 0.502 -8.025 19.468 476 HE1 MET 63 3HE MET 63 0.963 -8.082 16.199 477 HE2 MET 63 1HE MET 63 0.257 -9.693 16.005 478 HE3 MET 63 2HE MET 63 1.237 -9.322 17.422 479 H SER 64 H SER 64 1.987 -5.832 20.192 480 HA SER 64 HA SER 64 1.909 -3.220 18.820 481 HB2 SER 64 2HB SER 64 2.591 -2.707 21.129 482 HB3 SER 64 1HB SER 64 3.868 -3.916 21.029 483 HG SER 64 HG SER 64 4.821 -2.704 19.390 484 H PHE 65 H PHE 65 3.267 -3.136 17.087 485 HA PHE 65 HA PHE 65 5.523 -4.933 16.784 486 HB2 PHE 65 2HB PHE 65 3.581 -6.397 16.150 487 HB3 PHE 65 1HB PHE 65 3.162 -5.245 14.883 488 HD1 PHE 65 1HD PHE 65 5.676 -7.738 16.005 489 HD2 PHE 65 2HD PHE 65 4.564 -5.019 12.859 490 HE1 PHE 65 1HE PHE 65 7.350 -8.781 14.504 491 HE2 PHE 65 2HE PHE 65 6.237 -6.075 11.365 492 HZ PHE 65 HZ PHE 65 7.628 -7.953 12.186 493 H ASP 66 H ASP 66 6.729 -4.470 14.828 494 HA ASP 66 HA ASP 66 6.036 -1.947 13.429 495 HB2 ASP 66 2HB ASP 66 8.334 -1.118 13.746 496 HB3 ASP 66 1HB ASP 66 7.513 -1.320 15.291 497 H PHE 67 H PHE 67 6.478 -2.002 11.305 498 HA PHE 67 HA PHE 67 7.741 -4.431 10.172 499 HB2 PHE 67 2HB PHE 67 6.171 -2.159 8.892 500 HB3 PHE 67 1HB PHE 67 6.818 -3.552 8.021 501 HD1 PHE 67 2HD PHE 67 5.903 -5.824 8.384 502 HD2 PHE 67 1HD PHE 67 4.248 -2.414 10.418 503 HE1 PHE 67 2HE PHE 67 3.914 -7.166 9.025 504 HE2 PHE 67 1HE PHE 67 2.266 -3.760 11.056 505 HZ PHE 67 HZ PHE 67 2.099 -6.134 10.359 506 H GLY 68 H GLY 68 9.609 -4.371 9.023 507 HA2 GLY 68 2HA GLY 68 10.851 -1.829 8.235 508 HA3 GLY 68 1HA GLY 68 11.706 -2.786 9.446 509 H GLY 69 H GLY 69 12.526 -2.094 6.744 510 HA2 GLY 69 2HA GLY 69 13.579 -4.600 5.899 511 HA3 GLY 69 1HA GLY 69 12.243 -4.115 4.854 512 H VAL 70 H VAL 70 14.267 -4.206 3.373 513 HA VAL 70 HA VAL 70 15.425 -1.461 3.181 514 HB VAL 70 HB VAL 70 16.831 -4.077 2.524 515 HG11 VAL 70 1HG1 VAL 70 18.828 -2.578 2.275 516 HG12 VAL 70 2HG1 VAL 70 17.773 -1.181 2.492 517 HG13 VAL 70 3HG1 VAL 70 17.579 -2.226 1.085 518 HG21 VAL 70 3HG2 VAL 70 18.256 -3.514 4.486 519 HG22 VAL 70 1HG2 VAL 70 16.578 -3.762 4.960 520 HG23 VAL 70 2HG2 VAL 70 17.223 -2.127 4.831 521 H TYR 71 H TYR 71 15.296 -0.529 1.211 522 HA TYR 71 HA TYR 71 13.623 -1.737 -0.823 523 HB2 TYR 71 2HB TYR 71 15.224 0.851 -0.770 524 HB3 TYR 71 1HB TYR 71 14.127 0.391 -2.073 525 HD1 TYR 71 2HD TYR 71 11.671 0.018 -1.586 526 HD2 TYR 71 1HD TYR 71 14.328 1.734 1.337 527 HE1 TYR 71 2HE TYR 71 9.728 0.844 -0.290 528 HE2 TYR 71 1HE TYR 71 12.375 2.547 2.622 529 HH TYR 71 HH TYR 71 9.051 1.851 1.551 530 H ASP 72 H ASP 72 14.338 -3.163 -2.297 531 HA ASP 72 HA ASP 72 17.136 -3.671 -2.762 532 HB2 ASP 72 2HB ASP 72 15.419 -5.446 -2.901 533 HB3 ASP 72 1HB ASP 72 14.687 -4.631 -4.279 534 H GLN 73 H GLN 73 14.546 -1.954 -4.422 535 HA GLN 73 HA GLN 73 16.406 -0.307 -5.870 536 HB2 GLN 73 2HB GLN 73 16.409 -2.464 -7.209 537 HB3 GLN 73 1HB GLN 73 14.693 -2.219 -7.514 538 HG2 GLN 73 2HG GLN 73 15.927 -1.373 -9.431 539 HG3 GLN 73 1HG GLN 73 15.269 0.014 -8.567 540 HE21 GLN 73 1HE2 GLN 73 16.849 1.602 -8.925 541 HE22 GLN 73 2HE2 GLN 73 18.494 1.412 -8.553 542 H VAL 74 H VAL 74 15.396 1.485 -6.821 543 HA VAL 74 HA VAL 74 12.447 1.761 -6.495 544 HB VAL 74 HB VAL 74 14.521 3.843 -5.689 545 HG11 VAL 74 1HG1 VAL 74 12.448 4.872 -6.533 546 HG12 VAL 74 2HG1 VAL 74 12.516 5.039 -4.790 547 HG13 VAL 74 3HG1 VAL 74 11.480 3.812 -5.509 548 HG21 VAL 74 3HG2 VAL 74 12.685 2.107 -3.994 549 HG22 VAL 74 1HG2 VAL 74 13.710 3.406 -3.382 550 HG23 VAL 74 2HG2 VAL 74 14.442 1.966 -4.090 551 H LYS 75 H LYS 75 11.495 2.613 -8.283 552 HA LYS 75 HA LYS 75 13.050 4.266 -10.182 553 HB2 LYS 75 2HB LYS 75 11.545 1.734 -10.868 554 HB3 LYS 75 1HB LYS 75 12.123 2.890 -12.069 555 HG2 LYS 75 2HG LYS 75 14.463 2.524 -11.156 556 HG3 LYS 75 1HG LYS 75 13.813 1.225 -10.156 557 HD2 LYS 75 2HD LYS 75 13.636 1.325 -13.196 558 HD3 LYS 75 1HD LYS 75 14.821 0.392 -12.291 559 HE2 LYS 75 2HE LYS 75 12.826 -0.779 -11.144 560 HE3 LYS 75 1HE LYS 75 11.816 -0.047 -12.393 561 HZ1 LYS 75 3HZ LYS 75 14.144 -1.251 -13.495 562 HZ2 LYS 75 1HZ LYS 75 12.511 -1.508 -13.871 563 HZ3 LYS 75 2HZ LYS 75 13.231 -2.369 -12.598 564 H THR 76 H THR 76 11.848 6.033 -10.540 565 HA THR 76 HA THR 76 9.270 6.406 -9.547 566 HB THR 76 HB THR 76 10.581 7.949 -11.808 567 HG1 THR 76 1HG THR 76 10.702 8.366 -9.009 568 HG21 THR 76 3HG2 THR 76 8.219 8.557 -11.483 569 HG22 THR 76 1HG2 THR 76 9.257 9.842 -10.872 570 HG23 THR 76 2HG2 THR 76 8.483 8.726 -9.748 571 H ASN 77 H ASN 77 7.318 5.765 -10.218 572 HA ASN 77 HA ASN 77 5.638 4.870 -11.522 573 HB2 ASN 77 2HB ASN 77 6.971 6.616 -13.608 574 HB3 ASN 77 1HB ASN 77 5.322 6.003 -13.683 575 HD21 ASN 77 1HD2 ASN 77 5.465 6.501 -10.501 576 HD22 ASN 77 2HD2 ASN 77 5.055 8.146 -10.403 577 H ASP 78 H ASP 78 7.288 2.881 -11.257 578 HA ASP 78 HA ASP 78 7.228 1.482 -13.817 579 HB2 ASP 78 2HB ASP 78 9.817 2.200 -12.429 580 HB3 ASP 78 1HB ASP 78 9.725 0.848 -13.552 581 H LEU 79 H LEU 79 9.207 0.936 -10.903 582 HA LEU 79 HA LEU 79 7.372 -1.144 -9.946 583 HB2 LEU 79 2HB LEU 79 8.886 -2.170 -11.757 584 HB3 LEU 79 1HB LEU 79 10.240 -1.881 -10.666 585 HG LEU 79 HG LEU 79 8.690 -3.223 -8.897 586 HD11 LEU 79 1HD1 LEU 79 7.718 -4.334 -11.559 587 HD12 LEU 79 2HD1 LEU 79 6.740 -3.387 -10.443 588 HD13 LEU 79 3HD1 LEU 79 7.336 -4.968 -9.955 589 HD21 LEU 79 3HD2 LEU 79 9.767 -5.351 -9.597 590 HD22 LEU 79 1HD2 LEU 79 10.904 -4.006 -9.641 591 HD23 LEU 79 2HD2 LEU 79 10.204 -4.615 -11.141 592 H ILE 80 H ILE 80 7.476 -1.367 -7.787 593 HA ILE 80 HA ILE 80 9.838 -0.316 -6.288 594 HB ILE 80 HB ILE 80 6.917 0.137 -5.529 595 HG12 ILE 80 2HG1 ILE 80 9.017 2.123 -6.506 596 HG13 ILE 80 1HG1 ILE 80 7.680 1.530 -7.483 597 HG21 ILE 80 1HG2 ILE 80 7.914 1.571 -3.734 598 HG22 ILE 80 2HG2 ILE 80 9.523 1.106 -4.274 599 HG23 ILE 80 3HG2 ILE 80 8.442 -0.093 -3.571 600 HD11 ILE 80 3HD1 ILE 80 7.552 3.288 -5.026 601 HD12 ILE 80 1HD1 ILE 80 6.125 2.442 -5.628 602 HD13 ILE 80 2HD1 ILE 80 6.944 3.624 -6.642 603 H GLU 81 H GLU 81 10.564 -1.739 -4.818 604 HA GLU 81 HA GLU 81 8.793 -3.689 -3.549 605 HB2 GLU 81 2HB GLU 81 10.248 -5.616 -4.208 606 HB3 GLU 81 1HB GLU 81 9.392 -4.911 -5.576 607 HG2 GLU 81 2HG GLU 81 11.408 -3.625 -6.185 608 HG3 GLU 81 1HG GLU 81 12.278 -4.328 -4.826 609 H TYR 82 H TYR 82 9.988 -4.921 -1.895 610 HA TYR 82 HA TYR 82 12.560 -3.923 -0.994 611 HB2 TYR 82 2HB TYR 82 11.520 -3.209 1.272 612 HB3 TYR 82 1HB TYR 82 11.303 -2.099 -0.082 613 HD1 TYR 82 2HD TYR 82 9.627 -4.931 1.736 614 HD2 TYR 82 1HD TYR 82 9.068 -1.469 -0.768 615 HE1 TYR 82 2HE TYR 82 7.175 -5.123 1.997 616 HE2 TYR 82 1HE TYR 82 6.616 -1.674 -0.492 617 HH TYR 82 HH TYR 82 4.954 -2.908 0.319 618 H THR 83 H THR 83 13.364 -5.121 0.840 619 HA THR 83 HA THR 83 12.143 -7.827 1.075 620 HB THR 83 HB THR 83 15.008 -6.932 1.591 621 HG1 THR 83 1HG THR 83 13.648 -7.908 -0.656 622 HG21 THR 83 3HG2 THR 83 13.726 -9.683 1.376 623 HG22 THR 83 1HG2 THR 83 14.390 -8.962 2.843 624 HG23 THR 83 2HG2 THR 83 15.457 -9.381 1.508 625 H ILE 84 H ILE 84 11.414 -8.462 3.015 626 HA ILE 84 HA ILE 84 11.686 -6.680 5.364 627 HB ILE 84 HB ILE 84 9.965 -9.155 4.983 628 HG12 ILE 84 2HG1 ILE 84 9.334 -7.494 3.294 629 HG13 ILE 84 1HG1 ILE 84 8.093 -7.568 4.537 630 HG21 ILE 84 1HG2 ILE 84 8.644 -8.167 6.854 631 HG22 ILE 84 2HG2 ILE 84 9.857 -6.895 7.004 632 HG23 ILE 84 3HG2 ILE 84 10.288 -8.573 7.335 633 HD11 ILE 84 3HD1 ILE 84 10.159 -5.395 4.086 634 HD12 ILE 84 1HD1 ILE 84 9.296 -5.532 5.621 635 HD13 ILE 84 2HD1 ILE 84 8.410 -5.248 4.127 636 H GLY 85 H GLY 85 12.379 -7.460 7.403 637 HA2 GLY 85 2HA GLY 85 14.670 -9.046 7.401 638 HA3 GLY 85 1HA GLY 85 13.712 -8.686 8.834 639 H ASP 86 H ASP 86 11.276 -10.005 8.039 640 HA ASP 86 HA ASP 86 11.803 -12.637 8.885 641 HB2 ASP 86 2HB ASP 86 9.649 -11.429 9.166 642 HB3 ASP 86 1HB ASP 86 9.369 -11.544 7.431 643 H GLY 87 H GLY 87 12.215 -11.170 5.865 644 HA2 GLY 87 2HA GLY 87 13.292 -12.221 4.034 645 HA3 GLY 87 1HA GLY 87 12.659 -13.783 4.543 646 H ARG 88 H ARG 88 10.145 -11.685 4.870 647 HA ARG 88 HA ARG 88 8.759 -12.683 2.543 648 HB2 ARG 88 2HB ARG 88 7.998 -10.492 4.505 649 HB3 ARG 88 1HB ARG 88 6.922 -11.198 3.304 650 HG2 ARG 88 2HG ARG 88 7.157 -13.407 4.359 651 HG3 ARG 88 1HG ARG 88 8.279 -12.736 5.543 652 HD2 ARG 88 2HD ARG 88 6.038 -12.881 6.526 653 HD3 ARG 88 1HD ARG 88 6.487 -11.188 6.330 654 HE ARG 88 HE ARG 88 5.085 -12.094 4.027 655 HH11 ARG 88 1HH2 ARG 88 4.617 -11.254 7.369 656 HH12 ARG 88 2HH2 ARG 88 2.959 -10.798 7.155 657 HH21 ARG 88 1HH1 ARG 88 2.922 -11.492 3.761 658 HH22 ARG 88 2HH1 ARG 88 2.004 -10.932 5.117 659 H LYS 89 H LYS 89 8.004 -11.442 0.772 660 HA LYS 89 HA LYS 89 9.288 -8.799 0.297 661 HB2 LYS 89 2HB LYS 89 10.644 -10.609 -0.775 662 HB3 LYS 89 1HB LYS 89 9.233 -11.077 -1.720 663 HG2 LYS 89 2HG LYS 89 9.163 -8.842 -2.762 664 HG3 LYS 89 1HG LYS 89 10.522 -8.320 -1.768 665 HD2 LYS 89 2HD LYS 89 11.934 -10.066 -2.819 666 HD3 LYS 89 1HD LYS 89 10.567 -10.549 -3.823 667 HE2 LYS 89 2HE LYS 89 10.505 -8.305 -4.842 668 HE3 LYS 89 1HE LYS 89 11.849 -7.795 -3.821 669 HZ1 LYS 89 3HZ LYS 89 12.263 -10.212 -5.380 670 HZ2 LYS 89 1HZ LYS 89 13.333 -8.941 -5.040 671 HZ3 LYS 89 2HZ LYS 89 12.167 -8.764 -6.263 672 H VAL 90 H VAL 90 8.218 -7.484 -1.165 673 HA VAL 90 HA VAL 90 5.493 -8.293 -2.036 674 HB VAL 90 HB VAL 90 6.135 -5.662 -0.638 675 HG11 VAL 90 1HG1 VAL 90 3.511 -6.947 -1.486 676 HG12 VAL 90 2HG1 VAL 90 4.261 -5.548 -2.253 677 HG13 VAL 90 3HG1 VAL 90 3.662 -5.429 -0.601 678 HG21 VAL 90 3HG2 VAL 90 4.782 -8.181 0.402 679 HG22 VAL 90 1HG2 VAL 90 4.770 -6.629 1.243 680 HG23 VAL 90 2HG2 VAL 90 6.290 -7.482 0.988 681 H ARG 91 H ARG 91 5.355 -7.943 -4.153 682 HA ARG 91 HA ARG 91 7.125 -5.942 -5.480 683 HB2 ARG 91 2HB ARG 91 5.458 -8.228 -6.605 684 HB3 ARG 91 1HB ARG 91 6.517 -7.165 -7.537 685 HG2 ARG 91 2HG ARG 91 8.458 -7.925 -6.217 686 HG3 ARG 91 1HG ARG 91 7.410 -8.984 -5.274 687 HD2 ARG 91 2HD ARG 91 6.795 -10.202 -7.340 688 HD3 ARG 91 1HD ARG 91 7.873 -9.161 -8.269 689 HE ARG 91 HE ARG 91 8.636 -11.413 -6.653 690 HH11 ARG 91 1HH2 ARG 91 9.648 -8.287 -7.774 691 HH12 ARG 91 2HH2 ARG 91 11.338 -8.625 -7.597 692 HH21 ARG 91 1HH1 ARG 91 10.846 -11.848 -6.421 693 HH22 ARG 91 2HH1 ARG 91 12.014 -10.637 -6.831 694 H ILE 92 H ILE 92 6.233 -4.103 -6.280 695 HA ILE 92 HA ILE 92 3.250 -3.894 -6.489 696 HB ILE 92 HB ILE 92 5.238 -1.664 -5.853 697 HG12 ILE 92 2HG1 ILE 92 3.257 -3.053 -3.980 698 HG13 ILE 92 1HG1 ILE 92 4.987 -3.380 -3.987 699 HG21 ILE 92 1HG2 ILE 92 3.130 -0.950 -7.016 700 HG22 ILE 92 2HG2 ILE 92 3.181 -0.361 -5.361 701 HG23 ILE 92 3HG2 ILE 92 2.188 -1.757 -5.765 702 HD11 ILE 92 3HD1 ILE 92 3.661 -0.724 -3.362 703 HD12 ILE 92 1HD1 ILE 92 5.406 -0.949 -3.508 704 HD13 ILE 92 2HD1 ILE 92 4.510 -1.772 -2.229 705 H VAL 93 H VAL 93 2.551 -3.585 -8.519 706 HA VAL 93 HA VAL 93 4.441 -2.551 -10.595 707 HB VAL 93 HB VAL 93 2.036 -4.388 -10.970 708 HG11 VAL 93 1HG1 VAL 93 4.241 -3.470 -12.860 709 HG12 VAL 93 2HG1 VAL 93 2.539 -3.026 -12.964 710 HG13 VAL 93 3HG1 VAL 93 3.029 -4.691 -13.251 711 HG21 VAL 93 3HG2 VAL 93 3.721 -6.153 -11.379 712 HG22 VAL 93 1HG2 VAL 93 3.861 -5.520 -9.741 713 HG23 VAL 93 2HG2 VAL 93 5.008 -5.020 -10.982 714 H PHE 94 H PHE 94 3.921 -0.609 -11.393 715 HA PHE 94 HA PHE 94 1.187 0.499 -10.957 716 HB2 PHE 94 2HB PHE 94 3.814 1.823 -11.719 717 HB3 PHE 94 1HB PHE 94 2.276 2.663 -11.506 718 HD1 PHE 94 1HD PHE 94 4.934 0.729 -9.750 719 HD2 PHE 94 2HD PHE 94 1.340 3.049 -9.270 720 HE1 PHE 94 1HE PHE 94 5.322 0.841 -7.303 721 HE2 PHE 94 2HE PHE 94 1.741 3.157 -6.825 722 HZ PHE 94 HZ PHE 94 3.726 2.056 -5.843 723 H THR 95 H THR 95 -0.190 0.514 -12.615 724 HA THR 95 HA THR 95 0.841 0.489 -15.422 725 HB THR 95 HB THR 95 -1.689 -0.836 -14.364 726 HG1 THR 95 1HG THR 95 0.282 -1.831 -13.687 727 HG21 THR 95 3HG2 THR 95 -0.288 -0.947 -17.060 728 HG22 THR 95 1HG2 THR 95 -1.836 -0.166 -16.733 729 HG23 THR 95 2HG2 THR 95 -1.687 -1.916 -16.602 730 H HIS 96 H HIS 96 0.262 2.226 -16.538 731 HA HIS 96 HA HIS 96 -1.924 3.989 -15.566 732 HB2 HIS 96 2HB HIS 96 -0.863 5.675 -17.027 733 HB3 HIS 96 1HB HIS 96 0.276 5.030 -15.846 734 HD2 HIS 96 2HD HIS 96 -0.064 5.340 -19.672 735 HE1 HIS 96 1HE HIS 96 3.137 2.681 -18.959 736 HE2 HIS 96 2HE HIS 96 1.931 4.036 -20.737 737 H THR 97 H THR 97 -3.834 3.859 -16.571 738 HA THR 97 HA THR 97 -4.009 2.693 -19.316 739 HB THR 97 HB THR 97 -6.371 2.275 -18.746 740 HG1 THR 97 1HG THR 97 -6.780 3.884 -17.298 741 HG21 THR 97 3HG2 THR 97 -5.985 0.513 -17.083 742 HG22 THR 97 1HG2 THR 97 -4.464 1.269 -16.609 743 HG23 THR 97 2HG2 THR 97 -4.636 0.566 -18.218 744 H GLY 98 H GLY 98 -3.598 5.573 -18.041 745 HA2 GLY 98 2HA GLY 98 -3.837 7.663 -19.006 746 HA3 GLY 98 1HA GLY 98 -4.935 6.986 -20.205 747 H ASP 99 H ASP 99 -4.814 9.155 -17.796 748 HA ASP 99 HA ASP 99 -6.326 10.251 -16.495 749 HB2 ASP 99 2HB ASP 99 -7.556 10.361 -18.670 750 HB3 ASP 99 1HB ASP 99 -8.416 8.888 -18.232 751 H THR 100 H THR 100 -5.715 7.146 -16.181 752 HA THR 100 HA THR 100 -7.164 6.909 -13.676 753 HB THR 100 HB THR 100 -7.724 4.884 -15.877 754 HG1 THR 100 1HG THR 100 -9.914 5.833 -15.421 755 HG21 THR 100 3HG2 THR 100 -9.391 4.023 -14.242 756 HG22 THR 100 1HG2 THR 100 -8.806 5.182 -13.051 757 HG23 THR 100 2HG2 THR 100 -7.749 3.891 -13.622 758 H THR 101 H THR 101 -5.683 6.143 -12.320 759 HA THR 101 HA THR 101 -3.431 4.485 -13.315 760 HB THR 101 HB THR 101 -3.820 5.848 -10.622 761 HG1 THR 101 1HG THR 101 -3.620 7.245 -12.452 762 HG21 THR 101 3HG2 THR 101 -1.347 5.479 -10.443 763 HG22 THR 101 1HG2 THR 101 -1.405 4.520 -11.920 764 HG23 THR 101 2HG2 THR 101 -2.248 3.966 -10.471 765 H ASN 102 H ASN 102 -3.140 2.416 -12.698 766 HA ASN 102 HA ASN 102 -5.071 1.174 -10.776 767 HB2 ASN 102 2HB ASN 102 -3.787 -0.010 -13.259 768 HB3 ASN 102 1HB ASN 102 -4.820 -0.879 -12.127 769 HD21 ASN 102 1HD2 ASN 102 -5.323 -0.251 -15.037 770 HD22 ASN 102 2HD2 ASN 102 -6.793 0.598 -15.058 771 H ILE 103 H ILE 103 -4.105 0.488 -8.996 772 HA ILE 103 HA ILE 103 -1.166 0.002 -8.946 773 HB ILE 103 HB ILE 103 -3.137 0.268 -6.648 774 HG12 ILE 103 2HG1 ILE 103 -1.146 2.359 -7.628 775 HG13 ILE 103 1HG1 ILE 103 -2.855 2.391 -8.053 776 HG21 ILE 103 1HG2 ILE 103 -1.131 -0.999 -6.032 777 HG22 ILE 103 2HG2 ILE 103 -1.054 0.593 -5.290 778 HG23 ILE 103 3HG2 ILE 103 -0.102 0.250 -6.733 779 HD11 ILE 103 3HD1 ILE 103 -2.495 3.839 -6.128 780 HD12 ILE 103 1HD1 ILE 103 -1.704 2.533 -5.248 781 HD13 ILE 103 2HD1 ILE 103 -3.432 2.436 -5.613 782 H VAL 104 H VAL 104 -0.490 -2.076 -8.991 783 HA VAL 104 HA VAL 104 -2.295 -4.245 -7.997 784 HB VAL 104 HB VAL 104 -0.337 -4.406 -10.319 785 HG11 VAL 104 1HG1 VAL 104 -0.617 -6.559 -9.144 786 HG12 VAL 104 2HG1 VAL 104 -1.446 -6.618 -10.697 787 HG13 VAL 104 3HG1 VAL 104 -2.371 -6.384 -9.214 788 HG21 VAL 104 3HG2 VAL 104 -3.378 -4.283 -10.285 789 HG22 VAL 104 1HG2 VAL 104 -2.388 -4.568 -11.717 790 HG23 VAL 104 2HG2 VAL 104 -2.303 -3.019 -10.881 791 H GLU 105 H GLU 105 -1.440 -5.369 -6.373 792 HA GLU 105 HA GLU 105 1.485 -5.697 -6.122 793 HB2 GLU 105 2HB GLU 105 1.350 -5.079 -3.698 794 HB3 GLU 105 1HB GLU 105 1.028 -3.721 -4.773 795 HG2 GLU 105 2HG GLU 105 -1.401 -4.036 -4.472 796 HG3 GLU 105 1HG GLU 105 -1.105 -5.403 -3.406 797 H SER 106 H SER 106 2.104 -7.536 -5.078 798 HA SER 106 HA SER 106 -0.022 -9.430 -4.174 799 HB2 SER 106 2HB SER 106 1.330 -11.238 -5.157 800 HB3 SER 106 1HB SER 106 0.829 -10.081 -6.388 801 HG SER 106 HG SER 106 2.878 -9.141 -6.261 802 H PHE 107 H PHE 107 0.498 -10.762 -2.455 803 HA PHE 107 HA PHE 107 2.980 -10.095 -0.918 804 HB2 PHE 107 2HB PHE 107 0.190 -10.728 0.117 805 HB3 PHE 107 1HB PHE 107 1.620 -10.469 1.116 806 HD1 PHE 107 2HD PHE 107 -0.843 -8.839 -1.127 807 HD2 PHE 107 1HD PHE 107 2.576 -8.218 1.407 808 HE1 PHE 107 2HE PHE 107 -1.245 -6.394 -1.171 809 HE2 PHE 107 1HE PHE 107 2.175 -5.771 1.343 810 HZ PHE 107 HZ PHE 107 0.261 -4.862 0.060 811 H ASP 108 H ASP 108 3.651 -11.814 0.534 812 HA ASP 108 HA ASP 108 2.908 -14.567 -0.359 813 HB2 ASP 108 2HB ASP 108 5.676 -13.490 0.252 814 HB3 ASP 108 1HB ASP 108 5.280 -15.152 -0.182 815 HA PRO 109 HA PRO 109 2.769 -14.108 4.298 816 HB2 PRO 109 2HB PRO 109 0.267 -15.065 4.796 817 HB3 PRO 109 1HB PRO 109 0.521 -13.403 4.209 818 HG2 PRO 109 2HG PRO 109 -0.257 -15.851 2.637 819 HG3 PRO 109 1HG PRO 109 -0.951 -14.218 2.568 820 HD2 PRO 109 2HD PRO 109 0.933 -15.115 0.755 821 HD3 PRO 109 1HD PRO 109 0.787 -13.399 1.192 822 H GLU 110 H GLU 110 2.433 -15.878 5.971 823 HA GLU 110 HA GLU 110 3.922 -18.170 5.251 824 HB2 GLU 110 2HB GLU 110 2.136 -17.735 7.656 825 HB3 GLU 110 1HB GLU 110 3.352 -18.997 7.502 826 HG2 GLU 110 2HG GLU 110 5.116 -17.293 7.282 827 HG3 GLU 110 1HG GLU 110 3.912 -16.014 7.401 828 H GLU 111 H GLU 111 3.308 -20.328 5.116 829 HA GLU 111 HA GLU 111 0.876 -20.834 3.647 830 HB2 GLU 111 2HB GLU 111 3.008 -22.097 3.282 831 HB3 GLU 111 1HB GLU 111 2.777 -22.889 4.839 832 HG2 GLU 111 2HG GLU 111 0.624 -23.833 4.046 833 HG3 GLU 111 1HG GLU 111 0.836 -23.015 2.499 834 H THR 112 H THR 112 1.955 -21.605 6.951 835 HA THR 112 HA THR 112 -0.319 -23.115 7.709 836 HB THR 112 HB THR 112 1.654 -23.280 9.078 837 HG1 THR 112 1HG THR 112 -0.714 -22.576 10.026 838 HG21 THR 112 3HG2 THR 112 2.530 -21.343 10.342 839 HG22 THR 112 1HG2 THR 112 1.355 -20.295 9.556 840 HG23 THR 112 2HG2 THR 112 2.625 -21.065 8.605 841 H ASN 113 H ASN 113 0.299 -19.634 7.732 842 HA ASN 113 HA ASN 113 -1.888 -18.896 9.362 843 HB2 ASN 113 2HB ASN 113 -0.281 -17.424 7.258 844 HB3 ASN 113 1HB ASN 113 -1.581 -16.620 8.142 845 HD21 ASN 113 1HD2 ASN 113 0.639 -15.352 8.692 846 HD22 ASN 113 2HD2 ASN 113 1.378 -15.845 10.139 847 HA PRO 114 HA PRO 114 -5.242 -19.532 6.451 848 HB2 PRO 114 2HB PRO 114 -7.170 -17.836 7.394 849 HB3 PRO 114 1HB PRO 114 -6.626 -19.238 8.351 850 HG2 PRO 114 2HG PRO 114 -5.685 -16.375 8.547 851 HG3 PRO 114 1HG PRO 114 -6.266 -17.441 9.849 852 HD2 PRO 114 2HD PRO 114 -3.609 -17.155 9.407 853 HD3 PRO 114 1HD PRO 114 -4.282 -18.739 9.852 854 H ARG 115 H ARG 115 -4.755 -18.876 4.405 855 HA ARG 115 HA ARG 115 -4.087 -16.207 3.650 856 HB2 ARG 115 2HB ARG 115 -4.279 -17.112 1.320 857 HB3 ARG 115 1HB ARG 115 -3.260 -18.100 2.361 858 HG2 ARG 115 2HG ARG 115 -5.116 -19.670 2.737 859 HG3 ARG 115 1HG ARG 115 -6.186 -18.678 1.751 860 HD2 ARG 115 2HD ARG 115 -3.634 -19.973 0.737 861 HD3 ARG 115 1HD ARG 115 -5.252 -20.630 0.497 862 HE ARG 115 HE ARG 115 -4.054 -18.457 -0.960 863 HH11 ARG 115 1HH2 ARG 115 -7.054 -19.736 0.241 864 HH12 ARG 115 2HH2 ARG 115 -8.024 -18.927 -0.944 865 HH21 ARG 115 1HH1 ARG 115 -5.331 -17.405 -2.506 866 HH22 ARG 115 2HH1 ARG 115 -7.051 -17.609 -2.495 867 H GLU 116 H GLU 116 -7.108 -17.920 3.955 868 HA GLU 116 HA GLU 116 -8.722 -16.477 2.184 869 HB2 GLU 116 2HB GLU 116 -9.349 -18.565 3.417 870 HB3 GLU 116 1HB GLU 116 -9.504 -17.617 4.893 871 HG2 GLU 116 2HG GLU 116 -11.277 -16.248 3.829 872 HG3 GLU 116 1HG GLU 116 -11.103 -17.182 2.346 873 H LEU 117 H LEU 117 -8.118 -15.877 5.656 874 HA LEU 117 HA LEU 117 -9.664 -13.497 5.797 875 HB2 LEU 117 2HB LEU 117 -7.306 -14.272 7.550 876 HB3 LEU 117 1HB LEU 117 -8.598 -13.143 7.961 877 HG LEU 117 HG LEU 117 -8.952 -16.126 7.449 878 HD11 LEU 117 1HD1 LEU 117 -9.122 -14.515 10.020 879 HD12 LEU 117 2HD1 LEU 117 -7.804 -15.597 9.580 880 HD13 LEU 117 3HD1 LEU 117 -9.415 -16.248 9.864 881 HD21 LEU 117 3HD2 LEU 117 -11.292 -15.584 8.511 882 HD22 LEU 117 1HD2 LEU 117 -11.039 -15.150 6.826 883 HD23 LEU 117 2HD2 LEU 117 -10.943 -13.909 8.075 884 H GLN 118 H GLN 118 -6.247 -14.077 5.079 885 HA GLN 118 HA GLN 118 -5.364 -11.398 5.148 886 HB2 GLN 118 2HB GLN 118 -4.392 -13.747 3.483 887 HB3 GLN 118 1HB GLN 118 -3.514 -12.227 3.645 888 HG2 GLN 118 2HG GLN 118 -4.289 -13.995 5.996 889 HG3 GLN 118 1HG GLN 118 -2.716 -14.043 5.204 890 HE21 GLN 118 1HE2 GLN 118 -4.242 -12.726 7.854 891 HE22 GLN 118 2HE2 GLN 118 -3.267 -11.356 8.077 892 H GLN 119 H GLN 119 -6.680 -13.346 2.461 893 HA GLN 119 HA GLN 119 -6.358 -11.489 0.407 894 HB2 GLN 119 2HB GLN 119 -7.218 -13.943 0.346 895 HB3 GLN 119 1HB GLN 119 -8.817 -13.277 0.651 896 HG2 GLN 119 2HG GLN 119 -7.023 -12.556 -1.699 897 HG3 GLN 119 1HG GLN 119 -8.417 -13.629 -1.770 898 HE21 GLN 119 1HE2 GLN 119 -7.549 -10.548 -2.537 899 HE22 GLN 119 2HE2 GLN 119 -9.042 -9.765 -2.333 900 H SER 120 H SER 120 -9.046 -11.858 2.706 901 HA SER 120 HA SER 120 -10.602 -9.678 1.730 902 HB2 SER 120 2HB SER 120 -11.564 -11.459 3.135 903 HB3 SER 120 1HB SER 120 -10.567 -10.936 4.490 904 HG SER 120 HG SER 120 -11.605 -8.839 4.201 905 H GLY 121 H GLY 121 -8.068 -9.975 4.219 906 HA2 GLY 121 2HA GLY 121 -8.350 -7.418 5.367 907 HA3 GLY 121 1HA GLY 121 -6.872 -8.374 5.366 908 H TRP 122 H TRP 122 -6.108 -8.491 2.782 909 HA TRP 122 HA TRP 122 -5.029 -5.904 2.291 910 HB2 TRP 122 2HB TRP 122 -5.180 -8.366 0.505 911 HB3 TRP 122 1HB TRP 122 -4.243 -6.923 0.120 912 HD1 TRP 122 HD TRP 122 -3.853 -10.175 1.820 913 HE1 TRP 122 1HE TRP 122 -1.739 -10.204 3.287 914 HE3 TRP 122 3HE TRP 122 -2.720 -5.190 1.848 915 HZ2 TRP 122 2HZ TRP 122 0.186 -8.364 4.331 916 HZ3 TRP 122 3HZ TRP 122 -0.739 -4.361 3.080 917 HH2 TRP 122 HH TRP 122 0.715 -5.940 4.321 918 H GLN 123 H GLN 123 -7.822 -7.620 0.989 919 HA GLN 123 HA GLN 123 -8.397 -5.698 -1.080 920 HB2 GLN 123 2HB GLN 123 -9.143 -8.078 -1.134 921 HB3 GLN 123 1HB GLN 123 -10.245 -7.737 0.200 922 HG2 GLN 123 2HG GLN 123 -11.424 -6.067 -1.184 923 HG3 GLN 123 1HG GLN 123 -10.300 -6.349 -2.507 924 HE21 GLN 123 1HE2 GLN 123 -11.682 -7.333 -4.041 925 HE22 GLN 123 2HE2 GLN 123 -12.567 -8.751 -3.739 926 H ALA 124 H ALA 124 -9.441 -6.161 2.275 927 HA ALA 124 HA ALA 124 -11.567 -4.345 2.355 928 HB1 ALA 124 1HB ALA 124 -11.167 -4.254 4.788 929 HB2 ALA 124 2HB ALA 124 -9.592 -5.018 4.548 930 HB3 ALA 124 3HB ALA 124 -11.072 -5.906 4.182 931 H ILE 125 H ILE 125 -8.128 -3.731 3.133 932 HA ILE 125 HA ILE 125 -8.441 -0.980 3.700 933 HB ILE 125 HB ILE 125 -6.488 -2.164 4.469 934 HG12 ILE 125 2HG1 ILE 125 -5.395 -0.317 2.290 935 HG13 ILE 125 1HG1 ILE 125 -6.229 0.318 3.702 936 HG21 ILE 125 1HG2 ILE 125 -4.780 -3.059 2.926 937 HG22 ILE 125 2HG2 ILE 125 -5.797 -2.625 1.550 938 HG23 ILE 125 3HG2 ILE 125 -6.336 -3.848 2.695 939 HD11 ILE 125 3HD1 ILE 125 -3.815 -1.521 3.835 940 HD12 ILE 125 1HD1 ILE 125 -4.612 -0.731 5.199 941 HD13 ILE 125 2HD1 ILE 125 -3.747 0.231 4.002 942 H LEU 126 H LEU 126 -7.809 -2.704 0.681 943 HA LEU 126 HA LEU 126 -7.289 -0.410 -0.911 944 HB2 LEU 126 2HB LEU 126 -8.292 -3.207 -1.507 945 HB3 LEU 126 1HB LEU 126 -8.091 -2.033 -2.807 946 HG LEU 126 HG LEU 126 -5.876 -2.889 -0.891 947 HD11 LEU 126 1HD1 LEU 126 -6.500 -4.749 -2.289 948 HD12 LEU 126 2HD1 LEU 126 -4.966 -4.110 -2.870 949 HD13 LEU 126 3HD1 LEU 126 -6.456 -3.752 -3.743 950 HD21 LEU 126 3HD2 LEU 126 -4.560 -1.807 -3.060 951 HD22 LEU 126 1HD2 LEU 126 -4.993 -0.886 -1.623 952 HD23 LEU 126 2HD2 LEU 126 -6.013 -0.808 -3.049 953 H ASN 127 H ASN 127 -10.297 -2.132 -0.116 954 HA ASN 127 HA ASN 127 -11.995 -0.555 -1.779 955 HB2 ASN 127 2HB ASN 127 -12.593 -2.171 0.727 956 HB3 ASN 127 1HB ASN 127 -13.829 -1.452 -0.306 957 HD21 ASN 127 1HD2 ASN 127 -13.399 -4.356 0.150 958 HD22 ASN 127 2HD2 ASN 127 -13.050 -5.024 -1.370 959 H SER 128 H SER 128 -10.917 -0.243 1.569 960 HA SER 128 HA SER 128 -12.575 1.862 2.379 961 HB2 SER 128 2HB SER 128 -11.157 0.590 3.936 962 HB3 SER 128 1HB SER 128 -9.717 1.305 3.217 963 HG SER 128 HG SER 128 -11.793 2.555 4.683 964 H PHE 129 H PHE 129 -9.616 1.878 0.479 965 HA PHE 129 HA PHE 129 -8.890 4.551 0.624 966 HB2 PHE 129 2HB PHE 129 -7.619 2.741 -0.564 967 HB3 PHE 129 1HB PHE 129 -8.786 2.834 -1.881 968 HD1 PHE 129 1HD PHE 129 -8.977 4.912 -3.271 969 HD2 PHE 129 2HD PHE 129 -5.942 4.510 -0.245 970 HE1 PHE 129 1HE PHE 129 -7.754 6.842 -4.230 971 HE2 PHE 129 2HE PHE 129 -4.724 6.437 -1.216 972 HZ PHE 129 HZ PHE 129 -5.630 7.603 -3.207 973 H LYS 130 H LYS 130 -11.630 3.116 -0.958 974 HA LYS 130 HA LYS 130 -12.266 5.178 -2.800 975 HB2 LYS 130 2HB LYS 130 -14.070 3.197 -1.370 976 HB3 LYS 130 1HB LYS 130 -14.584 4.202 -2.725 977 HG2 LYS 130 2HG LYS 130 -12.163 2.371 -3.018 978 HG3 LYS 130 1HG LYS 130 -13.791 1.731 -3.218 979 HD2 LYS 130 2HD LYS 130 -14.250 3.361 -5.010 980 HD3 LYS 130 1HD LYS 130 -12.639 4.047 -4.826 981 HE2 LYS 130 2HE LYS 130 -13.212 1.166 -5.577 982 HE3 LYS 130 1HE LYS 130 -12.730 2.437 -6.701 983 HZ1 LYS 130 3HZ LYS 130 -11.168 1.208 -4.528 984 HZ2 LYS 130 1HZ LYS 130 -10.778 2.756 -5.096 985 HZ3 LYS 130 2HZ LYS 130 -10.739 1.431 -6.158 986 H SER 131 H SER 131 -13.091 4.702 0.618 987 HA SER 131 HA SER 131 -15.005 6.742 0.877 988 HB2 SER 131 2HB SER 131 -14.693 5.197 2.708 989 HB3 SER 131 1HB SER 131 -12.993 5.632 2.855 990 HG SER 131 HG SER 131 -13.702 7.758 3.420 991 H TYR 132 H TYR 132 -11.462 6.878 1.231 992 HA TYR 132 HA TYR 132 -11.315 9.645 1.891 993 HB2 TYR 132 2HB TYR 132 -9.285 7.799 0.582 994 HB3 TYR 132 1HB TYR 132 -8.916 9.417 1.182 995 HD1 TYR 132 1HD TYR 132 -10.044 6.006 2.192 996 HD2 TYR 132 2HD TYR 132 -8.665 9.839 3.580 997 HE1 TYR 132 1HE TYR 132 -9.762 5.087 4.473 998 HE2 TYR 132 2HE TYR 132 -8.388 8.906 5.857 999 HH TYR 132 HH TYR 132 -9.748 6.067 6.852 1000 H THR 133 H THR 133 -11.078 7.894 -1.207 1001 HA THR 133 HA THR 133 -10.581 10.160 -2.823 1002 HB THR 133 HB THR 133 -12.030 7.610 -3.637 1003 HG1 THR 133 1HG THR 133 -10.228 6.755 -3.024 1004 HG21 THR 133 3HG2 THR 133 -10.351 9.607 -5.200 1005 HG22 THR 133 1HG2 THR 133 -12.091 9.359 -5.358 1006 HG23 THR 133 2HG2 THR 133 -10.970 8.087 -5.840 1007 H GLU 134 H GLU 134 -13.598 8.625 -1.772 1008 HA GLU 134 HA GLU 134 -15.340 10.220 -3.366 1009 HB2 GLU 134 2HB GLU 134 -15.768 7.930 -2.251 1010 HB3 GLU 134 1HB GLU 134 -16.113 8.827 -0.777 1011 HG2 GLU 134 2HG GLU 134 -17.897 10.085 -1.999 1012 HG3 GLU 134 1HG GLU 134 -17.548 9.148 -3.444 1013 H ASN 135 H ASN 135 -13.308 11.316 -1.109 1014 HA ASN 135 HA ASN 135 -14.835 12.845 0.703 1015 HB2 ASN 135 2HB ASN 135 -12.791 14.247 0.929 1016 HB3 ASN 135 1HB ASN 135 -12.428 12.525 0.999 1017 HD21 ASN 135 1HD2 ASN 135 -10.504 14.604 0.180 1018 HD22 ASN 135 2HD2 ASN 135 -10.092 14.279 -1.435 1019 H ASN 136 H ASN 136 -14.645 13.077 -2.652 1020 HA ASN 136 HA ASN 136 -15.006 15.966 -2.866 1021 HB2 ASN 136 2HB ASN 136 -15.272 15.491 -5.275 1022 HB3 ASN 136 1HB ASN 136 -13.808 14.753 -4.631 1023 HD21 ASN 136 1HD2 ASN 136 -16.418 14.086 -6.606 1024 HD22 ASN 136 2HD2 ASN 136 -16.457 12.398 -6.438 1025 H LEU 137 H LEU 137 -16.964 13.729 -1.616 1026 HA LEU 137 HA LEU 137 -19.380 13.914 -3.053 1027 HB2 LEU 137 2HB LEU 137 -18.983 12.240 -1.275 1028 HB3 LEU 137 1HB LEU 137 -18.943 13.522 -0.071 1029 HG LEU 137 HG LEU 137 -21.331 14.065 -0.571 1030 HD11 LEU 137 1HD1 LEU 137 -21.711 13.474 -2.835 1031 HD12 LEU 137 2HD1 LEU 137 -22.584 12.229 -1.960 1032 HD13 LEU 137 3HD1 LEU 137 -20.999 11.867 -2.644 1033 HD21 LEU 137 3HD2 LEU 137 -22.310 12.006 0.396 1034 HD22 LEU 137 1HD2 LEU 137 -20.802 12.438 1.204 1035 HD23 LEU 137 2HD2 LEU 137 -20.826 11.128 0.025 1036 H GLU 138 H GLU 138 -18.072 15.856 -0.390 1037 HA GLU 138 HA GLU 138 -19.477 18.219 -1.257 1038 HB2 GLU 138 2HB GLU 138 -21.284 16.937 -0.077 1039 HB3 GLU 138 1HB GLU 138 -20.315 16.979 1.395 1040 HG2 GLU 138 2HG GLU 138 -20.375 19.455 1.371 1041 HG3 GLU 138 1HG GLU 138 -21.322 19.419 -0.116 1042 H HIS 139 H HIS 139 -18.577 20.048 -0.403 1043 HA HIS 139 HA HIS 139 -16.936 20.085 1.968 1044 HB2 HIS 139 2HB HIS 139 -14.815 20.647 0.800 1045 HB3 HIS 139 1HB HIS 139 -15.344 19.004 0.440 1046 HD2 HIS 139 2HD HIS 139 -14.902 22.433 -1.406 1047 HE1 HIS 139 1HE HIS 139 -16.147 19.578 -4.256 1048 HE2 HIS 139 2HE HIS 139 -15.313 21.957 -3.940 1049 H HIS 140 H HIS 140 -16.365 22.209 2.563 1050 HA HIS 140 HA HIS 140 -16.741 24.485 0.881 1051 HB2 HIS 140 2HB HIS 140 -19.139 23.875 1.204 1052 HB3 HIS 140 1HB HIS 140 -18.917 23.978 2.949 1053 HD2 HIS 140 2HD HIS 140 -19.145 26.561 3.973 1054 HE1 HIS 140 1HE HIS 140 -19.078 28.633 0.295 1055 HE2 HIS 140 2HE HIS 140 -19.358 28.887 2.806 1056 H HIS 141 H HIS 141 -14.566 24.086 2.137 1057 HA HIS 141 HA HIS 141 -13.079 24.780 3.748 1058 HB2 HIS 141 2HB HIS 141 -15.095 27.034 4.015 1059 HB3 HIS 141 1HB HIS 141 -13.423 27.077 4.570 1060 HD2 HIS 141 2HD HIS 141 -15.397 27.854 1.387 1061 HE1 HIS 141 1HE HIS 141 -11.366 27.481 0.186 1062 HE2 HIS 141 2HE HIS 141 -13.680 28.226 -0.546 1063 H HIS 142 H HIS 142 -13.292 25.999 6.181 1064 HA HIS 142 HA HIS 142 -15.381 24.979 7.849 1065 HB2 HIS 142 2HB HIS 142 -13.977 23.309 9.094 1066 HB3 HIS 142 1HB HIS 142 -14.323 22.817 7.437 1067 HD2 HIS 142 2HD HIS 142 -11.266 23.408 9.668 1068 HE1 HIS 142 1HE HIS 142 -9.827 23.316 5.700 1069 HE2 HIS 142 2HE HIS 142 -9.146 23.305 8.147 1070 H HIS 143 H HIS 143 -15.374 27.045 8.695 1071 HA HIS 143 HA HIS 143 -14.762 28.798 10.031 1072 HB2 HIS 143 2HB HIS 143 -14.719 27.014 11.729 1073 HB3 HIS 143 1HB HIS 143 -13.035 26.674 11.347 1074 HD2 HIS 143 2HD HIS 143 -15.141 29.527 13.099 1075 HE1 HIS 143 1HE HIS 143 -11.051 30.156 13.937 1076 HE2 HIS 143 2HE HIS 143 -13.410 30.949 14.443 1077 H HIS 144 H HIS 144 -11.607 27.213 10.263 1078 HA HIS 144 HA HIS 144 -10.123 29.541 9.743 1079 HB2 HIS 144 2HB HIS 144 -9.286 26.647 9.365 1080 HB3 HIS 144 1HB HIS 144 -8.198 28.027 9.527 1081 HD2 HIS 144 2HD HIS 144 -10.052 25.538 11.779 1082 HE1 HIS 144 1HE HIS 144 -8.779 28.682 14.291 1083 HE2 HIS 144 2HE HIS 144 -9.750 26.335 14.246 Start of MODEL 4 1 H1 GLY 1 1HT GLY 1 1.217 -19.340 -4.410 2 H2 GLY 1 2HT GLY 1 0.575 -20.265 -5.683 3 H3 GLY 1 3HT GLY 1 1.232 -21.033 -4.316 4 HA2 GLY 1 2HA GLY 1 -1.407 -20.042 -4.746 5 HA3 GLY 1 1HA GLY 1 -0.810 -21.114 -3.480 6 H ASN 2 H ASN 2 1.056 -19.597 -2.203 7 HA ASN 2 HA ASN 2 -0.541 -17.822 -0.599 8 HB2 ASN 2 2HB ASN 2 1.571 -17.446 0.637 9 HB3 ASN 2 1HB ASN 2 1.261 -19.162 0.386 10 HD21 ASN 2 1HD2 ASN 2 3.913 -18.099 0.854 11 HD22 ASN 2 2HD2 ASN 2 4.828 -18.363 -0.550 12 H LYS 3 H LYS 3 0.999 -17.416 -3.542 13 HA LYS 3 HA LYS 3 1.950 -14.698 -3.215 14 HB2 LYS 3 2HB LYS 3 1.402 -16.335 -5.719 15 HB3 LYS 3 1HB LYS 3 2.244 -14.784 -5.658 16 HG2 LYS 3 2HG LYS 3 4.010 -15.755 -4.253 17 HG3 LYS 3 1HG LYS 3 3.142 -17.289 -4.198 18 HD2 LYS 3 2HD LYS 3 4.936 -17.439 -5.857 19 HD3 LYS 3 1HD LYS 3 3.376 -17.500 -6.674 20 HE2 LYS 3 2HE LYS 3 3.616 -15.257 -7.499 21 HE3 LYS 3 1HE LYS 3 4.917 -14.892 -6.360 22 HZ1 LYS 3 3HZ LYS 3 6.251 -15.429 -8.041 23 HZ2 LYS 3 1HZ LYS 3 5.017 -16.191 -8.920 24 HZ3 LYS 3 2HZ LYS 3 5.848 -17.047 -7.711 25 H ILE 4 H ILE 4 -0.552 -14.636 -2.227 26 HA ILE 4 HA ILE 4 -2.582 -14.014 -4.148 27 HB ILE 4 HB ILE 4 -2.404 -13.230 -1.212 28 HG12 ILE 4 2HG1 ILE 4 -4.231 -15.479 -1.741 29 HG13 ILE 4 1HG1 ILE 4 -2.656 -15.884 -2.411 30 HG21 ILE 4 1HG2 ILE 4 -4.909 -13.153 -1.421 31 HG22 ILE 4 2HG2 ILE 4 -4.740 -13.373 -3.160 32 HG23 ILE 4 3HG2 ILE 4 -4.099 -11.925 -2.384 33 HD11 ILE 4 3HD1 ILE 4 -1.602 -15.370 -0.223 34 HD12 ILE 4 1HD1 ILE 4 -2.816 -16.636 -0.094 35 HD13 ILE 4 2HD1 ILE 4 -3.190 -15.004 0.443 36 H THR 5 H THR 5 -3.207 -12.085 -4.944 37 HA THR 5 HA THR 5 -1.789 -9.606 -4.171 38 HB THR 5 HB THR 5 -0.572 -10.417 -6.118 39 HG1 THR 5 1HG THR 5 -1.847 -8.714 -7.630 40 HG21 THR 5 3HG2 THR 5 -1.715 -10.888 -8.247 41 HG22 THR 5 1HG2 THR 5 -3.276 -10.631 -7.472 42 HG23 THR 5 2HG2 THR 5 -2.261 -11.986 -6.980 43 H VAL 6 H VAL 6 -2.862 -7.707 -4.896 44 HA VAL 6 HA VAL 6 -5.754 -7.987 -5.510 45 HB VAL 6 HB VAL 6 -6.230 -6.221 -3.803 46 HG11 VAL 6 1HG1 VAL 6 -4.889 -8.712 -2.689 47 HG12 VAL 6 2HG1 VAL 6 -6.550 -8.625 -3.276 48 HG13 VAL 6 3HG1 VAL 6 -6.073 -7.707 -1.854 49 HG21 VAL 6 3HG2 VAL 6 -3.344 -6.742 -2.971 50 HG22 VAL 6 1HG2 VAL 6 -4.505 -5.778 -2.059 51 HG23 VAL 6 2HG2 VAL 6 -3.964 -5.238 -3.644 52 H GLU 7 H GLU 7 -6.683 -5.886 -6.106 53 HA GLU 7 HA GLU 7 -4.806 -3.937 -7.246 54 HB2 GLU 7 2HB GLU 7 -5.919 -4.108 -9.483 55 HB3 GLU 7 1HB GLU 7 -5.045 -5.574 -9.046 56 HG2 GLU 7 2HG GLU 7 -7.160 -6.615 -8.289 57 HG3 GLU 7 1HG GLU 7 -8.040 -5.158 -8.742 58 H VAL 8 H VAL 8 -5.874 -1.991 -7.964 59 HA VAL 8 HA VAL 8 -8.690 -1.603 -7.255 60 HB VAL 8 HB VAL 8 -7.492 -1.206 -5.123 61 HG11 VAL 8 1HG1 VAL 8 -5.886 0.630 -4.918 62 HG12 VAL 8 2HG1 VAL 8 -6.011 0.962 -6.638 63 HG13 VAL 8 3HG1 VAL 8 -5.326 -0.565 -6.080 64 HG21 VAL 8 3HG2 VAL 8 -8.484 1.369 -6.385 65 HG22 VAL 8 1HG2 VAL 8 -8.416 1.015 -4.663 66 HG23 VAL 8 2HG2 VAL 8 -9.524 0.121 -5.705 67 H THR 9 H THR 9 -9.610 0.105 -8.344 68 HA THR 9 HA THR 9 -7.949 1.376 -10.469 69 HB THR 9 HB THR 9 -9.715 0.164 -11.521 70 HG1 THR 9 1HG THR 9 -9.578 2.618 -11.786 71 HG21 THR 9 3HG2 THR 9 -12.087 0.330 -10.778 72 HG22 THR 9 1HG2 THR 9 -11.571 1.264 -9.382 73 HG23 THR 9 2HG2 THR 9 -11.055 -0.409 -9.556 74 H VAL 10 H VAL 10 -7.442 3.446 -10.175 75 HA VAL 10 HA VAL 10 -9.314 5.241 -8.671 76 HB VAL 10 HB VAL 10 -7.166 6.422 -7.885 77 HG11 VAL 10 1HG1 VAL 10 -8.537 5.056 -6.347 78 HG12 VAL 10 2HG1 VAL 10 -6.822 4.844 -5.990 79 HG13 VAL 10 3HG1 VAL 10 -7.697 3.602 -6.882 80 HG21 VAL 10 3HG2 VAL 10 -5.123 5.081 -7.815 81 HG22 VAL 10 1HG2 VAL 10 -5.650 5.272 -9.480 82 HG23 VAL 10 2HG2 VAL 10 -5.927 3.748 -8.644 83 H TYR 11 H TYR 11 -9.696 7.162 -9.587 84 HA TYR 11 HA TYR 11 -8.599 7.678 -12.282 85 HB2 TYR 11 2HB TYR 11 -10.869 9.012 -10.777 86 HB3 TYR 11 1HB TYR 11 -10.438 9.275 -12.469 87 HD1 TYR 11 2HD TYR 11 -10.746 7.452 -14.159 88 HD2 TYR 11 1HD TYR 11 -12.053 6.975 -10.086 89 HE1 TYR 11 2HE TYR 11 -12.118 5.499 -14.820 90 HE2 TYR 11 1HE TYR 11 -13.421 5.026 -10.755 91 HH TYR 11 HH TYR 11 -13.245 3.265 -12.796 92 H ALA 12 H ALA 12 -6.541 8.435 -11.715 93 HA ALA 12 HA ALA 12 -6.370 11.238 -11.196 94 HB1 ALA 12 1HB ALA 12 -6.738 10.498 -8.863 95 HB2 ALA 12 2HB ALA 12 -5.116 11.151 -9.077 96 HB3 ALA 12 3HB ALA 12 -5.359 9.406 -8.991 97 H ALA 13 H ALA 13 -4.284 12.046 -11.570 98 HA ALA 13 HA ALA 13 -2.696 10.562 -13.388 99 HB1 ALA 13 1HB ALA 13 -2.756 13.023 -13.368 100 HB2 ALA 13 2HB ALA 13 -1.104 12.437 -13.192 101 HB3 ALA 13 3HB ALA 13 -1.981 13.037 -11.784 102 H ILE 14 H ILE 14 -1.114 9.105 -13.019 103 HA ILE 14 HA ILE 14 -0.553 7.996 -10.544 104 HB ILE 14 HB ILE 14 -0.033 6.882 -12.664 105 HG12 ILE 14 2HG1 ILE 14 2.530 7.278 -11.039 106 HG13 ILE 14 1HG1 ILE 14 1.186 6.276 -10.496 107 HG21 ILE 14 1HG2 ILE 14 1.854 7.556 -14.048 108 HG22 ILE 14 2HG2 ILE 14 2.320 8.810 -12.902 109 HG23 ILE 14 3HG2 ILE 14 0.825 8.972 -13.825 110 HD11 ILE 14 3HD1 ILE 14 2.721 5.881 -13.072 111 HD12 ILE 14 1HD1 ILE 14 1.399 4.877 -12.473 112 HD13 ILE 14 2HD1 ILE 14 2.925 4.954 -11.590 113 H GLU 15 H GLU 15 1.056 10.693 -12.181 114 HA GLU 15 HA GLU 15 3.331 10.884 -10.593 115 HB2 GLU 15 2HB GLU 15 2.876 12.157 -12.723 116 HB3 GLU 15 1HB GLU 15 1.765 13.186 -11.822 117 HG2 GLU 15 2HG GLU 15 3.918 14.314 -11.974 118 HG3 GLU 15 1HG GLU 15 3.679 13.829 -10.301 119 H LYS 16 H LYS 16 0.087 12.235 -10.113 120 HA LYS 16 HA LYS 16 0.760 13.680 -7.729 121 HB2 LYS 16 2HB LYS 16 -1.211 14.200 -9.179 122 HB3 LYS 16 1HB LYS 16 -1.963 12.692 -8.661 123 HG2 LYS 16 2HG LYS 16 -1.937 13.460 -6.315 124 HG3 LYS 16 1HG LYS 16 -1.122 14.946 -6.802 125 HD2 LYS 16 2HD LYS 16 -3.072 15.549 -8.200 126 HD3 LYS 16 1HD LYS 16 -3.882 14.063 -7.701 127 HE2 LYS 16 2HE LYS 16 -4.652 15.986 -6.349 128 HE3 LYS 16 1HE LYS 16 -3.811 14.804 -5.345 129 HZ1 LYS 16 3HZ LYS 16 -2.369 16.360 -4.769 130 HZ2 LYS 16 1HZ LYS 16 -3.192 17.502 -5.713 131 HZ3 LYS 16 2HZ LYS 16 -1.927 16.596 -6.393 132 H VAL 17 H VAL 17 -0.811 10.540 -8.355 133 HA VAL 17 HA VAL 17 -1.282 9.836 -5.670 134 HB VAL 17 HB VAL 17 -0.802 7.992 -8.036 135 HG11 VAL 17 1HG1 VAL 17 -2.155 7.550 -5.344 136 HG12 VAL 17 2HG1 VAL 17 -0.700 6.741 -5.930 137 HG13 VAL 17 3HG1 VAL 17 -2.253 6.421 -6.694 138 HG21 VAL 17 3HG2 VAL 17 -2.595 9.641 -8.450 139 HG22 VAL 17 1HG2 VAL 17 -3.368 9.187 -6.932 140 HG23 VAL 17 2HG2 VAL 17 -3.263 8.024 -8.254 141 H TRP 18 H TRP 18 1.520 9.276 -7.784 142 HA TRP 18 HA TRP 18 2.931 7.499 -6.195 143 HB2 TRP 18 2HB TRP 18 3.517 8.313 -8.529 144 HB3 TRP 18 1HB TRP 18 4.185 9.768 -7.797 145 HD1 TRP 18 HD TRP 18 4.758 6.015 -8.117 146 HE1 TRP 18 1HE TRP 18 7.146 5.462 -7.349 147 HE3 TRP 18 3HE TRP 18 6.199 10.552 -6.230 148 HZ2 TRP 18 2HZ TRP 18 9.348 6.714 -6.113 149 HZ3 TRP 18 3HZ TRP 18 8.465 10.826 -5.254 150 HH2 TRP 18 HH TRP 18 10.043 8.901 -5.192 151 H LYS 19 H LYS 19 2.757 11.028 -5.972 152 HA LYS 19 HA LYS 19 4.775 11.402 -4.017 153 HB2 LYS 19 2HB LYS 19 2.268 13.015 -4.608 154 HB3 LYS 19 1HB LYS 19 3.591 13.555 -3.568 155 HG2 LYS 19 2HG LYS 19 5.164 13.465 -5.441 156 HG3 LYS 19 1HG LYS 19 3.921 12.784 -6.483 157 HD2 LYS 19 2HD LYS 19 4.137 15.173 -6.959 158 HD3 LYS 19 1HD LYS 19 2.568 14.866 -6.217 159 HE2 LYS 19 2HE LYS 19 3.271 15.812 -4.121 160 HE3 LYS 19 1HE LYS 19 4.977 15.748 -4.577 161 HZ1 LYS 19 3HZ LYS 19 3.773 17.225 -6.543 162 HZ2 LYS 19 1HZ LYS 19 4.716 17.822 -5.266 163 HZ3 LYS 19 2HZ LYS 19 3.025 17.754 -5.112 164 H TYR 20 H TYR 20 1.215 11.110 -3.660 165 HA TYR 20 HA TYR 20 1.273 11.174 -0.802 166 HB2 TYR 20 2HB TYR 20 -0.857 10.265 -2.767 167 HB3 TYR 20 1HB TYR 20 -1.113 10.313 -1.023 168 HD1 TYR 20 2HD TYR 20 -0.630 12.528 0.217 169 HD2 TYR 20 1HD TYR 20 -1.203 12.311 -4.046 170 HE1 TYR 20 2HE TYR 20 -1.115 14.951 0.152 171 HE2 TYR 20 1HE TYR 20 -1.686 14.734 -4.099 172 HH TYR 20 HH TYR 20 -1.478 16.685 -2.877 173 H TRP 21 H TRP 21 1.298 8.599 -3.191 174 HA TRP 21 HA TRP 21 0.827 6.427 -1.485 175 HB2 TRP 21 2HB TRP 21 0.792 6.366 -4.001 176 HB3 TRP 21 1HB TRP 21 2.555 6.446 -4.000 177 HD1 TRP 21 HD TRP 21 3.763 4.148 -3.827 178 HE1 TRP 21 1HE TRP 21 3.063 1.760 -3.175 179 HE3 TRP 21 3HE TRP 21 -1.036 5.027 -2.361 180 HZ2 TRP 21 2HZ TRP 21 0.750 0.395 -2.161 181 HZ3 TRP 21 3HZ TRP 21 -2.470 3.177 -1.560 182 HH2 TRP 21 HH TRP 21 -1.584 0.861 -1.456 183 H ASN 22 H ASN 22 3.546 8.468 -1.804 184 HA ASN 22 HA ASN 22 5.320 6.628 -0.254 185 HB2 ASN 22 2HB ASN 22 6.027 8.959 -2.062 186 HB3 ASN 22 1HB ASN 22 7.174 7.941 -1.187 187 HD21 ASN 22 1HD2 ASN 22 6.254 8.356 -4.223 188 HD22 ASN 22 2HD2 ASN 22 6.211 6.755 -4.782 189 H GLU 23 H GLU 23 3.779 9.789 -0.385 190 HA GLU 23 HA GLU 23 5.311 11.257 1.374 191 HB2 GLU 23 2HB GLU 23 3.312 12.141 0.200 192 HB3 GLU 23 1HB GLU 23 2.294 11.274 1.331 193 HG2 GLU 23 2HG GLU 23 3.218 12.560 3.211 194 HG3 GLU 23 1HG GLU 23 4.344 13.370 2.128 195 HA PRO 24 HA PRO 24 4.981 8.299 4.914 196 HB2 PRO 24 2HB PRO 24 6.318 10.608 6.361 197 HB3 PRO 24 1HB PRO 24 6.738 8.878 6.394 198 HG2 PRO 24 2HG PRO 24 8.211 10.576 4.970 199 HG3 PRO 24 1HG PRO 24 7.813 8.978 4.319 200 HD2 PRO 24 2HD PRO 24 6.598 11.646 3.588 201 HD3 PRO 24 1HD PRO 24 7.002 10.265 2.553 202 H ALA 25 H ALA 25 4.358 11.783 5.335 203 HA ALA 25 HA ALA 25 2.753 11.652 7.621 204 HB1 ALA 25 1HB ALA 25 3.708 13.741 6.726 205 HB2 ALA 25 2HB ALA 25 1.970 13.892 6.988 206 HB3 ALA 25 3HB ALA 25 2.601 13.661 5.356 207 H HIS 26 H HIS 26 1.946 11.090 4.259 208 HA HIS 26 HA HIS 26 -0.923 11.162 4.684 209 HB2 HIS 26 2HB HIS 26 0.208 11.689 2.486 210 HB3 HIS 26 1HB HIS 26 0.595 9.975 2.333 211 HD2 HIS 26 2HD HIS 26 -2.603 12.284 2.337 212 HE1 HIS 26 1HE HIS 26 -3.696 8.480 0.872 213 HE2 HIS 26 2HE HIS 26 -4.510 10.852 1.276 214 H ILE 27 H ILE 27 1.570 8.610 4.410 215 HA ILE 27 HA ILE 27 -0.190 6.411 4.269 216 HB ILE 27 HB ILE 27 2.631 6.601 5.412 217 HG12 ILE 27 2HG1 ILE 27 1.651 5.619 2.688 218 HG13 ILE 27 1HG1 ILE 27 2.294 7.234 2.978 219 HG21 ILE 27 1HG2 ILE 27 1.616 4.547 6.273 220 HG22 ILE 27 2HG2 ILE 27 2.685 4.087 4.964 221 HG23 ILE 27 3HG2 ILE 27 0.949 4.159 4.689 222 HD11 ILE 27 3HD1 ILE 27 4.425 6.198 3.785 223 HD12 ILE 27 1HD1 ILE 27 4.067 5.837 2.097 224 HD13 ILE 27 2HD1 ILE 27 3.784 4.617 3.340 225 H MET 28 H MET 28 1.307 7.985 7.086 226 HA MET 28 HA MET 28 0.301 6.225 9.033 227 HB2 MET 28 2HB MET 28 0.755 8.096 10.644 228 HB3 MET 28 1HB MET 28 2.102 7.756 9.566 229 HG2 MET 28 2HG MET 28 1.508 9.642 8.165 230 HG3 MET 28 1HG MET 28 0.049 9.943 9.093 231 HE1 MET 28 3HE MET 28 3.768 9.088 10.765 232 HE2 MET 28 1HE MET 28 4.395 10.674 10.298 233 HE3 MET 28 2HE MET 28 3.775 9.571 9.071 234 H LYS 29 H LYS 29 -1.312 8.597 7.163 235 HA LYS 29 HA LYS 29 -3.403 9.219 9.029 236 HB2 LYS 29 2HB LYS 29 -2.692 10.695 7.130 237 HB3 LYS 29 1HB LYS 29 -3.404 9.538 6.010 238 HG2 LYS 29 2HG LYS 29 -5.605 9.834 7.052 239 HG3 LYS 29 1HG LYS 29 -4.912 10.955 8.226 240 HD2 LYS 29 2HD LYS 29 -4.261 12.471 6.377 241 HD3 LYS 29 1HD LYS 29 -4.980 11.352 5.217 242 HE2 LYS 29 2HE LYS 29 -7.182 11.638 6.291 243 HE3 LYS 29 1HE LYS 29 -6.469 12.740 7.470 244 HZ1 LYS 29 3HZ LYS 29 -6.184 13.251 4.583 245 HZ2 LYS 29 1HZ LYS 29 -6.096 14.346 5.876 246 HZ3 LYS 29 2HZ LYS 29 -7.599 13.712 5.403 247 H TRP 30 H TRP 30 -2.882 6.756 6.620 248 HA TRP 30 HA TRP 30 -5.410 5.412 7.398 249 HB2 TRP 30 2HB TRP 30 -5.953 4.920 5.069 250 HB3 TRP 30 1HB TRP 30 -5.828 6.668 5.272 251 HD1 TRP 30 HD TRP 30 -3.625 7.859 4.256 252 HE1 TRP 30 1HE TRP 30 -1.979 7.134 2.407 253 HE3 TRP 30 3HE TRP 30 -4.888 2.930 3.824 254 HZ2 TRP 30 2HZ TRP 30 -1.299 4.779 0.933 255 HZ3 TRP 30 3HZ TRP 30 -3.741 1.478 2.201 256 HH2 TRP 30 HH TRP 30 -1.953 2.389 0.747 257 H CYS 31 H CYS 31 -2.378 5.022 7.888 258 HA CYS 31 HA CYS 31 -1.421 2.860 6.421 259 HB2 CYS 31 2HB CYS 31 -0.006 4.048 8.015 260 HB3 CYS 31 1HB CYS 31 -1.037 3.560 9.353 261 HG CYS 31 HG CYS 31 -0.052 1.074 8.008 262 H GLN 32 H GLN 32 -2.059 0.823 6.237 263 HA GLN 32 HA GLN 32 -3.058 -1.187 6.595 264 HB2 GLN 32 2HB GLN 32 -1.863 -0.896 8.869 265 HB3 GLN 32 1HB GLN 32 -3.431 -0.429 9.517 266 HG2 GLN 32 2HG GLN 32 -4.364 -2.593 8.707 267 HG3 GLN 32 1HG GLN 32 -2.765 -3.062 8.162 268 HE21 GLN 32 1HE2 GLN 32 -1.712 -4.375 9.657 269 HE22 GLN 32 2HE2 GLN 32 -1.904 -4.283 11.341 270 H ALA 33 H ALA 33 -4.583 1.722 7.597 271 HA ALA 33 HA ALA 33 -6.736 2.464 7.694 272 HB1 ALA 33 1HB ALA 33 -7.095 0.279 5.649 273 HB2 ALA 33 2HB ALA 33 -6.586 1.925 5.294 274 HB3 ALA 33 3HB ALA 33 -8.211 1.614 5.913 275 H SER 34 H SER 34 -5.996 0.536 9.677 276 HA SER 34 HA SER 34 -8.506 -1.011 10.109 277 HB2 SER 34 2HB SER 34 -5.738 -1.401 11.236 278 HB3 SER 34 1HB SER 34 -7.166 -2.336 11.675 279 HG SER 34 HG SER 34 -6.885 -3.455 9.935 280 HA PRO 35 HA PRO 35 -8.940 2.614 13.023 281 HB2 PRO 35 2HB PRO 35 -11.493 1.040 13.496 282 HB3 PRO 35 1HB PRO 35 -11.278 2.803 13.364 283 HG2 PRO 35 2HG PRO 35 -12.251 1.440 11.309 284 HG3 PRO 35 1HG PRO 35 -11.046 2.715 11.028 285 HD2 PRO 35 2HD PRO 35 -10.655 -0.281 10.999 286 HD3 PRO 35 1HD PRO 35 -9.912 0.961 9.967 287 H GLU 36 H GLU 36 -9.197 -0.843 13.581 288 HA GLU 36 HA GLU 36 -9.338 -0.764 16.432 289 HB2 GLU 36 2HB GLU 36 -9.982 -2.721 14.985 290 HB3 GLU 36 1HB GLU 36 -8.274 -2.980 14.647 291 HG2 GLU 36 2HG GLU 36 -8.944 -4.479 16.450 292 HG3 GLU 36 1HG GLU 36 -7.871 -3.257 17.125 293 H TRP 37 H TRP 37 -6.743 -0.524 14.128 294 HA TRP 37 HA TRP 37 -4.679 -0.628 16.276 295 HB2 TRP 37 2HB TRP 37 -4.463 -0.922 13.257 296 HB3 TRP 37 1HB TRP 37 -3.069 -0.790 14.328 297 HD1 TRP 37 HD TRP 37 -6.059 -3.093 13.646 298 HE1 TRP 37 1HE TRP 37 -5.507 -5.451 14.495 299 HE3 TRP 37 3HE TRP 37 -1.577 -2.177 15.876 300 HZ2 TRP 37 2HZ TRP 37 -3.443 -6.780 15.938 301 HZ3 TRP 37 3HZ TRP 37 -0.340 -4.021 16.998 302 HH2 TRP 37 HH TRP 37 -1.269 -6.312 17.012 303 H HIS 38 H HIS 38 -2.854 0.906 15.857 304 HA HIS 38 HA HIS 38 -3.613 3.485 14.669 305 HB2 HIS 38 2HB HIS 38 -3.174 2.955 17.627 306 HB3 HIS 38 1HB HIS 38 -2.836 4.547 16.946 307 HD2 HIS 38 2HD HIS 38 -5.070 6.139 16.649 308 HE1 HIS 38 1HE HIS 38 -7.997 3.149 17.178 309 HE2 HIS 38 2HE HIS 38 -7.624 5.637 16.852 310 H VAL 39 H VAL 39 -1.857 4.825 14.310 311 HA VAL 39 HA VAL 39 0.815 3.528 14.453 312 HB VAL 39 HB VAL 39 0.040 3.612 12.175 313 HG11 VAL 39 1HG1 VAL 39 -1.579 5.609 12.590 314 HG12 VAL 39 2HG1 VAL 39 -0.751 5.536 11.049 315 HG13 VAL 39 3HG1 VAL 39 -0.187 6.642 12.283 316 HG21 VAL 39 3HG2 VAL 39 2.057 5.865 12.570 317 HG22 VAL 39 1HG2 VAL 39 1.909 4.790 11.183 318 HG23 VAL 39 2HG2 VAL 39 2.461 4.153 12.729 319 HA PRO 40 HA PRO 40 1.179 7.434 16.896 320 HB2 PRO 40 2HB PRO 40 3.037 6.635 18.739 321 HB3 PRO 40 1HB PRO 40 1.330 6.148 18.863 322 HG2 PRO 40 2HG PRO 40 3.669 4.573 17.821 323 HG3 PRO 40 1HG PRO 40 2.332 4.038 18.860 324 HD2 PRO 40 2HD PRO 40 2.412 3.595 16.119 325 HD3 PRO 40 1HD PRO 40 0.897 3.674 17.038 326 H ALA 41 H ALA 41 3.342 5.701 14.917 327 HA ALA 41 HA ALA 41 4.808 8.046 14.186 328 HB1 ALA 41 1HB ALA 41 5.973 7.534 16.300 329 HB2 ALA 41 2HB ALA 41 7.034 7.293 14.913 330 HB3 ALA 41 3HB ALA 41 6.309 5.904 15.722 331 H ALA 42 H ALA 42 6.202 7.673 12.392 332 HA ALA 42 HA ALA 42 6.512 5.045 11.263 333 HB1 ALA 42 1HB ALA 42 4.694 7.009 9.841 334 HB2 ALA 42 2HB ALA 42 4.173 5.522 10.629 335 HB3 ALA 42 3HB ALA 42 5.225 5.446 9.217 336 H GLN 43 H GLN 43 8.057 4.987 9.662 337 HA GLN 43 HA GLN 43 9.262 7.542 8.740 338 HB2 GLN 43 2HB GLN 43 10.786 5.227 10.000 339 HB3 GLN 43 1HB GLN 43 11.514 6.639 9.235 340 HG2 GLN 43 2HG GLN 43 10.373 8.104 10.892 341 HG3 GLN 43 1HG GLN 43 9.711 6.674 11.677 342 HE21 GLN 43 1HE2 GLN 43 11.048 7.839 13.515 343 HE22 GLN 43 2HE2 GLN 43 12.653 7.315 13.691 344 H ASN 44 H ASN 44 10.200 7.417 6.752 345 HA ASN 44 HA ASN 44 10.688 4.940 5.370 346 HB2 ASN 44 2HB ASN 44 8.212 5.079 5.178 347 HB3 ASN 44 1HB ASN 44 8.369 6.652 4.416 348 HD21 ASN 44 1HD2 ASN 44 7.093 4.922 2.820 349 HD22 ASN 44 2HD2 ASN 44 8.103 4.280 1.617 350 H ASP 45 H ASP 45 12.229 5.285 3.873 351 HA ASP 45 HA ASP 45 12.627 7.998 2.721 352 HB2 ASP 45 2HB ASP 45 14.190 7.708 4.642 353 HB3 ASP 45 1HB ASP 45 14.840 6.260 3.876 354 H LEU 46 H LEU 46 12.079 7.532 0.662 355 HA LEU 46 HA LEU 46 12.654 5.036 -0.634 356 HB2 LEU 46 2HB LEU 46 11.516 7.711 -1.435 357 HB3 LEU 46 1HB LEU 46 12.177 6.738 -2.738 358 HG LEU 46 HG LEU 46 10.705 4.830 -1.998 359 HD11 LEU 46 1HD1 LEU 46 9.623 6.927 -0.085 360 HD12 LEU 46 2HD1 LEU 46 10.432 5.421 0.351 361 HD13 LEU 46 3HD1 LEU 46 8.844 5.377 -0.414 362 HD21 LEU 46 3HD2 LEU 46 8.622 5.786 -2.859 363 HD22 LEU 46 1HD2 LEU 46 9.990 6.378 -3.791 364 HD23 LEU 46 2HD2 LEU 46 9.231 7.418 -2.585 365 H LYS 47 H LYS 47 14.785 4.524 -0.634 366 HA LYS 47 HA LYS 47 16.469 5.817 -2.564 367 HB2 LYS 47 2HB LYS 47 16.708 7.359 -0.590 368 HB3 LYS 47 1HB LYS 47 17.332 6.006 0.356 369 HG2 LYS 47 2HG LYS 47 19.203 5.733 -1.230 370 HG3 LYS 47 1HG LYS 47 18.562 7.040 -2.227 371 HD2 LYS 47 2HD LYS 47 18.844 8.613 -0.334 372 HD3 LYS 47 1HD LYS 47 19.506 7.302 0.646 373 HE2 LYS 47 2HE LYS 47 21.352 7.016 -0.964 374 HE3 LYS 47 1HE LYS 47 20.686 8.307 -1.967 375 HZ1 LYS 47 3HZ LYS 47 20.859 9.321 0.598 376 HZ2 LYS 47 1HZ LYS 47 21.820 9.732 -0.738 377 HZ3 LYS 47 2HZ LYS 47 22.325 8.507 0.325 378 H ALA 48 H ALA 48 17.978 4.407 -3.295 379 HA ALA 48 HA ALA 48 17.802 1.680 -2.670 380 HB1 ALA 48 1HB ALA 48 18.659 2.541 -4.808 381 HB2 ALA 48 2HB ALA 48 19.826 1.449 -4.059 382 HB3 ALA 48 3HB ALA 48 20.075 3.194 -3.984 383 H GLY 49 H GLY 49 18.807 0.403 -1.196 384 HA2 GLY 49 2HA GLY 49 20.261 -0.292 0.457 385 HA3 GLY 49 1HA GLY 49 21.297 1.087 0.101 386 H GLY 50 H GLY 50 18.217 2.240 0.522 387 HA2 GLY 50 2HA GLY 50 18.790 3.345 3.164 388 HA3 GLY 50 1HA GLY 50 17.389 3.684 2.149 389 H THR 51 H THR 51 17.164 3.217 4.891 390 HA THR 51 HA THR 51 15.631 0.654 4.985 391 HB THR 51 HB THR 51 16.416 0.242 7.207 392 HG1 THR 51 1HG THR 51 17.556 1.774 8.357 393 HG21 THR 51 3HG2 THR 51 18.818 0.048 6.956 394 HG22 THR 51 1HG2 THR 51 18.853 1.363 5.784 395 HG23 THR 51 2HG2 THR 51 18.122 -0.179 5.352 396 H PHE 52 H PHE 52 13.924 0.672 6.560 397 HA PHE 52 HA PHE 52 12.890 3.348 7.361 398 HB2 PHE 52 2HB PHE 52 10.671 2.767 6.529 399 HB3 PHE 52 1HB PHE 52 11.831 2.698 5.203 400 HD1 PHE 52 2HD PHE 52 9.776 0.663 7.536 401 HD2 PHE 52 1HD PHE 52 12.419 0.545 4.149 402 HE1 PHE 52 2HE PHE 52 9.152 -1.707 7.139 403 HE2 PHE 52 1HE PHE 52 11.799 -1.816 3.750 404 HZ PHE 52 HZ PHE 52 10.170 -2.945 5.241 405 H THR 53 H THR 53 11.057 3.117 8.884 406 HA THR 53 HA THR 53 10.857 0.619 10.388 407 HB THR 53 HB THR 53 11.805 3.178 11.741 408 HG1 THR 53 1HG THR 53 13.142 0.839 10.900 409 HG21 THR 53 3HG2 THR 53 10.450 1.748 13.207 410 HG22 THR 53 1HG2 THR 53 12.146 1.656 13.678 411 HG23 THR 53 2HG2 THR 53 11.417 0.340 12.760 412 H THR 54 H THR 54 8.713 0.415 10.396 413 HA THR 54 HA THR 54 6.963 2.777 10.867 414 HB THR 54 HB THR 54 5.173 1.324 9.922 415 HG1 THR 54 1HG THR 54 5.890 -0.686 10.280 416 HG21 THR 54 3HG2 THR 54 5.956 1.398 7.588 417 HG22 THR 54 1HG2 THR 54 7.612 1.619 8.147 418 HG23 THR 54 2HG2 THR 54 6.409 2.870 8.447 419 H THR 55 H THR 55 6.436 2.963 12.978 420 HA THR 55 HA THR 55 6.398 0.627 14.755 421 HB THR 55 HB THR 55 5.734 3.552 15.320 422 HG1 THR 55 1HG THR 55 7.791 3.871 15.493 423 HG21 THR 55 3HG2 THR 55 6.287 2.909 17.659 424 HG22 THR 55 1HG2 THR 55 6.462 1.232 17.144 425 HG23 THR 55 2HG2 THR 55 4.889 2.026 17.051 426 H MET 56 H MET 56 4.593 -0.615 14.731 427 HA MET 56 HA MET 56 1.910 0.689 14.538 428 HB2 MET 56 2HB MET 56 2.819 -2.019 13.502 429 HB3 MET 56 1HB MET 56 1.159 -1.423 13.479 430 HG2 MET 56 2HG MET 56 1.887 0.500 12.080 431 HG3 MET 56 1HG MET 56 3.524 -0.158 12.061 432 HE1 MET 56 3HE MET 56 3.878 -0.702 9.431 433 HE2 MET 56 1HE MET 56 2.650 0.556 9.615 434 HE3 MET 56 2HE MET 56 2.402 -0.764 8.475 435 H ALA 57 H ALA 57 0.662 0.346 16.261 436 HA ALA 57 HA ALA 57 0.908 -2.086 17.883 437 HB1 ALA 57 1HB ALA 57 1.307 0.680 19.071 438 HB2 ALA 57 2HB ALA 57 2.565 -0.543 18.891 439 HB3 ALA 57 3HB ALA 57 1.204 -0.830 19.976 440 H ALA 58 H ALA 58 -0.889 -2.474 19.150 441 HA ALA 58 HA ALA 58 -3.368 -1.417 18.134 442 HB1 ALA 58 1HB ALA 58 -4.425 -2.869 19.813 443 HB2 ALA 58 2HB ALA 58 -2.849 -3.180 20.542 444 HB3 ALA 58 3HB ALA 58 -3.189 -3.740 18.903 445 H LYS 59 H LYS 59 -4.888 -0.136 19.217 446 HA LYS 59 HA LYS 59 -3.906 2.052 20.676 447 HB2 LYS 59 2HB LYS 59 -6.339 2.535 21.124 448 HB3 LYS 59 1HB LYS 59 -5.986 2.213 19.429 449 HG2 LYS 59 2HG LYS 59 -6.723 -0.136 19.721 450 HG3 LYS 59 1HG LYS 59 -7.110 0.202 21.407 451 HD2 LYS 59 2HD LYS 59 -8.765 1.886 20.704 452 HD3 LYS 59 1HD LYS 59 -8.367 1.579 19.015 453 HE2 LYS 59 2HE LYS 59 -10.399 0.343 19.674 454 HE3 LYS 59 1HE LYS 59 -9.094 -0.771 19.263 455 HZ1 LYS 59 3HZ LYS 59 -10.514 -0.761 21.585 456 HZ2 LYS 59 1HZ LYS 59 -9.065 0.003 22.018 457 HZ3 LYS 59 2HZ LYS 59 -9.029 -1.549 21.330 458 H ASP 60 H ASP 60 -5.173 -1.037 21.717 459 HA ASP 60 HA ASP 60 -5.465 -0.362 24.510 460 HB2 ASP 60 2HB ASP 60 -5.264 -3.053 23.115 461 HB3 ASP 60 1HB ASP 60 -5.743 -2.807 24.794 462 H GLY 61 H GLY 61 -2.802 -0.884 22.505 463 HA2 GLY 61 2HA GLY 61 -0.547 -1.012 22.945 464 HA3 GLY 61 1HA GLY 61 -0.915 -0.762 24.651 465 H SER 62 H SER 62 -2.757 -3.297 23.515 466 HA SER 62 HA SER 62 -1.461 -5.256 25.088 467 HB2 SER 62 2HB SER 62 -3.444 -5.639 22.828 468 HB3 SER 62 1HB SER 62 -3.022 -6.844 24.041 469 HG SER 62 HG SER 62 -4.376 -5.907 25.331 470 H MET 63 H MET 63 -1.253 -4.413 21.683 471 HA MET 63 HA MET 63 0.972 -6.374 21.291 472 HB2 MET 63 2HB MET 63 -1.177 -5.518 19.316 473 HB3 MET 63 1HB MET 63 0.193 -6.567 18.947 474 HG2 MET 63 2HG MET 63 -0.589 -8.178 20.658 475 HG3 MET 63 1HG MET 63 -1.972 -7.139 20.991 476 HE1 MET 63 3HE MET 63 -0.739 -10.125 19.045 477 HE2 MET 63 1HE MET 63 -0.019 -8.842 18.064 478 HE3 MET 63 2HE MET 63 -1.274 -9.876 17.385 479 H SER 64 H SER 64 2.783 -5.584 20.435 480 HA SER 64 HA SER 64 2.839 -2.976 19.070 481 HB2 SER 64 2HB SER 64 4.635 -2.143 20.505 482 HB3 SER 64 1HB SER 64 3.207 -2.492 21.477 483 HG SER 64 HG SER 64 4.170 -4.514 21.980 484 H PHE 65 H PHE 65 4.161 -3.078 17.363 485 HA PHE 65 HA PHE 65 6.577 -4.713 17.344 486 HB2 PHE 65 2HB PHE 65 4.268 -5.281 15.441 487 HB3 PHE 65 1HB PHE 65 5.896 -5.937 15.270 488 HD1 PHE 65 2HD PHE 65 6.817 -7.522 16.977 489 HD2 PHE 65 1HD PHE 65 2.735 -6.173 17.144 490 HE1 PHE 65 2HE PHE 65 6.278 -9.342 18.566 491 HE2 PHE 65 1HE PHE 65 2.202 -7.994 18.733 492 HZ PHE 65 HZ PHE 65 3.972 -9.578 19.446 493 H ASP 66 H ASP 66 7.814 -4.358 15.373 494 HA ASP 66 HA ASP 66 7.147 -1.888 13.871 495 HB2 ASP 66 2HB ASP 66 9.797 -2.460 15.234 496 HB3 ASP 66 1HB ASP 66 9.443 -1.074 14.202 497 H PHE 67 H PHE 67 7.409 -2.192 11.761 498 HA PHE 67 HA PHE 67 8.806 -4.597 10.755 499 HB2 PHE 67 2HB PHE 67 7.079 -2.545 9.315 500 HB3 PHE 67 1HB PHE 67 7.701 -4.044 8.627 501 HD1 PHE 67 1HD PHE 67 6.848 -6.246 9.391 502 HD2 PHE 67 2HD PHE 67 5.229 -2.573 10.935 503 HE1 PHE 67 1HE PHE 67 4.919 -7.489 10.332 504 HE2 PHE 67 2HE PHE 67 3.301 -3.818 11.871 505 HZ PHE 67 HZ PHE 67 3.146 -6.275 11.572 506 H GLY 68 H GLY 68 10.525 -4.479 9.358 507 HA2 GLY 68 2HA GLY 68 11.610 -1.869 8.518 508 HA3 GLY 68 1HA GLY 68 12.611 -2.879 9.566 509 H GLY 69 H GLY 69 13.055 -2.059 6.806 510 HA2 GLY 69 2HA GLY 69 13.901 -4.591 5.719 511 HA3 GLY 69 1HA GLY 69 12.548 -3.874 4.837 512 H VAL 70 H VAL 70 14.755 -4.152 3.375 513 HA VAL 70 HA VAL 70 16.029 -1.435 3.284 514 HB VAL 70 HB VAL 70 17.224 -4.082 2.345 515 HG11 VAL 70 1HG1 VAL 70 18.422 -1.311 2.703 516 HG12 VAL 70 2HG1 VAL 70 18.102 -2.109 1.164 517 HG13 VAL 70 3HG1 VAL 70 19.323 -2.758 2.253 518 HG21 VAL 70 3HG2 VAL 70 17.719 -2.513 4.901 519 HG22 VAL 70 1HG2 VAL 70 18.696 -3.872 4.353 520 HG23 VAL 70 2HG2 VAL 70 17.007 -4.118 4.786 521 H TYR 71 H TYR 71 15.794 -0.341 1.412 522 HA TYR 71 HA TYR 71 14.106 -1.357 -0.702 523 HB2 TYR 71 2HB TYR 71 15.729 1.192 -0.383 524 HB3 TYR 71 1HB TYR 71 14.666 0.888 -1.755 525 HD1 TYR 71 1HD TYR 71 12.206 0.309 -1.284 526 HD2 TYR 71 2HD TYR 71 14.780 2.084 1.679 527 HE1 TYR 71 1HE TYR 71 10.230 1.035 0.008 528 HE2 TYR 71 2HE TYR 71 12.794 2.810 2.957 529 HH TYR 71 HH TYR 71 9.557 2.517 1.659 530 H ASP 72 H ASP 72 14.825 -2.706 -2.234 531 HA ASP 72 HA ASP 72 17.628 -3.090 -2.820 532 HB2 ASP 72 2HB ASP 72 15.177 -4.069 -4.322 533 HB3 ASP 72 1HB ASP 72 16.817 -4.711 -4.444 534 H GLN 73 H GLN 73 14.872 -1.498 -4.349 535 HA GLN 73 HA GLN 73 16.525 0.366 -5.770 536 HB2 GLN 73 2HB GLN 73 16.772 -1.675 -7.204 537 HB3 GLN 73 1HB GLN 73 15.025 -1.699 -7.433 538 HG2 GLN 73 2HG GLN 73 15.112 0.529 -8.483 539 HG3 GLN 73 1HG GLN 73 16.849 0.606 -8.202 540 HE21 GLN 73 1HE2 GLN 73 15.626 0.734 -10.842 541 HE22 GLN 73 2HE2 GLN 73 16.141 -0.637 -11.701 542 H VAL 74 H VAL 74 15.315 2.086 -6.594 543 HA VAL 74 HA VAL 74 12.362 1.991 -6.361 544 HB VAL 74 HB VAL 74 14.058 4.255 -5.205 545 HG11 VAL 74 1HG1 VAL 74 11.818 4.936 -5.961 546 HG12 VAL 74 2HG1 VAL 74 11.901 4.934 -4.207 547 HG13 VAL 74 3HG1 VAL 74 11.095 3.620 -5.038 548 HG21 VAL 74 3HG2 VAL 74 12.662 1.946 -3.790 549 HG22 VAL 74 1HG2 VAL 74 13.336 3.362 -2.979 550 HG23 VAL 74 2HG2 VAL 74 14.401 2.250 -3.836 551 H LYS 75 H LYS 75 11.418 2.921 -8.082 552 HA LYS 75 HA LYS 75 12.862 4.956 -9.675 553 HB2 LYS 75 2HB LYS 75 11.724 2.312 -10.621 554 HB3 LYS 75 1HB LYS 75 11.855 3.669 -11.738 555 HG2 LYS 75 2HG LYS 75 14.293 2.771 -10.144 556 HG3 LYS 75 1HG LYS 75 13.836 1.922 -11.624 557 HD2 LYS 75 2HD LYS 75 13.989 3.993 -12.926 558 HD3 LYS 75 1HD LYS 75 14.365 4.922 -11.480 559 HE2 LYS 75 2HE LYS 75 16.420 4.384 -12.719 560 HE3 LYS 75 1HE LYS 75 16.412 3.577 -11.150 561 HZ1 LYS 75 3HZ LYS 75 17.059 2.129 -13.037 562 HZ2 LYS 75 1HZ LYS 75 15.492 2.308 -13.664 563 HZ3 LYS 75 2HZ LYS 75 15.721 1.559 -12.158 564 H THR 76 H THR 76 11.603 6.654 -9.980 565 HA THR 76 HA THR 76 9.026 6.888 -8.952 566 HB THR 76 HB THR 76 10.237 8.551 -11.194 567 HG1 THR 76 1HG THR 76 11.671 8.407 -9.491 568 HG21 THR 76 3HG2 THR 76 7.866 9.053 -10.757 569 HG22 THR 76 1HG2 THR 76 8.888 10.365 -10.172 570 HG23 THR 76 2HG2 THR 76 8.204 9.203 -9.032 571 H ASN 77 H ASN 77 7.123 6.154 -9.655 572 HA ASN 77 HA ASN 77 5.517 5.196 -10.992 573 HB2 ASN 77 2HB ASN 77 6.724 7.122 -12.984 574 HB3 ASN 77 1HB ASN 77 5.133 6.370 -13.119 575 HD21 ASN 77 1HD2 ASN 77 5.513 9.222 -12.948 576 HD22 ASN 77 2HD2 ASN 77 4.818 9.746 -11.493 577 H ASP 78 H ASP 78 6.997 3.207 -10.850 578 HA ASP 78 HA ASP 78 7.132 1.997 -13.456 579 HB2 ASP 78 2HB ASP 78 9.220 3.294 -13.550 580 HB3 ASP 78 1HB ASP 78 9.725 2.593 -12.019 581 H LEU 79 H LEU 79 9.270 1.363 -10.716 582 HA LEU 79 HA LEU 79 7.567 -0.808 -9.731 583 HB2 LEU 79 2HB LEU 79 9.035 -1.681 -11.676 584 HB3 LEU 79 1HB LEU 79 10.423 -1.389 -10.630 585 HG LEU 79 HG LEU 79 8.959 -2.857 -8.863 586 HD11 LEU 79 1HD1 LEU 79 8.041 -3.927 -11.562 587 HD12 LEU 79 2HD1 LEU 79 7.015 -3.061 -10.423 588 HD13 LEU 79 3HD1 LEU 79 7.691 -4.625 -9.981 589 HD21 LEU 79 3HD2 LEU 79 10.141 -4.896 -9.658 590 HD22 LEU 79 1HD2 LEU 79 11.204 -3.489 -9.642 591 HD23 LEU 79 2HD2 LEU 79 10.531 -4.067 -11.166 592 H ILE 80 H ILE 80 7.735 -1.007 -7.606 593 HA ILE 80 HA ILE 80 10.161 -0.032 -6.169 594 HB ILE 80 HB ILE 80 7.279 0.491 -5.317 595 HG12 ILE 80 2HG1 ILE 80 9.414 2.428 -6.313 596 HG13 ILE 80 1HG1 ILE 80 8.054 1.883 -7.275 597 HG21 ILE 80 1HG2 ILE 80 9.958 1.314 -4.117 598 HG22 ILE 80 2HG2 ILE 80 8.821 0.172 -3.411 599 HG23 ILE 80 3HG2 ILE 80 8.388 1.867 -3.538 600 HD11 ILE 80 3HD1 ILE 80 6.498 2.821 -5.574 601 HD12 ILE 80 1HD1 ILE 80 7.518 4.034 -6.333 602 HD13 ILE 80 2HD1 ILE 80 7.890 3.477 -4.707 603 H GLU 81 H GLU 81 10.884 -1.444 -4.708 604 HA GLU 81 HA GLU 81 9.157 -3.406 -3.417 605 HB2 GLU 81 2HB GLU 81 10.581 -5.330 -4.160 606 HB3 GLU 81 1HB GLU 81 9.664 -4.607 -5.481 607 HG2 GLU 81 2HG GLU 81 11.644 -3.312 -6.168 608 HG3 GLU 81 1HG GLU 81 12.576 -4.010 -4.849 609 H TYR 82 H TYR 82 10.408 -4.653 -1.821 610 HA TYR 82 HA TYR 82 13.037 -3.779 -1.026 611 HB2 TYR 82 2HB TYR 82 12.290 -2.838 1.173 612 HB3 TYR 82 1HB TYR 82 11.789 -1.854 -0.200 613 HD1 TYR 82 2HD TYR 82 9.434 -1.812 -0.965 614 HD2 TYR 82 1HD TYR 82 10.618 -4.110 2.476 615 HE1 TYR 82 2HE TYR 82 7.063 -2.048 -0.302 616 HE2 TYR 82 1HE TYR 82 8.239 -4.339 3.129 617 HH TYR 82 HH TYR 82 6.143 -3.480 2.773 618 H THR 83 H THR 83 13.831 -4.997 0.776 619 HA THR 83 HA THR 83 12.446 -7.606 1.138 620 HB THR 83 HB THR 83 14.795 -8.204 2.082 621 HG1 THR 83 1HG THR 83 15.239 -5.839 2.170 622 HG21 THR 83 3HG2 THR 83 14.072 -8.942 -0.143 623 HG22 THR 83 1HG2 THR 83 15.766 -8.449 -0.192 624 HG23 THR 83 2HG2 THR 83 14.517 -7.381 -0.827 625 H ILE 84 H ILE 84 11.650 -8.150 3.061 626 HA ILE 84 HA ILE 84 11.831 -6.250 5.322 627 HB ILE 84 HB ILE 84 10.065 -8.694 4.875 628 HG12 ILE 84 2HG1 ILE 84 9.337 -5.729 4.790 629 HG13 ILE 84 1HG1 ILE 84 9.674 -6.676 3.346 630 HG21 ILE 84 1HG2 ILE 84 8.773 -7.739 6.826 631 HG22 ILE 84 2HG2 ILE 84 10.070 -6.571 7.063 632 HG23 ILE 84 3HG2 ILE 84 10.380 -8.293 7.273 633 HD11 ILE 84 3HD1 ILE 84 7.491 -7.371 5.341 634 HD12 ILE 84 1HD1 ILE 84 7.801 -8.152 3.790 635 HD13 ILE 84 2HD1 ILE 84 7.237 -6.485 3.841 636 H GLY 85 H GLY 85 12.746 -6.792 7.253 637 HA2 GLY 85 2HA GLY 85 14.715 -8.891 7.297 638 HA3 GLY 85 1HA GLY 85 14.310 -7.789 8.607 639 H ASP 86 H ASP 86 11.806 -9.734 7.044 640 HA ASP 86 HA ASP 86 11.584 -11.474 9.461 641 HB2 ASP 86 2HB ASP 86 9.759 -9.756 9.266 642 HB3 ASP 86 1HB ASP 86 9.320 -10.442 7.704 643 H GLY 87 H GLY 87 12.135 -11.291 6.146 644 HA2 GLY 87 2HA GLY 87 12.841 -13.192 4.869 645 HA3 GLY 87 1HA GLY 87 11.748 -14.224 5.787 646 H ARG 88 H ARG 88 9.799 -11.760 5.406 647 HA ARG 88 HA ARG 88 8.398 -12.903 3.157 648 HB2 ARG 88 2HB ARG 88 7.900 -10.395 4.802 649 HB3 ARG 88 1HB ARG 88 6.791 -11.023 3.581 650 HG2 ARG 88 2HG ARG 88 6.580 -13.134 4.844 651 HG3 ARG 88 1HG ARG 88 7.699 -12.529 6.059 652 HD2 ARG 88 2HD ARG 88 6.151 -10.676 6.566 653 HD3 ARG 88 1HD ARG 88 5.028 -11.279 5.349 654 HE ARG 88 HE ARG 88 5.534 -13.390 7.114 655 HH11 ARG 88 1HH2 ARG 88 4.154 -10.205 7.162 656 HH12 ARG 88 2HH2 ARG 88 3.040 -10.561 8.439 657 HH21 ARG 88 1HH1 ARG 88 4.074 -13.854 8.783 658 HH22 ARG 88 2HH1 ARG 88 2.994 -12.625 9.355 659 H LYS 89 H LYS 89 7.497 -11.246 1.517 660 HA LYS 89 HA LYS 89 9.471 -9.244 0.653 661 HB2 LYS 89 2HB LYS 89 10.135 -11.441 -0.394 662 HB3 LYS 89 1HB LYS 89 8.565 -11.494 -1.195 663 HG2 LYS 89 2HG LYS 89 9.057 -9.371 -2.344 664 HG3 LYS 89 1HG LYS 89 10.608 -9.264 -1.510 665 HD2 LYS 89 2HD LYS 89 11.313 -11.380 -2.580 666 HD3 LYS 89 1HD LYS 89 9.769 -11.456 -3.427 667 HE2 LYS 89 2HE LYS 89 11.514 -10.511 -4.888 668 HE3 LYS 89 1HE LYS 89 10.280 -9.299 -4.535 669 HZ1 LYS 89 3HZ LYS 89 12.449 -9.410 -2.632 670 HZ2 LYS 89 1HZ LYS 89 11.710 -8.067 -3.357 671 HZ3 LYS 89 2HZ LYS 89 12.914 -8.928 -4.193 672 H VAL 90 H VAL 90 8.647 -7.744 -0.791 673 HA VAL 90 HA VAL 90 5.755 -7.804 -1.431 674 HB VAL 90 HB VAL 90 7.129 -5.424 -0.104 675 HG11 VAL 90 1HG1 VAL 90 5.313 -4.776 -1.626 676 HG12 VAL 90 2HG1 VAL 90 4.793 -4.553 0.041 677 HG13 VAL 90 3HG1 VAL 90 4.233 -5.951 -0.876 678 HG21 VAL 90 3HG2 VAL 90 5.641 -5.973 1.844 679 HG22 VAL 90 1HG2 VAL 90 6.857 -7.211 1.539 680 HG23 VAL 90 2HG2 VAL 90 5.188 -7.475 1.036 681 H ARG 91 H ARG 91 5.325 -6.938 -3.374 682 HA ARG 91 HA ARG 91 7.356 -5.289 -4.780 683 HB2 ARG 91 2HB ARG 91 7.580 -7.691 -5.503 684 HB3 ARG 91 1HB ARG 91 5.895 -7.661 -6.021 685 HG2 ARG 91 2HG ARG 91 6.402 -5.828 -7.606 686 HG3 ARG 91 1HG ARG 91 8.083 -5.831 -7.072 687 HD2 ARG 91 2HD ARG 91 7.881 -7.110 -9.143 688 HD3 ARG 91 1HD ARG 91 8.278 -8.205 -7.819 689 HE ARG 91 HE ARG 91 5.460 -8.049 -8.098 690 HH11 ARG 91 1HH2 ARG 91 8.294 -9.242 -9.695 691 HH12 ARG 91 2HH2 ARG 91 7.467 -10.542 -10.488 692 HH21 ARG 91 1HH1 ARG 91 4.374 -9.746 -9.134 693 HH22 ARG 91 2HH1 ARG 91 5.245 -10.826 -10.170 694 H ILE 92 H ILE 92 6.457 -3.607 -5.802 695 HA ILE 92 HA ILE 92 3.479 -3.444 -6.074 696 HB ILE 92 HB ILE 92 5.491 -1.177 -5.692 697 HG12 ILE 92 2HG1 ILE 92 3.442 -2.268 -3.712 698 HG13 ILE 92 1HG1 ILE 92 5.154 -2.666 -3.653 699 HG21 ILE 92 1HG2 ILE 92 2.445 -1.216 -5.749 700 HG22 ILE 92 2HG2 ILE 92 3.489 -0.507 -6.976 701 HG23 ILE 92 3HG2 ILE 92 3.426 0.198 -5.369 702 HD11 ILE 92 3HD1 ILE 92 5.703 -0.267 -3.411 703 HD12 ILE 92 1HD1 ILE 92 4.676 -0.845 -2.101 704 HD13 ILE 92 2HD1 ILE 92 3.982 0.120 -3.403 705 H VAL 93 H VAL 93 2.768 -3.276 -8.123 706 HA VAL 93 HA VAL 93 4.657 -2.459 -10.292 707 HB VAL 93 HB VAL 93 2.295 -4.376 -10.480 708 HG11 VAL 93 1HG1 VAL 93 2.766 -3.196 -12.588 709 HG12 VAL 93 2HG1 VAL 93 3.272 -4.878 -12.719 710 HG13 VAL 93 3HG1 VAL 93 4.475 -3.616 -12.460 711 HG21 VAL 93 3HG2 VAL 93 4.118 -5.370 -9.157 712 HG22 VAL 93 1HG2 VAL 93 5.283 -4.945 -10.412 713 HG23 VAL 93 2HG2 VAL 93 4.025 -6.138 -10.740 714 H PHE 94 H PHE 94 4.100 -0.598 -11.194 715 HA PHE 94 HA PHE 94 1.389 0.536 -10.781 716 HB2 PHE 94 2HB PHE 94 3.995 1.696 -11.849 717 HB3 PHE 94 1HB PHE 94 2.485 2.597 -11.718 718 HD1 PHE 94 1HD PHE 94 5.210 0.966 -9.806 719 HD2 PHE 94 2HD PHE 94 1.583 3.263 -9.524 720 HE1 PHE 94 1HE PHE 94 5.668 1.408 -7.417 721 HE2 PHE 94 2HE PHE 94 2.054 3.706 -7.138 722 HZ PHE 94 HZ PHE 94 4.093 2.777 -6.080 723 H THR 95 H THR 95 -0.070 0.487 -12.365 724 HA THR 95 HA THR 95 0.771 0.290 -15.203 725 HB THR 95 HB THR 95 -1.425 -1.412 -13.941 726 HG1 THR 95 1HG THR 95 0.132 -2.693 -13.463 727 HG21 THR 95 3HG2 THR 95 -0.194 -1.381 -16.720 728 HG22 THR 95 1HG2 THR 95 -1.834 -0.877 -16.305 729 HG23 THR 95 2HG2 THR 95 -1.362 -2.566 -16.143 730 H HIS 96 H HIS 96 -0.519 1.417 -16.566 731 HA HIS 96 HA HIS 96 -3.078 2.551 -15.695 732 HB2 HIS 96 2HB HIS 96 -2.341 4.868 -16.212 733 HB3 HIS 96 1HB HIS 96 -1.455 4.192 -14.846 734 HD2 HIS 96 2HD HIS 96 1.174 3.025 -15.765 735 HE1 HIS 96 1HE HIS 96 1.460 5.851 -18.887 736 HE2 HIS 96 2HE HIS 96 2.747 4.136 -17.527 737 H THR 97 H THR 97 -4.180 3.622 -17.476 738 HA THR 97 HA THR 97 -3.254 2.753 -20.197 739 HB THR 97 HB THR 97 -5.570 2.207 -20.740 740 HG1 THR 97 1HG THR 97 -6.108 3.728 -18.723 741 HG21 THR 97 3HG2 THR 97 -5.838 0.224 -19.322 742 HG22 THR 97 1HG2 THR 97 -4.738 0.908 -18.126 743 HG23 THR 97 2HG2 THR 97 -4.133 0.443 -19.717 744 H GLY 98 H GLY 98 -4.358 5.236 -18.143 745 HA2 GLY 98 2HA GLY 98 -3.935 7.314 -19.932 746 HA3 GLY 98 1HA GLY 98 -5.649 6.921 -20.058 747 H ASP 99 H ASP 99 -6.870 8.216 -18.837 748 HA ASP 99 HA ASP 99 -5.817 9.797 -16.679 749 HB2 ASP 99 2HB ASP 99 -7.661 10.553 -18.185 750 HB3 ASP 99 1HB ASP 99 -8.714 9.333 -17.476 751 H THR 100 H THR 100 -6.350 6.602 -16.706 752 HA THR 100 HA THR 100 -7.308 6.481 -13.884 753 HB THR 100 HB THR 100 -7.693 4.360 -16.032 754 HG1 THR 100 1HG THR 100 -9.717 5.107 -16.221 755 HG21 THR 100 3HG2 THR 100 -7.618 3.451 -13.743 756 HG22 THR 100 1HG2 THR 100 -9.267 3.403 -14.359 757 HG23 THR 100 2HG2 THR 100 -8.795 4.653 -13.211 758 H THR 101 H THR 101 -5.889 5.692 -12.491 759 HA THR 101 HA THR 101 -3.502 4.205 -13.527 760 HB THR 101 HB THR 101 -3.826 5.744 -10.926 761 HG1 THR 101 1HG THR 101 -3.784 7.136 -12.656 762 HG21 THR 101 3HG2 THR 101 -1.420 4.454 -12.253 763 HG22 THR 101 1HG2 THR 101 -2.171 3.950 -10.736 764 HG23 THR 101 2HG2 THR 101 -1.347 5.504 -10.840 765 H ASN 102 H ASN 102 -3.191 2.179 -12.875 766 HA ASN 102 HA ASN 102 -5.054 0.966 -10.882 767 HB2 ASN 102 2HB ASN 102 -3.527 -0.303 -13.183 768 HB3 ASN 102 1HB ASN 102 -4.596 -1.146 -12.063 769 HD21 ASN 102 1HD2 ASN 102 -4.814 -0.610 -15.081 770 HD22 ASN 102 2HD2 ASN 102 -6.352 0.085 -15.265 771 H ILE 103 H ILE 103 -4.159 0.346 -9.046 772 HA ILE 103 HA ILE 103 -1.186 0.094 -8.808 773 HB ILE 103 HB ILE 103 -3.293 0.452 -6.645 774 HG12 ILE 103 2HG1 ILE 103 -1.328 2.514 -7.721 775 HG13 ILE 103 1HG1 ILE 103 -3.025 2.447 -8.187 776 HG21 ILE 103 1HG2 ILE 103 -1.293 -0.689 -5.806 777 HG22 ILE 103 2HG2 ILE 103 -1.309 0.959 -5.201 778 HG23 ILE 103 3HG2 ILE 103 -0.259 0.531 -6.548 779 HD11 ILE 103 3HD1 ILE 103 -3.680 2.689 -5.791 780 HD12 ILE 103 1HD1 ILE 103 -2.766 4.068 -6.403 781 HD13 ILE 103 2HD1 ILE 103 -1.968 2.881 -5.378 782 H VAL 104 H VAL 104 -0.382 -1.899 -8.505 783 HA VAL 104 HA VAL 104 -2.125 -4.085 -7.463 784 HB VAL 104 HB VAL 104 -0.050 -4.329 -9.679 785 HG11 VAL 104 1HG1 VAL 104 -2.031 -6.313 -8.494 786 HG12 VAL 104 2HG1 VAL 104 -0.276 -6.385 -8.352 787 HG13 VAL 104 3HG1 VAL 104 -1.038 -6.614 -9.920 788 HG21 VAL 104 3HG2 VAL 104 -2.019 -4.721 -11.152 789 HG22 VAL 104 1HG2 VAL 104 -2.019 -3.095 -10.474 790 HG23 VAL 104 2HG2 VAL 104 -3.089 -4.327 -9.808 791 H GLU 105 H GLU 105 -1.231 -5.219 -5.850 792 HA GLU 105 HA GLU 105 1.699 -5.165 -5.403 793 HB2 GLU 105 2HB GLU 105 0.713 -3.301 -4.058 794 HB3 GLU 105 1HB GLU 105 -0.340 -4.462 -3.250 795 HG2 GLU 105 2HG GLU 105 1.630 -5.659 -2.367 796 HG3 GLU 105 1HG GLU 105 2.697 -4.548 -3.219 797 H SER 106 H SER 106 2.458 -7.051 -4.714 798 HA SER 106 HA SER 106 0.608 -9.315 -4.280 799 HB2 SER 106 2HB SER 106 2.530 -10.725 -4.679 800 HB3 SER 106 1HB SER 106 2.500 -9.495 -5.942 801 HG SER 106 HG SER 106 4.028 -8.323 -4.710 802 H PHE 107 H PHE 107 0.902 -10.713 -2.444 803 HA PHE 107 HA PHE 107 2.574 -9.727 -0.226 804 HB2 PHE 107 2HB PHE 107 0.270 -8.634 -0.079 805 HB3 PHE 107 1HB PHE 107 -0.409 -10.246 0.138 806 HD1 PHE 107 1HD PHE 107 2.221 -7.943 1.480 807 HD2 PHE 107 2HD PHE 107 -0.478 -11.175 2.382 808 HE1 PHE 107 1HE PHE 107 2.854 -7.809 3.864 809 HE2 PHE 107 2HE PHE 107 0.165 -11.026 4.777 810 HZ PHE 107 HZ PHE 107 1.834 -9.348 5.512 811 H ASP 108 H ASP 108 3.134 -11.346 1.194 812 HA ASP 108 HA ASP 108 2.353 -14.139 0.465 813 HB2 ASP 108 2HB ASP 108 4.596 -14.785 1.294 814 HB3 ASP 108 1HB ASP 108 4.668 -13.714 -0.107 815 HA PRO 109 HA PRO 109 1.102 -13.405 4.892 816 HB2 PRO 109 2HB PRO 109 -1.333 -14.639 4.894 817 HB3 PRO 109 1HB PRO 109 -1.119 -13.014 4.208 818 HG2 PRO 109 2HG PRO 109 -1.296 -15.649 2.783 819 HG3 PRO 109 1HG PRO 109 -2.002 -14.088 2.351 820 HD2 PRO 109 2HD PRO 109 0.349 -15.073 1.237 821 HD3 PRO 109 1HD PRO 109 -0.055 -13.347 1.278 822 H GLU 110 H GLU 110 0.835 -14.906 6.687 823 HA GLU 110 HA GLU 110 2.538 -17.131 6.557 824 HB2 GLU 110 2HB GLU 110 0.344 -16.544 8.555 825 HB3 GLU 110 1HB GLU 110 1.640 -17.705 8.796 826 HG2 GLU 110 2HG GLU 110 3.303 -15.892 8.603 827 HG3 GLU 110 1HG GLU 110 2.007 -14.725 8.346 828 H GLU 111 H GLU 111 2.066 -19.366 6.758 829 HA GLU 111 HA GLU 111 0.113 -20.316 4.908 830 HB2 GLU 111 2HB GLU 111 2.253 -21.506 5.442 831 HB3 GLU 111 1HB GLU 111 1.599 -21.921 7.025 832 HG2 GLU 111 2HG GLU 111 -0.256 -23.151 5.946 833 HG3 GLU 111 1HG GLU 111 0.361 -22.702 4.359 834 H THR 112 H THR 112 0.225 -20.133 8.442 835 HA THR 112 HA THR 112 -2.132 -21.606 8.984 836 HB THR 112 HB THR 112 -2.097 -20.497 11.172 837 HG1 THR 112 1HG THR 112 -0.996 -18.557 9.737 838 HG21 THR 112 3HG2 THR 112 0.195 -21.080 11.841 839 HG22 THR 112 1HG2 THR 112 0.695 -21.101 10.151 840 HG23 THR 112 2HG2 THR 112 -0.460 -22.297 10.744 841 H ASN 113 H ASN 113 -1.582 -18.134 8.410 842 HA ASN 113 HA ASN 113 -4.177 -17.250 8.947 843 HB2 ASN 113 2HB ASN 113 -2.128 -16.128 7.036 844 HB3 ASN 113 1HB ASN 113 -3.580 -15.278 7.573 845 HD21 ASN 113 1HD2 ASN 113 -2.282 -13.631 8.714 846 HD22 ASN 113 2HD2 ASN 113 -1.477 -14.008 10.161 847 HA PRO 114 HA PRO 114 -6.280 -19.420 5.491 848 HB2 PRO 114 2HB PRO 114 -8.313 -17.233 5.960 849 HB3 PRO 114 1HB PRO 114 -8.591 -18.972 5.755 850 HG2 PRO 114 2HG PRO 114 -8.710 -17.844 8.173 851 HG3 PRO 114 1HG PRO 114 -7.982 -19.450 7.957 852 HD2 PRO 114 2HD PRO 114 -6.600 -16.817 8.458 853 HD3 PRO 114 1HD PRO 114 -6.132 -18.457 8.953 854 H ARG 115 H ARG 115 -6.065 -19.073 3.317 855 HA ARG 115 HA ARG 115 -4.975 -16.630 2.304 856 HB2 ARG 115 2HB ARG 115 -6.106 -19.051 0.868 857 HB3 ARG 115 1HB ARG 115 -5.172 -17.765 0.099 858 HG2 ARG 115 2HG ARG 115 -3.258 -18.276 1.611 859 HG3 ARG 115 1HG ARG 115 -4.196 -19.578 2.333 860 HD2 ARG 115 2HD ARG 115 -4.344 -20.704 0.149 861 HD3 ARG 115 1HD ARG 115 -3.425 -19.397 -0.596 862 HE ARG 115 HE ARG 115 -1.921 -20.411 1.555 863 HH11 ARG 115 1HH2 ARG 115 -3.139 -21.369 -1.551 864 HH12 ARG 115 2HH2 ARG 115 -1.842 -22.471 -1.869 865 HH21 ARG 115 1HH1 ARG 115 -0.223 -21.851 1.135 866 HH22 ARG 115 2HH1 ARG 115 -0.192 -22.742 -0.349 867 H GLU 116 H GLU 116 -8.188 -18.121 2.195 868 HA GLU 116 HA GLU 116 -9.346 -16.274 0.386 869 HB2 GLU 116 2HB GLU 116 -10.620 -18.040 2.502 870 HB3 GLU 116 1HB GLU 116 -11.512 -17.178 1.248 871 HG2 GLU 116 2HG GLU 116 -11.189 -19.461 0.493 872 HG3 GLU 116 1HG GLU 116 -10.154 -18.423 -0.486 873 H LEU 117 H LEU 117 -9.384 -16.410 3.968 874 HA LEU 117 HA LEU 117 -11.067 -14.126 4.261 875 HB2 LEU 117 2HB LEU 117 -10.465 -16.107 5.922 876 HB3 LEU 117 1HB LEU 117 -9.169 -15.030 6.446 877 HG LEU 117 HG LEU 117 -12.151 -14.423 6.471 878 HD11 LEU 117 1HD1 LEU 117 -11.858 -14.417 8.920 879 HD12 LEU 117 2HD1 LEU 117 -10.150 -14.804 8.719 880 HD13 LEU 117 3HD1 LEU 117 -11.379 -15.972 8.235 881 HD21 LEU 117 3HD2 LEU 117 -11.312 -12.330 7.781 882 HD22 LEU 117 1HD2 LEU 117 -11.136 -12.329 6.032 883 HD23 LEU 117 2HD2 LEU 117 -9.736 -12.667 7.050 884 H GLN 118 H GLN 118 -7.542 -14.530 4.765 885 HA GLN 118 HA GLN 118 -6.957 -11.881 5.416 886 HB2 GLN 118 2HB GLN 118 -4.649 -12.398 4.892 887 HB3 GLN 118 1HB GLN 118 -5.399 -13.843 5.568 888 HG2 GLN 118 2HG GLN 118 -4.239 -14.716 3.690 889 HG3 GLN 118 1HG GLN 118 -5.866 -14.496 3.065 890 HE21 GLN 118 1HE2 GLN 118 -5.510 -13.924 0.893 891 HE22 GLN 118 2HE2 GLN 118 -4.501 -12.653 0.399 892 H GLN 119 H GLN 119 -7.367 -13.365 2.228 893 HA GLN 119 HA GLN 119 -6.431 -11.253 0.628 894 HB2 GLN 119 2HB GLN 119 -6.982 -13.523 -0.224 895 HB3 GLN 119 1HB GLN 119 -8.693 -13.195 0.016 896 HG2 GLN 119 2HG GLN 119 -8.608 -11.366 -1.617 897 HG3 GLN 119 1HG GLN 119 -6.864 -11.557 -1.780 898 HE21 GLN 119 1HE2 GLN 119 -8.679 -11.785 -4.006 899 HE22 GLN 119 2HE2 GLN 119 -8.622 -13.388 -4.561 900 H SER 120 H SER 120 -9.583 -11.841 2.113 901 HA SER 120 HA SER 120 -10.971 -9.711 0.853 902 HB2 SER 120 2HB SER 120 -12.119 -11.563 2.015 903 HB3 SER 120 1HB SER 120 -11.509 -10.972 3.557 904 HG SER 120 HG SER 120 -13.099 -9.497 1.724 905 H GLY 121 H GLY 121 -8.983 -9.889 3.773 906 HA2 GLY 121 2HA GLY 121 -9.646 -7.407 4.910 907 HA3 GLY 121 1HA GLY 121 -8.120 -8.253 5.139 908 H TRP 122 H TRP 122 -6.935 -8.220 2.721 909 HA TRP 122 HA TRP 122 -5.934 -5.573 2.484 910 HB2 TRP 122 2HB TRP 122 -5.735 -7.886 0.526 911 HB3 TRP 122 1HB TRP 122 -4.723 -6.443 0.519 912 HD1 TRP 122 HD TRP 122 -4.818 -9.865 1.887 913 HE1 TRP 122 1HE TRP 122 -3.051 -10.168 3.736 914 HE3 TRP 122 3HE TRP 122 -3.536 -4.991 2.689 915 HZ2 TRP 122 2HZ TRP 122 -1.325 -8.556 5.346 916 HZ3 TRP 122 3HZ TRP 122 -1.833 -4.402 4.386 917 HH2 TRP 122 HH TRP 122 -0.725 -6.177 5.714 918 H GLN 123 H GLN 123 -8.359 -7.397 0.676 919 HA GLN 123 HA GLN 123 -8.725 -5.407 -1.369 920 HB2 GLN 123 2HB GLN 123 -9.270 -7.842 -1.669 921 HB3 GLN 123 1HB GLN 123 -10.626 -7.639 -0.559 922 HG2 GLN 123 2HG GLN 123 -11.613 -5.943 -2.066 923 HG3 GLN 123 1HG GLN 123 -10.243 -6.109 -3.158 924 HE21 GLN 123 1HE2 GLN 123 -12.984 -6.628 -3.928 925 HE22 GLN 123 2HE2 GLN 123 -13.104 -8.278 -4.307 926 H ALA 124 H ALA 124 -10.239 -6.115 1.743 927 HA ALA 124 HA ALA 124 -12.535 -4.545 1.535 928 HB1 ALA 124 1HB ALA 124 -10.847 -5.121 3.987 929 HB2 ALA 124 2HB ALA 124 -12.174 -6.112 3.386 930 HB3 ALA 124 3HB ALA 124 -12.500 -4.504 4.020 931 H ILE 125 H ILE 125 -9.342 -3.634 2.849 932 HA ILE 125 HA ILE 125 -10.036 -0.947 3.429 933 HB ILE 125 HB ILE 125 -7.563 -0.590 3.526 934 HG12 ILE 125 2HG1 ILE 125 -7.388 -3.522 2.733 935 HG13 ILE 125 1HG1 ILE 125 -6.981 -2.189 1.662 936 HG21 ILE 125 1HG2 ILE 125 -8.560 -3.132 4.871 937 HG22 ILE 125 2HG2 ILE 125 -8.818 -1.498 5.474 938 HG23 ILE 125 3HG2 ILE 125 -7.191 -2.164 5.415 939 HD11 ILE 125 3HD1 ILE 125 -5.593 -2.923 4.255 940 HD12 ILE 125 1HD1 ILE 125 -5.275 -1.424 3.375 941 HD13 ILE 125 2HD1 ILE 125 -4.926 -2.982 2.626 942 H LEU 126 H LEU 126 -8.851 -2.506 0.515 943 HA LEU 126 HA LEU 126 -8.230 -0.124 -0.930 944 HB2 LEU 126 2HB LEU 126 -8.797 -2.996 -1.708 945 HB3 LEU 126 1HB LEU 126 -8.552 -1.786 -2.961 946 HG LEU 126 HG LEU 126 -6.558 -2.401 -0.740 947 HD11 LEU 126 1HD1 LEU 126 -6.563 -3.237 -3.658 948 HD12 LEU 126 2HD1 LEU 126 -6.745 -4.297 -2.263 949 HD13 LEU 126 3HD1 LEU 126 -5.219 -3.468 -2.539 950 HD21 LEU 126 3HD2 LEU 126 -6.663 -0.291 -2.862 951 HD22 LEU 126 1HD2 LEU 126 -5.110 -1.119 -2.719 952 HD23 LEU 126 2HD2 LEU 126 -5.816 -0.312 -1.328 953 H ASN 127 H ASN 127 -11.181 -2.060 -0.600 954 HA ASN 127 HA ASN 127 -12.712 -0.697 -2.574 955 HB2 ASN 127 2HB ASN 127 -13.557 -2.157 -0.045 956 HB3 ASN 127 1HB ASN 127 -14.666 -1.644 -1.317 957 HD21 ASN 127 1HD2 ASN 127 -13.850 -4.442 -0.409 958 HD22 ASN 127 2HD2 ASN 127 -13.333 -5.209 -1.830 959 H SER 128 H SER 128 -12.220 -0.133 0.901 960 HA SER 128 HA SER 128 -14.073 1.975 1.204 961 HB2 SER 128 2HB SER 128 -11.485 1.551 2.729 962 HB3 SER 128 1HB SER 128 -12.862 2.515 3.254 963 HG SER 128 HG SER 128 -12.637 -0.280 2.930 964 H PHE 129 H PHE 129 -10.728 1.926 0.098 965 HA PHE 129 HA PHE 129 -10.150 4.656 0.236 966 HB2 PHE 129 2HB PHE 129 -8.504 2.834 -0.293 967 HB3 PHE 129 1HB PHE 129 -9.200 2.716 -1.909 968 HD1 PHE 129 1HD PHE 129 -7.185 4.818 0.374 969 HD2 PHE 129 2HD PHE 129 -8.905 4.547 -3.561 970 HE1 PHE 129 1HE PHE 129 -5.801 6.731 -0.366 971 HE2 PHE 129 2HE PHE 129 -7.516 6.463 -4.293 972 HZ PHE 129 HZ PHE 129 -5.965 7.555 -2.698 973 H LYS 130 H LYS 130 -12.119 2.878 -2.039 974 HA LYS 130 HA LYS 130 -12.169 4.758 -4.157 975 HB2 LYS 130 2HB LYS 130 -14.297 2.777 -3.274 976 HB3 LYS 130 1HB LYS 130 -14.277 3.622 -4.821 977 HG2 LYS 130 2HG LYS 130 -12.102 2.593 -5.371 978 HG3 LYS 130 1HG LYS 130 -12.112 1.739 -3.827 979 HD2 LYS 130 2HD LYS 130 -14.183 0.563 -4.476 980 HD3 LYS 130 1HD LYS 130 -14.191 1.420 -6.020 981 HE2 LYS 130 2HE LYS 130 -12.008 -0.457 -5.053 982 HE3 LYS 130 1HE LYS 130 -13.219 -0.830 -6.281 983 HZ1 LYS 130 3HZ LYS 130 -11.374 -0.143 -7.490 984 HZ2 LYS 130 1HZ LYS 130 -11.000 1.112 -6.413 985 HZ3 LYS 130 2HZ LYS 130 -12.346 1.249 -7.440 986 H SER 131 H SER 131 -14.161 4.408 -1.233 987 HA SER 131 HA SER 131 -16.096 6.353 -1.812 988 HB2 SER 131 2HB SER 131 -16.528 6.414 0.584 989 HB3 SER 131 1HB SER 131 -16.203 4.751 0.104 990 HG SER 131 HG SER 131 -14.582 4.786 1.423 991 H TYR 132 H TYR 132 -12.831 6.665 -0.513 992 HA TYR 132 HA TYR 132 -12.977 9.344 0.355 993 HB2 TYR 132 2HB TYR 132 -11.114 7.791 0.917 994 HB3 TYR 132 1HB TYR 132 -10.568 7.861 -0.756 995 HD1 TYR 132 2HD TYR 132 -9.593 9.945 -1.698 996 HD2 TYR 132 1HD TYR 132 -10.821 9.727 2.419 997 HE1 TYR 132 2HE TYR 132 -8.367 12.043 -1.218 998 HE2 TYR 132 1HE TYR 132 -9.596 11.827 2.892 999 HH TYR 132 HH TYR 132 -8.143 13.733 0.309 1000 H THR 133 H THR 133 -12.009 7.967 -2.803 1001 HA THR 133 HA THR 133 -11.386 10.431 -4.043 1002 HB THR 133 HB THR 133 -11.549 9.140 -6.134 1003 HG1 THR 133 1HG THR 133 -13.294 7.868 -5.802 1004 HG21 THR 133 3HG2 THR 133 -9.534 8.895 -4.712 1005 HG22 THR 133 1HG2 THR 133 -9.897 7.405 -5.586 1006 HG23 THR 133 2HG2 THR 133 -10.309 7.547 -3.878 1007 H GLU 134 H GLU 134 -14.400 8.630 -3.672 1008 HA GLU 134 HA GLU 134 -15.954 10.160 -5.529 1009 HB2 GLU 134 2HB GLU 134 -16.753 8.418 -3.166 1010 HB3 GLU 134 1HB GLU 134 -17.912 9.130 -4.288 1011 HG2 GLU 134 2HG GLU 134 -16.865 7.935 -6.165 1012 HG3 GLU 134 1HG GLU 134 -15.655 7.257 -5.086 1013 H ASN 135 H ASN 135 -15.047 10.583 -2.170 1014 HA ASN 135 HA ASN 135 -17.022 12.495 -1.450 1015 HB2 ASN 135 2HB ASN 135 -14.206 12.162 -0.377 1016 HB3 ASN 135 1HB ASN 135 -15.509 13.052 0.405 1017 HD21 ASN 135 1HD2 ASN 135 -14.213 10.777 1.632 1018 HD22 ASN 135 2HD2 ASN 135 -15.366 9.539 1.770 1019 H ASN 136 H ASN 136 -14.731 12.690 -3.812 1020 HA ASN 136 HA ASN 136 -13.618 15.269 -3.513 1021 HB2 ASN 136 2HB ASN 136 -13.283 15.168 -5.988 1022 HB3 ASN 136 1HB ASN 136 -12.745 13.705 -5.168 1023 HD21 ASN 136 1HD2 ASN 136 -13.577 13.838 -7.988 1024 HD22 ASN 136 2HD2 ASN 136 -14.937 12.832 -8.138 1025 H LEU 137 H LEU 137 -16.660 14.178 -5.001 1026 HA LEU 137 HA LEU 137 -17.467 16.934 -5.664 1027 HB2 LEU 137 2HB LEU 137 -18.988 14.314 -5.964 1028 HB3 LEU 137 1HB LEU 137 -19.420 15.867 -6.683 1029 HG LEU 137 HG LEU 137 -16.909 14.279 -7.289 1030 HD11 LEU 137 1HD1 LEU 137 -17.948 13.917 -9.498 1031 HD12 LEU 137 2HD1 LEU 137 -19.390 14.773 -8.952 1032 HD13 LEU 137 3HD1 LEU 137 -18.936 13.241 -8.202 1033 HD21 LEU 137 3HD2 LEU 137 -16.263 16.519 -7.679 1034 HD22 LEU 137 1HD2 LEU 137 -17.871 17.004 -8.223 1035 HD23 LEU 137 2HD2 LEU 137 -16.834 16.024 -9.263 1036 H GLU 138 H GLU 138 -17.365 17.576 -3.375 1037 HA GLU 138 HA GLU 138 -19.986 17.624 -2.235 1038 HB2 GLU 138 2HB GLU 138 -18.831 15.322 -1.516 1039 HB3 GLU 138 1HB GLU 138 -17.967 16.329 -0.361 1040 HG2 GLU 138 2HG GLU 138 -20.990 16.091 -0.623 1041 HG3 GLU 138 1HG GLU 138 -20.000 15.397 0.661 1042 H HIS 139 H HIS 139 -16.582 17.876 -1.118 1043 HA HIS 139 HA HIS 139 -16.719 20.752 -0.929 1044 HB2 HIS 139 2HB HIS 139 -16.484 20.861 1.532 1045 HB3 HIS 139 1HB HIS 139 -18.031 20.159 1.059 1046 HD2 HIS 139 2HD HIS 139 -16.874 19.219 3.976 1047 HE1 HIS 139 1HE HIS 139 -15.744 15.644 2.033 1048 HE2 HIS 139 2HE HIS 139 -16.160 16.726 4.292 1049 H HIS 140 H HIS 140 -14.686 21.681 -0.520 1050 HA HIS 140 HA HIS 140 -12.431 20.158 -1.323 1051 HB2 HIS 140 2HB HIS 140 -12.552 22.830 0.120 1052 HB3 HIS 140 1HB HIS 140 -11.154 22.187 -0.745 1053 HD2 HIS 140 2HD HIS 140 -11.304 22.396 -3.558 1054 HE1 HIS 140 1HE HIS 140 -15.082 24.277 -3.694 1055 HE2 HIS 140 2HE HIS 140 -13.060 23.595 -5.074 1056 H HIS 141 H HIS 141 -13.319 21.528 1.855 1057 HA HIS 141 HA HIS 141 -12.549 21.091 3.981 1058 HB2 HIS 141 2HB HIS 141 -13.971 19.105 3.539 1059 HB3 HIS 141 1HB HIS 141 -12.568 18.251 2.901 1060 HD2 HIS 141 2HD HIS 141 -13.973 19.435 6.385 1061 HE1 HIS 141 1HE HIS 141 -10.553 17.061 7.088 1062 HE2 HIS 141 2HE HIS 141 -12.492 18.272 8.195 1063 H HIS 142 H HIS 142 -10.488 22.211 3.408 1064 HA HIS 142 HA HIS 142 -8.188 22.366 3.346 1065 HB2 HIS 142 2HB HIS 142 -8.390 19.728 4.836 1066 HB3 HIS 142 1HB HIS 142 -6.981 20.786 4.795 1067 HD2 HIS 142 2HD HIS 142 -7.223 23.157 6.354 1068 HE1 HIS 142 1HE HIS 142 -10.933 22.146 8.098 1069 HE2 HIS 142 2HE HIS 142 -8.982 23.771 8.183 1070 H HIS 143 H HIS 143 -7.907 22.168 1.098 1071 HA HIS 143 HA HIS 143 -7.877 19.747 -0.337 1072 HB2 HIS 143 2HB HIS 143 -8.004 22.009 -1.377 1073 HB3 HIS 143 1HB HIS 143 -6.320 22.289 -0.944 1074 HD2 HIS 143 2HD HIS 143 -8.402 20.253 -3.568 1075 HE1 HIS 143 1HE HIS 143 -4.314 19.598 -4.393 1076 HE2 HIS 143 2HE HIS 143 -6.680 19.209 -5.231 1077 H HIS 144 H HIS 144 -5.238 21.570 1.200 1078 HA HIS 144 HA HIS 144 -3.108 19.890 0.412 1079 HB2 HIS 144 2HB HIS 144 -3.366 21.578 2.924 1080 HB3 HIS 144 1HB HIS 144 -1.861 20.957 2.243 1081 HD2 HIS 144 2HD HIS 144 -0.912 22.373 -0.025 1082 HE1 HIS 144 1HE HIS 144 -3.975 25.279 -0.073 1083 HE2 HIS 144 2HE HIS 144 -1.736 24.619 -1.074 Start of MODEL 5 1 H1 GLY 1 1HT GLY 1 -1.630 -19.980 -4.441 2 H2 GLY 1 2HT GLY 1 -2.717 -19.329 -5.571 3 H3 GLY 1 3HT GLY 1 -2.887 -20.939 -5.055 4 HA2 GLY 1 2HA GLY 1 -4.355 -19.002 -4.064 5 HA3 GLY 1 1HA GLY 1 -3.843 -20.385 -3.094 6 H ASN 2 H ASN 2 -1.179 -19.870 -2.699 7 HA ASN 2 HA ASN 2 -1.200 -18.005 -0.570 8 HB2 ASN 2 2HB ASN 2 1.165 -19.175 -2.058 9 HB3 ASN 2 1HB ASN 2 1.230 -18.384 -0.483 10 HD21 ASN 2 1HD2 ASN 2 1.857 -21.249 -1.189 11 HD22 ASN 2 2HD2 ASN 2 0.840 -22.179 -0.198 12 H LYS 3 H LYS 3 -0.075 -17.791 -3.905 13 HA LYS 3 HA LYS 3 1.066 -15.165 -3.679 14 HB2 LYS 3 2HB LYS 3 0.131 -16.731 -6.113 15 HB3 LYS 3 1HB LYS 3 1.081 -15.247 -6.161 16 HG2 LYS 3 2HG LYS 3 2.920 -16.335 -4.956 17 HG3 LYS 3 1HG LYS 3 1.966 -17.805 -4.776 18 HD2 LYS 3 2HD LYS 3 3.516 -18.122 -6.629 19 HD3 LYS 3 1HD LYS 3 1.883 -18.023 -7.275 20 HE2 LYS 3 2HE LYS 3 2.255 -15.813 -8.139 21 HE3 LYS 3 1HE LYS 3 3.689 -15.572 -7.136 22 HZ1 LYS 3 3HZ LYS 3 4.918 -17.051 -8.432 23 HZ2 LYS 3 1HZ LYS 3 4.051 -16.128 -9.557 24 HZ3 LYS 3 2HZ LYS 3 3.541 -17.703 -9.180 25 H ILE 4 H ILE 4 -1.225 -14.761 -2.420 26 HA ILE 4 HA ILE 4 -3.531 -14.159 -3.890 27 HB ILE 4 HB ILE 4 -2.506 -12.821 -1.357 28 HG12 ILE 4 2HG1 ILE 4 -4.479 -15.135 -1.664 29 HG13 ILE 4 1HG1 ILE 4 -2.775 -15.351 -1.268 30 HG21 ILE 4 1HG2 ILE 4 -4.996 -12.348 -0.993 31 HG22 ILE 4 2HG2 ILE 4 -5.269 -12.875 -2.650 32 HG23 ILE 4 3HG2 ILE 4 -4.282 -11.453 -2.329 33 HD11 ILE 4 3HD1 ILE 4 -4.805 -13.819 0.385 34 HD12 ILE 4 1HD1 ILE 4 -3.085 -13.937 0.757 35 HD13 ILE 4 2HD1 ILE 4 -4.094 -15.383 0.783 36 H THR 5 H THR 5 -4.195 -12.388 -5.001 37 HA THR 5 HA THR 5 -2.384 -10.049 -5.267 38 HB THR 5 HB THR 5 -1.944 -11.426 -7.215 39 HG1 THR 5 1HG THR 5 -3.452 -9.118 -7.416 40 HG21 THR 5 3HG2 THR 5 -4.952 -11.488 -7.631 41 HG22 THR 5 1HG2 THR 5 -3.962 -12.851 -7.116 42 HG23 THR 5 2HG2 THR 5 -3.748 -12.163 -8.721 43 H VAL 6 H VAL 6 -3.372 -8.144 -5.472 44 HA VAL 6 HA VAL 6 -6.319 -7.974 -5.749 45 HB VAL 6 HB VAL 6 -6.317 -6.287 -3.845 46 HG11 VAL 6 1HG1 VAL 6 -7.130 -8.604 -3.521 47 HG12 VAL 6 2HG1 VAL 6 -6.352 -7.988 -2.063 48 HG13 VAL 6 3HG1 VAL 6 -5.493 -9.120 -3.109 49 HG21 VAL 6 3HG2 VAL 6 -3.563 -7.487 -3.338 50 HG22 VAL 6 1HG2 VAL 6 -4.426 -6.424 -2.233 51 HG23 VAL 6 2HG2 VAL 6 -3.894 -5.820 -3.801 52 H GLU 7 H GLU 7 -7.037 -5.912 -6.403 53 HA GLU 7 HA GLU 7 -5.052 -3.940 -7.296 54 HB2 GLU 7 2HB GLU 7 -5.925 -3.984 -9.634 55 HB3 GLU 7 1HB GLU 7 -5.135 -5.496 -9.186 56 HG2 GLU 7 2HG GLU 7 -7.333 -6.516 -8.706 57 HG3 GLU 7 1HG GLU 7 -8.134 -5.016 -9.167 58 H VAL 8 H VAL 8 -6.057 -1.981 -8.128 59 HA VAL 8 HA VAL 8 -8.901 -1.556 -7.551 60 HB VAL 8 HB VAL 8 -8.312 0.515 -6.156 61 HG11 VAL 8 1HG1 VAL 8 -8.130 -0.704 -4.074 62 HG12 VAL 8 2HG1 VAL 8 -7.537 -2.145 -4.898 63 HG13 VAL 8 3HG1 VAL 8 -9.194 -1.606 -5.147 64 HG21 VAL 8 3HG2 VAL 8 -5.911 0.594 -6.794 65 HG22 VAL 8 1HG2 VAL 8 -5.636 -0.920 -5.932 66 HG23 VAL 8 2HG2 VAL 8 -6.118 0.523 -5.045 67 H THR 9 H THR 9 -9.709 0.314 -8.457 68 HA THR 9 HA THR 9 -8.089 1.455 -10.674 69 HB THR 9 HB THR 9 -10.060 0.505 -11.604 70 HG1 THR 9 1HG THR 9 -9.701 2.864 -11.917 71 HG21 THR 9 3HG2 THR 9 -11.600 1.664 -9.252 72 HG22 THR 9 1HG2 THR 9 -11.275 -0.040 -9.552 73 HG23 THR 9 2HG2 THR 9 -12.329 0.864 -10.635 74 H VAL 10 H VAL 10 -7.290 3.431 -10.329 75 HA VAL 10 HA VAL 10 -8.765 5.363 -8.587 76 HB VAL 10 HB VAL 10 -5.751 5.093 -8.915 77 HG11 VAL 10 1HG1 VAL 10 -5.709 6.688 -6.993 78 HG12 VAL 10 2HG1 VAL 10 -7.465 6.813 -7.084 79 HG13 VAL 10 3HG1 VAL 10 -6.468 7.396 -8.416 80 HG21 VAL 10 3HG2 VAL 10 -7.567 4.281 -6.615 81 HG22 VAL 10 1HG2 VAL 10 -5.804 4.255 -6.576 82 HG23 VAL 10 2HG2 VAL 10 -6.675 3.182 -7.666 83 H TYR 11 H TYR 11 -9.336 7.176 -9.609 84 HA TYR 11 HA TYR 11 -8.296 7.748 -12.319 85 HB2 TYR 11 2HB TYR 11 -10.588 9.001 -10.768 86 HB3 TYR 11 1HB TYR 11 -10.183 9.309 -12.455 87 HD1 TYR 11 1HD TYR 11 -11.507 6.788 -10.069 88 HD2 TYR 11 2HD TYR 11 -10.670 7.641 -14.202 89 HE1 TYR 11 1HE TYR 11 -12.845 4.819 -10.751 90 HE2 TYR 11 2HE TYR 11 -12.008 5.670 -14.877 91 HH TYR 11 HH TYR 11 -13.081 3.841 -14.160 92 H ALA 12 H ALA 12 -6.258 8.543 -11.762 93 HA ALA 12 HA ALA 12 -6.122 11.347 -11.229 94 HB1 ALA 12 1HB ALA 12 -5.063 9.507 -9.059 95 HB2 ALA 12 2HB ALA 12 -6.454 10.577 -8.903 96 HB3 ALA 12 3HB ALA 12 -4.843 11.255 -9.126 97 H ALA 13 H ALA 13 -4.036 12.188 -11.620 98 HA ALA 13 HA ALA 13 -2.465 10.699 -13.460 99 HB1 ALA 13 1HB ALA 13 -1.105 12.656 -13.603 100 HB2 ALA 13 2HB ALA 13 -1.494 13.159 -11.953 101 HB3 ALA 13 3HB ALA 13 -2.713 13.264 -13.221 102 H ILE 14 H ILE 14 -0.665 9.450 -13.171 103 HA ILE 14 HA ILE 14 -0.119 8.196 -10.777 104 HB ILE 14 HB ILE 14 0.604 7.376 -12.984 105 HG12 ILE 14 2HG1 ILE 14 2.966 7.649 -11.063 106 HG13 ILE 14 1HG1 ILE 14 1.631 6.528 -10.812 107 HG21 ILE 14 1HG2 ILE 14 2.900 9.376 -12.781 108 HG22 ILE 14 2HG2 ILE 14 1.482 9.622 -13.802 109 HG23 ILE 14 3HG2 ILE 14 2.564 8.266 -14.110 110 HD11 ILE 14 3HD1 ILE 14 3.504 5.397 -11.864 111 HD12 ILE 14 1HD1 ILE 14 3.492 6.554 -13.190 112 HD13 ILE 14 2HD1 ILE 14 2.131 5.458 -12.965 113 H GLU 15 H GLU 15 1.355 11.131 -12.060 114 HA GLU 15 HA GLU 15 3.480 11.342 -10.233 115 HB2 GLU 15 2HB GLU 15 3.450 13.772 -10.832 116 HB3 GLU 15 1HB GLU 15 3.413 12.712 -12.241 117 HG2 GLU 15 2HG GLU 15 0.941 12.992 -12.356 118 HG3 GLU 15 1HG GLU 15 1.015 14.106 -10.998 119 H LYS 16 H LYS 16 0.083 12.266 -9.994 120 HA LYS 16 HA LYS 16 0.363 13.709 -7.517 121 HB2 LYS 16 2HB LYS 16 -1.507 14.049 -9.145 122 HB3 LYS 16 1HB LYS 16 -2.119 12.446 -8.740 123 HG2 LYS 16 2HG LYS 16 -2.430 13.130 -6.391 124 HG3 LYS 16 1HG LYS 16 -1.741 14.715 -6.746 125 HD2 LYS 16 2HD LYS 16 -3.586 15.145 -8.351 126 HD3 LYS 16 1HD LYS 16 -4.279 13.571 -7.959 127 HE2 LYS 16 2HE LYS 16 -3.855 15.858 -6.007 128 HE3 LYS 16 1HE LYS 16 -5.405 15.340 -6.672 129 HZ1 LYS 16 3HZ LYS 16 -5.249 14.307 -4.597 130 HZ2 LYS 16 1HZ LYS 16 -3.623 13.878 -4.821 131 HZ3 LYS 16 2HZ LYS 16 -4.838 13.084 -5.706 132 H VAL 17 H VAL 17 -0.790 10.443 -8.399 133 HA VAL 17 HA VAL 17 -1.348 9.585 -5.757 134 HB VAL 17 HB VAL 17 -0.590 7.867 -8.146 135 HG11 VAL 17 1HG1 VAL 17 -2.129 7.257 -5.592 136 HG12 VAL 17 2HG1 VAL 17 -0.559 6.595 -6.046 137 HG13 VAL 17 3HG1 VAL 17 -1.996 6.155 -6.962 138 HG21 VAL 17 3HG2 VAL 17 -2.435 9.391 -8.700 139 HG22 VAL 17 1HG2 VAL 17 -3.292 8.920 -7.230 140 HG23 VAL 17 2HG2 VAL 17 -3.047 7.747 -8.526 141 H TRP 18 H TRP 18 1.567 9.356 -7.783 142 HA TRP 18 HA TRP 18 3.125 7.675 -6.219 143 HB2 TRP 18 2HB TRP 18 3.764 8.537 -8.461 144 HB3 TRP 18 1HB TRP 18 4.046 10.128 -7.760 145 HD1 TRP 18 HD TRP 18 6.074 10.308 -5.945 146 HE1 TRP 18 1HE TRP 18 8.250 8.939 -5.744 147 HE3 TRP 18 3HE TRP 18 4.853 6.291 -8.845 148 HZ2 TRP 18 2HZ TRP 18 9.329 6.462 -6.690 149 HZ3 TRP 18 3HZ TRP 18 6.469 4.443 -9.180 150 HH2 TRP 18 HH TRP 18 8.700 4.523 -8.105 151 H LYS 19 H LYS 19 2.541 11.164 -5.838 152 HA LYS 19 HA LYS 19 4.450 11.636 -3.805 153 HB2 LYS 19 2HB LYS 19 1.806 12.997 -4.391 154 HB3 LYS 19 1HB LYS 19 2.995 13.630 -3.258 155 HG2 LYS 19 2HG LYS 19 3.825 13.028 -6.126 156 HG3 LYS 19 1HG LYS 19 2.992 14.532 -5.757 157 HD2 LYS 19 2HD LYS 19 4.749 15.120 -4.122 158 HD3 LYS 19 1HD LYS 19 5.591 13.615 -4.465 159 HE2 LYS 19 2HE LYS 19 6.577 15.497 -5.725 160 HE3 LYS 19 1HE LYS 19 5.886 14.294 -6.813 161 HZ1 LYS 19 3HZ LYS 19 4.116 15.644 -7.324 162 HZ2 LYS 19 1HZ LYS 19 5.358 16.786 -7.155 163 HZ3 LYS 19 2HZ LYS 19 4.242 16.555 -5.894 164 H TYR 20 H TYR 20 0.956 10.865 -3.557 165 HA TYR 20 HA TYR 20 0.925 10.785 -0.704 166 HB2 TYR 20 2HB TYR 20 -0.910 9.736 -2.869 167 HB3 TYR 20 1HB TYR 20 -1.245 9.371 -1.179 168 HD1 TYR 20 2HD TYR 20 -0.423 12.263 -3.438 169 HD2 TYR 20 1HD TYR 20 -2.531 10.975 0.088 170 HE1 TYR 20 2HE TYR 20 -1.418 14.517 -3.202 171 HE2 TYR 20 1HE TYR 20 -3.513 13.230 0.317 172 HH TYR 20 HH TYR 20 -3.670 15.261 -0.536 173 H TRP 21 H TRP 21 1.382 8.279 -3.165 174 HA TRP 21 HA TRP 21 1.399 6.105 -1.326 175 HB2 TRP 21 2HB TRP 21 1.066 6.116 -3.921 176 HB3 TRP 21 1HB TRP 21 2.821 6.053 -4.020 177 HD1 TRP 21 HD TRP 21 3.869 3.669 -3.769 178 HE1 TRP 21 1HE TRP 21 2.990 1.362 -3.042 179 HE3 TRP 21 3HE TRP 21 -0.801 4.983 -2.230 180 HZ2 TRP 21 2HZ TRP 21 0.600 0.229 -1.937 181 HZ3 TRP 21 3HZ TRP 21 -2.365 3.280 -1.350 182 HH2 TRP 21 HH TRP 21 -1.672 0.903 -1.199 183 H ASN 22 H ASN 22 3.754 8.511 -2.048 184 HA ASN 22 HA ASN 22 6.003 6.907 -0.909 185 HB2 ASN 22 2HB ASN 22 5.982 9.363 -2.689 186 HB3 ASN 22 1HB ASN 22 7.439 8.647 -2.013 187 HD21 ASN 22 1HD2 ASN 22 4.578 6.967 -3.440 188 HD22 ASN 22 2HD2 ASN 22 5.474 6.193 -4.656 189 H GLU 23 H GLU 23 4.121 9.869 -0.504 190 HA GLU 23 HA GLU 23 5.886 11.213 1.247 191 HB2 GLU 23 2HB GLU 23 2.939 11.400 0.644 192 HB3 GLU 23 1HB GLU 23 3.531 12.257 2.058 193 HG2 GLU 23 2HG GLU 23 4.775 12.607 -0.703 194 HG3 GLU 23 1HG GLU 23 3.476 13.631 -0.104 195 HA PRO 24 HA PRO 24 5.173 8.505 4.822 196 HB2 PRO 24 2HB PRO 24 6.557 9.804 6.764 197 HB3 PRO 24 1HB PRO 24 7.407 9.108 5.367 198 HG2 PRO 24 2HG PRO 24 6.502 11.959 5.756 199 HG3 PRO 24 1HG PRO 24 8.117 11.365 5.301 200 HD2 PRO 24 2HD PRO 24 6.332 12.217 3.408 201 HD3 PRO 24 1HD PRO 24 7.452 10.864 3.085 202 H ALA 25 H ALA 25 4.692 12.014 5.272 203 HA ALA 25 HA ALA 25 3.022 11.888 7.528 204 HB1 ALA 25 1HB ALA 25 3.020 13.958 5.318 205 HB2 ALA 25 2HB ALA 25 4.071 13.968 6.734 206 HB3 ALA 25 3HB ALA 25 2.328 14.163 6.929 207 H HIS 26 H HIS 26 2.345 11.420 4.131 208 HA HIS 26 HA HIS 26 -0.529 11.641 4.348 209 HB2 HIS 26 2HB HIS 26 1.178 10.427 2.158 210 HB3 HIS 26 1HB HIS 26 -0.529 10.851 2.031 211 HD2 HIS 26 2HD HIS 26 0.072 12.927 0.119 212 HE1 HIS 26 1HE HIS 26 2.193 15.363 2.834 213 HE2 HIS 26 2HE HIS 26 1.168 15.262 0.514 214 H ILE 27 H ILE 27 1.773 8.910 4.318 215 HA ILE 27 HA ILE 27 -0.160 6.849 4.138 216 HB ILE 27 HB ILE 27 2.650 6.913 5.292 217 HG12 ILE 27 2HG1 ILE 27 1.638 5.661 2.696 218 HG13 ILE 27 1HG1 ILE 27 2.263 7.301 2.784 219 HG21 ILE 27 1HG2 ILE 27 1.624 5.016 6.382 220 HG22 ILE 27 2HG2 ILE 27 2.532 4.345 5.040 221 HG23 ILE 27 3HG2 ILE 27 0.784 4.532 4.912 222 HD11 ILE 27 3HD1 ILE 27 4.028 5.741 2.077 223 HD12 ILE 27 1HD1 ILE 27 3.793 4.795 3.546 224 HD13 ILE 27 2HD1 ILE 27 4.413 6.444 3.647 225 H MET 28 H MET 28 1.275 8.428 6.993 226 HA MET 28 HA MET 28 0.015 6.774 8.930 227 HB2 MET 28 2HB MET 28 0.494 8.701 10.511 228 HB3 MET 28 1HB MET 28 1.890 8.126 9.606 229 HG2 MET 28 2HG MET 28 1.662 9.953 8.015 230 HG3 MET 28 1HG MET 28 0.189 10.502 8.792 231 HE1 MET 28 3HE MET 28 4.501 10.816 10.281 232 HE2 MET 28 1HE MET 28 3.848 9.734 9.045 233 HE3 MET 28 2HE MET 28 3.688 9.327 10.752 234 H LYS 29 H LYS 29 -1.240 9.317 6.946 235 HA LYS 29 HA LYS 29 -3.387 10.137 8.625 236 HB2 LYS 29 2HB LYS 29 -2.517 11.412 6.651 237 HB3 LYS 29 1HB LYS 29 -3.265 10.218 5.596 238 HG2 LYS 29 2HG LYS 29 -5.483 10.746 6.488 239 HG3 LYS 29 1HG LYS 29 -4.776 11.877 7.642 240 HD2 LYS 29 2HD LYS 29 -3.909 13.245 5.760 241 HD3 LYS 29 1HD LYS 29 -4.654 12.125 4.619 242 HE2 LYS 29 2HE LYS 29 -6.128 13.765 6.701 243 HE3 LYS 29 1HE LYS 29 -6.092 14.090 4.967 244 HZ1 LYS 29 3HZ LYS 29 -7.576 12.099 6.440 245 HZ2 LYS 29 1HZ LYS 29 -6.832 11.520 5.030 246 HZ3 LYS 29 2HZ LYS 29 -7.910 12.826 4.941 247 H TRP 30 H TRP 30 -2.964 7.484 6.367 248 HA TRP 30 HA TRP 30 -5.604 6.355 7.154 249 HB2 TRP 30 2HB TRP 30 -6.039 5.654 4.858 250 HB3 TRP 30 1HB TRP 30 -5.826 7.401 4.903 251 HD1 TRP 30 HD TRP 30 -3.481 8.365 3.962 252 HE1 TRP 30 1HE TRP 30 -1.824 7.400 2.236 253 HE3 TRP 30 3HE TRP 30 -5.043 3.498 3.847 254 HZ2 TRP 30 2HZ TRP 30 -1.232 4.900 0.976 255 HZ3 TRP 30 3HZ TRP 30 -3.925 1.855 2.391 256 HH2 TRP 30 HH TRP 30 -2.023 2.540 0.954 257 H CYS 31 H CYS 31 -2.566 5.799 7.774 258 HA CYS 31 HA CYS 31 -1.855 3.367 6.573 259 HB2 CYS 31 2HB CYS 31 -0.232 4.594 7.882 260 HB3 CYS 31 1HB CYS 31 -1.238 4.509 9.317 261 HG CYS 31 HG CYS 31 -0.755 1.898 9.376 262 H GLN 32 H GLN 32 -2.464 1.314 6.871 263 HA GLN 32 HA GLN 32 -3.507 -0.547 7.639 264 HB2 GLN 32 2HB GLN 32 -2.559 0.342 9.913 265 HB3 GLN 32 1HB GLN 32 -4.206 0.854 10.242 266 HG2 GLN 32 2HG GLN 32 -3.977 -1.332 11.229 267 HG3 GLN 32 1HG GLN 32 -4.939 -1.548 9.773 268 HE21 GLN 32 1HE2 GLN 32 -4.320 -3.575 8.979 269 HE22 GLN 32 2HE2 GLN 32 -2.713 -4.060 8.735 270 H ALA 33 H ALA 33 -5.159 2.489 8.276 271 HA ALA 33 HA ALA 33 -7.309 3.196 7.970 272 HB1 ALA 33 1HB ALA 33 -8.447 2.392 5.985 273 HB2 ALA 33 2HB ALA 33 -7.469 0.930 5.962 274 HB3 ALA 33 3HB ALA 33 -6.722 2.490 5.626 275 H SER 34 H SER 34 -6.737 1.173 9.989 276 HA SER 34 HA SER 34 -9.342 -0.249 10.225 277 HB2 SER 34 2HB SER 34 -6.676 -0.873 11.487 278 HB3 SER 34 1HB SER 34 -8.178 -1.773 11.719 279 HG SER 34 HG SER 34 -7.999 -2.594 9.771 280 HA PRO 35 HA PRO 35 -9.768 3.087 13.444 281 HB2 PRO 35 2HB PRO 35 -12.277 1.446 13.926 282 HB3 PRO 35 1HB PRO 35 -12.100 3.217 13.858 283 HG2 PRO 35 2HG PRO 35 -13.123 1.946 11.779 284 HG3 PRO 35 1HG PRO 35 -11.907 3.217 11.509 285 HD2 PRO 35 2HD PRO 35 -11.519 0.208 11.439 286 HD3 PRO 35 1HD PRO 35 -10.877 1.468 10.340 287 H GLU 36 H GLU 36 -9.861 -0.371 13.777 288 HA GLU 36 HA GLU 36 -9.824 -0.458 16.673 289 HB2 GLU 36 2HB GLU 36 -9.313 -2.499 14.492 290 HB3 GLU 36 1HB GLU 36 -9.250 -2.903 16.212 291 HG2 GLU 36 2HG GLU 36 -11.592 -2.146 16.459 292 HG3 GLU 36 1HG GLU 36 -11.643 -1.738 14.747 293 H TRP 37 H TRP 37 -7.589 0.695 14.584 294 HA TRP 37 HA TRP 37 -5.345 0.163 16.442 295 HB2 TRP 37 2HB TRP 37 -5.191 -0.208 13.427 296 HB3 TRP 37 1HB TRP 37 -3.807 -0.225 14.521 297 HD1 TRP 37 HD TRP 37 -7.023 -2.168 13.797 298 HE1 TRP 37 1HE TRP 37 -6.737 -4.590 14.609 299 HE3 TRP 37 3HE TRP 37 -2.463 -1.798 16.040 300 HZ2 TRP 37 2HZ TRP 37 -4.828 -6.164 16.017 301 HZ3 TRP 37 3HZ TRP 37 -1.436 -3.789 17.119 302 HH2 TRP 37 HH TRP 37 -2.620 -5.962 17.092 303 H HIS 38 H HIS 38 -3.470 1.602 15.892 304 HA HIS 38 HA HIS 38 -4.175 4.149 14.598 305 HB2 HIS 38 2HB HIS 38 -4.867 4.313 17.013 306 HB3 HIS 38 1HB HIS 38 -3.204 3.977 17.483 307 HD2 HIS 38 2HD HIS 38 -5.203 6.845 15.610 308 HE1 HIS 38 1HE HIS 38 -1.467 8.373 16.840 309 HE2 HIS 38 2HE HIS 38 -3.694 8.968 15.772 310 H VAL 39 H VAL 39 -2.263 5.542 14.412 311 HA VAL 39 HA VAL 39 0.312 4.045 14.273 312 HB VAL 39 HB VAL 39 -0.634 4.281 12.065 313 HG11 VAL 39 1HG1 VAL 39 -0.589 7.318 12.214 314 HG12 VAL 39 2HG1 VAL 39 -2.021 6.433 12.719 315 HG13 VAL 39 3HG1 VAL 39 -1.419 6.268 11.080 316 HG21 VAL 39 3HG2 VAL 39 1.606 6.316 12.407 317 HG22 VAL 39 1HG2 VAL 39 1.229 5.394 10.953 318 HG23 VAL 39 2HG2 VAL 39 1.844 4.568 12.386 319 HA PRO 40 HA PRO 40 0.951 7.883 16.803 320 HB2 PRO 40 2HB PRO 40 2.706 6.924 18.658 321 HB3 PRO 40 1HB PRO 40 0.966 6.567 18.755 322 HG2 PRO 40 2HG PRO 40 3.184 4.838 17.682 323 HG3 PRO 40 1HG PRO 40 1.835 4.388 18.749 324 HD2 PRO 40 2HD PRO 40 1.809 3.940 16.022 325 HD3 PRO 40 1HD PRO 40 0.317 4.191 16.958 326 H ALA 41 H ALA 41 3.005 5.938 14.871 327 HA ALA 41 HA ALA 41 4.615 8.175 14.097 328 HB1 ALA 41 1HB ALA 41 5.751 7.647 16.220 329 HB2 ALA 41 2HB ALA 41 6.789 7.287 14.840 330 HB3 ALA 41 3HB ALA 41 5.970 5.977 15.693 331 H ALA 42 H ALA 42 5.901 7.707 12.278 332 HA ALA 42 HA ALA 42 6.136 5.046 11.210 333 HB1 ALA 42 1HB ALA 42 4.212 6.971 9.874 334 HB2 ALA 42 2HB ALA 42 3.770 5.464 10.674 335 HB3 ALA 42 3HB ALA 42 4.741 5.428 9.202 336 H GLN 43 H GLN 43 7.587 4.936 9.490 337 HA GLN 43 HA GLN 43 8.740 7.483 8.460 338 HB2 GLN 43 2HB GLN 43 10.286 5.094 9.527 339 HB3 GLN 43 1HB GLN 43 10.997 6.492 8.719 340 HG2 GLN 43 2HG GLN 43 10.092 7.970 10.495 341 HG3 GLN 43 1HG GLN 43 9.407 6.564 11.306 342 HE21 GLN 43 1HE2 GLN 43 12.109 8.573 11.273 343 HE22 GLN 43 2HE2 GLN 43 13.209 7.532 12.041 344 H ASN 44 H ASN 44 9.489 7.367 6.369 345 HA ASN 44 HA ASN 44 9.530 4.836 4.901 346 HB2 ASN 44 2HB ASN 44 7.139 5.542 4.811 347 HB3 ASN 44 1HB ASN 44 7.634 7.064 4.082 348 HD21 ASN 44 1HD2 ASN 44 6.743 6.744 1.976 349 HD22 ASN 44 2HD2 ASN 44 7.239 5.491 0.946 350 H ASP 45 H ASP 45 11.409 4.965 3.883 351 HA ASP 45 HA ASP 45 12.195 7.463 2.459 352 HB2 ASP 45 2HB ASP 45 13.989 5.685 4.148 353 HB3 ASP 45 1HB ASP 45 14.529 7.043 3.158 354 H LEU 46 H LEU 46 11.610 6.641 0.487 355 HA LEU 46 HA LEU 46 12.484 4.016 -0.423 356 HB2 LEU 46 2HB LEU 46 11.500 4.867 -2.617 357 HB3 LEU 46 1HB LEU 46 10.378 4.721 -1.280 358 HG LEU 46 HG LEU 46 11.706 7.414 -1.405 359 HD11 LEU 46 1HD1 LEU 46 10.271 8.218 -3.284 360 HD12 LEU 46 2HD1 LEU 46 9.873 6.535 -3.647 361 HD13 LEU 46 3HD1 LEU 46 11.538 7.095 -3.780 362 HD21 LEU 46 3HD2 LEU 46 9.789 6.735 0.106 363 HD22 LEU 46 1HD2 LEU 46 8.761 6.678 -1.328 364 HD23 LEU 46 2HD2 LEU 46 9.514 8.198 -0.836 365 H LYS 47 H LYS 47 14.675 4.052 -0.364 366 HA LYS 47 HA LYS 47 16.062 5.481 -2.532 367 HB2 LYS 47 2HB LYS 47 16.927 5.673 0.375 368 HB3 LYS 47 1HB LYS 47 17.889 6.208 -1.005 369 HG2 LYS 47 2HG LYS 47 16.007 7.771 -1.639 370 HG3 LYS 47 1HG LYS 47 15.187 7.315 -0.146 371 HD2 LYS 47 2HD LYS 47 17.087 8.135 1.181 372 HD3 LYS 47 1HD LYS 47 17.929 8.590 -0.300 373 HE2 LYS 47 2HE LYS 47 16.090 10.144 -0.875 374 HE3 LYS 47 1HE LYS 47 15.248 9.694 0.608 375 HZ1 LYS 47 3HZ LYS 47 17.378 11.538 0.236 376 HZ2 LYS 47 1HZ LYS 47 17.790 10.367 1.391 377 HZ3 LYS 47 2HZ LYS 47 16.385 11.299 1.594 378 H ALA 48 H ALA 48 17.656 4.242 -3.429 379 HA ALA 48 HA ALA 48 17.784 1.501 -2.977 380 HB1 ALA 48 1HB ALA 48 18.603 2.588 -5.029 381 HB2 ALA 48 2HB ALA 48 19.832 1.529 -4.339 382 HB3 ALA 48 3HB ALA 48 19.954 3.277 -4.130 383 H GLY 49 H GLY 49 18.619 0.313 -1.380 384 HA2 GLY 49 2HA GLY 49 20.083 -0.442 0.249 385 HA3 GLY 49 1HA GLY 49 21.144 0.923 -0.090 386 H GLY 50 H GLY 50 18.090 2.130 0.300 387 HA2 GLY 50 2HA GLY 50 18.666 3.251 2.926 388 HA3 GLY 50 1HA GLY 50 17.264 3.585 1.914 389 H THR 51 H THR 51 17.045 3.171 4.667 390 HA THR 51 HA THR 51 15.516 0.609 4.831 391 HB THR 51 HB THR 51 16.242 0.343 7.117 392 HG1 THR 51 1HG THR 51 17.590 1.899 8.069 393 HG21 THR 51 3HG2 THR 51 18.645 0.037 6.852 394 HG22 THR 51 1HG2 THR 51 18.679 1.167 5.501 395 HG23 THR 51 2HG2 THR 51 17.864 -0.386 5.331 396 H PHE 52 H PHE 52 13.763 0.653 6.358 397 HA PHE 52 HA PHE 52 12.791 3.238 7.336 398 HB2 PHE 52 2HB PHE 52 10.669 3.083 6.127 399 HB3 PHE 52 1HB PHE 52 12.010 3.183 4.989 400 HD1 PHE 52 2HD PHE 52 12.846 1.083 3.840 401 HD2 PHE 52 1HD PHE 52 9.258 1.086 6.218 402 HE1 PHE 52 2HE PHE 52 12.162 -1.068 2.823 403 HE2 PHE 52 1HE PHE 52 8.589 -1.068 5.203 404 HZ PHE 52 HZ PHE 52 10.038 -2.145 3.508 405 H THR 53 H THR 53 10.629 2.920 8.469 406 HA THR 53 HA THR 53 9.950 0.247 9.353 407 HB THR 53 HB THR 53 11.154 2.169 11.385 408 HG1 THR 53 1HG THR 53 12.266 -0.291 10.616 409 HG21 THR 53 3HG2 THR 53 10.259 -0.728 11.589 410 HG22 THR 53 1HG2 THR 53 9.443 0.657 12.317 411 HG23 THR 53 2HG2 THR 53 11.047 0.187 12.873 412 H THR 54 H THR 54 7.919 0.193 10.230 413 HA THR 54 HA THR 54 6.486 2.776 10.623 414 HB THR 54 HB THR 54 5.310 0.192 9.532 415 HG1 THR 54 1HG THR 54 6.622 0.921 7.965 416 HG21 THR 54 3HG2 THR 54 3.720 1.776 10.641 417 HG22 THR 54 1HG2 THR 54 3.421 1.630 8.914 418 HG23 THR 54 2HG2 THR 54 4.258 3.043 9.551 419 H THR 55 H THR 55 5.770 3.032 12.667 420 HA THR 55 HA THR 55 5.689 0.717 14.500 421 HB THR 55 HB THR 55 5.318 3.692 15.043 422 HG1 THR 55 1HG THR 55 7.569 2.853 16.002 423 HG21 THR 55 3HG2 THR 55 4.371 2.286 16.823 424 HG22 THR 55 1HG2 THR 55 5.876 3.018 17.378 425 HG23 THR 55 2HG2 THR 55 5.851 1.328 16.880 426 H MET 56 H MET 56 3.804 -0.340 14.727 427 HA MET 56 HA MET 56 1.217 1.141 14.590 428 HB2 MET 56 2HB MET 56 1.832 -1.643 13.543 429 HB3 MET 56 1HB MET 56 0.241 -0.880 13.562 430 HG2 MET 56 2HG MET 56 1.124 0.957 12.131 431 HG3 MET 56 1HG MET 56 2.674 0.124 12.061 432 HE1 MET 56 3HE MET 56 3.292 -1.537 10.368 433 HE2 MET 56 1HE MET 56 2.223 -2.808 9.766 434 HE3 MET 56 2HE MET 56 2.570 -2.688 11.487 435 H ALA 57 H ALA 57 -0.070 0.817 16.309 436 HA ALA 57 HA ALA 57 0.186 -1.592 17.976 437 HB1 ALA 57 1HB ALA 57 0.533 1.209 19.088 438 HB2 ALA 57 2HB ALA 57 1.804 -0.004 18.950 439 HB3 ALA 57 3HB ALA 57 0.443 -0.276 20.038 440 H ALA 58 H ALA 58 -1.608 -2.038 19.173 441 HA ALA 58 HA ALA 58 -4.109 -1.015 18.186 442 HB1 ALA 58 1HB ALA 58 -5.139 -2.518 19.836 443 HB2 ALA 58 2HB ALA 58 -3.558 -2.808 20.565 444 HB3 ALA 58 3HB ALA 58 -3.885 -3.349 18.917 445 H LYS 59 H LYS 59 -5.664 0.214 19.295 446 HA LYS 59 HA LYS 59 -4.705 2.397 20.790 447 HB2 LYS 59 2HB LYS 59 -7.515 1.273 20.508 448 HB3 LYS 59 1HB LYS 59 -7.156 2.825 21.266 449 HG2 LYS 59 2HG LYS 59 -6.121 3.622 19.176 450 HG3 LYS 59 1HG LYS 59 -6.453 2.070 18.408 451 HD2 LYS 59 2HD LYS 59 -8.876 2.418 18.735 452 HD3 LYS 59 1HD LYS 59 -8.553 3.968 19.512 453 HE2 LYS 59 2HE LYS 59 -7.723 3.295 16.665 454 HE3 LYS 59 1HE LYS 59 -9.181 4.194 17.087 455 HZ1 LYS 59 3HZ LYS 59 -7.292 5.638 16.549 456 HZ2 LYS 59 1HZ LYS 59 -6.425 4.988 17.854 457 HZ3 LYS 59 2HZ LYS 59 -7.849 5.870 18.137 458 H ASP 60 H ASP 60 -6.003 -0.714 21.783 459 HA ASP 60 HA ASP 60 -6.263 -0.084 24.583 460 HB2 ASP 60 2HB ASP 60 -6.053 -2.739 23.128 461 HB3 ASP 60 1HB ASP 60 -6.502 -2.549 24.821 462 H GLY 61 H GLY 61 -3.610 -0.580 22.544 463 HA2 GLY 61 2HA GLY 61 -1.357 -0.794 22.932 464 HA3 GLY 61 1HA GLY 61 -1.691 -0.389 24.613 465 H SER 62 H SER 62 -3.445 -3.057 23.404 466 HA SER 62 HA SER 62 -2.034 -4.910 25.166 467 HB2 SER 62 2HB SER 62 -4.415 -5.312 23.337 468 HB3 SER 62 1HB SER 62 -3.825 -6.473 24.527 469 HG SER 62 HG SER 62 -4.627 -5.284 26.088 470 H MET 63 H MET 63 -1.961 -4.023 21.841 471 HA MET 63 HA MET 63 -0.168 -6.322 21.206 472 HB2 MET 63 2HB MET 63 -2.335 -5.193 19.400 473 HB3 MET 63 1HB MET 63 -1.171 -6.444 18.966 474 HG2 MET 63 2HG MET 63 -2.054 -7.878 20.785 475 HG3 MET 63 1HG MET 63 -3.240 -6.633 21.169 476 HE1 MET 63 3HE MET 63 -2.602 -9.811 19.268 477 HE2 MET 63 1HE MET 63 -1.757 -8.685 18.197 478 HE3 MET 63 2HE MET 63 -3.192 -9.535 17.631 479 H SER 64 H SER 64 1.586 -5.826 20.018 480 HA SER 64 HA SER 64 1.872 -3.176 18.751 481 HB2 SER 64 2HB SER 64 3.994 -2.743 19.874 482 HB3 SER 64 1HB SER 64 2.714 -2.921 21.073 483 HG SER 64 HG SER 64 4.293 -4.225 21.802 484 H PHE 65 H PHE 65 3.429 -3.114 17.132 485 HA PHE 65 HA PHE 65 5.090 -5.440 16.528 486 HB2 PHE 65 2HB PHE 65 2.880 -4.590 14.619 487 HB3 PHE 65 1HB PHE 65 4.127 -5.790 14.291 488 HD1 PHE 65 1HD PHE 65 4.350 -7.774 15.976 489 HD2 PHE 65 2HD PHE 65 0.809 -5.342 15.635 490 HE1 PHE 65 1HE PHE 65 3.011 -9.560 17.043 491 HE2 PHE 65 2HE PHE 65 -0.513 -7.137 16.702 492 HZ PHE 65 HZ PHE 65 0.580 -9.243 17.407 493 H ASP 66 H ASP 66 6.490 -5.033 14.680 494 HA ASP 66 HA ASP 66 6.824 -2.175 13.921 495 HB2 ASP 66 2HB ASP 66 8.341 -2.718 15.825 496 HB3 ASP 66 1HB ASP 66 9.046 -4.021 14.874 497 H PHE 67 H PHE 67 6.225 -2.448 11.815 498 HA PHE 67 HA PHE 67 7.400 -4.622 10.191 499 HB2 PHE 67 2HB PHE 67 4.971 -4.123 9.993 500 HB3 PHE 67 1HB PHE 67 5.357 -2.493 9.450 501 HD1 PHE 67 1HD PHE 67 5.656 -6.113 8.601 502 HD2 PHE 67 2HD PHE 67 6.133 -2.086 7.153 503 HE1 PHE 67 1HE PHE 67 5.958 -6.971 6.301 504 HE2 PHE 67 2HE PHE 67 6.430 -2.955 4.853 505 HZ PHE 67 HZ PHE 67 6.343 -5.396 4.427 506 H GLY 68 H GLY 68 8.996 -4.284 8.749 507 HA2 GLY 68 2HA GLY 68 9.587 -1.724 7.562 508 HA3 GLY 68 1HA GLY 68 10.752 -2.180 8.807 509 H GLY 69 H GLY 69 11.737 -1.871 6.371 510 HA2 GLY 69 2HA GLY 69 12.844 -4.436 5.733 511 HA3 GLY 69 1HA GLY 69 11.699 -3.901 4.502 512 H VAL 70 H VAL 70 13.973 -4.126 3.401 513 HA VAL 70 HA VAL 70 15.355 -1.469 3.434 514 HB VAL 70 HB VAL 70 16.501 -4.178 2.637 515 HG11 VAL 70 1HG1 VAL 70 18.668 -2.945 2.759 516 HG12 VAL 70 2HG1 VAL 70 17.783 -1.454 3.070 517 HG13 VAL 70 3HG1 VAL 70 17.600 -2.281 1.524 518 HG21 VAL 70 3HG2 VAL 70 16.816 -2.587 5.213 519 HG22 VAL 70 1HG2 VAL 70 17.767 -4.009 4.788 520 HG23 VAL 70 2HG2 VAL 70 16.032 -4.154 5.047 521 H TYR 71 H TYR 71 15.228 -0.339 1.585 522 HA TYR 71 HA TYR 71 13.765 -1.326 -0.689 523 HB2 TYR 71 2HB TYR 71 15.312 1.210 -0.117 524 HB3 TYR 71 1HB TYR 71 14.564 0.927 -1.684 525 HD1 TYR 71 1HD TYR 71 12.053 0.356 -1.744 526 HD2 TYR 71 2HD TYR 71 13.954 2.085 1.714 527 HE1 TYR 71 1HE TYR 71 9.851 1.106 -0.901 528 HE2 TYR 71 2HE TYR 71 11.739 2.836 2.539 529 HH TYR 71 HH TYR 71 8.762 1.818 1.009 530 H ASP 72 H ASP 72 14.615 -2.772 -2.046 531 HA ASP 72 HA ASP 72 17.446 -3.173 -2.409 532 HB2 ASP 72 2HB ASP 72 15.123 -4.254 -4.046 533 HB3 ASP 72 1HB ASP 72 16.771 -4.884 -4.007 534 H GLN 73 H GLN 73 14.836 -1.623 -4.227 535 HA GLN 73 HA GLN 73 16.674 0.063 -5.670 536 HB2 GLN 73 2HB GLN 73 16.886 -2.075 -6.944 537 HB3 GLN 73 1HB GLN 73 15.152 -2.039 -7.256 538 HG2 GLN 73 2HG GLN 73 15.380 0.078 -8.487 539 HG3 GLN 73 1HG GLN 73 17.099 0.143 -8.096 540 HE21 GLN 73 1HE2 GLN 73 18.389 -0.587 -9.777 541 HE22 GLN 73 2HE2 GLN 73 17.936 -1.756 -10.921 542 H VAL 74 H VAL 74 15.609 1.720 -6.796 543 HA VAL 74 HA VAL 74 12.659 1.848 -6.715 544 HB VAL 74 HB VAL 74 13.313 2.835 -4.589 545 HG11 VAL 74 1HG1 VAL 74 15.188 4.598 -6.198 546 HG12 VAL 74 2HG1 VAL 74 15.669 3.310 -5.092 547 HG13 VAL 74 3HG1 VAL 74 14.864 4.747 -4.478 548 HG21 VAL 74 3HG2 VAL 74 12.727 5.098 -6.555 549 HG22 VAL 74 1HG2 VAL 74 12.376 5.073 -4.837 550 HG23 VAL 74 2HG2 VAL 74 11.514 3.990 -5.916 551 H LYS 75 H LYS 75 11.800 3.089 -8.327 552 HA LYS 75 HA LYS 75 13.530 4.784 -10.008 553 HB2 LYS 75 2HB LYS 75 12.019 2.330 -10.966 554 HB3 LYS 75 1HB LYS 75 12.505 3.621 -12.069 555 HG2 LYS 75 2HG LYS 75 14.874 3.267 -11.396 556 HG3 LYS 75 1HG LYS 75 14.370 1.950 -10.337 557 HD2 LYS 75 2HD LYS 75 13.461 0.719 -12.267 558 HD3 LYS 75 1HD LYS 75 13.937 2.035 -13.340 559 HE2 LYS 75 2HE LYS 75 16.305 1.689 -12.717 560 HE3 LYS 75 1HE LYS 75 15.830 0.368 -11.649 561 HZ1 LYS 75 3HZ LYS 75 16.083 0.413 -14.519 562 HZ2 LYS 75 1HZ LYS 75 14.643 -0.298 -13.976 563 HZ3 LYS 75 2HZ LYS 75 16.140 -0.899 -13.443 564 H THR 76 H THR 76 12.475 6.649 -10.248 565 HA THR 76 HA THR 76 9.945 7.232 -9.314 566 HB THR 76 HB THR 76 11.369 8.640 -11.598 567 HG1 THR 76 1HG THR 76 12.340 8.137 -9.317 568 HG21 THR 76 3HG2 THR 76 9.389 9.628 -9.517 569 HG22 THR 76 1HG2 THR 76 9.078 9.465 -11.245 570 HG23 THR 76 2HG2 THR 76 10.243 10.653 -10.667 571 H ASN 77 H ASN 77 7.963 6.646 -9.961 572 HA ASN 77 HA ASN 77 6.226 5.848 -11.237 573 HB2 ASN 77 2HB ASN 77 7.545 7.636 -13.297 574 HB3 ASN 77 1HB ASN 77 5.886 7.048 -13.362 575 HD21 ASN 77 1HD2 ASN 77 5.385 7.350 -10.461 576 HD22 ASN 77 2HD2 ASN 77 5.298 9.016 -10.160 577 H ASP 78 H ASP 78 7.463 3.723 -11.110 578 HA ASP 78 HA ASP 78 7.415 2.461 -13.689 579 HB2 ASP 78 2HB ASP 78 9.620 3.538 -13.859 580 HB3 ASP 78 1HB ASP 78 10.099 2.821 -12.331 581 H LEU 79 H LEU 79 9.475 1.716 -10.894 582 HA LEU 79 HA LEU 79 7.590 -0.336 -9.935 583 HB2 LEU 79 2HB LEU 79 8.865 -1.426 -11.732 584 HB3 LEU 79 1HB LEU 79 10.371 -0.992 -10.950 585 HG LEU 79 HG LEU 79 8.485 -2.469 -9.132 586 HD11 LEU 79 1HD1 LEU 79 7.981 -3.651 -11.249 587 HD12 LEU 79 2HD1 LEU 79 8.854 -4.682 -10.121 588 HD13 LEU 79 3HD1 LEU 79 9.700 -3.954 -11.487 589 HD21 LEU 79 3HD2 LEU 79 10.869 -1.974 -8.573 590 HD22 LEU 79 1HD2 LEU 79 11.382 -3.011 -9.901 591 HD23 LEU 79 2HD2 LEU 79 10.512 -3.698 -8.527 592 H ILE 80 H ILE 80 7.721 -0.659 -7.804 593 HA ILE 80 HA ILE 80 10.078 0.322 -6.256 594 HB ILE 80 HB ILE 80 7.142 0.655 -5.505 595 HG12 ILE 80 2HG1 ILE 80 9.207 2.782 -6.219 596 HG13 ILE 80 1HG1 ILE 80 7.964 2.212 -7.324 597 HG21 ILE 80 1HG2 ILE 80 8.562 0.292 -3.522 598 HG22 ILE 80 2HG2 ILE 80 8.096 1.980 -3.592 599 HG23 ILE 80 3HG2 ILE 80 9.712 1.496 -4.098 600 HD11 ILE 80 3HD1 ILE 80 6.452 3.616 -6.432 601 HD12 ILE 80 1HD1 ILE 80 7.730 4.303 -5.441 602 HD13 ILE 80 2HD1 ILE 80 6.722 3.006 -4.801 603 H GLU 81 H GLU 81 10.837 -1.186 -4.855 604 HA GLU 81 HA GLU 81 9.093 -3.243 -3.715 605 HB2 GLU 81 2HB GLU 81 10.661 -5.086 -4.475 606 HB3 GLU 81 1HB GLU 81 9.694 -4.380 -5.771 607 HG2 GLU 81 2HG GLU 81 11.575 -2.959 -6.445 608 HG3 GLU 81 1HG GLU 81 12.556 -3.587 -5.126 609 H TYR 82 H TYR 82 10.245 -4.497 -2.068 610 HA TYR 82 HA TYR 82 12.821 -3.532 -1.120 611 HB2 TYR 82 2HB TYR 82 11.872 -2.808 1.100 612 HB3 TYR 82 1HB TYR 82 11.410 -1.759 -0.237 613 HD1 TYR 82 2HD TYR 82 10.206 -4.406 2.080 614 HD2 TYR 82 1HD TYR 82 9.098 -1.677 -1.061 615 HE1 TYR 82 2HE TYR 82 7.805 -4.820 2.543 616 HE2 TYR 82 1HE TYR 82 6.709 -2.105 -0.585 617 HH TYR 82 HH TYR 82 5.435 -4.314 0.595 618 H THR 83 H THR 83 13.640 -4.790 0.627 619 HA THR 83 HA THR 83 12.499 -7.520 0.730 620 HB THR 83 HB THR 83 15.228 -6.481 1.594 621 HG1 THR 83 1HG THR 83 14.936 -8.174 -0.561 622 HG21 THR 83 3HG2 THR 83 14.642 -8.542 2.781 623 HG22 THR 83 1HG2 THR 83 15.815 -8.921 1.522 624 HG23 THR 83 2HG2 THR 83 14.111 -9.293 1.276 625 H ILE 84 H ILE 84 11.615 -8.298 2.544 626 HA ILE 84 HA ILE 84 11.468 -6.604 4.958 627 HB ILE 84 HB ILE 84 9.964 -9.161 4.244 628 HG12 ILE 84 2HG1 ILE 84 8.049 -7.174 4.156 629 HG13 ILE 84 1HG1 ILE 84 9.437 -6.236 3.632 630 HG21 ILE 84 1HG2 ILE 84 10.043 -8.850 6.659 631 HG22 ILE 84 2HG2 ILE 84 8.441 -8.381 6.106 632 HG23 ILE 84 3HG2 ILE 84 9.628 -7.141 6.501 633 HD11 ILE 84 3HD1 ILE 84 9.844 -8.002 1.854 634 HD12 ILE 84 1HD1 ILE 84 8.326 -7.122 1.672 635 HD13 ILE 84 2HD1 ILE 84 8.329 -8.749 2.348 636 H GLY 85 H GLY 85 12.309 -7.215 6.898 637 HA2 GLY 85 2HA GLY 85 14.433 -9.142 6.952 638 HA3 GLY 85 1HA GLY 85 13.812 -8.219 8.316 639 H ASP 86 H ASP 86 11.617 -10.193 6.383 640 HA ASP 86 HA ASP 86 11.413 -12.193 8.579 641 HB2 ASP 86 2HB ASP 86 9.455 -10.634 8.413 642 HB3 ASP 86 1HB ASP 86 9.220 -11.145 6.743 643 H GLY 87 H GLY 87 12.095 -11.527 5.329 644 HA2 GLY 87 2HA GLY 87 13.065 -13.109 3.844 645 HA3 GLY 87 1HA GLY 87 12.196 -14.410 4.647 646 H ARG 88 H ARG 88 9.901 -12.126 4.410 647 HA ARG 88 HA ARG 88 8.597 -13.389 2.157 648 HB2 ARG 88 2HB ARG 88 7.777 -10.888 3.683 649 HB3 ARG 88 1HB ARG 88 6.741 -11.900 2.681 650 HG2 ARG 88 2HG ARG 88 8.113 -12.781 5.251 651 HG3 ARG 88 1HG ARG 88 6.414 -12.359 5.098 652 HD2 ARG 88 2HD ARG 88 6.200 -14.226 3.377 653 HD3 ARG 88 1HD ARG 88 7.829 -14.726 3.824 654 HE ARG 88 HE ARG 88 6.282 -14.507 6.166 655 HH11 ARG 88 1HH2 ARG 88 6.562 -16.417 3.276 656 HH12 ARG 88 2HH2 ARG 88 5.990 -17.871 4.023 657 HH21 ARG 88 1HH1 ARG 88 5.551 -16.420 7.136 658 HH22 ARG 88 2HH1 ARG 88 5.420 -17.872 6.203 659 H LYS 89 H LYS 89 8.184 -12.578 0.149 660 HA LYS 89 HA LYS 89 9.759 -10.186 -0.707 661 HB2 LYS 89 2HB LYS 89 8.768 -12.500 -2.415 662 HB3 LYS 89 1HB LYS 89 9.879 -11.222 -2.900 663 HG2 LYS 89 2HG LYS 89 10.438 -13.314 -0.763 664 HG3 LYS 89 1HG LYS 89 11.047 -13.362 -2.412 665 HD2 LYS 89 2HD LYS 89 12.226 -11.177 -1.985 666 HD3 LYS 89 1HD LYS 89 11.707 -11.265 -0.304 667 HE2 LYS 89 2HE LYS 89 12.880 -13.403 -0.021 668 HE3 LYS 89 1HE LYS 89 13.416 -13.334 -1.700 669 HZ1 LYS 89 3HZ LYS 89 13.968 -10.958 -0.149 670 HZ2 LYS 89 1HZ LYS 89 14.962 -11.803 -1.233 671 HZ3 LYS 89 2HZ LYS 89 14.799 -12.346 0.369 672 H VAL 90 H VAL 90 8.769 -8.540 -1.630 673 HA VAL 90 HA VAL 90 5.937 -8.739 -2.504 674 HB VAL 90 HB VAL 90 7.066 -6.530 -0.739 675 HG11 VAL 90 1HG1 VAL 90 4.279 -7.018 -1.869 676 HG12 VAL 90 2HG1 VAL 90 5.351 -5.680 -2.283 677 HG13 VAL 90 3HG1 VAL 90 4.666 -5.787 -0.667 678 HG21 VAL 90 3HG2 VAL 90 6.712 -8.614 0.522 679 HG22 VAL 90 1HG2 VAL 90 5.076 -8.742 -0.117 680 HG23 VAL 90 2HG2 VAL 90 5.501 -7.419 0.969 681 H ARG 91 H ARG 91 5.527 -7.636 -4.344 682 HA ARG 91 HA ARG 91 7.531 -5.707 -5.421 683 HB2 ARG 91 2HB ARG 91 7.875 -7.966 -6.436 684 HB3 ARG 91 1HB ARG 91 6.199 -7.962 -6.979 685 HG2 ARG 91 2HG ARG 91 6.641 -5.941 -8.345 686 HG3 ARG 91 1HG ARG 91 8.312 -5.928 -7.783 687 HD2 ARG 91 2HD ARG 91 7.026 -8.223 -9.304 688 HD3 ARG 91 1HD ARG 91 8.048 -6.992 -10.036 689 HE ARG 91 HE ARG 91 9.449 -8.124 -7.873 690 HH11 ARG 91 1HH2 ARG 91 8.231 -8.971 -11.016 691 HH12 ARG 91 2HH2 ARG 91 9.440 -10.178 -11.301 692 HH21 ARG 91 1HH1 ARG 91 11.021 -9.701 -8.255 693 HH22 ARG 91 2HH1 ARG 91 11.014 -10.589 -9.743 694 H ILE 92 H ILE 92 6.607 -3.937 -6.279 695 HA ILE 92 HA ILE 92 3.644 -3.850 -6.668 696 HB ILE 92 HB ILE 92 5.498 -1.597 -5.775 697 HG12 ILE 92 2HG1 ILE 92 3.419 -3.132 -4.153 698 HG13 ILE 92 1HG1 ILE 92 5.150 -3.406 -4.035 699 HG21 ILE 92 1HG2 ILE 92 3.331 -0.402 -5.365 700 HG22 ILE 92 2HG2 ILE 92 2.469 -1.769 -6.060 701 HG23 ILE 92 3HG2 ILE 92 3.546 -0.801 -7.062 702 HD11 ILE 92 3HD1 ILE 92 3.698 -0.824 -3.386 703 HD12 ILE 92 1HD1 ILE 92 5.452 -1.017 -3.380 704 HD13 ILE 92 2HD1 ILE 92 4.460 -1.925 -2.239 705 H VAL 93 H VAL 93 3.030 -3.359 -8.692 706 HA VAL 93 HA VAL 93 5.009 -2.138 -10.584 707 HB VAL 93 HB VAL 93 2.739 -4.048 -11.262 708 HG11 VAL 93 1HG1 VAL 93 3.377 -2.533 -13.102 709 HG12 VAL 93 2HG1 VAL 93 3.892 -4.178 -13.452 710 HG13 VAL 93 3HG1 VAL 93 5.068 -2.987 -12.895 711 HG21 VAL 93 3HG2 VAL 93 5.718 -4.575 -11.001 712 HG22 VAL 93 1HG2 VAL 93 4.534 -5.725 -11.618 713 HG23 VAL 93 2HG2 VAL 93 4.462 -5.207 -9.937 714 H PHE 94 H PHE 94 4.412 -0.250 -11.475 715 HA PHE 94 HA PHE 94 1.680 0.812 -10.967 716 HB2 PHE 94 2HB PHE 94 4.304 2.102 -11.821 717 HB3 PHE 94 1HB PHE 94 2.779 2.982 -11.729 718 HD1 PHE 94 1HD PHE 94 5.324 1.123 -9.740 719 HD2 PHE 94 2HD PHE 94 1.799 3.591 -9.567 720 HE1 PHE 94 1HE PHE 94 5.636 1.410 -7.302 721 HE2 PHE 94 2HE PHE 94 2.123 3.873 -7.133 722 HZ PHE 94 HZ PHE 94 4.038 2.780 -6.006 723 H THR 95 H THR 95 0.234 0.748 -12.536 724 HA THR 95 HA THR 95 1.065 0.748 -15.398 725 HB THR 95 HB THR 95 -0.829 -0.805 -15.816 726 HG1 THR 95 1HG THR 95 -1.048 -1.603 -13.227 727 HG21 THR 95 3HG2 THR 95 1.115 -1.826 -13.724 728 HG22 THR 95 1HG2 THR 95 1.461 -1.702 -15.449 729 HG23 THR 95 2HG2 THR 95 0.220 -2.816 -14.875 730 H HIS 96 H HIS 96 -0.114 2.036 -16.700 731 HA HIS 96 HA HIS 96 -2.640 3.233 -15.848 732 HB2 HIS 96 2HB HIS 96 -1.751 5.556 -16.158 733 HB3 HIS 96 1HB HIS 96 -1.035 4.733 -14.774 734 HD2 HIS 96 2HD HIS 96 1.633 3.555 -15.469 735 HE1 HIS 96 1HE HIS 96 2.306 6.468 -18.450 736 HE2 HIS 96 2HE HIS 96 3.404 4.673 -17.030 737 H THR 97 H THR 97 -3.796 4.091 -17.560 738 HA THR 97 HA THR 97 -2.830 3.329 -20.270 739 HB THR 97 HB THR 97 -5.178 3.447 -20.919 740 HG1 THR 97 1HG THR 97 -6.469 3.710 -18.709 741 HG21 THR 97 3HG2 THR 97 -4.351 1.358 -19.874 742 HG22 THR 97 1HG2 THR 97 -6.053 1.633 -19.506 743 HG23 THR 97 2HG2 THR 97 -4.824 1.973 -18.288 744 H GLY 98 H GLY 98 -3.455 6.026 -18.245 745 HA2 GLY 98 2HA GLY 98 -2.265 7.974 -19.730 746 HA3 GLY 98 1HA GLY 98 -3.923 7.980 -20.333 747 H ASP 99 H ASP 99 -5.492 8.946 -19.151 748 HA ASP 99 HA ASP 99 -4.741 10.634 -16.931 749 HB2 ASP 99 2HB ASP 99 -7.444 10.028 -18.163 750 HB3 ASP 99 1HB ASP 99 -7.126 11.311 -16.996 751 H THR 100 H THR 100 -5.577 7.382 -17.118 752 HA THR 100 HA THR 100 -6.793 7.269 -14.417 753 HB THR 100 HB THR 100 -7.494 5.035 -15.081 754 HG1 THR 100 1HG THR 100 -6.845 4.132 -16.932 755 HG21 THR 100 3HG2 THR 100 -8.920 6.955 -15.769 756 HG22 THR 100 1HG2 THR 100 -9.038 5.603 -16.895 757 HG23 THR 100 2HG2 THR 100 -8.059 7.010 -17.307 758 H THR 101 H THR 101 -6.062 5.435 -13.120 759 HA THR 101 HA THR 101 -3.308 4.463 -13.616 760 HB THR 101 HB THR 101 -4.141 5.842 -11.034 761 HG1 THR 101 1HG THR 101 -2.895 7.496 -11.722 762 HG21 THR 101 3HG2 THR 101 -1.503 4.636 -11.953 763 HG22 THR 101 1HG2 THR 101 -2.507 4.061 -10.620 764 HG23 THR 101 2HG2 THR 101 -1.700 5.622 -10.508 765 H ASN 102 H ASN 102 -3.011 2.404 -12.964 766 HA ASN 102 HA ASN 102 -5.056 1.111 -11.200 767 HB2 ASN 102 2HB ASN 102 -5.324 0.438 -13.590 768 HB3 ASN 102 1HB ASN 102 -3.660 -0.134 -13.603 769 HD21 ASN 102 1HD2 ASN 102 -4.482 -2.358 -14.007 770 HD22 ASN 102 2HD2 ASN 102 -5.158 -3.260 -12.738 771 H ILE 103 H ILE 103 -4.179 0.299 -9.418 772 HA ILE 103 HA ILE 103 -1.240 -0.203 -9.266 773 HB ILE 103 HB ILE 103 -3.262 0.177 -7.020 774 HG12 ILE 103 2HG1 ILE 103 -1.144 2.134 -8.032 775 HG13 ILE 103 1HG1 ILE 103 -2.850 2.245 -8.456 776 HG21 ILE 103 1HG2 ILE 103 -0.218 0.010 -7.028 777 HG22 ILE 103 2HG2 ILE 103 -1.323 -1.173 -6.328 778 HG23 ILE 103 3HG2 ILE 103 -1.188 0.427 -5.618 779 HD11 ILE 103 3HD1 ILE 103 -2.399 3.735 -6.590 780 HD12 ILE 103 1HD1 ILE 103 -1.698 2.413 -5.657 781 HD13 ILE 103 2HD1 ILE 103 -3.423 2.410 -6.037 782 H VAL 104 H VAL 104 -0.585 -2.260 -9.164 783 HA VAL 104 HA VAL 104 -2.461 -4.413 -8.286 784 HB VAL 104 HB VAL 104 -1.413 -5.889 -9.928 785 HG11 VAL 104 1HG1 VAL 104 -2.325 -3.265 -11.153 786 HG12 VAL 104 2HG1 VAL 104 -3.380 -4.569 -10.612 787 HG13 VAL 104 3HG1 VAL 104 -2.295 -4.824 -11.977 788 HG21 VAL 104 3HG2 VAL 104 0.846 -4.984 -10.079 789 HG22 VAL 104 1HG2 VAL 104 0.238 -3.437 -10.671 790 HG23 VAL 104 2HG2 VAL 104 0.129 -4.879 -11.680 791 H GLU 105 H GLU 105 -1.702 -5.747 -6.730 792 HA GLU 105 HA GLU 105 1.200 -5.794 -6.076 793 HB2 GLU 105 2HB GLU 105 -1.072 -5.419 -4.087 794 HB3 GLU 105 1HB GLU 105 0.633 -5.640 -3.678 795 HG2 GLU 105 2HG GLU 105 1.180 -3.574 -4.957 796 HG3 GLU 105 1HG GLU 105 -0.531 -3.344 -5.284 797 H SER 106 H SER 106 1.931 -7.808 -5.747 798 HA SER 106 HA SER 106 0.056 -9.990 -4.980 799 HB2 SER 106 2HB SER 106 1.070 -11.460 -6.658 800 HB3 SER 106 1HB SER 106 0.357 -10.051 -7.438 801 HG SER 106 HG SER 106 3.033 -10.759 -7.077 802 H PHE 107 H PHE 107 0.823 -11.136 -3.343 803 HA PHE 107 HA PHE 107 3.665 -11.693 -3.007 804 HB2 PHE 107 2HB PHE 107 3.708 -10.710 -0.685 805 HB3 PHE 107 1HB PHE 107 3.607 -9.500 -1.965 806 HD1 PHE 107 1HD PHE 107 1.526 -8.239 -2.375 807 HD2 PHE 107 2HD PHE 107 1.730 -11.202 0.740 808 HE1 PHE 107 1HE PHE 107 -0.600 -7.398 -1.431 809 HE2 PHE 107 2HE PHE 107 -0.397 -10.352 1.680 810 HZ PHE 107 HZ PHE 107 -1.563 -8.454 0.589 811 H ASP 108 H ASP 108 4.004 -13.012 -1.019 812 HA ASP 108 HA ASP 108 1.742 -14.896 -0.607 813 HB2 ASP 108 2HB ASP 108 4.726 -15.335 -0.472 814 HB3 ASP 108 1HB ASP 108 3.504 -16.564 -0.152 815 HA PRO 109 HA PRO 109 2.507 -13.115 3.595 816 HB2 PRO 109 2HB PRO 109 0.047 -13.431 4.710 817 HB3 PRO 109 1HB PRO 109 0.345 -12.174 3.487 818 HG2 PRO 109 2HG PRO 109 -0.872 -14.906 3.112 819 HG3 PRO 109 1HG PRO 109 -1.447 -13.339 2.500 820 HD2 PRO 109 2HD PRO 109 0.030 -15.080 0.954 821 HD3 PRO 109 1HD PRO 109 0.110 -13.315 0.722 822 H GLU 110 H GLU 110 1.609 -14.196 5.892 823 HA GLU 110 HA GLU 110 3.160 -16.485 6.263 824 HB2 GLU 110 2HB GLU 110 0.817 -15.461 7.876 825 HB3 GLU 110 1HB GLU 110 1.956 -16.672 8.453 826 HG2 GLU 110 2HG GLU 110 2.725 -13.854 7.589 827 HG3 GLU 110 1HG GLU 110 2.471 -14.342 9.260 828 H GLU 111 H GLU 111 2.791 -18.629 6.180 829 HA GLU 111 HA GLU 111 0.429 -19.597 4.741 830 HB2 GLU 111 2HB GLU 111 2.729 -20.414 4.209 831 HB3 GLU 111 1HB GLU 111 2.807 -21.165 5.800 832 HG2 GLU 111 2HG GLU 111 0.867 -22.586 5.245 833 HG3 GLU 111 1HG GLU 111 0.719 -21.794 3.680 834 H THR 112 H THR 112 1.827 -19.863 7.975 835 HA THR 112 HA THR 112 0.104 -21.874 8.979 836 HB THR 112 HB THR 112 2.146 -21.311 10.163 837 HG1 THR 112 1HG THR 112 -0.175 -21.573 11.248 838 HG21 THR 112 3HG2 THR 112 0.897 -18.592 10.699 839 HG22 THR 112 1HG2 THR 112 2.205 -18.885 9.553 840 HG23 THR 112 2HG2 THR 112 2.462 -19.151 11.274 841 H ASN 113 H ASN 113 -0.238 -18.384 8.699 842 HA ASN 113 HA ASN 113 -2.571 -18.172 10.354 843 HB2 ASN 113 2HB ASN 113 -1.395 -16.337 8.246 844 HB3 ASN 113 1HB ASN 113 -2.721 -15.880 9.296 845 HD21 ASN 113 1HD2 ASN 113 -0.228 -14.464 9.359 846 HD22 ASN 113 2HD2 ASN 113 0.512 -14.758 10.857 847 HA PRO 114 HA PRO 114 -5.623 -19.542 7.364 848 HB2 PRO 114 2HB PRO 114 -7.833 -17.980 7.986 849 HB3 PRO 114 1HB PRO 114 -7.270 -19.305 9.035 850 HG2 PRO 114 2HG PRO 114 -6.629 -16.361 9.237 851 HG3 PRO 114 1HG PRO 114 -7.220 -17.460 10.513 852 HD2 PRO 114 2HD PRO 114 -4.607 -16.901 10.362 853 HD3 PRO 114 1HD PRO 114 -5.121 -18.575 10.687 854 H ARG 115 H ARG 115 -4.853 -18.964 5.364 855 HA ARG 115 HA ARG 115 -4.483 -16.357 4.380 856 HB2 ARG 115 2HB ARG 115 -5.014 -18.940 2.877 857 HB3 ARG 115 1HB ARG 115 -4.391 -17.457 2.148 858 HG2 ARG 115 2HG ARG 115 -2.422 -17.546 3.640 859 HG3 ARG 115 1HG ARG 115 -3.037 -19.034 4.364 860 HD2 ARG 115 2HD ARG 115 -2.370 -18.693 1.425 861 HD3 ARG 115 1HD ARG 115 -1.318 -19.471 2.599 862 HE ARG 115 HE ARG 115 -3.633 -20.622 1.338 863 HH11 ARG 115 1HH2 ARG 115 -1.732 -20.588 4.243 864 HH12 ARG 115 2HH2 ARG 115 -2.209 -22.179 4.733 865 HH21 ARG 115 1HH1 ARG 115 -4.252 -22.703 1.978 866 HH22 ARG 115 2HH1 ARG 115 -3.636 -23.377 3.451 867 H GLU 116 H GLU 116 -7.335 -18.332 4.619 868 HA GLU 116 HA GLU 116 -8.940 -17.204 2.607 869 HB2 GLU 116 2HB GLU 116 -9.760 -18.254 5.339 870 HB3 GLU 116 1HB GLU 116 -10.840 -18.036 3.960 871 HG2 GLU 116 2HG GLU 116 -8.408 -19.870 3.961 872 HG3 GLU 116 1HG GLU 116 -10.058 -20.411 4.243 873 H LEU 117 H LEU 117 -8.686 -16.332 6.055 874 HA LEU 117 HA LEU 117 -10.436 -14.087 5.911 875 HB2 LEU 117 2HB LEU 117 -8.212 -14.653 7.894 876 HB3 LEU 117 1HB LEU 117 -9.506 -13.479 8.111 877 HG LEU 117 HG LEU 117 -9.864 -16.488 7.845 878 HD11 LEU 117 1HD1 LEU 117 -10.487 -16.416 10.215 879 HD12 LEU 117 2HD1 LEU 117 -10.238 -14.672 10.250 880 HD13 LEU 117 3HD1 LEU 117 -8.869 -15.750 10.006 881 HD21 LEU 117 3HD2 LEU 117 -12.274 -15.830 8.690 882 HD22 LEU 117 1HD2 LEU 117 -11.891 -15.616 6.989 883 HD23 LEU 117 2HD2 LEU 117 -11.882 -14.225 8.075 884 H GLN 118 H GLN 118 -6.934 -14.431 5.510 885 HA GLN 118 HA GLN 118 -6.217 -11.718 5.514 886 HB2 GLN 118 2HB GLN 118 -5.057 -14.014 3.908 887 HB3 GLN 118 1HB GLN 118 -4.267 -12.449 4.108 888 HG2 GLN 118 2HG GLN 118 -5.061 -14.232 6.439 889 HG3 GLN 118 1HG GLN 118 -3.463 -14.255 5.708 890 HE21 GLN 118 1HE2 GLN 118 -2.038 -12.452 6.127 891 HE22 GLN 118 2HE2 GLN 118 -2.411 -11.260 7.277 892 H GLN 119 H GLN 119 -7.477 -13.757 2.887 893 HA GLN 119 HA GLN 119 -7.097 -12.111 0.700 894 HB2 GLN 119 2HB GLN 119 -8.079 -14.425 0.681 895 HB3 GLN 119 1HB GLN 119 -9.582 -13.757 1.305 896 HG2 GLN 119 2HG GLN 119 -9.806 -13.993 -1.105 897 HG3 GLN 119 1HG GLN 119 -9.703 -12.277 -0.750 898 HE21 GLN 119 1HE2 GLN 119 -8.166 -11.145 -1.960 899 HE22 GLN 119 2HE2 GLN 119 -6.864 -11.861 -2.778 900 H SER 120 H SER 120 -9.818 -12.090 2.991 901 HA SER 120 HA SER 120 -11.108 -9.798 1.831 902 HB2 SER 120 2HB SER 120 -12.346 -11.462 3.163 903 HB3 SER 120 1HB SER 120 -11.416 -11.018 4.590 904 HG SER 120 HG SER 120 -13.300 -9.511 3.126 905 H GLY 121 H GLY 121 -8.739 -10.324 4.412 906 HA2 GLY 121 2HA GLY 121 -8.857 -7.781 5.617 907 HA3 GLY 121 1HA GLY 121 -7.468 -8.858 5.641 908 H TRP 122 H TRP 122 -6.597 -8.976 3.094 909 HA TRP 122 HA TRP 122 -5.293 -6.487 2.718 910 HB2 TRP 122 2HB TRP 122 -5.613 -8.801 0.773 911 HB3 TRP 122 1HB TRP 122 -4.479 -7.465 0.583 912 HD1 TRP 122 HD TRP 122 -4.618 -10.863 1.978 913 HE1 TRP 122 1HE TRP 122 -2.654 -11.297 3.581 914 HE3 TRP 122 3HE TRP 122 -2.905 -6.077 2.619 915 HZ2 TRP 122 2HZ TRP 122 -0.630 -9.827 4.953 916 HZ3 TRP 122 3HZ TRP 122 -0.958 -5.637 4.080 917 HH2 TRP 122 HH TRP 122 0.183 -7.502 5.245 918 H GLN 123 H GLN 123 -8.190 -7.882 1.313 919 HA GLN 123 HA GLN 123 -8.538 -5.826 -0.692 920 HB2 GLN 123 2HB GLN 123 -9.454 -8.168 -0.864 921 HB3 GLN 123 1HB GLN 123 -10.611 -7.762 0.401 922 HG2 GLN 123 2HG GLN 123 -11.512 -5.943 -1.007 923 HG3 GLN 123 1HG GLN 123 -10.349 -6.334 -2.266 924 HE21 GLN 123 1HE2 GLN 123 -11.636 -7.232 -3.910 925 HE22 GLN 123 2HE2 GLN 123 -12.709 -8.526 -3.677 926 H ALA 124 H ALA 124 -9.620 -6.360 2.628 927 HA ALA 124 HA ALA 124 -11.644 -4.412 2.778 928 HB1 ALA 124 1HB ALA 124 -9.765 -5.396 4.943 929 HB2 ALA 124 2HB ALA 124 -11.325 -6.104 4.521 930 HB3 ALA 124 3HB ALA 124 -11.253 -4.495 5.231 931 H ILE 125 H ILE 125 -8.170 -4.114 3.616 932 HA ILE 125 HA ILE 125 -8.273 -1.406 4.396 933 HB ILE 125 HB ILE 125 -6.398 -2.784 5.028 934 HG12 ILE 125 2HG1 ILE 125 -5.315 -0.780 2.996 935 HG13 ILE 125 1HG1 ILE 125 -5.945 -0.324 4.572 936 HG21 ILE 125 1HG2 ILE 125 -5.764 -3.072 2.075 937 HG22 ILE 125 2HG2 ILE 125 -6.414 -4.328 3.123 938 HG23 ILE 125 3HG2 ILE 125 -4.802 -3.710 3.401 939 HD11 ILE 125 3HD1 ILE 125 -4.257 -1.788 5.658 940 HD12 ILE 125 1HD1 ILE 125 -3.502 -0.530 4.679 941 HD13 ILE 125 2HD1 ILE 125 -3.601 -2.182 4.070 942 H LEU 126 H LEU 126 -7.682 -2.920 1.253 943 HA LEU 126 HA LEU 126 -7.119 -0.525 -0.160 944 HB2 LEU 126 2HB LEU 126 -7.980 -3.309 -0.928 945 HB3 LEU 126 1HB LEU 126 -7.979 -2.079 -2.170 946 HG LEU 126 HG LEU 126 -5.503 -2.583 -0.457 947 HD11 LEU 126 1HD1 LEU 126 -4.645 -4.020 -2.297 948 HD12 LEU 126 2HD1 LEU 126 -6.217 -3.923 -3.092 949 HD13 LEU 126 3HD1 LEU 126 -6.070 -4.726 -1.528 950 HD21 LEU 126 3HD2 LEU 126 -4.325 -1.619 -2.443 951 HD22 LEU 126 1HD2 LEU 126 -5.504 -0.482 -1.806 952 HD23 LEU 126 2HD2 LEU 126 -5.876 -1.409 -3.249 953 H ASN 127 H ASN 127 -10.149 -2.235 0.515 954 HA ASN 127 HA ASN 127 -11.829 -0.619 -1.112 955 HB2 ASN 127 2HB ASN 127 -12.420 -2.234 1.393 956 HB3 ASN 127 1HB ASN 127 -13.667 -1.471 0.407 957 HD21 ASN 127 1HD2 ASN 127 -13.489 -4.341 0.766 958 HD22 ASN 127 2HD2 ASN 127 -13.145 -5.020 -0.749 959 H SER 128 H SER 128 -10.723 -0.316 2.239 960 HA SER 128 HA SER 128 -12.350 1.820 3.045 961 HB2 SER 128 2HB SER 128 -9.496 1.230 3.878 962 HB3 SER 128 1HB SER 128 -10.640 2.244 4.756 963 HG SER 128 HG SER 128 -10.386 -0.452 4.716 964 H PHE 129 H PHE 129 -9.229 1.814 1.357 965 HA PHE 129 HA PHE 129 -8.738 4.581 1.392 966 HB2 PHE 129 2HB PHE 129 -7.076 2.883 0.686 967 HB3 PHE 129 1HB PHE 129 -8.013 2.575 -0.771 968 HD1 PHE 129 1HD PHE 129 -6.054 5.173 1.064 969 HD2 PHE 129 2HD PHE 129 -7.871 4.095 -2.688 970 HE1 PHE 129 1HE PHE 129 -4.930 7.086 -0.036 971 HE2 PHE 129 2HE PHE 129 -6.739 6.009 -3.779 972 HZ PHE 129 HZ PHE 129 -5.270 7.505 -2.454 973 H LYS 130 H LYS 130 -10.448 2.587 -1.025 974 HA LYS 130 HA LYS 130 -11.113 4.707 -2.793 975 HB2 LYS 130 2HB LYS 130 -12.490 2.045 -2.295 976 HB3 LYS 130 1HB LYS 130 -12.823 3.114 -3.658 977 HG2 LYS 130 2HG LYS 130 -10.522 2.889 -4.461 978 HG3 LYS 130 1HG LYS 130 -10.085 1.951 -3.039 979 HD2 LYS 130 2HD LYS 130 -10.438 0.441 -4.912 980 HD3 LYS 130 1HD LYS 130 -11.690 0.178 -3.704 981 HE2 LYS 130 2HE LYS 130 -12.448 0.275 -6.184 982 HE3 LYS 130 1HE LYS 130 -13.356 1.268 -5.055 983 HZ1 LYS 130 3HZ LYS 130 -12.191 3.188 -5.740 984 HZ2 LYS 130 1HZ LYS 130 -12.648 2.382 -7.160 985 HZ3 LYS 130 2HZ LYS 130 -11.043 2.283 -6.608 986 H SER 131 H SER 131 -12.838 3.222 -0.069 987 HA SER 131 HA SER 131 -15.255 4.633 -0.302 988 HB2 SER 131 2HB SER 131 -14.971 2.664 1.146 989 HB3 SER 131 1HB SER 131 -13.904 3.587 2.201 990 HG SER 131 HG SER 131 -16.367 4.723 1.608 991 H TYR 132 H TYR 132 -12.231 5.450 1.339 992 HA TYR 132 HA TYR 132 -13.121 7.734 2.722 993 HB2 TYR 132 2HB TYR 132 -10.945 6.636 3.135 994 HB3 TYR 132 1HB TYR 132 -10.380 7.162 1.551 995 HD1 TYR 132 1HD TYR 132 -9.896 9.554 1.098 996 HD2 TYR 132 2HD TYR 132 -11.236 8.267 4.979 997 HE1 TYR 132 1HE TYR 132 -9.257 11.749 2.050 998 HE2 TYR 132 2HE TYR 132 -10.591 10.463 5.925 999 HH TYR 132 HH TYR 132 -10.289 12.809 5.066 1000 H THR 133 H THR 133 -11.647 7.437 -0.525 1001 HA THR 133 HA THR 133 -11.698 10.186 -1.167 1002 HB THR 133 HB THR 133 -11.446 9.395 -3.502 1003 HG1 THR 133 1HG THR 133 -12.611 7.628 -3.743 1004 HG21 THR 133 3HG2 THR 133 -9.831 7.810 -1.488 1005 HG22 THR 133 1HG2 THR 133 -9.474 9.449 -2.032 1006 HG23 THR 133 2HG2 THR 133 -9.374 8.101 -3.165 1007 H GLU 134 H GLU 134 -14.025 7.568 -1.831 1008 HA GLU 134 HA GLU 134 -15.873 9.181 -3.273 1009 HB2 GLU 134 2HB GLU 134 -15.643 6.573 -3.130 1010 HB3 GLU 134 1HB GLU 134 -16.665 6.694 -1.706 1011 HG2 GLU 134 2HG GLU 134 -17.370 7.683 -4.497 1012 HG3 GLU 134 1HG GLU 134 -18.002 6.234 -3.729 1013 H ASN 135 H ASN 135 -15.533 8.358 0.157 1014 HA ASN 135 HA ASN 135 -17.994 9.421 1.064 1015 HB2 ASN 135 2HB ASN 135 -16.577 7.938 2.428 1016 HB3 ASN 135 1HB ASN 135 -15.349 9.195 2.527 1017 HD21 ASN 135 1HD2 ASN 135 -18.603 8.282 3.633 1018 HD22 ASN 135 2HD2 ASN 135 -18.696 9.452 4.860 1019 H ASN 136 H ASN 136 -14.791 10.893 0.610 1020 HA ASN 136 HA ASN 136 -15.751 13.537 1.492 1021 HB2 ASN 136 2HB ASN 136 -13.036 12.584 0.519 1022 HB3 ASN 136 1HB ASN 136 -13.387 14.190 1.154 1023 HD21 ASN 136 1HD2 ASN 136 -11.698 11.784 2.215 1024 HD22 ASN 136 2HD2 ASN 136 -12.223 11.628 3.822 1025 H LEU 137 H LEU 137 -15.803 11.712 -1.308 1026 HA LEU 137 HA LEU 137 -16.055 12.173 -3.552 1027 HB2 LEU 137 2HB LEU 137 -17.060 14.808 -2.441 1028 HB3 LEU 137 1HB LEU 137 -17.364 14.219 -4.071 1029 HG LEU 137 HG LEU 137 -18.231 12.674 -1.580 1030 HD11 LEU 137 1HD1 LEU 137 -19.866 14.625 -3.242 1031 HD12 LEU 137 2HD1 LEU 137 -19.338 14.881 -1.580 1032 HD13 LEU 137 3HD1 LEU 137 -20.499 13.607 -1.948 1033 HD21 LEU 137 3HD2 LEU 137 -18.204 11.258 -3.573 1034 HD22 LEU 137 1HD2 LEU 137 -19.017 12.495 -4.526 1035 HD23 LEU 137 2HD2 LEU 137 -19.878 11.652 -3.240 1036 H GLU 138 H GLU 138 -15.643 14.119 -5.260 1037 HA GLU 138 HA GLU 138 -12.802 14.520 -5.220 1038 HB2 GLU 138 2HB GLU 138 -14.178 14.206 -7.301 1039 HB3 GLU 138 1HB GLU 138 -14.859 15.809 -7.052 1040 HG2 GLU 138 2HG GLU 138 -12.591 16.799 -7.208 1041 HG3 GLU 138 1HG GLU 138 -11.905 15.193 -7.420 1042 H HIS 139 H HIS 139 -12.823 15.631 -3.070 1043 HA HIS 139 HA HIS 139 -12.438 18.449 -3.399 1044 HB2 HIS 139 2HB HIS 139 -14.923 18.426 -3.236 1045 HB3 HIS 139 1HB HIS 139 -14.803 17.598 -1.684 1046 HD2 HIS 139 2HD HIS 139 -14.621 19.351 0.458 1047 HE1 HIS 139 1HE HIS 139 -13.373 22.773 -1.677 1048 HE2 HIS 139 2HE HIS 139 -14.030 21.890 0.612 1049 H HIS 140 H HIS 140 -11.306 19.342 -1.658 1050 HA HIS 140 HA HIS 140 -9.824 17.517 -0.047 1051 HB2 HIS 140 2HB HIS 140 -8.958 19.729 -0.784 1052 HB3 HIS 140 1HB HIS 140 -10.136 20.528 0.251 1053 HD2 HIS 140 2HD HIS 140 -9.137 21.014 2.781 1054 HE1 HIS 140 1HE HIS 140 -6.100 18.082 2.807 1055 HE2 HIS 140 2HE HIS 140 -7.160 19.972 4.131 1056 H HIS 141 H HIS 141 -10.327 16.659 1.902 1057 HA HIS 141 HA HIS 141 -12.868 17.181 3.147 1058 HB2 HIS 141 2HB HIS 141 -11.752 14.952 3.175 1059 HB3 HIS 141 1HB HIS 141 -10.484 15.611 4.203 1060 HD2 HIS 141 2HD HIS 141 -14.435 15.125 4.468 1061 HE1 HIS 141 1HE HIS 141 -12.774 15.132 8.350 1062 HE2 HIS 141 2HE HIS 141 -14.919 14.848 7.020 1063 H HIS 142 H HIS 142 -13.083 19.202 4.005 1064 HA HIS 142 HA HIS 142 -11.026 20.669 5.319 1065 HB2 HIS 142 2HB HIS 142 -12.888 22.144 6.048 1066 HB3 HIS 142 1HB HIS 142 -12.977 21.774 4.326 1067 HD2 HIS 142 2HD HIS 142 -15.161 21.419 7.473 1068 HE1 HIS 142 1HE HIS 142 -16.965 19.032 4.493 1069 HE2 HIS 142 2HE HIS 142 -17.273 20.035 6.806 1070 H HIS 143 H HIS 143 -10.631 20.987 7.511 1071 HA HIS 143 HA HIS 143 -10.336 20.316 9.686 1072 HB2 HIS 143 2HB HIS 143 -12.602 21.317 9.831 1073 HB3 HIS 143 1HB HIS 143 -13.311 19.743 9.479 1074 HD2 HIS 143 2HD HIS 143 -11.863 21.690 12.509 1075 HE1 HIS 143 1HE HIS 143 -12.594 17.742 13.816 1076 HE2 HIS 143 2HE HIS 143 -11.982 20.088 14.570 1077 H HIS 144 H HIS 144 -8.995 18.517 9.287 1078 HA HIS 144 HA HIS 144 -9.892 15.926 8.592 1079 HB2 HIS 144 2HB HIS 144 -7.434 16.734 10.181 1080 HB3 HIS 144 1HB HIS 144 -7.687 15.173 9.395 1081 HD2 HIS 144 2HD HIS 144 -6.011 18.424 8.540 1082 HE1 HIS 144 1HE HIS 144 -7.211 16.830 4.819 1083 HE2 HIS 144 2HE HIS 144 -5.767 18.590 5.946 Start of MODEL 6 1 H1 GLY 1 1HT GLY 1 -3.092 -21.995 -4.360 2 H2 GLY 1 2HT GLY 1 -3.409 -21.055 -2.980 3 H3 GLY 1 3HT GLY 1 -1.842 -21.645 -3.269 4 HA2 GLY 1 2HA GLY 1 -1.585 -20.253 -5.184 5 HA3 GLY 1 1HA GLY 1 -3.256 -19.712 -5.023 6 H ASN 2 H ASN 2 -0.190 -19.872 -3.232 7 HA ASN 2 HA ASN 2 -0.892 -17.914 -1.268 8 HB2 ASN 2 2HB ASN 2 1.851 -18.828 -2.187 9 HB3 ASN 2 1HB ASN 2 1.487 -17.965 -0.692 10 HD21 ASN 2 1HD2 ASN 2 2.473 -20.871 -1.337 11 HD22 ASN 2 2HD2 ASN 2 1.452 -21.835 -0.384 12 H LYS 3 H LYS 3 0.015 -17.718 -4.542 13 HA LYS 3 HA LYS 3 1.316 -15.150 -4.511 14 HB2 LYS 3 2HB LYS 3 -0.021 -16.684 -6.767 15 HB3 LYS 3 1HB LYS 3 0.979 -15.244 -6.973 16 HG2 LYS 3 2HG LYS 3 2.893 -16.415 -5.944 17 HG3 LYS 3 1HG LYS 3 1.900 -17.859 -5.734 18 HD2 LYS 3 2HD LYS 3 1.580 -17.989 -8.191 19 HD3 LYS 3 1HD LYS 3 2.599 -16.562 -8.389 20 HE2 LYS 3 2HE LYS 3 3.468 -19.196 -7.157 21 HE3 LYS 3 1HE LYS 3 3.906 -18.616 -8.763 22 HZ1 LYS 3 3HZ LYS 3 5.693 -17.910 -7.565 23 HZ2 LYS 3 1HZ LYS 3 4.806 -17.678 -6.138 24 HZ3 LYS 3 2HZ LYS 3 4.696 -16.544 -7.399 25 H ILE 4 H ILE 4 -0.743 -14.600 -2.941 26 HA ILE 4 HA ILE 4 -3.214 -13.915 -4.021 27 HB ILE 4 HB ILE 4 -1.741 -12.298 -1.906 28 HG12 ILE 4 2HG1 ILE 4 -1.676 -14.662 -1.323 29 HG13 ILE 4 1HG1 ILE 4 -2.789 -13.820 -0.270 30 HG21 ILE 4 1HG2 ILE 4 -4.045 -11.861 -1.055 31 HG22 ILE 4 2HG2 ILE 4 -4.699 -12.720 -2.449 32 HG23 ILE 4 3HG2 ILE 4 -3.803 -11.219 -2.679 33 HD11 ILE 4 3HD1 ILE 4 -3.904 -15.801 -0.821 34 HD12 ILE 4 1HD1 ILE 4 -3.374 -15.765 -2.493 35 HD13 ILE 4 2HD1 ILE 4 -4.629 -14.655 -1.940 36 H THR 5 H THR 5 -4.017 -12.233 -5.097 37 HA THR 5 HA THR 5 -2.258 -9.979 -5.897 38 HB THR 5 HB THR 5 -2.107 -11.504 -7.766 39 HG1 THR 5 1HG THR 5 -3.243 -9.143 -7.897 40 HG21 THR 5 3HG2 THR 5 -4.057 -12.939 -7.215 41 HG22 THR 5 1HG2 THR 5 -4.080 -12.422 -8.900 42 HG23 THR 5 2HG2 THR 5 -5.139 -11.646 -7.730 43 H VAL 6 H VAL 6 -3.258 -8.073 -5.872 44 HA VAL 6 HA VAL 6 -6.224 -7.900 -5.916 45 HB VAL 6 HB VAL 6 -6.139 -6.285 -4.016 46 HG11 VAL 6 1HG1 VAL 6 -5.921 -7.965 -2.238 47 HG12 VAL 6 2HG1 VAL 6 -5.068 -9.044 -3.343 48 HG13 VAL 6 3HG1 VAL 6 -6.763 -8.647 -3.632 49 HG21 VAL 6 3HG2 VAL 6 -3.270 -7.272 -3.766 50 HG22 VAL 6 1HG2 VAL 6 -4.102 -6.298 -2.559 51 HG23 VAL 6 2HG2 VAL 6 -3.771 -5.628 -4.153 52 H GLU 7 H GLU 7 -7.010 -5.778 -6.405 53 HA GLU 7 HA GLU 7 -5.085 -3.830 -7.479 54 HB2 GLU 7 2HB GLU 7 -6.278 -3.744 -9.668 55 HB3 GLU 7 1HB GLU 7 -5.484 -5.295 -9.395 56 HG2 GLU 7 2HG GLU 7 -7.643 -6.258 -8.634 57 HG3 GLU 7 1HG GLU 7 -8.438 -4.717 -8.942 58 H VAL 8 H VAL 8 -6.031 -1.773 -7.991 59 HA VAL 8 HA VAL 8 -8.781 -1.251 -7.095 60 HB VAL 8 HB VAL 8 -7.537 -1.097 -5.007 61 HG11 VAL 8 1HG1 VAL 8 -5.736 0.867 -6.440 62 HG12 VAL 8 2HG1 VAL 8 -5.297 -0.758 -5.909 63 HG13 VAL 8 3HG1 VAL 8 -5.669 0.489 -4.722 64 HG21 VAL 8 3HG2 VAL 8 -8.061 1.735 -5.994 65 HG22 VAL 8 1HG2 VAL 8 -8.135 1.158 -4.329 66 HG23 VAL 8 2HG2 VAL 8 -9.332 0.619 -5.504 67 H THR 9 H THR 9 -9.671 0.509 -8.098 68 HA THR 9 HA THR 9 -8.106 1.786 -10.245 69 HB THR 9 HB THR 9 -10.290 2.581 -11.008 70 HG1 THR 9 1HG THR 9 -11.111 2.784 -8.824 71 HG21 THR 9 3HG2 THR 9 -10.357 -0.338 -10.201 72 HG22 THR 9 1HG2 THR 9 -9.584 0.309 -11.650 73 HG23 THR 9 2HG2 THR 9 -11.336 0.401 -11.467 74 H VAL 10 H VAL 10 -7.261 3.764 -9.949 75 HA VAL 10 HA VAL 10 -8.463 5.628 -7.944 76 HB VAL 10 HB VAL 10 -5.497 5.263 -8.528 77 HG11 VAL 10 1HG1 VAL 10 -6.991 6.925 -6.461 78 HG12 VAL 10 2HG1 VAL 10 -6.067 7.552 -7.827 79 HG13 VAL 10 3HG1 VAL 10 -5.239 6.721 -6.514 80 HG21 VAL 10 3HG2 VAL 10 -7.178 4.363 -6.155 81 HG22 VAL 10 1HG2 VAL 10 -5.419 4.277 -6.238 82 HG23 VAL 10 2HG2 VAL 10 -6.399 3.308 -7.334 83 H TYR 11 H TYR 11 -9.080 7.502 -8.829 84 HA TYR 11 HA TYR 11 -8.218 8.202 -11.573 85 HB2 TYR 11 2HB TYR 11 -10.324 9.455 -9.776 86 HB3 TYR 11 1HB TYR 11 -10.035 9.848 -11.472 87 HD1 TYR 11 2HD TYR 11 -10.625 8.241 -13.272 88 HD2 TYR 11 1HD TYR 11 -11.386 7.310 -9.141 89 HE1 TYR 11 2HE TYR 11 -12.098 6.371 -13.958 90 HE2 TYR 11 1HE TYR 11 -12.854 5.443 -9.834 91 HH TYR 11 HH TYR 11 -13.128 4.466 -13.204 92 H ALA 12 H ALA 12 -6.095 8.868 -11.112 93 HA ALA 12 HA ALA 12 -5.795 11.638 -10.475 94 HB1 ALA 12 1HB ALA 12 -6.014 10.783 -8.171 95 HB2 ALA 12 2HB ALA 12 -4.384 11.386 -8.468 96 HB3 ALA 12 3HB ALA 12 -4.696 9.649 -8.466 97 H ALA 13 H ALA 13 -3.692 12.405 -10.963 98 HA ALA 13 HA ALA 13 -2.302 10.969 -12.972 99 HB1 ALA 13 1HB ALA 13 -2.266 13.424 -12.802 100 HB2 ALA 13 2HB ALA 13 -0.627 12.773 -12.782 101 HB3 ALA 13 3HB ALA 13 -1.381 13.314 -11.282 102 H ILE 14 H ILE 14 -0.663 9.510 -12.844 103 HA ILE 14 HA ILE 14 -0.021 8.155 -10.513 104 HB ILE 14 HB ILE 14 0.376 7.246 -12.747 105 HG12 ILE 14 2HG1 ILE 14 3.015 7.417 -11.215 106 HG13 ILE 14 1HG1 ILE 14 1.670 6.397 -10.713 107 HG21 ILE 14 1HG2 ILE 14 1.215 9.379 -13.777 108 HG22 ILE 14 2HG2 ILE 14 2.245 7.991 -14.130 109 HG23 ILE 14 3HG2 ILE 14 2.738 9.162 -12.910 110 HD11 ILE 14 3HD1 ILE 14 3.113 6.227 -13.369 111 HD12 ILE 14 1HD1 ILE 14 1.753 5.224 -12.865 112 HD13 ILE 14 2HD1 ILE 14 3.291 5.115 -12.013 113 H GLU 15 H GLU 15 1.488 11.026 -11.882 114 HA GLU 15 HA GLU 15 3.870 11.048 -10.416 115 HB2 GLU 15 2HB GLU 15 3.319 12.546 -12.337 116 HB3 GLU 15 1HB GLU 15 2.209 13.434 -11.298 117 HG2 GLU 15 2HG GLU 15 4.083 14.040 -9.799 118 HG3 GLU 15 1HG GLU 15 5.191 13.120 -10.812 119 H LYS 16 H LYS 16 0.624 12.222 -9.579 120 HA LYS 16 HA LYS 16 1.427 13.376 -7.054 121 HB2 LYS 16 2HB LYS 16 -0.590 14.122 -8.339 122 HB3 LYS 16 1HB LYS 16 -1.355 12.573 -7.991 123 HG2 LYS 16 2HG LYS 16 -1.217 13.026 -5.565 124 HG3 LYS 16 1HG LYS 16 -0.388 14.550 -5.889 125 HD2 LYS 16 2HD LYS 16 -2.380 15.363 -7.117 126 HD3 LYS 16 1HD LYS 16 -3.205 13.842 -6.778 127 HE2 LYS 16 2HE LYS 16 -3.027 14.278 -4.352 128 HE3 LYS 16 1HE LYS 16 -2.193 15.798 -4.683 129 HZ1 LYS 16 3HZ LYS 16 -4.946 15.112 -5.564 130 HZ2 LYS 16 1HZ LYS 16 -4.146 16.577 -5.863 131 HZ3 LYS 16 2HZ LYS 16 -4.548 16.140 -4.271 132 H VAL 17 H VAL 17 -0.221 10.372 -8.051 133 HA VAL 17 HA VAL 17 -0.611 9.319 -5.468 134 HB VAL 17 HB VAL 17 -0.237 7.816 -8.077 135 HG11 VAL 17 1HG1 VAL 17 -1.655 6.077 -6.924 136 HG12 VAL 17 2HG1 VAL 17 -1.509 7.007 -5.431 137 HG13 VAL 17 3HG1 VAL 17 -0.078 6.287 -6.166 138 HG21 VAL 17 3HG2 VAL 17 -2.735 8.894 -6.724 139 HG22 VAL 17 1HG2 VAL 17 -2.715 7.905 -8.184 140 HG23 VAL 17 2HG2 VAL 17 -2.013 9.521 -8.206 141 H TRP 18 H TRP 18 2.096 8.927 -7.756 142 HA TRP 18 HA TRP 18 3.539 6.994 -6.363 143 HB2 TRP 18 2HB TRP 18 4.028 7.872 -8.674 144 HB3 TRP 18 1HB TRP 18 4.707 9.322 -7.940 145 HD1 TRP 18 HD TRP 18 5.299 5.557 -8.268 146 HE1 TRP 18 1HE TRP 18 7.758 5.042 -7.717 147 HE3 TRP 18 3HE TRP 18 6.860 10.169 -6.682 148 HZ2 TRP 18 2HZ TRP 18 10.066 6.373 -6.749 149 HZ3 TRP 18 3HZ TRP 18 9.210 10.502 -5.951 150 HH2 TRP 18 HH TRP 18 10.815 8.597 -5.987 151 H LYS 19 H LYS 19 3.494 10.510 -5.962 152 HA LYS 19 HA LYS 19 5.572 10.660 -4.014 153 HB2 LYS 19 2HB LYS 19 4.810 12.584 -5.412 154 HB3 LYS 19 1HB LYS 19 3.284 12.588 -4.530 155 HG2 LYS 19 2HG LYS 19 4.445 13.090 -2.433 156 HG3 LYS 19 1HG LYS 19 6.008 12.927 -3.226 157 HD2 LYS 19 2HD LYS 19 5.505 15.301 -3.014 158 HD3 LYS 19 1HD LYS 19 5.408 14.862 -4.717 159 HE2 LYS 19 2HE LYS 19 3.009 14.961 -4.707 160 HE3 LYS 19 1HE LYS 19 2.931 14.910 -2.945 161 HZ1 LYS 19 3HZ LYS 19 2.606 17.120 -3.432 162 HZ2 LYS 19 1HZ LYS 19 3.728 17.134 -4.702 163 HZ3 LYS 19 2HZ LYS 19 4.269 17.075 -3.092 164 H TYR 20 H TYR 20 1.990 10.642 -3.742 165 HA TYR 20 HA TYR 20 1.931 10.775 -0.889 166 HB2 TYR 20 2HB TYR 20 -0.055 10.130 -3.071 167 HB3 TYR 20 1HB TYR 20 -0.504 9.732 -1.415 168 HD1 TYR 20 1HD TYR 20 1.052 12.587 -3.333 169 HD2 TYR 20 2HD TYR 20 -1.684 11.443 -0.213 170 HE1 TYR 20 1HE TYR 20 0.454 14.961 -2.977 171 HE2 TYR 20 2HE TYR 20 -2.268 13.816 0.138 172 HH TYR 20 HH TYR 20 -2.231 15.935 -1.162 173 H TRP 21 H TRP 21 1.802 8.088 -3.175 174 HA TRP 21 HA TRP 21 1.301 6.042 -1.303 175 HB2 TRP 21 2HB TRP 21 1.093 5.842 -3.815 176 HB3 TRP 21 1HB TRP 21 2.854 5.797 -3.927 177 HD1 TRP 21 HD TRP 21 3.925 3.441 -3.644 178 HE1 TRP 21 1HE TRP 21 3.100 1.150 -2.793 179 HE3 TRP 21 3HE TRP 21 -0.728 4.748 -2.051 180 HZ2 TRP 21 2HZ TRP 21 0.750 0.028 -1.588 181 HZ3 TRP 21 3HZ TRP 21 -2.250 3.063 -1.074 182 HH2 TRP 21 HH TRP 21 -1.519 0.703 -0.834 183 H ASN 22 H ASN 22 4.059 7.967 -1.863 184 HA ASN 22 HA ASN 22 5.910 6.077 -0.476 185 HB2 ASN 22 2HB ASN 22 6.512 8.482 -2.218 186 HB3 ASN 22 1HB ASN 22 7.707 7.433 -1.462 187 HD21 ASN 22 1HD2 ASN 22 5.925 4.993 -2.060 188 HD22 ASN 22 2HD2 ASN 22 6.178 4.704 -3.714 189 H GLU 23 H GLU 23 4.331 9.188 -0.280 190 HA GLU 23 HA GLU 23 6.105 10.405 1.571 191 HB2 GLU 23 2HB GLU 23 4.374 11.616 0.185 192 HB3 GLU 23 1HB GLU 23 3.133 10.982 1.256 193 HG2 GLU 23 2HG GLU 23 3.700 13.225 2.001 194 HG3 GLU 23 1HG GLU 23 4.348 12.102 3.189 195 HA PRO 24 HA PRO 24 4.647 7.729 4.969 196 HB2 PRO 24 2HB PRO 24 6.067 8.769 7.092 197 HB3 PRO 24 1HB PRO 24 6.816 7.748 5.850 198 HG2 PRO 24 2HG PRO 24 6.803 10.752 6.051 199 HG3 PRO 24 1HG PRO 24 8.164 9.668 5.700 200 HD2 PRO 24 2HD PRO 24 6.834 10.984 3.714 201 HD3 PRO 24 1HD PRO 24 7.507 9.360 3.450 202 H ALA 25 H ALA 25 4.615 11.250 5.177 203 HA ALA 25 HA ALA 25 2.892 11.533 7.391 204 HB1 ALA 25 1HB ALA 25 3.149 13.341 4.970 205 HB2 ALA 25 2HB ALA 25 4.163 13.405 6.411 206 HB3 ALA 25 3HB ALA 25 2.445 13.788 6.525 207 H HIS 26 H HIS 26 2.240 10.928 3.985 208 HA HIS 26 HA HIS 26 -0.638 11.270 4.242 209 HB2 HIS 26 2HB HIS 26 0.991 10.055 1.994 210 HB3 HIS 26 1HB HIS 26 -0.703 10.530 1.916 211 HD2 HIS 26 2HD HIS 26 0.467 13.411 3.802 212 HE1 HIS 26 1HE HIS 26 1.714 14.376 -0.112 213 HE2 HIS 26 2HE HIS 26 1.308 15.303 2.217 214 H ILE 27 H ILE 27 1.606 8.488 3.992 215 HA ILE 27 HA ILE 27 -0.388 6.479 3.895 216 HB ILE 27 HB ILE 27 2.472 6.418 4.927 217 HG12 ILE 27 2HG1 ILE 27 1.369 5.395 2.268 218 HG13 ILE 27 1HG1 ILE 27 2.031 7.015 2.460 219 HG21 ILE 27 1HG2 ILE 27 1.397 4.466 5.884 220 HG22 ILE 27 2HG2 ILE 27 2.266 3.881 4.476 221 HG23 ILE 27 3HG2 ILE 27 0.524 4.132 4.392 222 HD11 ILE 27 3HD1 ILE 27 4.178 6.058 3.212 223 HD12 ILE 27 1HD1 ILE 27 3.745 5.471 1.610 224 HD13 ILE 27 2HD1 ILE 27 3.525 4.432 3.014 225 H MET 28 H MET 28 1.416 7.821 6.664 226 HA MET 28 HA MET 28 0.207 6.190 8.643 227 HB2 MET 28 2HB MET 28 1.199 7.715 10.260 228 HB3 MET 28 1HB MET 28 2.332 7.408 8.951 229 HG2 MET 28 2HG MET 28 2.536 9.742 9.062 230 HG3 MET 28 1HG MET 28 1.193 9.639 7.937 231 HE1 MET 28 3HE MET 28 2.352 11.270 11.252 232 HE2 MET 28 1HE MET 28 2.167 9.543 11.597 233 HE3 MET 28 2HE MET 28 1.121 10.723 12.386 234 H LYS 29 H LYS 29 -1.120 8.740 6.838 235 HA LYS 29 HA LYS 29 -2.951 9.746 8.841 236 HB2 LYS 29 2HB LYS 29 -2.112 11.070 6.868 237 HB3 LYS 29 1HB LYS 29 -3.089 10.048 5.820 238 HG2 LYS 29 2HG LYS 29 -5.131 10.741 6.989 239 HG3 LYS 29 1HG LYS 29 -4.175 11.722 8.102 240 HD2 LYS 29 2HD LYS 29 -3.371 13.091 6.196 241 HD3 LYS 29 1HD LYS 29 -4.347 12.118 5.094 242 HE2 LYS 29 2HE LYS 29 -5.501 14.221 5.699 243 HE3 LYS 29 1HE LYS 29 -6.395 12.814 6.279 244 HZ1 LYS 29 3HZ LYS 29 -5.696 14.897 7.813 245 HZ2 LYS 29 1HZ LYS 29 -4.405 13.839 8.111 246 HZ3 LYS 29 2HZ LYS 29 -6.000 13.334 8.406 247 H TRP 30 H TRP 30 -2.958 7.198 6.457 248 HA TRP 30 HA TRP 30 -5.700 6.362 7.284 249 HB2 TRP 30 2HB TRP 30 -6.191 5.705 4.958 250 HB3 TRP 30 1HB TRP 30 -5.898 7.437 5.078 251 HD1 TRP 30 HD TRP 30 -3.692 8.390 3.974 252 HE1 TRP 30 1HE TRP 30 -1.987 7.400 2.298 253 HE3 TRP 30 3HE TRP 30 -5.075 3.482 4.106 254 HZ2 TRP 30 2HZ TRP 30 -1.307 4.862 1.169 255 HZ3 TRP 30 3HZ TRP 30 -3.903 1.803 2.746 256 HH2 TRP 30 HH TRP 30 -2.019 2.477 1.271 257 H CYS 31 H CYS 31 -2.535 5.516 7.425 258 HA CYS 31 HA CYS 31 -2.264 2.970 6.374 259 HB2 CYS 31 2HB CYS 31 -0.402 4.099 7.463 260 HB3 CYS 31 1HB CYS 31 -1.251 4.085 8.993 261 HG CYS 31 HG CYS 31 -0.803 1.278 7.876 262 H GLN 32 H GLN 32 -2.934 0.953 6.919 263 HA GLN 32 HA GLN 32 -4.091 -0.732 7.910 264 HB2 GLN 32 2HB GLN 32 -2.999 0.286 10.080 265 HB3 GLN 32 1HB GLN 32 -4.599 0.946 10.390 266 HG2 GLN 32 2HG GLN 32 -4.505 -1.166 11.554 267 HG3 GLN 32 1HG GLN 32 -5.517 -1.428 10.139 268 HE21 GLN 32 1HE2 GLN 32 -1.975 -1.569 10.907 269 HE22 GLN 32 2HE2 GLN 32 -1.720 -3.034 10.087 270 H ALA 33 H ALA 33 -5.421 2.493 8.292 271 HA ALA 33 HA ALA 33 -7.500 3.376 7.987 272 HB1 ALA 33 1HB ALA 33 -7.856 0.976 6.171 273 HB2 ALA 33 2HB ALA 33 -7.031 2.462 5.702 274 HB3 ALA 33 3HB ALA 33 -8.755 2.490 6.090 275 H SER 34 H SER 34 -7.209 1.713 10.278 276 HA SER 34 HA SER 34 -9.972 0.653 10.609 277 HB2 SER 34 2HB SER 34 -7.388 -0.572 11.605 278 HB3 SER 34 1HB SER 34 -9.007 -1.161 11.984 279 HG SER 34 HG SER 34 -8.341 -0.761 9.304 280 HA PRO 35 HA PRO 35 -9.617 3.370 14.227 281 HB2 PRO 35 2HB PRO 35 -11.886 2.760 15.597 282 HB3 PRO 35 1HB PRO 35 -11.968 3.530 13.993 283 HG2 PRO 35 2HG PRO 35 -12.181 0.591 14.655 284 HG3 PRO 35 1HG PRO 35 -13.299 1.590 13.697 285 HD2 PRO 35 2HD PRO 35 -11.392 0.073 12.478 286 HD3 PRO 35 1HD PRO 35 -11.832 1.672 11.833 287 H GLU 36 H GLU 36 -9.415 -0.043 14.383 288 HA GLU 36 HA GLU 36 -8.998 -0.197 17.281 289 HB2 GLU 36 2HB GLU 36 -10.151 -1.977 15.693 290 HB3 GLU 36 1HB GLU 36 -8.504 -2.475 15.328 291 HG2 GLU 36 2HG GLU 36 -9.270 -3.871 17.153 292 HG3 GLU 36 1HG GLU 36 -8.127 -2.728 17.845 293 H TRP 37 H TRP 37 -7.196 1.204 15.153 294 HA TRP 37 HA TRP 37 -4.653 0.430 16.404 295 HB2 TRP 37 2HB TRP 37 -5.202 0.211 13.423 296 HB3 TRP 37 1HB TRP 37 -3.568 0.328 14.076 297 HD1 TRP 37 HD TRP 37 -6.530 -2.067 13.848 298 HE1 TRP 37 1HE TRP 37 -5.764 -4.402 14.624 299 HE3 TRP 37 3HE TRP 37 -1.881 -0.918 15.607 300 HZ2 TRP 37 2HZ TRP 37 -3.471 -5.620 15.844 301 HZ3 TRP 37 3HZ TRP 37 -0.428 -2.678 16.570 302 HH2 TRP 37 HH TRP 37 -1.217 -5.025 16.689 303 H HIS 38 H HIS 38 -3.011 1.975 16.129 304 HA HIS 38 HA HIS 38 -3.736 4.579 14.925 305 HB2 HIS 38 2HB HIS 38 -4.402 4.596 17.369 306 HB3 HIS 38 1HB HIS 38 -2.719 4.288 17.788 307 HD2 HIS 38 2HD HIS 38 -4.795 7.152 15.975 308 HE1 HIS 38 1HE HIS 38 -1.148 8.771 17.355 309 HE2 HIS 38 2HE HIS 38 -3.357 9.317 16.225 310 H VAL 39 H VAL 39 -1.803 6.004 14.802 311 HA VAL 39 HA VAL 39 0.774 4.492 14.688 312 HB VAL 39 HB VAL 39 -0.209 6.564 12.690 313 HG11 VAL 39 1HG1 VAL 39 1.738 5.654 11.359 314 HG12 VAL 39 2HG1 VAL 39 2.238 4.740 12.775 315 HG13 VAL 39 3HG1 VAL 39 2.228 6.504 12.824 316 HG21 VAL 39 3HG2 VAL 39 -0.099 3.523 12.514 317 HG22 VAL 39 1HG2 VAL 39 -0.430 4.604 11.163 318 HG23 VAL 39 2HG2 VAL 39 -1.557 4.519 12.507 319 HA PRO 40 HA PRO 40 1.259 8.247 17.445 320 HB2 PRO 40 2HB PRO 40 3.581 6.530 18.358 321 HB3 PRO 40 1HB PRO 40 2.409 7.436 19.345 322 HG2 PRO 40 2HG PRO 40 2.210 4.793 19.136 323 HG3 PRO 40 1HG PRO 40 0.747 5.803 19.081 324 HD2 PRO 40 2HD PRO 40 2.216 4.494 16.780 325 HD3 PRO 40 1HD PRO 40 0.464 4.608 17.072 326 H ALA 41 H ALA 41 3.289 6.554 15.251 327 HA ALA 41 HA ALA 41 4.515 8.936 14.251 328 HB1 ALA 41 1HB ALA 41 6.315 7.068 15.821 329 HB2 ALA 41 2HB ALA 41 5.877 8.706 16.297 330 HB3 ALA 41 3HB ALA 41 6.851 8.442 14.853 331 H ALA 42 H ALA 42 6.012 8.499 12.495 332 HA ALA 42 HA ALA 42 6.322 5.808 11.492 333 HB1 ALA 42 1HB ALA 42 4.543 7.732 9.973 334 HB2 ALA 42 2HB ALA 42 4.006 6.272 10.800 335 HB3 ALA 42 3HB ALA 42 5.075 6.145 9.408 336 H GLN 43 H GLN 43 7.881 5.650 9.895 337 HA GLN 43 HA GLN 43 9.083 8.133 8.810 338 HB2 GLN 43 2HB GLN 43 10.743 5.939 10.130 339 HB3 GLN 43 1HB GLN 43 11.320 7.452 9.432 340 HG2 GLN 43 2HG GLN 43 11.277 7.891 11.777 341 HG3 GLN 43 1HG GLN 43 9.792 8.643 11.195 342 HE21 GLN 43 1HE2 GLN 43 10.624 5.212 12.007 343 HE22 GLN 43 2HE2 GLN 43 9.339 5.013 13.100 344 H ASN 44 H ASN 44 10.282 7.800 6.908 345 HA ASN 44 HA ASN 44 10.568 5.172 5.727 346 HB2 ASN 44 2HB ASN 44 8.134 5.703 5.335 347 HB3 ASN 44 1HB ASN 44 8.634 7.110 4.402 348 HD21 ASN 44 1HD2 ASN 44 7.808 6.289 2.378 349 HD22 ASN 44 2HD2 ASN 44 8.513 4.960 1.590 350 H ASP 45 H ASP 45 12.241 5.201 4.348 351 HA ASP 45 HA ASP 45 13.210 7.799 3.222 352 HB2 ASP 45 2HB ASP 45 14.656 6.936 5.060 353 HB3 ASP 45 1HB ASP 45 14.862 5.429 4.174 354 H LEU 46 H LEU 46 11.998 7.371 1.331 355 HA LEU 46 HA LEU 46 12.178 4.940 -0.139 356 HB2 LEU 46 2HB LEU 46 10.383 6.757 -0.361 357 HB3 LEU 46 1HB LEU 46 11.561 7.695 -1.274 358 HG LEU 46 HG LEU 46 11.759 5.383 -2.693 359 HD11 LEU 46 1HD1 LEU 46 8.905 5.295 -1.673 360 HD12 LEU 46 2HD1 LEU 46 10.170 4.135 -1.267 361 HD13 LEU 46 3HD1 LEU 46 9.592 4.263 -2.930 362 HD21 LEU 46 3HD2 LEU 46 11.144 7.523 -3.699 363 HD22 LEU 46 1HD2 LEU 46 9.518 7.403 -3.038 364 HD23 LEU 46 2HD2 LEU 46 10.047 6.270 -4.279 365 H LYS 47 H LYS 47 14.312 4.313 -0.433 366 HA LYS 47 HA LYS 47 15.712 5.460 -2.652 367 HB2 LYS 47 2HB LYS 47 16.306 7.089 -0.833 368 HB3 LYS 47 1HB LYS 47 17.020 5.764 0.082 369 HG2 LYS 47 2HG LYS 47 18.635 5.346 -1.734 370 HG3 LYS 47 1HG LYS 47 17.889 6.618 -2.703 371 HD2 LYS 47 2HD LYS 47 18.484 8.281 -0.964 372 HD3 LYS 47 1HD LYS 47 19.238 7.005 -0.009 373 HE2 LYS 47 2HE LYS 47 20.932 8.236 -1.310 374 HE3 LYS 47 1HE LYS 47 20.826 6.561 -1.854 375 HZ1 LYS 47 3HZ LYS 47 19.435 8.854 -3.131 376 HZ2 LYS 47 1HZ LYS 47 19.431 7.247 -3.674 377 HZ3 LYS 47 2HZ LYS 47 20.870 8.148 -3.701 378 H ALA 48 H ALA 48 17.249 4.026 -3.462 379 HA ALA 48 HA ALA 48 17.059 1.312 -2.745 380 HB1 ALA 48 1HB ALA 48 17.821 2.054 -4.961 381 HB2 ALA 48 2HB ALA 48 19.013 0.989 -4.232 382 HB3 ALA 48 3HB ALA 48 19.278 2.734 -4.251 383 H GLY 49 H GLY 49 18.218 0.020 -1.387 384 HA2 GLY 49 2HA GLY 49 19.793 -0.654 0.170 385 HA3 GLY 49 1HA GLY 49 20.758 0.765 -0.228 386 H GLY 50 H GLY 50 17.736 1.909 0.341 387 HA2 GLY 50 2HA GLY 50 18.408 2.838 3.057 388 HA3 GLY 50 1HA GLY 50 17.094 3.411 2.030 389 H THR 51 H THR 51 16.449 2.940 4.593 390 HA THR 51 HA THR 51 14.716 0.527 4.455 391 HB THR 51 HB THR 51 16.603 -0.180 5.817 392 HG1 THR 51 1HG THR 51 15.174 -1.000 7.080 393 HG21 THR 51 3HG2 THR 51 17.287 1.051 7.826 394 HG22 THR 51 1HG2 THR 51 16.090 2.302 7.494 395 HG23 THR 51 2HG2 THR 51 17.460 2.083 6.407 396 H PHE 52 H PHE 52 13.125 0.578 6.326 397 HA PHE 52 HA PHE 52 12.263 3.333 7.046 398 HB2 PHE 52 2HB PHE 52 9.971 2.863 6.369 399 HB3 PHE 52 1HB PHE 52 11.035 2.641 4.982 400 HD1 PHE 52 1HD PHE 52 11.588 0.341 4.161 401 HD2 PHE 52 2HD PHE 52 8.830 0.944 7.407 402 HE1 PHE 52 1HE PHE 52 10.795 -1.995 3.930 403 HE2 PHE 52 2HE PHE 52 8.038 -1.395 7.172 404 HZ PHE 52 HZ PHE 52 9.023 -2.862 5.431 405 H THR 53 H THR 53 10.478 3.264 8.673 406 HA THR 53 HA THR 53 10.173 0.852 10.263 407 HB THR 53 HB THR 53 11.569 3.261 11.499 408 HG1 THR 53 1HG THR 53 12.619 0.683 11.022 409 HG21 THR 53 3HG2 THR 53 10.156 2.021 13.091 410 HG22 THR 53 1HG2 THR 53 11.861 1.720 13.427 411 HG23 THR 53 2HG2 THR 53 10.900 0.504 12.586 412 H THR 54 H THR 54 8.095 0.881 10.849 413 HA THR 54 HA THR 54 6.741 3.475 11.413 414 HB THR 54 HB THR 54 5.488 1.022 10.125 415 HG1 THR 54 1HG THR 54 5.812 1.989 8.244 416 HG21 THR 54 3HG2 THR 54 4.482 3.860 10.570 417 HG22 THR 54 1HG2 THR 54 3.872 2.404 11.357 418 HG23 THR 54 2HG2 THR 54 3.645 2.634 9.625 419 H THR 55 H THR 55 5.974 3.618 13.426 420 HA THR 55 HA THR 55 5.894 1.222 15.140 421 HB THR 55 HB THR 55 5.357 4.138 15.851 422 HG1 THR 55 1HG THR 55 7.551 4.046 16.548 423 HG21 THR 55 3HG2 THR 55 5.948 3.366 18.135 424 HG22 THR 55 1HG2 THR 55 6.097 1.716 17.534 425 HG23 THR 55 2HG2 THR 55 4.528 2.522 17.520 426 H MET 56 H MET 56 4.053 0.061 15.144 427 HA MET 56 HA MET 56 1.404 1.441 14.936 428 HB2 MET 56 2HB MET 56 2.244 -1.340 14.033 429 HB3 MET 56 1HB MET 56 0.592 -0.719 13.991 430 HG2 MET 56 2HG MET 56 1.328 1.116 12.493 431 HG3 MET 56 1HG MET 56 2.962 0.452 12.508 432 HE1 MET 56 3HE MET 56 1.799 1.082 9.999 433 HE2 MET 56 1HE MET 56 1.774 -0.339 8.947 434 HE3 MET 56 2HE MET 56 3.205 0.027 9.910 435 H ALA 57 H ALA 57 0.117 1.209 16.656 436 HA ALA 57 HA ALA 57 0.407 -1.117 18.456 437 HB1 ALA 57 1HB ALA 57 1.801 0.669 19.426 438 HB2 ALA 57 2HB ALA 57 0.393 0.336 20.434 439 HB3 ALA 57 3HB ALA 57 0.419 1.763 19.397 440 H ALA 58 H ALA 58 -1.433 -1.730 19.437 441 HA ALA 58 HA ALA 58 -3.924 -0.982 18.256 442 HB1 ALA 58 1HB ALA 58 -3.383 -2.571 20.779 443 HB2 ALA 58 2HB ALA 58 -3.512 -3.235 19.148 444 HB3 ALA 58 3HB ALA 58 -4.918 -2.495 19.913 445 H LYS 59 H LYS 59 -5.671 0.182 19.199 446 HA LYS 59 HA LYS 59 -5.028 2.506 20.569 447 HB2 LYS 59 2HB LYS 59 -7.073 2.128 19.193 448 HB3 LYS 59 1HB LYS 59 -7.713 1.088 20.463 449 HG2 LYS 59 2HG LYS 59 -7.660 2.975 22.049 450 HG3 LYS 59 1HG LYS 59 -6.978 4.008 20.796 451 HD2 LYS 59 2HD LYS 59 -9.012 3.673 19.422 452 HD3 LYS 59 1HD LYS 59 -9.692 2.655 20.693 453 HE2 LYS 59 2HE LYS 59 -8.936 5.582 20.978 454 HE3 LYS 59 1HE LYS 59 -10.577 4.946 20.863 455 HZ1 LYS 59 3HZ LYS 59 -8.933 5.167 23.136 456 HZ2 LYS 59 1HZ LYS 59 -9.276 3.528 22.871 457 HZ3 LYS 59 2HZ LYS 59 -10.546 4.642 23.041 458 H ASP 60 H ASP 60 -6.214 -0.612 21.782 459 HA ASP 60 HA ASP 60 -6.397 0.275 24.548 460 HB2 ASP 60 2HB ASP 60 -7.854 -1.515 23.591 461 HB3 ASP 60 1HB ASP 60 -6.436 -2.540 23.394 462 H GLY 61 H GLY 61 -3.873 -0.515 22.490 463 HA2 GLY 61 2HA GLY 61 -1.628 -0.851 22.828 464 HA3 GLY 61 1HA GLY 61 -1.888 -0.457 24.523 465 H SER 62 H SER 62 -3.805 -3.015 23.221 466 HA SER 62 HA SER 62 -2.820 -4.934 25.064 467 HB2 SER 62 2HB SER 62 -4.269 -6.505 23.810 468 HB3 SER 62 1HB SER 62 -5.104 -4.998 24.180 469 HG SER 62 HG SER 62 -5.035 -4.433 22.117 470 H MET 63 H MET 63 -2.102 -4.242 21.677 471 HA MET 63 HA MET 63 0.218 -6.107 21.772 472 HB2 MET 63 2HB MET 63 -1.695 -7.203 20.571 473 HB3 MET 63 1HB MET 63 -1.717 -5.860 19.430 474 HG2 MET 63 2HG MET 63 0.594 -6.385 18.740 475 HG3 MET 63 1HG MET 63 0.663 -7.684 19.929 476 HE1 MET 63 3HE MET 63 0.950 -7.653 16.480 477 HE2 MET 63 1HE MET 63 0.559 -9.376 16.394 478 HE3 MET 63 2HE MET 63 1.576 -8.765 17.694 479 H SER 64 H SER 64 1.998 -5.428 20.619 480 HA SER 64 HA SER 64 1.883 -2.948 19.033 481 HB2 SER 64 2HB SER 64 2.414 -2.215 21.329 482 HB3 SER 64 1HB SER 64 3.751 -3.359 21.387 483 HG SER 64 HG SER 64 4.423 -1.250 20.777 484 H PHE 65 H PHE 65 3.486 -2.819 17.470 485 HA PHE 65 HA PHE 65 5.715 -4.677 17.411 486 HB2 PHE 65 2HB PHE 65 3.790 -6.078 16.584 487 HB3 PHE 65 1HB PHE 65 3.567 -4.932 15.263 488 HD1 PHE 65 1HD PHE 65 5.981 -7.333 16.803 489 HD2 PHE 65 2HD PHE 65 5.063 -4.976 13.319 490 HE1 PHE 65 1HE PHE 65 7.775 -8.487 15.545 491 HE2 PHE 65 2HE PHE 65 6.857 -6.137 12.069 492 HZ PHE 65 HZ PHE 65 8.213 -7.892 13.178 493 H ASP 66 H ASP 66 7.007 -4.353 15.374 494 HA ASP 66 HA ASP 66 6.628 -1.675 14.126 495 HB2 ASP 66 2HB ASP 66 9.189 -2.712 15.392 496 HB3 ASP 66 1HB ASP 66 9.028 -1.211 14.481 497 H PHE 67 H PHE 67 6.666 -1.919 11.985 498 HA PHE 67 HA PHE 67 7.909 -4.304 10.760 499 HB2 PHE 67 2HB PHE 67 6.207 -2.106 9.526 500 HB3 PHE 67 1HB PHE 67 6.732 -3.589 8.726 501 HD1 PHE 67 2HD PHE 67 5.825 -5.797 9.409 502 HD2 PHE 67 1HD PHE 67 4.434 -2.158 11.236 503 HE1 PHE 67 2HE PHE 67 3.885 -7.011 10.357 504 HE2 PHE 67 1HE PHE 67 2.497 -3.376 12.182 505 HZ PHE 67 HZ PHE 67 2.221 -5.802 11.744 506 H GLY 68 H GLY 68 9.628 -4.218 9.402 507 HA2 GLY 68 2HA GLY 68 10.700 -1.698 8.385 508 HA3 GLY 68 1HA GLY 68 11.693 -2.510 9.594 509 H GLY 69 H GLY 69 12.423 -2.020 6.903 510 HA2 GLY 69 2HA GLY 69 13.401 -4.595 6.137 511 HA3 GLY 69 1HA GLY 69 12.095 -4.067 5.072 512 H VAL 70 H VAL 70 14.227 -4.312 3.685 513 HA VAL 70 HA VAL 70 15.508 -1.621 3.456 514 HB VAL 70 HB VAL 70 16.729 -4.329 2.796 515 HG11 VAL 70 1HG1 VAL 70 17.880 -1.511 2.809 516 HG12 VAL 70 2HG1 VAL 70 17.624 -2.524 1.387 517 HG13 VAL 70 3HG1 VAL 70 18.830 -2.981 2.586 518 HG21 VAL 70 3HG2 VAL 70 16.472 -4.034 5.231 519 HG22 VAL 70 1HG2 VAL 70 17.237 -2.448 5.131 520 HG23 VAL 70 2HG2 VAL 70 18.168 -3.901 4.776 521 H TYR 71 H TYR 71 15.281 -0.643 1.524 522 HA TYR 71 HA TYR 71 13.652 -1.825 -0.546 523 HB2 TYR 71 2HB TYR 71 15.260 0.755 -0.438 524 HB3 TYR 71 1HB TYR 71 14.210 0.309 -1.784 525 HD1 TYR 71 2HD TYR 71 11.737 0.046 -1.432 526 HD2 TYR 71 1HD TYR 71 14.296 1.544 1.685 527 HE1 TYR 71 2HE TYR 71 9.759 0.897 -0.209 528 HE2 TYR 71 1HE TYR 71 12.316 2.386 2.900 529 HH TYR 71 HH TYR 71 9.065 2.186 1.496 530 H ASP 72 H ASP 72 14.401 -3.314 -1.935 531 HA ASP 72 HA ASP 72 17.216 -3.760 -2.405 532 HB2 ASP 72 2HB ASP 72 15.552 -5.599 -2.424 533 HB3 ASP 72 1HB ASP 72 14.793 -4.889 -3.846 534 H GLN 73 H GLN 73 14.501 -2.514 -4.338 535 HA GLN 73 HA GLN 73 16.320 -0.872 -5.970 536 HB2 GLN 73 2HB GLN 73 14.414 -2.909 -7.203 537 HB3 GLN 73 1HB GLN 73 15.317 -1.693 -8.100 538 HG2 GLN 73 2HG GLN 73 16.520 -3.986 -6.509 539 HG3 GLN 73 1HG GLN 73 16.414 -3.881 -8.258 540 HE21 GLN 73 1HE2 GLN 73 17.158 -1.111 -8.579 541 HE22 GLN 73 2HE2 GLN 73 18.785 -0.958 -8.116 542 H VAL 74 H VAL 74 15.337 0.927 -6.781 543 HA VAL 74 HA VAL 74 12.408 1.306 -6.386 544 HB VAL 74 HB VAL 74 13.624 2.375 -4.503 545 HG11 VAL 74 1HG1 VAL 74 15.759 2.798 -5.942 546 HG12 VAL 74 2HG1 VAL 74 15.309 4.045 -4.786 547 HG13 VAL 74 3HG1 VAL 74 14.948 4.259 -6.499 548 HG21 VAL 74 3HG2 VAL 74 11.551 3.414 -5.379 549 HG22 VAL 74 1HG2 VAL 74 12.500 4.393 -6.498 550 HG23 VAL 74 2HG2 VAL 74 12.669 4.632 -4.769 551 H LYS 75 H LYS 75 11.468 2.041 -8.235 552 HA LYS 75 HA LYS 75 13.031 3.671 -10.157 553 HB2 LYS 75 2HB LYS 75 11.313 1.279 -10.921 554 HB3 LYS 75 1HB LYS 75 12.127 2.369 -12.041 555 HG2 LYS 75 2HG LYS 75 13.611 0.652 -10.011 556 HG3 LYS 75 1HG LYS 75 13.306 0.151 -11.669 557 HD2 LYS 75 2HD LYS 75 14.547 2.149 -12.486 558 HD3 LYS 75 1HD LYS 75 14.911 2.593 -10.822 559 HE2 LYS 75 2HE LYS 75 16.804 1.381 -11.794 560 HE3 LYS 75 1HE LYS 75 16.076 0.442 -10.493 561 HZ1 LYS 75 3HZ LYS 75 16.606 -0.651 -12.778 562 HZ2 LYS 75 1HZ LYS 75 15.133 0.049 -13.244 563 HZ3 LYS 75 2HZ LYS 75 15.175 -1.051 -11.950 564 H THR 76 H THR 76 11.976 5.515 -10.142 565 HA THR 76 HA THR 76 9.390 5.955 -9.251 566 HB THR 76 HB THR 76 10.998 7.755 -9.413 567 HG1 THR 76 1HG THR 76 8.543 7.905 -10.174 568 HG21 THR 76 3HG2 THR 76 11.797 8.642 -11.531 569 HG22 THR 76 1HG2 THR 76 10.782 7.524 -12.433 570 HG23 THR 76 2HG2 THR 76 12.147 6.916 -11.499 571 H ASN 77 H ASN 77 7.408 5.799 -10.084 572 HA ASN 77 HA ASN 77 5.712 5.171 -11.510 573 HB2 ASN 77 2HB ASN 77 7.404 6.839 -13.390 574 HB3 ASN 77 1HB ASN 77 5.722 6.397 -13.672 575 HD21 ASN 77 1HD2 ASN 77 6.651 9.141 -13.384 576 HD22 ASN 77 2HD2 ASN 77 5.921 9.772 -11.990 577 H ASP 78 H ASP 78 7.328 3.039 -11.218 578 HA ASP 78 HA ASP 78 7.100 1.658 -13.784 579 HB2 ASP 78 2HB ASP 78 9.763 2.271 -12.490 580 HB3 ASP 78 1HB ASP 78 9.582 0.905 -13.584 581 H LEU 79 H LEU 79 9.239 0.908 -11.051 582 HA LEU 79 HA LEU 79 7.336 -1.108 -10.018 583 HB2 LEU 79 2HB LEU 79 8.834 -2.132 -11.862 584 HB3 LEU 79 1HB LEU 79 10.191 -1.863 -10.772 585 HG LEU 79 HG LEU 79 8.631 -3.199 -9.009 586 HD11 LEU 79 1HD1 LEU 79 6.683 -3.357 -10.553 587 HD12 LEU 79 2HD1 LEU 79 7.281 -4.944 -10.086 588 HD13 LEU 79 3HD1 LEU 79 7.662 -4.292 -11.682 589 HD21 LEU 79 3HD2 LEU 79 10.843 -3.989 -9.751 590 HD22 LEU 79 1HD2 LEU 79 10.144 -4.593 -11.253 591 HD23 LEU 79 2HD2 LEU 79 9.702 -5.330 -9.711 592 H ILE 80 H ILE 80 7.453 -1.326 -7.857 593 HA ILE 80 HA ILE 80 9.853 -0.305 -6.390 594 HB ILE 80 HB ILE 80 6.948 0.149 -5.578 595 HG12 ILE 80 2HG1 ILE 80 9.032 2.138 -6.576 596 HG13 ILE 80 1HG1 ILE 80 7.680 1.547 -7.536 597 HG21 ILE 80 1HG2 ILE 80 8.507 -0.103 -3.655 598 HG22 ILE 80 2HG2 ILE 80 7.956 1.556 -3.789 599 HG23 ILE 80 3HG2 ILE 80 9.566 1.117 -4.357 600 HD11 ILE 80 3HD1 ILE 80 6.981 3.647 -6.663 601 HD12 ILE 80 1HD1 ILE 80 7.572 3.269 -5.048 602 HD13 ILE 80 2HD1 ILE 80 6.146 2.449 -5.685 603 H GLU 81 H GLU 81 10.602 -1.731 -4.915 604 HA GLU 81 HA GLU 81 8.835 -3.696 -3.656 605 HB2 GLU 81 2HB GLU 81 10.290 -5.613 -4.348 606 HB3 GLU 81 1HB GLU 81 9.420 -4.888 -5.701 607 HG2 GLU 81 2HG GLU 81 11.430 -3.586 -6.307 608 HG3 GLU 81 1HG GLU 81 12.311 -4.309 -4.963 609 H TYR 82 H TYR 82 9.976 -4.903 -1.976 610 HA TYR 82 HA TYR 82 12.575 -3.964 -1.083 611 HB2 TYR 82 2HB TYR 82 11.656 -3.117 1.110 612 HB3 TYR 82 1HB TYR 82 11.239 -2.107 -0.273 613 HD1 TYR 82 1HD TYR 82 8.938 -2.064 -1.183 614 HD2 TYR 82 2HD TYR 82 9.918 -4.501 2.225 615 HE1 TYR 82 1HE TYR 82 6.529 -2.366 -0.702 616 HE2 TYR 82 2HE TYR 82 7.501 -4.792 2.697 617 HH TYR 82 HH TYR 82 5.288 -3.194 2.032 618 H THR 83 H THR 83 13.379 -5.176 0.693 619 HA THR 83 HA THR 83 12.184 -7.870 0.882 620 HB THR 83 HB THR 83 14.883 -6.835 1.836 621 HG1 THR 83 1HG THR 83 14.064 -7.106 -0.579 622 HG21 THR 83 3HG2 THR 83 15.462 -9.260 1.834 623 HG22 THR 83 1HG2 THR 83 13.785 -9.644 1.452 624 HG23 THR 83 2HG2 THR 83 14.191 -8.890 2.996 625 H ILE 84 H ILE 84 11.160 -8.543 2.680 626 HA ILE 84 HA ILE 84 10.990 -6.764 5.037 627 HB ILE 84 HB ILE 84 9.422 -9.261 4.279 628 HG12 ILE 84 2HG1 ILE 84 8.545 -6.337 4.247 629 HG13 ILE 84 1HG1 ILE 84 9.099 -7.186 2.807 630 HG21 ILE 84 1HG2 ILE 84 9.419 -8.975 6.714 631 HG22 ILE 84 2HG2 ILE 84 7.858 -8.448 6.112 632 HG23 ILE 84 3HG2 ILE 84 9.079 -7.254 6.556 633 HD11 ILE 84 3HD1 ILE 84 7.280 -8.773 2.952 634 HD12 ILE 84 1HD1 ILE 84 6.606 -7.148 3.044 635 HD13 ILE 84 2HD1 ILE 84 6.752 -8.120 4.506 636 H GLY 85 H GLY 85 11.367 -7.589 7.174 637 HA2 GLY 85 2HA GLY 85 13.730 -9.001 7.519 638 HA3 GLY 85 1HA GLY 85 12.513 -8.791 8.772 639 H ASP 86 H ASP 86 10.375 -10.275 7.605 640 HA ASP 86 HA ASP 86 11.004 -12.887 8.406 641 HB2 ASP 86 2HB ASP 86 8.728 -11.907 8.388 642 HB3 ASP 86 1HB ASP 86 8.743 -11.918 6.628 643 H GLY 87 H GLY 87 11.784 -11.242 5.569 644 HA2 GLY 87 2HA GLY 87 13.176 -12.043 3.856 645 HA3 GLY 87 1HA GLY 87 12.738 -13.702 4.256 646 H ARG 88 H ARG 88 9.949 -11.898 4.239 647 HA ARG 88 HA ARG 88 9.036 -13.037 1.718 648 HB2 ARG 88 2HB ARG 88 7.688 -11.128 3.662 649 HB3 ARG 88 1HB ARG 88 6.901 -11.886 2.277 650 HG2 ARG 88 2HG ARG 88 7.387 -14.121 3.224 651 HG3 ARG 88 1HG ARG 88 8.159 -13.361 4.616 652 HD2 ARG 88 2HD ARG 88 5.257 -12.936 3.812 653 HD3 ARG 88 1HD ARG 88 5.798 -14.033 5.080 654 HE ARG 88 HE ARG 88 6.869 -11.486 5.610 655 HH11 ARG 88 1HH2 ARG 88 3.812 -13.136 5.483 656 HH12 ARG 88 2HH2 ARG 88 3.064 -12.112 6.663 657 HH21 ARG 88 1HH1 ARG 88 5.883 -10.155 7.149 658 HH22 ARG 88 2HH1 ARG 88 4.235 -10.430 7.603 659 H LYS 89 H LYS 89 8.614 -11.948 -0.172 660 HA LYS 89 HA LYS 89 9.761 -9.202 -0.433 661 HB2 LYS 89 2HB LYS 89 9.277 -11.332 -2.532 662 HB3 LYS 89 1HB LYS 89 9.949 -9.725 -2.835 663 HG2 LYS 89 2HG LYS 89 11.793 -10.322 -1.124 664 HG3 LYS 89 1HG LYS 89 11.205 -11.979 -1.203 665 HD2 LYS 89 2HD LYS 89 12.185 -10.324 -3.552 666 HD3 LYS 89 1HD LYS 89 13.107 -11.591 -2.744 667 HE2 LYS 89 2HE LYS 89 10.609 -11.906 -4.452 668 HE3 LYS 89 1HE LYS 89 12.184 -12.659 -4.682 669 HZ1 LYS 89 3HZ LYS 89 10.923 -14.335 -3.765 670 HZ2 LYS 89 1HZ LYS 89 10.101 -13.302 -2.700 671 HZ3 LYS 89 2HZ LYS 89 11.723 -13.712 -2.401 672 H VAL 90 H VAL 90 8.765 -7.801 -1.970 673 HA VAL 90 HA VAL 90 5.867 -8.216 -2.431 674 HB VAL 90 HB VAL 90 6.964 -5.685 -1.134 675 HG11 VAL 90 1HG1 VAL 90 4.549 -5.168 -0.823 676 HG12 VAL 90 2HG1 VAL 90 4.130 -6.639 -1.703 677 HG13 VAL 90 3HG1 VAL 90 4.963 -5.322 -2.529 678 HG21 VAL 90 3HG2 VAL 90 5.464 -8.056 0.071 679 HG22 VAL 90 1HG2 VAL 90 5.663 -6.501 0.886 680 HG23 VAL 90 2HG2 VAL 90 7.075 -7.482 0.510 681 H ARG 91 H ARG 91 5.468 -7.825 -4.492 682 HA ARG 91 HA ARG 91 7.197 -5.930 -6.035 683 HB2 ARG 91 2HB ARG 91 5.545 -8.305 -6.981 684 HB3 ARG 91 1HB ARG 91 6.508 -7.241 -8.010 685 HG2 ARG 91 2HG ARG 91 8.552 -7.891 -6.777 686 HG3 ARG 91 1HG ARG 91 7.596 -8.964 -5.756 687 HD2 ARG 91 2HD ARG 91 6.912 -10.250 -7.763 688 HD3 ARG 91 1HD ARG 91 7.902 -9.196 -8.770 689 HE ARG 91 HE ARG 91 8.826 -11.385 -7.153 690 HH11 ARG 91 1HH2 ARG 91 9.672 -8.248 -8.376 691 HH12 ARG 91 2HH2 ARG 91 11.379 -8.524 -8.286 692 HH21 ARG 91 1HH1 ARG 91 11.063 -11.744 -7.038 693 HH22 ARG 91 2HH1 ARG 91 12.165 -10.500 -7.528 694 H ILE 92 H ILE 92 6.213 -4.088 -6.595 695 HA ILE 92 HA ILE 92 3.229 -3.979 -6.815 696 HB ILE 92 HB ILE 92 5.156 -1.730 -6.082 697 HG12 ILE 92 2HG1 ILE 92 3.204 -3.243 -4.283 698 HG13 ILE 92 1HG1 ILE 92 4.936 -3.538 -4.304 699 HG21 ILE 92 1HG2 ILE 92 3.052 -0.516 -5.523 700 HG22 ILE 92 2HG2 ILE 92 2.116 -1.901 -6.072 701 HG23 ILE 92 3HG2 ILE 92 3.075 -0.980 -7.220 702 HD11 ILE 92 3HD1 ILE 92 5.337 -1.165 -3.690 703 HD12 ILE 92 1HD1 ILE 92 4.396 -2.026 -2.473 704 HD13 ILE 92 2HD1 ILE 92 3.593 -0.915 -3.581 705 H VAL 93 H VAL 93 2.583 -3.759 -8.877 706 HA VAL 93 HA VAL 93 4.405 -2.539 -10.895 707 HB VAL 93 HB VAL 93 1.999 -4.357 -11.328 708 HG11 VAL 93 1HG1 VAL 93 4.201 -3.391 -13.193 709 HG12 VAL 93 2HG1 VAL 93 2.507 -2.904 -13.261 710 HG13 VAL 93 3HG1 VAL 93 2.957 -4.567 -13.620 711 HG21 VAL 93 3HG2 VAL 93 3.706 -6.099 -11.828 712 HG22 VAL 93 1HG2 VAL 93 3.807 -5.554 -10.155 713 HG23 VAL 93 2HG2 VAL 93 4.978 -4.978 -11.342 714 H PHE 94 H PHE 94 3.920 -0.504 -11.405 715 HA PHE 94 HA PHE 94 1.205 0.582 -10.928 716 HB2 PHE 94 2HB PHE 94 3.848 1.882 -11.687 717 HB3 PHE 94 1HB PHE 94 2.336 2.765 -11.458 718 HD1 PHE 94 1HD PHE 94 4.955 0.748 -9.744 719 HD2 PHE 94 2HD PHE 94 1.387 3.094 -9.214 720 HE1 PHE 94 1HE PHE 94 5.341 0.795 -7.302 721 HE2 PHE 94 2HE PHE 94 1.782 3.138 -6.773 722 HZ PHE 94 HZ PHE 94 3.752 1.990 -5.812 723 H THR 95 H THR 95 -0.224 0.672 -12.530 724 HA THR 95 HA THR 95 0.674 0.940 -15.356 725 HB THR 95 HB THR 95 -1.587 -0.851 -14.375 726 HG1 THR 95 1HG THR 95 0.958 -1.286 -14.271 727 HG21 THR 95 3HG2 THR 95 -1.958 0.031 -16.642 728 HG22 THR 95 1HG2 THR 95 -1.530 -1.677 -16.724 729 HG23 THR 95 2HG2 THR 95 -0.328 -0.448 -17.113 730 H HIS 96 H HIS 96 -0.592 2.249 -16.606 731 HA HIS 96 HA HIS 96 -3.118 3.347 -15.602 732 HB2 HIS 96 2HB HIS 96 -2.300 5.686 -15.768 733 HB3 HIS 96 1HB HIS 96 -1.444 4.786 -14.518 734 HD2 HIS 96 2HD HIS 96 -0.711 6.306 -18.073 735 HE1 HIS 96 1HE HIS 96 2.946 5.033 -16.392 736 HE2 HIS 96 2HE HIS 96 1.887 6.271 -18.339 737 H THR 97 H THR 97 -4.363 4.251 -17.236 738 HA THR 97 HA THR 97 -3.434 3.692 -20.018 739 HB THR 97 HB THR 97 -5.818 3.706 -20.586 740 HG1 THR 97 1HG THR 97 -6.860 4.999 -19.270 741 HG21 THR 97 3HG2 THR 97 -4.803 1.599 -19.777 742 HG22 THR 97 1HG2 THR 97 -6.499 1.716 -19.308 743 HG23 THR 97 2HG2 THR 97 -5.235 2.033 -18.122 744 H GLY 98 H GLY 98 -4.211 6.199 -17.803 745 HA2 GLY 98 2HA GLY 98 -3.204 8.316 -19.215 746 HA3 GLY 98 1HA GLY 98 -4.892 8.244 -19.725 747 H ASP 99 H ASP 99 -6.426 9.086 -18.422 748 HA ASP 99 HA ASP 99 -5.639 10.627 -16.105 749 HB2 ASP 99 2HB ASP 99 -8.378 10.073 -17.279 750 HB3 ASP 99 1HB ASP 99 -8.008 11.294 -16.061 751 H THR 100 H THR 100 -6.265 7.382 -16.464 752 HA THR 100 HA THR 100 -7.340 7.081 -13.686 753 HB THR 100 HB THR 100 -7.648 5.166 -16.037 754 HG1 THR 100 1HG THR 100 -8.864 7.029 -16.342 755 HG21 THR 100 3HG2 THR 100 -9.321 4.090 -14.545 756 HG22 THR 100 1HG2 THR 100 -8.882 5.213 -13.258 757 HG23 THR 100 2HG2 THR 100 -7.705 4.039 -13.847 758 H THR 101 H THR 101 -5.926 6.226 -12.314 759 HA THR 101 HA THR 101 -3.549 4.738 -13.315 760 HB THR 101 HB THR 101 -4.011 6.094 -10.634 761 HG1 THR 101 1HG THR 101 -3.226 6.976 -13.066 762 HG21 THR 101 3HG2 THR 101 -1.528 5.771 -10.410 763 HG22 THR 101 1HG2 THR 101 -1.555 4.783 -11.869 764 HG23 THR 101 2HG2 THR 101 -2.410 4.249 -10.422 765 H ASN 102 H ASN 102 -3.266 2.646 -12.787 766 HA ASN 102 HA ASN 102 -5.183 1.340 -10.901 767 HB2 ASN 102 2HB ASN 102 -3.763 0.188 -13.326 768 HB3 ASN 102 1HB ASN 102 -4.862 -0.685 -12.259 769 HD21 ASN 102 1HD2 ASN 102 -4.904 0.544 -15.247 770 HD22 ASN 102 2HD2 ASN 102 -6.493 1.139 -15.331 771 H ILE 103 H ILE 103 -4.280 0.556 -9.116 772 HA ILE 103 HA ILE 103 -1.327 0.136 -8.963 773 HB ILE 103 HB ILE 103 -3.369 0.404 -6.727 774 HG12 ILE 103 2HG1 ILE 103 -1.336 2.468 -7.668 775 HG13 ILE 103 1HG1 ILE 103 -3.041 2.520 -8.103 776 HG21 ILE 103 1HG2 ILE 103 -0.333 0.363 -6.709 777 HG22 ILE 103 2HG2 ILE 103 -1.390 -0.883 -6.052 778 HG23 ILE 103 3HG2 ILE 103 -1.332 0.700 -5.300 779 HD11 ILE 103 3HD1 ILE 103 -3.614 2.562 -5.648 780 HD12 ILE 103 1HD1 ILE 103 -2.702 3.972 -6.192 781 HD13 ILE 103 2HD1 ILE 103 -1.884 2.688 -5.301 782 H VAL 104 H VAL 104 -0.630 -1.925 -8.941 783 HA VAL 104 HA VAL 104 -2.491 -4.131 -8.139 784 HB VAL 104 HB VAL 104 -0.211 -4.250 -10.157 785 HG11 VAL 104 1HG1 VAL 104 -0.655 -6.409 -9.052 786 HG12 VAL 104 2HG1 VAL 104 -1.227 -6.458 -10.715 787 HG13 VAL 104 3HG1 VAL 104 -2.378 -6.245 -9.395 788 HG21 VAL 104 3HG2 VAL 104 -2.022 -4.414 -11.850 789 HG22 VAL 104 1HG2 VAL 104 -2.068 -2.867 -11.003 790 HG23 VAL 104 2HG2 VAL 104 -3.221 -4.137 -10.585 791 H GLU 105 H GLU 105 -1.827 -5.287 -6.430 792 HA GLU 105 HA GLU 105 1.052 -5.271 -5.628 793 HB2 GLU 105 2HB GLU 105 -1.386 -5.138 -3.814 794 HB3 GLU 105 1HB GLU 105 0.294 -5.233 -3.286 795 HG2 GLU 105 2HG GLU 105 0.775 -3.089 -4.399 796 HG3 GLU 105 1HG GLU 105 -0.890 -2.995 -4.951 797 H SER 106 H SER 106 1.862 -7.265 -5.599 798 HA SER 106 HA SER 106 0.135 -9.565 -4.861 799 HB2 SER 106 2HB SER 106 2.086 -9.511 -7.176 800 HB3 SER 106 1HB SER 106 1.159 -10.909 -6.635 801 HG SER 106 HG SER 106 -0.164 -10.100 -8.111 802 H PHE 107 H PHE 107 0.987 -10.784 -3.328 803 HA PHE 107 HA PHE 107 3.875 -11.186 -3.058 804 HB2 PHE 107 2HB PHE 107 3.919 -10.326 -0.698 805 HB3 PHE 107 1HB PHE 107 3.687 -9.063 -1.905 806 HD1 PHE 107 2HD PHE 107 2.003 -11.066 0.723 807 HD2 PHE 107 1HD PHE 107 1.547 -7.882 -2.143 808 HE1 PHE 107 2HE PHE 107 -0.127 -10.395 1.790 809 HE2 PHE 107 1HE PHE 107 -0.579 -7.227 -1.068 810 HZ PHE 107 HZ PHE 107 -1.409 -8.477 0.890 811 H ASP 108 H ASP 108 4.378 -12.629 -1.195 812 HA ASP 108 HA ASP 108 2.326 -14.751 -1.047 813 HB2 ASP 108 2HB ASP 108 4.630 -15.287 -1.798 814 HB3 ASP 108 1HB ASP 108 5.251 -14.805 -0.222 815 HA PRO 109 HA PRO 109 1.859 -13.215 3.277 816 HB2 PRO 109 2HB PRO 109 -0.444 -14.464 3.983 817 HB3 PRO 109 1HB PRO 109 -0.455 -13.145 2.787 818 HG2 PRO 109 2HG PRO 109 -0.456 -16.120 2.288 819 HG3 PRO 109 1HG PRO 109 -1.505 -14.875 1.565 820 HD2 PRO 109 2HD PRO 109 0.743 -15.822 0.291 821 HD3 PRO 109 1HD PRO 109 0.182 -14.153 0.068 822 H GLU 110 H GLU 110 1.749 -14.306 5.481 823 HA GLU 110 HA GLU 110 3.725 -16.278 5.712 824 HB2 GLU 110 2HB GLU 110 3.038 -14.694 7.510 825 HB3 GLU 110 1HB GLU 110 1.555 -15.615 7.724 826 HG2 GLU 110 2HG GLU 110 2.864 -17.616 8.323 827 HG3 GLU 110 1HG GLU 110 4.360 -16.727 8.062 828 H GLU 111 H GLU 111 3.655 -18.478 6.128 829 HA GLU 111 HA GLU 111 1.549 -19.959 4.844 830 HB2 GLU 111 2HB GLU 111 2.845 -21.944 5.487 831 HB3 GLU 111 1HB GLU 111 3.879 -20.712 4.767 832 HG2 GLU 111 2HG GLU 111 4.475 -19.953 7.120 833 HG3 GLU 111 1HG GLU 111 3.592 -21.352 7.728 834 H THR 112 H THR 112 2.472 -19.410 8.225 835 HA THR 112 HA THR 112 0.685 -21.244 9.412 836 HB THR 112 HB THR 112 1.080 -20.013 11.479 837 HG1 THR 112 1HG THR 112 1.022 -17.935 11.132 838 HG21 THR 112 3HG2 THR 112 3.534 -20.005 11.496 839 HG22 THR 112 1HG2 THR 112 3.567 -19.963 9.737 840 HG23 THR 112 2HG2 THR 112 2.953 -21.390 10.572 841 H ASN 113 H ASN 113 0.324 -17.767 8.661 842 HA ASN 113 HA ASN 113 -2.286 -17.572 9.786 843 HB2 ASN 113 2HB ASN 113 -0.837 -15.606 9.537 844 HB3 ASN 113 1HB ASN 113 -0.890 -15.773 7.780 845 HD21 ASN 113 1HD2 ASN 113 -2.383 -14.193 10.388 846 HD22 ASN 113 2HD2 ASN 113 -3.822 -13.746 9.606 847 HA PRO 114 HA PRO 114 -4.427 -19.465 6.277 848 HB2 PRO 114 2HB PRO 114 -6.964 -18.293 6.543 849 HB3 PRO 114 1HB PRO 114 -6.404 -19.676 7.504 850 HG2 PRO 114 2HG PRO 114 -6.391 -16.757 8.224 851 HG3 PRO 114 1HG PRO 114 -6.891 -18.144 9.213 852 HD2 PRO 114 2HD PRO 114 -4.484 -17.014 9.567 853 HD3 PRO 114 1HD PRO 114 -4.652 -18.785 9.652 854 H ARG 115 H ARG 115 -4.405 -18.945 4.157 855 HA ARG 115 HA ARG 115 -3.705 -16.320 3.277 856 HB2 ARG 115 2HB ARG 115 -3.836 -17.313 1.017 857 HB3 ARG 115 1HB ARG 115 -2.903 -18.312 2.115 858 HG2 ARG 115 2HG ARG 115 -4.898 -19.752 2.470 859 HG3 ARG 115 1HG ARG 115 -5.801 -18.773 1.319 860 HD2 ARG 115 2HD ARG 115 -3.247 -20.258 0.642 861 HD3 ARG 115 1HD ARG 115 -4.869 -20.853 0.295 862 HE ARG 115 HE ARG 115 -3.431 -18.845 -1.179 863 HH11 ARG 115 1HH2 ARG 115 -6.591 -19.887 -0.183 864 HH12 ARG 115 2HH2 ARG 115 -7.407 -19.121 -1.505 865 HH21 ARG 115 1HH1 ARG 115 -4.504 -17.854 -2.916 866 HH22 ARG 115 2HH1 ARG 115 -6.227 -17.972 -3.048 867 H GLU 116 H GLU 116 -6.739 -18.157 3.266 868 HA GLU 116 HA GLU 116 -8.229 -16.493 1.594 869 HB2 GLU 116 2HB GLU 116 -10.224 -17.477 2.831 870 HB3 GLU 116 1HB GLU 116 -9.081 -18.664 2.208 871 HG2 GLU 116 2HG GLU 116 -8.026 -18.824 4.440 872 HG3 GLU 116 1HG GLU 116 -9.180 -17.657 5.073 873 H LEU 117 H LEU 117 -7.692 -16.253 5.102 874 HA LEU 117 HA LEU 117 -9.460 -14.113 5.594 875 HB2 LEU 117 2HB LEU 117 -8.324 -15.670 7.267 876 HB3 LEU 117 1HB LEU 117 -6.872 -14.701 7.055 877 HG LEU 117 HG LEU 117 -8.531 -12.659 7.649 878 HD11 LEU 117 1HD1 LEU 117 -9.872 -15.006 9.057 879 HD12 LEU 117 2HD1 LEU 117 -10.579 -14.085 7.728 880 HD13 LEU 117 3HD1 LEU 117 -10.265 -13.300 9.275 881 HD21 LEU 117 3HD2 LEU 117 -6.566 -13.276 9.010 882 HD22 LEU 117 1HD2 LEU 117 -7.478 -14.587 9.758 883 HD23 LEU 117 2HD2 LEU 117 -7.937 -12.908 10.054 884 H GLN 118 H GLN 118 -5.988 -14.162 4.796 885 HA GLN 118 HA GLN 118 -5.527 -11.381 5.002 886 HB2 GLN 118 2HB GLN 118 -4.138 -13.444 3.260 887 HB3 GLN 118 1HB GLN 118 -3.510 -11.833 3.608 888 HG2 GLN 118 2HG GLN 118 -4.133 -13.912 5.735 889 HG3 GLN 118 1HG GLN 118 -2.526 -13.638 5.070 890 HE21 GLN 118 1HE2 GLN 118 -4.176 -12.974 7.786 891 HE22 GLN 118 2HE2 GLN 118 -3.561 -11.438 8.163 892 H GLN 119 H GLN 119 -6.399 -13.408 2.181 893 HA GLN 119 HA GLN 119 -6.290 -11.464 0.206 894 HB2 GLN 119 2HB GLN 119 -6.729 -13.896 -0.163 895 HB3 GLN 119 1HB GLN 119 -8.365 -13.670 0.443 896 HG2 GLN 119 2HG GLN 119 -8.844 -12.082 -1.386 897 HG3 GLN 119 1HG GLN 119 -7.189 -12.249 -1.971 898 HE21 GLN 119 1HE2 GLN 119 -9.532 -12.924 -3.556 899 HE22 GLN 119 2HE2 GLN 119 -9.486 -14.596 -3.846 900 H SER 120 H SER 120 -8.996 -12.257 2.373 901 HA SER 120 HA SER 120 -10.774 -10.260 1.376 902 HB2 SER 120 2HB SER 120 -10.713 -11.570 4.114 903 HB3 SER 120 1HB SER 120 -12.072 -10.705 3.401 904 HG SER 120 HG SER 120 -11.223 -13.255 3.009 905 H GLY 121 H GLY 121 -8.368 -10.344 3.999 906 HA2 GLY 121 2HA GLY 121 -9.003 -7.856 5.177 907 HA3 GLY 121 1HA GLY 121 -7.447 -8.671 5.281 908 H TRP 122 H TRP 122 -6.467 -8.655 2.771 909 HA TRP 122 HA TRP 122 -5.585 -5.984 2.422 910 HB2 TRP 122 2HB TRP 122 -5.387 -8.367 0.547 911 HB3 TRP 122 1HB TRP 122 -4.519 -6.848 0.329 912 HD1 TRP 122 HD TRP 122 -4.062 -10.150 1.875 913 HE1 TRP 122 1HE TRP 122 -2.120 -10.134 3.560 914 HE3 TRP 122 3HE TRP 122 -3.320 -5.107 2.339 915 HZ2 TRP 122 2HZ TRP 122 -0.466 -8.245 4.924 916 HZ3 TRP 122 3HZ TRP 122 -1.552 -4.236 3.835 917 HH2 TRP 122 HH TRP 122 -0.123 -5.797 5.126 918 H GLN 123 H GLN 123 -8.112 -7.875 0.860 919 HA GLN 123 HA GLN 123 -8.664 -5.959 -1.214 920 HB2 GLN 123 2HB GLN 123 -9.244 -8.403 -1.324 921 HB3 GLN 123 1HB GLN 123 -10.488 -8.125 -0.107 922 HG2 GLN 123 2HG GLN 123 -11.600 -6.505 -1.614 923 HG3 GLN 123 1HG GLN 123 -10.347 -6.767 -2.821 924 HE21 GLN 123 1HE2 GLN 123 -11.413 -7.924 -4.465 925 HE22 GLN 123 2HE2 GLN 123 -12.307 -9.344 -4.205 926 H ALA 124 H ALA 124 -9.938 -6.584 2.038 927 HA ALA 124 HA ALA 124 -12.180 -4.911 1.986 928 HB1 ALA 124 1HB ALA 124 -10.354 -5.528 4.322 929 HB2 ALA 124 2HB ALA 124 -11.725 -6.507 3.798 930 HB3 ALA 124 3HB ALA 124 -11.996 -4.889 4.447 931 H ILE 125 H ILE 125 -8.867 -4.101 3.090 932 HA ILE 125 HA ILE 125 -9.416 -1.399 3.706 933 HB ILE 125 HB ILE 125 -7.456 -2.498 4.596 934 HG12 ILE 125 2HG1 ILE 125 -6.422 -0.425 2.603 935 HG13 ILE 125 1HG1 ILE 125 -7.323 0.005 4.048 936 HG21 ILE 125 1HG2 ILE 125 -5.578 -3.214 3.179 937 HG22 ILE 125 2HG2 ILE 125 -6.474 -2.741 1.737 938 HG23 ILE 125 3HG2 ILE 125 -7.053 -4.063 2.746 939 HD11 ILE 125 3HD1 ILE 125 -4.896 0.146 4.468 940 HD12 ILE 125 1HD1 ILE 125 -4.714 -1.548 4.003 941 HD13 ILE 125 2HD1 ILE 125 -5.623 -1.124 5.454 942 H LEU 126 H LEU 126 -8.413 -2.979 0.710 943 HA LEU 126 HA LEU 126 -7.896 -0.615 -0.776 944 HB2 LEU 126 2HB LEU 126 -8.620 -3.457 -1.523 945 HB3 LEU 126 1HB LEU 126 -8.413 -2.237 -2.778 946 HG LEU 126 HG LEU 126 -6.300 -2.951 -0.700 947 HD11 LEU 126 1HD1 LEU 126 -6.664 -4.844 -2.156 948 HD12 LEU 126 2HD1 LEU 126 -5.135 -4.081 -2.596 949 HD13 LEU 126 3HD1 LEU 126 -6.565 -3.821 -3.594 950 HD21 LEU 126 3HD2 LEU 126 -5.531 -0.874 -1.343 951 HD22 LEU 126 1HD2 LEU 126 -6.416 -0.864 -2.862 952 HD23 LEU 126 2HD2 LEU 126 -4.891 -1.742 -2.732 953 H ASN 127 H ASN 127 -10.852 -2.507 -0.234 954 HA ASN 127 HA ASN 127 -12.505 -1.105 -2.070 955 HB2 ASN 127 2HB ASN 127 -13.203 -2.588 0.491 956 HB3 ASN 127 1HB ASN 127 -14.389 -2.022 -0.685 957 HD21 ASN 127 1HD2 ASN 127 -13.683 -4.865 0.076 958 HD22 ASN 127 2HD2 ASN 127 -13.248 -5.612 -1.385 959 H SER 128 H SER 128 -11.741 -0.584 1.345 960 HA SER 128 HA SER 128 -13.534 1.526 1.859 961 HB2 SER 128 2HB SER 128 -10.803 1.038 3.081 962 HB3 SER 128 1HB SER 128 -12.072 2.055 3.759 963 HG SER 128 HG SER 128 -12.684 -0.589 3.071 964 H PHE 129 H PHE 129 -10.271 1.498 0.507 965 HA PHE 129 HA PHE 129 -9.768 4.260 0.535 966 HB2 PHE 129 2HB PHE 129 -8.066 2.497 0.022 967 HB3 PHE 129 1HB PHE 129 -8.829 2.249 -1.547 968 HD1 PHE 129 1HD PHE 129 -6.838 4.602 0.515 969 HD2 PHE 129 2HD PHE 129 -8.662 3.966 -3.328 970 HE1 PHE 129 1HE PHE 129 -5.566 6.516 -0.408 971 HE2 PHE 129 2HE PHE 129 -7.387 5.881 -4.245 972 HZ PHE 129 HZ PHE 129 -5.838 7.156 -2.789 973 H LYS 130 H LYS 130 -11.382 2.227 -1.909 974 HA LYS 130 HA LYS 130 -11.724 4.196 -3.894 975 HB2 LYS 130 2HB LYS 130 -13.486 1.822 -3.195 976 HB3 LYS 130 1HB LYS 130 -13.591 2.751 -4.692 977 HG2 LYS 130 2HG LYS 130 -11.310 2.111 -5.308 978 HG3 LYS 130 1HG LYS 130 -11.087 1.295 -3.762 979 HD2 LYS 130 2HD LYS 130 -11.580 -0.389 -5.457 980 HD3 LYS 130 1HD LYS 130 -12.952 -0.276 -4.362 981 HE2 LYS 130 2HE LYS 130 -14.285 0.877 -5.991 982 HE3 LYS 130 1HE LYS 130 -12.878 1.293 -6.971 983 HZ1 LYS 130 3HZ LYS 130 -14.363 -1.201 -6.805 984 HZ2 LYS 130 1HZ LYS 130 -12.680 -1.339 -6.974 985 HZ3 LYS 130 2HZ LYS 130 -13.581 -0.479 -8.130 986 H SER 131 H SER 131 -13.895 3.194 -1.244 987 HA SER 131 HA SER 131 -15.968 5.048 -1.825 988 HB2 SER 131 2HB SER 131 -16.733 4.549 0.478 989 HB3 SER 131 1HB SER 131 -16.328 3.081 -0.407 990 HG SER 131 HG SER 131 -15.107 2.735 1.277 991 H TYR 132 H TYR 132 -13.183 5.180 0.387 992 HA TYR 132 HA TYR 132 -13.769 7.688 1.547 993 HB2 TYR 132 2HB TYR 132 -12.123 6.112 2.491 994 HB3 TYR 132 1HB TYR 132 -11.075 6.361 1.096 995 HD1 TYR 132 2HD TYR 132 -12.475 7.944 4.153 996 HD2 TYR 132 1HD TYR 132 -9.805 8.457 0.819 997 HE1 TYR 132 2HE TYR 132 -11.520 9.963 5.223 998 HE2 TYR 132 1HE TYR 132 -8.857 10.475 1.893 999 HH TYR 132 HH TYR 132 -8.946 11.194 4.865 1000 H THR 133 H THR 133 -11.724 6.820 -1.243 1001 HA THR 133 HA THR 133 -10.846 9.422 -1.852 1002 HB THR 133 HB THR 133 -11.286 7.130 -3.796 1003 HG1 THR 133 1HG THR 133 -10.000 6.762 -1.816 1004 HG21 THR 133 3HG2 THR 133 -10.792 9.244 -4.934 1005 HG22 THR 133 1HG2 THR 133 -9.377 8.194 -4.999 1006 HG23 THR 133 2HG2 THR 133 -9.427 9.532 -3.853 1007 H GLU 134 H GLU 134 -13.643 7.579 -3.071 1008 HA GLU 134 HA GLU 134 -14.571 9.619 -4.832 1009 HB2 GLU 134 2HB GLU 134 -15.156 7.190 -4.993 1010 HB3 GLU 134 1HB GLU 134 -16.139 7.361 -3.544 1011 HG2 GLU 134 2HG GLU 134 -17.606 7.519 -5.480 1012 HG3 GLU 134 1HG GLU 134 -17.507 9.119 -4.753 1013 H ASN 135 H ASN 135 -15.140 8.893 -1.426 1014 HA ASN 135 HA ASN 135 -17.384 10.570 -1.015 1015 HB2 ASN 135 2HB ASN 135 -16.633 8.851 0.611 1016 HB3 ASN 135 1HB ASN 135 -15.207 9.819 0.970 1017 HD21 ASN 135 1HD2 ASN 135 -15.816 10.250 3.193 1018 HD22 ASN 135 2HD2 ASN 135 -17.149 11.226 3.588 1019 H ASN 136 H ASN 136 -14.317 11.421 -2.005 1020 HA ASN 136 HA ASN 136 -13.679 13.706 -0.501 1021 HB2 ASN 136 2HB ASN 136 -12.361 14.398 -2.476 1022 HB3 ASN 136 1HB ASN 136 -12.132 12.687 -2.125 1023 HD21 ASN 136 1HD2 ASN 136 -11.666 13.740 -4.756 1024 HD22 ASN 136 2HD2 ASN 136 -12.841 13.100 -5.799 1025 H LEU 137 H LEU 137 -16.161 13.151 -2.831 1026 HA LEU 137 HA LEU 137 -17.441 15.658 -2.331 1027 HB2 LEU 137 2HB LEU 137 -17.273 16.644 -4.546 1028 HB3 LEU 137 1HB LEU 137 -15.675 16.454 -3.841 1029 HG LEU 137 HG LEU 137 -15.995 14.006 -5.224 1030 HD11 LEU 137 1HD1 LEU 137 -18.077 14.884 -6.274 1031 HD12 LEU 137 2HD1 LEU 137 -16.815 14.532 -7.452 1032 HD13 LEU 137 3HD1 LEU 137 -17.141 16.200 -6.982 1033 HD21 LEU 137 3HD2 LEU 137 -13.956 15.415 -5.227 1034 HD22 LEU 137 1HD2 LEU 137 -14.750 16.560 -6.308 1035 HD23 LEU 137 2HD2 LEU 137 -14.398 14.923 -6.862 1036 H GLU 138 H GLU 138 -19.532 15.773 -3.256 1037 HA GLU 138 HA GLU 138 -20.565 13.815 -5.063 1038 HB2 GLU 138 2HB GLU 138 -22.048 12.629 -3.424 1039 HB3 GLU 138 1HB GLU 138 -20.337 12.285 -3.177 1040 HG2 GLU 138 2HG GLU 138 -20.248 13.965 -1.367 1041 HG3 GLU 138 1HG GLU 138 -21.960 14.316 -1.599 1042 H HIS 139 H HIS 139 -20.563 16.715 -4.467 1043 HA HIS 139 HA HIS 139 -21.979 18.517 -4.492 1044 HB2 HIS 139 2HB HIS 139 -22.718 17.362 -6.569 1045 HB3 HIS 139 1HB HIS 139 -23.932 16.490 -5.637 1046 HD2 HIS 139 2HD HIS 139 -23.366 20.066 -7.130 1047 HE1 HIS 139 1HE HIS 139 -27.119 20.068 -5.195 1048 HE2 HIS 139 2HE HIS 139 -25.567 21.404 -6.699 1049 H HIS 140 H HIS 140 -22.189 18.893 -2.282 1050 HA HIS 140 HA HIS 140 -24.840 18.489 -1.166 1051 HB2 HIS 140 2HB HIS 140 -24.048 17.315 0.862 1052 HB3 HIS 140 1HB HIS 140 -23.788 16.345 -0.587 1053 HD2 HIS 140 2HD HIS 140 -21.723 17.855 2.297 1054 HE1 HIS 140 1HE HIS 140 -18.950 16.509 -0.587 1055 HE2 HIS 140 2HE HIS 140 -19.207 17.380 1.784 1056 H HIS 141 H HIS 141 -25.275 19.876 0.550 1057 HA HIS 141 HA HIS 141 -23.707 22.273 0.684 1058 HB2 HIS 141 2HB HIS 141 -25.367 22.950 2.408 1059 HB3 HIS 141 1HB HIS 141 -26.140 22.331 0.949 1060 HD2 HIS 141 2HD HIS 141 -25.759 21.363 4.718 1061 HE1 HIS 141 1HE HIS 141 -28.159 18.421 2.870 1062 HE2 HIS 141 2HE HIS 141 -27.283 19.276 5.096 1063 H HIS 142 H HIS 142 -22.526 23.096 2.446 1064 HA HIS 142 HA HIS 142 -20.937 21.209 3.872 1065 HB2 HIS 142 2HB HIS 142 -21.303 24.184 4.366 1066 HB3 HIS 142 1HB HIS 142 -19.994 23.186 4.997 1067 HD2 HIS 142 2HD HIS 142 -20.711 25.291 1.902 1068 HE1 HIS 142 1HE HIS 142 -17.591 22.669 0.803 1069 HE2 HIS 142 2HE HIS 142 -18.893 24.737 0.112 1070 H HIS 143 H HIS 143 -21.044 20.491 5.972 1071 HA HIS 143 HA HIS 143 -23.568 20.368 7.248 1072 HB2 HIS 143 2HB HIS 143 -21.777 18.669 7.547 1073 HB3 HIS 143 1HB HIS 143 -20.818 19.848 8.440 1074 HD2 HIS 143 2HD HIS 143 -21.420 19.942 11.150 1075 HE1 HIS 143 1HE HIS 143 -25.061 17.808 11.012 1076 HE2 HIS 143 2HE HIS 143 -23.361 18.900 12.552 1077 H HIS 144 H HIS 144 -20.654 22.294 7.952 1078 HA HIS 144 HA HIS 144 -21.642 23.600 10.261 1079 HB2 HIS 144 2HB HIS 144 -19.608 24.581 8.232 1080 HB3 HIS 144 1HB HIS 144 -19.831 25.219 9.861 1081 HD2 HIS 144 2HD HIS 144 -17.656 22.645 8.176 1082 HE1 HIS 144 1HE HIS 144 -17.941 21.364 12.189 1083 HE2 HIS 144 2HE HIS 144 -16.695 21.042 10.000 Start of MODEL 7 1 H1 GLY 1 1HT GLY 1 3.382 -21.829 -2.060 2 H2 GLY 1 2HT GLY 1 2.397 -22.498 -3.273 3 H3 GLY 1 3HT GLY 1 1.704 -21.592 -2.014 4 HA2 GLY 1 2HA GLY 1 3.732 -20.233 -3.590 5 HA3 GLY 1 1HA GLY 1 2.203 -20.572 -4.403 6 H ASN 2 H ASN 2 0.219 -20.122 -2.924 7 HA ASN 2 HA ASN 2 -1.111 -18.522 -1.952 8 HB2 ASN 2 2HB ASN 2 1.352 -17.922 -0.275 9 HB3 ASN 2 1HB ASN 2 -0.327 -17.595 0.149 10 HD21 ASN 2 1HD2 ASN 2 -1.629 -19.943 -0.453 11 HD22 ASN 2 2HD2 ASN 2 -0.976 -21.234 0.431 12 H LYS 3 H LYS 3 0.380 -17.772 -4.314 13 HA LYS 3 HA LYS 3 1.442 -15.123 -4.002 14 HB2 LYS 3 2HB LYS 3 1.974 -16.793 -5.887 15 HB3 LYS 3 1HB LYS 3 0.427 -16.353 -6.603 16 HG2 LYS 3 2HG LYS 3 1.154 -13.969 -6.655 17 HG3 LYS 3 1HG LYS 3 2.701 -14.440 -5.961 18 HD2 LYS 3 2HD LYS 3 3.154 -15.877 -7.916 19 HD3 LYS 3 1HD LYS 3 1.604 -15.409 -8.619 20 HE2 LYS 3 2HE LYS 3 3.435 -14.058 -9.578 21 HE3 LYS 3 1HE LYS 3 2.333 -13.041 -8.649 22 HZ1 LYS 3 3HZ LYS 3 3.845 -12.722 -7.012 23 HZ2 LYS 3 1HZ LYS 3 4.932 -12.961 -8.293 24 HZ3 LYS 3 2HZ LYS 3 4.584 -14.237 -7.227 25 H ILE 4 H ILE 4 -0.780 -14.860 -2.661 26 HA ILE 4 HA ILE 4 -3.128 -14.192 -4.108 27 HB ILE 4 HB ILE 4 -2.223 -13.172 -1.382 28 HG12 ILE 4 2HG1 ILE 4 -4.003 -15.569 -2.050 29 HG13 ILE 4 1HG1 ILE 4 -2.297 -15.711 -1.637 30 HG21 ILE 4 1HG2 ILE 4 -4.973 -13.342 -2.686 31 HG22 ILE 4 2HG2 ILE 4 -4.089 -11.864 -2.312 32 HG23 ILE 4 3HG2 ILE 4 -4.685 -12.875 -1.014 33 HD11 ILE 4 3HD1 ILE 4 -4.443 -14.539 0.149 34 HD12 ILE 4 1HD1 ILE 4 -2.726 -14.627 0.542 35 HD13 ILE 4 2HD1 ILE 4 -3.662 -16.105 0.340 36 H THR 5 H THR 5 -3.738 -12.338 -5.056 37 HA THR 5 HA THR 5 -2.103 -9.896 -4.776 38 HB THR 5 HB THR 5 -1.256 -10.959 -6.801 39 HG1 THR 5 1HG THR 5 -3.049 -8.808 -7.111 40 HG21 THR 5 3HG2 THR 5 -2.747 -11.552 -8.657 41 HG22 THR 5 1HG2 THR 5 -4.150 -11.087 -7.700 42 HG23 THR 5 2HG2 THR 5 -3.171 -12.469 -7.215 43 H VAL 6 H VAL 6 -3.179 -8.005 -5.201 44 HA VAL 6 HA VAL 6 -6.122 -8.123 -5.616 45 HB VAL 6 HB VAL 6 -6.406 -6.450 -3.790 46 HG11 VAL 6 1HG1 VAL 6 -5.079 -9.035 -2.894 47 HG12 VAL 6 2HG1 VAL 6 -6.769 -8.873 -3.370 48 HG13 VAL 6 3HG1 VAL 6 -6.176 -8.045 -1.933 49 HG21 VAL 6 3HG2 VAL 6 -4.098 -5.553 -3.755 50 HG22 VAL 6 1HG2 VAL 6 -3.491 -7.108 -3.201 51 HG23 VAL 6 2HG2 VAL 6 -4.541 -6.154 -2.160 52 H GLU 7 H GLU 7 -7.024 -6.050 -6.185 53 HA GLU 7 HA GLU 7 -5.129 -4.090 -7.360 54 HB2 GLU 7 2HB GLU 7 -7.466 -5.354 -8.854 55 HB3 GLU 7 1HB GLU 7 -6.416 -4.066 -9.453 56 HG2 GLU 7 2HG GLU 7 -4.461 -5.601 -9.244 57 HG3 GLU 7 1HG GLU 7 -5.549 -6.882 -8.722 58 H VAL 8 H VAL 8 -6.135 -2.067 -7.856 59 HA VAL 8 HA VAL 8 -8.812 -1.507 -6.793 60 HB VAL 8 HB VAL 8 -7.459 -1.302 -4.778 61 HG11 VAL 8 1HG1 VAL 8 -5.676 0.547 -6.390 62 HG12 VAL 8 2HG1 VAL 8 -5.263 -1.075 -5.839 63 HG13 VAL 8 3HG1 VAL 8 -5.518 0.207 -4.667 64 HG21 VAL 8 3HG2 VAL 8 -7.956 0.986 -4.154 65 HG22 VAL 8 1HG2 VAL 8 -9.212 0.492 -5.287 66 HG23 VAL 8 2HG2 VAL 8 -7.893 1.529 -5.828 67 H THR 9 H THR 9 -9.719 0.271 -7.733 68 HA THR 9 HA THR 9 -8.273 1.450 -10.027 69 HB THR 9 HB THR 9 -11.208 1.737 -9.232 70 HG1 THR 9 1HG THR 9 -10.855 -0.386 -9.640 71 HG21 THR 9 3HG2 THR 9 -9.727 2.233 -11.841 72 HG22 THR 9 1HG2 THR 9 -10.397 3.472 -10.781 73 HG23 THR 9 2HG2 THR 9 -11.470 2.360 -11.621 74 H VAL 10 H VAL 10 -7.377 3.411 -9.801 75 HA VAL 10 HA VAL 10 -8.477 5.348 -7.805 76 HB VAL 10 HB VAL 10 -5.540 4.911 -8.495 77 HG11 VAL 10 1HG1 VAL 10 -6.015 7.240 -7.894 78 HG12 VAL 10 2HG1 VAL 10 -5.192 6.461 -6.549 79 HG13 VAL 10 3HG1 VAL 10 -6.933 6.723 -6.481 80 HG21 VAL 10 3HG2 VAL 10 -5.377 4.036 -6.173 81 HG22 VAL 10 1HG2 VAL 10 -6.423 3.038 -7.179 82 HG23 VAL 10 2HG2 VAL 10 -7.131 4.156 -6.012 83 H TYR 11 H TYR 11 -9.155 7.123 -8.785 84 HA TYR 11 HA TYR 11 -8.383 7.702 -11.570 85 HB2 TYR 11 2HB TYR 11 -10.776 7.780 -10.832 86 HB3 TYR 11 1HB TYR 11 -10.377 9.095 -9.735 87 HD1 TYR 11 2HD TYR 11 -10.431 8.066 -13.316 88 HD2 TYR 11 1HD TYR 11 -10.105 11.380 -10.585 89 HE1 TYR 11 2HE TYR 11 -10.610 9.646 -15.205 90 HE2 TYR 11 1HE TYR 11 -10.281 12.957 -12.490 91 HH TYR 11 HH TYR 11 -11.076 11.854 -15.717 92 H ALA 12 H ALA 12 -6.220 8.351 -11.171 93 HA ALA 12 HA ALA 12 -5.873 11.147 -10.720 94 HB1 ALA 12 1HB ALA 12 -4.436 11.025 -8.722 95 HB2 ALA 12 2HB ALA 12 -4.758 9.296 -8.581 96 HB3 ALA 12 3HB ALA 12 -6.061 10.458 -8.349 97 H ALA 13 H ALA 13 -3.773 11.852 -11.261 98 HA ALA 13 HA ALA 13 -2.427 10.252 -13.182 99 HB1 ALA 13 1HB ALA 13 -2.491 12.831 -12.955 100 HB2 ALA 13 2HB ALA 13 -0.961 12.111 -13.439 101 HB3 ALA 13 3HB ALA 13 -1.197 12.648 -11.772 102 H ILE 14 H ILE 14 -0.654 8.932 -13.008 103 HA ILE 14 HA ILE 14 -0.023 7.628 -10.656 104 HB ILE 14 HB ILE 14 0.527 6.766 -12.882 105 HG12 ILE 14 2HG1 ILE 14 3.090 7.093 -11.240 106 HG13 ILE 14 1HG1 ILE 14 1.784 6.001 -10.779 107 HG21 ILE 14 1HG2 ILE 14 2.812 8.782 -12.941 108 HG22 ILE 14 2HG2 ILE 14 1.292 9.009 -13.803 109 HG23 ILE 14 3HG2 ILE 14 2.339 7.661 -14.218 110 HD11 ILE 14 3HD1 ILE 14 2.006 4.813 -12.902 111 HD12 ILE 14 1HD1 ILE 14 3.523 4.817 -12.008 112 HD13 ILE 14 2HD1 ILE 14 3.310 5.897 -13.382 113 H GLU 15 H GLU 15 1.510 10.481 -12.049 114 HA GLU 15 HA GLU 15 3.746 10.633 -10.353 115 HB2 GLU 15 2HB GLU 15 3.767 13.061 -10.995 116 HB3 GLU 15 1HB GLU 15 3.634 11.971 -12.375 117 HG2 GLU 15 2HG GLU 15 1.172 12.315 -12.382 118 HG3 GLU 15 1HG GLU 15 1.333 13.453 -11.056 119 H LYS 16 H LYS 16 0.416 11.695 -9.956 120 HA LYS 16 HA LYS 16 0.898 13.170 -7.523 121 HB2 LYS 16 2HB LYS 16 -1.032 13.612 -9.062 122 HB3 LYS 16 1HB LYS 16 -1.720 12.051 -8.611 123 HG2 LYS 16 2HG LYS 16 -1.819 12.772 -6.244 124 HG3 LYS 16 1HG LYS 16 -1.096 14.320 -6.686 125 HD2 LYS 16 2HD LYS 16 -3.033 14.806 -8.136 126 HD3 LYS 16 1HD LYS 16 -3.756 13.260 -7.690 127 HE2 LYS 16 2HE LYS 16 -3.810 13.968 -5.319 128 HE3 LYS 16 1HE LYS 16 -3.090 15.517 -5.767 129 HZ1 LYS 16 3HZ LYS 16 -5.048 16.280 -6.422 130 HZ2 LYS 16 1HZ LYS 16 -5.758 14.912 -5.714 131 HZ3 LYS 16 2HZ LYS 16 -5.363 14.904 -7.366 132 H VAL 17 H VAL 17 -0.485 9.974 -8.322 133 HA VAL 17 HA VAL 17 -1.007 9.157 -5.664 134 HB VAL 17 HB VAL 17 -0.368 7.413 -8.079 135 HG11 VAL 17 1HG1 VAL 17 -1.771 6.822 -5.439 136 HG12 VAL 17 2HG1 VAL 17 -0.266 6.102 -6.016 137 HG13 VAL 17 3HG1 VAL 17 -1.780 5.739 -6.828 138 HG21 VAL 17 3HG2 VAL 17 -2.823 7.338 -8.365 139 HG22 VAL 17 1HG2 VAL 17 -2.223 8.990 -8.497 140 HG23 VAL 17 2HG2 VAL 17 -3.019 8.456 -7.016 141 H TRP 18 H TRP 18 1.827 8.685 -7.771 142 HA TRP 18 HA TRP 18 3.317 7.015 -6.121 143 HB2 TRP 18 2HB TRP 18 3.972 7.617 -8.430 144 HB3 TRP 18 1HB TRP 18 4.344 9.255 -7.902 145 HD1 TRP 18 HD TRP 18 6.363 9.491 -6.058 146 HE1 TRP 18 1HE TRP 18 8.485 8.058 -5.740 147 HE3 TRP 18 3HE TRP 18 5.008 5.326 -8.674 148 HZ2 TRP 18 2HZ TRP 18 9.478 5.495 -6.510 149 HZ3 TRP 18 3HZ TRP 18 6.562 3.407 -8.870 150 HH2 TRP 18 HH TRP 18 8.792 3.486 -7.791 151 H LYS 19 H LYS 19 2.958 10.548 -6.020 152 HA LYS 19 HA LYS 19 4.986 11.062 -4.136 153 HB2 LYS 19 2HB LYS 19 3.852 12.781 -5.576 154 HB3 LYS 19 1HB LYS 19 2.404 12.622 -4.583 155 HG2 LYS 19 2HG LYS 19 3.697 13.315 -2.587 156 HG3 LYS 19 1HG LYS 19 5.144 13.455 -3.580 157 HD2 LYS 19 2HD LYS 19 4.040 15.205 -4.932 158 HD3 LYS 19 1HD LYS 19 2.591 15.057 -3.936 159 HE2 LYS 19 2HE LYS 19 3.990 16.959 -3.188 160 HE3 LYS 19 1HE LYS 19 3.889 15.718 -1.938 161 HZ1 LYS 19 3HZ LYS 19 6.182 16.765 -2.878 162 HZ2 LYS 19 1HZ LYS 19 6.053 15.354 -3.810 163 HZ3 LYS 19 2HZ LYS 19 6.052 15.251 -2.114 164 H TYR 20 H TYR 20 1.423 10.810 -3.632 165 HA TYR 20 HA TYR 20 1.628 10.949 -0.787 166 HB2 TYR 20 2HB TYR 20 -0.627 9.991 -2.583 167 HB3 TYR 20 1HB TYR 20 -0.782 10.236 -0.848 168 HD1 TYR 20 2HD TYR 20 0.000 12.558 0.090 169 HD2 TYR 20 1HD TYR 20 -1.112 11.889 -4.018 170 HE1 TYR 20 2HE TYR 20 -0.406 14.974 -0.201 171 HE2 TYR 20 1HE TYR 20 -1.519 14.316 -4.290 172 HH TYR 20 HH TYR 20 -0.454 16.533 -2.864 173 H TRP 21 H TRP 21 1.234 8.271 -3.062 174 HA TRP 21 HA TRP 21 0.842 6.233 -1.186 175 HB2 TRP 21 2HB TRP 21 0.516 6.033 -3.672 176 HB3 TRP 21 1HB TRP 21 2.268 5.980 -3.871 177 HD1 TRP 21 HD TRP 21 3.495 3.726 -3.225 178 HE1 TRP 21 1HE TRP 21 2.658 1.388 -2.534 179 HE3 TRP 21 3HE TRP 21 -1.415 4.784 -2.347 180 HZ2 TRP 21 2HZ TRP 21 0.224 0.142 -1.705 181 HZ3 TRP 21 3HZ TRP 21 -2.972 3.006 -1.605 182 HH2 TRP 21 HH TRP 21 -2.159 0.685 -1.285 183 H ASN 22 H ASN 22 3.639 8.055 -1.859 184 HA ASN 22 HA ASN 22 5.466 6.110 -0.524 185 HB2 ASN 22 2HB ASN 22 6.045 8.455 -2.358 186 HB3 ASN 22 1HB ASN 22 7.261 7.416 -1.619 187 HD21 ASN 22 1HD2 ASN 22 5.479 4.982 -2.001 188 HD22 ASN 22 2HD2 ASN 22 5.586 4.624 -3.654 189 H GLU 23 H GLU 23 3.934 9.227 -0.345 190 HA GLU 23 HA GLU 23 5.801 10.448 1.385 191 HB2 GLU 23 2HB GLU 23 4.005 11.726 0.140 192 HB3 GLU 23 1HB GLU 23 2.849 11.119 1.313 193 HG2 GLU 23 2HG GLU 23 3.535 13.314 2.048 194 HG3 GLU 23 1HG GLU 23 4.278 12.155 3.134 195 HA PRO 24 HA PRO 24 4.615 7.813 4.929 196 HB2 PRO 24 2HB PRO 24 6.201 8.940 6.891 197 HB3 PRO 24 1HB PRO 24 6.836 7.846 5.650 198 HG2 PRO 24 2HG PRO 24 6.882 10.853 5.712 199 HG3 PRO 24 1HG PRO 24 8.186 9.725 5.281 200 HD2 PRO 24 2HD PRO 24 6.713 10.999 3.379 201 HD3 PRO 24 1HD PRO 24 7.315 9.335 3.111 202 H ALA 25 H ALA 25 4.695 11.352 5.188 203 HA ALA 25 HA ALA 25 3.111 11.666 7.488 204 HB1 ALA 25 1HB ALA 25 2.703 13.945 6.696 205 HB2 ALA 25 2HB ALA 25 3.260 13.501 5.082 206 HB3 ALA 25 3HB ALA 25 4.391 13.497 6.434 207 H HIS 26 H HIS 26 2.249 11.023 4.163 208 HA HIS 26 HA HIS 26 -0.591 11.489 4.567 209 HB2 HIS 26 2HB HIS 26 0.586 11.812 2.357 210 HB3 HIS 26 1HB HIS 26 0.789 10.065 2.252 211 HD2 HIS 26 2HD HIS 26 -2.070 12.738 1.963 212 HE1 HIS 26 1HE HIS 26 -3.740 8.969 1.058 213 HE2 HIS 26 2HE HIS 26 -4.178 11.470 1.093 214 H ILE 27 H ILE 27 1.529 8.610 4.155 215 HA ILE 27 HA ILE 27 -0.536 6.682 4.240 216 HB ILE 27 HB ILE 27 2.389 6.486 5.071 217 HG12 ILE 27 2HG1 ILE 27 1.034 5.555 2.487 218 HG13 ILE 27 1HG1 ILE 27 1.809 7.122 2.648 219 HG21 ILE 27 1HG2 ILE 27 0.316 4.293 4.607 220 HG22 ILE 27 2HG2 ILE 27 1.229 4.599 6.084 221 HG23 ILE 27 3HG2 ILE 27 2.048 3.986 4.664 222 HD11 ILE 27 3HD1 ILE 27 3.175 4.448 3.059 223 HD12 ILE 27 1HD1 ILE 27 3.945 6.023 3.238 224 HD13 ILE 27 2HD1 ILE 27 3.364 5.502 1.665 225 H MET 28 H MET 28 1.522 7.974 6.852 226 HA MET 28 HA MET 28 0.434 6.398 8.912 227 HB2 MET 28 2HB MET 28 1.593 7.892 10.421 228 HB3 MET 28 1HB MET 28 2.592 7.605 9.005 229 HG2 MET 28 2HG MET 28 2.783 9.928 9.143 230 HG3 MET 28 1HG MET 28 1.371 9.823 8.113 231 HE1 MET 28 3HE MET 28 1.623 10.950 12.538 232 HE2 MET 28 1HE MET 28 2.764 11.459 11.291 233 HE3 MET 28 2HE MET 28 2.608 9.749 11.698 234 H LYS 29 H LYS 29 -1.112 8.705 7.089 235 HA LYS 29 HA LYS 29 -2.762 9.806 9.255 236 HB2 LYS 29 2HB LYS 29 -1.988 11.183 7.281 237 HB3 LYS 29 1HB LYS 29 -3.045 10.223 6.260 238 HG2 LYS 29 2HG LYS 29 -4.993 10.879 7.591 239 HG3 LYS 29 1HG LYS 29 -3.953 11.821 8.660 240 HD2 LYS 29 2HD LYS 29 -3.283 13.244 6.748 241 HD3 LYS 29 1HD LYS 29 -4.348 12.313 5.693 242 HE2 LYS 29 2HE LYS 29 -6.292 12.970 7.056 243 HE3 LYS 29 1HE LYS 29 -5.236 13.879 8.139 244 HZ1 LYS 29 3HZ LYS 29 -5.855 15.524 6.733 245 HZ2 LYS 29 1HZ LYS 29 -6.070 14.487 5.408 246 HZ3 LYS 29 2HZ LYS 29 -4.504 14.952 5.875 247 H TRP 30 H TRP 30 -2.900 7.382 6.742 248 HA TRP 30 HA TRP 30 -5.551 6.462 7.713 249 HB2 TRP 30 2HB TRP 30 -6.283 6.045 5.421 250 HB3 TRP 30 1HB TRP 30 -5.903 7.753 5.617 251 HD1 TRP 30 HD TRP 30 -3.627 8.637 4.481 252 HE1 TRP 30 1HE TRP 30 -2.194 7.713 2.543 253 HE3 TRP 30 3HE TRP 30 -5.565 3.928 4.118 254 HZ2 TRP 30 2HZ TRP 30 -1.918 5.301 1.036 255 HZ3 TRP 30 3HZ TRP 30 -4.712 2.347 2.427 256 HH2 TRP 30 HH TRP 30 -2.896 3.024 0.878 257 H CYS 31 H CYS 31 -2.599 5.620 8.011 258 HA CYS 31 HA CYS 31 -2.098 3.292 6.560 259 HB2 CYS 31 2HB CYS 31 -0.654 2.620 8.445 260 HB3 CYS 31 1HB CYS 31 -0.442 4.326 8.077 261 HG CYS 31 HG CYS 31 -2.463 3.608 10.325 262 H GLN 32 H GLN 32 -2.932 1.295 6.594 263 HA GLN 32 HA GLN 32 -4.167 -0.526 7.152 264 HB2 GLN 32 2HB GLN 32 -2.947 -0.208 9.386 265 HB3 GLN 32 1HB GLN 32 -4.409 0.566 9.979 266 HG2 GLN 32 2HG GLN 32 -5.710 -1.469 9.439 267 HG3 GLN 32 1HG GLN 32 -4.235 -2.253 8.877 268 HE21 GLN 32 1HE2 GLN 32 -5.587 -3.479 10.966 269 HE22 GLN 32 2HE2 GLN 32 -4.719 -3.285 12.407 270 H ALA 33 H ALA 33 -5.320 2.628 8.041 271 HA ALA 33 HA ALA 33 -7.378 3.613 8.035 272 HB1 ALA 33 1HB ALA 33 -7.259 2.979 5.644 273 HB2 ALA 33 2HB ALA 33 -8.912 2.905 6.253 274 HB3 ALA 33 3HB ALA 33 -7.991 1.422 6.031 275 H SER 34 H SER 34 -6.913 1.753 10.133 276 HA SER 34 HA SER 34 -9.646 0.707 10.561 277 HB2 SER 34 2HB SER 34 -8.210 -1.193 10.175 278 HB3 SER 34 1HB SER 34 -7.057 -0.603 11.368 279 HG SER 34 HG SER 34 -8.294 -1.335 12.898 280 HA PRO 35 HA PRO 35 -9.283 3.316 14.219 281 HB2 PRO 35 2HB PRO 35 -11.532 2.589 15.600 282 HB3 PRO 35 1HB PRO 35 -11.619 3.522 14.089 283 HG2 PRO 35 2HG PRO 35 -11.976 0.559 14.496 284 HG3 PRO 35 1HG PRO 35 -12.973 1.689 13.547 285 HD2 PRO 35 2HD PRO 35 -11.061 0.093 12.372 286 HD3 PRO 35 1HD PRO 35 -11.463 1.718 11.735 287 H GLU 36 H GLU 36 -9.270 -0.131 14.323 288 HA GLU 36 HA GLU 36 -8.747 -0.392 17.181 289 HB2 GLU 36 2HB GLU 36 -8.593 -2.387 14.895 290 HB3 GLU 36 1HB GLU 36 -8.408 -2.792 16.602 291 HG2 GLU 36 2HG GLU 36 -10.681 -1.935 17.051 292 HG3 GLU 36 1HG GLU 36 -10.863 -1.524 15.347 293 H TRP 37 H TRP 37 -6.939 1.046 15.022 294 HA TRP 37 HA TRP 37 -4.412 0.228 16.269 295 HB2 TRP 37 2HB TRP 37 -4.942 0.049 13.277 296 HB3 TRP 37 1HB TRP 37 -3.321 0.067 13.980 297 HD1 TRP 37 HD TRP 37 -6.458 -2.109 13.766 298 HE1 TRP 37 1HE TRP 37 -5.847 -4.506 14.492 299 HE3 TRP 37 3HE TRP 37 -1.691 -1.334 15.395 300 HZ2 TRP 37 2HZ TRP 37 -3.622 -5.908 15.621 301 HZ3 TRP 37 3HZ TRP 37 -0.347 -3.211 16.292 302 HH2 TRP 37 HH TRP 37 -1.305 -5.493 16.407 303 H HIS 38 H HIS 38 -2.703 1.706 15.830 304 HA HIS 38 HA HIS 38 -3.406 4.308 14.667 305 HB2 HIS 38 2HB HIS 38 -4.147 4.424 17.067 306 HB3 HIS 38 1HB HIS 38 -2.503 4.035 17.569 307 HD2 HIS 38 2HD HIS 38 -0.859 6.275 17.767 308 HE1 HIS 38 1HE HIS 38 -3.253 8.942 15.533 309 HE2 HIS 38 2HE HIS 38 -1.140 8.733 16.927 310 H VAL 39 H VAL 39 -1.509 5.717 14.596 311 HA VAL 39 HA VAL 39 1.077 4.273 14.569 312 HB VAL 39 HB VAL 39 0.284 4.345 12.306 313 HG11 VAL 39 1HG1 VAL 39 0.218 7.389 12.363 314 HG12 VAL 39 2HG1 VAL 39 -1.211 6.426 12.685 315 HG13 VAL 39 3HG1 VAL 39 -0.392 6.283 11.155 316 HG21 VAL 39 3HG2 VAL 39 2.734 4.762 12.840 317 HG22 VAL 39 1HG2 VAL 39 2.424 6.489 12.634 318 HG23 VAL 39 2HG2 VAL 39 2.207 5.383 11.278 319 HA PRO 40 HA PRO 40 1.631 8.179 16.961 320 HB2 PRO 40 2HB PRO 40 3.509 7.306 18.753 321 HB3 PRO 40 1HB PRO 40 1.786 6.918 18.934 322 HG2 PRO 40 2HG PRO 40 4.005 5.203 17.865 323 HG3 PRO 40 1HG PRO 40 2.650 4.755 18.922 324 HD2 PRO 40 2HD PRO 40 2.680 4.288 16.183 325 HD3 PRO 40 1HD PRO 40 1.177 4.451 17.127 326 H ALA 41 H ALA 41 3.674 6.380 14.926 327 HA ALA 41 HA ALA 41 5.222 8.676 14.181 328 HB1 ALA 41 1HB ALA 41 7.427 7.795 14.843 329 HB2 ALA 41 2HB ALA 41 6.640 6.435 15.650 330 HB3 ALA 41 3HB ALA 41 6.408 8.074 16.255 331 H ALA 42 H ALA 42 6.500 8.299 12.330 332 HA ALA 42 HA ALA 42 6.730 5.680 11.157 333 HB1 ALA 42 1HB ALA 42 5.356 6.119 9.180 334 HB2 ALA 42 2HB ALA 42 4.881 7.682 9.848 335 HB3 ALA 42 3HB ALA 42 4.378 6.196 10.642 336 H GLN 43 H GLN 43 8.210 5.613 9.482 337 HA GLN 43 HA GLN 43 9.363 8.161 8.499 338 HB2 GLN 43 2HB GLN 43 10.965 5.895 9.750 339 HB3 GLN 43 1HB GLN 43 11.643 7.304 8.930 340 HG2 GLN 43 2HG GLN 43 10.522 8.781 10.602 341 HG3 GLN 43 1HG GLN 43 9.944 7.346 11.442 342 HE21 GLN 43 1HE2 GLN 43 11.380 8.754 13.112 343 HE22 GLN 43 2HE2 GLN 43 12.982 8.212 13.262 344 H ASN 44 H ASN 44 10.457 7.948 6.547 345 HA ASN 44 HA ASN 44 10.726 5.417 5.184 346 HB2 ASN 44 2HB ASN 44 8.268 5.875 4.944 347 HB3 ASN 44 1HB ASN 44 8.662 7.381 4.120 348 HD21 ASN 44 1HD2 ASN 44 7.270 5.936 2.445 349 HD22 ASN 44 2HD2 ASN 44 8.214 5.042 1.353 350 H ASP 45 H ASP 45 12.283 5.582 3.658 351 HA ASP 45 HA ASP 45 13.040 8.253 2.578 352 HB2 ASP 45 2HB ASP 45 14.559 7.648 4.461 353 HB3 ASP 45 1HB ASP 45 14.975 6.157 3.624 354 H LEU 46 H LEU 46 12.273 7.875 0.546 355 HA LEU 46 HA LEU 46 12.542 5.400 -0.843 356 HB2 LEU 46 2HB LEU 46 11.811 8.237 -1.595 357 HB3 LEU 46 1HB LEU 46 12.068 7.068 -2.880 358 HG LEU 46 HG LEU 46 9.665 7.256 -2.218 359 HD11 LEU 46 1HD1 LEU 46 10.958 4.949 -2.895 360 HD12 LEU 46 2HD1 LEU 46 9.236 5.035 -2.578 361 HD13 LEU 46 3HD1 LEU 46 10.329 4.471 -1.320 362 HD21 LEU 46 3HD2 LEU 46 10.481 6.004 0.430 363 HD22 LEU 46 1HD2 LEU 46 8.903 6.639 -0.025 364 HD23 LEU 46 2HD2 LEU 46 10.244 7.741 0.234 365 H LYS 47 H LYS 47 14.621 4.697 -0.853 366 HA LYS 47 HA LYS 47 16.336 5.739 -2.890 367 HB2 LYS 47 2HB LYS 47 16.765 7.354 -0.985 368 HB3 LYS 47 1HB LYS 47 17.342 5.999 -0.017 369 HG2 LYS 47 2HG LYS 47 19.088 5.529 -1.703 370 HG3 LYS 47 1HG LYS 47 18.494 6.863 -2.695 371 HD2 LYS 47 2HD LYS 47 18.996 8.449 -0.866 372 HD3 LYS 47 1HD LYS 47 19.604 7.116 0.120 373 HE2 LYS 47 2HE LYS 47 21.471 8.273 -0.982 374 HE3 LYS 47 1HE LYS 47 21.314 6.635 -1.621 375 HZ1 LYS 47 3HZ LYS 47 19.876 8.838 -2.931 376 HZ2 LYS 47 1HZ LYS 47 20.454 7.387 -3.592 377 HZ3 LYS 47 2HZ LYS 47 21.537 8.644 -3.229 378 H ALA 48 H ALA 48 17.899 4.254 -3.463 379 HA ALA 48 HA ALA 48 17.468 1.549 -2.794 380 HB1 ALA 48 1HB ALA 48 19.904 2.853 -4.048 381 HB2 ALA 48 2HB ALA 48 18.480 2.290 -4.921 382 HB3 ALA 48 3HB ALA 48 19.520 1.131 -4.093 383 H GLY 49 H GLY 49 18.408 0.221 -1.304 384 HA2 GLY 49 2HA GLY 49 19.691 -0.483 0.475 385 HA3 GLY 49 1HA GLY 49 20.869 0.755 0.050 386 H GLY 50 H GLY 50 17.888 2.196 0.347 387 HA2 GLY 50 2HA GLY 50 18.559 3.518 2.840 388 HA3 GLY 50 1HA GLY 50 17.116 3.772 1.859 389 H THR 51 H THR 51 17.483 3.307 4.808 390 HA THR 51 HA THR 51 15.849 0.843 5.198 391 HB THR 51 HB THR 51 17.392 2.446 7.273 392 HG1 THR 51 1HG THR 51 18.468 1.161 5.435 393 HG21 THR 51 3HG2 THR 51 16.075 -0.298 7.338 394 HG22 THR 51 1HG2 THR 51 15.608 1.118 8.279 395 HG23 THR 51 2HG2 THR 51 17.146 0.319 8.591 396 H PHE 52 H PHE 52 14.058 0.965 6.572 397 HA PHE 52 HA PHE 52 12.956 3.628 7.242 398 HB2 PHE 52 2HB PHE 52 10.810 3.055 6.223 399 HB3 PHE 52 1HB PHE 52 12.072 3.025 4.996 400 HD1 PHE 52 1HD PHE 52 9.792 0.938 7.051 401 HD2 PHE 52 2HD PHE 52 12.820 0.889 3.995 402 HE1 PHE 52 1HE PHE 52 9.239 -1.431 6.540 403 HE2 PHE 52 2HE PHE 52 12.262 -1.473 3.484 404 HZ PHE 52 HZ PHE 52 10.475 -2.631 4.756 405 H THR 53 H THR 53 11.255 3.514 8.805 406 HA THR 53 HA THR 53 10.775 0.945 10.147 407 HB THR 53 HB THR 53 11.897 3.346 11.653 408 HG1 THR 53 1HG THR 53 13.065 0.971 10.680 409 HG21 THR 53 3HG2 THR 53 11.275 0.489 12.501 410 HG22 THR 53 1HG2 THR 53 10.404 1.935 13.011 411 HG23 THR 53 2HG2 THR 53 12.076 1.691 13.508 412 H THR 54 H THR 54 8.685 0.856 10.702 413 HA THR 54 HA THR 54 7.164 3.379 11.127 414 HB THR 54 HB THR 54 6.047 0.842 9.881 415 HG1 THR 54 1HG THR 54 6.587 3.217 8.488 416 HG21 THR 54 3HG2 THR 54 5.007 3.695 10.003 417 HG22 THR 54 1HG2 THR 54 4.413 2.356 10.981 418 HG23 THR 54 2HG2 THR 54 4.195 2.333 9.235 419 H THR 55 H THR 55 6.434 3.509 13.150 420 HA THR 55 HA THR 55 6.300 1.103 14.845 421 HB THR 55 HB THR 55 5.840 4.030 15.574 422 HG1 THR 55 1HG THR 55 7.974 3.268 14.684 423 HG21 THR 55 3HG2 THR 55 6.466 1.567 17.252 424 HG22 THR 55 1HG2 THR 55 4.930 2.432 17.215 425 HG23 THR 55 2HG2 THR 55 6.365 3.216 17.864 426 H MET 56 H MET 56 4.402 0.078 15.182 427 HA MET 56 HA MET 56 1.845 1.578 14.986 428 HB2 MET 56 2HB MET 56 2.423 -1.137 13.744 429 HB3 MET 56 1HB MET 56 0.863 -0.312 13.769 430 HG2 MET 56 2HG MET 56 1.905 1.597 12.510 431 HG3 MET 56 1HG MET 56 3.393 0.662 12.411 432 HE1 MET 56 3HE MET 56 -0.527 0.051 10.130 433 HE2 MET 56 1HE MET 56 0.181 1.571 10.692 434 HE3 MET 56 2HE MET 56 -0.465 0.413 11.851 435 H ALA 57 H ALA 57 0.466 1.092 16.584 436 HA ALA 57 HA ALA 57 0.751 -1.391 18.145 437 HB1 ALA 57 1HB ALA 57 2.228 0.255 19.266 438 HB2 ALA 57 2HB ALA 57 0.839 -0.164 20.268 439 HB3 ALA 57 3HB ALA 57 0.868 1.373 19.402 440 H ALA 58 H ALA 58 -1.094 -1.991 19.199 441 HA ALA 58 HA ALA 58 -3.573 -1.125 18.099 442 HB1 ALA 58 1HB ALA 58 -4.597 -2.645 19.743 443 HB2 ALA 58 2HB ALA 58 -3.038 -2.812 20.553 444 HB3 ALA 58 3HB ALA 58 -3.245 -3.415 18.910 445 H LYS 59 H LYS 59 -5.278 0.044 19.095 446 HA LYS 59 HA LYS 59 -4.538 2.316 20.527 447 HB2 LYS 59 2HB LYS 59 -6.615 2.042 19.147 448 HB3 LYS 59 1HB LYS 59 -7.287 1.011 20.407 449 HG2 LYS 59 2HG LYS 59 -7.118 2.867 22.023 450 HG3 LYS 59 1HG LYS 59 -6.410 3.889 20.779 451 HD2 LYS 59 2HD LYS 59 -8.488 3.686 19.441 452 HD3 LYS 59 1HD LYS 59 -9.191 2.673 20.702 453 HE2 LYS 59 2HE LYS 59 -9.948 5.013 20.945 454 HE3 LYS 59 1HE LYS 59 -8.959 4.532 22.325 455 HZ1 LYS 59 3HZ LYS 59 -7.354 5.965 21.772 456 HZ2 LYS 59 1HZ LYS 59 -8.539 6.729 20.830 457 HZ3 LYS 59 2HZ LYS 59 -7.466 5.622 20.113 458 H ASP 60 H ASP 60 -5.857 -0.793 21.625 459 HA ASP 60 HA ASP 60 -6.055 0.000 24.399 460 HB2 ASP 60 2HB ASP 60 -7.466 -1.791 23.385 461 HB3 ASP 60 1HB ASP 60 -6.029 -2.789 23.186 462 H GLY 61 H GLY 61 -3.495 -0.790 22.357 463 HA2 GLY 61 2HA GLY 61 -1.239 -1.046 22.748 464 HA3 GLY 61 1HA GLY 61 -1.546 -0.704 24.449 465 H SER 62 H SER 62 -3.485 -3.213 23.165 466 HA SER 62 HA SER 62 -2.403 -5.178 24.918 467 HB2 SER 62 2HB SER 62 -3.960 -6.717 23.789 468 HB3 SER 62 1HB SER 62 -4.756 -5.196 24.184 469 HG SER 62 HG SER 62 -5.221 -5.206 22.131 470 H MET 63 H MET 63 -1.911 -4.405 21.522 471 HA MET 63 HA MET 63 0.270 -6.430 21.353 472 HB2 MET 63 2HB MET 63 -1.760 -7.165 20.069 473 HB3 MET 63 1HB MET 63 -1.657 -5.691 19.112 474 HG2 MET 63 2HG MET 63 0.548 -6.342 18.270 475 HG3 MET 63 1HG MET 63 0.575 -7.752 19.331 476 HE1 MET 63 3HE MET 63 0.285 -9.165 15.729 477 HE2 MET 63 1HE MET 63 1.111 -9.313 17.286 478 HE3 MET 63 2HE MET 63 1.190 -7.803 16.384 479 H SER 64 H SER 64 2.042 -5.843 20.126 480 HA SER 64 HA SER 64 2.204 -3.124 19.007 481 HB2 SER 64 2HB SER 64 2.927 -2.880 21.346 482 HB3 SER 64 1HB SER 64 4.083 -4.192 21.131 483 HG SER 64 HG SER 64 4.678 -2.692 19.197 484 H PHE 65 H PHE 65 3.631 -2.968 17.342 485 HA PHE 65 HA PHE 65 5.648 -4.983 16.820 486 HB2 PHE 65 2HB PHE 65 3.518 -6.065 16.002 487 HB3 PHE 65 1HB PHE 65 3.308 -4.724 14.882 488 HD1 PHE 65 1HD PHE 65 5.351 -7.698 15.699 489 HD2 PHE 65 2HD PHE 65 4.831 -4.436 12.947 490 HE1 PHE 65 1HE PHE 65 6.915 -8.783 14.115 491 HE2 PHE 65 2HE PHE 65 6.394 -5.528 11.360 492 HZ PHE 65 HZ PHE 65 7.438 -7.701 11.947 493 H ASP 66 H ASP 66 6.934 -4.424 14.954 494 HA ASP 66 HA ASP 66 6.622 -1.666 13.898 495 HB2 ASP 66 2HB ASP 66 9.155 -2.792 15.145 496 HB3 ASP 66 1HB ASP 66 8.993 -1.220 14.360 497 H PHE 67 H PHE 67 6.965 -1.607 11.763 498 HA PHE 67 HA PHE 67 8.043 -3.985 10.367 499 HB2 PHE 67 2HB PHE 67 6.574 -1.495 9.416 500 HB3 PHE 67 1HB PHE 67 7.170 -2.749 8.332 501 HD1 PHE 67 1HD PHE 67 4.693 -1.949 10.970 502 HD2 PHE 67 2HD PHE 67 6.142 -4.979 8.284 503 HE1 PHE 67 1HE PHE 67 2.673 -3.316 11.418 504 HE2 PHE 67 2HE PHE 67 4.121 -6.341 8.735 505 HZ PHE 67 HZ PHE 67 2.389 -5.512 10.302 506 H GLY 68 H GLY 68 9.967 -3.962 9.370 507 HA2 GLY 68 2HA GLY 68 11.344 -1.459 8.690 508 HA3 GLY 68 1HA GLY 68 12.116 -2.498 9.894 509 H GLY 69 H GLY 69 12.945 -1.768 7.165 510 HA2 GLY 69 2HA GLY 69 13.998 -4.249 6.323 511 HA3 GLY 69 1HA GLY 69 12.616 -3.831 5.310 512 H VAL 70 H VAL 70 14.536 -3.864 3.728 513 HA VAL 70 HA VAL 70 15.595 -1.094 3.414 514 HB VAL 70 HB VAL 70 17.122 -3.661 2.825 515 HG11 VAL 70 1HG1 VAL 70 19.034 -2.082 2.487 516 HG12 VAL 70 2HG1 VAL 70 17.921 -0.729 2.682 517 HG13 VAL 70 3HG1 VAL 70 17.744 -1.824 1.314 518 HG21 VAL 70 3HG2 VAL 70 18.552 -2.967 4.733 519 HG22 VAL 70 1HG2 VAL 70 16.897 -3.287 5.246 520 HG23 VAL 70 2HG2 VAL 70 17.454 -1.624 5.058 521 H TYR 71 H TYR 71 15.468 -0.286 1.397 522 HA TYR 71 HA TYR 71 13.759 -1.580 -0.539 523 HB2 TYR 71 2HB TYR 71 15.421 0.961 -0.685 524 HB3 TYR 71 1HB TYR 71 14.250 0.465 -1.901 525 HD1 TYR 71 1HD TYR 71 11.828 0.036 -1.175 526 HD2 TYR 71 2HD TYR 71 14.646 2.172 1.282 527 HE1 TYR 71 1HE TYR 71 9.968 1.007 0.129 528 HE2 TYR 71 2HE TYR 71 12.771 3.141 2.578 529 HH TYR 71 HH TYR 71 9.382 2.407 1.736 530 H ASP 72 H ASP 72 14.407 -2.997 -2.031 531 HA ASP 72 HA ASP 72 17.208 -3.578 -2.495 532 HB2 ASP 72 2HB ASP 72 14.666 -4.628 -3.787 533 HB3 ASP 72 1HB ASP 72 16.282 -5.276 -4.071 534 H GLN 73 H GLN 73 14.607 -1.850 -4.103 535 HA GLN 73 HA GLN 73 16.458 -0.417 -5.783 536 HB2 GLN 73 2HB GLN 73 16.236 -2.620 -6.996 537 HB3 GLN 73 1HB GLN 73 14.514 -2.302 -7.179 538 HG2 GLN 73 2HG GLN 73 15.036 -0.212 -8.412 539 HG3 GLN 73 1HG GLN 73 16.757 -0.541 -8.225 540 HE21 GLN 73 1HE2 GLN 73 17.643 -1.499 -10.051 541 HE22 GLN 73 2HE2 GLN 73 16.814 -2.530 -11.115 542 H VAL 74 H VAL 74 15.534 1.425 -6.637 543 HA VAL 74 HA VAL 74 12.614 1.870 -6.282 544 HB VAL 74 HB VAL 74 14.780 3.818 -5.397 545 HG11 VAL 74 1HG1 VAL 74 12.856 5.069 -4.444 546 HG12 VAL 74 2HG1 VAL 74 11.753 3.907 -5.174 547 HG13 VAL 74 3HG1 VAL 74 12.745 4.940 -6.198 548 HG21 VAL 74 3HG2 VAL 74 13.950 3.317 -3.104 549 HG22 VAL 74 1HG2 VAL 74 14.670 1.905 -3.870 550 HG23 VAL 74 2HG2 VAL 74 12.915 2.052 -3.770 551 H LYS 75 H LYS 75 11.731 2.772 -8.039 552 HA LYS 75 HA LYS 75 13.324 4.472 -9.849 553 HB2 LYS 75 2HB LYS 75 11.930 1.878 -10.594 554 HB3 LYS 75 1HB LYS 75 12.246 3.135 -11.798 555 HG2 LYS 75 2HG LYS 75 14.664 3.009 -11.230 556 HG3 LYS 75 1HG LYS 75 14.309 1.715 -10.085 557 HD2 LYS 75 2HD LYS 75 13.425 0.322 -11.916 558 HD3 LYS 75 1HD LYS 75 13.760 1.616 -13.068 559 HE2 LYS 75 2HE LYS 75 15.828 0.182 -11.377 560 HE3 LYS 75 1HE LYS 75 15.567 -0.059 -13.104 561 HZ1 LYS 75 3HZ LYS 75 17.023 1.582 -13.388 562 HZ2 LYS 75 1HZ LYS 75 16.982 2.024 -11.750 563 HZ3 LYS 75 2HZ LYS 75 15.820 2.641 -12.824 564 H THR 76 H THR 76 12.214 6.272 -9.990 565 HA THR 76 HA THR 76 9.594 6.690 -9.144 566 HB THR 76 HB THR 76 9.764 8.858 -10.284 567 HG1 THR 76 1HG THR 76 10.964 7.618 -12.079 568 HG21 THR 76 3HG2 THR 76 11.852 9.641 -9.247 569 HG22 THR 76 1HG2 THR 76 12.419 7.977 -9.102 570 HG23 THR 76 2HG2 THR 76 11.022 8.517 -8.170 571 H ASN 77 H ASN 77 7.649 6.496 -10.078 572 HA ASN 77 HA ASN 77 6.030 5.812 -11.545 573 HB2 ASN 77 2HB ASN 77 7.894 7.144 -13.525 574 HB3 ASN 77 1HB ASN 77 6.210 6.726 -13.836 575 HD21 ASN 77 1HD2 ASN 77 7.805 9.410 -13.419 576 HD22 ASN 77 2HD2 ASN 77 6.794 10.273 -12.365 577 H ASP 78 H ASP 78 7.378 3.654 -10.879 578 HA ASP 78 HA ASP 78 7.371 2.039 -13.320 579 HB2 ASP 78 2HB ASP 78 9.697 2.897 -13.196 580 HB3 ASP 78 1HB ASP 78 9.843 2.235 -11.590 581 H LEU 79 H LEU 79 8.941 1.439 -10.210 582 HA LEU 79 HA LEU 79 6.706 -0.008 -9.101 583 HB2 LEU 79 2HB LEU 79 7.360 -2.241 -9.441 584 HB3 LEU 79 1HB LEU 79 7.877 -1.530 -10.958 585 HG LEU 79 HG LEU 79 9.730 -1.947 -8.558 586 HD11 LEU 79 1HD1 LEU 79 8.964 -4.103 -9.413 587 HD12 LEU 79 2HD1 LEU 79 10.669 -3.837 -9.773 588 HD13 LEU 79 3HD1 LEU 79 9.460 -3.643 -11.042 589 HD21 LEU 79 3HD2 LEU 79 10.387 -0.148 -10.175 590 HD22 LEU 79 1HD2 LEU 79 10.344 -1.342 -11.472 591 HD23 LEU 79 2HD2 LEU 79 11.510 -1.495 -10.161 592 H ILE 80 H ILE 80 7.207 -0.963 -7.041 593 HA ILE 80 HA ILE 80 9.717 -0.023 -5.755 594 HB ILE 80 HB ILE 80 6.960 0.370 -4.514 595 HG12 ILE 80 2HG1 ILE 80 8.939 2.439 -5.577 596 HG13 ILE 80 1HG1 ILE 80 7.469 1.959 -6.409 597 HG21 ILE 80 1HG2 ILE 80 8.271 1.585 -2.764 598 HG22 ILE 80 2HG2 ILE 80 9.759 1.145 -3.590 599 HG23 ILE 80 3HG2 ILE 80 8.752 -0.104 -2.871 600 HD11 ILE 80 3HD1 ILE 80 6.134 2.685 -4.430 601 HD12 ILE 80 1HD1 ILE 80 7.009 3.994 -5.222 602 HD13 ILE 80 2HD1 ILE 80 7.623 3.313 -3.722 603 H GLU 81 H GLU 81 10.520 -1.395 -4.244 604 HA GLU 81 HA GLU 81 8.958 -3.624 -3.193 605 HB2 GLU 81 2HB GLU 81 10.643 -5.306 -4.047 606 HB3 GLU 81 1HB GLU 81 9.643 -4.602 -5.317 607 HG2 GLU 81 2HG GLU 81 11.441 -3.014 -5.873 608 HG3 GLU 81 1HG GLU 81 12.445 -3.681 -4.593 609 H TYR 82 H TYR 82 10.169 -4.796 -1.586 610 HA TYR 82 HA TYR 82 12.708 -3.786 -0.617 611 HB2 TYR 82 2HB TYR 82 11.709 -3.155 1.639 612 HB3 TYR 82 1HB TYR 82 11.342 -2.034 0.331 613 HD1 TYR 82 1HD TYR 82 9.979 -4.906 2.293 614 HD2 TYR 82 2HD TYR 82 9.047 -1.681 -0.388 615 HE1 TYR 82 1HE TYR 82 7.564 -5.285 2.677 616 HE2 TYR 82 2HE TYR 82 6.632 -2.069 -0.006 617 HH TYR 82 HH TYR 82 5.489 -4.304 2.445 618 H THR 83 H THR 83 13.336 -4.957 1.396 619 HA THR 83 HA THR 83 12.124 -7.681 1.555 620 HB THR 83 HB THR 83 15.053 -6.911 1.887 621 HG1 THR 83 1HG THR 83 15.171 -8.173 -0.098 622 HG21 THR 83 3HG2 THR 83 15.370 -9.394 1.777 623 HG22 THR 83 1HG2 THR 83 13.621 -9.600 1.816 624 HG23 THR 83 2HG2 THR 83 14.459 -8.899 3.200 625 H ILE 84 H ILE 84 11.579 -8.348 3.532 626 HA ILE 84 HA ILE 84 12.093 -6.583 5.864 627 HB ILE 84 HB ILE 84 10.151 -8.908 5.594 628 HG12 ILE 84 2HG1 ILE 84 9.549 -7.237 3.924 629 HG13 ILE 84 1HG1 ILE 84 8.397 -7.166 5.243 630 HG21 ILE 84 1HG2 ILE 84 10.629 -8.361 7.913 631 HG22 ILE 84 2HG2 ILE 84 9.021 -7.771 7.522 632 HG23 ILE 84 3HG2 ILE 84 10.372 -6.645 7.610 633 HD11 ILE 84 3HD1 ILE 84 8.880 -4.908 4.761 634 HD12 ILE 84 1HD1 ILE 84 10.599 -5.210 4.573 635 HD13 ILE 84 2HD1 ILE 84 9.870 -5.231 6.172 636 H GLY 85 H GLY 85 12.753 -7.479 7.812 637 HA2 GLY 85 2HA GLY 85 14.925 -9.225 7.739 638 HA3 GLY 85 1HA GLY 85 14.031 -8.796 9.194 639 H ASP 86 H ASP 86 11.507 -9.881 8.544 640 HA ASP 86 HA ASP 86 11.801 -12.556 9.339 641 HB2 ASP 86 2HB ASP 86 9.736 -11.213 9.677 642 HB3 ASP 86 1HB ASP 86 9.433 -11.258 7.941 643 H GLY 87 H GLY 87 12.080 -11.094 6.237 644 HA2 GLY 87 2HA GLY 87 13.087 -12.253 4.397 645 HA3 GLY 87 1HA GLY 87 12.324 -13.749 4.912 646 H ARG 88 H ARG 88 10.000 -11.470 5.335 647 HA ARG 88 HA ARG 88 8.429 -12.318 3.112 648 HB2 ARG 88 2HB ARG 88 8.101 -9.911 4.926 649 HB3 ARG 88 1HB ARG 88 6.878 -10.511 3.817 650 HG2 ARG 88 2HG ARG 88 6.762 -12.640 5.007 651 HG3 ARG 88 1HG ARG 88 8.084 -12.154 6.071 652 HD2 ARG 88 2HD ARG 88 5.911 -11.831 7.185 653 HD3 ARG 88 1HD ARG 88 6.729 -10.292 6.935 654 HE ARG 88 HE ARG 88 5.039 -9.662 5.476 655 HH11 ARG 88 1HH2 ARG 88 4.955 -13.095 5.987 656 HH12 ARG 88 2HH2 ARG 88 3.457 -13.318 5.147 657 HH21 ARG 88 1HH1 ARG 88 3.089 -9.955 4.367 658 HH22 ARG 88 2HH1 ARG 88 2.399 -11.537 4.230 659 H LYS 89 H LYS 89 7.899 -11.252 1.221 660 HA LYS 89 HA LYS 89 9.415 -8.799 0.505 661 HB2 LYS 89 2HB LYS 89 10.542 -10.944 -0.309 662 HB3 LYS 89 1HB LYS 89 9.145 -11.203 -1.352 663 HG2 LYS 89 2HG LYS 89 9.527 -8.903 -2.319 664 HG3 LYS 89 1HG LYS 89 11.017 -8.801 -1.382 665 HD2 LYS 89 2HD LYS 89 10.380 -10.922 -3.464 666 HD3 LYS 89 1HD LYS 89 11.420 -9.529 -3.717 667 HE2 LYS 89 2HE LYS 89 12.842 -10.395 -1.750 668 HE3 LYS 89 1HE LYS 89 11.940 -11.906 -1.911 669 HZ1 LYS 89 3HZ LYS 89 13.912 -12.048 -3.220 670 HZ2 LYS 89 1HZ LYS 89 13.568 -10.587 -4.009 671 HZ3 LYS 89 2HZ LYS 89 12.585 -11.946 -4.275 672 H VAL 90 H VAL 90 8.390 -7.479 -0.910 673 HA VAL 90 HA VAL 90 5.754 -8.221 -2.003 674 HB VAL 90 HB VAL 90 6.228 -5.696 -0.366 675 HG11 VAL 90 1HG1 VAL 90 3.722 -6.882 -1.622 676 HG12 VAL 90 2HG1 VAL 90 4.551 -5.416 -2.141 677 HG13 VAL 90 3HG1 VAL 90 3.753 -5.466 -0.575 678 HG21 VAL 90 3HG2 VAL 90 4.636 -6.788 1.270 679 HG22 VAL 90 1HG2 VAL 90 6.198 -7.591 1.159 680 HG23 VAL 90 2HG2 VAL 90 4.789 -8.288 0.354 681 H ARG 91 H ARG 91 5.378 -7.330 -3.933 682 HA ARG 91 HA ARG 91 7.289 -5.305 -5.018 683 HB2 ARG 91 2HB ARG 91 7.583 -7.612 -5.997 684 HB3 ARG 91 1HB ARG 91 5.909 -7.557 -6.545 685 HG2 ARG 91 2HG ARG 91 6.410 -5.537 -7.894 686 HG3 ARG 91 1HG ARG 91 8.078 -5.577 -7.328 687 HD2 ARG 91 2HD ARG 91 6.699 -7.766 -8.914 688 HD3 ARG 91 1HD ARG 91 7.858 -6.609 -9.568 689 HE ARG 91 HE ARG 91 8.466 -8.969 -8.044 690 HH11 ARG 91 1HH2 ARG 91 9.489 -5.709 -8.675 691 HH12 ARG 91 2HH2 ARG 91 11.147 -6.013 -8.284 692 HH21 ARG 91 1HH1 ARG 91 10.635 -9.352 -7.524 693 HH22 ARG 91 2HH1 ARG 91 11.793 -8.069 -7.637 694 H ILE 92 H ILE 92 6.340 -3.517 -5.748 695 HA ILE 92 HA ILE 92 3.371 -3.452 -6.148 696 HB ILE 92 HB ILE 92 5.233 -1.204 -5.260 697 HG12 ILE 92 2HG1 ILE 92 3.153 -2.730 -3.628 698 HG13 ILE 92 1HG1 ILE 92 4.883 -3.022 -3.532 699 HG21 ILE 92 1HG2 ILE 92 3.283 -0.398 -6.533 700 HG22 ILE 92 2HG2 ILE 92 3.069 -0.003 -4.840 701 HG23 ILE 92 3HG2 ILE 92 2.200 -1.367 -5.541 702 HD11 ILE 92 3HD1 ILE 92 3.514 -0.397 -2.893 703 HD12 ILE 92 1HD1 ILE 92 5.252 -0.681 -2.839 704 HD13 ILE 92 2HD1 ILE 92 4.183 -1.533 -1.728 705 H VAL 93 H VAL 93 2.879 -3.205 -8.238 706 HA VAL 93 HA VAL 93 4.756 -1.751 -10.059 707 HB VAL 93 HB VAL 93 2.762 -3.950 -10.749 708 HG11 VAL 93 1HG1 VAL 93 3.136 -2.390 -12.611 709 HG12 VAL 93 2HG1 VAL 93 3.946 -3.913 -12.948 710 HG13 VAL 93 3HG1 VAL 93 4.881 -2.522 -12.400 711 HG21 VAL 93 3HG2 VAL 93 4.645 -4.835 -9.442 712 HG22 VAL 93 1HG2 VAL 93 5.794 -4.029 -10.511 713 HG23 VAL 93 2HG2 VAL 93 4.785 -5.341 -11.122 714 H PHE 94 H PHE 94 3.969 0.061 -10.894 715 HA PHE 94 HA PHE 94 1.113 0.777 -10.507 716 HB2 PHE 94 2HB PHE 94 3.569 2.382 -11.321 717 HB3 PHE 94 1HB PHE 94 1.944 3.056 -11.199 718 HD1 PHE 94 2HD PHE 94 0.816 3.281 -9.018 719 HD2 PHE 94 1HD PHE 94 4.816 1.726 -9.297 720 HE1 PHE 94 2HE PHE 94 1.099 3.565 -6.578 721 HE2 PHE 94 1HE PHE 94 5.087 2.007 -6.853 722 HZ PHE 94 HZ PHE 94 3.234 2.923 -5.502 723 H THR 95 H THR 95 -0.246 0.552 -12.146 724 HA THR 95 HA THR 95 0.758 0.556 -14.959 725 HB THR 95 HB THR 95 -1.615 -1.004 -13.848 726 HG1 THR 95 1HG THR 95 0.144 -2.010 -13.088 727 HG21 THR 95 3HG2 THR 95 -1.484 -2.151 -16.056 728 HG22 THR 95 1HG2 THR 95 -0.207 -1.039 -16.547 729 HG23 THR 95 2HG2 THR 95 -1.833 -0.434 -16.233 730 H HIS 96 H HIS 96 -0.439 1.682 -16.418 731 HA HIS 96 HA HIS 96 -2.944 2.995 -15.687 732 HB2 HIS 96 2HB HIS 96 -2.047 5.255 -16.175 733 HB3 HIS 96 1HB HIS 96 -1.264 4.546 -14.763 734 HD2 HIS 96 2HD HIS 96 -0.353 5.554 -18.451 735 HE1 HIS 96 1HE HIS 96 3.180 4.257 -16.538 736 HE2 HIS 96 2HE HIS 96 2.243 5.334 -18.638 737 H THR 97 H THR 97 -3.867 4.120 -17.519 738 HA THR 97 HA THR 97 -2.825 3.266 -20.191 739 HB THR 97 HB THR 97 -5.098 2.686 -20.872 740 HG1 THR 97 1HG THR 97 -5.654 3.680 -18.322 741 HG21 THR 97 3HG2 THR 97 -4.335 1.332 -18.267 742 HG22 THR 97 1HG2 THR 97 -3.674 0.930 -19.851 743 HG23 THR 97 2HG2 THR 97 -5.384 0.656 -19.513 744 H GLY 98 H GLY 98 -5.177 5.334 -18.468 745 HA2 GLY 98 2HA GLY 98 -4.321 7.742 -19.572 746 HA3 GLY 98 1HA GLY 98 -5.579 7.132 -20.643 747 H ASP 99 H ASP 99 -5.077 9.137 -18.102 748 HA ASP 99 HA ASP 99 -6.408 10.159 -16.544 749 HB2 ASP 99 2HB ASP 99 -8.665 9.064 -18.249 750 HB3 ASP 99 1HB ASP 99 -8.784 10.376 -17.081 751 H THR 100 H THR 100 -5.827 7.116 -16.484 752 HA THR 100 HA THR 100 -7.337 6.609 -14.019 753 HB THR 100 HB THR 100 -7.422 4.630 -16.340 754 HG1 THR 100 1HG THR 100 -9.723 5.826 -15.399 755 HG21 THR 100 3HG2 THR 100 -7.545 3.571 -14.122 756 HG22 THR 100 1HG2 THR 100 -9.123 3.513 -14.905 757 HG23 THR 100 2HG2 THR 100 -8.816 4.693 -13.635 758 H THR 101 H THR 101 -6.205 5.394 -12.617 759 HA THR 101 HA THR 101 -3.655 4.115 -13.504 760 HB THR 101 HB THR 101 -4.128 5.615 -10.894 761 HG1 THR 101 1HG THR 101 -4.016 6.956 -12.742 762 HG21 THR 101 3HG2 THR 101 -1.644 4.360 -12.135 763 HG22 THR 101 1HG2 THR 101 -2.465 3.826 -10.666 764 HG23 THR 101 2HG2 THR 101 -1.643 5.383 -10.699 765 H ASN 102 H ASN 102 -3.427 2.086 -12.889 766 HA ASN 102 HA ASN 102 -5.289 0.918 -10.857 767 HB2 ASN 102 2HB ASN 102 -5.700 0.118 -13.194 768 HB3 ASN 102 1HB ASN 102 -4.035 -0.452 -13.271 769 HD21 ASN 102 1HD2 ASN 102 -6.951 -0.781 -11.180 770 HD22 ASN 102 2HD2 ASN 102 -6.674 -2.411 -10.794 771 H ILE 103 H ILE 103 -4.272 0.265 -9.077 772 HA ILE 103 HA ILE 103 -1.334 -0.154 -9.072 773 HB ILE 103 HB ILE 103 -3.310 -0.008 -6.757 774 HG12 ILE 103 2HG1 ILE 103 -1.393 2.140 -7.765 775 HG13 ILE 103 1HG1 ILE 103 -3.123 2.132 -8.092 776 HG21 ILE 103 1HG2 ILE 103 -1.259 0.318 -5.384 777 HG22 ILE 103 2HG2 ILE 103 -0.272 0.077 -6.822 778 HG23 ILE 103 3HG2 ILE 103 -1.262 -1.238 -6.200 779 HD11 ILE 103 3HD1 ILE 103 -1.843 2.282 -5.350 780 HD12 ILE 103 1HD1 ILE 103 -3.580 2.159 -5.644 781 HD13 ILE 103 2HD1 ILE 103 -2.688 3.577 -6.191 782 H VAL 104 H VAL 104 -0.544 -2.169 -9.039 783 HA VAL 104 HA VAL 104 -2.314 -4.463 -8.309 784 HB VAL 104 HB VAL 104 -0.049 -4.454 -10.348 785 HG11 VAL 104 1HG1 VAL 104 -0.464 -6.644 -9.303 786 HG12 VAL 104 2HG1 VAL 104 -1.011 -6.654 -10.974 787 HG13 VAL 104 3HG1 VAL 104 -2.184 -6.508 -9.667 788 HG21 VAL 104 3HG2 VAL 104 -3.057 -4.323 -10.776 789 HG22 VAL 104 1HG2 VAL 104 -1.865 -4.592 -12.045 790 HG23 VAL 104 2HG2 VAL 104 -1.889 -3.064 -11.171 791 H GLU 105 H GLU 105 -1.539 -5.748 -6.750 792 HA GLU 105 HA GLU 105 1.348 -5.683 -6.016 793 HB2 GLU 105 2HB GLU 105 -1.005 -5.465 -4.093 794 HB3 GLU 105 1HB GLU 105 0.695 -5.619 -3.636 795 HG2 GLU 105 2HG GLU 105 1.184 -3.495 -4.833 796 HG3 GLU 105 1HG GLU 105 -0.521 -3.342 -5.227 797 H SER 106 H SER 106 2.132 -7.652 -5.627 798 HA SER 106 HA SER 106 0.322 -9.929 -5.015 799 HB2 SER 106 2HB SER 106 1.367 -11.310 -6.700 800 HB3 SER 106 1HB SER 106 0.817 -9.837 -7.498 801 HG SER 106 HG SER 106 3.441 -10.429 -6.578 802 H PHE 107 H PHE 107 1.113 -11.149 -3.403 803 HA PHE 107 HA PHE 107 3.987 -11.435 -2.942 804 HB2 PHE 107 2HB PHE 107 3.774 -10.605 -0.559 805 HB3 PHE 107 1HB PHE 107 3.648 -9.340 -1.771 806 HD1 PHE 107 1HD PHE 107 1.444 -8.366 -2.392 807 HD2 PHE 107 2HD PHE 107 1.822 -11.199 0.826 808 HE1 PHE 107 1HE PHE 107 -0.802 -7.736 -1.570 809 HE2 PHE 107 2HE PHE 107 -0.436 -10.554 1.641 810 HZ PHE 107 HZ PHE 107 -1.741 -8.831 0.438 811 H ASP 108 H ASP 108 4.330 -12.819 -0.955 812 HA ASP 108 HA ASP 108 2.227 -14.922 -0.829 813 HB2 ASP 108 2HB ASP 108 4.046 -16.487 -0.326 814 HB3 ASP 108 1HB ASP 108 4.228 -15.721 -1.903 815 HA PRO 109 HA PRO 109 2.529 -13.272 3.486 816 HB2 PRO 109 2HB PRO 109 -0.090 -13.496 4.231 817 HB3 PRO 109 1HB PRO 109 0.480 -12.169 3.205 818 HG2 PRO 109 2HG PRO 109 -0.966 -14.677 2.418 819 HG3 PRO 109 1HG PRO 109 -1.176 -13.022 1.809 820 HD2 PRO 109 2HD PRO 109 0.323 -14.992 0.496 821 HD3 PRO 109 1HD PRO 109 0.566 -13.244 0.248 822 H GLU 110 H GLU 110 1.152 -14.397 5.549 823 HA GLU 110 HA GLU 110 2.509 -16.765 6.110 824 HB2 GLU 110 2HB GLU 110 -0.119 -15.740 7.232 825 HB3 GLU 110 1HB GLU 110 0.832 -17.038 7.956 826 HG2 GLU 110 2HG GLU 110 2.734 -15.493 8.240 827 HG3 GLU 110 1HG GLU 110 1.798 -14.194 7.505 828 H GLU 111 H GLU 111 2.336 -18.660 5.156 829 HA GLU 111 HA GLU 111 0.157 -19.467 3.485 830 HB2 GLU 111 2HB GLU 111 1.380 -21.626 3.359 831 HB3 GLU 111 1HB GLU 111 2.433 -20.243 3.058 832 HG2 GLU 111 2HG GLU 111 3.204 -20.332 5.422 833 HG3 GLU 111 1HG GLU 111 2.193 -21.748 5.689 834 H THR 112 H THR 112 1.041 -20.015 6.827 835 HA THR 112 HA THR 112 -0.646 -22.208 7.388 836 HB THR 112 HB THR 112 -0.440 -21.509 9.746 837 HG1 THR 112 1HG THR 112 0.745 -19.550 10.122 838 HG21 THR 112 3HG2 THR 112 2.120 -21.129 8.169 839 HG22 THR 112 1HG2 THR 112 1.451 -22.678 8.687 840 HG23 THR 112 2HG2 THR 112 2.014 -21.513 9.887 841 H ASN 113 H ASN 113 -1.184 -18.694 7.577 842 HA ASN 113 HA ASN 113 -3.786 -18.922 8.643 843 HB2 ASN 113 2HB ASN 113 -2.476 -16.649 7.162 844 HB3 ASN 113 1HB ASN 113 -4.050 -16.521 7.943 845 HD21 ASN 113 1HD2 ASN 113 -1.043 -18.168 9.031 846 HD22 ASN 113 2HD2 ASN 113 -0.931 -17.316 10.495 847 HA PRO 114 HA PRO 114 -6.186 -20.079 5.034 848 HB2 PRO 114 2HB PRO 114 -8.247 -18.019 5.790 849 HB3 PRO 114 1HB PRO 114 -8.449 -19.763 5.555 850 HG2 PRO 114 2HG PRO 114 -8.458 -18.637 7.996 851 HG3 PRO 114 1HG PRO 114 -7.788 -20.262 7.716 852 HD2 PRO 114 2HD PRO 114 -6.316 -17.670 8.184 853 HD3 PRO 114 1HD PRO 114 -5.898 -19.333 8.660 854 H ARG 115 H ARG 115 -6.235 -19.431 2.920 855 HA ARG 115 HA ARG 115 -5.076 -16.941 2.132 856 HB2 ARG 115 2HB ARG 115 -6.639 -19.007 0.545 857 HB3 ARG 115 1HB ARG 115 -5.726 -17.675 -0.172 858 HG2 ARG 115 2HG ARG 115 -3.654 -18.522 0.860 859 HG3 ARG 115 1HG ARG 115 -4.556 -19.849 1.601 860 HD2 ARG 115 2HD ARG 115 -4.361 -19.362 -1.391 861 HD3 ARG 115 1HD ARG 115 -3.399 -20.536 -0.496 862 HE ARG 115 HE ARG 115 -6.105 -21.026 0.078 863 HH11 ARG 115 1HH2 ARG 115 -3.872 -21.131 -2.573 864 HH12 ARG 115 2HH2 ARG 115 -4.694 -22.417 -3.391 865 HH21 ARG 115 1HH1 ARG 115 -7.181 -22.712 -0.992 866 HH22 ARG 115 2HH1 ARG 115 -6.565 -23.312 -2.496 867 H GLU 116 H GLU 116 -8.407 -18.174 2.264 868 HA GLU 116 HA GLU 116 -9.654 -15.990 0.993 869 HB2 GLU 116 2HB GLU 116 -10.744 -18.205 1.459 870 HB3 GLU 116 1HB GLU 116 -10.825 -17.776 3.167 871 HG2 GLU 116 2HG GLU 116 -12.239 -15.820 2.631 872 HG3 GLU 116 1HG GLU 116 -12.110 -16.180 0.913 873 H LEU 117 H LEU 117 -8.922 -16.587 4.451 874 HA LEU 117 HA LEU 117 -10.276 -14.324 5.435 875 HB2 LEU 117 2HB LEU 117 -9.504 -16.220 6.860 876 HB3 LEU 117 1HB LEU 117 -7.838 -15.721 6.592 877 HG LEU 117 HG LEU 117 -8.354 -13.519 7.682 878 HD11 LEU 117 1HD1 LEU 117 -10.562 -13.576 9.116 879 HD12 LEU 117 2HD1 LEU 117 -11.123 -14.721 7.908 880 HD13 LEU 117 3HD1 LEU 117 -10.649 -13.090 7.430 881 HD21 LEU 117 3HD2 LEU 117 -7.403 -15.382 8.982 882 HD22 LEU 117 1HD2 LEU 117 -9.027 -15.971 9.343 883 HD23 LEU 117 2HD2 LEU 117 -8.486 -14.418 9.981 884 H GLN 118 H GLN 118 -6.846 -14.845 4.697 885 HA GLN 118 HA GLN 118 -5.987 -12.208 5.266 886 HB2 GLN 118 2HB GLN 118 -4.871 -14.251 3.312 887 HB3 GLN 118 1HB GLN 118 -4.028 -12.778 3.804 888 HG2 GLN 118 2HG GLN 118 -4.066 -13.500 6.141 889 HG3 GLN 118 1HG GLN 118 -4.957 -14.954 5.700 890 HE21 GLN 118 1HE2 GLN 118 -1.871 -13.915 6.398 891 HE22 GLN 118 2HE2 GLN 118 -0.988 -15.073 5.526 892 H GLN 119 H GLN 119 -6.874 -13.694 2.137 893 HA GLN 119 HA GLN 119 -6.512 -11.418 0.552 894 HB2 GLN 119 2HB GLN 119 -6.874 -13.756 -0.296 895 HB3 GLN 119 1HB GLN 119 -8.579 -13.608 0.123 896 HG2 GLN 119 2HG GLN 119 -8.791 -11.672 -1.408 897 HG3 GLN 119 1HG GLN 119 -7.080 -11.797 -1.806 898 HE21 GLN 119 1HE2 GLN 119 -9.227 -12.047 -3.741 899 HE22 GLN 119 2HE2 GLN 119 -9.167 -13.625 -4.361 900 H SER 120 H SER 120 -9.348 -12.541 2.358 901 HA SER 120 HA SER 120 -11.206 -10.643 1.464 902 HB2 SER 120 2HB SER 120 -10.991 -12.048 4.140 903 HB3 SER 120 1HB SER 120 -12.388 -11.096 3.638 904 HG SER 120 HG SER 120 -12.351 -12.513 1.710 905 H GLY 121 H GLY 121 -8.657 -10.411 3.871 906 HA2 GLY 121 2HA GLY 121 -9.527 -7.885 4.981 907 HA3 GLY 121 1HA GLY 121 -7.987 -8.687 5.265 908 H TRP 122 H TRP 122 -6.970 -8.881 2.678 909 HA TRP 122 HA TRP 122 -5.806 -6.345 2.313 910 HB2 TRP 122 2HB TRP 122 -5.948 -8.778 0.490 911 HB3 TRP 122 1HB TRP 122 -4.985 -7.355 0.097 912 HD1 TRP 122 HD TRP 122 -4.629 -10.588 1.821 913 HE1 TRP 122 1HE TRP 122 -2.532 -10.606 3.305 914 HE3 TRP 122 3HE TRP 122 -3.539 -5.592 1.871 915 HZ2 TRP 122 2HZ TRP 122 -0.647 -8.760 4.373 916 HZ3 TRP 122 3HZ TRP 122 -1.585 -4.758 3.136 917 HH2 TRP 122 HH TRP 122 -0.135 -6.335 4.384 918 H GLN 123 H GLN 123 -8.532 -7.871 0.646 919 HA GLN 123 HA GLN 123 -8.815 -5.733 -1.283 920 HB2 GLN 123 2HB GLN 123 -10.845 -6.897 -1.967 921 HB3 GLN 123 1HB GLN 123 -9.528 -8.053 -1.756 922 HG2 GLN 123 2HG GLN 123 -10.416 -8.500 0.562 923 HG3 GLN 123 1HG GLN 123 -11.805 -7.505 0.188 924 HE21 GLN 123 1HE2 GLN 123 -13.455 -9.042 0.022 925 HE22 GLN 123 2HE2 GLN 123 -13.413 -10.368 -1.036 926 H ALA 124 H ALA 124 -10.201 -6.546 1.850 927 HA ALA 124 HA ALA 124 -12.400 -4.806 1.877 928 HB1 ALA 124 1HB ALA 124 -12.096 -6.517 3.593 929 HB2 ALA 124 2HB ALA 124 -12.210 -4.941 4.365 930 HB3 ALA 124 3HB ALA 124 -10.634 -5.716 4.172 931 H ILE 125 H ILE 125 -9.092 -4.224 3.102 932 HA ILE 125 HA ILE 125 -9.533 -1.561 3.914 933 HB ILE 125 HB ILE 125 -7.607 -2.818 4.695 934 HG12 ILE 125 2HG1 ILE 125 -6.569 -0.565 2.906 935 HG13 ILE 125 1HG1 ILE 125 -7.430 -0.290 4.418 936 HG21 ILE 125 1HG2 ILE 125 -6.632 -2.784 1.822 937 HG22 ILE 125 2HG2 ILE 125 -7.261 -4.182 2.674 938 HG23 ILE 125 3HG2 ILE 125 -5.764 -3.452 3.201 939 HD11 ILE 125 3HD1 ILE 125 -4.844 -1.858 4.128 940 HD12 ILE 125 1HD1 ILE 125 -5.717 -1.588 5.634 941 HD13 ILE 125 2HD1 ILE 125 -4.993 -0.227 4.782 942 H LEU 126 H LEU 126 -8.620 -2.983 0.822 943 HA LEU 126 HA LEU 126 -8.036 -0.525 -0.512 944 HB2 LEU 126 2HB LEU 126 -8.757 -3.311 -1.450 945 HB3 LEU 126 1HB LEU 126 -8.553 -2.018 -2.624 946 HG LEU 126 HG LEU 126 -6.446 -2.862 -0.599 947 HD11 LEU 126 1HD1 LEU 126 -6.667 -3.490 -3.560 948 HD12 LEU 126 2HD1 LEU 126 -6.827 -4.628 -2.218 949 HD13 LEU 126 3HD1 LEU 126 -5.278 -3.853 -2.534 950 HD21 LEU 126 3HD2 LEU 126 -5.687 -0.741 -1.084 951 HD22 LEU 126 1HD2 LEU 126 -6.558 -0.627 -2.603 952 HD23 LEU 126 2HD2 LEU 126 -5.040 -1.509 -2.522 953 H ASN 127 H ASN 127 -11.018 -2.353 -0.008 954 HA ASN 127 HA ASN 127 -12.643 -0.923 -1.827 955 HB2 ASN 127 2HB ASN 127 -13.445 -2.209 0.797 956 HB3 ASN 127 1HB ASN 127 -14.519 -1.802 -0.534 957 HD21 ASN 127 1HD2 ASN 127 -12.057 -2.703 -2.353 958 HD22 ASN 127 2HD2 ASN 127 -12.261 -4.385 -2.405 959 H SER 128 H SER 128 -11.826 -0.318 1.579 960 HA SER 128 HA SER 128 -13.575 1.855 2.007 961 HB2 SER 128 2HB SER 128 -12.127 2.401 3.910 962 HB3 SER 128 1HB SER 128 -12.407 0.665 3.828 963 HG SER 128 HG SER 128 -10.119 2.140 3.059 964 H PHE 129 H PHE 129 -10.377 1.646 0.576 965 HA PHE 129 HA PHE 129 -9.695 4.373 0.573 966 HB2 PHE 129 2HB PHE 129 -8.145 2.482 -0.014 967 HB3 PHE 129 1HB PHE 129 -8.967 2.331 -1.561 968 HD1 PHE 129 1HD PHE 129 -6.861 4.557 0.540 969 HD2 PHE 129 2HD PHE 129 -8.627 3.990 -3.341 970 HE1 PHE 129 1HE PHE 129 -5.483 6.405 -0.361 971 HE2 PHE 129 2HE PHE 129 -7.241 5.839 -4.232 972 HZ PHE 129 HZ PHE 129 -5.671 7.049 -2.745 973 H LYS 130 H LYS 130 -11.585 2.454 -1.737 974 HA LYS 130 HA LYS 130 -11.882 4.379 -3.764 975 HB2 LYS 130 2HB LYS 130 -13.798 2.206 -2.851 976 HB3 LYS 130 1HB LYS 130 -13.929 3.079 -4.378 977 HG2 LYS 130 2HG LYS 130 -11.703 2.257 -5.051 978 HG3 LYS 130 1HG LYS 130 -11.561 1.385 -3.524 979 HD2 LYS 130 2HD LYS 130 -13.538 0.027 -4.097 980 HD3 LYS 130 1HD LYS 130 -13.722 0.915 -5.610 981 HE2 LYS 130 2HE LYS 130 -12.577 -1.198 -6.055 982 HE3 LYS 130 1HE LYS 130 -11.443 0.130 -6.301 983 HZ1 LYS 130 3HZ LYS 130 -11.480 -1.932 -4.256 984 HZ2 LYS 130 1HZ LYS 130 -11.062 -0.379 -3.719 985 HZ3 LYS 130 2HZ LYS 130 -10.167 -1.116 -4.957 986 H SER 131 H SER 131 -13.765 3.800 -0.815 987 HA SER 131 HA SER 131 -15.849 5.635 -1.299 988 HB2 SER 131 2HB SER 131 -14.651 4.827 1.370 989 HB3 SER 131 1HB SER 131 -16.234 5.559 1.120 990 HG SER 131 HG SER 131 -16.694 3.708 -0.236 991 H TYR 132 H TYR 132 -12.660 6.025 0.192 992 HA TYR 132 HA TYR 132 -12.962 8.681 1.091 993 HB2 TYR 132 2HB TYR 132 -11.096 7.183 1.769 994 HB3 TYR 132 1HB TYR 132 -10.425 7.296 0.147 995 HD1 TYR 132 1HD TYR 132 -9.411 9.406 -0.672 996 HD2 TYR 132 2HD TYR 132 -11.031 9.122 3.303 997 HE1 TYR 132 1HE TYR 132 -8.300 11.536 -0.062 998 HE2 TYR 132 2HE TYR 132 -9.914 11.249 3.906 999 HH TYR 132 HH TYR 132 -7.503 12.517 2.517 1000 H THR 133 H THR 133 -11.657 7.408 -1.991 1001 HA THR 133 HA THR 133 -11.004 9.895 -3.139 1002 HB THR 133 HB THR 133 -11.039 8.652 -5.280 1003 HG1 THR 133 1HG THR 133 -12.227 6.951 -5.445 1004 HG21 THR 133 3HG2 THR 133 -9.859 7.079 -2.981 1005 HG22 THR 133 1HG2 THR 133 -9.087 8.439 -3.791 1006 HG23 THR 133 2HG2 THR 133 -9.383 6.939 -4.670 1007 H GLU 134 H GLU 134 -14.019 8.076 -2.991 1008 HA GLU 134 HA GLU 134 -15.439 9.587 -4.946 1009 HB2 GLU 134 2HB GLU 134 -16.142 7.337 -4.103 1010 HB3 GLU 134 1HB GLU 134 -16.567 8.073 -2.560 1011 HG2 GLU 134 2HG GLU 134 -18.215 9.529 -3.689 1012 HG3 GLU 134 1HG GLU 134 -17.761 8.850 -5.249 1013 H ASN 135 H ASN 135 -14.840 10.002 -1.497 1014 HA ASN 135 HA ASN 135 -16.755 12.137 -1.133 1015 HB2 ASN 135 2HB ASN 135 -16.018 10.653 0.719 1016 HB3 ASN 135 1HB ASN 135 -14.398 11.333 0.608 1017 HD21 ASN 135 1HD2 ASN 135 -17.695 11.963 1.680 1018 HD22 ASN 135 2HD2 ASN 135 -17.359 13.436 2.451 1019 H ASN 136 H ASN 136 -13.550 11.929 -2.372 1020 HA ASN 136 HA ASN 136 -12.645 14.565 -1.700 1021 HB2 ASN 136 2HB ASN 136 -11.760 12.730 -3.944 1022 HB3 ASN 136 1HB ASN 136 -10.893 14.149 -3.369 1023 HD21 ASN 136 1HD2 ASN 136 -12.207 12.943 -0.595 1024 HD22 ASN 136 2HD2 ASN 136 -10.962 11.899 -0.107 1025 H LEU 137 H LEU 137 -14.868 13.343 -4.009 1026 HA LEU 137 HA LEU 137 -14.577 15.257 -6.075 1027 HB2 LEU 137 2HB LEU 137 -16.813 13.455 -5.130 1028 HB3 LEU 137 1HB LEU 137 -17.159 14.632 -6.384 1029 HG LEU 137 HG LEU 137 -16.550 12.393 -7.314 1030 HD11 LEU 137 1HD1 LEU 137 -15.442 13.246 -9.128 1031 HD12 LEU 137 2HD1 LEU 137 -14.222 14.082 -8.178 1032 HD13 LEU 137 3HD1 LEU 137 -15.821 14.784 -8.372 1033 HD21 LEU 137 3HD2 LEU 137 -14.922 11.913 -5.382 1034 HD22 LEU 137 1HD2 LEU 137 -13.743 12.878 -6.254 1035 HD23 LEU 137 2HD2 LEU 137 -14.400 11.414 -6.978 1036 H GLU 138 H GLU 138 -16.507 15.279 -3.097 1037 HA GLU 138 HA GLU 138 -17.875 17.701 -3.621 1038 HB2 GLU 138 2HB GLU 138 -18.478 16.063 -1.833 1039 HB3 GLU 138 1HB GLU 138 -17.050 16.553 -0.925 1040 HG2 GLU 138 2HG GLU 138 -17.907 18.871 -0.812 1041 HG3 GLU 138 1HG GLU 138 -19.314 18.404 -1.761 1042 H HIS 139 H HIS 139 -16.225 19.028 -4.567 1043 HA HIS 139 HA HIS 139 -15.027 20.836 -2.708 1044 HB2 HIS 139 2HB HIS 139 -13.355 19.025 -2.513 1045 HB3 HIS 139 1HB HIS 139 -13.125 19.025 -4.254 1046 HD2 HIS 139 2HD HIS 139 -11.403 21.035 -5.197 1047 HE1 HIS 139 1HE HIS 139 -10.880 23.045 -1.521 1048 HE2 HIS 139 2HE HIS 139 -10.116 22.929 -3.942 1049 H HIS 140 H HIS 140 -13.547 19.951 -5.779 1050 HA HIS 140 HA HIS 140 -13.297 21.091 -7.738 1051 HB2 HIS 140 2HB HIS 140 -15.713 20.473 -7.922 1052 HB3 HIS 140 1HB HIS 140 -16.143 22.014 -7.185 1053 HD2 HIS 140 2HD HIS 140 -16.403 24.057 -9.031 1054 HE1 HIS 140 1HE HIS 140 -14.244 22.278 -12.193 1055 HE2 HIS 140 2HE HIS 140 -15.628 24.296 -11.514 1056 H HIS 141 H HIS 141 -13.220 22.552 -4.897 1057 HA HIS 141 HA HIS 141 -13.128 25.366 -5.852 1058 HB2 HIS 141 2HB HIS 141 -13.105 24.233 -3.036 1059 HB3 HIS 141 1HB HIS 141 -13.156 25.944 -3.472 1060 HD2 HIS 141 2HD HIS 141 -15.705 23.793 -2.151 1061 HE1 HIS 141 1HE HIS 141 -17.721 25.515 -5.438 1062 HE2 HIS 141 2HE HIS 141 -18.025 24.234 -3.266 1063 H HIS 142 H HIS 142 -11.100 24.311 -6.978 1064 HA HIS 142 HA HIS 142 -8.754 23.821 -5.453 1065 HB2 HIS 142 2HB HIS 142 -9.060 24.817 -8.310 1066 HB3 HIS 142 1HB HIS 142 -7.564 24.202 -7.605 1067 HD2 HIS 142 2HD HIS 142 -10.617 22.823 -9.430 1068 HE1 HIS 142 1HE HIS 142 -8.859 19.526 -7.467 1069 HE2 HIS 142 2HE HIS 142 -10.577 20.223 -9.203 1070 H HIS 143 H HIS 143 -10.115 26.738 -6.937 1071 HA HIS 143 HA HIS 143 -9.589 28.966 -6.738 1072 HB2 HIS 143 2HB HIS 143 -10.332 28.461 -4.413 1073 HB3 HIS 143 1HB HIS 143 -8.668 28.081 -3.975 1074 HD2 HIS 143 2HD HIS 143 -10.709 31.276 -5.181 1075 HE1 HIS 143 1HE HIS 143 -7.173 32.560 -3.266 1076 HE2 HIS 143 2HE HIS 143 -9.337 33.334 -4.346 1077 H HIS 144 H HIS 144 -7.914 28.955 -8.316 1078 HA HIS 144 HA HIS 144 -5.362 29.838 -7.361 1079 HB2 HIS 144 2HB HIS 144 -5.120 27.361 -7.054 1080 HB3 HIS 144 1HB HIS 144 -5.422 27.139 -8.775 1081 HD2 HIS 144 2HD HIS 144 -2.516 28.180 -6.407 1082 HE1 HIS 144 1HE HIS 144 -1.126 28.643 -10.366 1083 HE2 HIS 144 2HE HIS 144 -0.441 28.651 -7.921 Start of MODEL 8 1 H1 GLY 1 1HT GLY 1 3.914 -17.308 -8.176 2 H2 GLY 1 2HT GLY 1 4.772 -18.572 -8.921 3 H3 GLY 1 3HT GLY 1 4.640 -18.513 -7.227 4 HA2 GLY 1 2HA GLY 1 2.842 -19.611 -9.159 5 HA3 GLY 1 1HA GLY 1 2.912 -19.875 -7.417 6 H ASN 2 H ASN 2 2.883 -16.673 -7.543 7 HA ASN 2 HA ASN 2 1.323 -15.061 -7.070 8 HB2 ASN 2 2HB ASN 2 0.886 -15.403 -9.511 9 HB3 ASN 2 1HB ASN 2 -0.368 -16.568 -9.097 10 HD21 ASN 2 1HD2 ASN 2 -0.652 -13.897 -10.463 11 HD22 ASN 2 2HD2 ASN 2 -1.743 -13.019 -9.504 12 H LYS 3 H LYS 3 1.082 -15.897 -4.899 13 HA LYS 3 HA LYS 3 -0.952 -17.808 -4.216 14 HB2 LYS 3 2HB LYS 3 0.354 -15.730 -2.429 15 HB3 LYS 3 1HB LYS 3 -0.434 -17.228 -1.925 16 HG2 LYS 3 2HG LYS 3 2.083 -17.102 -3.636 17 HG3 LYS 3 1HG LYS 3 2.070 -17.360 -1.896 18 HD2 LYS 3 2HD LYS 3 0.666 -19.424 -2.267 19 HD3 LYS 3 1HD LYS 3 0.864 -19.199 -4.003 20 HE2 LYS 3 2HE LYS 3 3.142 -19.568 -2.041 21 HE3 LYS 3 1HE LYS 3 2.511 -20.807 -3.125 22 HZ1 LYS 3 3HZ LYS 3 2.940 -18.785 -4.819 23 HZ2 LYS 3 1HZ LYS 3 4.062 -20.021 -4.515 24 HZ3 LYS 3 2HZ LYS 3 4.198 -18.532 -3.707 25 H ILE 4 H ILE 4 -0.750 -14.373 -3.306 26 HA ILE 4 HA ILE 4 -3.674 -14.062 -3.819 27 HB ILE 4 HB ILE 4 -2.170 -12.948 -1.414 28 HG12 ILE 4 2HG1 ILE 4 -4.308 -15.123 -1.560 29 HG13 ILE 4 1HG1 ILE 4 -2.592 -15.431 -1.307 30 HG21 ILE 4 1HG2 ILE 4 -5.111 -12.830 -2.229 31 HG22 ILE 4 2HG2 ILE 4 -4.003 -11.460 -2.197 32 HG23 ILE 4 3HG2 ILE 4 -4.477 -12.236 -0.699 33 HD11 ILE 4 3HD1 ILE 4 -4.459 -13.913 0.533 34 HD12 ILE 4 1HD1 ILE 4 -2.710 -13.963 0.750 35 HD13 ILE 4 2HD1 ILE 4 -3.660 -15.447 0.850 36 H THR 5 H THR 5 -4.191 -12.290 -4.888 37 HA THR 5 HA THR 5 -2.279 -10.045 -5.207 38 HB THR 5 HB THR 5 -3.820 -11.410 -7.451 39 HG1 THR 5 1HG THR 5 -2.090 -12.636 -7.144 40 HG21 THR 5 3HG2 THR 5 -1.973 -8.990 -7.412 41 HG22 THR 5 1HG2 THR 5 -3.665 -9.027 -7.912 42 HG23 THR 5 2HG2 THR 5 -2.441 -9.839 -8.884 43 H VAL 6 H VAL 6 -3.249 -8.086 -5.200 44 HA VAL 6 HA VAL 6 -6.213 -7.870 -5.356 45 HB VAL 6 HB VAL 6 -6.160 -6.289 -3.423 46 HG11 VAL 6 1HG1 VAL 6 -5.099 -9.067 -2.812 47 HG12 VAL 6 2HG1 VAL 6 -6.790 -8.647 -3.083 48 HG13 VAL 6 3HG1 VAL 6 -5.944 -8.016 -1.672 49 HG21 VAL 6 3HG2 VAL 6 -4.161 -6.300 -1.935 50 HG22 VAL 6 1HG2 VAL 6 -3.768 -5.651 -3.526 51 HG23 VAL 6 2HG2 VAL 6 -3.304 -7.298 -3.110 52 H GLU 7 H GLU 7 -6.949 -5.803 -5.972 53 HA GLU 7 HA GLU 7 -4.985 -3.811 -6.857 54 HB2 GLU 7 2HB GLU 7 -5.920 -3.779 -9.175 55 HB3 GLU 7 1HB GLU 7 -5.088 -5.287 -8.797 56 HG2 GLU 7 2HG GLU 7 -7.253 -6.370 -8.304 57 HG3 GLU 7 1HG GLU 7 -8.099 -4.872 -8.679 58 H VAL 8 H VAL 8 -6.003 -1.817 -7.626 59 HA VAL 8 HA VAL 8 -8.837 -1.412 -6.960 60 HB VAL 8 HB VAL 8 -7.741 -1.049 -4.817 61 HG11 VAL 8 1HG1 VAL 8 -6.000 0.975 -6.237 62 HG12 VAL 8 2HG1 VAL 8 -5.476 -0.591 -5.618 63 HG13 VAL 8 3HG1 VAL 8 -6.015 0.660 -4.501 64 HG21 VAL 8 3HG2 VAL 8 -8.413 1.656 -6.029 65 HG22 VAL 8 1HG2 VAL 8 -8.523 1.198 -4.329 66 HG23 VAL 8 2HG2 VAL 8 -9.619 0.480 -5.507 67 H THR 9 H THR 9 -9.749 0.210 -8.128 68 HA THR 9 HA THR 9 -8.168 1.401 -10.298 69 HB THR 9 HB THR 9 -10.362 2.064 -11.159 70 HG1 THR 9 1HG THR 9 -11.093 2.218 -8.807 71 HG21 THR 9 3HG2 THR 9 -9.587 -0.240 -11.603 72 HG22 THR 9 1HG2 THR 9 -11.345 -0.168 -11.470 73 HG23 THR 9 2HG2 THR 9 -10.384 -0.781 -10.124 74 H VAL 10 H VAL 10 -7.280 3.361 -9.998 75 HA VAL 10 HA VAL 10 -8.594 5.345 -8.177 76 HB VAL 10 HB VAL 10 -5.618 5.011 -8.741 77 HG11 VAL 10 1HG1 VAL 10 -5.395 6.603 -6.826 78 HG12 VAL 10 2HG1 VAL 10 -7.150 6.762 -6.777 79 HG13 VAL 10 3HG1 VAL 10 -6.252 7.327 -8.186 80 HG21 VAL 10 3HG2 VAL 10 -6.461 3.116 -7.419 81 HG22 VAL 10 1HG2 VAL 10 -7.270 4.222 -6.310 82 HG23 VAL 10 2HG2 VAL 10 -5.508 4.181 -6.391 83 H TYR 11 H TYR 11 -9.281 7.104 -9.228 84 HA TYR 11 HA TYR 11 -8.393 7.643 -11.996 85 HB2 TYR 11 2HB TYR 11 -10.568 8.956 -10.325 86 HB3 TYR 11 1HB TYR 11 -10.279 9.198 -12.049 87 HD1 TYR 11 1HD TYR 11 -10.726 7.362 -13.686 88 HD2 TYR 11 2HD TYR 11 -11.618 6.892 -9.501 89 HE1 TYR 11 1HE TYR 11 -12.122 5.376 -14.198 90 HE2 TYR 11 2HE TYR 11 -13.010 4.910 -10.024 91 HH TYR 11 HH TYR 11 -14.080 3.817 -11.731 92 H ALA 12 H ALA 12 -6.307 8.438 -11.546 93 HA ALA 12 HA ALA 12 -6.136 11.252 -11.091 94 HB1 ALA 12 1HB ALA 12 -6.358 10.552 -8.731 95 HB2 ALA 12 2HB ALA 12 -4.751 11.202 -9.050 96 HB3 ALA 12 3HB ALA 12 -4.990 9.459 -8.926 97 H ALA 13 H ALA 13 -4.019 12.061 -11.543 98 HA ALA 13 HA ALA 13 -2.573 10.553 -13.460 99 HB1 ALA 13 1HB ALA 13 -1.147 12.458 -13.622 100 HB2 ALA 13 2HB ALA 13 -1.431 12.931 -11.943 101 HB3 ALA 13 3HB ALA 13 -2.707 13.123 -13.144 102 H ILE 14 H ILE 14 -0.855 9.184 -13.251 103 HA ILE 14 HA ILE 14 -0.267 7.882 -10.890 104 HB ILE 14 HB ILE 14 0.302 7.029 -13.122 105 HG12 ILE 14 2HG1 ILE 14 2.807 7.202 -11.375 106 HG13 ILE 14 1HG1 ILE 14 1.438 6.167 -10.982 107 HG21 ILE 14 1HG2 ILE 14 1.207 9.217 -14.016 108 HG22 ILE 14 2HG2 ILE 14 2.249 7.833 -14.347 109 HG23 ILE 14 3HG2 ILE 14 2.666 8.956 -13.056 110 HD11 ILE 14 3HD1 ILE 14 3.029 6.025 -13.551 111 HD12 ILE 14 1HD1 ILE 14 1.702 4.967 -13.077 112 HD13 ILE 14 2HD1 ILE 14 3.213 4.948 -12.169 113 H GLU 15 H GLU 15 1.292 10.771 -12.194 114 HA GLU 15 HA GLU 15 3.519 10.841 -10.484 115 HB2 GLU 15 2HB GLU 15 3.542 13.300 -11.005 116 HB3 GLU 15 1HB GLU 15 3.418 12.278 -12.436 117 HG2 GLU 15 2HG GLU 15 0.963 12.624 -12.456 118 HG3 GLU 15 1HG GLU 15 1.105 13.684 -11.059 119 H LYS 16 H LYS 16 0.177 11.880 -10.017 120 HA LYS 16 HA LYS 16 0.675 13.201 -7.491 121 HB2 LYS 16 2HB LYS 16 -1.236 13.766 -9.013 122 HB3 LYS 16 1HB LYS 16 -1.953 12.196 -8.650 123 HG2 LYS 16 2HG LYS 16 -2.084 12.780 -6.258 124 HG3 LYS 16 1HG LYS 16 -1.301 14.328 -6.578 125 HD2 LYS 16 2HD LYS 16 -3.192 14.969 -8.049 126 HD3 LYS 16 1HD LYS 16 -3.973 13.426 -7.704 127 HE2 LYS 16 2HE LYS 16 -4.068 14.004 -5.304 128 HE3 LYS 16 1HE LYS 16 -3.278 15.545 -5.644 129 HZ1 LYS 16 3HZ LYS 16 -5.113 16.343 -6.756 130 HZ2 LYS 16 1HZ LYS 16 -5.831 15.453 -5.501 131 HZ3 LYS 16 2HZ LYS 16 -5.746 14.797 -7.066 132 H VAL 17 H VAL 17 -0.640 10.055 -8.528 133 HA VAL 17 HA VAL 17 -1.248 9.051 -5.956 134 HB VAL 17 HB VAL 17 -0.501 7.504 -8.462 135 HG11 VAL 17 1HG1 VAL 17 -1.994 6.682 -5.934 136 HG12 VAL 17 2HG1 VAL 17 -0.449 6.043 -6.492 137 HG13 VAL 17 3HG1 VAL 17 -1.916 5.704 -7.399 138 HG21 VAL 17 3HG2 VAL 17 -3.201 8.433 -7.417 139 HG22 VAL 17 1HG2 VAL 17 -2.948 7.413 -8.832 140 HG23 VAL 17 2HG2 VAL 17 -2.369 9.075 -8.835 141 H TRP 18 H TRP 18 1.693 8.751 -7.972 142 HA TRP 18 HA TRP 18 3.092 6.977 -6.330 143 HB2 TRP 18 2HB TRP 18 3.766 7.749 -8.638 144 HB3 TRP 18 1HB TRP 18 4.320 9.262 -7.929 145 HD1 TRP 18 HD TRP 18 5.076 5.507 -7.960 146 HE1 TRP 18 1HE TRP 18 7.489 5.127 -7.143 147 HE3 TRP 18 3HE TRP 18 6.312 10.263 -6.512 148 HZ2 TRP 18 2HZ TRP 18 9.640 6.598 -6.045 149 HZ3 TRP 18 3HZ TRP 18 8.568 10.729 -5.583 150 HH2 TRP 18 HH TRP 18 10.234 8.894 -5.348 151 H LYS 19 H LYS 19 2.997 10.531 -6.250 152 HA LYS 19 HA LYS 19 4.805 10.857 -4.062 153 HB2 LYS 19 2HB LYS 19 2.609 12.654 -5.145 154 HB3 LYS 19 1HB LYS 19 3.733 13.153 -3.881 155 HG2 LYS 19 2HG LYS 19 5.636 12.774 -5.396 156 HG3 LYS 19 1HG LYS 19 4.540 12.236 -6.662 157 HD2 LYS 19 2HD LYS 19 3.442 14.459 -6.656 158 HD3 LYS 19 1HD LYS 19 4.551 14.997 -5.394 159 HE2 LYS 19 2HE LYS 19 6.464 14.615 -6.910 160 HE3 LYS 19 1HE LYS 19 5.357 14.076 -8.172 161 HZ1 LYS 19 3HZ LYS 19 5.214 16.192 -8.769 162 HZ2 LYS 19 1HZ LYS 19 6.037 16.726 -7.385 163 HZ3 LYS 19 2HZ LYS 19 4.356 16.483 -7.331 164 H TYR 20 H TYR 20 1.233 10.657 -4.216 165 HA TYR 20 HA TYR 20 0.810 11.081 -1.434 166 HB2 TYR 20 2HB TYR 20 -0.953 11.361 -3.159 167 HB3 TYR 20 1HB TYR 20 -0.950 9.622 -3.438 168 HD1 TYR 20 1HD TYR 20 -1.748 8.046 -1.665 169 HD2 TYR 20 2HD TYR 20 -1.972 12.309 -1.129 170 HE1 TYR 20 1HE TYR 20 -3.289 7.730 0.252 171 HE2 TYR 20 2HE TYR 20 -3.510 11.985 0.786 172 HH TYR 20 HH TYR 20 -5.150 9.240 1.385 173 H TRP 21 H TRP 21 1.096 8.139 -3.394 174 HA TRP 21 HA TRP 21 0.622 6.296 -1.259 175 HB2 TRP 21 2HB TRP 21 0.364 5.750 -3.690 176 HB3 TRP 21 1HB TRP 21 2.110 5.865 -3.896 177 HD1 TRP 21 HD TRP 21 3.584 3.875 -2.952 178 HE1 TRP 21 1HE TRP 21 3.020 1.530 -2.056 179 HE3 TRP 21 3HE TRP 21 -1.455 4.364 -2.390 180 HZ2 TRP 21 2HZ TRP 21 0.716 0.051 -1.214 181 HZ3 TRP 21 3HZ TRP 21 -2.815 2.474 -1.555 182 HH2 TRP 21 HH TRP 21 -1.739 0.319 -0.964 183 H ASN 22 H ASN 22 3.335 8.192 -2.199 184 HA ASN 22 HA ASN 22 5.325 6.511 -0.791 185 HB2 ASN 22 2HB ASN 22 5.502 8.953 -2.574 186 HB3 ASN 22 1HB ASN 22 6.895 8.323 -1.723 187 HD21 ASN 22 1HD2 ASN 22 4.493 6.034 -2.899 188 HD22 ASN 22 2HD2 ASN 22 5.431 5.434 -4.180 189 H GLU 23 H GLU 23 3.515 9.489 -0.453 190 HA GLU 23 HA GLU 23 5.194 10.758 1.422 191 HB2 GLU 23 2HB GLU 23 3.312 11.866 0.170 192 HB3 GLU 23 1HB GLU 23 2.179 11.041 1.234 193 HG2 GLU 23 2HG GLU 23 2.537 13.283 2.115 194 HG3 GLU 23 1HG GLU 23 3.324 12.151 3.203 195 HA PRO 24 HA PRO 24 4.158 7.728 4.688 196 HB2 PRO 24 2HB PRO 24 5.769 8.590 6.725 197 HB3 PRO 24 1HB PRO 24 6.429 7.789 5.285 198 HG2 PRO 24 2HG PRO 24 6.258 10.736 5.871 199 HG3 PRO 24 1HG PRO 24 7.644 9.802 5.262 200 HD2 PRO 24 2HD PRO 24 6.013 11.237 3.584 201 HD3 PRO 24 1HD PRO 24 6.787 9.725 3.054 202 H ALA 25 H ALA 25 4.145 11.225 5.336 203 HA ALA 25 HA ALA 25 2.631 11.215 7.693 204 HB1 ALA 25 1HB ALA 25 2.610 13.288 5.480 205 HB2 ALA 25 2HB ALA 25 3.772 13.214 6.805 206 HB3 ALA 25 3HB ALA 25 2.074 13.544 7.142 207 H HIS 26 H HIS 26 1.573 11.213 4.310 208 HA HIS 26 HA HIS 26 -1.222 11.460 4.866 209 HB2 HIS 26 2HB HIS 26 0.192 10.284 2.451 210 HB3 HIS 26 1HB HIS 26 -1.525 10.676 2.530 211 HD2 HIS 26 2HD HIS 26 -0.052 12.481 0.365 212 HE1 HIS 26 1HE HIS 26 0.291 15.470 3.322 213 HE2 HIS 26 2HE HIS 26 0.381 15.010 0.827 214 H ILE 27 H ILE 27 0.924 8.632 4.433 215 HA ILE 27 HA ILE 27 -1.139 6.675 4.477 216 HB ILE 27 HB ILE 27 1.810 6.490 5.230 217 HG12 ILE 27 2HG1 ILE 27 0.332 5.551 2.724 218 HG13 ILE 27 1HG1 ILE 27 1.187 7.088 2.830 219 HG21 ILE 27 1HG2 ILE 27 1.430 3.963 4.858 220 HG22 ILE 27 2HG2 ILE 27 -0.297 4.297 4.928 221 HG23 ILE 27 3HG2 ILE 27 0.720 4.614 6.328 222 HD11 ILE 27 3HD1 ILE 27 3.288 5.864 3.351 223 HD12 ILE 27 1HD1 ILE 27 2.623 5.408 1.785 224 HD13 ILE 27 2HD1 ILE 27 2.424 4.338 3.167 225 H MET 28 H MET 28 0.836 8.108 7.085 226 HA MET 28 HA MET 28 -0.055 6.533 9.205 227 HB2 MET 28 2HB MET 28 0.824 9.440 9.122 228 HB3 MET 28 1HB MET 28 0.537 8.576 10.630 229 HG2 MET 28 2HG MET 28 2.307 7.015 10.180 230 HG3 MET 28 1HG MET 28 2.472 7.562 8.519 231 HE1 MET 28 3HE MET 28 3.739 9.728 12.351 232 HE2 MET 28 1HE MET 28 2.598 8.388 12.176 233 HE3 MET 28 2HE MET 28 2.099 10.036 11.801 234 H LYS 29 H LYS 29 -1.909 8.674 7.304 235 HA LYS 29 HA LYS 29 -3.852 9.350 9.389 236 HB2 LYS 29 2HB LYS 29 -3.241 10.911 7.507 237 HB3 LYS 29 1HB LYS 29 -4.031 9.805 6.387 238 HG2 LYS 29 2HG LYS 29 -6.161 10.070 7.585 239 HG3 LYS 29 1HG LYS 29 -5.384 11.137 8.757 240 HD2 LYS 29 2HD LYS 29 -4.835 12.722 6.929 241 HD3 LYS 29 1HD LYS 29 -5.643 11.659 5.778 242 HE2 LYS 29 2HE LYS 29 -7.768 11.936 7.005 243 HE3 LYS 29 1HE LYS 29 -6.960 12.990 8.169 244 HZ1 LYS 29 3HZ LYS 29 -6.354 13.954 5.639 245 HZ2 LYS 29 1HZ LYS 29 -7.347 14.673 6.810 246 HZ3 LYS 29 2HZ LYS 29 -8.023 13.641 5.642 247 H TRP 30 H TRP 30 -3.436 6.995 6.839 248 HA TRP 30 HA TRP 30 -5.955 5.627 7.642 249 HB2 TRP 30 2HB TRP 30 -6.532 5.176 5.319 250 HB3 TRP 30 1HB TRP 30 -6.379 6.917 5.542 251 HD1 TRP 30 HD TRP 30 -4.170 8.093 4.515 252 HE1 TRP 30 1HE TRP 30 -2.587 7.379 2.595 253 HE3 TRP 30 3HE TRP 30 -5.514 3.187 4.035 254 HZ2 TRP 30 2HZ TRP 30 -1.980 5.037 1.070 255 HZ3 TRP 30 3HZ TRP 30 -4.426 1.744 2.367 256 HH2 TRP 30 HH TRP 30 -2.667 2.658 0.881 257 H CYS 31 H CYS 31 -2.906 5.185 8.053 258 HA CYS 31 HA CYS 31 -2.069 2.993 6.540 259 HB2 CYS 31 2HB CYS 31 -0.724 4.375 8.238 260 HB3 CYS 31 1HB CYS 31 -1.426 3.361 9.485 261 HG CYS 31 HG CYS 31 0.221 1.616 8.897 262 H GLN 32 H GLN 32 -2.599 0.886 6.518 263 HA GLN 32 HA GLN 32 -3.614 -1.103 6.974 264 HB2 GLN 32 2HB GLN 32 -3.893 -0.133 9.842 265 HB3 GLN 32 1HB GLN 32 -4.007 -1.790 9.275 266 HG2 GLN 32 2HG GLN 32 -1.518 -0.064 9.011 267 HG3 GLN 32 1HG GLN 32 -1.778 -1.256 10.282 268 HE21 GLN 32 1HE2 GLN 32 -1.760 -3.542 9.668 269 HE22 GLN 32 2HE2 GLN 32 -1.113 -4.042 8.180 270 H ALA 33 H ALA 33 -5.180 1.835 7.967 271 HA ALA 33 HA ALA 33 -7.367 2.504 8.101 272 HB1 ALA 33 1HB ALA 33 -7.558 0.536 5.822 273 HB2 ALA 33 2HB ALA 33 -7.076 2.220 5.673 274 HB3 ALA 33 3HB ALA 33 -8.722 1.811 6.165 275 H SER 34 H SER 34 -6.571 0.205 9.762 276 HA SER 34 HA SER 34 -9.089 -1.353 9.958 277 HB2 SER 34 2HB SER 34 -6.340 -1.883 11.094 278 HB3 SER 34 1HB SER 34 -7.741 -2.935 11.286 279 HG SER 34 HG SER 34 -6.797 -3.728 9.518 280 HA PRO 35 HA PRO 35 -9.738 1.115 13.716 281 HB2 PRO 35 2HB PRO 35 -11.926 -0.098 14.789 282 HB3 PRO 35 1HB PRO 35 -12.035 0.806 13.260 283 HG2 PRO 35 2HG PRO 35 -11.714 -2.164 13.654 284 HG3 PRO 35 1HG PRO 35 -12.879 -1.304 12.623 285 HD2 PRO 35 2HD PRO 35 -10.551 -2.333 11.600 286 HD3 PRO 35 1HD PRO 35 -11.253 -0.826 10.965 287 H GLU 36 H GLU 36 -8.992 -2.275 13.706 288 HA GLU 36 HA GLU 36 -8.654 -2.488 16.616 289 HB2 GLU 36 2HB GLU 36 -8.100 -4.436 14.349 290 HB3 GLU 36 1HB GLU 36 -7.880 -4.812 16.058 291 HG2 GLU 36 2HG GLU 36 -10.270 -4.360 16.471 292 HG3 GLU 36 1HG GLU 36 -10.493 -3.960 14.773 293 H TRP 37 H TRP 37 -6.959 -0.853 14.445 294 HA TRP 37 HA TRP 37 -4.425 -1.175 15.904 295 HB2 TRP 37 2HB TRP 37 -4.709 -1.626 12.907 296 HB3 TRP 37 1HB TRP 37 -3.167 -1.215 13.657 297 HD1 TRP 37 HD TRP 37 -5.810 -3.995 13.617 298 HE1 TRP 37 1HE TRP 37 -4.730 -6.166 14.493 299 HE3 TRP 37 3HE TRP 37 -1.272 -2.181 15.071 300 HZ2 TRP 37 2HZ TRP 37 -2.263 -7.011 15.664 301 HZ3 TRP 37 3HZ TRP 37 0.425 -3.689 16.066 302 HH2 TRP 37 HH TRP 37 -0.064 -6.101 16.363 303 H HIS 38 H HIS 38 -2.983 0.540 15.602 304 HA HIS 38 HA HIS 38 -3.942 2.992 14.265 305 HB2 HIS 38 2HB HIS 38 -3.557 2.596 17.253 306 HB3 HIS 38 1HB HIS 38 -3.263 4.185 16.543 307 HD2 HIS 38 2HD HIS 38 -5.559 5.689 16.493 308 HE1 HIS 38 1HE HIS 38 -8.378 2.551 16.395 309 HE2 HIS 38 2HE HIS 38 -8.094 5.070 16.477 310 H VAL 39 H VAL 39 -2.308 4.454 13.827 311 HA VAL 39 HA VAL 39 0.470 3.396 13.940 312 HB VAL 39 HB VAL 39 -0.498 3.550 11.712 313 HG11 VAL 39 1HG1 VAL 39 -1.963 5.713 12.465 314 HG12 VAL 39 2HG1 VAL 39 -1.543 5.434 10.784 315 HG13 VAL 39 3HG1 VAL 39 -0.606 6.572 11.742 316 HG21 VAL 39 3HG2 VAL 39 1.936 3.986 12.066 317 HG22 VAL 39 1HG2 VAL 39 1.598 5.716 12.154 318 HG23 VAL 39 2HG2 VAL 39 1.301 4.833 10.657 319 HA PRO 40 HA PRO 40 0.483 7.306 16.468 320 HB2 PRO 40 2HB PRO 40 2.202 6.582 18.449 321 HB3 PRO 40 1HB PRO 40 0.514 6.019 18.436 322 HG2 PRO 40 2HG PRO 40 2.987 4.558 17.535 323 HG3 PRO 40 1HG PRO 40 1.645 3.964 18.536 324 HD2 PRO 40 2HD PRO 40 1.818 3.467 15.820 325 HD3 PRO 40 1HD PRO 40 0.257 3.570 16.666 326 H ALA 41 H ALA 41 2.847 5.572 14.703 327 HA ALA 41 HA ALA 41 4.237 7.946 13.948 328 HB1 ALA 41 1HB ALA 41 6.453 7.377 14.878 329 HB2 ALA 41 2HB ALA 41 5.735 6.022 15.748 330 HB3 ALA 41 3HB ALA 41 5.281 7.671 16.160 331 H ALA 42 H ALA 42 5.712 7.583 12.255 332 HA ALA 42 HA ALA 42 6.409 4.935 11.381 333 HB1 ALA 42 1HB ALA 42 5.150 4.804 9.340 334 HB2 ALA 42 2HB ALA 42 4.566 6.457 9.512 335 HB3 ALA 42 3HB ALA 42 3.984 5.202 10.603 336 H GLN 43 H GLN 43 7.910 4.918 9.677 337 HA GLN 43 HA GLN 43 8.920 7.527 8.694 338 HB2 GLN 43 2HB GLN 43 10.727 5.379 9.891 339 HB3 GLN 43 1HB GLN 43 11.210 6.952 9.258 340 HG2 GLN 43 2HG GLN 43 11.166 7.278 11.625 341 HG3 GLN 43 1HG GLN 43 9.642 7.975 11.081 342 HE21 GLN 43 1HE2 GLN 43 8.150 7.476 12.718 343 HE22 GLN 43 2HE2 GLN 43 7.943 5.930 13.391 344 H ASN 44 H ASN 44 10.063 7.384 6.756 345 HA ASN 44 HA ASN 44 10.521 4.857 5.411 346 HB2 ASN 44 2HB ASN 44 8.072 5.151 5.081 347 HB3 ASN 44 1HB ASN 44 8.374 6.716 4.338 348 HD21 ASN 44 1HD2 ASN 44 7.082 5.083 2.651 349 HD22 ASN 44 2HD2 ASN 44 8.118 4.387 1.503 350 H ASP 45 H ASP 45 12.186 5.109 4.042 351 HA ASP 45 HA ASP 45 12.840 7.805 2.945 352 HB2 ASP 45 2HB ASP 45 14.302 7.271 4.885 353 HB3 ASP 45 1HB ASP 45 14.807 5.786 4.082 354 H LEU 46 H LEU 46 12.121 7.371 0.908 355 HA LEU 46 HA LEU 46 12.624 4.931 -0.513 356 HB2 LEU 46 2HB LEU 46 11.525 7.668 -1.160 357 HB3 LEU 46 1HB LEU 46 11.963 6.642 -2.512 358 HG LEU 46 HG LEU 46 10.162 5.519 -0.317 359 HD11 LEU 46 1HD1 LEU 46 8.189 6.245 -1.612 360 HD12 LEU 46 2HD1 LEU 46 9.242 7.163 -2.691 361 HD13 LEU 46 3HD1 LEU 46 9.102 7.621 -0.992 362 HD21 LEU 46 3HD2 LEU 46 11.076 3.982 -2.089 363 HD22 LEU 46 1HD2 LEU 46 10.315 4.988 -3.323 364 HD23 LEU 46 2HD2 LEU 46 9.324 4.113 -2.159 365 H LYS 47 H LYS 47 14.804 4.481 -0.519 366 HA LYS 47 HA LYS 47 16.370 5.728 -2.565 367 HB2 LYS 47 2HB LYS 47 16.626 7.389 -0.695 368 HB3 LYS 47 1HB LYS 47 17.328 6.118 0.303 369 HG2 LYS 47 2HG LYS 47 19.158 5.820 -1.328 370 HG3 LYS 47 1HG LYS 47 18.438 7.047 -2.373 371 HD2 LYS 47 2HD LYS 47 18.721 8.733 -0.577 372 HD3 LYS 47 1HD LYS 47 19.452 7.503 0.455 373 HE2 LYS 47 2HE LYS 47 21.268 7.192 -1.189 374 HE3 LYS 47 1HE LYS 47 20.533 8.408 -2.235 375 HZ1 LYS 47 3HZ LYS 47 22.246 8.784 -0.035 376 HZ2 LYS 47 1HZ LYS 47 20.755 9.521 0.302 377 HZ3 LYS 47 2HZ LYS 47 21.614 9.946 -1.101 378 H ALA 48 H ALA 48 17.968 4.343 -3.239 379 HA ALA 48 HA ALA 48 17.866 1.641 -2.468 380 HB1 ALA 48 1HB ALA 48 18.678 2.393 -4.667 381 HB2 ALA 48 2HB ALA 48 19.875 1.373 -3.870 382 HB3 ALA 48 3HB ALA 48 20.088 3.124 -3.902 383 H GLY 49 H GLY 49 19.024 0.431 -1.027 384 HA2 GLY 49 2HA GLY 49 20.533 -0.125 0.628 385 HA3 GLY 49 1HA GLY 49 21.458 1.324 0.239 386 H GLY 50 H GLY 50 18.365 2.342 0.620 387 HA2 GLY 50 2HA GLY 50 18.840 3.472 3.271 388 HA3 GLY 50 1HA GLY 50 17.465 3.784 2.213 389 H THR 51 H THR 51 17.105 3.333 4.932 390 HA THR 51 HA THR 51 15.721 0.684 5.017 391 HB THR 51 HB THR 51 16.332 0.450 7.324 392 HG1 THR 51 1HG THR 51 17.824 2.458 7.932 393 HG21 THR 51 3HG2 THR 51 18.760 0.428 7.278 394 HG22 THR 51 1HG2 THR 51 18.790 1.634 5.994 395 HG23 THR 51 2HG2 THR 51 18.196 0.010 5.662 396 H PHE 52 H PHE 52 13.844 0.613 6.349 397 HA PHE 52 HA PHE 52 12.534 3.224 6.965 398 HB2 PHE 52 2HB PHE 52 10.440 2.396 6.023 399 HB3 PHE 52 1HB PHE 52 11.696 2.366 4.789 400 HD1 PHE 52 1HD PHE 52 12.671 0.207 4.015 401 HD2 PHE 52 2HD PHE 52 9.549 0.292 6.973 402 HE1 PHE 52 1HE PHE 52 12.310 -2.228 3.716 403 HE2 PHE 52 2HE PHE 52 9.187 -2.143 6.665 404 HZ PHE 52 HZ PHE 52 10.570 -3.401 5.035 405 H THR 53 H THR 53 10.860 3.094 8.550 406 HA THR 53 HA THR 53 10.617 0.612 10.123 407 HB THR 53 HB THR 53 11.494 3.246 11.379 408 HG1 THR 53 1HG THR 53 13.268 1.387 11.758 409 HG21 THR 53 3HG2 THR 53 11.181 0.446 12.512 410 HG22 THR 53 1HG2 THR 53 10.142 1.825 12.875 411 HG23 THR 53 2HG2 THR 53 11.828 1.830 13.389 412 H THR 54 H THR 54 8.502 0.338 10.409 413 HA THR 54 HA THR 54 6.671 2.685 10.638 414 HB THR 54 HB THR 54 4.941 1.235 9.728 415 HG1 THR 54 1HG THR 54 7.005 -0.691 9.688 416 HG21 THR 54 3HG2 THR 54 5.832 0.922 7.459 417 HG22 THR 54 1HG2 THR 54 7.478 1.063 8.076 418 HG23 THR 54 2HG2 THR 54 6.395 2.455 8.128 419 H THR 55 H THR 55 6.115 2.986 12.750 420 HA THR 55 HA THR 55 6.112 0.720 14.629 421 HB THR 55 HB THR 55 5.496 3.666 15.108 422 HG1 THR 55 1HG THR 55 7.541 3.869 14.762 423 HG21 THR 55 3HG2 THR 55 6.264 1.400 16.984 424 HG22 THR 55 1HG2 THR 55 4.692 2.198 16.911 425 HG23 THR 55 2HG2 THR 55 6.111 3.092 17.451 426 H MET 56 H MET 56 4.298 -0.492 14.746 427 HA MET 56 HA MET 56 1.620 0.830 14.647 428 HB2 MET 56 2HB MET 56 2.456 -1.840 13.452 429 HB3 MET 56 1HB MET 56 0.794 -1.254 13.551 430 HG2 MET 56 2HG MET 56 1.434 0.733 12.194 431 HG3 MET 56 1HG MET 56 3.066 0.079 12.046 432 HE1 MET 56 3HE MET 56 1.532 -0.290 8.539 433 HE2 MET 56 1HE MET 56 3.150 -0.371 9.242 434 HE3 MET 56 2HE MET 56 2.042 0.913 9.720 435 H ALA 57 H ALA 57 0.346 0.332 16.333 436 HA ALA 57 HA ALA 57 0.773 -2.103 17.919 437 HB1 ALA 57 1HB ALA 57 0.941 -0.845 20.027 438 HB2 ALA 57 2HB ALA 57 0.930 0.674 19.132 439 HB3 ALA 57 3HB ALA 57 2.282 -0.444 18.955 440 H ALA 58 H ALA 58 -1.011 -2.746 19.040 441 HA ALA 58 HA ALA 58 -3.564 -1.874 18.100 442 HB1 ALA 58 1HB ALA 58 -4.448 -3.430 19.826 443 HB2 ALA 58 2HB ALA 58 -2.816 -3.608 20.475 444 HB3 ALA 58 3HB ALA 58 -3.182 -4.175 18.846 445 H LYS 59 H LYS 59 -5.172 -0.710 19.193 446 HA LYS 59 HA LYS 59 -4.374 1.536 20.665 447 HB2 LYS 59 2HB LYS 59 -6.896 1.687 21.232 448 HB3 LYS 59 1HB LYS 59 -6.466 1.661 19.520 449 HG2 LYS 59 2HG LYS 59 -7.047 -0.671 19.299 450 HG3 LYS 59 1HG LYS 59 -7.181 -0.876 21.044 451 HD2 LYS 59 2HD LYS 59 -9.406 -0.738 20.018 452 HD3 LYS 59 1HD LYS 59 -9.136 0.629 21.093 453 HE2 LYS 59 2HE LYS 59 -8.831 2.139 19.252 454 HE3 LYS 59 1HE LYS 59 -8.599 0.818 18.106 455 HZ1 LYS 59 3HZ LYS 59 -10.753 1.149 17.685 456 HZ2 LYS 59 1HZ LYS 59 -11.039 1.954 19.150 457 HZ3 LYS 59 2HZ LYS 59 -11.015 0.255 19.106 458 H ASP 60 H ASP 60 -5.373 -1.652 21.742 459 HA ASP 60 HA ASP 60 -5.530 -0.912 24.563 460 HB2 ASP 60 2HB ASP 60 -5.887 -3.382 24.852 461 HB3 ASP 60 1HB ASP 60 -7.029 -2.637 23.737 462 H GLY 61 H GLY 61 -3.059 -1.526 22.381 463 HA2 GLY 61 2HA GLY 61 -0.797 -1.843 22.629 464 HA3 GLY 61 1HA GLY 61 -1.013 -1.469 24.336 465 H SER 62 H SER 62 -2.949 -4.053 23.156 466 HA SER 62 HA SER 62 -1.878 -5.955 24.925 467 HB2 SER 62 2HB SER 62 -3.520 -6.382 22.415 468 HB3 SER 62 1HB SER 62 -3.272 -7.573 23.690 469 HG SER 62 HG SER 62 -5.053 -6.631 24.389 470 H MET 63 H MET 63 -1.259 -5.312 21.501 471 HA MET 63 HA MET 63 1.240 -6.874 21.639 472 HB2 MET 63 2HB MET 63 -0.537 -8.417 20.762 473 HB3 MET 63 1HB MET 63 -0.826 -7.288 19.438 474 HG2 MET 63 2HG MET 63 1.468 -7.593 18.624 475 HG3 MET 63 1HG MET 63 1.867 -8.591 20.020 476 HE1 MET 63 3HE MET 63 -0.869 -8.275 17.195 477 HE2 MET 63 1HE MET 63 -0.515 -9.749 16.288 478 HE3 MET 63 2HE MET 63 0.714 -8.498 16.457 479 H SER 64 H SER 64 2.813 -6.162 20.237 480 HA SER 64 HA SER 64 2.238 -3.977 18.343 481 HB2 SER 64 2HB SER 64 2.793 -2.845 20.461 482 HB3 SER 64 1HB SER 64 4.278 -3.787 20.580 483 HG SER 64 HG SER 64 5.153 -2.612 19.035 484 H PHE 65 H PHE 65 3.922 -3.635 16.826 485 HA PHE 65 HA PHE 65 6.198 -5.463 16.762 486 HB2 PHE 65 2HB PHE 65 4.253 -6.772 15.798 487 HB3 PHE 65 1HB PHE 65 4.122 -5.557 14.528 488 HD1 PHE 65 1HD PHE 65 6.278 -8.218 15.972 489 HD2 PHE 65 2HD PHE 65 5.810 -5.430 12.727 490 HE1 PHE 65 1HE PHE 65 8.098 -9.349 14.733 491 HE2 PHE 65 2HE PHE 65 7.631 -6.573 11.493 492 HZ PHE 65 HZ PHE 65 8.775 -8.528 12.495 493 H ASP 66 H ASP 66 7.571 -5.009 14.837 494 HA ASP 66 HA ASP 66 7.245 -2.277 13.706 495 HB2 ASP 66 2HB ASP 66 8.686 -2.145 15.729 496 HB3 ASP 66 1HB ASP 66 9.767 -3.344 15.027 497 H PHE 67 H PHE 67 7.366 -2.454 11.556 498 HA PHE 67 HA PHE 67 8.746 -4.743 10.286 499 HB2 PHE 67 2HB PHE 67 7.027 -2.544 9.076 500 HB3 PHE 67 1HB PHE 67 7.639 -3.964 8.234 501 HD1 PHE 67 2HD PHE 67 6.815 -6.242 8.809 502 HD2 PHE 67 1HD PHE 67 5.148 -2.729 10.649 503 HE1 PHE 67 2HE PHE 67 4.879 -7.572 9.602 504 HE2 PHE 67 1HE PHE 67 3.214 -4.067 11.441 505 HZ PHE 67 HZ PHE 67 3.080 -6.486 10.916 506 H GLY 68 H GLY 68 10.587 -4.547 9.136 507 HA2 GLY 68 2HA GLY 68 11.608 -1.944 8.251 508 HA3 GLY 68 1HA GLY 68 12.557 -2.779 9.483 509 H GLY 69 H GLY 69 13.326 -2.136 6.790 510 HA2 GLY 69 2HA GLY 69 14.547 -4.579 6.010 511 HA3 GLY 69 1HA GLY 69 13.182 -4.217 4.949 512 H VAL 70 H VAL 70 15.201 -4.188 3.459 513 HA VAL 70 HA VAL 70 16.264 -1.398 3.265 514 HB VAL 70 HB VAL 70 17.639 -3.973 2.380 515 HG11 VAL 70 1HG1 VAL 70 19.629 -2.477 2.185 516 HG12 VAL 70 2HG1 VAL 70 18.607 -1.095 2.579 517 HG13 VAL 70 3HG1 VAL 70 18.334 -1.997 1.090 518 HG21 VAL 70 3HG2 VAL 70 18.090 -2.266 4.854 519 HG22 VAL 70 1HG2 VAL 70 19.149 -3.573 4.329 520 HG23 VAL 70 2HG2 VAL 70 17.496 -3.922 4.828 521 H TYR 71 H TYR 71 15.878 -0.388 1.354 522 HA TYR 71 HA TYR 71 14.180 -1.590 -0.631 523 HB2 TYR 71 2HB TYR 71 15.755 1.012 -0.653 524 HB3 TYR 71 1HB TYR 71 14.538 0.562 -1.846 525 HD1 TYR 71 1HD TYR 71 12.161 0.035 -1.055 526 HD2 TYR 71 2HD TYR 71 15.049 2.006 1.463 527 HE1 TYR 71 1HE TYR 71 10.339 0.839 0.414 528 HE2 TYR 71 2HE TYR 71 13.215 2.808 2.920 529 HH TYR 71 HH TYR 71 9.814 2.229 2.087 530 H ASP 72 H ASP 72 14.823 -2.906 -2.245 531 HA ASP 72 HA ASP 72 17.607 -3.370 -2.835 532 HB2 ASP 72 2HB ASP 72 15.894 -5.153 -2.965 533 HB3 ASP 72 1HB ASP 72 15.102 -4.295 -4.283 534 H GLN 73 H GLN 73 14.882 -1.755 -4.438 535 HA GLN 73 HA GLN 73 16.659 0.012 -5.912 536 HB2 GLN 73 2HB GLN 73 16.638 -2.065 -7.309 537 HB3 GLN 73 1HB GLN 73 14.887 -1.928 -7.450 538 HG2 GLN 73 2HG GLN 73 15.138 0.273 -8.551 539 HG3 GLN 73 1HG GLN 73 16.889 0.165 -8.377 540 HE21 GLN 73 1HE2 GLN 73 17.902 -0.584 -10.237 541 HE22 GLN 73 2HE2 GLN 73 17.199 -1.621 -11.381 542 H VAL 74 H VAL 74 15.598 1.837 -6.650 543 HA VAL 74 HA VAL 74 12.654 2.045 -6.250 544 HB VAL 74 HB VAL 74 14.709 4.085 -5.303 545 HG11 VAL 74 1HG1 VAL 74 11.668 3.990 -5.109 546 HG12 VAL 74 2HG1 VAL 74 12.619 5.166 -6.014 547 HG13 VAL 74 3HG1 VAL 74 12.680 5.153 -4.261 548 HG21 VAL 74 3HG2 VAL 74 13.943 3.442 -3.030 549 HG22 VAL 74 1HG2 VAL 74 14.693 2.083 -3.868 550 HG23 VAL 74 2HG2 VAL 74 12.935 2.176 -3.732 551 H LYS 75 H LYS 75 11.679 2.949 -7.967 552 HA LYS 75 HA LYS 75 13.075 4.900 -9.670 553 HB2 LYS 75 2HB LYS 75 12.003 2.209 -10.594 554 HB3 LYS 75 1HB LYS 75 12.169 3.565 -11.712 555 HG2 LYS 75 2HG LYS 75 14.591 3.690 -11.157 556 HG3 LYS 75 1HG LYS 75 14.405 2.307 -10.080 557 HD2 LYS 75 2HD LYS 75 13.661 0.917 -11.981 558 HD3 LYS 75 1HD LYS 75 13.835 2.297 -13.063 559 HE2 LYS 75 2HE LYS 75 16.068 1.007 -11.463 560 HE3 LYS 75 1HE LYS 75 15.813 0.838 -13.201 561 HZ1 LYS 75 3HZ LYS 75 15.830 3.464 -13.014 562 HZ2 LYS 75 1HZ LYS 75 17.252 2.566 -13.227 563 HZ3 LYS 75 2HZ LYS 75 16.819 3.114 -11.678 564 H THR 76 H THR 76 11.740 6.553 -9.878 565 HA THR 76 HA THR 76 9.128 6.647 -8.920 566 HB THR 76 HB THR 76 10.349 8.457 -11.037 567 HG1 THR 76 1HG THR 76 10.971 7.993 -8.440 568 HG21 THR 76 3HG2 THR 76 7.943 8.858 -10.684 569 HG22 THR 76 1HG2 THR 76 8.888 10.172 -9.989 570 HG23 THR 76 2HG2 THR 76 8.201 8.933 -8.943 571 H ASN 77 H ASN 77 7.215 6.081 -9.713 572 HA ASN 77 HA ASN 77 5.601 5.217 -11.093 573 HB2 ASN 77 2HB ASN 77 7.046 6.984 -13.090 574 HB3 ASN 77 1HB ASN 77 5.446 6.291 -13.331 575 HD21 ASN 77 1HD2 ASN 77 5.725 9.086 -13.336 576 HD22 ASN 77 2HD2 ASN 77 5.012 9.723 -11.935 577 H ASP 78 H ASP 78 7.325 3.272 -10.699 578 HA ASP 78 HA ASP 78 7.367 1.814 -13.231 579 HB2 ASP 78 2HB ASP 78 9.905 2.479 -11.715 580 HB3 ASP 78 1HB ASP 78 9.819 1.257 -12.981 581 H LEU 79 H LEU 79 9.397 1.215 -10.406 582 HA LEU 79 HA LEU 79 7.544 -0.837 -9.368 583 HB2 LEU 79 2HB LEU 79 9.034 -1.858 -11.200 584 HB3 LEU 79 1HB LEU 79 10.403 -1.567 -10.134 585 HG LEU 79 HG LEU 79 8.818 -2.896 -8.342 586 HD11 LEU 79 1HD1 LEU 79 7.536 -4.677 -9.400 587 HD12 LEU 79 2HD1 LEU 79 7.992 -4.108 -11.008 588 HD13 LEU 79 3HD1 LEU 79 6.951 -3.124 -9.987 589 HD21 LEU 79 3HD2 LEU 79 9.976 -5.000 -8.951 590 HD22 LEU 79 1HD2 LEU 79 11.081 -3.625 -8.995 591 HD23 LEU 79 2HD2 LEU 79 10.446 -4.295 -10.499 592 H ILE 80 H ILE 80 7.679 -1.047 -7.212 593 HA ILE 80 HA ILE 80 10.059 0.016 -5.746 594 HB ILE 80 HB ILE 80 7.143 0.309 -4.897 595 HG12 ILE 80 2HG1 ILE 80 9.131 2.418 -5.847 596 HG13 ILE 80 1HG1 ILE 80 7.791 1.806 -6.812 597 HG21 ILE 80 1HG2 ILE 80 8.731 0.056 -2.994 598 HG22 ILE 80 2HG2 ILE 80 8.132 1.702 -3.066 599 HG23 ILE 80 3HG2 ILE 80 9.743 1.326 -3.670 600 HD11 ILE 80 3HD1 ILE 80 6.245 2.582 -4.908 601 HD12 ILE 80 1HD1 ILE 80 7.021 3.847 -5.852 602 HD13 ILE 80 2HD1 ILE 80 7.647 3.432 -4.263 603 H GLU 81 H GLU 81 10.918 -1.488 -4.432 604 HA GLU 81 HA GLU 81 9.253 -3.514 -3.139 605 HB2 GLU 81 2HB GLU 81 10.677 -5.392 -4.006 606 HB3 GLU 81 1HB GLU 81 9.705 -4.630 -5.264 607 HG2 GLU 81 2HG GLU 81 11.650 -3.285 -5.970 608 HG3 GLU 81 1HG GLU 81 12.636 -4.033 -4.717 609 H TYR 82 H TYR 82 10.570 -4.804 -1.613 610 HA TYR 82 HA TYR 82 13.210 -3.815 -0.874 611 HB2 TYR 82 2HB TYR 82 12.409 -3.205 1.466 612 HB3 TYR 82 1HB TYR 82 11.923 -2.079 0.200 613 HD1 TYR 82 2HD TYR 82 9.592 -2.034 -0.652 614 HD2 TYR 82 1HD TYR 82 10.720 -4.640 2.584 615 HE1 TYR 82 2HE TYR 82 7.204 -2.390 -0.102 616 HE2 TYR 82 1HE TYR 82 8.323 -4.986 3.123 617 HH TYR 82 HH TYR 82 6.215 -4.067 2.794 618 H THR 83 H THR 83 14.222 -5.106 0.728 619 HA THR 83 HA THR 83 13.267 -7.878 0.741 620 HB THR 83 HB THR 83 15.835 -6.673 1.853 621 HG1 THR 83 1HG THR 83 15.513 -6.377 -0.415 622 HG21 THR 83 3HG2 THR 83 15.335 -8.905 2.767 623 HG22 THR 83 1HG2 THR 83 16.668 -9.006 1.617 624 HG23 THR 83 2HG2 THR 83 15.052 -9.523 1.139 625 H ILE 84 H ILE 84 12.363 -8.840 2.465 626 HA ILE 84 HA ILE 84 12.080 -7.339 5.022 627 HB ILE 84 HB ILE 84 10.459 -9.675 3.929 628 HG12 ILE 84 2HG1 ILE 84 9.738 -6.714 4.100 629 HG13 ILE 84 1HG1 ILE 84 10.231 -7.517 2.614 630 HG21 ILE 84 1HG2 ILE 84 10.034 -7.832 6.322 631 HG22 ILE 84 2HG2 ILE 84 10.438 -9.544 6.403 632 HG23 ILE 84 3HG2 ILE 84 8.880 -9.042 5.774 633 HD11 ILE 84 3HD1 ILE 84 8.307 -9.092 2.867 634 HD12 ILE 84 1HD1 ILE 84 7.818 -7.409 2.674 635 HD13 ILE 84 2HD1 ILE 84 7.774 -8.160 4.267 636 H GLY 85 H GLY 85 12.636 -8.309 6.944 637 HA2 GLY 85 2HA GLY 85 14.827 -10.012 7.067 638 HA3 GLY 85 1HA GLY 85 13.710 -9.744 8.401 639 H ASP 86 H ASP 86 11.361 -10.858 7.322 640 HA ASP 86 HA ASP 86 11.682 -13.591 7.896 641 HB2 ASP 86 2HB ASP 86 9.475 -12.156 6.384 642 HB3 ASP 86 1HB ASP 86 9.353 -13.789 7.041 643 H GLY 87 H GLY 87 12.133 -11.787 4.971 644 HA2 GLY 87 2HA GLY 87 13.266 -12.543 3.061 645 HA3 GLY 87 1HA GLY 87 12.967 -14.214 3.525 646 H ARG 88 H ARG 88 10.097 -12.511 3.873 647 HA ARG 88 HA ARG 88 8.843 -13.831 1.670 648 HB2 ARG 88 2HB ARG 88 7.883 -11.503 3.377 649 HB3 ARG 88 1HB ARG 88 6.880 -12.374 2.216 650 HG2 ARG 88 2HG ARG 88 7.350 -14.502 3.494 651 HG3 ARG 88 1HG ARG 88 8.200 -13.538 4.703 652 HD2 ARG 88 2HD ARG 88 5.295 -13.150 3.903 653 HD3 ARG 88 1HD ARG 88 5.824 -14.016 5.337 654 HE ARG 88 HE ARG 88 5.859 -11.116 4.910 655 HH11 ARG 88 1HH2 ARG 88 6.937 -13.799 6.840 656 HH12 ARG 88 2HH2 ARG 88 7.312 -12.821 8.218 657 HH21 ARG 88 1HH1 ARG 88 6.358 -9.852 6.716 658 HH22 ARG 88 2HH1 ARG 88 6.987 -10.595 8.149 659 H LYS 89 H LYS 89 8.297 -13.087 -0.344 660 HA LYS 89 HA LYS 89 9.728 -10.715 -1.338 661 HB2 LYS 89 2HB LYS 89 8.139 -12.837 -2.829 662 HB3 LYS 89 1HB LYS 89 9.179 -11.614 -3.558 663 HG2 LYS 89 2HG LYS 89 10.208 -13.711 -1.604 664 HG3 LYS 89 1HG LYS 89 10.205 -13.944 -3.345 665 HD2 LYS 89 2HD LYS 89 11.642 -11.922 -3.602 666 HD3 LYS 89 1HD LYS 89 11.691 -11.748 -1.851 667 HE2 LYS 89 2HE LYS 89 13.697 -12.916 -2.643 668 HE3 LYS 89 1HE LYS 89 12.712 -13.985 -1.643 669 HZ1 LYS 89 3HZ LYS 89 12.189 -15.279 -3.388 670 HZ2 LYS 89 1HZ LYS 89 13.618 -14.648 -4.049 671 HZ3 LYS 89 2HZ LYS 89 12.116 -13.984 -4.484 672 H VAL 90 H VAL 90 8.760 -8.851 -1.527 673 HA VAL 90 HA VAL 90 5.858 -8.666 -2.166 674 HB VAL 90 HB VAL 90 7.305 -6.961 -0.089 675 HG11 VAL 90 1HG1 VAL 90 4.971 -6.188 0.417 676 HG12 VAL 90 2HG1 VAL 90 4.384 -7.121 -0.960 677 HG13 VAL 90 3HG1 VAL 90 5.477 -5.762 -1.216 678 HG21 VAL 90 3HG2 VAL 90 7.022 -9.229 0.776 679 HG22 VAL 90 1HG2 VAL 90 5.349 -9.277 0.231 680 HG23 VAL 90 2HG2 VAL 90 5.816 -8.194 1.537 681 H ARG 91 H ARG 91 5.635 -7.513 -3.952 682 HA ARG 91 HA ARG 91 7.428 -5.221 -4.545 683 HB2 ARG 91 2HB ARG 91 7.506 -5.945 -6.924 684 HB3 ARG 91 1HB ARG 91 8.299 -7.099 -5.854 685 HG2 ARG 91 2HG ARG 91 6.248 -8.500 -5.857 686 HG3 ARG 91 1HG ARG 91 5.474 -7.363 -6.959 687 HD2 ARG 91 2HD ARG 91 7.235 -7.777 -8.634 688 HD3 ARG 91 1HD ARG 91 8.003 -8.926 -7.540 689 HE ARG 91 HE ARG 91 5.323 -9.702 -7.873 690 HH11 ARG 91 1HH2 ARG 91 8.253 -9.394 -9.714 691 HH12 ARG 91 2HH2 ARG 91 7.856 -10.680 -10.805 692 HH21 ARG 91 1HH1 ARG 91 4.812 -11.378 -9.298 693 HH22 ARG 91 2HH1 ARG 91 5.909 -11.801 -10.569 694 H ILE 92 H ILE 92 6.422 -3.525 -5.526 695 HA ILE 92 HA ILE 92 3.458 -3.680 -5.894 696 HB ILE 92 HB ILE 92 5.210 -1.289 -5.166 697 HG12 ILE 92 2HG1 ILE 92 3.248 -2.849 -3.422 698 HG13 ILE 92 1HG1 ILE 92 4.995 -3.037 -3.341 699 HG21 ILE 92 1HG2 ILE 92 3.011 -0.166 -4.765 700 HG22 ILE 92 2HG2 ILE 92 2.176 -1.623 -5.292 701 HG23 ILE 92 3HG2 ILE 92 3.133 -0.697 -6.438 702 HD11 ILE 92 3HD1 ILE 92 4.283 -1.510 -1.592 703 HD12 ILE 92 1HD1 ILE 92 3.445 -0.495 -2.765 704 HD13 ILE 92 2HD1 ILE 92 5.206 -0.611 -2.796 705 H VAL 93 H VAL 93 2.815 -3.468 -7.972 706 HA VAL 93 HA VAL 93 4.673 -2.321 -9.995 707 HB VAL 93 HB VAL 93 2.243 -4.112 -10.396 708 HG11 VAL 93 1HG1 VAL 93 4.475 -3.245 -12.274 709 HG12 VAL 93 2HG1 VAL 93 2.788 -2.741 -12.371 710 HG13 VAL 93 3HG1 VAL 93 3.222 -4.421 -12.671 711 HG21 VAL 93 3HG2 VAL 93 3.902 -5.908 -10.820 712 HG22 VAL 93 1HG2 VAL 93 4.019 -5.306 -9.169 713 HG23 VAL 93 2HG2 VAL 93 5.203 -4.806 -10.375 714 H PHE 94 H PHE 94 4.179 -0.381 -10.799 715 HA PHE 94 HA PHE 94 1.467 0.783 -10.353 716 HB2 PHE 94 2HB PHE 94 4.157 2.040 -11.025 717 HB3 PHE 94 1HB PHE 94 2.647 2.938 -10.856 718 HD1 PHE 94 2HD PHE 94 5.197 0.926 -9.051 719 HD2 PHE 94 1HD PHE 94 1.617 3.278 -8.647 720 HE1 PHE 94 2HE PHE 94 5.492 0.967 -6.592 721 HE2 PHE 94 1HE PHE 94 1.922 3.312 -6.187 722 HZ PHE 94 HZ PHE 94 3.856 2.157 -5.161 723 H THR 95 H THR 95 0.130 0.812 -12.026 724 HA THR 95 HA THR 95 1.166 1.027 -14.811 725 HB THR 95 HB THR 95 -1.156 -0.723 -13.898 726 HG1 THR 95 1HG THR 95 0.975 -1.445 -13.294 727 HG21 THR 95 3HG2 THR 95 0.241 -0.406 -16.580 728 HG22 THR 95 1HG2 THR 95 -1.405 0.104 -16.203 729 HG23 THR 95 2HG2 THR 95 -0.995 -1.608 -16.219 730 H HIS 96 H HIS 96 -0.168 2.172 -16.204 731 HA HIS 96 HA HIS 96 -2.643 3.414 -15.235 732 HB2 HIS 96 2HB HIS 96 -1.782 5.706 -15.720 733 HB3 HIS 96 1HB HIS 96 -0.934 4.948 -14.373 734 HD2 HIS 96 2HD HIS 96 -0.207 5.991 -18.103 735 HE1 HIS 96 1HE HIS 96 3.424 4.746 -16.344 736 HE2 HIS 96 2HE HIS 96 2.379 5.800 -18.406 737 H THR 97 H THR 97 -3.839 4.388 -16.896 738 HA THR 97 HA THR 97 -2.968 3.858 -19.704 739 HB THR 97 HB THR 97 -5.212 3.015 -20.203 740 HG1 THR 97 1HG THR 97 -5.986 4.267 -18.190 741 HG21 THR 97 3HG2 THR 97 -3.993 1.617 -17.800 742 HG22 THR 97 1HG2 THR 97 -3.473 1.404 -19.473 743 HG23 THR 97 2HG2 THR 97 -5.083 0.885 -18.974 744 H GLY 98 H GLY 98 -2.810 6.306 -18.316 745 HA2 GLY 98 2HA GLY 98 -3.208 8.527 -18.789 746 HA3 GLY 98 1HA GLY 98 -4.267 8.026 -20.103 747 H ASP 99 H ASP 99 -4.357 9.899 -17.559 748 HA ASP 99 HA ASP 99 -5.853 10.617 -16.000 749 HB2 ASP 99 2HB ASP 99 -8.131 10.904 -16.787 750 HB3 ASP 99 1HB ASP 99 -7.014 11.210 -18.112 751 H THR 100 H THR 100 -5.143 7.636 -16.069 752 HA THR 100 HA THR 100 -6.941 6.850 -13.891 753 HB THR 100 HB THR 100 -6.615 5.100 -16.369 754 HG1 THR 100 1HG THR 100 -8.491 5.841 -17.011 755 HG21 THR 100 3HG2 THR 100 -8.339 4.824 -13.881 756 HG22 THR 100 1HG2 THR 100 -6.948 3.820 -14.292 757 HG23 THR 100 2HG2 THR 100 -8.399 3.759 -15.286 758 H THR 101 H THR 101 -5.890 5.659 -12.402 759 HA THR 101 HA THR 101 -3.242 4.433 -13.056 760 HB THR 101 HB THR 101 -3.961 6.005 -10.557 761 HG1 THR 101 1HG THR 101 -2.042 6.564 -12.556 762 HG21 THR 101 3HG2 THR 101 -1.418 4.562 -11.404 763 HG22 THR 101 1HG2 THR 101 -2.409 4.214 -9.985 764 HG23 THR 101 2HG2 THR 101 -1.496 5.717 -10.077 765 H ASN 102 H ASN 102 -3.073 2.380 -12.447 766 HA ASN 102 HA ASN 102 -5.041 1.205 -10.524 767 HB2 ASN 102 2HB ASN 102 -3.656 -0.096 -12.895 768 HB3 ASN 102 1HB ASN 102 -4.773 -0.890 -11.783 769 HD21 ASN 102 1HD2 ASN 102 -4.762 0.270 -14.823 770 HD22 ASN 102 2HD2 ASN 102 -6.344 0.878 -14.932 771 H ILE 103 H ILE 103 -4.156 0.432 -8.722 772 HA ILE 103 HA ILE 103 -1.202 0.056 -8.516 773 HB ILE 103 HB ILE 103 -3.314 0.221 -6.324 774 HG12 ILE 103 2HG1 ILE 103 -1.327 2.370 -7.183 775 HG13 ILE 103 1HG1 ILE 103 -3.020 2.367 -7.666 776 HG21 ILE 103 1HG2 ILE 103 -1.309 -1.009 -5.607 777 HG22 ILE 103 2HG2 ILE 103 -1.320 0.568 -4.837 778 HG23 ILE 103 3HG2 ILE 103 -0.270 0.277 -6.222 779 HD11 ILE 103 3HD1 ILE 103 -2.750 3.811 -5.724 780 HD12 ILE 103 1HD1 ILE 103 -1.974 2.510 -4.821 781 HD13 ILE 103 2HD1 ILE 103 -3.683 2.386 -5.256 782 H VAL 104 H VAL 104 -0.459 -2.000 -8.561 783 HA VAL 104 HA VAL 104 -2.252 -4.251 -7.735 784 HB VAL 104 HB VAL 104 -0.167 -4.274 -9.950 785 HG11 VAL 104 1HG1 VAL 104 -0.453 -6.476 -8.897 786 HG12 VAL 104 2HG1 VAL 104 -1.210 -6.484 -10.485 787 HG13 VAL 104 3HG1 VAL 104 -2.206 -6.338 -9.038 788 HG21 VAL 104 3HG2 VAL 104 -2.120 -4.416 -11.476 789 HG22 VAL 104 1HG2 VAL 104 -2.111 -2.897 -10.579 790 HG23 VAL 104 2HG2 VAL 104 -3.202 -4.200 -10.099 791 H GLU 105 H GLU 105 -1.438 -5.458 -6.141 792 HA GLU 105 HA GLU 105 1.488 -5.705 -5.743 793 HB2 GLU 105 2HB GLU 105 0.684 -3.819 -4.297 794 HB3 GLU 105 1HB GLU 105 -0.436 -4.927 -3.511 795 HG2 GLU 105 2HG GLU 105 1.464 -6.322 -2.752 796 HG3 GLU 105 1HG GLU 105 2.587 -5.246 -3.577 797 H SER 106 H SER 106 2.089 -7.675 -4.976 798 HA SER 106 HA SER 106 0.023 -9.590 -4.015 799 HB2 SER 106 2HB SER 106 2.118 -10.205 -6.129 800 HB3 SER 106 1HB SER 106 0.982 -11.357 -5.420 801 HG SER 106 HG SER 106 0.185 -10.558 -7.376 802 H PHE 107 H PHE 107 0.728 -10.985 -2.483 803 HA PHE 107 HA PHE 107 3.589 -11.269 -1.862 804 HB2 PHE 107 2HB PHE 107 3.255 -10.509 0.506 805 HB3 PHE 107 1HB PHE 107 3.098 -9.207 -0.676 806 HD1 PHE 107 1HD PHE 107 1.226 -11.436 1.632 807 HD2 PHE 107 2HD PHE 107 0.929 -8.176 -1.162 808 HE1 PHE 107 1HE PHE 107 -1.081 -10.972 2.411 809 HE2 PHE 107 2HE PHE 107 -1.377 -7.720 -0.377 810 HZ PHE 107 HZ PHE 107 -2.381 -9.114 1.412 811 H ASP 108 H ASP 108 4.022 -12.913 -0.342 812 HA ASP 108 HA ASP 108 2.230 -15.126 -0.575 813 HB2 ASP 108 2HB ASP 108 4.760 -14.814 1.059 814 HB3 ASP 108 1HB ASP 108 3.930 -16.341 0.766 815 HA PRO 109 HA PRO 109 0.056 -14.293 3.335 816 HB2 PRO 109 2HB PRO 109 -1.362 -16.587 3.647 817 HB3 PRO 109 1HB PRO 109 -1.697 -15.497 2.290 818 HG2 PRO 109 2HG PRO 109 0.036 -17.962 2.298 819 HG3 PRO 109 1HG PRO 109 -1.280 -17.550 1.174 820 HD2 PRO 109 2HD PRO 109 1.313 -17.059 0.520 821 HD3 PRO 109 1HD PRO 109 0.018 -15.938 0.032 822 H GLU 110 H GLU 110 -0.456 -15.874 5.402 823 HA GLU 110 HA GLU 110 0.317 -17.079 7.188 824 HB2 GLU 110 2HB GLU 110 1.511 -18.509 5.279 825 HB3 GLU 110 1HB GLU 110 2.970 -17.690 5.823 826 HG2 GLU 110 2HG GLU 110 2.863 -19.754 7.060 827 HG3 GLU 110 1HG GLU 110 2.404 -18.486 8.193 828 H GLU 111 H GLU 111 0.746 -14.285 6.542 829 HA GLU 111 HA GLU 111 3.344 -13.542 7.725 830 HB2 GLU 111 2HB GLU 111 0.975 -11.849 6.857 831 HB3 GLU 111 1HB GLU 111 2.523 -11.208 7.408 832 HG2 GLU 111 2HG GLU 111 3.663 -12.372 5.560 833 HG3 GLU 111 1HG GLU 111 2.125 -13.016 5.001 834 H THR 112 H THR 112 0.055 -12.383 8.503 835 HA THR 112 HA THR 112 0.617 -12.731 11.414 836 HB THR 112 HB THR 112 -0.958 -10.465 10.142 837 HG1 THR 112 1HG THR 112 1.439 -10.611 9.862 838 HG21 THR 112 3HG2 THR 112 -0.743 -9.469 12.421 839 HG22 THR 112 1HG2 THR 112 0.006 -10.962 12.985 840 HG23 THR 112 2HG2 THR 112 -1.672 -10.964 12.442 841 H ASN 113 H ASN 113 -1.712 -12.919 8.795 842 HA ASN 113 HA ASN 113 -3.583 -14.429 10.544 843 HB2 ASN 113 2HB ASN 113 -5.133 -12.796 8.700 844 HB3 ASN 113 1HB ASN 113 -5.147 -12.728 10.457 845 HD21 ASN 113 1HD2 ASN 113 -3.562 -11.206 11.480 846 HD22 ASN 113 2HD2 ASN 113 -3.022 -9.863 10.594 847 HA PRO 114 HA PRO 114 -3.986 -17.299 7.183 848 HB2 PRO 114 2HB PRO 114 -6.690 -17.870 7.033 849 HB3 PRO 114 1HB PRO 114 -5.666 -18.419 8.381 850 HG2 PRO 114 2HG PRO 114 -7.398 -15.949 8.240 851 HG3 PRO 114 1HG PRO 114 -7.347 -17.194 9.510 852 HD2 PRO 114 2HD PRO 114 -5.999 -14.917 9.874 853 HD3 PRO 114 1HD PRO 114 -5.224 -16.453 10.324 854 H ARG 115 H ARG 115 -5.084 -17.723 5.025 855 HA ARG 115 HA ARG 115 -4.757 -15.514 3.345 856 HB2 ARG 115 2HB ARG 115 -6.261 -18.095 2.817 857 HB3 ARG 115 1HB ARG 115 -5.666 -16.983 1.583 858 HG2 ARG 115 2HG ARG 115 -3.358 -17.346 2.368 859 HG3 ARG 115 1HG ARG 115 -3.941 -18.456 3.602 860 HD2 ARG 115 2HD ARG 115 -3.143 -19.745 1.688 861 HD3 ARG 115 1HD ARG 115 -4.895 -19.903 1.794 862 HE ARG 115 HE ARG 115 -4.230 -17.720 0.102 863 HH11 ARG 115 1HH2 ARG 115 -4.152 -21.192 0.234 864 HH12 ARG 115 2HH2 ARG 115 -4.293 -21.390 -1.481 865 HH21 ARG 115 1HH1 ARG 115 -4.411 -17.989 -2.137 866 HH22 ARG 115 2HH1 ARG 115 -4.439 -19.581 -2.821 867 H GLU 116 H GLU 116 -7.808 -17.124 4.300 868 HA GLU 116 HA GLU 116 -9.598 -15.618 2.861 869 HB2 GLU 116 2HB GLU 116 -9.930 -16.643 5.697 870 HB3 GLU 116 1HB GLU 116 -11.247 -16.185 4.618 871 HG2 GLU 116 2HG GLU 116 -10.567 -17.927 3.020 872 HG3 GLU 116 1HG GLU 116 -9.224 -18.379 4.065 873 H LEU 117 H LEU 117 -8.440 -14.867 6.165 874 HA LEU 117 HA LEU 117 -9.898 -12.442 6.394 875 HB2 LEU 117 2HB LEU 117 -8.859 -13.884 8.264 876 HB3 LEU 117 1HB LEU 117 -7.340 -13.100 7.874 877 HG LEU 117 HG LEU 117 -8.835 -10.842 8.135 878 HD11 LEU 117 1HD1 LEU 117 -10.955 -12.084 8.545 879 HD12 LEU 117 2HD1 LEU 117 -10.516 -11.062 9.911 880 HD13 LEU 117 3HD1 LEU 117 -10.240 -12.801 9.990 881 HD21 LEU 117 3HD2 LEU 117 -7.722 -12.450 10.461 882 HD22 LEU 117 1HD2 LEU 117 -8.168 -10.744 10.556 883 HD23 LEU 117 2HD2 LEU 117 -6.861 -11.254 9.493 884 H GLN 118 H GLN 118 -6.602 -13.172 5.317 885 HA GLN 118 HA GLN 118 -5.683 -10.491 5.107 886 HB2 GLN 118 2HB GLN 118 -4.872 -13.093 3.780 887 HB3 GLN 118 1HB GLN 118 -4.007 -11.591 3.449 888 HG2 GLN 118 2HG GLN 118 -4.446 -12.544 6.306 889 HG3 GLN 118 1HG GLN 118 -3.088 -13.139 5.352 890 HE21 GLN 118 1HE2 GLN 118 -1.720 -11.968 7.046 891 HE22 GLN 118 2HE2 GLN 118 -1.463 -10.300 6.857 892 H GLN 119 H GLN 119 -6.939 -12.719 2.605 893 HA GLN 119 HA GLN 119 -6.847 -10.895 0.475 894 HB2 GLN 119 2HB GLN 119 -7.241 -13.363 0.276 895 HB3 GLN 119 1HB GLN 119 -8.876 -13.126 0.889 896 HG2 GLN 119 2HG GLN 119 -9.377 -11.635 -1.032 897 HG3 GLN 119 1HG GLN 119 -7.737 -11.864 -1.631 898 HE21 GLN 119 1HE2 GLN 119 -10.022 -12.600 -3.191 899 HE22 GLN 119 2HE2 GLN 119 -10.040 -14.291 -3.345 900 H SER 120 H SER 120 -9.626 -11.762 2.547 901 HA SER 120 HA SER 120 -11.385 -9.791 1.519 902 HB2 SER 120 2HB SER 120 -12.165 -11.753 2.784 903 HB3 SER 120 1HB SER 120 -11.386 -11.133 4.237 904 HG SER 120 HG SER 120 -13.626 -10.175 2.834 905 H GLY 121 H GLY 121 -9.161 -9.792 4.302 906 HA2 GLY 121 2HA GLY 121 -9.949 -7.310 5.397 907 HA3 GLY 121 1HA GLY 121 -8.390 -8.085 5.640 908 H TRP 122 H TRP 122 -7.198 -8.066 3.231 909 HA TRP 122 HA TRP 122 -6.371 -5.362 2.914 910 HB2 TRP 122 2HB TRP 122 -5.843 -7.903 1.352 911 HB3 TRP 122 1HB TRP 122 -5.201 -6.361 0.802 912 HD1 TRP 122 HD TRP 122 -5.347 -8.044 4.311 913 HE1 TRP 122 1HE TRP 122 -3.002 -7.864 5.362 914 HE3 TRP 122 3HE TRP 122 -2.869 -5.663 0.534 915 HZ2 TRP 122 2HZ TRP 122 -0.418 -6.840 4.692 916 HZ3 TRP 122 3HZ TRP 122 -0.472 -5.093 0.768 917 HH2 TRP 122 HH TRP 122 0.758 -5.678 2.841 918 H GLN 123 H GLN 123 -8.531 -7.447 1.013 919 HA GLN 123 HA GLN 123 -8.953 -5.598 -1.107 920 HB2 GLN 123 2HB GLN 123 -9.459 -8.044 -1.224 921 HB3 GLN 123 1HB GLN 123 -10.833 -7.782 -0.149 922 HG2 GLN 123 2HG GLN 123 -11.844 -6.245 -1.800 923 HG3 GLN 123 1HG GLN 123 -10.452 -6.454 -2.859 924 HE21 GLN 123 1HE2 GLN 123 -11.362 -7.614 -4.598 925 HE22 GLN 123 2HE2 GLN 123 -12.172 -9.095 -4.425 926 H ALA 124 H ALA 124 -10.587 -6.120 1.998 927 HA ALA 124 HA ALA 124 -12.843 -4.509 1.595 928 HB1 ALA 124 1HB ALA 124 -11.288 -5.009 4.146 929 HB2 ALA 124 2HB ALA 124 -12.623 -5.983 3.531 930 HB3 ALA 124 3HB ALA 124 -12.915 -4.332 4.074 931 H ILE 125 H ILE 125 -9.703 -3.561 3.065 932 HA ILE 125 HA ILE 125 -10.430 -0.826 3.399 933 HB ILE 125 HB ILE 125 -7.965 -0.466 3.716 934 HG12 ILE 125 2HG1 ILE 125 -7.780 -3.451 3.179 935 HG13 ILE 125 1HG1 ILE 125 -7.216 -2.216 2.065 936 HG21 ILE 125 1HG2 ILE 125 -9.422 -1.168 5.594 937 HG22 ILE 125 2HG2 ILE 125 -7.830 -1.894 5.761 938 HG23 ILE 125 3HG2 ILE 125 -9.175 -2.857 5.162 939 HD11 ILE 125 3HD1 ILE 125 -5.312 -3.006 3.337 940 HD12 ILE 125 1HD1 ILE 125 -6.157 -2.738 4.859 941 HD13 ILE 125 2HD1 ILE 125 -5.676 -1.361 3.864 942 H LEU 126 H LEU 126 -8.934 -2.574 0.737 943 HA LEU 126 HA LEU 126 -8.163 -0.298 -0.777 944 HB2 LEU 126 2HB LEU 126 -8.721 -3.189 -1.445 945 HB3 LEU 126 1HB LEU 126 -8.330 -2.061 -2.727 946 HG LEU 126 HG LEU 126 -6.496 -2.379 -0.301 947 HD11 LEU 126 1HD1 LEU 126 -6.364 -3.907 -2.928 948 HD12 LEU 126 2HD1 LEU 126 -6.728 -4.601 -1.350 949 HD13 LEU 126 3HD1 LEU 126 -5.129 -3.939 -1.669 950 HD21 LEU 126 3HD2 LEU 126 -4.760 -1.542 -1.908 951 HD22 LEU 126 1HD2 LEU 126 -6.067 -0.379 -1.736 952 HD23 LEU 126 2HD2 LEU 126 -5.992 -1.411 -3.157 953 H ASN 127 H ASN 127 -11.174 -2.128 -0.543 954 HA ASN 127 HA ASN 127 -12.515 -0.915 -2.741 955 HB2 ASN 127 2HB ASN 127 -13.594 -2.115 -0.166 956 HB3 ASN 127 1HB ASN 127 -14.601 -1.652 -1.536 957 HD21 ASN 127 1HD2 ASN 127 -14.073 -4.407 -0.404 958 HD22 ASN 127 2HD2 ASN 127 -13.485 -5.309 -1.715 959 H SER 128 H SER 128 -12.107 -0.007 0.637 960 HA SER 128 HA SER 128 -13.902 2.218 0.620 961 HB2 SER 128 2HB SER 128 -11.518 1.673 2.409 962 HB3 SER 128 1HB SER 128 -12.801 2.840 2.724 963 HG SER 128 HG SER 128 -14.211 1.220 3.034 964 H PHE 129 H PHE 129 -10.479 1.823 -0.182 965 HA PHE 129 HA PHE 129 -9.670 4.502 -0.141 966 HB2 PHE 129 2HB PHE 129 -8.159 2.527 -0.401 967 HB3 PHE 129 1HB PHE 129 -8.724 2.338 -2.056 968 HD1 PHE 129 2HD PHE 129 -8.163 4.044 -3.800 969 HD2 PHE 129 1HD PHE 129 -6.662 4.384 0.221 970 HE1 PHE 129 2HE PHE 129 -6.517 5.745 -4.546 971 HE2 PHE 129 1HE PHE 129 -5.027 6.081 -0.537 972 HZ PHE 129 HZ PHE 129 -4.953 6.761 -2.919 973 H LYS 130 H LYS 130 -10.933 2.620 -2.905 974 HA LYS 130 HA LYS 130 -10.921 4.807 -4.736 975 HB2 LYS 130 2HB LYS 130 -12.451 3.348 -6.101 976 HB3 LYS 130 1HB LYS 130 -10.949 2.561 -5.632 977 HG2 LYS 130 2HG LYS 130 -12.091 1.449 -3.764 978 HG3 LYS 130 1HG LYS 130 -13.610 2.221 -4.202 979 HD2 LYS 130 2HD LYS 130 -12.040 0.344 -6.018 980 HD3 LYS 130 1HD LYS 130 -13.402 -0.152 -5.022 981 HE2 LYS 130 2HE LYS 130 -14.762 1.696 -6.277 982 HE3 LYS 130 1HE LYS 130 -13.444 1.666 -7.452 983 HZ1 LYS 130 3HZ LYS 130 -14.741 -0.825 -6.565 984 HZ2 LYS 130 1HZ LYS 130 -13.851 -0.529 -7.979 985 HZ3 LYS 130 2HZ LYS 130 -15.413 0.117 -7.808 986 H SER 131 H SER 131 -13.310 3.560 -2.462 987 HA SER 131 HA SER 131 -15.552 5.009 -3.355 988 HB2 SER 131 2HB SER 131 -15.682 3.170 -1.714 989 HB3 SER 131 1HB SER 131 -14.852 4.172 -0.529 990 HG SER 131 HG SER 131 -17.285 4.845 -1.832 991 H TYR 132 H TYR 132 -12.856 5.905 -1.275 992 HA TYR 132 HA TYR 132 -13.896 8.286 -0.197 993 HB2 TYR 132 2HB TYR 132 -11.824 7.167 0.601 994 HB3 TYR 132 1HB TYR 132 -11.006 7.647 -0.884 995 HD1 TYR 132 2HD TYR 132 -12.433 8.854 2.314 996 HD2 TYR 132 1HD TYR 132 -10.418 10.022 -1.305 997 HE1 TYR 132 2HE TYR 132 -11.938 11.071 3.300 998 HE2 TYR 132 1HE TYR 132 -9.932 12.239 -0.312 999 HH TYR 132 HH TYR 132 -11.207 13.679 1.689 1000 H THR 133 H THR 133 -12.076 7.711 -3.217 1001 HA THR 133 HA THR 133 -11.818 10.405 -3.996 1002 HB THR 133 HB THR 133 -11.364 9.504 -6.223 1003 HG1 THR 133 1HG THR 133 -13.142 7.837 -5.775 1004 HG21 THR 133 3HG2 THR 133 -9.615 9.271 -4.487 1005 HG22 THR 133 1HG2 THR 133 -9.565 7.935 -5.637 1006 HG23 THR 133 2HG2 THR 133 -10.280 7.700 -4.044 1007 H GLU 134 H GLU 134 -14.423 8.061 -4.410 1008 HA GLU 134 HA GLU 134 -15.965 9.574 -6.286 1009 HB2 GLU 134 2HB GLU 134 -16.830 7.454 -4.290 1010 HB3 GLU 134 1HB GLU 134 -17.807 8.039 -5.633 1011 HG2 GLU 134 2HG GLU 134 -15.087 6.705 -5.949 1012 HG3 GLU 134 1HG GLU 134 -16.630 5.878 -6.142 1013 H ASN 135 H ASN 135 -15.907 9.337 -2.757 1014 HA ASN 135 HA ASN 135 -18.163 11.004 -2.262 1015 HB2 ASN 135 2HB ASN 135 -15.767 10.433 -0.493 1016 HB3 ASN 135 1HB ASN 135 -17.311 11.103 0.038 1017 HD21 ASN 135 1HD2 ASN 135 -15.905 8.422 0.637 1018 HD22 ASN 135 2HD2 ASN 135 -17.095 7.259 0.301 1019 H ASN 136 H ASN 136 -14.799 11.656 -2.961 1020 HA ASN 136 HA ASN 136 -14.677 14.327 -1.968 1021 HB2 ASN 136 2HB ASN 136 -12.683 12.935 -2.484 1022 HB3 ASN 136 1HB ASN 136 -13.071 13.033 -4.199 1023 HD21 ASN 136 1HD2 ASN 136 -12.856 15.425 -1.487 1024 HD22 ASN 136 2HD2 ASN 136 -11.912 16.534 -2.359 1025 H LEU 137 H LEU 137 -16.279 12.947 -4.646 1026 HA LEU 137 HA LEU 137 -16.117 15.035 -6.539 1027 HB2 LEU 137 2HB LEU 137 -17.089 12.600 -6.756 1028 HB3 LEU 137 1HB LEU 137 -18.593 13.304 -6.178 1029 HG LEU 137 HG LEU 137 -18.115 15.107 -8.153 1030 HD11 LEU 137 1HD1 LEU 137 -16.711 12.614 -9.188 1031 HD12 LEU 137 2HD1 LEU 137 -15.903 14.124 -8.766 1032 HD13 LEU 137 3HD1 LEU 137 -17.044 14.080 -10.108 1033 HD21 LEU 137 3HD2 LEU 137 -19.464 13.719 -9.708 1034 HD22 LEU 137 1HD2 LEU 137 -20.109 13.669 -8.067 1035 HD23 LEU 137 2HD2 LEU 137 -19.177 12.309 -8.687 1036 H GLU 138 H GLU 138 -17.565 16.741 -7.014 1037 HA GLU 138 HA GLU 138 -18.786 18.609 -6.464 1038 HB2 GLU 138 2HB GLU 138 -20.386 16.563 -4.886 1039 HB3 GLU 138 1HB GLU 138 -20.933 18.193 -5.260 1040 HG2 GLU 138 2HG GLU 138 -20.201 16.113 -7.354 1041 HG3 GLU 138 1HG GLU 138 -21.844 16.465 -6.834 1042 H HIS 139 H HIS 139 -16.475 18.008 -4.851 1043 HA HIS 139 HA HIS 139 -16.963 19.832 -2.656 1044 HB2 HIS 139 2HB HIS 139 -17.739 17.657 -1.699 1045 HB3 HIS 139 1HB HIS 139 -16.145 16.972 -2.010 1046 HD2 HIS 139 2HD HIS 139 -17.844 19.508 0.472 1047 HE1 HIS 139 1HE HIS 139 -13.849 18.944 1.716 1048 HE2 HIS 139 2HE HIS 139 -16.078 19.994 2.333 1049 H HIS 140 H HIS 140 -14.999 18.283 -4.912 1050 HA HIS 140 HA HIS 140 -12.433 18.527 -3.734 1051 HB2 HIS 140 2HB HIS 140 -12.895 17.213 -5.798 1052 HB3 HIS 140 1HB HIS 140 -13.175 18.713 -6.678 1053 HD2 HIS 140 2HD HIS 140 -10.827 20.080 -7.444 1054 HE1 HIS 140 1HE HIS 140 -8.085 17.446 -5.607 1055 HE2 HIS 140 2HE HIS 140 -8.308 19.451 -7.150 1056 H HIS 141 H HIS 141 -14.409 20.769 -5.654 1057 HA HIS 141 HA HIS 141 -13.202 23.083 -4.466 1058 HB2 HIS 141 2HB HIS 141 -11.395 22.429 -6.064 1059 HB3 HIS 141 1HB HIS 141 -12.547 22.547 -7.391 1060 HD2 HIS 141 2HD HIS 141 -10.919 25.012 -4.723 1061 HE1 HIS 141 1HE HIS 141 -12.292 27.268 -8.016 1062 HE2 HIS 141 2HE HIS 141 -11.042 27.383 -5.809 1063 H HIS 142 H HIS 142 -15.756 22.557 -4.371 1064 HA HIS 142 HA HIS 142 -17.359 23.335 -6.586 1065 HB2 HIS 142 2HB HIS 142 -18.223 22.053 -4.637 1066 HB3 HIS 142 1HB HIS 142 -18.010 23.474 -3.617 1067 HD2 HIS 142 2HD HIS 142 -20.194 25.192 -3.653 1068 HE1 HIS 142 1HE HIS 142 -22.093 23.652 -7.096 1069 HE2 HIS 142 2HE HIS 142 -22.298 25.323 -5.194 1070 H HIS 143 H HIS 143 -16.045 25.108 -3.804 1071 HA HIS 143 HA HIS 143 -17.289 27.602 -4.350 1072 HB2 HIS 143 2HB HIS 143 -14.665 27.049 -2.919 1073 HB3 HIS 143 1HB HIS 143 -15.611 28.534 -2.817 1074 HD2 HIS 143 2HD HIS 143 -17.925 28.363 -1.178 1075 HE1 HIS 143 1HE HIS 143 -17.264 24.398 0.114 1076 HE2 HIS 143 2HE HIS 143 -18.669 26.483 0.475 1077 H HIS 144 H HIS 144 -16.523 29.434 -5.407 1078 HA HIS 144 HA HIS 144 -15.089 29.054 -7.800 1079 HB2 HIS 144 2HB HIS 144 -15.077 31.550 -7.920 1080 HB3 HIS 144 1HB HIS 144 -16.668 30.896 -7.525 1081 HD2 HIS 144 2HD HIS 144 -17.313 31.094 -4.658 1082 HE1 HIS 144 1HE HIS 144 -14.502 34.171 -3.982 1083 HE2 HIS 144 2HE HIS 144 -16.493 32.938 -3.001 Start of MODEL 9 1 H1 GLY 1 1HT GLY 1 -1.420 -21.658 -2.416 2 H2 GLY 1 2HT GLY 1 -0.010 -20.954 -1.782 3 H3 GLY 1 3HT GLY 1 0.075 -21.938 -3.164 4 HA2 GLY 1 2HA GLY 1 0.116 -19.950 -4.211 5 HA3 GLY 1 1HA GLY 1 -1.630 -20.151 -4.071 6 H ASN 2 H ASN 2 0.834 -19.363 -1.623 7 HA ASN 2 HA ASN 2 -0.769 -17.424 -0.307 8 HB2 ASN 2 2HB ASN 2 1.351 -16.843 0.882 9 HB3 ASN 2 1HB ASN 2 1.037 -18.577 0.858 10 HD21 ASN 2 1HD2 ASN 2 3.079 -19.532 0.693 11 HD22 ASN 2 2HD2 ASN 2 4.243 -19.111 -0.467 12 H LYS 3 H LYS 3 0.902 -17.295 -3.224 13 HA LYS 3 HA LYS 3 1.742 -14.541 -3.205 14 HB2 LYS 3 2HB LYS 3 1.211 -16.445 -5.517 15 HB3 LYS 3 1HB LYS 3 2.008 -14.876 -5.656 16 HG2 LYS 3 2HG LYS 3 3.787 -15.636 -4.127 17 HG3 LYS 3 1HG LYS 3 2.999 -17.208 -3.985 18 HD2 LYS 3 2HD LYS 3 3.282 -17.578 -6.410 19 HD3 LYS 3 1HD LYS 3 4.053 -15.999 -6.566 20 HE2 LYS 3 2HE LYS 3 5.745 -17.787 -6.432 21 HE3 LYS 3 1HE LYS 3 5.849 -16.728 -5.025 22 HZ1 LYS 3 3HZ LYS 3 5.066 -18.321 -3.649 23 HZ2 LYS 3 1HZ LYS 3 5.734 -19.350 -4.819 24 HZ3 LYS 3 2HZ LYS 3 4.066 -19.025 -4.827 25 H ILE 4 H ILE 4 -0.733 -14.416 -2.188 26 HA ILE 4 HA ILE 4 -2.915 -14.190 -3.912 27 HB ILE 4 HB ILE 4 -2.330 -12.474 -1.463 28 HG12 ILE 4 2HG1 ILE 4 -3.825 -15.133 -1.633 29 HG13 ILE 4 1HG1 ILE 4 -2.172 -14.969 -1.050 30 HG21 ILE 4 1HG2 ILE 4 -4.942 -13.236 -2.827 31 HG22 ILE 4 2HG2 ILE 4 -4.218 -11.635 -2.820 32 HG23 ILE 4 3HG2 ILE 4 -4.818 -12.323 -1.328 33 HD11 ILE 4 3HD1 ILE 4 -3.012 -13.370 0.706 34 HD12 ILE 4 1HD1 ILE 4 -3.641 -15.008 0.873 35 HD13 ILE 4 2HD1 ILE 4 -4.654 -13.738 0.184 36 H THR 5 H THR 5 -3.604 -12.631 -5.302 37 HA THR 5 HA THR 5 -1.946 -10.174 -5.664 38 HB THR 5 HB THR 5 -3.330 -11.789 -7.852 39 HG1 THR 5 1HG THR 5 -0.713 -11.748 -6.834 40 HG21 THR 5 3HG2 THR 5 -1.955 -10.344 -9.345 41 HG22 THR 5 1HG2 THR 5 -1.403 -9.439 -7.937 42 HG23 THR 5 2HG2 THR 5 -3.106 -9.402 -8.400 43 H VAL 6 H VAL 6 -3.038 -8.328 -5.693 44 HA VAL 6 HA VAL 6 -5.969 -8.260 -6.103 45 HB VAL 6 HB VAL 6 -6.159 -6.704 -4.125 46 HG11 VAL 6 1HG1 VAL 6 -5.144 -9.489 -3.465 47 HG12 VAL 6 2HG1 VAL 6 -6.793 -9.099 -3.947 48 HG13 VAL 6 3HG1 VAL 6 -6.147 -8.480 -2.427 49 HG21 VAL 6 3HG2 VAL 6 -3.338 -7.712 -3.560 50 HG22 VAL 6 1HG2 VAL 6 -4.324 -6.791 -2.432 51 HG23 VAL 6 2HG2 VAL 6 -3.787 -6.052 -3.940 52 H GLU 7 H GLU 7 -6.735 -6.116 -6.531 53 HA GLU 7 HA GLU 7 -4.772 -4.080 -7.307 54 HB2 GLU 7 2HB GLU 7 -5.537 -3.965 -9.622 55 HB3 GLU 7 1HB GLU 7 -4.932 -5.581 -9.269 56 HG2 GLU 7 2HG GLU 7 -6.935 -6.252 -10.266 57 HG3 GLU 7 1HG GLU 7 -7.586 -5.983 -8.654 58 H VAL 8 H VAL 8 -5.879 -2.079 -8.066 59 HA VAL 8 HA VAL 8 -8.700 -1.767 -7.347 60 HB VAL 8 HB VAL 8 -7.605 -1.489 -5.171 61 HG11 VAL 8 1HG1 VAL 8 -5.358 -0.929 -5.942 62 HG12 VAL 8 2HG1 VAL 8 -5.938 0.284 -4.799 63 HG13 VAL 8 3HG1 VAL 8 -5.924 0.639 -6.520 64 HG21 VAL 8 3HG2 VAL 8 -9.534 0.031 -5.837 65 HG22 VAL 8 1HG2 VAL 8 -8.340 1.267 -6.244 66 HG23 VAL 8 2HG2 VAL 8 -8.487 0.696 -4.584 67 H THR 9 H THR 9 -9.627 -0.005 -8.353 68 HA THR 9 HA THR 9 -8.040 1.296 -10.465 69 HB THR 9 HB THR 9 -10.236 2.014 -11.288 70 HG1 THR 9 1HG THR 9 -11.062 2.152 -9.073 71 HG21 THR 9 3HG2 THR 9 -9.424 -0.261 -11.878 72 HG22 THR 9 1HG2 THR 9 -11.185 -0.190 -11.790 73 HG23 THR 9 2HG2 THR 9 -10.264 -0.903 -10.466 74 H VAL 10 H VAL 10 -7.281 3.306 -10.170 75 HA VAL 10 HA VAL 10 -8.583 5.154 -8.221 76 HB VAL 10 HB VAL 10 -5.587 4.798 -8.642 77 HG11 VAL 10 1HG1 VAL 10 -6.183 7.100 -8.015 78 HG12 VAL 10 2HG1 VAL 10 -5.445 6.298 -6.635 79 HG13 VAL 10 3HG1 VAL 10 -7.195 6.505 -6.700 80 HG21 VAL 10 3HG2 VAL 10 -5.608 3.862 -6.338 81 HG22 VAL 10 1HG2 VAL 10 -6.549 2.868 -7.449 82 HG23 VAL 10 2HG2 VAL 10 -7.369 3.953 -6.324 83 H TYR 11 H TYR 11 -9.028 7.093 -9.070 84 HA TYR 11 HA TYR 11 -8.088 7.757 -11.802 85 HB2 TYR 11 2HB TYR 11 -10.248 9.009 -10.068 86 HB3 TYR 11 1HB TYR 11 -9.906 9.411 -11.752 87 HD1 TYR 11 2HD TYR 11 -10.433 7.808 -13.577 88 HD2 TYR 11 1HD TYR 11 -11.333 6.871 -9.474 89 HE1 TYR 11 2HE TYR 11 -11.871 5.932 -14.314 90 HE2 TYR 11 1HE TYR 11 -12.768 4.998 -10.220 91 HH TYR 11 HH TYR 11 -12.641 3.562 -12.963 92 H ALA 12 H ALA 12 -6.001 8.495 -11.359 93 HA ALA 12 HA ALA 12 -5.779 11.237 -10.548 94 HB1 ALA 12 1HB ALA 12 -4.575 9.158 -8.692 95 HB2 ALA 12 2HB ALA 12 -5.922 10.223 -8.299 96 HB3 ALA 12 3HB ALA 12 -4.320 10.901 -8.590 97 H ALA 13 H ALA 13 -3.714 12.097 -10.978 98 HA ALA 13 HA ALA 13 -2.342 10.906 -13.141 99 HB1 ALA 13 1HB ALA 13 -1.408 13.088 -11.249 100 HB2 ALA 13 2HB ALA 13 -2.345 13.335 -12.722 101 HB3 ALA 13 3HB ALA 13 -0.696 12.718 -12.820 102 H ILE 14 H ILE 14 -0.546 9.629 -13.245 103 HA ILE 14 HA ILE 14 0.130 7.921 -11.216 104 HB ILE 14 HB ILE 14 0.725 7.642 -13.627 105 HG12 ILE 14 2HG1 ILE 14 2.961 6.545 -13.207 106 HG13 ILE 14 1HG1 ILE 14 3.011 7.317 -11.627 107 HG21 ILE 14 1HG2 ILE 14 3.126 9.417 -13.024 108 HG22 ILE 14 2HG2 ILE 14 1.687 9.994 -13.869 109 HG23 ILE 14 3HG2 ILE 14 2.673 8.712 -14.573 110 HD11 ILE 14 3HD1 ILE 14 2.088 4.836 -11.983 111 HD12 ILE 14 1HD1 ILE 14 0.570 5.670 -12.253 112 HD13 ILE 14 2HD1 ILE 14 1.444 5.887 -10.734 113 H GLU 15 H GLU 15 1.559 11.048 -11.970 114 HA GLU 15 HA GLU 15 3.750 10.897 -10.160 115 HB2 GLU 15 2HB GLU 15 3.595 12.458 -12.112 116 HB3 GLU 15 1HB GLU 15 2.359 13.370 -11.251 117 HG2 GLU 15 2HG GLU 15 3.960 13.843 -9.431 118 HG3 GLU 15 1HG GLU 15 5.188 12.891 -10.255 119 H LYS 16 H LYS 16 0.403 12.065 -9.846 120 HA LYS 16 HA LYS 16 0.764 13.357 -7.322 121 HB2 LYS 16 2HB LYS 16 -1.127 13.804 -8.892 122 HB3 LYS 16 1HB LYS 16 -1.780 12.210 -8.527 123 HG2 LYS 16 2HG LYS 16 -1.998 12.828 -6.143 124 HG3 LYS 16 1HG LYS 16 -1.296 14.409 -6.488 125 HD2 LYS 16 2HD LYS 16 -3.195 14.905 -8.004 126 HD3 LYS 16 1HD LYS 16 -3.888 13.324 -7.642 127 HE2 LYS 16 2HE LYS 16 -4.940 15.077 -6.255 128 HE3 LYS 16 1HE LYS 16 -4.041 13.940 -5.248 129 HZ1 LYS 16 3HZ LYS 16 -3.633 16.318 -4.720 130 HZ2 LYS 16 1HZ LYS 16 -2.925 16.500 -6.250 131 HZ3 LYS 16 2HZ LYS 16 -2.227 15.450 -5.112 132 H VAL 17 H VAL 17 -0.649 10.186 -8.188 133 HA VAL 17 HA VAL 17 -1.111 9.327 -5.535 134 HB VAL 17 HB VAL 17 -2.210 8.324 -7.492 135 HG11 VAL 17 1HG1 VAL 17 0.480 7.032 -8.097 136 HG12 VAL 17 2HG1 VAL 17 -0.191 8.405 -8.970 137 HG13 VAL 17 3HG1 VAL 17 -1.014 6.857 -9.007 138 HG21 VAL 17 3HG2 VAL 17 -2.091 5.996 -6.779 139 HG22 VAL 17 1HG2 VAL 17 -1.978 7.019 -5.349 140 HG23 VAL 17 2HG2 VAL 17 -0.531 6.254 -6.010 141 H TRP 18 H TRP 18 1.704 9.044 -7.673 142 HA TRP 18 HA TRP 18 3.186 7.153 -6.262 143 HB2 TRP 18 2HB TRP 18 3.901 8.006 -8.441 144 HB3 TRP 18 1HB TRP 18 4.130 9.619 -7.767 145 HD1 TRP 18 HD TRP 18 6.156 9.925 -5.990 146 HE1 TRP 18 1HE TRP 18 8.355 8.612 -5.707 147 HE3 TRP 18 3HE TRP 18 5.033 5.748 -8.692 148 HZ2 TRP 18 2HZ TRP 18 9.487 6.119 -6.521 149 HZ3 TRP 18 3HZ TRP 18 6.687 3.918 -8.924 150 HH2 TRP 18 HH TRP 18 8.908 4.099 -7.833 151 H LYS 19 H LYS 19 3.143 10.685 -5.837 152 HA LYS 19 HA LYS 19 4.977 10.737 -3.647 153 HB2 LYS 19 2HB LYS 19 2.827 12.716 -4.470 154 HB3 LYS 19 1HB LYS 19 4.081 13.038 -3.267 155 HG2 LYS 19 2HG LYS 19 5.824 12.630 -4.978 156 HG3 LYS 19 1HG LYS 19 4.569 12.329 -6.181 157 HD2 LYS 19 2HD LYS 19 3.706 14.619 -5.873 158 HD3 LYS 19 1HD LYS 19 4.945 14.928 -4.654 159 HE2 LYS 19 2HE LYS 19 6.707 14.555 -6.331 160 HE3 LYS 19 1HE LYS 19 5.483 14.222 -7.556 161 HZ1 LYS 19 3HZ LYS 19 5.344 16.380 -7.931 162 HZ2 LYS 19 1HZ LYS 19 6.473 16.708 -6.708 163 HZ3 LYS 19 2HZ LYS 19 4.817 16.632 -6.336 164 H TYR 20 H TYR 20 1.409 10.720 -3.805 165 HA TYR 20 HA TYR 20 0.988 10.913 -1.021 166 HB2 TYR 20 2HB TYR 20 -0.755 11.364 -2.731 167 HB3 TYR 20 1HB TYR 20 -0.789 9.649 -3.126 168 HD1 TYR 20 2HD TYR 20 -1.616 7.972 -1.461 169 HD2 TYR 20 1HD TYR 20 -1.772 12.196 -0.651 170 HE1 TYR 20 2HE TYR 20 -3.165 7.560 0.428 171 HE2 TYR 20 1HE TYR 20 -3.314 11.775 1.237 172 HH TYR 20 HH TYR 20 -4.668 10.222 2.197 173 H TRP 21 H TRP 21 1.244 8.117 -3.182 174 HA TRP 21 HA TRP 21 0.697 6.144 -1.190 175 HB2 TRP 21 2HB TRP 21 0.416 5.815 -3.668 176 HB3 TRP 21 1HB TRP 21 2.170 5.793 -3.842 177 HD1 TRP 21 HD TRP 21 3.423 3.578 -3.135 178 HE1 TRP 21 1HE TRP 21 2.634 1.272 -2.301 179 HE3 TRP 21 3HE TRP 21 -1.494 4.604 -2.283 180 HZ2 TRP 21 2HZ TRP 21 0.222 0.025 -1.397 181 HZ3 TRP 21 3HZ TRP 21 -3.019 2.845 -1.444 182 HH2 TRP 21 HH TRP 21 -2.172 0.559 -1.000 183 H ASN 22 H ASN 22 3.521 7.949 -1.999 184 HA ASN 22 HA ASN 22 5.369 6.068 -0.623 185 HB2 ASN 22 2HB ASN 22 5.883 8.544 -2.302 186 HB3 ASN 22 1HB ASN 22 7.133 7.527 -1.586 187 HD21 ASN 22 1HD2 ASN 22 5.611 5.005 -2.144 188 HD22 ASN 22 2HD2 ASN 22 5.751 4.759 -3.817 189 H GLU 23 H GLU 23 3.784 9.161 -0.310 190 HA GLU 23 HA GLU 23 5.573 10.365 1.500 191 HB2 GLU 23 2HB GLU 23 2.757 10.854 0.648 192 HB3 GLU 23 1HB GLU 23 3.153 11.511 2.226 193 HG2 GLU 23 2HG GLU 23 5.031 12.770 1.288 194 HG3 GLU 23 1HG GLU 23 4.779 12.047 -0.294 195 HA PRO 24 HA PRO 24 4.609 7.742 5.062 196 HB2 PRO 24 2HB PRO 24 5.989 9.019 7.050 197 HB3 PRO 24 1HB PRO 24 6.828 8.169 5.737 198 HG2 PRO 24 2HG PRO 24 6.259 11.115 6.003 199 HG3 PRO 24 1HG PRO 24 7.772 10.312 5.530 200 HD2 PRO 24 2HD PRO 24 6.019 11.356 3.672 201 HD3 PRO 24 1HD PRO 24 7.045 9.943 3.328 202 H ALA 25 H ALA 25 4.276 11.278 5.461 203 HA ALA 25 HA ALA 25 2.565 11.302 7.676 204 HB1 ALA 25 1HB ALA 25 2.660 13.265 5.374 205 HB2 ALA 25 2HB ALA 25 3.678 13.316 6.811 206 HB3 ALA 25 3HB ALA 25 1.938 13.569 6.956 207 H HIS 26 H HIS 26 1.920 10.672 4.314 208 HA HIS 26 HA HIS 26 -0.976 10.885 4.543 209 HB2 HIS 26 2HB HIS 26 0.816 9.768 2.366 210 HB3 HIS 26 1HB HIS 26 -0.930 9.971 2.225 211 HD2 HIS 26 2HD HIS 26 0.359 12.994 4.104 212 HE1 HIS 26 1HE HIS 26 0.449 14.100 0.032 213 HE2 HIS 26 2HE HIS 26 0.607 14.968 2.414 214 H ILE 27 H ILE 27 1.378 8.176 4.284 215 HA ILE 27 HA ILE 27 -0.571 6.112 4.286 216 HB ILE 27 HB ILE 27 2.342 6.137 5.157 217 HG12 ILE 27 2HG1 ILE 27 1.110 5.029 2.590 218 HG13 ILE 27 1HG1 ILE 27 1.720 6.676 2.710 219 HG21 ILE 27 1HG2 ILE 27 0.434 3.789 4.748 220 HG22 ILE 27 2HG2 ILE 27 1.349 4.171 6.207 221 HG23 ILE 27 3HG2 ILE 27 2.187 3.598 4.775 222 HD11 ILE 27 3HD1 ILE 27 3.945 5.837 3.313 223 HD12 ILE 27 1HD1 ILE 27 3.425 5.146 1.782 224 HD13 ILE 27 2HD1 ILE 27 3.356 4.176 3.250 225 H MET 28 H MET 28 1.313 7.555 6.951 226 HA MET 28 HA MET 28 0.251 5.916 9.000 227 HB2 MET 28 2HB MET 28 1.297 7.467 10.533 228 HB3 MET 28 1HB MET 28 2.356 7.173 9.161 229 HG2 MET 28 2HG MET 28 2.514 9.506 9.277 230 HG3 MET 28 1HG MET 28 1.134 9.368 8.198 231 HE1 MET 28 3HE MET 28 2.245 9.337 11.828 232 HE2 MET 28 1HE MET 28 1.198 10.520 12.628 233 HE3 MET 28 2HE MET 28 2.382 11.048 11.436 234 H LYS 29 H LYS 29 -1.348 8.151 7.152 235 HA LYS 29 HA LYS 29 -3.087 9.207 9.267 236 HB2 LYS 29 2HB LYS 29 -2.282 10.591 7.304 237 HB3 LYS 29 1HB LYS 29 -3.297 9.603 6.261 238 HG2 LYS 29 2HG LYS 29 -5.289 10.242 7.538 239 HG3 LYS 29 1HG LYS 29 -4.294 11.204 8.632 240 HD2 LYS 29 2HD LYS 29 -3.590 12.628 6.721 241 HD3 LYS 29 1HD LYS 29 -4.634 11.686 5.654 242 HE2 LYS 29 2HE LYS 29 -5.554 13.278 8.069 243 HE3 LYS 29 1HE LYS 29 -5.783 13.740 6.383 244 HZ1 LYS 29 3HZ LYS 29 -6.858 11.299 7.684 245 HZ2 LYS 29 1HZ LYS 29 -7.051 11.699 6.048 246 HZ3 LYS 29 2HZ LYS 29 -7.755 12.673 7.248 247 H TRP 30 H TRP 30 -3.078 6.722 6.838 248 HA TRP 30 HA TRP 30 -5.742 5.767 7.731 249 HB2 TRP 30 2HB TRP 30 -6.414 5.271 5.419 250 HB3 TRP 30 1HB TRP 30 -6.126 6.999 5.613 251 HD1 TRP 30 HD TRP 30 -3.893 7.993 4.525 252 HE1 TRP 30 1HE TRP 30 -2.355 7.146 2.628 253 HE3 TRP 30 3HE TRP 30 -5.559 3.184 4.132 254 HZ2 TRP 30 2HZ TRP 30 -1.911 4.744 1.130 255 HZ3 TRP 30 3HZ TRP 30 -4.588 1.650 2.473 256 HH2 TRP 30 HH TRP 30 -2.772 2.413 0.970 257 H CYS 31 H CYS 31 -2.799 4.970 8.120 258 HA CYS 31 HA CYS 31 -2.228 2.633 6.697 259 HB2 CYS 31 2HB CYS 31 -0.755 3.892 8.369 260 HB3 CYS 31 1HB CYS 31 -1.587 3.010 9.638 261 HG CYS 31 HG CYS 31 0.514 1.863 7.739 262 H GLN 32 H GLN 32 -2.965 0.581 6.794 263 HA GLN 32 HA GLN 32 -4.218 -1.239 7.347 264 HB2 GLN 32 2HB GLN 32 -4.435 -0.038 10.127 265 HB3 GLN 32 1HB GLN 32 -4.748 -1.705 9.676 266 HG2 GLN 32 2HG GLN 32 -2.059 -0.323 9.342 267 HG3 GLN 32 1HG GLN 32 -2.477 -1.384 10.681 268 HE21 GLN 32 1HE2 GLN 32 -0.716 -1.501 7.942 269 HE22 GLN 32 2HE2 GLN 32 -0.993 -3.105 7.462 270 H ALA 33 H ALA 33 -5.439 1.941 7.957 271 HA ALA 33 HA ALA 33 -7.521 2.879 7.842 272 HB1 ALA 33 1HB ALA 33 -7.342 1.978 5.528 273 HB2 ALA 33 2HB ALA 33 -9.008 1.980 6.116 274 HB3 ALA 33 3HB ALA 33 -8.088 0.478 6.080 275 H SER 34 H SER 34 -6.933 0.900 9.977 276 HA SER 34 HA SER 34 -9.647 -0.166 10.581 277 HB2 SER 34 2HB SER 34 -6.935 -1.017 11.587 278 HB3 SER 34 1HB SER 34 -8.478 -1.693 12.107 279 HG SER 34 HG SER 34 -8.822 -2.065 9.758 280 HA PRO 35 HA PRO 35 -9.392 3.480 13.476 281 HB2 PRO 35 2HB PRO 35 -11.992 2.168 14.339 282 HB3 PRO 35 1HB PRO 35 -11.644 3.898 14.094 283 HG2 PRO 35 2HG PRO 35 -12.995 2.557 12.246 284 HG3 PRO 35 1HG PRO 35 -11.726 3.703 11.755 285 HD2 PRO 35 2HD PRO 35 -11.596 0.678 11.829 286 HD3 PRO 35 1HD PRO 35 -10.910 1.815 10.637 287 H GLU 36 H GLU 36 -9.474 0.120 14.044 288 HA GLU 36 HA GLU 36 -9.304 0.185 16.958 289 HB2 GLU 36 2HB GLU 36 -9.036 -1.996 14.869 290 HB3 GLU 36 1HB GLU 36 -8.876 -2.304 16.603 291 HG2 GLU 36 2HG GLU 36 -11.165 -1.411 16.952 292 HG3 GLU 36 1HG GLU 36 -11.314 -1.135 15.220 293 H TRP 37 H TRP 37 -7.237 1.329 14.854 294 HA TRP 37 HA TRP 37 -4.863 0.634 16.463 295 HB2 TRP 37 2HB TRP 37 -5.129 0.173 13.467 296 HB3 TRP 37 1HB TRP 37 -3.560 0.342 14.252 297 HD1 TRP 37 HD TRP 37 -6.637 -1.972 14.202 298 HE1 TRP 37 1HE TRP 37 -5.931 -4.265 15.152 299 HE3 TRP 37 3HE TRP 37 -1.886 -0.873 15.691 300 HZ2 TRP 37 2HZ TRP 37 -3.638 -5.470 16.385 301 HZ3 TRP 37 3HZ TRP 37 -0.461 -2.602 16.747 302 HH2 TRP 37 HH TRP 37 -1.329 -4.895 17.096 303 H HIS 38 H HIS 38 -3.074 2.063 16.006 304 HA HIS 38 HA HIS 38 -3.693 4.622 14.672 305 HB2 HIS 38 2HB HIS 38 -2.902 4.379 17.600 306 HB3 HIS 38 1HB HIS 38 -3.034 5.888 16.695 307 HD2 HIS 38 2HD HIS 38 -5.198 4.161 19.094 308 HE1 HIS 38 1HE HIS 38 -7.933 5.575 16.205 309 HE2 HIS 38 2HE HIS 38 -7.713 4.616 18.545 310 H VAL 39 H VAL 39 -1.748 5.966 14.518 311 HA VAL 39 HA VAL 39 0.770 4.392 14.611 312 HB VAL 39 HB VAL 39 -0.024 6.358 12.451 313 HG11 VAL 39 1HG1 VAL 39 2.353 4.471 12.796 314 HG12 VAL 39 2HG1 VAL 39 2.405 6.233 12.742 315 HG13 VAL 39 3HG1 VAL 39 1.972 5.314 11.301 316 HG21 VAL 39 3HG2 VAL 39 -1.408 4.332 12.314 317 HG22 VAL 39 1HG2 VAL 39 0.026 3.312 12.472 318 HG23 VAL 39 2HG2 VAL 39 -0.194 4.312 11.039 319 HA PRO 40 HA PRO 40 1.398 8.322 16.976 320 HB2 PRO 40 2HB PRO 40 3.258 7.433 18.789 321 HB3 PRO 40 1HB PRO 40 1.524 7.074 18.961 322 HG2 PRO 40 2HG PRO 40 3.710 5.319 17.868 323 HG3 PRO 40 1HG PRO 40 2.383 4.893 18.970 324 HD2 PRO 40 2HD PRO 40 2.312 4.376 16.269 325 HD3 PRO 40 1HD PRO 40 0.836 4.653 17.220 326 H ALA 41 H ALA 41 3.454 6.446 15.016 327 HA ALA 41 HA ALA 41 5.005 8.720 14.214 328 HB1 ALA 41 1HB ALA 41 6.179 8.203 16.318 329 HB2 ALA 41 2HB ALA 41 7.209 7.878 14.924 330 HB3 ALA 41 3HB ALA 41 6.427 6.545 15.776 331 H ALA 42 H ALA 42 6.287 8.294 12.384 332 HA ALA 42 HA ALA 42 6.604 5.657 11.305 333 HB1 ALA 42 1HB ALA 42 4.610 7.485 9.955 334 HB2 ALA 42 2HB ALA 42 4.214 6.007 10.820 335 HB3 ALA 42 3HB ALA 42 5.162 5.924 9.340 336 H GLN 43 H GLN 43 7.934 5.600 9.483 337 HA GLN 43 HA GLN 43 8.951 8.151 8.392 338 HB2 GLN 43 2HB GLN 43 10.715 6.017 9.654 339 HB3 GLN 43 1HB GLN 43 11.295 7.404 8.729 340 HG2 GLN 43 2HG GLN 43 10.183 8.924 10.394 341 HG3 GLN 43 1HG GLN 43 9.749 7.507 11.345 342 HE21 GLN 43 1HE2 GLN 43 12.090 9.892 11.072 343 HE22 GLN 43 2HE2 GLN 43 13.362 9.096 11.864 344 H ASN 44 H ASN 44 10.101 7.868 6.432 345 HA ASN 44 HA ASN 44 10.210 5.268 5.134 346 HB2 ASN 44 2HB ASN 44 7.816 5.948 4.831 347 HB3 ASN 44 1HB ASN 44 8.361 7.417 4.027 348 HD21 ASN 44 1HD2 ASN 44 7.277 6.687 2.021 349 HD22 ASN 44 2HD2 ASN 44 7.981 5.474 1.065 350 H ASP 45 H ASP 45 12.308 5.513 4.555 351 HA ASP 45 HA ASP 45 13.267 8.029 3.332 352 HB2 ASP 45 2HB ASP 45 14.663 6.863 5.045 353 HB3 ASP 45 1HB ASP 45 14.762 5.458 3.987 354 H LEU 46 H LEU 46 12.055 7.894 1.363 355 HA LEU 46 HA LEU 46 12.037 5.600 -0.301 356 HB2 LEU 46 2HB LEU 46 10.421 7.522 -0.478 357 HB3 LEU 46 1HB LEU 46 11.721 8.507 -1.135 358 HG LEU 46 HG LEU 46 11.960 6.814 -3.019 359 HD11 LEU 46 1HD1 LEU 46 11.043 4.779 -2.260 360 HD12 LEU 46 2HD1 LEU 46 9.779 5.363 -3.329 361 HD13 LEU 46 3HD1 LEU 46 9.603 5.543 -1.586 362 HD21 LEU 46 3HD2 LEU 46 9.230 8.101 -2.703 363 HD22 LEU 46 1HD2 LEU 46 9.943 7.576 -4.227 364 HD23 LEU 46 2HD2 LEU 46 10.677 8.897 -3.317 365 H LYS 47 H LYS 47 14.142 4.800 -0.570 366 HA LYS 47 HA LYS 47 15.640 5.925 -2.720 367 HB2 LYS 47 2HB LYS 47 16.345 7.470 -0.866 368 HB3 LYS 47 1HB LYS 47 16.960 6.080 0.020 369 HG2 LYS 47 2HG LYS 47 18.542 5.586 -1.804 370 HG3 LYS 47 1HG LYS 47 17.887 6.922 -2.751 371 HD2 LYS 47 2HD LYS 47 18.596 8.508 -0.987 372 HD3 LYS 47 1HD LYS 47 19.259 7.168 -0.052 373 HE2 LYS 47 2HE LYS 47 20.824 6.650 -1.886 374 HE3 LYS 47 1HE LYS 47 20.156 7.976 -2.839 375 HZ1 LYS 47 3HZ LYS 47 20.860 8.881 -0.253 376 HZ2 LYS 47 1HZ LYS 47 21.432 9.409 -1.761 377 HZ3 LYS 47 2HZ LYS 47 22.192 8.109 -0.972 378 H ALA 48 H ALA 48 17.136 4.462 -3.529 379 HA ALA 48 HA ALA 48 16.758 1.729 -2.938 380 HB1 ALA 48 1HB ALA 48 17.563 2.558 -5.118 381 HB2 ALA 48 2HB ALA 48 18.669 1.361 -4.448 382 HB3 ALA 48 3HB ALA 48 19.072 3.077 -4.368 383 H GLY 49 H GLY 49 17.852 0.316 -1.613 384 HA2 GLY 49 2HA GLY 49 19.331 -0.473 -0.038 385 HA3 GLY 49 1HA GLY 49 20.432 0.834 -0.471 386 H GLY 50 H GLY 50 17.559 2.281 0.156 387 HA2 GLY 50 2HA GLY 50 18.396 3.301 2.746 388 HA3 GLY 50 1HA GLY 50 16.935 3.732 1.856 389 H THR 51 H THR 51 16.894 3.272 4.615 390 HA THR 51 HA THR 51 15.285 0.765 4.850 391 HB THR 51 HB THR 51 16.998 2.061 7.003 392 HG1 THR 51 1HG THR 51 17.710 0.558 4.988 393 HG21 THR 51 3HG2 THR 51 15.400 -0.524 6.925 394 HG22 THR 51 1HG2 THR 51 15.127 0.859 7.990 395 HG23 THR 51 2HG2 THR 51 16.575 -0.127 8.175 396 H PHE 52 H PHE 52 13.548 0.877 6.294 397 HA PHE 52 HA PHE 52 12.572 3.576 7.080 398 HB2 PHE 52 2HB PHE 52 10.349 3.032 6.223 399 HB3 PHE 52 1HB PHE 52 11.522 2.926 4.912 400 HD1 PHE 52 2HD PHE 52 9.307 0.980 7.164 401 HD2 PHE 52 1HD PHE 52 12.166 0.723 3.960 402 HE1 PHE 52 2HE PHE 52 8.649 -1.380 6.764 403 HE2 PHE 52 1HE PHE 52 11.504 -1.628 3.564 404 HZ PHE 52 HZ PHE 52 9.749 -2.680 4.961 405 H THR 53 H THR 53 10.952 3.502 8.746 406 HA THR 53 HA THR 53 10.595 0.964 10.194 407 HB THR 53 HB THR 53 11.707 3.452 11.554 408 HG1 THR 53 1HG THR 53 13.487 2.718 10.738 409 HG21 THR 53 3HG2 THR 53 12.015 1.893 13.463 410 HG22 THR 53 1HG2 THR 53 11.225 0.617 12.539 411 HG23 THR 53 2HG2 THR 53 10.316 2.049 13.024 412 H THR 54 H THR 54 8.481 0.835 10.658 413 HA THR 54 HA THR 54 6.908 3.330 11.095 414 HB THR 54 HB THR 54 5.857 0.707 9.967 415 HG1 THR 54 1HG THR 54 5.864 2.692 8.207 416 HG21 THR 54 3HG2 THR 54 4.193 2.215 11.058 417 HG22 THR 54 1HG2 THR 54 3.929 2.086 9.321 418 HG23 THR 54 2HG2 THR 54 4.705 3.519 9.994 419 H THR 55 H THR 55 6.265 3.518 13.158 420 HA THR 55 HA THR 55 6.255 1.188 14.949 421 HB THR 55 HB THR 55 5.634 4.118 15.530 422 HG1 THR 55 1HG THR 55 8.016 2.632 15.431 423 HG21 THR 55 3HG2 THR 55 6.376 1.790 17.335 424 HG22 THR 55 1HG2 THR 55 4.799 2.576 17.260 425 HG23 THR 55 2HG2 THR 55 6.198 3.463 17.857 426 H MET 56 H MET 56 4.435 -0.025 14.954 427 HA MET 56 HA MET 56 1.768 1.292 14.704 428 HB2 MET 56 2HB MET 56 2.639 -1.504 13.881 429 HB3 MET 56 1HB MET 56 1.006 -0.848 13.752 430 HG2 MET 56 2HG MET 56 1.802 0.887 12.197 431 HG3 MET 56 1HG MET 56 3.453 0.297 12.371 432 HE1 MET 56 3HE MET 56 -0.050 -1.659 10.187 433 HE2 MET 56 1HE MET 56 -0.108 -0.384 11.407 434 HE3 MET 56 2HE MET 56 0.053 -2.072 11.891 435 H ALA 57 H ALA 57 0.594 1.168 16.512 436 HA ALA 57 HA ALA 57 0.846 -1.173 18.311 437 HB1 ALA 57 1HB ALA 57 2.328 0.584 19.214 438 HB2 ALA 57 2HB ALA 57 0.946 0.300 20.272 439 HB3 ALA 57 3HB ALA 57 0.978 1.717 19.221 440 H ALA 58 H ALA 58 -1.024 -1.766 19.258 441 HA ALA 58 HA ALA 58 -3.502 -0.804 18.171 442 HB1 ALA 58 1HB ALA 58 -4.540 -2.406 19.717 443 HB2 ALA 58 2HB ALA 58 -2.993 -2.632 20.536 444 HB3 ALA 58 3HB ALA 58 -3.189 -3.146 18.861 445 H LYS 59 H LYS 59 -5.189 0.305 19.291 446 HA LYS 59 HA LYS 59 -4.444 2.505 20.792 447 HB2 LYS 59 2HB LYS 59 -6.600 2.218 19.546 448 HB3 LYS 59 1HB LYS 59 -7.148 1.109 20.801 449 HG2 LYS 59 2HG LYS 59 -6.939 2.893 22.487 450 HG3 LYS 59 1HG LYS 59 -6.345 3.997 21.253 451 HD2 LYS 59 2HD LYS 59 -8.493 3.783 20.039 452 HD3 LYS 59 1HD LYS 59 -9.082 2.685 21.288 453 HE2 LYS 59 2HE LYS 59 -8.828 4.468 22.981 454 HE3 LYS 59 1HE LYS 59 -8.235 5.568 21.737 455 HZ1 LYS 59 3HZ LYS 59 -10.813 5.302 22.455 456 HZ2 LYS 59 1HZ LYS 59 -10.739 4.293 21.094 457 HZ3 LYS 59 2HZ LYS 59 -10.283 5.925 20.966 458 H ASP 60 H ASP 60 -5.489 -0.706 21.842 459 HA ASP 60 HA ASP 60 -5.515 -0.028 24.678 460 HB2 ASP 60 2HB ASP 60 -5.692 -2.695 23.241 461 HB3 ASP 60 1HB ASP 60 -5.955 -2.448 24.966 462 H GLY 61 H GLY 61 -3.116 -0.656 22.404 463 HA2 GLY 61 2HA GLY 61 -0.869 -1.104 22.564 464 HA3 GLY 61 1HA GLY 61 -1.005 -0.662 24.262 465 H SER 62 H SER 62 -3.103 -3.173 23.302 466 HA SER 62 HA SER 62 -1.910 -5.083 25.049 467 HB2 SER 62 2HB SER 62 -4.323 -5.060 24.546 468 HB3 SER 62 1HB SER 62 -3.983 -5.485 22.871 469 HG SER 62 HG SER 62 -2.969 -7.395 23.685 470 H MET 63 H MET 63 -1.349 -4.222 21.768 471 HA MET 63 HA MET 63 0.782 -6.181 21.517 472 HB2 MET 63 2HB MET 63 -1.253 -7.477 20.845 473 HB3 MET 63 1HB MET 63 -1.562 -6.293 19.578 474 HG2 MET 63 2HG MET 63 0.567 -6.848 18.490 475 HG3 MET 63 1HG MET 63 0.992 -7.929 19.814 476 HE1 MET 63 3HE MET 63 -2.060 -7.223 17.345 477 HE2 MET 63 1HE MET 63 -1.916 -8.684 16.360 478 HE3 MET 63 2HE MET 63 -0.580 -7.538 16.440 479 H SER 64 H SER 64 2.362 -5.416 20.253 480 HA SER 64 HA SER 64 1.851 -3.377 18.198 481 HB2 SER 64 2HB SER 64 3.777 -2.937 20.499 482 HB3 SER 64 1HB SER 64 3.567 -1.873 19.110 483 HG SER 64 HG SER 64 1.957 -2.274 21.333 484 H PHE 65 H PHE 65 3.567 -3.116 16.738 485 HA PHE 65 HA PHE 65 5.939 -4.798 16.897 486 HB2 PHE 65 2HB PHE 65 3.712 -5.358 14.895 487 HB3 PHE 65 1HB PHE 65 5.377 -5.860 14.604 488 HD1 PHE 65 2HD PHE 65 6.559 -7.255 16.422 489 HD2 PHE 65 1HD PHE 65 2.280 -6.784 16.270 490 HE1 PHE 65 2HE PHE 65 6.286 -9.256 17.847 491 HE2 PHE 65 1HE PHE 65 2.024 -8.795 17.696 492 HZ PHE 65 HZ PHE 65 4.021 -10.026 18.488 493 H ASP 66 H ASP 66 7.526 -4.165 15.507 494 HA ASP 66 HA ASP 66 7.133 -1.566 14.100 495 HB2 ASP 66 2HB ASP 66 9.632 -2.860 15.244 496 HB3 ASP 66 1HB ASP 66 9.573 -1.303 14.420 497 H PHE 67 H PHE 67 7.074 -1.718 11.954 498 HA PHE 67 HA PHE 67 8.142 -4.091 10.548 499 HB2 PHE 67 2HB PHE 67 6.402 -1.739 9.694 500 HB3 PHE 67 1HB PHE 67 6.951 -2.991 8.578 501 HD1 PHE 67 1HD PHE 67 4.732 -2.254 11.445 502 HD2 PHE 67 2HD PHE 67 6.119 -5.308 8.752 503 HE1 PHE 67 1HE PHE 67 2.890 -3.737 12.180 504 HE2 PHE 67 2HE PHE 67 4.270 -6.790 9.491 505 HZ PHE 67 HZ PHE 67 2.659 -6.005 11.205 506 H GLY 68 H GLY 68 9.877 -3.992 9.229 507 HA2 GLY 68 2HA GLY 68 11.016 -1.452 8.320 508 HA3 GLY 68 1HA GLY 68 12.003 -2.390 9.445 509 H GLY 69 H GLY 69 12.562 -1.756 6.688 510 HA2 GLY 69 2HA GLY 69 13.405 -4.337 5.754 511 HA3 GLY 69 1HA GLY 69 12.054 -3.697 4.811 512 H VAL 70 H VAL 70 14.196 -4.019 3.331 513 HA VAL 70 HA VAL 70 15.421 -1.299 3.058 514 HB VAL 70 HB VAL 70 16.735 -3.968 2.431 515 HG11 VAL 70 1HG1 VAL 70 17.781 -1.111 2.383 516 HG12 VAL 70 2HG1 VAL 70 17.544 -2.153 0.980 517 HG13 VAL 70 3HG1 VAL 70 18.781 -2.549 2.167 518 HG21 VAL 70 3HG2 VAL 70 17.198 -2.021 4.722 519 HG22 VAL 70 1HG2 VAL 70 18.181 -3.447 4.382 520 HG23 VAL 70 2HG2 VAL 70 16.497 -3.634 4.861 521 H TYR 71 H TYR 71 15.231 -0.386 1.095 522 HA TYR 71 HA TYR 71 13.557 -1.612 -0.924 523 HB2 TYR 71 2HB TYR 71 15.156 0.972 -0.941 524 HB3 TYR 71 1HB TYR 71 13.968 0.505 -2.159 525 HD1 TYR 71 2HD TYR 71 11.556 0.084 -1.457 526 HD2 TYR 71 1HD TYR 71 14.412 1.960 1.165 527 HE1 TYR 71 2HE TYR 71 9.711 0.940 -0.049 528 HE2 TYR 71 1HE TYR 71 12.556 2.812 2.564 529 HH TYR 71 HH TYR 71 9.191 1.897 1.904 530 H ASP 72 H ASP 72 14.272 -2.970 -2.464 531 HA ASP 72 HA ASP 72 17.092 -3.416 -2.940 532 HB2 ASP 72 2HB ASP 72 14.651 -4.456 -4.411 533 HB3 ASP 72 1HB ASP 72 16.297 -5.073 -4.563 534 H GLN 73 H GLN 73 14.398 -1.849 -4.626 535 HA GLN 73 HA GLN 73 16.195 -0.151 -6.130 536 HB2 GLN 73 2HB GLN 73 16.250 -2.266 -7.460 537 HB3 GLN 73 1HB GLN 73 14.502 -2.169 -7.652 538 HG2 GLN 73 2HG GLN 73 14.725 -0.020 -8.836 539 HG3 GLN 73 1HG GLN 73 16.469 -0.045 -8.580 540 HE21 GLN 73 1HE2 GLN 73 14.898 -0.109 -11.170 541 HE22 GLN 73 2HE2 GLN 73 15.439 -1.506 -11.970 542 H VAL 74 H VAL 74 15.146 1.627 -6.982 543 HA VAL 74 HA VAL 74 12.218 1.798 -6.949 544 HB VAL 74 HB VAL 74 12.888 2.378 -4.632 545 HG11 VAL 74 1HG1 VAL 74 15.198 3.237 -5.265 546 HG12 VAL 74 2HG1 VAL 74 14.317 4.275 -4.144 547 HG13 VAL 74 3HG1 VAL 74 14.425 4.715 -5.847 548 HG21 VAL 74 3HG2 VAL 74 11.733 4.539 -4.529 549 HG22 VAL 74 1HG2 VAL 74 10.940 3.511 -5.715 550 HG23 VAL 74 2HG2 VAL 74 12.005 4.816 -6.236 551 H LYS 75 H LYS 75 11.478 3.211 -8.438 552 HA LYS 75 HA LYS 75 13.202 5.292 -9.583 553 HB2 LYS 75 2HB LYS 75 12.103 3.003 -11.262 554 HB3 LYS 75 1HB LYS 75 12.709 4.510 -11.943 555 HG2 LYS 75 2HG LYS 75 14.909 4.066 -10.830 556 HG3 LYS 75 1HG LYS 75 14.281 2.510 -10.285 557 HD2 LYS 75 2HD LYS 75 13.928 1.804 -12.611 558 HD3 LYS 75 1HD LYS 75 14.523 3.363 -13.183 559 HE2 LYS 75 2HE LYS 75 16.123 1.368 -11.542 560 HE3 LYS 75 1HE LYS 75 16.311 1.658 -13.272 561 HZ1 LYS 75 3HZ LYS 75 16.414 4.136 -12.073 562 HZ2 LYS 75 1HZ LYS 75 17.712 3.274 -12.743 563 HZ3 LYS 75 2HZ LYS 75 17.363 3.128 -11.087 564 H THR 76 H THR 76 12.044 7.034 -10.135 565 HA THR 76 HA THR 76 9.484 7.479 -9.276 566 HB THR 76 HB THR 76 10.726 8.800 -11.718 567 HG1 THR 76 1HG THR 76 11.638 8.621 -9.253 568 HG21 THR 76 3HG2 THR 76 8.373 9.436 -11.298 569 HG22 THR 76 1HG2 THR 76 9.462 10.774 -10.941 570 HG23 THR 76 2HG2 THR 76 8.777 9.820 -9.625 571 H ASN 77 H ASN 77 7.594 6.582 -9.814 572 HA ASN 77 HA ASN 77 5.919 5.564 -10.998 573 HB2 ASN 77 2HB ASN 77 7.059 7.212 -13.270 574 HB3 ASN 77 1HB ASN 77 5.444 6.511 -13.202 575 HD21 ASN 77 1HD2 ASN 77 5.225 7.147 -10.233 576 HD22 ASN 77 2HD2 ASN 77 4.944 8.818 -10.171 577 H ASP 78 H ASP 78 7.039 3.501 -10.746 578 HA ASP 78 HA ASP 78 7.320 2.122 -13.249 579 HB2 ASP 78 2HB ASP 78 9.532 3.208 -13.176 580 HB3 ASP 78 1HB ASP 78 9.804 2.544 -11.576 581 H LEU 79 H LEU 79 9.136 1.425 -10.311 582 HA LEU 79 HA LEU 79 7.125 -0.493 -9.353 583 HB2 LEU 79 2HB LEU 79 8.335 -1.721 -11.097 584 HB3 LEU 79 1HB LEU 79 9.864 -1.352 -10.317 585 HG LEU 79 HG LEU 79 7.896 -2.636 -8.446 586 HD11 LEU 79 1HD1 LEU 79 7.273 -3.840 -10.503 587 HD12 LEU 79 2HD1 LEU 79 8.098 -4.904 -9.369 588 HD13 LEU 79 3HD1 LEU 79 8.960 -4.269 -10.772 589 HD21 LEU 79 3HD2 LEU 79 10.343 -2.267 -7.990 590 HD22 LEU 79 1HD2 LEU 79 10.718 -3.473 -9.218 591 HD23 LEU 79 2HD2 LEU 79 9.815 -3.930 -7.773 592 H ILE 80 H ILE 80 7.295 -0.933 -7.225 593 HA ILE 80 HA ILE 80 9.652 0.073 -5.703 594 HB ILE 80 HB ILE 80 6.734 0.374 -4.858 595 HG12 ILE 80 2HG1 ILE 80 8.711 2.496 -5.799 596 HG13 ILE 80 1HG1 ILE 80 7.368 1.890 -6.761 597 HG21 ILE 80 1HG2 ILE 80 9.346 1.366 -3.638 598 HG22 ILE 80 2HG2 ILE 80 8.319 0.099 -2.972 599 HG23 ILE 80 3HG2 ILE 80 7.739 1.752 -3.026 600 HD11 ILE 80 3HD1 ILE 80 6.647 3.951 -5.741 601 HD12 ILE 80 1HD1 ILE 80 7.193 3.426 -4.153 602 HD13 ILE 80 2HD1 ILE 80 5.810 2.646 -4.918 603 H GLU 81 H GLU 81 10.443 -1.418 -4.344 604 HA GLU 81 HA GLU 81 8.766 -3.503 -3.174 605 HB2 GLU 81 2HB GLU 81 10.308 -5.324 -3.996 606 HB3 GLU 81 1HB GLU 81 9.344 -4.591 -5.276 607 HG2 GLU 81 2HG GLU 81 11.230 -3.165 -5.928 608 HG3 GLU 81 1HG GLU 81 12.213 -3.840 -4.633 609 H TYR 82 H TYR 82 9.959 -4.703 -1.553 610 HA TYR 82 HA TYR 82 12.585 -3.839 -0.719 611 HB2 TYR 82 2HB TYR 82 11.764 -2.977 1.518 612 HB3 TYR 82 1HB TYR 82 11.373 -1.931 0.157 613 HD1 TYR 82 1HD TYR 82 9.062 -1.827 -0.761 614 HD2 TYR 82 2HD TYR 82 9.978 -4.214 2.701 615 HE1 TYR 82 1HE TYR 82 6.650 -2.019 -0.252 616 HE2 TYR 82 2HE TYR 82 7.557 -4.388 3.203 617 HH TYR 82 HH TYR 82 5.507 -3.573 2.710 618 H THR 83 H THR 83 13.389 -5.077 1.045 619 HA THR 83 HA THR 83 12.147 -7.742 1.235 620 HB THR 83 HB THR 83 14.379 -8.231 2.427 621 HG1 THR 83 1HG THR 83 15.100 -5.736 1.340 622 HG21 THR 83 3HG2 THR 83 14.026 -8.765 0.051 623 HG22 THR 83 1HG2 THR 83 15.679 -8.211 0.335 624 HG23 THR 83 2HG2 THR 83 14.498 -7.122 -0.390 625 H ILE 84 H ILE 84 11.224 -8.491 3.012 626 HA ILE 84 HA ILE 84 11.049 -6.773 5.442 627 HB ILE 84 HB ILE 84 9.259 -9.065 4.532 628 HG12 ILE 84 2HG1 ILE 84 8.722 -6.062 4.519 629 HG13 ILE 84 1HG1 ILE 84 9.172 -6.975 3.084 630 HG21 ILE 84 1HG2 ILE 84 9.241 -8.798 6.979 631 HG22 ILE 84 2HG2 ILE 84 7.742 -8.161 6.344 632 HG23 ILE 84 3HG2 ILE 84 9.030 -7.059 6.823 633 HD11 ILE 84 3HD1 ILE 84 6.698 -7.489 4.771 634 HD12 ILE 84 1HD1 ILE 84 7.167 -8.383 3.324 635 HD13 ILE 84 2HD1 ILE 84 6.733 -6.681 3.210 636 H GLY 85 H GLY 85 11.448 -7.657 7.469 637 HA2 GLY 85 2HA GLY 85 13.548 -9.444 7.761 638 HA3 GLY 85 1HA GLY 85 12.406 -9.038 9.038 639 H ASP 86 H ASP 86 10.038 -10.120 7.906 640 HA ASP 86 HA ASP 86 10.179 -12.800 8.706 641 HB2 ASP 86 2HB ASP 86 8.151 -11.347 6.970 642 HB3 ASP 86 1HB ASP 86 7.895 -12.950 7.657 643 H GLY 87 H GLY 87 11.046 -11.288 5.745 644 HA2 GLY 87 2HA GLY 87 12.228 -12.245 3.972 645 HA3 GLY 87 1HA GLY 87 11.789 -13.855 4.531 646 H ARG 88 H ARG 88 9.055 -11.937 4.544 647 HA ARG 88 HA ARG 88 7.818 -13.324 2.371 648 HB2 ARG 88 2HB ARG 88 6.997 -10.794 3.843 649 HB3 ARG 88 1HB ARG 88 5.962 -11.679 2.718 650 HG2 ARG 88 2HG ARG 88 6.114 -13.688 4.137 651 HG3 ARG 88 1HG ARG 88 7.160 -12.826 5.265 652 HD2 ARG 88 2HD ARG 88 4.325 -11.990 4.563 653 HD3 ARG 88 1HD ARG 88 4.782 -12.875 6.016 654 HE ARG 88 HE ARG 88 6.371 -10.552 5.858 655 HH11 ARG 88 1HH2 ARG 88 3.074 -11.529 6.328 656 HH12 ARG 88 2HH2 ARG 88 2.665 -10.153 7.297 657 HH21 ARG 88 1HH1 ARG 88 5.832 -8.752 7.122 658 HH22 ARG 88 2HH1 ARG 88 4.226 -8.583 7.746 659 H LYS 89 H LYS 89 7.447 -12.672 0.270 660 HA LYS 89 HA LYS 89 9.125 -10.472 -0.739 661 HB2 LYS 89 2HB LYS 89 9.143 -12.864 -1.707 662 HB3 LYS 89 1HB LYS 89 7.550 -12.513 -2.353 663 HG2 LYS 89 2HG LYS 89 8.880 -11.875 -4.193 664 HG3 LYS 89 1HG LYS 89 8.756 -10.333 -3.352 665 HD2 LYS 89 2HD LYS 89 10.959 -10.849 -2.216 666 HD3 LYS 89 1HD LYS 89 11.067 -12.313 -3.187 667 HE2 LYS 89 2HE LYS 89 12.361 -10.505 -4.224 668 HE3 LYS 89 1HE LYS 89 10.987 -10.925 -5.248 669 HZ1 LYS 89 3HZ LYS 89 9.766 -9.070 -4.370 670 HZ2 LYS 89 1HZ LYS 89 11.261 -8.517 -4.950 671 HZ3 LYS 89 2HZ LYS 89 11.018 -8.702 -3.280 672 H VAL 90 H VAL 90 8.300 -8.668 -1.594 673 HA VAL 90 HA VAL 90 5.412 -8.449 -2.209 674 HB VAL 90 HB VAL 90 6.933 -6.439 -0.498 675 HG11 VAL 90 1HG1 VAL 90 4.008 -6.626 -1.305 676 HG12 VAL 90 2HG1 VAL 90 5.162 -5.426 -1.888 677 HG13 VAL 90 3HG1 VAL 90 4.688 -5.435 -0.195 678 HG21 VAL 90 3HG2 VAL 90 4.888 -8.576 0.246 679 HG22 VAL 90 1HG2 VAL 90 5.337 -7.242 1.310 680 HG23 VAL 90 2HG2 VAL 90 6.544 -8.435 0.836 681 H ARG 91 H ARG 91 5.127 -7.489 -4.097 682 HA ARG 91 HA ARG 91 7.133 -5.588 -5.173 683 HB2 ARG 91 2HB ARG 91 5.902 -7.910 -6.700 684 HB3 ARG 91 1HB ARG 91 6.941 -6.657 -7.385 685 HG2 ARG 91 2HG ARG 91 8.771 -7.350 -5.850 686 HG3 ARG 91 1HG ARG 91 7.732 -8.623 -5.208 687 HD2 ARG 91 2HD ARG 91 8.564 -8.382 -8.116 688 HD3 ARG 91 1HD ARG 91 9.298 -9.474 -6.942 689 HE ARG 91 HE ARG 91 6.527 -9.935 -6.926 690 HH11 ARG 91 1HH2 ARG 91 9.268 -10.227 -9.029 691 HH12 ARG 91 2HH2 ARG 91 8.623 -11.575 -9.905 692 HH21 ARG 91 1HH1 ARG 91 5.679 -11.695 -8.075 693 HH22 ARG 91 2HH1 ARG 91 6.591 -12.404 -9.365 694 H ILE 92 H ILE 92 6.207 -3.834 -6.047 695 HA ILE 92 HA ILE 92 3.247 -3.800 -6.470 696 HB ILE 92 HB ILE 92 5.069 -1.469 -5.698 697 HG12 ILE 92 2HG1 ILE 92 3.099 -3.018 -3.957 698 HG13 ILE 92 1HG1 ILE 92 4.846 -3.197 -3.872 699 HG21 ILE 92 1HG2 ILE 92 2.914 -0.298 -5.313 700 HG22 ILE 92 2HG2 ILE 92 2.035 -1.741 -5.806 701 HG23 ILE 92 3HG2 ILE 92 3.008 -0.858 -6.975 702 HD11 ILE 92 3HD1 ILE 92 4.135 -1.675 -2.125 703 HD12 ILE 92 1HD1 ILE 92 3.276 -0.667 -3.289 704 HD13 ILE 92 2HD1 ILE 92 5.038 -0.765 -3.334 705 H VAL 93 H VAL 93 2.813 -3.764 -8.599 706 HA VAL 93 HA VAL 93 4.748 -2.567 -10.509 707 HB VAL 93 HB VAL 93 2.302 -4.301 -11.076 708 HG11 VAL 93 1HG1 VAL 93 4.707 -3.534 -12.769 709 HG12 VAL 93 2HG1 VAL 93 3.065 -2.930 -12.982 710 HG13 VAL 93 3HG1 VAL 93 3.416 -4.632 -13.266 711 HG21 VAL 93 3HG2 VAL 93 3.924 -6.153 -11.385 712 HG22 VAL 93 1HG2 VAL 93 3.924 -5.570 -9.723 713 HG23 VAL 93 2HG2 VAL 93 5.220 -5.103 -10.821 714 H PHE 94 H PHE 94 4.326 -0.498 -11.005 715 HA PHE 94 HA PHE 94 1.613 0.638 -10.687 716 HB2 PHE 94 2HB PHE 94 4.390 1.774 -11.220 717 HB3 PHE 94 1HB PHE 94 2.947 2.769 -11.306 718 HD1 PHE 94 1HD PHE 94 5.055 0.717 -9.049 719 HD2 PHE 94 2HD PHE 94 1.733 3.433 -9.273 720 HE1 PHE 94 1HE PHE 94 5.090 0.959 -6.590 721 HE2 PHE 94 2HE PHE 94 1.772 3.673 -6.808 722 HZ PHE 94 HZ PHE 94 3.443 2.435 -5.467 723 H THR 95 H THR 95 0.315 1.063 -12.346 724 HA THR 95 HA THR 95 1.337 1.008 -15.143 725 HB THR 95 HB THR 95 -0.802 -0.218 -15.718 726 HG1 THR 95 1HG THR 95 -1.331 0.353 -13.224 727 HG21 THR 95 3HG2 THR 95 1.047 -1.642 -13.773 728 HG22 THR 95 1HG2 THR 95 1.337 -1.441 -15.501 729 HG23 THR 95 2HG2 THR 95 -0.015 -2.424 -14.943 730 H HIS 96 H HIS 96 0.014 2.179 -16.600 731 HA HIS 96 HA HIS 96 -1.963 4.058 -15.464 732 HB2 HIS 96 2HB HIS 96 -0.797 5.959 -16.578 733 HB3 HIS 96 1HB HIS 96 0.177 5.241 -15.297 734 HD2 HIS 96 2HD HIS 96 0.106 5.275 -19.259 735 HE1 HIS 96 1HE HIS 96 3.859 3.817 -17.984 736 HE2 HIS 96 2HE HIS 96 2.492 4.517 -20.006 737 H THR 97 H THR 97 -3.415 4.845 -16.979 738 HA THR 97 HA THR 97 -3.156 4.112 -19.811 739 HB THR 97 HB THR 97 -5.498 3.143 -18.124 740 HG1 THR 97 1HG THR 97 -3.512 2.007 -17.811 741 HG21 THR 97 3HG2 THR 97 -6.092 1.915 -20.207 742 HG22 THR 97 1HG2 THR 97 -4.767 2.724 -21.044 743 HG23 THR 97 2HG2 THR 97 -6.135 3.662 -20.439 744 H GLY 98 H GLY 98 -3.093 6.378 -20.071 745 HA2 GLY 98 2HA GLY 98 -4.007 8.439 -20.524 746 HA3 GLY 98 1HA GLY 98 -5.559 7.613 -20.624 747 H ASP 99 H ASP 99 -6.926 8.848 -19.432 748 HA ASP 99 HA ASP 99 -6.105 10.178 -16.985 749 HB2 ASP 99 2HB ASP 99 -7.776 11.148 -18.572 750 HB3 ASP 99 1HB ASP 99 -8.892 9.850 -18.155 751 H THR 100 H THR 100 -5.721 7.358 -16.836 752 HA THR 100 HA THR 100 -7.344 6.768 -14.462 753 HB THR 100 HB THR 100 -7.187 4.810 -16.791 754 HG1 THR 100 1HG THR 100 -8.656 6.188 -17.462 755 HG21 THR 100 3HG2 THR 100 -7.353 3.699 -14.607 756 HG22 THR 100 1HG2 THR 100 -8.894 3.580 -15.453 757 HG23 THR 100 2HG2 THR 100 -8.695 4.750 -14.152 758 H THR 101 H THR 101 -6.355 5.348 -13.063 759 HA THR 101 HA THR 101 -3.669 4.292 -13.762 760 HB THR 101 HB THR 101 -4.335 5.726 -11.161 761 HG1 THR 101 1HG THR 101 -2.549 6.663 -13.106 762 HG21 THR 101 3HG2 THR 101 -2.587 4.014 -10.924 763 HG22 THR 101 1HG2 THR 101 -1.871 5.617 -10.856 764 HG23 THR 101 2HG2 THR 101 -1.733 4.666 -12.324 765 H ASN 102 H ASN 102 -3.110 2.398 -12.749 766 HA ASN 102 HA ASN 102 -5.136 1.092 -10.985 767 HB2 ASN 102 2HB ASN 102 -3.713 -0.119 -13.385 768 HB3 ASN 102 1HB ASN 102 -4.728 -1.008 -12.248 769 HD21 ASN 102 1HD2 ASN 102 -5.114 -0.403 -15.222 770 HD22 ASN 102 2HD2 ASN 102 -6.650 0.312 -15.309 771 H ILE 103 H ILE 103 -4.246 0.215 -9.233 772 HA ILE 103 HA ILE 103 -1.272 0.022 -9.018 773 HB ILE 103 HB ILE 103 -3.374 0.158 -6.815 774 HG12 ILE 103 2HG1 ILE 103 -1.485 2.358 -7.765 775 HG13 ILE 103 1HG1 ILE 103 -3.191 2.280 -8.192 776 HG21 ILE 103 1HG2 ILE 103 -1.300 -0.977 -6.111 777 HG22 ILE 103 2HG2 ILE 103 -1.381 0.605 -5.360 778 HG23 ILE 103 3HG2 ILE 103 -0.334 0.350 -6.754 779 HD11 ILE 103 3HD1 ILE 103 -2.936 3.769 -6.295 780 HD12 ILE 103 1HD1 ILE 103 -2.059 2.539 -5.389 781 HD13 ILE 103 2HD1 ILE 103 -3.775 2.315 -5.757 782 H VAL 104 H VAL 104 -0.438 -1.983 -8.883 783 HA VAL 104 HA VAL 104 -2.183 -4.276 -8.095 784 HB VAL 104 HB VAL 104 0.029 -4.282 -10.182 785 HG11 VAL 104 1HG1 VAL 104 -0.871 -6.558 -10.685 786 HG12 VAL 104 2HG1 VAL 104 -1.969 -6.404 -9.314 787 HG13 VAL 104 3HG1 VAL 104 -0.226 -6.452 -9.050 788 HG21 VAL 104 3HG2 VAL 104 -2.991 -4.360 -10.511 789 HG22 VAL 104 1HG2 VAL 104 -1.819 -4.577 -11.812 790 HG23 VAL 104 2HG2 VAL 104 -1.936 -3.029 -10.980 791 H GLU 105 H GLU 105 -1.421 -5.329 -6.396 792 HA GLU 105 HA GLU 105 1.467 -5.464 -5.817 793 HB2 GLU 105 2HB GLU 105 0.987 -4.863 -3.411 794 HB3 GLU 105 1HB GLU 105 0.772 -3.520 -4.532 795 HG2 GLU 105 2HG GLU 105 -1.655 -3.877 -4.562 796 HG3 GLU 105 1HG GLU 105 -1.487 -5.274 -3.508 797 H SER 106 H SER 106 2.042 -7.282 -4.710 798 HA SER 106 HA SER 106 -0.067 -9.243 -3.927 799 HB2 SER 106 2HB SER 106 1.258 -11.030 -4.931 800 HB3 SER 106 1HB SER 106 0.880 -9.828 -6.164 801 HG SER 106 HG SER 106 2.979 -9.900 -6.427 802 H PHE 107 H PHE 107 0.491 -10.584 -2.210 803 HA PHE 107 HA PHE 107 3.026 -9.981 -0.744 804 HB2 PHE 107 2HB PHE 107 0.237 -10.298 0.440 805 HB3 PHE 107 1HB PHE 107 1.727 -10.017 1.342 806 HD1 PHE 107 1HD PHE 107 -0.777 -8.505 -0.926 807 HD2 PHE 107 2HD PHE 107 2.829 -7.796 1.311 808 HE1 PHE 107 1HE PHE 107 -1.043 -6.070 -1.255 809 HE2 PHE 107 2HE PHE 107 2.549 -5.357 0.973 810 HZ PHE 107 HZ PHE 107 0.621 -4.495 -0.318 811 H ASP 108 H ASP 108 3.241 -11.670 1.078 812 HA ASP 108 HA ASP 108 2.280 -14.364 0.250 813 HB2 ASP 108 2HB ASP 108 5.143 -13.624 0.935 814 HB3 ASP 108 1HB ASP 108 4.544 -15.247 0.582 815 HA PRO 109 HA PRO 109 1.652 -13.441 4.789 816 HB2 PRO 109 2HB PRO 109 -0.733 -15.216 4.249 817 HB3 PRO 109 1HB PRO 109 -0.651 -13.697 5.176 818 HG2 PRO 109 2HG PRO 109 -1.740 -13.732 2.742 819 HG3 PRO 109 1HG PRO 109 -0.710 -12.372 3.242 820 HD2 PRO 109 2HD PRO 109 0.021 -14.712 1.447 821 HD3 PRO 109 1HD PRO 109 0.433 -12.991 1.263 822 H GLU 110 H GLU 110 1.439 -15.052 6.583 823 HA GLU 110 HA GLU 110 3.306 -17.135 6.334 824 HB2 GLU 110 2HB GLU 110 1.100 -16.769 8.385 825 HB3 GLU 110 1HB GLU 110 2.475 -17.855 8.568 826 HG2 GLU 110 2HG GLU 110 2.692 -14.842 8.200 827 HG3 GLU 110 1HG GLU 110 2.798 -15.669 9.751 828 H GLU 111 H GLU 111 3.074 -19.353 6.262 829 HA GLU 111 HA GLU 111 0.998 -20.364 4.556 830 HB2 GLU 111 2HB GLU 111 2.096 -22.561 4.918 831 HB3 GLU 111 1HB GLU 111 3.249 -21.302 4.476 832 HG2 GLU 111 2HG GLU 111 3.822 -21.005 6.880 833 HG3 GLU 111 1HG GLU 111 2.712 -22.307 7.295 834 H THR 112 H THR 112 1.567 -20.372 8.025 835 HA THR 112 HA THR 112 -0.307 -22.345 8.761 836 HB THR 112 HB THR 112 0.448 -19.882 10.388 837 HG1 THR 112 1HG THR 112 1.942 -21.935 9.476 838 HG21 THR 112 3HG2 THR 112 -1.378 -21.233 11.349 839 HG22 THR 112 1HG2 THR 112 0.094 -21.415 12.303 840 HG23 THR 112 2HG2 THR 112 -0.396 -22.689 11.188 841 H ASN 113 H ASN 113 -0.648 -18.808 8.425 842 HA ASN 113 HA ASN 113 -3.392 -18.786 9.222 843 HB2 ASN 113 2HB ASN 113 -1.741 -16.724 7.727 844 HB3 ASN 113 1HB ASN 113 -3.354 -16.436 8.381 845 HD21 ASN 113 1HD2 ASN 113 -3.296 -17.598 10.863 846 HD22 ASN 113 2HD2 ASN 113 -2.081 -16.907 11.827 847 HA PRO 114 HA PRO 114 -5.119 -20.000 5.255 848 HB2 PRO 114 2HB PRO 114 -7.710 -19.118 5.468 849 HB3 PRO 114 1HB PRO 114 -7.096 -20.470 6.449 850 HG2 PRO 114 2HG PRO 114 -7.356 -17.569 7.216 851 HG3 PRO 114 1HG PRO 114 -7.881 -19.005 8.121 852 HD2 PRO 114 2HD PRO 114 -5.521 -17.760 8.695 853 HD3 PRO 114 1HD PRO 114 -5.681 -19.529 8.816 854 H ARG 115 H ARG 115 -5.262 -19.160 3.225 855 HA ARG 115 HA ARG 115 -4.440 -16.485 2.714 856 HB2 ARG 115 2HB ARG 115 -5.675 -18.557 0.871 857 HB3 ARG 115 1HB ARG 115 -4.893 -17.068 0.331 858 HG2 ARG 115 2HG ARG 115 -2.782 -17.787 1.392 859 HG3 ARG 115 1HG ARG 115 -3.558 -19.274 1.936 860 HD2 ARG 115 2HD ARG 115 -4.014 -19.884 -0.435 861 HD3 ARG 115 1HD ARG 115 -3.183 -18.418 -0.946 862 HE ARG 115 HE ARG 115 -1.155 -19.458 -0.508 863 HH11 ARG 115 1HH2 ARG 115 -3.738 -21.174 1.058 864 HH12 ARG 115 2HH2 ARG 115 -2.736 -22.503 1.543 865 HH21 ARG 115 1HH1 ARG 115 0.149 -21.194 0.138 866 HH22 ARG 115 2HH1 ARG 115 -0.543 -22.512 1.023 867 H GLU 116 H GLU 116 -7.571 -18.108 2.701 868 HA GLU 116 HA GLU 116 -9.151 -16.236 1.416 869 HB2 GLU 116 2HB GLU 116 -9.851 -17.992 3.797 870 HB3 GLU 116 1HB GLU 116 -11.039 -17.112 2.835 871 HG2 GLU 116 2HG GLU 116 -10.961 -19.388 2.008 872 HG3 GLU 116 1HG GLU 116 -10.217 -18.353 0.794 873 H LEU 117 H LEU 117 -8.349 -16.342 4.909 874 HA LEU 117 HA LEU 117 -9.838 -14.056 5.615 875 HB2 LEU 117 2HB LEU 117 -8.960 -15.721 7.246 876 HB3 LEU 117 1HB LEU 117 -7.327 -15.151 6.920 877 HG LEU 117 HG LEU 117 -7.990 -12.876 7.747 878 HD11 LEU 117 1HD1 LEU 117 -10.302 -12.618 7.474 879 HD12 LEU 117 2HD1 LEU 117 -10.217 -12.939 9.198 880 HD13 LEU 117 3HD1 LEU 117 -10.682 -14.229 8.088 881 HD21 LEU 117 3HD2 LEU 117 -8.519 -15.145 9.691 882 HD22 LEU 117 1HD2 LEU 117 -8.077 -13.496 10.134 883 HD23 LEU 117 2HD2 LEU 117 -6.929 -14.513 9.261 884 H GLN 118 H GLN 118 -6.435 -14.464 4.700 885 HA GLN 118 HA GLN 118 -5.642 -11.767 5.055 886 HB2 GLN 118 2HB GLN 118 -4.543 -13.889 3.183 887 HB3 GLN 118 1HB GLN 118 -3.710 -12.395 3.624 888 HG2 GLN 118 2HG GLN 118 -4.597 -14.510 5.622 889 HG3 GLN 118 1HG GLN 118 -2.971 -14.392 4.966 890 HE21 GLN 118 1HE2 GLN 118 -4.618 -13.644 7.700 891 HE22 GLN 118 2HE2 GLN 118 -3.787 -12.244 8.181 892 H GLN 119 H GLN 119 -6.750 -13.533 2.166 893 HA GLN 119 HA GLN 119 -6.454 -11.509 0.289 894 HB2 GLN 119 2HB GLN 119 -7.088 -13.876 -0.213 895 HB3 GLN 119 1HB GLN 119 -8.705 -13.549 0.407 896 HG2 GLN 119 2HG GLN 119 -9.033 -11.816 -1.323 897 HG3 GLN 119 1HG GLN 119 -7.399 -12.092 -1.918 898 HE21 GLN 119 1HE2 GLN 119 -9.667 -12.417 -3.608 899 HE22 GLN 119 2HE2 GLN 119 -9.823 -14.064 -3.990 900 H SER 120 H SER 120 -9.233 -12.197 2.397 901 HA SER 120 HA SER 120 -10.859 -10.058 1.476 902 HB2 SER 120 2HB SER 120 -12.133 -10.426 3.553 903 HB3 SER 120 1HB SER 120 -11.760 -11.952 2.758 904 HG SER 120 HG SER 120 -11.235 -11.338 5.209 905 H GLY 121 H GLY 121 -8.378 -10.314 4.020 906 HA2 GLY 121 2HA GLY 121 -8.863 -7.808 5.256 907 HA3 GLY 121 1HA GLY 121 -7.346 -8.698 5.301 908 H TRP 122 H TRP 122 -6.437 -8.707 2.774 909 HA TRP 122 HA TRP 122 -5.473 -6.053 2.392 910 HB2 TRP 122 2HB TRP 122 -5.344 -8.477 0.564 911 HB3 TRP 122 1HB TRP 122 -4.438 -6.984 0.312 912 HD1 TRP 122 HD TRP 122 -4.083 -10.269 1.951 913 HE1 TRP 122 1HE TRP 122 -2.119 -10.262 3.611 914 HE3 TRP 122 3HE TRP 122 -3.170 -5.245 2.226 915 HZ2 TRP 122 2HZ TRP 122 -0.384 -8.385 4.884 916 HZ3 TRP 122 3HZ TRP 122 -1.353 -4.382 3.668 917 HH2 TRP 122 HH TRP 122 0.041 -5.943 4.996 918 H GLN 123 H GLN 123 -8.009 -7.950 0.838 919 HA GLN 123 HA GLN 123 -8.512 -6.079 -1.273 920 HB2 GLN 123 2HB GLN 123 -9.149 -8.501 -1.335 921 HB3 GLN 123 1HB GLN 123 -10.391 -8.173 -0.128 922 HG2 GLN 123 2HG GLN 123 -11.466 -6.568 -1.661 923 HG3 GLN 123 1HG GLN 123 -10.212 -6.854 -2.858 924 HE21 GLN 123 1HE2 GLN 123 -10.804 -8.353 -4.417 925 HE22 GLN 123 2HE2 GLN 123 -11.931 -9.602 -4.191 926 H ALA 124 H ALA 124 -9.871 -6.579 1.969 927 HA ALA 124 HA ALA 124 -12.065 -4.848 1.811 928 HB1 ALA 124 1HB ALA 124 -10.297 -5.507 4.181 929 HB2 ALA 124 2HB ALA 124 -11.771 -6.352 3.704 930 HB3 ALA 124 3HB ALA 124 -11.863 -4.700 4.306 931 H ILE 125 H ILE 125 -8.770 -4.101 3.006 932 HA ILE 125 HA ILE 125 -9.254 -1.363 3.499 933 HB ILE 125 HB ILE 125 -7.361 -2.501 4.494 934 HG12 ILE 125 2HG1 ILE 125 -6.225 -0.481 2.497 935 HG13 ILE 125 1HG1 ILE 125 -7.160 -0.008 3.908 936 HG21 ILE 125 1HG2 ILE 125 -6.269 -2.805 1.679 937 HG22 ILE 125 2HG2 ILE 125 -6.924 -4.100 2.677 938 HG23 ILE 125 3HG2 ILE 125 -5.449 -3.281 3.159 939 HD11 ILE 125 3HD1 ILE 125 -5.528 -1.155 5.362 940 HD12 ILE 125 1HD1 ILE 125 -4.760 0.105 4.402 941 HD13 ILE 125 2HD1 ILE 125 -4.574 -1.590 3.948 942 H LEU 126 H LEU 126 -8.178 -3.090 0.607 943 HA LEU 126 HA LEU 126 -7.534 -0.798 -0.936 944 HB2 LEU 126 2HB LEU 126 -8.235 -3.658 -1.601 945 HB3 LEU 126 1HB LEU 126 -8.005 -2.502 -2.909 946 HG LEU 126 HG LEU 126 -5.876 -2.944 -0.755 947 HD11 LEU 126 1HD1 LEU 126 -6.111 -4.319 -3.460 948 HD12 LEU 126 2HD1 LEU 126 -6.284 -5.105 -1.894 949 HD13 LEU 126 3HD1 LEU 126 -4.728 -4.427 -2.371 950 HD21 LEU 126 3HD2 LEU 126 -5.742 -1.835 -3.597 951 HD22 LEU 126 1HD2 LEU 126 -4.360 -2.026 -2.521 952 HD23 LEU 126 2HD2 LEU 126 -5.621 -0.870 -2.132 953 H ASN 127 H ASN 127 -10.562 -2.614 -0.547 954 HA ASN 127 HA ASN 127 -12.024 -1.128 -2.496 955 HB2 ASN 127 2HB ASN 127 -12.885 -2.789 -0.108 956 HB3 ASN 127 1HB ASN 127 -14.019 -2.103 -1.275 957 HD21 ASN 127 1HD2 ASN 127 -13.727 -4.937 -0.899 958 HD22 ASN 127 2HD2 ASN 127 -13.092 -5.591 -2.329 959 H SER 128 H SER 128 -11.575 -0.825 1.012 960 HA SER 128 HA SER 128 -13.392 1.280 1.454 961 HB2 SER 128 2HB SER 128 -12.392 -0.036 3.281 962 HB3 SER 128 1HB SER 128 -10.819 0.679 2.940 963 HG SER 128 HG SER 128 -11.779 2.727 3.378 964 H PHE 129 H PHE 129 -10.078 1.272 0.293 965 HA PHE 129 HA PHE 129 -9.346 3.915 0.658 966 HB2 PHE 129 2HB PHE 129 -7.853 2.144 -0.236 967 HB3 PHE 129 1HB PHE 129 -8.723 2.201 -1.766 968 HD1 PHE 129 1HD PHE 129 -6.698 4.258 0.610 969 HD2 PHE 129 2HD PHE 129 -8.203 3.921 -3.412 970 HE1 PHE 129 1HE PHE 129 -5.310 6.186 -0.079 971 HE2 PHE 129 2HE PHE 129 -6.807 5.848 -4.089 972 HZ PHE 129 HZ PHE 129 -5.362 6.983 -2.425 973 H LYS 130 H LYS 130 -11.894 2.726 -1.225 974 HA LYS 130 HA LYS 130 -12.031 4.558 -3.357 975 HB2 LYS 130 2HB LYS 130 -14.371 3.876 -3.530 976 HB3 LYS 130 1HB LYS 130 -13.379 2.468 -3.161 977 HG2 LYS 130 2HG LYS 130 -13.979 2.800 -0.698 978 HG3 LYS 130 1HG LYS 130 -15.117 4.038 -1.212 979 HD2 LYS 130 2HD LYS 130 -16.335 2.412 -2.590 980 HD3 LYS 130 1HD LYS 130 -15.196 1.148 -2.127 981 HE2 LYS 130 2HE LYS 130 -17.253 1.043 -0.755 982 HE3 LYS 130 1HE LYS 130 -15.844 1.414 0.238 983 HZ1 LYS 130 3HZ LYS 130 -16.498 3.565 0.532 984 HZ2 LYS 130 1HZ LYS 130 -18.018 2.819 0.428 985 HZ3 LYS 130 2HZ LYS 130 -17.377 3.629 -0.920 986 H SER 131 H SER 131 -13.164 4.749 -0.014 987 HA SER 131 HA SER 131 -14.745 7.055 -0.189 988 HB2 SER 131 2HB SER 131 -13.022 6.147 2.136 989 HB3 SER 131 1HB SER 131 -14.372 7.276 2.230 990 HG SER 131 HG SER 131 -14.351 4.542 2.063 991 H TYR 132 H TYR 132 -11.264 6.723 0.474 992 HA TYR 132 HA TYR 132 -10.737 9.509 0.774 993 HB2 TYR 132 2HB TYR 132 -8.943 7.182 0.011 994 HB3 TYR 132 1HB TYR 132 -8.345 8.804 0.364 995 HD1 TYR 132 1HD TYR 132 -10.175 5.884 1.804 996 HD2 TYR 132 2HD TYR 132 -8.176 9.594 2.668 997 HE1 TYR 132 1HE TYR 132 -10.246 5.361 4.221 998 HE2 TYR 132 2HE TYR 132 -8.254 9.068 5.084 999 HH TYR 132 HH TYR 132 -8.775 7.546 6.619 1000 H THR 133 H THR 133 -10.507 7.280 -2.006 1001 HA THR 133 HA THR 133 -9.447 9.135 -3.854 1002 HB THR 133 HB THR 133 -11.223 6.720 -4.337 1003 HG1 THR 133 1HG THR 133 -9.467 5.878 -3.524 1004 HG21 THR 133 3HG2 THR 133 -9.462 8.351 -6.207 1005 HG22 THR 133 1HG2 THR 133 -11.198 8.051 -6.366 1006 HG23 THR 133 2HG2 THR 133 -10.046 6.734 -6.588 1007 H GLU 134 H GLU 134 -12.807 8.188 -3.175 1008 HA GLU 134 HA GLU 134 -13.945 10.089 -5.040 1009 HB2 GLU 134 2HB GLU 134 -15.192 8.374 -2.875 1010 HB3 GLU 134 1HB GLU 134 -16.104 9.300 -4.064 1011 HG2 GLU 134 2HG GLU 134 -14.114 7.102 -4.736 1012 HG3 GLU 134 1HG GLU 134 -15.860 6.891 -4.695 1013 H ASN 135 H ASN 135 -12.341 10.708 -2.335 1014 HA ASN 135 HA ASN 135 -14.069 12.269 -0.726 1015 HB2 ASN 135 2HB ASN 135 -11.808 11.539 -0.016 1016 HB3 ASN 135 1HB ASN 135 -11.089 12.634 -1.192 1017 HD21 ASN 135 1HD2 ASN 135 -13.321 12.660 1.629 1018 HD22 ASN 135 2HD2 ASN 135 -12.866 14.205 2.161 1019 H ASN 136 H ASN 136 -13.149 12.714 -3.899 1020 HA ASN 136 HA ASN 136 -12.704 15.506 -4.079 1021 HB2 ASN 136 2HB ASN 136 -13.897 13.560 -6.083 1022 HB3 ASN 136 1HB ASN 136 -13.404 15.209 -6.473 1023 HD21 ASN 136 1HD2 ASN 136 -12.265 12.547 -7.418 1024 HD22 ASN 136 2HD2 ASN 136 -10.611 12.638 -7.045 1025 H LEU 137 H LEU 137 -15.643 13.546 -4.126 1026 HA LEU 137 HA LEU 137 -17.281 15.804 -3.324 1027 HB2 LEU 137 2HB LEU 137 -18.868 15.270 -5.397 1028 HB3 LEU 137 1HB LEU 137 -17.518 16.383 -5.594 1029 HG LEU 137 HG LEU 137 -16.123 14.594 -6.547 1030 HD11 LEU 137 1HD1 LEU 137 -18.527 12.841 -5.935 1031 HD12 LEU 137 2HD1 LEU 137 -16.851 12.620 -5.434 1032 HD13 LEU 137 3HD1 LEU 137 -17.296 12.375 -7.116 1033 HD21 LEU 137 3HD2 LEU 137 -17.563 15.913 -8.049 1034 HD22 LEU 137 1HD2 LEU 137 -18.867 14.745 -7.835 1035 HD23 LEU 137 2HD2 LEU 137 -17.377 14.264 -8.644 1036 H GLU 138 H GLU 138 -19.674 15.038 -3.332 1037 HA GLU 138 HA GLU 138 -19.773 12.585 -1.753 1038 HB2 GLU 138 2HB GLU 138 -21.894 14.628 -2.513 1039 HB3 GLU 138 1HB GLU 138 -22.180 13.250 -1.452 1040 HG2 GLU 138 2HG GLU 138 -21.741 15.195 -0.061 1041 HG3 GLU 138 1HG GLU 138 -20.358 14.114 0.066 1042 H HIS 139 H HIS 139 -21.547 11.013 -2.177 1043 HA HIS 139 HA HIS 139 -21.289 9.874 -4.762 1044 HB2 HIS 139 2HB HIS 139 -23.345 9.331 -2.593 1045 HB3 HIS 139 1HB HIS 139 -22.995 8.278 -3.965 1046 HD2 HIS 139 2HD HIS 139 -20.681 6.702 -3.677 1047 HE1 HIS 139 1HE HIS 139 -19.498 8.226 0.079 1048 HE2 HIS 139 2HE HIS 139 -19.033 6.443 -1.670 1049 H HIS 140 H HIS 140 -22.474 10.112 -6.569 1050 HA HIS 140 HA HIS 140 -25.188 11.186 -6.552 1051 HB2 HIS 140 2HB HIS 140 -22.897 12.688 -7.875 1052 HB3 HIS 140 1HB HIS 140 -24.608 13.036 -8.136 1053 HD2 HIS 140 2HD HIS 140 -21.909 14.371 -5.923 1054 HE1 HIS 140 1HE HIS 140 -25.441 14.809 -3.650 1055 HE2 HIS 140 2HE HIS 140 -23.002 15.494 -3.833 1056 H HIS 141 H HIS 141 -26.129 11.152 -8.704 1057 HA HIS 141 HA HIS 141 -24.831 9.840 -10.892 1058 HB2 HIS 141 2HB HIS 141 -25.114 7.897 -9.350 1059 HB3 HIS 141 1HB HIS 141 -26.848 8.201 -9.305 1060 HD2 HIS 141 2HD HIS 141 -24.143 6.924 -11.887 1061 HE1 HIS 141 1HE HIS 141 -27.973 6.191 -13.504 1062 HE2 HIS 141 2HE HIS 141 -25.482 5.828 -13.841 1063 H HIS 142 H HIS 142 -25.762 11.768 -11.810 1064 HA HIS 142 HA HIS 142 -28.595 12.226 -11.835 1065 HB2 HIS 142 2HB HIS 142 -26.907 14.021 -12.229 1066 HB3 HIS 142 1HB HIS 142 -26.463 13.252 -13.752 1067 HD2 HIS 142 2HD HIS 142 -27.861 14.412 -15.827 1068 HE1 HIS 142 1HE HIS 142 -31.373 15.430 -13.716 1069 HE2 HIS 142 2HE HIS 142 -30.234 15.491 -15.986 1070 H HIS 143 H HIS 143 -30.114 11.329 -13.136 1071 HA HIS 143 HA HIS 143 -29.567 9.086 -14.758 1072 HB2 HIS 143 2HB HIS 143 -31.759 9.474 -13.712 1073 HB3 HIS 143 1HB HIS 143 -32.009 10.893 -14.723 1074 HD2 HIS 143 2HD HIS 143 -31.671 6.965 -15.251 1075 HE1 HIS 143 1HE HIS 143 -33.601 8.638 -18.613 1076 HE2 HIS 143 2HE HIS 143 -32.845 6.468 -17.530 1077 H HIS 144 H HIS 144 -31.323 11.785 -16.193 1078 HA HIS 144 HA HIS 144 -30.039 11.438 -18.746 1079 HB2 HIS 144 2HB HIS 144 -31.469 13.429 -19.368 1080 HB3 HIS 144 1HB HIS 144 -32.373 12.083 -18.673 1081 HD2 HIS 144 2HD HIS 144 -31.690 15.814 -17.915 1082 HE1 HIS 144 1HE HIS 144 -33.663 14.211 -14.544 1083 HE2 HIS 144 2HE HIS 144 -32.881 16.357 -15.654 Start of MODEL 10 1 H1 GLY 1 1HT GLY 1 -0.996 -19.439 -4.235 2 H2 GLY 1 2HT GLY 1 -2.160 -19.228 -5.454 3 H3 GLY 1 3HT GLY 1 -2.101 -20.681 -4.575 4 HA2 GLY 1 2HA GLY 1 -3.732 -18.589 -4.035 5 HA3 GLY 1 1HA GLY 1 -3.315 -19.880 -2.908 6 H ASN 2 H ASN 2 -0.602 -19.285 -2.503 7 HA ASN 2 HA ASN 2 -0.735 -17.326 -0.466 8 HB2 ASN 2 2HB ASN 2 1.700 -18.451 -1.885 9 HB3 ASN 2 1HB ASN 2 1.710 -17.600 -0.340 10 HD21 ASN 2 1HD2 ASN 2 -0.812 -18.878 0.607 11 HD22 ASN 2 2HD2 ASN 2 -0.410 -20.487 0.967 12 H LYS 3 H LYS 3 0.456 -17.219 -3.795 13 HA LYS 3 HA LYS 3 1.447 -14.520 -3.650 14 HB2 LYS 3 2HB LYS 3 1.522 -14.739 -6.177 15 HB3 LYS 3 1HB LYS 3 2.388 -16.006 -5.307 16 HG2 LYS 3 2HG LYS 3 0.600 -17.607 -5.657 17 HG3 LYS 3 1HG LYS 3 -0.494 -16.370 -6.252 18 HD2 LYS 3 2HD LYS 3 0.394 -17.694 -8.117 19 HD3 LYS 3 1HD LYS 3 0.925 -16.018 -8.232 20 HE2 LYS 3 2HE LYS 3 2.728 -17.819 -8.670 21 HE3 LYS 3 1HE LYS 3 3.158 -16.570 -7.509 22 HZ1 LYS 3 3HZ LYS 3 2.938 -18.005 -5.751 23 HZ2 LYS 3 1HZ LYS 3 3.512 -19.065 -6.945 24 HZ3 LYS 3 2HZ LYS 3 1.857 -19.031 -6.564 25 H ILE 4 H ILE 4 -0.987 -14.311 -2.531 26 HA ILE 4 HA ILE 4 -3.241 -13.885 -4.068 27 HB ILE 4 HB ILE 4 -2.340 -12.201 -1.701 28 HG12 ILE 4 2HG1 ILE 4 -4.090 -14.707 -1.714 29 HG13 ILE 4 1HG1 ILE 4 -2.378 -14.724 -1.304 30 HG21 ILE 4 1HG2 ILE 4 -4.800 -11.860 -1.378 31 HG22 ILE 4 2HG2 ILE 4 -5.105 -12.746 -2.863 32 HG23 ILE 4 3HG2 ILE 4 -4.263 -11.203 -2.913 33 HD11 ILE 4 3HD1 ILE 4 -4.534 -13.168 0.158 34 HD12 ILE 4 1HD1 ILE 4 -2.815 -13.107 0.534 35 HD13 ILE 4 2HD1 ILE 4 -3.710 -14.607 0.742 36 H THR 5 H THR 5 -4.042 -12.205 -5.280 37 HA THR 5 HA THR 5 -2.272 -9.880 -5.855 38 HB THR 5 HB THR 5 -1.992 -11.369 -7.733 39 HG1 THR 5 1HG THR 5 -2.395 -9.210 -8.272 40 HG21 THR 5 3HG2 THR 5 -3.931 -12.854 -7.326 41 HG22 THR 5 1HG2 THR 5 -3.887 -12.296 -8.996 42 HG23 THR 5 2HG2 THR 5 -5.018 -11.572 -7.859 43 H VAL 6 H VAL 6 -3.283 -7.989 -5.843 44 HA VAL 6 HA VAL 6 -6.232 -7.814 -6.041 45 HB VAL 6 HB VAL 6 -6.219 -6.238 -4.068 46 HG11 VAL 6 1HG1 VAL 6 -5.298 -9.065 -3.450 47 HG12 VAL 6 2HG1 VAL 6 -6.953 -8.601 -3.833 48 HG13 VAL 6 3HG1 VAL 6 -6.189 -8.003 -2.362 49 HG21 VAL 6 3HG2 VAL 6 -3.796 -5.722 -4.066 50 HG22 VAL 6 1HG2 VAL 6 -3.436 -7.396 -3.653 51 HG23 VAL 6 2HG2 VAL 6 -4.290 -6.377 -2.504 52 H GLU 7 H GLU 7 -6.964 -5.674 -6.483 53 HA GLU 7 HA GLU 7 -4.990 -3.693 -7.378 54 HB2 GLU 7 2HB GLU 7 -6.027 -3.557 -9.648 55 HB3 GLU 7 1HB GLU 7 -5.222 -5.098 -9.363 56 HG2 GLU 7 2HG GLU 7 -7.411 -6.125 -8.786 57 HG3 GLU 7 1HG GLU 7 -8.210 -4.591 -9.114 58 H VAL 8 H VAL 8 -6.030 -1.638 -8.027 59 HA VAL 8 HA VAL 8 -8.811 -1.260 -7.130 60 HB VAL 8 HB VAL 8 -7.520 -0.888 -5.083 61 HG11 VAL 8 1HG1 VAL 8 -5.774 0.817 -4.947 62 HG12 VAL 8 2HG1 VAL 8 -5.927 1.133 -6.672 63 HG13 VAL 8 3HG1 VAL 8 -5.342 -0.435 -6.108 64 HG21 VAL 8 3HG2 VAL 8 -8.283 1.817 -6.252 65 HG22 VAL 8 1HG2 VAL 8 -8.264 1.361 -4.551 66 HG23 VAL 8 2HG2 VAL 8 -9.452 0.652 -5.642 67 H THR 9 H THR 9 -9.816 0.366 -8.245 68 HA THR 9 HA THR 9 -8.365 1.566 -10.512 69 HB THR 9 HB THR 9 -10.622 2.158 -11.282 70 HG1 THR 9 1HG THR 9 -11.308 2.342 -8.980 71 HG21 THR 9 3HG2 THR 9 -9.760 -0.100 -11.790 72 HG22 THR 9 1HG2 THR 9 -11.512 -0.110 -11.583 73 HG23 THR 9 2HG2 THR 9 -10.468 -0.701 -10.289 74 H VAL 10 H VAL 10 -7.535 3.564 -10.255 75 HA VAL 10 HA VAL 10 -8.928 5.543 -8.501 76 HB VAL 10 HB VAL 10 -5.920 5.216 -8.847 77 HG11 VAL 10 1HG1 VAL 10 -7.592 6.997 -7.034 78 HG12 VAL 10 2HG1 VAL 10 -6.597 7.539 -8.385 79 HG13 VAL 10 3HG1 VAL 10 -5.838 6.846 -6.955 80 HG21 VAL 10 3HG2 VAL 10 -7.723 4.491 -6.507 81 HG22 VAL 10 1HG2 VAL 10 -5.962 4.425 -6.494 82 HG23 VAL 10 2HG2 VAL 10 -6.872 3.347 -7.545 83 H TYR 11 H TYR 11 -9.449 7.360 -9.542 84 HA TYR 11 HA TYR 11 -8.406 7.855 -12.282 85 HB2 TYR 11 2HB TYR 11 -10.746 9.092 -10.788 86 HB3 TYR 11 1HB TYR 11 -10.320 9.392 -12.473 87 HD1 TYR 11 2HD TYR 11 -10.613 7.618 -14.197 88 HD2 TYR 11 1HD TYR 11 -11.751 6.939 -10.102 89 HE1 TYR 11 2HE TYR 11 -11.888 5.606 -14.880 90 HE2 TYR 11 1HE TYR 11 -13.021 4.927 -10.793 91 HH TYR 11 HH TYR 11 -12.936 3.760 -14.136 92 H ALA 12 H ALA 12 -6.368 8.699 -11.662 93 HA ALA 12 HA ALA 12 -6.321 11.524 -11.221 94 HB1 ALA 12 1HB ALA 12 -5.120 11.528 -9.069 95 HB2 ALA 12 2HB ALA 12 -5.317 9.777 -8.953 96 HB3 ALA 12 3HB ALA 12 -6.729 10.828 -8.885 97 H ALA 13 H ALA 13 -4.200 12.397 -11.460 98 HA ALA 13 HA ALA 13 -2.530 10.983 -13.244 99 HB1 ALA 13 1HB ALA 13 -2.616 13.440 -13.134 100 HB2 ALA 13 2HB ALA 13 -0.963 12.862 -12.921 101 HB3 ALA 13 3HB ALA 13 -1.898 13.400 -11.524 102 H ILE 14 H ILE 14 -1.208 9.319 -12.778 103 HA ILE 14 HA ILE 14 -0.642 8.292 -10.270 104 HB ILE 14 HB ILE 14 -0.293 7.040 -12.334 105 HG12 ILE 14 2HG1 ILE 14 2.364 7.318 -10.852 106 HG13 ILE 14 1HG1 ILE 14 0.980 6.448 -10.196 107 HG21 ILE 14 1HG2 ILE 14 2.158 8.796 -12.784 108 HG22 ILE 14 2HG2 ILE 14 0.644 8.967 -13.674 109 HG23 ILE 14 3HG2 ILE 14 1.592 7.489 -13.819 110 HD11 ILE 14 3HD1 ILE 14 2.581 4.960 -11.284 111 HD12 ILE 14 1HD1 ILE 14 2.371 5.824 -12.803 112 HD13 ILE 14 2HD1 ILE 14 1.018 4.938 -12.099 113 H GLU 15 H GLU 15 1.100 10.795 -12.057 114 HA GLU 15 HA GLU 15 3.449 10.873 -10.525 115 HB2 GLU 15 2HB GLU 15 3.095 12.032 -12.714 116 HB3 GLU 15 1HB GLU 15 2.047 13.191 -11.902 117 HG2 GLU 15 2HG GLU 15 3.922 13.891 -10.452 118 HG3 GLU 15 1HG GLU 15 4.966 12.699 -11.219 119 H LYS 16 H LYS 16 0.290 12.425 -10.082 120 HA LYS 16 HA LYS 16 1.088 13.976 -7.785 121 HB2 LYS 16 2HB LYS 16 -0.819 14.600 -9.288 122 HB3 LYS 16 1HB LYS 16 -1.713 13.207 -8.685 123 HG2 LYS 16 2HG LYS 16 -1.616 14.107 -6.392 124 HG3 LYS 16 1HG LYS 16 -0.657 15.476 -6.955 125 HD2 LYS 16 2HD LYS 16 -2.544 16.182 -8.403 126 HD3 LYS 16 1HD LYS 16 -3.497 14.820 -7.811 127 HE2 LYS 16 2HE LYS 16 -4.071 16.879 -6.578 128 HE3 LYS 16 1HE LYS 16 -3.317 15.704 -5.499 129 HZ1 LYS 16 3HZ LYS 16 -1.512 16.983 -5.228 130 HZ2 LYS 16 1HZ LYS 16 -2.518 18.247 -5.748 131 HZ3 LYS 16 2HZ LYS 16 -1.477 17.481 -6.853 132 H VAL 17 H VAL 17 -0.704 10.921 -8.280 133 HA VAL 17 HA VAL 17 -1.277 10.407 -5.556 134 HB VAL 17 HB VAL 17 -0.896 8.414 -7.811 135 HG11 VAL 17 1HG1 VAL 17 -0.919 7.273 -5.637 136 HG12 VAL 17 2HG1 VAL 17 -2.471 7.011 -6.421 137 HG13 VAL 17 3HG1 VAL 17 -2.328 8.204 -5.131 138 HG21 VAL 17 3HG2 VAL 17 -3.348 8.609 -8.073 139 HG22 VAL 17 1HG2 VAL 17 -2.566 10.164 -8.343 140 HG23 VAL 17 2HG2 VAL 17 -3.386 9.846 -6.817 141 H TRP 18 H TRP 18 1.480 9.468 -7.598 142 HA TRP 18 HA TRP 18 2.774 7.702 -5.933 143 HB2 TRP 18 2HB TRP 18 3.507 8.374 -8.244 144 HB3 TRP 18 1HB TRP 18 4.160 9.863 -7.566 145 HD1 TRP 18 HD TRP 18 4.429 6.079 -6.831 146 HE1 TRP 18 1HE TRP 18 6.878 5.540 -6.242 147 HE3 TRP 18 3HE TRP 18 6.512 10.752 -7.124 148 HZ2 TRP 18 2HZ TRP 18 9.359 6.848 -5.950 149 HZ3 TRP 18 3HZ TRP 18 8.939 11.056 -6.679 150 HH2 TRP 18 HH TRP 18 10.363 9.095 -6.090 151 H LYS 19 H LYS 19 2.614 11.201 -5.656 152 HA LYS 19 HA LYS 19 4.669 11.593 -3.741 153 HB2 LYS 19 2HB LYS 19 2.089 13.143 -4.125 154 HB3 LYS 19 1HB LYS 19 3.487 13.702 -3.212 155 HG2 LYS 19 2HG LYS 19 4.880 13.586 -5.242 156 HG3 LYS 19 1HG LYS 19 3.494 13.008 -6.168 157 HD2 LYS 19 2HD LYS 19 2.279 15.110 -5.660 158 HD3 LYS 19 1HD LYS 19 3.677 15.691 -4.755 159 HE2 LYS 19 2HE LYS 19 3.642 14.990 -7.708 160 HE3 LYS 19 1HE LYS 19 3.684 16.621 -7.033 161 HZ1 LYS 19 3HZ LYS 19 5.752 14.520 -6.685 162 HZ2 LYS 19 1HZ LYS 19 5.784 16.045 -5.942 163 HZ3 LYS 19 2HZ LYS 19 5.892 15.923 -7.633 164 H TYR 20 H TYR 20 1.146 11.026 -3.306 165 HA TYR 20 HA TYR 20 1.258 11.025 -0.440 166 HB2 TYR 20 2HB TYR 20 -0.805 9.914 -2.366 167 HB3 TYR 20 1HB TYR 20 -1.037 10.031 -0.620 168 HD1 TYR 20 2HD TYR 20 -0.560 11.995 -3.743 169 HD2 TYR 20 1HD TYR 20 -1.476 12.195 0.444 170 HE1 TYR 20 2HE TYR 20 -1.218 14.370 -3.994 171 HE2 TYR 20 1HE TYR 20 -2.130 14.564 0.192 172 HH TYR 20 HH TYR 20 -2.280 16.099 -2.983 173 H TRP 21 H TRP 21 1.285 8.476 -2.913 174 HA TRP 21 HA TRP 21 1.196 6.286 -1.124 175 HB2 TRP 21 2HB TRP 21 0.733 6.291 -3.651 176 HB3 TRP 21 1HB TRP 21 2.477 6.249 -3.895 177 HD1 TRP 21 HD TRP 21 3.657 3.913 -3.578 178 HE1 TRP 21 1HE TRP 21 2.842 1.575 -2.881 179 HE3 TRP 21 3HE TRP 21 -1.092 5.056 -2.144 180 HZ2 TRP 21 2HZ TRP 21 0.464 0.348 -1.840 181 HZ3 TRP 21 3HZ TRP 21 -2.622 3.298 -1.316 182 HH2 TRP 21 HH TRP 21 -1.854 0.943 -1.160 183 H ASN 22 H ASN 22 3.708 8.481 -1.847 184 HA ASN 22 HA ASN 22 5.872 6.659 -0.883 185 HB2 ASN 22 2HB ASN 22 5.870 9.210 -2.521 186 HB3 ASN 22 1HB ASN 22 7.348 8.577 -1.818 187 HD21 ASN 22 1HD2 ASN 22 4.573 7.073 -3.593 188 HD22 ASN 22 2HD2 ASN 22 5.562 6.236 -4.687 189 H GLU 23 H GLU 23 4.109 9.610 -0.164 190 HA GLU 23 HA GLU 23 6.036 10.591 1.758 191 HB2 GLU 23 2HB GLU 23 3.264 11.401 0.884 192 HB3 GLU 23 1HB GLU 23 3.884 12.070 2.390 193 HG2 GLU 23 2HG GLU 23 5.833 12.990 1.228 194 HG3 GLU 23 1HG GLU 23 5.340 12.240 -0.280 195 HA PRO 24 HA PRO 24 4.460 7.709 4.900 196 HB2 PRO 24 2HB PRO 24 5.936 8.481 7.083 197 HB3 PRO 24 1HB PRO 24 6.653 7.595 5.724 198 HG2 PRO 24 2HG PRO 24 6.682 10.560 6.255 199 HG3 PRO 24 1HG PRO 24 8.032 9.509 5.771 200 HD2 PRO 24 2HD PRO 24 6.676 11.051 3.963 201 HD3 PRO 24 1HD PRO 24 7.355 9.468 3.508 202 H ALA 25 H ALA 25 4.545 11.194 5.415 203 HA ALA 25 HA ALA 25 2.932 11.372 7.705 204 HB1 ALA 25 1HB ALA 25 2.509 13.689 7.007 205 HB2 ALA 25 2HB ALA 25 3.117 13.323 5.392 206 HB3 ALA 25 3HB ALA 25 4.207 13.267 6.776 207 H HIS 26 H HIS 26 2.058 11.089 4.287 208 HA HIS 26 HA HIS 26 -0.793 11.421 4.770 209 HB2 HIS 26 2HB HIS 26 0.754 10.474 2.339 210 HB3 HIS 26 1HB HIS 26 -0.980 10.798 2.371 211 HD2 HIS 26 2HD HIS 26 -1.638 13.608 2.796 212 HE1 HIS 26 1HE HIS 26 2.244 15.002 1.917 213 HE2 HIS 26 2HE HIS 26 -0.166 15.699 2.279 214 H ILE 27 H ILE 27 1.396 8.655 4.152 215 HA ILE 27 HA ILE 27 -0.610 6.675 3.944 216 HB ILE 27 HB ILE 27 2.282 6.516 4.863 217 HG12 ILE 27 2HG1 ILE 27 1.040 5.666 2.207 218 HG13 ILE 27 1HG1 ILE 27 1.738 7.263 2.461 219 HG21 ILE 27 1HG2 ILE 27 2.024 4.004 4.246 220 HG22 ILE 27 2HG2 ILE 27 0.287 4.278 4.294 221 HG23 ILE 27 3HG2 ILE 27 1.255 4.503 5.747 222 HD11 ILE 27 3HD1 ILE 27 3.367 5.722 1.428 223 HD12 ILE 27 1HD1 ILE 27 3.222 4.636 2.803 224 HD13 ILE 27 2HD1 ILE 27 3.906 6.247 3.013 225 H MET 28 H MET 28 1.264 7.709 6.797 226 HA MET 28 HA MET 28 0.099 5.911 8.626 227 HB2 MET 28 2HB MET 28 1.026 7.320 10.376 228 HB3 MET 28 1HB MET 28 2.187 7.205 9.057 229 HG2 MET 28 2HG MET 28 1.258 9.415 8.201 230 HG3 MET 28 1HG MET 28 0.359 9.554 9.701 231 HE1 MET 28 3HE MET 28 1.753 8.911 12.063 232 HE2 MET 28 1HE MET 28 1.258 10.583 11.769 233 HE3 MET 28 2HE MET 28 2.863 10.233 12.404 234 H LYS 29 H LYS 29 -1.256 8.655 7.106 235 HA LYS 29 HA LYS 29 -3.117 9.447 9.132 236 HB2 LYS 29 2HB LYS 29 -2.277 10.785 7.121 237 HB3 LYS 29 1HB LYS 29 -3.435 9.886 6.149 238 HG2 LYS 29 2HG LYS 29 -5.254 10.627 7.692 239 HG3 LYS 29 1HG LYS 29 -4.082 11.611 8.564 240 HD2 LYS 29 2HD LYS 29 -4.760 11.910 5.622 241 HD3 LYS 29 1HD LYS 29 -5.391 12.929 6.906 242 HE2 LYS 29 2HE LYS 29 -2.907 13.469 7.465 243 HE3 LYS 29 1HE LYS 29 -2.539 12.788 5.876 244 HZ1 LYS 29 3HZ LYS 29 -2.874 15.124 5.681 245 HZ2 LYS 29 1HZ LYS 29 -4.381 15.029 6.455 246 HZ3 LYS 29 2HZ LYS 29 -4.168 14.320 4.925 247 H TRP 30 H TRP 30 -3.203 7.157 6.473 248 HA TRP 30 HA TRP 30 -5.897 6.190 7.329 249 HB2 TRP 30 2HB TRP 30 -6.423 5.732 4.970 250 HB3 TRP 30 1HB TRP 30 -6.074 7.443 5.202 251 HD1 TRP 30 HD TRP 30 -3.818 8.396 4.159 252 HE1 TRP 30 1HE TRP 30 -2.166 7.460 2.405 253 HE3 TRP 30 3HE TRP 30 -5.403 3.546 3.954 254 HZ2 TRP 30 2HZ TRP 30 -1.593 4.978 1.088 255 HZ3 TRP 30 3HZ TRP 30 -4.307 1.921 2.464 256 HH2 TRP 30 HH TRP 30 -2.406 2.623 1.026 257 H CYS 31 H CYS 31 -2.718 5.380 7.368 258 HA CYS 31 HA CYS 31 -2.455 2.894 6.153 259 HB2 CYS 31 2HB CYS 31 -0.568 3.963 7.250 260 HB3 CYS 31 1HB CYS 31 -1.390 3.896 8.788 261 HG CYS 31 HG CYS 31 -0.788 1.478 9.042 262 H GLN 32 H GLN 32 -3.043 0.839 6.662 263 HA GLN 32 HA GLN 32 -4.153 -0.894 7.614 264 HB2 GLN 32 2HB GLN 32 -3.072 0.025 9.803 265 HB3 GLN 32 1HB GLN 32 -4.645 0.734 10.135 266 HG2 GLN 32 2HG GLN 32 -4.581 -1.412 11.254 267 HG3 GLN 32 1HG GLN 32 -5.659 -1.574 9.875 268 HE21 GLN 32 1HE2 GLN 32 -2.068 -1.726 10.177 269 HE22 GLN 32 2HE2 GLN 32 -1.926 -3.239 9.419 270 H ALA 33 H ALA 33 -5.525 2.301 7.989 271 HA ALA 33 HA ALA 33 -7.623 3.163 7.692 272 HB1 ALA 33 1HB ALA 33 -8.985 2.181 5.921 273 HB2 ALA 33 2HB ALA 33 -8.065 0.681 6.001 274 HB3 ALA 33 3HB ALA 33 -7.291 2.159 5.422 275 H SER 34 H SER 34 -7.138 1.496 10.006 276 HA SER 34 HA SER 34 -9.844 0.343 10.503 277 HB2 SER 34 2HB SER 34 -7.173 -0.483 11.680 278 HB3 SER 34 1HB SER 34 -8.744 -1.168 12.103 279 HG SER 34 HG SER 34 -8.699 -2.297 10.342 280 HA PRO 35 HA PRO 35 -9.810 3.563 13.719 281 HB2 PRO 35 2HB PRO 35 -12.120 2.996 15.062 282 HB3 PRO 35 1HB PRO 35 -12.153 3.607 13.389 283 HG2 PRO 35 2HG PRO 35 -12.345 0.748 14.347 284 HG3 PRO 35 1HG PRO 35 -13.392 1.600 13.186 285 HD2 PRO 35 2HD PRO 35 -11.346 -0.018 12.352 286 HD3 PRO 35 1HD PRO 35 -11.806 1.443 11.442 287 H GLU 36 H GLU 36 -9.779 0.137 14.430 288 HA GLU 36 HA GLU 36 -9.435 0.400 17.296 289 HB2 GLU 36 2HB GLU 36 -10.439 -1.609 16.100 290 HB3 GLU 36 1HB GLU 36 -8.823 -2.007 15.537 291 HG2 GLU 36 2HG GLU 36 -9.257 -3.319 17.542 292 HG3 GLU 36 1HG GLU 36 -8.070 -2.091 17.955 293 H TRP 37 H TRP 37 -7.371 0.429 14.514 294 HA TRP 37 HA TRP 37 -4.911 0.272 16.200 295 HB2 TRP 37 2HB TRP 37 -5.239 -0.092 13.205 296 HB3 TRP 37 1HB TRP 37 -3.727 -0.232 14.104 297 HD1 TRP 37 HD TRP 37 -7.130 -1.934 13.729 298 HE1 TRP 37 1HE TRP 37 -6.949 -4.370 14.521 299 HE3 TRP 37 3HE TRP 37 -2.371 -1.902 15.583 300 HZ2 TRP 37 2HZ TRP 37 -5.051 -6.080 15.780 301 HZ3 TRP 37 3HZ TRP 37 -1.415 -3.969 16.592 302 HH2 TRP 37 HH TRP 37 -2.750 -6.045 16.672 303 H HIS 38 H HIS 38 -3.276 1.797 15.848 304 HA HIS 38 HA HIS 38 -3.914 4.233 14.300 305 HB2 HIS 38 2HB HIS 38 -3.415 5.670 16.240 306 HB3 HIS 38 1HB HIS 38 -4.808 4.643 16.576 307 HD2 HIS 38 2HD HIS 38 -3.781 2.074 17.980 308 HE1 HIS 38 1HE HIS 38 -0.877 4.350 20.028 309 HE2 HIS 38 2HE HIS 38 -2.084 2.118 19.962 310 H VAL 39 H VAL 39 -1.976 5.639 14.133 311 HA VAL 39 HA VAL 39 0.562 4.087 14.351 312 HB VAL 39 HB VAL 39 -0.218 6.110 12.237 313 HG11 VAL 39 1HG1 VAL 39 1.845 5.177 11.105 314 HG12 VAL 39 2HG1 VAL 39 2.216 4.299 12.583 315 HG13 VAL 39 3HG1 VAL 39 2.210 6.065 12.585 316 HG21 VAL 39 3HG2 VAL 39 -1.534 4.078 11.939 317 HG22 VAL 39 1HG2 VAL 39 -0.115 3.061 12.212 318 HG23 VAL 39 2HG2 VAL 39 -0.220 4.051 10.767 319 HA PRO 40 HA PRO 40 1.066 7.974 16.826 320 HB2 PRO 40 2HB PRO 40 2.809 7.059 18.736 321 HB3 PRO 40 1HB PRO 40 1.069 6.699 18.801 322 HG2 PRO 40 2HG PRO 40 3.314 4.952 17.815 323 HG3 PRO 40 1HG PRO 40 1.926 4.510 18.831 324 HD2 PRO 40 2HD PRO 40 2.015 4.035 16.118 325 HD3 PRO 40 1HD PRO 40 0.486 4.292 16.989 326 H ALA 41 H ALA 41 3.204 6.105 14.955 327 HA ALA 41 HA ALA 41 4.811 8.376 14.268 328 HB1 ALA 41 1HB ALA 41 5.877 7.801 16.423 329 HB2 ALA 41 2HB ALA 41 6.972 7.529 15.066 330 HB3 ALA 41 3HB ALA 41 6.167 6.161 15.839 331 H ALA 42 H ALA 42 6.150 7.983 12.478 332 HA ALA 42 HA ALA 42 6.468 5.351 11.352 333 HB1 ALA 42 1HB ALA 42 5.164 5.749 9.305 334 HB2 ALA 42 2HB ALA 42 4.600 7.287 9.961 335 HB3 ALA 42 3HB ALA 42 4.130 5.778 10.729 336 H GLN 43 H GLN 43 7.980 5.292 9.702 337 HA GLN 43 HA GLN 43 9.141 7.851 8.745 338 HB2 GLN 43 2HB GLN 43 10.715 5.569 9.996 339 HB3 GLN 43 1HB GLN 43 11.417 6.978 9.199 340 HG2 GLN 43 2HG GLN 43 10.293 8.454 10.871 341 HG3 GLN 43 1HG GLN 43 9.672 7.023 11.688 342 HE21 GLN 43 1HE2 GLN 43 11.755 9.181 12.483 343 HE22 GLN 43 2HE2 GLN 43 13.077 8.265 13.022 344 H ASN 44 H ASN 44 10.293 7.649 6.805 345 HA ASN 44 HA ASN 44 10.502 5.119 5.411 346 HB2 ASN 44 2HB ASN 44 8.085 5.699 5.104 347 HB3 ASN 44 1HB ASN 44 8.575 7.206 4.330 348 HD21 ASN 44 1HD2 ASN 44 7.851 6.729 2.199 349 HD22 ASN 44 2HD2 ASN 44 8.480 5.454 1.270 350 H ASP 45 H ASP 45 12.247 5.240 4.157 351 HA ASP 45 HA ASP 45 13.102 7.836 2.978 352 HB2 ASP 45 2HB ASP 45 14.876 5.832 4.416 353 HB3 ASP 45 1HB ASP 45 15.434 7.270 3.560 354 H LEU 46 H LEU 46 12.373 7.210 0.964 355 HA LEU 46 HA LEU 46 12.886 4.660 -0.213 356 HB2 LEU 46 2HB LEU 46 12.274 7.335 -1.497 357 HB3 LEU 46 1HB LEU 46 12.213 5.780 -2.307 358 HG LEU 46 HG LEU 46 10.489 6.571 0.065 359 HD11 LEU 46 1HD1 LEU 46 9.881 7.802 -1.976 360 HD12 LEU 46 2HD1 LEU 46 8.653 6.589 -1.607 361 HD13 LEU 46 3HD1 LEU 46 9.822 6.291 -2.890 362 HD21 LEU 46 3HD2 LEU 46 10.722 4.000 -1.552 363 HD22 LEU 46 1HD2 LEU 46 9.178 4.435 -0.810 364 HD23 LEU 46 2HD2 LEU 46 10.594 4.204 0.197 365 H LYS 47 H LYS 47 14.984 4.030 -0.289 366 HA LYS 47 HA LYS 47 16.715 5.286 -2.217 367 HB2 LYS 47 2HB LYS 47 17.083 6.706 -0.184 368 HB3 LYS 47 1HB LYS 47 17.592 5.270 0.698 369 HG2 LYS 47 2HG LYS 47 19.449 4.927 -0.887 370 HG3 LYS 47 1HG LYS 47 18.917 6.319 -1.829 371 HD2 LYS 47 2HD LYS 47 19.309 7.785 0.132 372 HD3 LYS 47 1HD LYS 47 19.852 6.387 1.060 373 HE2 LYS 47 2HE LYS 47 21.689 6.021 -0.546 374 HE3 LYS 47 1HE LYS 47 21.142 7.404 -1.495 375 HZ1 LYS 47 3HZ LYS 47 22.359 8.687 -0.194 376 HZ2 LYS 47 1HZ LYS 47 22.788 7.374 0.792 377 HZ3 LYS 47 2HZ LYS 47 21.381 8.267 1.131 378 H ALA 48 H ALA 48 17.871 3.692 -3.150 379 HA ALA 48 HA ALA 48 17.571 1.003 -2.527 380 HB1 ALA 48 1HB ALA 48 19.484 0.647 -4.056 381 HB2 ALA 48 2HB ALA 48 19.858 2.368 -3.973 382 HB3 ALA 48 3HB ALA 48 18.345 1.830 -4.705 383 H GLY 49 H GLY 49 18.335 -0.215 -0.893 384 HA2 GLY 49 2HA GLY 49 19.851 -1.112 0.636 385 HA3 GLY 49 1HA GLY 49 21.043 0.093 0.152 386 H GLY 50 H GLY 50 18.130 1.608 0.740 387 HA2 GLY 50 2HA GLY 50 19.056 2.781 3.259 388 HA3 GLY 50 1HA GLY 50 17.616 3.226 2.341 389 H THR 51 H THR 51 17.281 3.013 5.011 390 HA THR 51 HA THR 51 15.670 0.524 5.341 391 HB THR 51 HB THR 51 17.670 0.168 6.662 392 HG1 THR 51 1HG THR 51 15.429 1.061 8.115 393 HG21 THR 51 3HG2 THR 51 18.426 1.805 8.340 394 HG22 THR 51 1HG2 THR 51 17.169 2.924 7.825 395 HG23 THR 51 2HG2 THR 51 18.475 2.497 6.724 396 H PHE 52 H PHE 52 14.051 0.737 7.031 397 HA PHE 52 HA PHE 52 13.181 3.464 7.739 398 HB2 PHE 52 2HB PHE 52 10.958 3.154 6.778 399 HB3 PHE 52 1HB PHE 52 12.170 3.014 5.508 400 HD1 PHE 52 1HD PHE 52 12.823 0.737 4.628 401 HD2 PHE 52 2HD PHE 52 9.579 1.235 7.417 402 HE1 PHE 52 1HE PHE 52 12.002 -1.537 4.092 403 HE2 PHE 52 2HE PHE 52 8.764 -1.038 6.874 404 HZ PHE 52 HZ PHE 52 9.974 -2.423 5.211 405 H THR 53 H THR 53 11.175 3.353 9.129 406 HA THR 53 HA THR 53 10.773 0.816 10.558 407 HB THR 53 HB THR 53 11.660 3.336 12.028 408 HG1 THR 53 1HG THR 53 13.028 0.947 11.368 409 HG21 THR 53 3HG2 THR 53 11.156 0.488 12.962 410 HG22 THR 53 1HG2 THR 53 10.158 1.891 13.340 411 HG23 THR 53 2HG2 THR 53 11.801 1.785 13.964 412 H THR 54 H THR 54 8.647 0.607 10.900 413 HA THR 54 HA THR 54 6.924 3.033 11.104 414 HB THR 54 HB THR 54 6.169 0.331 9.925 415 HG1 THR 54 1HG THR 54 7.489 1.281 8.471 416 HG21 THR 54 3HG2 THR 54 4.249 1.537 10.874 417 HG22 THR 54 1HG2 THR 54 4.180 1.599 9.114 418 HG23 THR 54 2HG2 THR 54 4.727 3.007 10.023 419 H THR 55 H THR 55 6.127 3.237 13.125 420 HA THR 55 HA THR 55 5.944 0.872 14.889 421 HB THR 55 HB THR 55 5.479 3.824 15.512 422 HG1 THR 55 1HG THR 55 7.554 3.864 15.179 423 HG21 THR 55 3HG2 THR 55 6.022 1.415 17.285 424 HG22 THR 55 1HG2 THR 55 4.491 2.281 17.163 425 HG23 THR 55 2HG2 THR 55 5.904 3.083 17.844 426 H MET 56 H MET 56 4.016 -0.191 14.915 427 HA MET 56 HA MET 56 1.493 1.366 14.778 428 HB2 MET 56 2HB MET 56 1.973 0.405 12.517 429 HB3 MET 56 1HB MET 56 2.017 -1.202 13.232 430 HG2 MET 56 2HG MET 56 -0.338 -0.926 13.988 431 HG3 MET 56 1HG MET 56 -0.359 0.693 13.297 432 HE1 MET 56 3HE MET 56 -0.538 -3.336 11.126 433 HE2 MET 56 1HE MET 56 -1.154 -2.948 12.737 434 HE3 MET 56 2HE MET 56 0.582 -3.006 12.441 435 H ALA 57 H ALA 57 0.150 0.799 16.364 436 HA ALA 57 HA ALA 57 0.138 -1.906 17.488 437 HB1 ALA 57 1HB ALA 57 0.524 -1.115 19.791 438 HB2 ALA 57 2HB ALA 57 0.828 0.514 19.182 439 HB3 ALA 57 3HB ALA 57 1.929 -0.800 18.771 440 H ALA 58 H ALA 58 -1.611 -2.256 18.914 441 HA ALA 58 HA ALA 58 -4.029 -0.972 18.066 442 HB1 ALA 58 1HB ALA 58 -3.996 -3.323 18.749 443 HB2 ALA 58 2HB ALA 58 -5.138 -2.395 19.722 444 HB3 ALA 58 3HB ALA 58 -3.568 -2.846 20.394 445 H LYS 59 H LYS 59 -5.459 0.312 19.295 446 HA LYS 59 HA LYS 59 -4.287 2.436 20.715 447 HB2 LYS 59 2HB LYS 59 -7.161 1.462 20.674 448 HB3 LYS 59 1HB LYS 59 -6.645 2.996 21.375 449 HG2 LYS 59 2HG LYS 59 -5.827 3.777 19.210 450 HG3 LYS 59 1HG LYS 59 -6.176 2.215 18.472 451 HD2 LYS 59 2HD LYS 59 -7.964 3.780 17.902 452 HD3 LYS 59 1HD LYS 59 -8.601 2.542 18.974 453 HE2 LYS 59 2HE LYS 59 -8.694 4.061 20.835 454 HE3 LYS 59 1HE LYS 59 -7.621 5.220 20.044 455 HZ1 LYS 59 3HZ LYS 59 -9.661 6.140 19.706 456 HZ2 LYS 59 1HZ LYS 59 -10.451 4.649 19.540 457 HZ3 LYS 59 2HZ LYS 59 -9.484 5.240 18.275 458 H ASP 60 H ASP 60 -5.804 -0.549 21.843 459 HA ASP 60 HA ASP 60 -5.764 0.126 24.640 460 HB2 ASP 60 2HB ASP 60 -5.912 -2.559 23.232 461 HB3 ASP 60 1HB ASP 60 -6.221 -2.296 24.948 462 H GLY 61 H GLY 61 -3.371 -0.675 22.396 463 HA2 GLY 61 2HA GLY 61 -1.095 -0.969 22.619 464 HA3 GLY 61 1HA GLY 61 -1.271 -0.697 24.350 465 H SER 62 H SER 62 -3.411 -3.078 23.351 466 HA SER 62 HA SER 62 -2.153 -5.140 24.821 467 HB2 SER 62 2HB SER 62 -4.332 -5.342 22.723 468 HB3 SER 62 1HB SER 62 -3.925 -6.580 23.911 469 HG SER 62 HG SER 62 -5.496 -4.427 24.175 470 H MET 63 H MET 63 -2.288 -4.404 21.365 471 HA MET 63 HA MET 63 -0.284 -6.551 20.798 472 HB2 MET 63 2HB MET 63 -2.436 -5.358 19.010 473 HB3 MET 63 1HB MET 63 -1.220 -6.528 18.492 474 HG2 MET 63 2HG MET 63 -2.049 -8.146 20.148 475 HG3 MET 63 1HG MET 63 -3.275 -6.993 20.674 476 HE1 MET 63 3HE MET 63 -5.893 -6.890 17.973 477 HE2 MET 63 1HE MET 63 -4.838 -5.782 18.859 478 HE3 MET 63 2HE MET 63 -5.681 -7.070 19.714 479 H SER 64 H SER 64 1.502 -6.018 19.651 480 HA SER 64 HA SER 64 1.831 -3.306 18.537 481 HB2 SER 64 2HB SER 64 3.895 -2.918 19.748 482 HB3 SER 64 1HB SER 64 2.618 -3.249 20.917 483 HG SER 64 HG SER 64 4.371 -5.218 19.872 484 H PHE 65 H PHE 65 3.412 -3.182 16.946 485 HA PHE 65 HA PHE 65 5.053 -5.504 16.261 486 HB2 PHE 65 2HB PHE 65 2.899 -4.516 14.353 487 HB3 PHE 65 1HB PHE 65 4.138 -5.714 13.986 488 HD1 PHE 65 2HD PHE 65 4.307 -7.779 15.592 489 HD2 PHE 65 1HD PHE 65 0.793 -5.305 15.257 490 HE1 PHE 65 2HE PHE 65 2.922 -9.599 16.547 491 HE2 PHE 65 1HE PHE 65 -0.573 -7.130 16.208 492 HZ PHE 65 HZ PHE 65 0.484 -9.271 16.855 493 H ASP 66 H ASP 66 6.626 -5.017 14.691 494 HA ASP 66 HA ASP 66 6.940 -2.168 13.898 495 HB2 ASP 66 2HB ASP 66 9.040 -3.878 15.273 496 HB3 ASP 66 1HB ASP 66 9.313 -2.270 14.602 497 H PHE 67 H PHE 67 7.219 -2.124 11.766 498 HA PHE 67 HA PHE 67 8.168 -4.512 10.309 499 HB2 PHE 67 2HB PHE 67 7.080 -1.863 9.275 500 HB3 PHE 67 1HB PHE 67 7.406 -3.307 8.312 501 HD1 PHE 67 2HD PHE 67 5.993 -5.345 8.558 502 HD2 PHE 67 1HD PHE 67 5.139 -1.766 10.788 503 HE1 PHE 67 2HE PHE 67 3.748 -6.234 9.133 504 HE2 PHE 67 1HE PHE 67 2.900 -2.662 11.359 505 HZ PHE 67 HZ PHE 67 2.204 -4.892 10.533 506 H GLY 68 H GLY 68 10.254 -4.679 9.775 507 HA2 GLY 68 2HA GLY 68 11.888 -2.235 9.254 508 HA3 GLY 68 1HA GLY 68 12.483 -3.551 10.265 509 H GLY 69 H GLY 69 13.074 -2.339 7.449 510 HA2 GLY 69 2HA GLY 69 14.179 -4.678 6.294 511 HA3 GLY 69 1HA GLY 69 12.665 -4.273 5.480 512 H VAL 70 H VAL 70 14.500 -4.084 3.728 513 HA VAL 70 HA VAL 70 15.233 -1.216 3.514 514 HB VAL 70 HB VAL 70 17.355 -1.894 2.485 515 HG11 VAL 70 1HG1 VAL 70 18.476 -2.712 4.520 516 HG12 VAL 70 2HG1 VAL 70 16.915 -3.182 5.196 517 HG13 VAL 70 3HG1 VAL 70 17.281 -1.480 4.919 518 HG21 VAL 70 3HG2 VAL 70 16.760 -4.082 1.555 519 HG22 VAL 70 1HG2 VAL 70 16.448 -4.718 3.173 520 HG23 VAL 70 2HG2 VAL 70 18.092 -4.301 2.684 521 H TYR 71 H TYR 71 15.431 -0.449 1.369 522 HA TYR 71 HA TYR 71 13.545 -1.747 -0.491 523 HB2 TYR 71 2HB TYR 71 14.991 0.927 -0.547 524 HB3 TYR 71 1HB TYR 71 13.906 0.377 -1.824 525 HD1 TYR 71 1HD TYR 71 11.476 0.051 -1.379 526 HD2 TYR 71 2HD TYR 71 14.097 1.638 1.644 527 HE1 TYR 71 1HE TYR 71 9.514 0.802 -0.071 528 HE2 TYR 71 2HE TYR 71 12.128 2.392 2.944 529 HH TYR 71 HH TYR 71 8.901 2.284 1.630 530 H ASP 72 H ASP 72 14.203 -3.037 -2.103 531 HA ASP 72 HA ASP 72 16.999 -3.529 -2.626 532 HB2 ASP 72 2HB ASP 72 15.292 -5.305 -2.774 533 HB3 ASP 72 1HB ASP 72 14.516 -4.455 -4.108 534 H GLN 73 H GLN 73 14.346 -1.826 -4.203 535 HA GLN 73 HA GLN 73 16.103 -0.048 -5.595 536 HB2 GLN 73 2HB GLN 73 15.569 -2.552 -6.926 537 HB3 GLN 73 1HB GLN 73 14.661 -1.336 -7.807 538 HG2 GLN 73 2HG GLN 73 17.633 -1.215 -7.174 539 HG3 GLN 73 1HG GLN 73 16.933 -1.634 -8.736 540 HE21 GLN 73 1HE2 GLN 73 14.889 0.292 -8.953 541 HE22 GLN 73 2HE2 GLN 73 15.582 1.840 -9.002 542 H VAL 74 H VAL 74 15.014 1.685 -6.566 543 HA VAL 74 HA VAL 74 12.050 1.778 -6.297 544 HB VAL 74 HB VAL 74 13.950 3.980 -5.388 545 HG11 VAL 74 1HG1 VAL 74 11.815 4.866 -6.233 546 HG12 VAL 74 2HG1 VAL 74 11.841 4.986 -4.488 547 HG13 VAL 74 3HG1 VAL 74 10.922 3.702 -5.256 548 HG21 VAL 74 3HG2 VAL 74 12.281 2.021 -3.770 549 HG22 VAL 74 1HG2 VAL 74 13.147 3.405 -3.101 550 HG23 VAL 74 2HG2 VAL 74 14.046 2.075 -3.838 551 H LYS 75 H LYS 75 11.089 2.652 -8.068 552 HA LYS 75 HA LYS 75 12.610 4.437 -9.866 553 HB2 LYS 75 2HB LYS 75 11.218 1.855 -10.676 554 HB3 LYS 75 1HB LYS 75 11.700 3.105 -11.828 555 HG2 LYS 75 2HG LYS 75 14.056 2.852 -11.074 556 HG3 LYS 75 1HG LYS 75 13.551 1.570 -9.974 557 HD2 LYS 75 2HD LYS 75 12.726 0.241 -11.891 558 HD3 LYS 75 1HD LYS 75 13.246 1.518 -12.992 559 HE2 LYS 75 2HE LYS 75 15.053 -0.075 -11.145 560 HE3 LYS 75 1HE LYS 75 14.944 -0.261 -12.895 561 HZ1 LYS 75 3HZ LYS 75 15.379 2.356 -12.693 562 HZ2 LYS 75 1HZ LYS 75 16.621 1.214 -12.868 563 HZ3 LYS 75 2HZ LYS 75 16.231 1.813 -11.327 564 H THR 76 H THR 76 11.377 6.200 -10.000 565 HA THR 76 HA THR 76 8.781 6.449 -9.063 566 HB THR 76 HB THR 76 10.084 8.135 -11.224 567 HG1 THR 76 1HG THR 76 10.229 8.201 -8.398 568 HG21 THR 76 3HG2 THR 76 7.911 8.737 -9.191 569 HG22 THR 76 1HG2 THR 76 7.711 8.677 -10.942 570 HG23 THR 76 2HG2 THR 76 8.691 9.944 -10.212 571 H ASN 77 H ASN 77 6.867 5.774 -9.811 572 HA ASN 77 HA ASN 77 5.253 4.889 -11.189 573 HB2 ASN 77 2HB ASN 77 6.535 6.791 -13.161 574 HB3 ASN 77 1HB ASN 77 4.912 6.117 -13.284 575 HD21 ASN 77 1HD2 ASN 77 4.967 6.456 -10.093 576 HD22 ASN 77 2HD2 ASN 77 4.502 8.079 -9.917 577 H ASP 78 H ASP 78 6.754 2.882 -11.030 578 HA ASP 78 HA ASP 78 6.826 1.647 -13.629 579 HB2 ASP 78 2HB ASP 78 8.915 2.930 -13.772 580 HB3 ASP 78 1HB ASP 78 9.447 2.250 -12.247 581 H LEU 79 H LEU 79 8.941 1.087 -10.823 582 HA LEU 79 HA LEU 79 7.245 -1.107 -9.873 583 HB2 LEU 79 2HB LEU 79 8.740 -1.985 -11.766 584 HB3 LEU 79 1HB LEU 79 10.110 -1.676 -10.710 585 HG LEU 79 HG LEU 79 8.654 -3.139 -8.943 586 HD11 LEU 79 1HD1 LEU 79 7.373 -4.924 -10.051 587 HD12 LEU 79 2HD1 LEU 79 7.721 -4.221 -11.633 588 HD13 LEU 79 3HD1 LEU 79 6.705 -3.353 -10.490 589 HD21 LEU 79 3HD2 LEU 79 9.830 -5.193 -9.731 590 HD22 LEU 79 1HD2 LEU 79 10.893 -3.783 -9.729 591 HD23 LEU 79 2HD2 LEU 79 10.213 -4.369 -11.246 592 H ILE 80 H ILE 80 7.365 -1.277 -7.727 593 HA ILE 80 HA ILE 80 9.758 -0.277 -6.263 594 HB ILE 80 HB ILE 80 6.866 0.280 -5.464 595 HG12 ILE 80 2HG1 ILE 80 9.012 2.172 -6.520 596 HG13 ILE 80 1HG1 ILE 80 7.627 1.617 -7.453 597 HG21 ILE 80 1HG2 ILE 80 9.530 1.197 -4.289 598 HG22 ILE 80 2HG2 ILE 80 8.452 0.021 -3.540 599 HG23 ILE 80 3HG2 ILE 80 7.946 1.693 -3.701 600 HD11 ILE 80 3HD1 ILE 80 6.141 2.617 -5.635 601 HD12 ILE 80 1HD1 ILE 80 7.047 3.767 -6.617 602 HD13 ILE 80 2HD1 ILE 80 7.601 3.370 -4.992 603 H GLU 81 H GLU 81 10.443 -1.679 -4.765 604 HA GLU 81 HA GLU 81 8.649 -3.602 -3.504 605 HB2 GLU 81 2HB GLU 81 10.052 -5.556 -4.180 606 HB3 GLU 81 1HB GLU 81 9.221 -4.819 -5.548 607 HG2 GLU 81 2HG GLU 81 11.277 -3.576 -6.132 608 HG3 GLU 81 1HG GLU 81 12.122 -4.331 -4.783 609 H TYR 82 H TYR 82 9.847 -4.870 -1.874 610 HA TYR 82 HA TYR 82 12.437 -3.901 -0.967 611 HB2 TYR 82 2HB TYR 82 11.430 -3.233 1.317 612 HB3 TYR 82 1HB TYR 82 11.170 -2.101 -0.006 613 HD1 TYR 82 1HD TYR 82 9.570 -4.947 1.838 614 HD2 TYR 82 2HD TYR 82 8.915 -1.529 -0.701 615 HE1 TYR 82 1HE TYR 82 7.130 -5.165 2.159 616 HE2 TYR 82 2HE TYR 82 6.478 -1.757 -0.366 617 HH TYR 82 HH TYR 82 4.850 -3.041 0.465 618 H THR 83 H THR 83 13.107 -5.051 1.045 619 HA THR 83 HA THR 83 11.916 -7.785 1.186 620 HB THR 83 HB THR 83 14.789 -6.918 1.707 621 HG1 THR 83 1HG THR 83 15.099 -7.220 -0.327 622 HG21 THR 83 3HG2 THR 83 14.156 -8.937 2.960 623 HG22 THR 83 1HG2 THR 83 15.215 -9.370 1.619 624 HG23 THR 83 2HG2 THR 83 13.481 -9.653 1.496 625 H ILE 84 H ILE 84 11.228 -8.440 3.143 626 HA ILE 84 HA ILE 84 11.574 -6.659 5.494 627 HB ILE 84 HB ILE 84 9.688 -9.013 5.091 628 HG12 ILE 84 2HG1 ILE 84 9.149 -7.320 3.412 629 HG13 ILE 84 1HG1 ILE 84 7.926 -7.284 4.672 630 HG21 ILE 84 1HG2 ILE 84 10.070 -8.446 7.449 631 HG22 ILE 84 2HG2 ILE 84 8.448 -7.952 6.977 632 HG23 ILE 84 3HG2 ILE 84 9.728 -6.750 7.118 633 HD11 ILE 84 3HD1 ILE 84 9.310 -5.348 5.718 634 HD12 ILE 84 1HD1 ILE 84 8.431 -5.000 4.234 635 HD13 ILE 84 2HD1 ILE 84 10.158 -5.299 4.174 636 H GLY 85 H GLY 85 12.255 -7.476 7.476 637 HA2 GLY 85 2HA GLY 85 14.409 -9.244 7.482 638 HA3 GLY 85 1HA GLY 85 13.495 -8.800 8.920 639 H ASP 86 H ASP 86 10.980 -9.903 8.193 640 HA ASP 86 HA ASP 86 11.248 -12.556 9.053 641 HB2 ASP 86 2HB ASP 86 8.933 -11.267 7.573 642 HB3 ASP 86 1HB ASP 86 8.855 -12.747 8.527 643 H GLY 87 H GLY 87 11.563 -11.159 5.929 644 HA2 GLY 87 2HA GLY 87 12.594 -12.341 4.121 645 HA3 GLY 87 1HA GLY 87 11.858 -13.840 4.675 646 H ARG 88 H ARG 88 9.472 -11.575 4.998 647 HA ARG 88 HA ARG 88 7.967 -12.546 2.775 648 HB2 ARG 88 2HB ARG 88 7.546 -10.090 4.525 649 HB3 ARG 88 1HB ARG 88 6.377 -10.661 3.329 650 HG2 ARG 88 2HG ARG 88 6.230 -12.826 4.506 651 HG3 ARG 88 1HG ARG 88 7.385 -12.252 5.710 652 HD2 ARG 88 2HD ARG 88 5.829 -10.421 6.323 653 HD3 ARG 88 1HD ARG 88 4.682 -11.007 5.123 654 HE ARG 88 HE ARG 88 4.113 -12.773 6.540 655 HH11 ARG 88 1HH2 ARG 88 6.921 -11.104 7.712 656 HH12 ARG 88 2HH2 ARG 88 6.938 -11.925 9.235 657 HH21 ARG 88 1HH1 ARG 88 4.139 -13.848 8.529 658 HH22 ARG 88 2HH1 ARG 88 5.363 -13.478 9.699 659 H LYS 89 H LYS 89 7.521 -11.618 0.812 660 HA LYS 89 HA LYS 89 9.189 -9.301 -0.044 661 HB2 LYS 89 2HB LYS 89 9.855 -11.588 -0.920 662 HB3 LYS 89 1HB LYS 89 8.328 -11.632 -1.796 663 HG2 LYS 89 2HG LYS 89 8.975 -9.428 -2.875 664 HG3 LYS 89 1HG LYS 89 10.546 -9.564 -2.095 665 HD2 LYS 89 2HD LYS 89 9.375 -11.554 -4.057 666 HD3 LYS 89 1HD LYS 89 10.599 -10.353 -4.439 667 HE2 LYS 89 2HE LYS 89 12.035 -11.469 -2.574 668 HE3 LYS 89 1HE LYS 89 10.896 -12.815 -2.684 669 HZ1 LYS 89 3HZ LYS 89 12.131 -13.516 -4.354 670 HZ2 LYS 89 1HZ LYS 89 12.982 -12.053 -4.470 671 HZ3 LYS 89 2HZ LYS 89 11.493 -12.235 -5.269 672 H VAL 90 H VAL 90 8.260 -7.828 -1.398 673 HA VAL 90 HA VAL 90 5.387 -8.092 -2.084 674 HB VAL 90 HB VAL 90 6.606 -5.636 -0.754 675 HG11 VAL 90 1HG1 VAL 90 4.786 -5.065 -2.303 676 HG12 VAL 90 2HG1 VAL 90 4.200 -4.905 -0.652 677 HG13 VAL 90 3HG1 VAL 90 3.762 -6.318 -1.605 678 HG21 VAL 90 3HG2 VAL 90 5.113 -6.257 1.169 679 HG22 VAL 90 1HG2 VAL 90 6.390 -7.440 0.889 680 HG23 VAL 90 2HG2 VAL 90 4.745 -7.775 0.352 681 H ARG 91 H ARG 91 4.915 -7.279 -4.041 682 HA ARG 91 HA ARG 91 6.914 -5.606 -5.484 683 HB2 ARG 91 2HB ARG 91 5.443 -8.041 -6.559 684 HB3 ARG 91 1HB ARG 91 6.457 -6.956 -7.512 685 HG2 ARG 91 2HG ARG 91 8.407 -7.522 -6.103 686 HG3 ARG 91 1HG ARG 91 7.402 -8.600 -5.135 687 HD2 ARG 91 2HD ARG 91 7.874 -8.914 -8.122 688 HD3 ARG 91 1HD ARG 91 8.724 -9.821 -6.874 689 HE ARG 91 HE ARG 91 5.958 -10.127 -6.449 690 HH11 ARG 91 1HH2 ARG 91 8.420 -10.958 -8.752 691 HH12 ARG 91 2HH2 ARG 91 7.628 -12.409 -9.272 692 HH21 ARG 91 1HH1 ARG 91 4.928 -12.019 -7.131 693 HH22 ARG 91 2HH1 ARG 91 5.654 -13.007 -8.355 694 H ILE 92 H ILE 92 5.943 -3.779 -6.060 695 HA ILE 92 HA ILE 92 2.995 -3.707 -6.497 696 HB ILE 92 HB ILE 92 4.917 -1.421 -5.856 697 HG12 ILE 92 2HG1 ILE 92 2.892 -2.783 -4.016 698 HG13 ILE 92 1HG1 ILE 92 4.623 -3.091 -3.961 699 HG21 ILE 92 1HG2 ILE 92 2.879 -0.734 -7.112 700 HG22 ILE 92 2HG2 ILE 92 2.791 -0.163 -5.455 701 HG23 ILE 92 3HG2 ILE 92 1.873 -1.582 -5.946 702 HD11 ILE 92 3HD1 ILE 92 5.020 -0.674 -3.516 703 HD12 ILE 92 1HD1 ILE 92 4.039 -1.434 -2.263 704 HD13 ILE 92 2HD1 ILE 92 3.277 -0.412 -3.481 705 H VAL 93 H VAL 93 2.469 -3.689 -8.611 706 HA VAL 93 HA VAL 93 4.359 -2.554 -10.612 707 HB VAL 93 HB VAL 93 2.029 -4.469 -11.070 708 HG11 VAL 93 1HG1 VAL 93 4.377 -3.638 -12.816 709 HG12 VAL 93 2HG1 VAL 93 2.703 -3.138 -13.046 710 HG13 VAL 93 3HG1 VAL 93 3.152 -4.828 -13.255 711 HG21 VAL 93 3HG2 VAL 93 3.736 -5.568 -9.675 712 HG22 VAL 93 1HG2 VAL 93 5.000 -5.056 -10.792 713 HG23 VAL 93 2HG2 VAL 93 3.785 -6.220 -11.311 714 H PHE 94 H PHE 94 3.805 -0.532 -11.170 715 HA PHE 94 HA PHE 94 1.035 0.430 -10.859 716 HB2 PHE 94 2HB PHE 94 3.606 1.825 -11.683 717 HB3 PHE 94 1HB PHE 94 2.049 2.623 -11.460 718 HD1 PHE 94 1HD PHE 94 4.832 0.882 -9.721 719 HD2 PHE 94 2HD PHE 94 1.096 2.956 -9.208 720 HE1 PHE 94 1HE PHE 94 5.251 1.049 -7.290 721 HE2 PHE 94 2HE PHE 94 1.530 3.123 -6.773 722 HZ PHE 94 HZ PHE 94 3.608 2.172 -5.815 723 H THR 95 H THR 95 -0.343 0.557 -12.499 724 HA THR 95 HA THR 95 0.630 0.590 -15.314 725 HB THR 95 HB THR 95 -1.249 -0.945 -15.882 726 HG1 THR 95 1HG THR 95 -2.678 -1.277 -14.421 727 HG21 THR 95 3HG2 THR 95 -0.228 -2.995 -14.990 728 HG22 THR 95 1HG2 THR 95 0.630 -2.051 -13.773 729 HG23 THR 95 2HG2 THR 95 1.025 -1.855 -15.481 730 H HIS 96 H HIS 96 -0.749 1.631 -16.760 731 HA HIS 96 HA HIS 96 -3.141 3.016 -15.798 732 HB2 HIS 96 2HB HIS 96 -2.236 5.249 -16.411 733 HB3 HIS 96 1HB HIS 96 -1.346 4.532 -15.070 734 HD2 HIS 96 2HD HIS 96 -0.673 5.830 -18.642 735 HE1 HIS 96 1HE HIS 96 2.836 3.836 -17.400 736 HE2 HIS 96 2HE HIS 96 1.836 5.343 -19.182 737 H THR 97 H THR 97 -4.287 4.050 -17.545 738 HA THR 97 HA THR 97 -3.484 3.257 -20.302 739 HB THR 97 HB THR 97 -5.775 2.502 -20.743 740 HG1 THR 97 1HG THR 97 -6.307 3.869 -18.592 741 HG21 THR 97 3HG2 THR 97 -5.752 0.445 -19.412 742 HG22 THR 97 1HG2 THR 97 -4.666 1.187 -18.240 743 HG23 THR 97 2HG2 THR 97 -4.102 0.853 -19.879 744 H GLY 98 H GLY 98 -3.265 5.781 -18.973 745 HA2 GLY 98 2HA GLY 98 -3.589 7.996 -19.501 746 HA3 GLY 98 1HA GLY 98 -4.523 7.479 -20.902 747 H ASP 99 H ASP 99 -4.825 9.426 -18.427 748 HA ASP 99 HA ASP 99 -6.524 10.323 -17.190 749 HB2 ASP 99 2HB ASP 99 -8.291 8.870 -19.182 750 HB3 ASP 99 1HB ASP 99 -8.790 10.182 -18.120 751 H THR 100 H THR 100 -5.684 7.273 -17.005 752 HA THR 100 HA THR 100 -7.387 6.711 -14.678 753 HB THR 100 HB THR 100 -7.110 4.724 -16.968 754 HG1 THR 100 1HG THR 100 -8.657 5.921 -17.725 755 HG21 THR 100 3HG2 THR 100 -8.662 4.651 -14.352 756 HG22 THR 100 1HG2 THR 100 -7.311 3.605 -14.801 757 HG23 THR 100 2HG2 THR 100 -8.846 3.481 -15.657 758 H THR 101 H THR 101 -6.330 5.582 -13.123 759 HA THR 101 HA THR 101 -3.629 4.454 -13.716 760 HB THR 101 HB THR 101 -4.428 6.039 -11.243 761 HG1 THR 101 1HG THR 101 -3.297 6.710 -13.672 762 HG21 THR 101 3HG2 THR 101 -1.778 4.855 -12.151 763 HG22 THR 101 1HG2 THR 101 -2.719 4.347 -10.748 764 HG23 THR 101 2HG2 THR 101 -1.974 5.941 -10.778 765 H ASN 102 H ASN 102 -3.369 2.437 -13.033 766 HA ASN 102 HA ASN 102 -5.283 1.262 -11.057 767 HB2 ASN 102 2HB ASN 102 -3.948 -0.046 -13.451 768 HB3 ASN 102 1HB ASN 102 -4.990 -0.859 -12.283 769 HD21 ASN 102 1HD2 ASN 102 -5.167 0.163 -15.341 770 HD22 ASN 102 2HD2 ASN 102 -6.762 0.743 -15.404 771 H ILE 103 H ILE 103 -4.315 0.648 -9.241 772 HA ILE 103 HA ILE 103 -1.366 0.241 -9.159 773 HB ILE 103 HB ILE 103 -3.358 0.661 -6.898 774 HG12 ILE 103 2HG1 ILE 103 -1.354 2.674 -8.015 775 HG13 ILE 103 1HG1 ILE 103 -3.062 2.673 -8.450 776 HG21 ILE 103 1HG2 ILE 103 -1.271 1.094 -5.552 777 HG22 ILE 103 2HG2 ILE 103 -0.315 0.633 -6.956 778 HG23 ILE 103 3HG2 ILE 103 -1.349 -0.552 -6.165 779 HD11 ILE 103 3HD1 ILE 103 -1.945 2.997 -5.643 780 HD12 ILE 103 1HD1 ILE 103 -3.665 2.919 -6.047 781 HD13 ILE 103 2HD1 ILE 103 -2.677 4.265 -6.628 782 H VAL 104 H VAL 104 -0.624 -1.804 -8.900 783 HA VAL 104 HA VAL 104 -2.502 -3.957 -8.021 784 HB VAL 104 HB VAL 104 -0.104 -4.176 -9.884 785 HG11 VAL 104 1HG1 VAL 104 -2.256 -6.169 -9.072 786 HG12 VAL 104 2HG1 VAL 104 -0.548 -6.257 -8.644 787 HG13 VAL 104 3HG1 VAL 104 -1.045 -6.456 -10.321 788 HG21 VAL 104 3HG2 VAL 104 -1.817 -4.536 -11.657 789 HG22 VAL 104 1HG2 VAL 104 -1.938 -2.924 -10.952 790 HG23 VAL 104 2HG2 VAL 104 -3.086 -4.179 -10.486 791 H GLU 105 H GLU 105 -1.891 -5.061 -6.235 792 HA GLU 105 HA GLU 105 0.920 -4.844 -5.256 793 HB2 GLU 105 2HB GLU 105 -1.624 -4.690 -3.594 794 HB3 GLU 105 1HB GLU 105 0.028 -4.656 -2.976 795 HG2 GLU 105 2HG GLU 105 0.460 -2.574 -4.213 796 HG3 GLU 105 1HG GLU 105 -1.174 -2.610 -4.864 797 H SER 106 H SER 106 1.782 -6.752 -4.730 798 HA SER 106 HA SER 106 0.042 -9.171 -4.487 799 HB2 SER 106 2HB SER 106 1.421 -9.210 -6.528 800 HB3 SER 106 1HB SER 106 2.874 -8.953 -5.567 801 HG SER 106 HG SER 106 2.733 -11.115 -5.768 802 H PHE 107 H PHE 107 0.604 -10.677 -2.918 803 HA PHE 107 HA PHE 107 2.766 -10.012 -1.006 804 HB2 PHE 107 2HB PHE 107 -0.133 -10.455 -0.185 805 HB3 PHE 107 1HB PHE 107 1.239 -10.224 0.903 806 HD1 PHE 107 1HD PHE 107 2.411 -8.019 1.023 807 HD2 PHE 107 2HD PHE 107 -1.108 -8.558 -1.395 808 HE1 PHE 107 1HE PHE 107 2.158 -5.562 0.833 809 HE2 PHE 107 2HE PHE 107 -1.357 -6.104 -1.572 810 HZ PHE 107 HZ PHE 107 0.273 -4.606 -0.463 811 H ASP 108 H ASP 108 3.204 -11.791 0.459 812 HA ASP 108 HA ASP 108 2.174 -14.451 -0.408 813 HB2 ASP 108 2HB ASP 108 4.376 -14.010 -1.496 814 HB3 ASP 108 1HB ASP 108 5.098 -13.783 0.094 815 HA PRO 109 HA PRO 109 1.930 -13.766 4.222 816 HB2 PRO 109 2HB PRO 109 -0.421 -15.613 3.751 817 HB3 PRO 109 1HB PRO 109 -0.315 -14.174 4.793 818 HG2 PRO 109 2HG PRO 109 -1.609 -14.027 2.470 819 HG3 PRO 109 1HG PRO 109 -0.543 -12.692 2.974 820 HD2 PRO 109 2HD PRO 109 0.041 -14.900 0.972 821 HD3 PRO 109 1HD PRO 109 0.412 -13.163 0.857 822 H GLU 110 H GLU 110 2.057 -15.435 5.952 823 HA GLU 110 HA GLU 110 3.903 -17.490 5.295 824 HB2 GLU 110 2HB GLU 110 3.717 -16.379 7.533 825 HB3 GLU 110 1HB GLU 110 2.220 -17.255 7.808 826 HG2 GLU 110 2HG GLU 110 3.420 -19.401 7.606 827 HG3 GLU 110 1HG GLU 110 4.918 -18.536 7.283 828 H GLU 111 H GLU 111 3.626 -19.747 5.346 829 HA GLU 111 HA GLU 111 1.314 -20.716 3.979 830 HB2 GLU 111 2HB GLU 111 3.497 -22.239 5.434 831 HB3 GLU 111 1HB GLU 111 2.345 -22.950 4.303 832 HG2 GLU 111 2HG GLU 111 4.302 -20.728 3.594 833 HG3 GLU 111 1HG GLU 111 4.564 -22.432 3.243 834 H THR 112 H THR 112 2.404 -20.986 7.344 835 HA THR 112 HA THR 112 0.313 -22.657 8.266 836 HB THR 112 HB THR 112 0.971 -21.883 10.516 837 HG1 THR 112 1HG THR 112 1.437 -19.815 10.425 838 HG21 THR 112 3HG2 THR 112 3.342 -22.269 8.661 839 HG22 THR 112 1HG2 THR 112 2.385 -23.560 9.390 840 HG23 THR 112 2HG2 THR 112 3.356 -22.497 10.410 841 H ASN 113 H ASN 113 0.651 -19.106 8.165 842 HA ASN 113 HA ASN 113 -1.709 -18.501 9.579 843 HB2 ASN 113 2HB ASN 113 -0.173 -16.928 7.483 844 HB3 ASN 113 1HB ASN 113 -1.513 -16.251 8.403 845 HD21 ASN 113 1HD2 ASN 113 0.796 -18.546 9.836 846 HD22 ASN 113 2HD2 ASN 113 1.503 -17.423 10.894 847 HA PRO 114 HA PRO 114 -4.790 -19.479 6.452 848 HB2 PRO 114 2HB PRO 114 -6.940 -18.006 7.283 849 HB3 PRO 114 1HB PRO 114 -6.315 -19.356 8.264 850 HG2 PRO 114 2HG PRO 114 -5.691 -16.408 8.535 851 HG3 PRO 114 1HG PRO 114 -6.239 -17.540 9.798 852 HD2 PRO 114 2HD PRO 114 -3.599 -16.965 9.514 853 HD3 PRO 114 1HD PRO 114 -4.130 -18.616 9.925 854 H ARG 115 H ARG 115 -4.312 -18.756 4.447 855 HA ARG 115 HA ARG 115 -3.808 -16.047 3.729 856 HB2 ARG 115 2HB ARG 115 -3.871 -16.918 1.401 857 HB3 ARG 115 1HB ARG 115 -2.870 -17.907 2.458 858 HG2 ARG 115 2HG ARG 115 -4.739 -19.506 2.734 859 HG3 ARG 115 1HG ARG 115 -5.743 -18.528 1.666 860 HD2 ARG 115 2HD ARG 115 -3.111 -19.810 0.872 861 HD3 ARG 115 1HD ARG 115 -4.706 -20.442 0.470 862 HE ARG 115 HE ARG 115 -3.355 -18.255 -0.822 863 HH11 ARG 115 1HH2 ARG 115 -6.471 -19.513 0.052 864 HH12 ARG 115 2HH2 ARG 115 -7.306 -18.680 -1.216 865 HH21 ARG 115 1HH1 ARG 115 -4.460 -17.166 -2.470 866 HH22 ARG 115 2HH1 ARG 115 -6.172 -17.356 -2.638 867 H GLU 116 H GLU 116 -6.701 -17.946 3.919 868 HA GLU 116 HA GLU 116 -8.412 -16.604 2.171 869 HB2 GLU 116 2HB GLU 116 -9.025 -17.897 4.846 870 HB3 GLU 116 1HB GLU 116 -10.253 -17.418 3.676 871 HG2 GLU 116 2HG GLU 116 -9.839 -19.781 3.346 872 HG3 GLU 116 1HG GLU 116 -9.120 -18.938 1.982 873 H LEU 117 H LEU 117 -7.882 -15.946 5.645 874 HA LEU 117 HA LEU 117 -9.592 -13.664 5.749 875 HB2 LEU 117 2HB LEU 117 -7.260 -14.305 7.585 876 HB3 LEU 117 1HB LEU 117 -8.650 -13.287 7.951 877 HG LEU 117 HG LEU 117 -8.716 -16.286 7.414 878 HD11 LEU 117 1HD1 LEU 117 -9.222 -14.709 9.957 879 HD12 LEU 117 2HD1 LEU 117 -7.771 -15.653 9.621 880 HD13 LEU 117 3HD1 LEU 117 -9.332 -16.460 9.790 881 HD21 LEU 117 3HD2 LEU 117 -11.167 -15.965 8.299 882 HD22 LEU 117 1HD2 LEU 117 -10.826 -15.504 6.635 883 HD23 LEU 117 2HD2 LEU 117 -10.943 -14.265 7.885 884 H GLN 118 H GLN 118 -6.144 -14.059 5.110 885 HA GLN 118 HA GLN 118 -5.362 -11.355 5.239 886 HB2 GLN 118 2HB GLN 118 -4.312 -13.629 3.524 887 HB3 GLN 118 1HB GLN 118 -3.471 -12.093 3.749 888 HG2 GLN 118 2HG GLN 118 -4.257 -13.940 6.029 889 HG3 GLN 118 1HG GLN 118 -2.674 -13.954 5.271 890 HE21 GLN 118 1HE2 GLN 118 -3.965 -12.937 8.032 891 HE22 GLN 118 2HE2 GLN 118 -3.145 -11.469 8.263 892 H GLN 119 H GLN 119 -6.501 -13.302 2.461 893 HA GLN 119 HA GLN 119 -6.255 -11.371 0.482 894 HB2 GLN 119 2HB GLN 119 -6.901 -13.767 0.107 895 HB3 GLN 119 1HB GLN 119 -8.503 -13.400 0.732 896 HG2 GLN 119 2HG GLN 119 -8.842 -11.748 -1.083 897 HG3 GLN 119 1HG GLN 119 -7.227 -12.088 -1.693 898 HE21 GLN 119 1HE2 GLN 119 -9.652 -12.486 -3.232 899 HE22 GLN 119 2HE2 GLN 119 -9.788 -14.149 -3.539 900 H SER 120 H SER 120 -8.937 -11.935 2.721 901 HA SER 120 HA SER 120 -10.629 -9.868 1.750 902 HB2 SER 120 2HB SER 120 -11.446 -11.680 3.205 903 HB3 SER 120 1HB SER 120 -10.470 -11.058 4.532 904 HG SER 120 HG SER 120 -12.525 -10.208 4.719 905 H GLY 121 H GLY 121 -8.094 -9.946 4.264 906 HA2 GLY 121 2HA GLY 121 -8.533 -7.367 5.318 907 HA3 GLY 121 1HA GLY 121 -7.009 -8.246 5.373 908 H TRP 122 H TRP 122 -6.202 -8.420 2.817 909 HA TRP 122 HA TRP 122 -5.200 -5.830 2.246 910 HB2 TRP 122 2HB TRP 122 -5.295 -8.335 0.521 911 HB3 TRP 122 1HB TRP 122 -4.392 -6.882 0.095 912 HD1 TRP 122 HD TRP 122 -3.937 -10.079 1.889 913 HE1 TRP 122 1HE TRP 122 -1.816 -10.021 3.338 914 HE3 TRP 122 3HE TRP 122 -2.914 -5.076 1.762 915 HZ2 TRP 122 2HZ TRP 122 0.076 -8.111 4.316 916 HZ3 TRP 122 3HZ TRP 122 -0.945 -4.168 2.956 917 HH2 TRP 122 HH TRP 122 0.552 -5.677 4.231 918 H GLN 123 H GLN 123 -7.947 -7.637 0.969 919 HA GLN 123 HA GLN 123 -8.540 -5.751 -1.132 920 HB2 GLN 123 2HB GLN 123 -9.218 -8.171 -1.154 921 HB3 GLN 123 1HB GLN 123 -10.379 -7.818 0.123 922 HG2 GLN 123 2HG GLN 123 -11.490 -6.167 -1.356 923 HG3 GLN 123 1HG GLN 123 -10.328 -6.525 -2.626 924 HE21 GLN 123 1HE2 GLN 123 -11.128 -7.980 -4.134 925 HE22 GLN 123 2HE2 GLN 123 -12.268 -9.195 -3.807 926 H ALA 124 H ALA 124 -9.624 -6.251 2.203 927 HA ALA 124 HA ALA 124 -11.807 -4.493 2.248 928 HB1 ALA 124 1HB ALA 124 -11.315 -6.071 4.064 929 HB2 ALA 124 2HB ALA 124 -11.470 -4.433 4.691 930 HB3 ALA 124 3HB ALA 124 -9.870 -5.150 4.481 931 H ILE 125 H ILE 125 -8.404 -3.822 3.151 932 HA ILE 125 HA ILE 125 -8.807 -1.077 3.729 933 HB ILE 125 HB ILE 125 -6.870 -2.303 4.554 934 HG12 ILE 125 2HG1 ILE 125 -5.878 -0.194 2.577 935 HG13 ILE 125 1HG1 ILE 125 -6.672 0.201 4.091 936 HG21 ILE 125 1HG2 ILE 125 -5.079 -3.067 3.076 937 HG22 ILE 125 2HG2 ILE 125 -5.938 -2.462 1.671 938 HG23 ILE 125 3HG2 ILE 125 -6.595 -3.809 2.591 939 HD11 ILE 125 3HD1 ILE 125 -4.924 -1.026 5.324 940 HD12 ILE 125 1HD1 ILE 125 -4.240 0.277 4.357 941 HD13 ILE 125 2HD1 ILE 125 -4.114 -1.392 3.802 942 H LEU 126 H LEU 126 -7.927 -2.783 0.753 943 HA LEU 126 HA LEU 126 -7.409 -0.486 -0.837 944 HB2 LEU 126 2HB LEU 126 -8.179 -3.345 -1.449 945 HB3 LEU 126 1HB LEU 126 -8.015 -2.177 -2.754 946 HG LEU 126 HG LEU 126 -5.814 -2.805 -0.739 947 HD11 LEU 126 1HD1 LEU 126 -6.202 -3.782 -3.581 948 HD12 LEU 126 2HD1 LEU 126 -6.246 -4.765 -2.115 949 HD13 LEU 126 3HD1 LEU 126 -4.738 -4.008 -2.628 950 HD21 LEU 126 3HD2 LEU 126 -5.109 -0.745 -1.539 951 HD22 LEU 126 1HD2 LEU 126 -6.038 -0.849 -3.030 952 HD23 LEU 126 2HD2 LEU 126 -4.502 -1.700 -2.882 953 H ASN 127 H ASN 127 -10.391 -2.272 -0.101 954 HA ASN 127 HA ASN 127 -12.055 -0.964 -1.979 955 HB2 ASN 127 2HB ASN 127 -12.704 -2.217 0.707 956 HB3 ASN 127 1HB ASN 127 -13.926 -1.688 -0.450 957 HD21 ASN 127 1HD2 ASN 127 -13.533 -4.465 0.395 958 HD22 ASN 127 2HD2 ASN 127 -13.101 -5.338 -0.989 959 H SER 128 H SER 128 -11.139 -0.163 1.340 960 HA SER 128 HA SER 128 -12.822 2.160 1.561 961 HB2 SER 128 2HB SER 128 -11.998 0.946 3.538 962 HB3 SER 128 1HB SER 128 -10.347 1.408 3.136 963 HG SER 128 HG SER 128 -11.490 3.643 3.092 964 H PHE 129 H PHE 129 -9.543 1.573 0.409 965 HA PHE 129 HA PHE 129 -8.472 4.132 0.520 966 HB2 PHE 129 2HB PHE 129 -7.222 2.079 -0.147 967 HB3 PHE 129 1HB PHE 129 -8.052 2.100 -1.698 968 HD1 PHE 129 1HD PHE 129 -5.535 3.819 0.406 969 HD2 PHE 129 2HD PHE 129 -7.540 3.818 -3.401 970 HE1 PHE 129 1HE PHE 129 -3.889 5.449 -0.467 971 HE2 PHE 129 2HE PHE 129 -5.887 5.445 -4.266 972 HZ PHE 129 HZ PHE 129 -4.064 6.262 -2.803 973 H LYS 130 H LYS 130 -10.260 2.690 -2.227 974 HA LYS 130 HA LYS 130 -10.281 5.103 -3.779 975 HB2 LYS 130 2HB LYS 130 -11.782 3.904 -5.278 976 HB3 LYS 130 1HB LYS 130 -10.483 2.827 -4.775 977 HG2 LYS 130 2HG LYS 130 -12.002 1.861 -3.044 978 HG3 LYS 130 1HG LYS 130 -13.310 2.874 -3.645 979 HD2 LYS 130 2HD LYS 130 -13.031 1.796 -5.902 980 HD3 LYS 130 1HD LYS 130 -11.863 0.690 -5.177 981 HE2 LYS 130 2HE LYS 130 -13.605 -0.073 -3.572 982 HE3 LYS 130 1HE LYS 130 -14.761 1.012 -4.330 983 HZ1 LYS 130 3HZ LYS 130 -13.540 -0.535 -6.320 984 HZ2 LYS 130 1HZ LYS 130 -15.167 -0.520 -5.844 985 HZ3 LYS 130 2HZ LYS 130 -14.074 -1.579 -5.091 986 H SER 131 H SER 131 -12.522 3.618 -1.484 987 HA SER 131 HA SER 131 -14.826 5.081 -1.985 988 HB2 SER 131 2HB SER 131 -15.544 4.461 0.222 989 HB3 SER 131 1HB SER 131 -14.498 3.154 -0.331 990 HG SER 131 HG SER 131 -12.949 4.967 0.788 991 H TYR 132 H TYR 132 -11.952 5.989 -0.158 992 HA TYR 132 HA TYR 132 -12.957 8.350 1.032 993 HB2 TYR 132 2HB TYR 132 -10.847 7.266 1.721 994 HB3 TYR 132 1HB TYR 132 -10.123 7.685 0.170 995 HD1 TYR 132 2HD TYR 132 -11.605 9.110 3.287 996 HD2 TYR 132 1HD TYR 132 -9.273 9.940 -0.236 997 HE1 TYR 132 2HE TYR 132 -11.052 11.354 4.176 998 HE2 TYR 132 1HE TYR 132 -8.731 12.181 0.658 999 HH TYR 132 HH TYR 132 -9.480 13.098 3.919 1000 H THR 133 H THR 133 -11.185 7.820 -2.029 1001 HA THR 133 HA THR 133 -11.162 10.524 -2.867 1002 HB THR 133 HB THR 133 -10.596 9.611 -5.070 1003 HG1 THR 133 1HG THR 133 -12.066 7.874 -5.046 1004 HG21 THR 133 3HG2 THR 133 -9.321 8.035 -2.822 1005 HG22 THR 133 1HG2 THR 133 -8.848 9.659 -3.326 1006 HG23 THR 133 2HG2 THR 133 -8.626 8.294 -4.421 1007 H GLU 134 H GLU 134 -13.397 7.834 -3.537 1008 HA GLU 134 HA GLU 134 -15.087 9.263 -5.331 1009 HB2 GLU 134 2HB GLU 134 -15.629 6.846 -3.572 1010 HB3 GLU 134 1HB GLU 134 -16.739 7.433 -4.811 1011 HG2 GLU 134 2HG GLU 134 -15.014 7.091 -6.535 1012 HG3 GLU 134 1HG GLU 134 -13.883 6.530 -5.310 1013 H ASN 135 H ASN 135 -15.053 8.877 -1.808 1014 HA ASN 135 HA ASN 135 -17.597 9.981 -1.262 1015 HB2 ASN 135 2HB ASN 135 -16.251 8.752 0.411 1016 HB3 ASN 135 1HB ASN 135 -15.083 10.070 0.436 1017 HD21 ASN 135 1HD2 ASN 135 -15.472 10.739 2.628 1018 HD22 ASN 135 2HD2 ASN 135 -16.956 11.385 3.136 1019 H ASN 136 H ASN 136 -14.387 11.501 -1.548 1020 HA ASN 136 HA ASN 136 -15.250 14.146 -0.918 1021 HB2 ASN 136 2HB ASN 136 -12.869 13.222 -2.553 1022 HB3 ASN 136 1HB ASN 136 -13.090 14.835 -1.875 1023 HD21 ASN 136 1HD2 ASN 136 -11.042 12.623 -1.261 1024 HD22 ASN 136 2HD2 ASN 136 -11.134 12.440 0.423 1025 H LEU 137 H LEU 137 -14.828 12.394 -3.996 1026 HA LEU 137 HA LEU 137 -15.391 14.570 -5.705 1027 HB2 LEU 137 2HB LEU 137 -14.337 12.478 -6.489 1028 HB3 LEU 137 1HB LEU 137 -15.826 11.601 -6.173 1029 HG LEU 137 HG LEU 137 -17.001 12.984 -7.895 1030 HD11 LEU 137 1HD1 LEU 137 -14.295 14.357 -8.069 1031 HD12 LEU 137 2HD1 LEU 137 -15.902 15.078 -7.971 1032 HD13 LEU 137 3HD1 LEU 137 -15.373 14.336 -9.469 1033 HD21 LEU 137 3HD2 LEU 137 -15.876 12.018 -9.855 1034 HD22 LEU 137 1HD2 LEU 137 -15.927 10.850 -8.534 1035 HD23 LEU 137 2HD2 LEU 137 -14.432 11.717 -8.890 1036 H GLU 138 H GLU 138 -17.452 12.052 -4.309 1037 HA GLU 138 HA GLU 138 -19.780 13.733 -4.304 1038 HB2 GLU 138 2HB GLU 138 -21.106 12.380 -5.936 1039 HB3 GLU 138 1HB GLU 138 -19.772 13.244 -6.698 1040 HG2 GLU 138 2HG GLU 138 -18.392 11.187 -6.624 1041 HG3 GLU 138 1HG GLU 138 -19.727 10.314 -5.877 1042 H HIS 139 H HIS 139 -21.776 11.886 -4.235 1043 HA HIS 139 HA HIS 139 -22.830 10.481 -2.772 1044 HB2 HIS 139 2HB HIS 139 -21.449 8.844 -4.062 1045 HB3 HIS 139 1HB HIS 139 -20.182 8.994 -2.848 1046 HD2 HIS 139 2HD HIS 139 -23.690 7.309 -3.264 1047 HE1 HIS 139 1HE HIS 139 -22.226 6.285 0.562 1048 HE2 HIS 139 2HE HIS 139 -24.068 5.849 -1.131 1049 H HIS 140 H HIS 140 -22.693 12.328 -1.246 1050 HA HIS 140 HA HIS 140 -20.728 12.419 0.831 1051 HB2 HIS 140 2HB HIS 140 -23.565 13.508 0.791 1052 HB3 HIS 140 1HB HIS 140 -22.293 13.971 1.922 1053 HD2 HIS 140 2HD HIS 140 -23.516 14.920 -1.605 1054 HE1 HIS 140 1HE HIS 140 -19.719 16.704 -1.136 1055 HE2 HIS 140 2HE HIS 140 -21.792 16.611 -2.599 1056 H HIS 141 H HIS 141 -22.254 12.558 3.156 1057 HA HIS 141 HA HIS 141 -23.702 10.043 3.518 1058 HB2 HIS 141 2HB HIS 141 -21.308 9.376 3.722 1059 HB3 HIS 141 1HB HIS 141 -21.095 10.574 4.997 1060 HD2 HIS 141 2HD HIS 141 -21.752 9.629 7.525 1061 HE1 HIS 141 1HE HIS 141 -23.907 6.203 6.327 1062 HE2 HIS 141 2HE HIS 141 -23.016 7.489 8.326 1063 H HIS 142 H HIS 142 -22.061 12.722 5.226 1064 HA HIS 142 HA HIS 142 -22.723 14.038 6.995 1065 HB2 HIS 142 2HB HIS 142 -25.468 13.566 5.786 1066 HB3 HIS 142 1HB HIS 142 -25.039 14.861 6.903 1067 HD2 HIS 142 2HD HIS 142 -24.961 14.162 3.119 1068 HE1 HIS 142 1HE HIS 142 -22.604 17.608 3.746 1069 HE2 HIS 142 2HE HIS 142 -23.718 16.158 1.984 1070 H HIS 143 H HIS 143 -22.114 12.429 8.554 1071 HA HIS 143 HA HIS 143 -23.834 10.392 9.489 1072 HB2 HIS 143 2HB HIS 143 -21.379 10.495 9.937 1073 HB3 HIS 143 1HB HIS 143 -21.657 11.843 11.039 1074 HD2 HIS 143 2HD HIS 143 -21.993 7.958 10.995 1075 HE1 HIS 143 1HE HIS 143 -23.475 9.300 14.714 1076 HE2 HIS 143 2HE HIS 143 -22.836 7.248 13.362 1077 H HIS 144 H HIS 144 -23.335 13.740 10.561 1078 HA HIS 144 HA HIS 144 -26.009 13.988 11.557 1079 HB2 HIS 144 2HB HIS 144 -25.425 14.284 13.955 1080 HB3 HIS 144 1HB HIS 144 -25.120 12.638 13.403 1081 HD2 HIS 144 2HD HIS 144 -23.192 15.505 15.065 1082 HE1 HIS 144 1HE HIS 144 -20.278 12.806 13.631 1083 HE2 HIS 144 2HE HIS 144 -20.664 14.842 15.097 Start of MODEL 11 1 H1 GLY 1 1HT GLY 1 2.083 -18.366 1.427 2 H2 GLY 1 2HT GLY 1 2.238 -20.011 1.821 3 H3 GLY 1 3HT GLY 1 1.076 -19.511 0.687 4 HA2 GLY 1 2HA GLY 1 3.851 -18.822 0.115 5 HA3 GLY 1 1HA GLY 1 3.396 -20.519 -0.036 6 H ASN 2 H ASN 2 0.573 -19.032 -0.500 7 HA ASN 2 HA ASN 2 0.496 -19.482 -3.308 8 HB2 ASN 2 2HB ASN 2 -1.501 -19.595 -1.812 9 HB3 ASN 2 1HB ASN 2 -1.426 -17.847 -1.606 10 HD21 ASN 2 1HD2 ASN 2 -3.023 -16.914 -2.903 11 HD22 ASN 2 2HD2 ASN 2 -3.391 -17.396 -4.490 12 H LYS 3 H LYS 3 -0.265 -17.716 -4.832 13 HA LYS 3 HA LYS 3 1.457 -15.304 -4.555 14 HB2 LYS 3 2HB LYS 3 1.247 -15.221 -7.070 15 HB3 LYS 3 1HB LYS 3 2.069 -16.659 -6.468 16 HG2 LYS 3 2HG LYS 3 0.011 -17.980 -6.691 17 HG3 LYS 3 1HG LYS 3 -0.873 -16.559 -7.234 18 HD2 LYS 3 2HD LYS 3 0.627 -16.373 -9.193 19 HD3 LYS 3 1HD LYS 3 1.506 -17.803 -8.650 20 HE2 LYS 3 2HE LYS 3 -0.550 -19.151 -8.850 21 HE3 LYS 3 1HE LYS 3 -1.441 -17.722 -9.378 22 HZ1 LYS 3 3HZ LYS 3 -0.699 -19.093 -11.242 23 HZ2 LYS 3 1HZ LYS 3 0.916 -18.872 -10.768 24 HZ3 LYS 3 2HZ LYS 3 -0.007 -17.542 -11.285 25 H ILE 4 H ILE 4 -0.791 -15.014 -3.110 26 HA ILE 4 HA ILE 4 -3.157 -14.230 -4.331 27 HB ILE 4 HB ILE 4 -1.863 -12.965 -1.888 28 HG12 ILE 4 2HG1 ILE 4 -3.906 -15.238 -2.035 29 HG13 ILE 4 1HG1 ILE 4 -2.178 -15.505 -1.823 30 HG21 ILE 4 1HG2 ILE 4 -3.739 -11.583 -2.706 31 HG22 ILE 4 2HG2 ILE 4 -4.259 -12.436 -1.266 32 HG23 ILE 4 3HG2 ILE 4 -4.754 -13.012 -2.858 33 HD11 ILE 4 3HD1 ILE 4 -3.969 -13.937 0.052 34 HD12 ILE 4 1HD1 ILE 4 -2.230 -14.139 0.242 35 HD13 ILE 4 2HD1 ILE 4 -3.300 -15.538 0.344 36 H THR 5 H THR 5 -3.875 -12.415 -5.357 37 HA THR 5 HA THR 5 -2.054 -10.092 -5.682 38 HB THR 5 HB THR 5 -3.572 -11.434 -7.959 39 HG1 THR 5 1HG THR 5 -1.884 -12.629 -8.140 40 HG21 THR 5 3HG2 THR 5 -3.268 -9.014 -8.288 41 HG22 THR 5 1HG2 THR 5 -2.185 -9.902 -9.356 42 HG23 THR 5 2HG2 THR 5 -1.556 -9.155 -7.891 43 H VAL 6 H VAL 6 -3.068 -8.179 -5.674 44 HA VAL 6 HA VAL 6 -6.031 -8.035 -5.811 45 HB VAL 6 HB VAL 6 -5.988 -6.459 -3.869 46 HG11 VAL 6 1HG1 VAL 6 -5.785 -8.191 -2.128 47 HG12 VAL 6 2HG1 VAL 6 -4.915 -9.233 -3.255 48 HG13 VAL 6 3HG1 VAL 6 -6.607 -8.832 -3.553 49 HG21 VAL 6 3HG2 VAL 6 -3.977 -6.501 -2.373 50 HG22 VAL 6 1HG2 VAL 6 -3.617 -5.791 -3.945 51 HG23 VAL 6 2HG2 VAL 6 -3.118 -7.444 -3.586 52 H GLU 7 H GLU 7 -6.800 -5.930 -6.303 53 HA GLU 7 HA GLU 7 -4.867 -3.942 -7.277 54 HB2 GLU 7 2HB GLU 7 -5.975 -3.859 -9.509 55 HB3 GLU 7 1HB GLU 7 -5.166 -5.397 -9.218 56 HG2 GLU 7 2HG GLU 7 -7.324 -6.418 -8.566 57 HG3 GLU 7 1HG GLU 7 -8.145 -4.891 -8.877 58 H VAL 8 H VAL 8 -5.905 -1.917 -7.873 59 HA VAL 8 HA VAL 8 -8.682 -1.502 -6.993 60 HB VAL 8 HB VAL 8 -7.371 -1.226 -4.933 61 HG11 VAL 8 1HG1 VAL 8 -5.216 -0.653 -5.924 62 HG12 VAL 8 2HG1 VAL 8 -5.684 0.554 -4.733 63 HG13 VAL 8 3HG1 VAL 8 -5.842 0.910 -6.445 64 HG21 VAL 8 3HG2 VAL 8 -8.177 0.983 -4.301 65 HG22 VAL 8 1HG2 VAL 8 -9.359 0.253 -5.383 66 HG23 VAL 8 2HG2 VAL 8 -8.254 1.489 -5.986 67 H THR 9 H THR 9 -9.650 0.221 -8.019 68 HA THR 9 HA THR 9 -8.147 1.442 -10.254 69 HB THR 9 HB THR 9 -11.118 1.576 -9.580 70 HG1 THR 9 1HG THR 9 -10.635 0.113 -11.695 71 HG21 THR 9 3HG2 THR 9 -10.371 3.385 -11.083 72 HG22 THR 9 1HG2 THR 9 -11.325 2.202 -11.974 73 HG23 THR 9 2HG2 THR 9 -9.570 2.205 -12.118 74 H VAL 10 H VAL 10 -7.271 3.430 -9.976 75 HA VAL 10 HA VAL 10 -8.571 5.369 -8.104 76 HB VAL 10 HB VAL 10 -5.582 5.011 -8.570 77 HG11 VAL 10 1HG1 VAL 10 -7.172 6.777 -6.663 78 HG12 VAL 10 2HG1 VAL 10 -6.185 7.329 -8.015 79 HG13 VAL 10 3HG1 VAL 10 -5.422 6.582 -6.616 80 HG21 VAL 10 3HG2 VAL 10 -7.324 4.234 -6.196 81 HG22 VAL 10 1HG2 VAL 10 -5.561 4.153 -6.231 82 HG23 VAL 10 2HG2 VAL 10 -6.511 3.118 -7.294 83 H TYR 11 H TYR 11 -9.194 7.161 -9.129 84 HA TYR 11 HA TYR 11 -8.231 7.744 -11.866 85 HB2 TYR 11 2HB TYR 11 -10.477 8.980 -10.235 86 HB3 TYR 11 1HB TYR 11 -10.124 9.313 -11.930 87 HD1 TYR 11 1HD TYR 11 -11.437 6.798 -9.547 88 HD2 TYR 11 2HD TYR 11 -10.581 7.622 -13.684 89 HE1 TYR 11 1HE TYR 11 -12.781 4.828 -10.221 90 HE2 TYR 11 2HE TYR 11 -11.931 5.650 -14.348 91 HH TYR 11 HH TYR 11 -13.899 4.317 -13.268 92 H ALA 12 H ALA 12 -6.173 8.567 -11.378 93 HA ALA 12 HA ALA 12 -6.063 11.370 -10.817 94 HB1 ALA 12 1HB ALA 12 -4.939 9.500 -8.710 95 HB2 ALA 12 2HB ALA 12 -6.305 10.591 -8.494 96 HB3 ALA 12 3HB ALA 12 -4.689 11.244 -8.759 97 H ALA 13 H ALA 13 -3.966 12.242 -11.208 98 HA ALA 13 HA ALA 13 -2.445 10.856 -13.159 99 HB1 ALA 13 1HB ALA 13 -0.859 12.736 -12.928 100 HB2 ALA 13 2HB ALA 13 -1.688 13.252 -11.457 101 HB3 ALA 13 3HB ALA 13 -2.524 13.313 -13.008 102 H ILE 14 H ILE 14 -0.696 9.512 -12.970 103 HA ILE 14 HA ILE 14 -0.130 8.162 -10.629 104 HB ILE 14 HB ILE 14 0.515 7.329 -12.853 105 HG12 ILE 14 2HG1 ILE 14 2.772 6.456 -12.359 106 HG13 ILE 14 1HG1 ILE 14 2.999 7.659 -11.109 107 HG21 ILE 14 1HG2 ILE 14 2.418 8.259 -14.075 108 HG22 ILE 14 2HG2 ILE 14 2.711 9.440 -12.802 109 HG23 ILE 14 3HG2 ILE 14 1.245 9.542 -13.780 110 HD11 ILE 14 3HD1 ILE 14 1.409 6.633 -9.684 111 HD12 ILE 14 1HD1 ILE 14 2.330 5.312 -10.370 112 HD13 ILE 14 2HD1 ILE 14 0.724 5.665 -10.999 113 H GLU 15 H GLU 15 1.303 11.133 -11.850 114 HA GLU 15 HA GLU 15 3.540 11.304 -10.166 115 HB2 GLU 15 2HB GLU 15 3.100 12.748 -12.162 116 HB3 GLU 15 1HB GLU 15 1.840 13.580 -11.256 117 HG2 GLU 15 2HG GLU 15 3.507 14.312 -9.587 118 HG3 GLU 15 1HG GLU 15 4.770 13.442 -10.451 119 H LYS 16 H LYS 16 0.158 12.306 -9.693 120 HA LYS 16 HA LYS 16 0.626 13.554 -7.143 121 HB2 LYS 16 2HB LYS 16 -1.306 14.102 -8.640 122 HB3 LYS 16 1HB LYS 16 -1.986 12.511 -8.304 123 HG2 LYS 16 2HG LYS 16 -2.115 13.054 -5.898 124 HG3 LYS 16 1HG LYS 16 -1.373 14.625 -6.201 125 HD2 LYS 16 2HD LYS 16 -3.294 15.240 -7.645 126 HD3 LYS 16 1HD LYS 16 -4.035 13.674 -7.316 127 HE2 LYS 16 2HE LYS 16 -4.120 14.209 -4.907 128 HE3 LYS 16 1HE LYS 16 -3.362 15.771 -5.222 129 HZ1 LYS 16 3HZ LYS 16 -6.081 14.884 -5.752 130 HZ2 LYS 16 1HZ LYS 16 -5.377 15.894 -6.920 131 HZ3 LYS 16 2HZ LYS 16 -5.500 16.417 -5.308 132 H VAL 17 H VAL 17 -0.689 10.402 -8.181 133 HA VAL 17 HA VAL 17 -1.245 9.396 -5.601 134 HB VAL 17 HB VAL 17 -0.522 7.841 -8.107 135 HG11 VAL 17 1HG1 VAL 17 -1.915 6.043 -7.017 136 HG12 VAL 17 2HG1 VAL 17 -1.984 7.030 -5.558 137 HG13 VAL 17 3HG1 VAL 17 -0.439 6.395 -6.123 138 HG21 VAL 17 3HG2 VAL 17 -2.397 9.404 -8.468 139 HG22 VAL 17 1HG2 VAL 17 -3.210 8.774 -7.035 140 HG23 VAL 17 2HG2 VAL 17 -2.976 7.740 -8.446 141 H TRP 18 H TRP 18 1.673 9.206 -7.620 142 HA TRP 18 HA TRP 18 3.142 7.403 -6.079 143 HB2 TRP 18 2HB TRP 18 3.831 8.219 -8.322 144 HB3 TRP 18 1HB TRP 18 4.182 9.802 -7.632 145 HD1 TRP 18 HD TRP 18 6.176 9.886 -5.765 146 HE1 TRP 18 1HE TRP 18 8.288 8.424 -5.529 147 HE3 TRP 18 3HE TRP 18 4.848 5.950 -8.722 148 HZ2 TRP 18 2HZ TRP 18 9.279 5.913 -6.475 149 HZ3 TRP 18 3HZ TRP 18 6.389 4.041 -9.044 150 HH2 TRP 18 HH TRP 18 8.598 4.014 -7.917 151 H LYS 19 H LYS 19 2.899 10.938 -5.801 152 HA LYS 19 HA LYS 19 4.730 11.206 -3.625 153 HB2 LYS 19 2HB LYS 19 2.456 12.978 -4.584 154 HB3 LYS 19 1HB LYS 19 3.578 13.445 -3.305 155 HG2 LYS 19 2HG LYS 19 5.475 13.190 -4.859 156 HG3 LYS 19 1HG LYS 19 4.365 12.721 -6.146 157 HD2 LYS 19 2HD LYS 19 3.260 14.911 -6.042 158 HD3 LYS 19 1HD LYS 19 4.288 15.389 -4.688 159 HE2 LYS 19 2HE LYS 19 5.124 16.305 -6.839 160 HE3 LYS 19 1HE LYS 19 6.285 15.195 -6.107 161 HZ1 LYS 19 3HZ LYS 19 5.395 15.027 -8.636 162 HZ2 LYS 19 1HZ LYS 19 4.361 13.937 -7.850 163 HZ3 LYS 19 2HZ LYS 19 6.045 13.728 -7.754 164 H TYR 20 H TYR 20 1.172 10.881 -3.755 165 HA TYR 20 HA TYR 20 0.765 11.083 -0.945 166 HB2 TYR 20 2HB TYR 20 -0.859 10.162 -3.306 167 HB3 TYR 20 1HB TYR 20 -1.451 9.746 -1.703 168 HD1 TYR 20 1HD TYR 20 0.138 12.752 -3.348 169 HD2 TYR 20 2HD TYR 20 -3.068 11.317 -0.864 170 HE1 TYR 20 1HE TYR 20 -0.709 15.058 -3.108 171 HE2 TYR 20 2HE TYR 20 -3.906 13.632 -0.628 172 HH TYR 20 HH TYR 20 -3.039 16.116 -2.589 173 H TRP 21 H TRP 21 1.210 8.293 -3.083 174 HA TRP 21 HA TRP 21 0.804 6.317 -1.076 175 HB2 TRP 21 2HB TRP 21 0.610 5.965 -3.566 176 HB3 TRP 21 1HB TRP 21 2.366 6.042 -3.678 177 HD1 TRP 21 HD TRP 21 3.625 3.803 -3.222 178 HE1 TRP 21 1HE TRP 21 2.955 1.502 -2.278 179 HE3 TRP 21 3HE TRP 21 -1.149 4.825 -1.775 180 HZ2 TRP 21 2HZ TRP 21 0.676 0.260 -1.062 181 HZ3 TRP 21 3HZ TRP 21 -2.553 3.076 -0.730 182 HH2 TRP 21 HH TRP 21 -1.649 0.794 -0.375 183 H ASN 22 H ASN 22 3.496 8.333 -1.867 184 HA ASN 22 HA ASN 22 5.447 6.636 -0.397 185 HB2 ASN 22 2HB ASN 22 5.823 9.055 -2.190 186 HB3 ASN 22 1HB ASN 22 7.132 8.176 -1.400 187 HD21 ASN 22 1HD2 ASN 22 4.276 6.554 -2.832 188 HD22 ASN 22 2HD2 ASN 22 5.148 5.807 -4.079 189 H GLU 23 H GLU 23 3.827 9.771 -0.328 190 HA GLU 23 HA GLU 23 5.398 11.211 1.433 191 HB2 GLU 23 2HB GLU 23 2.524 11.265 0.687 192 HB3 GLU 23 1HB GLU 23 2.881 12.039 2.219 193 HG2 GLU 23 2HG GLU 23 4.498 13.529 1.166 194 HG3 GLU 23 1HG GLU 23 4.341 12.696 -0.369 195 HA PRO 24 HA PRO 24 5.141 8.152 4.891 196 HB2 PRO 24 2HB PRO 24 6.624 10.382 6.321 197 HB3 PRO 24 1HB PRO 24 6.974 8.637 6.305 198 HG2 PRO 24 2HG PRO 24 8.466 10.280 4.850 199 HG3 PRO 24 1HG PRO 24 7.933 8.737 4.156 200 HD2 PRO 24 2HD PRO 24 6.810 11.494 3.636 201 HD3 PRO 24 1HD PRO 24 7.130 10.166 2.496 202 H ALA 25 H ALA 25 4.660 11.640 5.384 203 HA ALA 25 HA ALA 25 3.101 11.515 7.711 204 HB1 ALA 25 1HB ALA 25 4.140 13.580 6.852 205 HB2 ALA 25 2HB ALA 25 2.417 13.799 7.163 206 HB3 ALA 25 3HB ALA 25 2.996 13.593 5.511 207 H HIS 26 H HIS 26 2.227 11.185 4.319 208 HA HIS 26 HA HIS 26 -0.621 11.336 4.739 209 HB2 HIS 26 2HB HIS 26 0.464 11.844 2.557 210 HB3 HIS 26 1HB HIS 26 0.881 10.141 2.383 211 HD2 HIS 26 2HD HIS 26 -1.150 8.650 1.201 212 HE1 HIS 26 1HE HIS 26 -4.309 11.383 1.806 213 HE2 HIS 26 2HE HIS 26 -3.674 9.156 0.767 214 H ILE 27 H ILE 27 1.707 8.625 4.510 215 HA ILE 27 HA ILE 27 -0.195 6.542 4.334 216 HB ILE 27 HB ILE 27 2.607 6.565 5.527 217 HG12 ILE 27 2HG1 ILE 27 1.606 5.597 2.807 218 HG13 ILE 27 1HG1 ILE 27 2.343 7.173 3.072 219 HG21 ILE 27 1HG2 ILE 27 2.529 4.052 5.127 220 HG22 ILE 27 2HG2 ILE 27 0.807 4.208 4.808 221 HG23 ILE 27 3HG2 ILE 27 1.444 4.585 6.405 222 HD11 ILE 27 3HD1 ILE 27 3.657 4.470 3.486 223 HD12 ILE 27 1HD1 ILE 27 4.400 6.006 3.934 224 HD13 ILE 27 2HD1 ILE 27 4.047 5.656 2.240 225 H MET 28 H MET 28 1.289 8.051 7.201 226 HA MET 28 HA MET 28 0.014 6.372 9.126 227 HB2 MET 28 2HB MET 28 0.689 8.170 10.751 228 HB3 MET 28 1HB MET 28 2.014 7.615 9.730 229 HG2 MET 28 2HG MET 28 1.789 9.551 8.284 230 HG3 MET 28 1HG MET 28 0.346 10.089 9.128 231 HE1 MET 28 3HE MET 28 3.970 9.157 9.295 232 HE2 MET 28 1HE MET 28 3.810 8.717 11.000 233 HE3 MET 28 2HE MET 28 4.688 10.169 10.543 234 H LYS 29 H LYS 29 -1.066 9.176 7.348 235 HA LYS 29 HA LYS 29 -3.074 10.133 9.069 236 HB2 LYS 29 2HB LYS 29 -2.162 11.264 7.020 237 HB3 LYS 29 1HB LYS 29 -3.119 10.166 6.035 238 HG2 LYS 29 2HG LYS 29 -5.188 10.977 7.250 239 HG3 LYS 29 1HG LYS 29 -4.181 12.170 8.061 240 HD2 LYS 29 2HD LYS 29 -4.543 11.927 5.060 241 HD3 LYS 29 1HD LYS 29 -5.360 13.100 6.082 242 HE2 LYS 29 2HE LYS 29 -2.987 13.896 6.783 243 HE3 LYS 29 1HE LYS 29 -2.410 12.985 5.383 244 HZ1 LYS 29 3HZ LYS 29 -3.112 14.564 4.041 245 HZ2 LYS 29 1HZ LYS 29 -3.475 15.519 5.394 246 HZ3 LYS 29 2HZ LYS 29 -4.676 14.532 4.706 247 H TRP 30 H TRP 30 -3.220 7.733 6.459 248 HA TRP 30 HA TRP 30 -5.973 6.943 7.303 249 HB2 TRP 30 2HB TRP 30 -6.143 5.903 5.023 250 HB3 TRP 30 1HB TRP 30 -5.956 7.655 4.987 251 HD1 TRP 30 HD TRP 30 -3.641 8.639 4.141 252 HE1 TRP 30 1HE TRP 30 -1.737 7.609 2.742 253 HE3 TRP 30 3HE TRP 30 -4.837 3.705 4.560 254 HZ2 TRP 30 2HZ TRP 30 -0.856 5.025 1.877 255 HZ3 TRP 30 3HZ TRP 30 -3.474 1.979 3.418 256 HH2 TRP 30 HH TRP 30 -1.477 2.627 2.087 257 H CYS 31 H CYS 31 -2.697 5.968 7.465 258 HA CYS 31 HA CYS 31 -1.722 3.881 7.602 259 HB2 CYS 31 2HB CYS 31 -2.257 3.010 9.806 260 HB3 CYS 31 1HB CYS 31 -2.255 4.782 9.824 261 HG CYS 31 HG CYS 31 -4.500 4.450 10.848 262 H GLN 32 H GLN 32 -3.625 1.876 9.155 263 HA GLN 32 HA GLN 32 -3.980 0.134 6.914 264 HB2 GLN 32 2HB GLN 32 -3.416 -0.516 9.378 265 HB3 GLN 32 1HB GLN 32 -5.134 -0.317 9.694 266 HG2 GLN 32 2HG GLN 32 -4.764 -2.666 9.207 267 HG3 GLN 32 1HG GLN 32 -5.585 -1.974 7.815 268 HE21 GLN 32 1HE2 GLN 32 -4.706 -3.055 6.011 269 HE22 GLN 32 2HE2 GLN 32 -3.043 -3.240 5.724 270 H ALA 33 H ALA 33 -5.601 2.720 8.062 271 HA ALA 33 HA ALA 33 -7.638 3.680 7.665 272 HB1 ALA 33 1HB ALA 33 -8.750 3.140 5.640 273 HB2 ALA 33 2HB ALA 33 -8.309 1.437 5.742 274 HB3 ALA 33 3HB ALA 33 -7.087 2.639 5.323 275 H SER 34 H SER 34 -7.275 1.741 9.799 276 HA SER 34 HA SER 34 -10.103 0.893 10.161 277 HB2 SER 34 2HB SER 34 -7.611 -0.660 10.889 278 HB3 SER 34 1HB SER 34 -9.248 -1.121 11.349 279 HG SER 34 HG SER 34 -8.063 -1.794 9.178 280 HA PRO 35 HA PRO 35 -9.489 3.231 13.982 281 HB2 PRO 35 2HB PRO 35 -11.713 2.550 15.418 282 HB3 PRO 35 1HB PRO 35 -11.834 3.522 13.932 283 HG2 PRO 35 2HG PRO 35 -12.204 0.543 14.252 284 HG3 PRO 35 1HG PRO 35 -13.274 1.710 13.439 285 HD2 PRO 35 2HD PRO 35 -11.496 0.204 12.015 286 HD3 PRO 35 1HD PRO 35 -11.861 1.886 11.545 287 H GLU 36 H GLU 36 -9.369 -0.182 13.811 288 HA GLU 36 HA GLU 36 -8.939 -0.724 16.638 289 HB2 GLU 36 2HB GLU 36 -9.908 -2.389 15.045 290 HB3 GLU 36 1HB GLU 36 -8.358 -2.467 14.214 291 HG2 GLU 36 2HG GLU 36 -7.269 -3.280 16.273 292 HG3 GLU 36 1HG GLU 36 -8.786 -3.132 17.153 293 H TRP 37 H TRP 37 -7.007 0.183 13.890 294 HA TRP 37 HA TRP 37 -4.493 -0.080 15.481 295 HB2 TRP 37 2HB TRP 37 -4.908 -0.419 12.488 296 HB3 TRP 37 1HB TRP 37 -3.324 -0.330 13.267 297 HD1 TRP 37 HD TRP 37 -6.314 -2.645 12.837 298 HE1 TRP 37 1HE TRP 37 -5.709 -4.974 13.749 299 HE3 TRP 37 3HE TRP 37 -1.834 -1.583 15.037 300 HZ2 TRP 37 2HZ TRP 37 -3.600 -6.225 15.235 301 HZ3 TRP 37 3HZ TRP 37 -0.551 -3.359 16.198 302 HH2 TRP 37 HH TRP 37 -1.428 -5.675 16.297 303 H HIS 38 H HIS 38 -3.015 1.549 15.346 304 HA HIS 38 HA HIS 38 -3.714 4.030 13.883 305 HB2 HIS 38 2HB HIS 38 -4.606 4.183 16.241 306 HB3 HIS 38 1HB HIS 38 -2.964 3.956 16.842 307 HD2 HIS 38 2HD HIS 38 -4.939 6.636 14.678 308 HE1 HIS 38 1HE HIS 38 -1.446 8.439 16.213 309 HE2 HIS 38 2HE HIS 38 -3.565 8.846 14.877 310 H VAL 39 H VAL 39 -1.835 5.532 13.825 311 HA VAL 39 HA VAL 39 0.804 4.139 13.993 312 HB VAL 39 HB VAL 39 -0.191 6.046 11.859 313 HG11 VAL 39 1HG1 VAL 39 1.987 5.409 10.729 314 HG12 VAL 39 2HG1 VAL 39 2.475 4.615 12.222 315 HG13 VAL 39 3HG1 VAL 39 2.218 6.360 12.197 316 HG21 VAL 39 3HG2 VAL 39 0.464 3.076 11.776 317 HG22 VAL 39 1HG2 VAL 39 -0.030 4.053 10.393 318 HG23 VAL 39 2HG2 VAL 39 -1.154 3.764 11.726 319 HA PRO 40 HA PRO 40 0.985 8.119 16.393 320 HB2 PRO 40 2HB PRO 40 2.498 7.296 18.518 321 HB3 PRO 40 1HB PRO 40 0.760 6.940 18.415 322 HG2 PRO 40 2HG PRO 40 3.091 5.143 17.785 323 HG3 PRO 40 1HG PRO 40 1.585 4.755 18.642 324 HD2 PRO 40 2HD PRO 40 2.013 4.164 15.967 325 HD3 PRO 40 1HD PRO 40 0.389 4.414 16.651 326 H ALA 41 H ALA 41 3.252 6.127 14.837 327 HA ALA 41 HA ALA 41 4.963 8.339 14.195 328 HB1 ALA 41 1HB ALA 41 6.097 6.184 16.008 329 HB2 ALA 41 2HB ALA 41 5.822 7.865 16.459 330 HB3 ALA 41 3HB ALA 41 7.025 7.467 15.232 331 H ALA 42 H ALA 42 6.403 7.844 12.533 332 HA ALA 42 HA ALA 42 6.866 5.169 11.618 333 HB1 ALA 42 1HB ALA 42 5.046 6.905 9.925 334 HB2 ALA 42 2HB ALA 42 4.542 5.468 10.810 335 HB3 ALA 42 3HB ALA 42 5.687 5.327 9.476 336 H GLN 43 H GLN 43 8.398 5.062 9.963 337 HA GLN 43 HA GLN 43 9.614 7.595 9.010 338 HB2 GLN 43 2HB GLN 43 11.106 5.320 10.374 339 HB3 GLN 43 1HB GLN 43 11.874 6.677 9.546 340 HG2 GLN 43 2HG GLN 43 10.757 8.248 11.119 341 HG3 GLN 43 1HG GLN 43 10.040 6.877 11.960 342 HE21 GLN 43 1HE2 GLN 43 12.676 8.968 12.046 343 HE22 GLN 43 2HE2 GLN 43 13.726 8.014 12.978 344 H ASN 44 H ASN 44 10.588 7.430 7.045 345 HA ASN 44 HA ASN 44 11.104 4.936 5.702 346 HB2 ASN 44 2HB ASN 44 8.638 5.027 5.490 347 HB3 ASN 44 1HB ASN 44 8.768 6.603 4.735 348 HD21 ASN 44 1HD2 ASN 44 7.719 5.606 2.787 349 HD22 ASN 44 2HD2 ASN 44 8.657 4.670 1.726 350 H ASP 45 H ASP 45 12.585 5.259 4.140 351 HA ASP 45 HA ASP 45 13.153 8.031 3.170 352 HB2 ASP 45 2HB ASP 45 15.123 5.834 3.905 353 HB3 ASP 45 1HB ASP 45 15.548 7.385 3.186 354 H LEU 46 H LEU 46 12.130 7.792 1.190 355 HA LEU 46 HA LEU 46 12.231 5.458 -0.409 356 HB2 LEU 46 2HB LEU 46 10.532 7.255 -0.666 357 HB3 LEU 46 1HB LEU 46 11.780 8.341 -1.254 358 HG LEU 46 HG LEU 46 12.197 6.729 -3.170 359 HD11 LEU 46 1HD1 LEU 46 11.391 4.606 -2.449 360 HD12 LEU 46 2HD1 LEU 46 10.186 5.113 -3.616 361 HD13 LEU 46 3HD1 LEU 46 9.859 5.267 -1.894 362 HD21 LEU 46 3HD2 LEU 46 10.139 7.352 -4.419 363 HD22 LEU 46 1HD2 LEU 46 10.804 8.704 -3.499 364 HD23 LEU 46 2HD2 LEU 46 9.390 7.841 -2.899 365 H LYS 47 H LYS 47 14.366 4.730 -0.669 366 HA LYS 47 HA LYS 47 15.841 5.931 -2.808 367 HB2 LYS 47 2HB LYS 47 16.485 7.436 -0.898 368 HB3 LYS 47 1HB LYS 47 17.136 6.037 -0.051 369 HG2 LYS 47 2HG LYS 47 18.735 5.646 -1.891 370 HG3 LYS 47 1HG LYS 47 18.054 7.007 -2.783 371 HD2 LYS 47 2HD LYS 47 18.720 8.534 -0.952 372 HD3 LYS 47 1HD LYS 47 19.412 7.172 -0.072 373 HE2 LYS 47 2HE LYS 47 20.990 6.767 -1.930 374 HE3 LYS 47 1HE LYS 47 20.297 8.125 -2.816 375 HZ1 LYS 47 3HZ LYS 47 21.786 8.195 -0.259 376 HZ2 LYS 47 1HZ LYS 47 20.877 9.510 -0.822 377 HZ3 LYS 47 2HZ LYS 47 22.197 8.942 -1.728 378 H ALA 48 H ALA 48 17.215 4.444 -3.714 379 HA ALA 48 HA ALA 48 16.914 1.722 -3.096 380 HB1 ALA 48 1HB ALA 48 18.750 1.364 -4.693 381 HB2 ALA 48 2HB ALA 48 19.156 3.081 -4.623 382 HB3 ALA 48 3HB ALA 48 17.615 2.565 -5.309 383 H GLY 49 H GLY 49 18.066 0.314 -1.824 384 HA2 GLY 49 2HA GLY 49 19.667 -0.483 -0.357 385 HA3 GLY 49 1HA GLY 49 20.669 0.916 -0.724 386 H GLY 50 H GLY 50 17.687 2.097 -0.006 387 HA2 GLY 50 2HA GLY 50 18.480 2.971 2.683 388 HA3 GLY 50 1HA GLY 50 17.091 3.526 1.751 389 H THR 51 H THR 51 16.723 2.941 4.384 390 HA THR 51 HA THR 51 15.066 0.460 4.330 391 HB THR 51 HB THR 51 16.975 -0.078 5.712 392 HG1 THR 51 1HG THR 51 15.027 -0.691 6.605 393 HG21 THR 51 3HG2 THR 51 17.833 2.196 6.090 394 HG22 THR 51 1HG2 THR 51 17.634 1.351 7.623 395 HG23 THR 51 2HG2 THR 51 16.455 2.560 7.126 396 H PHE 52 H PHE 52 13.434 0.483 6.075 397 HA PHE 52 HA PHE 52 12.439 3.182 6.810 398 HB2 PHE 52 2HB PHE 52 10.203 2.657 5.993 399 HB3 PHE 52 1HB PHE 52 11.351 2.512 4.665 400 HD1 PHE 52 1HD PHE 52 9.157 0.644 6.992 401 HD2 PHE 52 2HD PHE 52 11.950 0.287 3.734 402 HE1 PHE 52 1HE PHE 52 8.465 -1.715 6.659 403 HE2 PHE 52 2HE PHE 52 11.250 -2.067 3.403 404 HZ PHE 52 HZ PHE 52 9.511 -3.067 4.861 405 H THR 53 H THR 53 10.620 3.024 8.354 406 HA THR 53 HA THR 53 10.322 0.554 9.878 407 HB THR 53 HB THR 53 11.489 3.025 11.234 408 HG1 THR 53 1HG THR 53 12.654 0.631 10.297 409 HG21 THR 53 3HG2 THR 53 11.789 1.465 13.138 410 HG22 THR 53 1HG2 THR 53 11.005 0.189 12.211 411 HG23 THR 53 2HG2 THR 53 10.089 1.614 12.700 412 H THR 54 H THR 54 8.187 0.469 10.220 413 HA THR 54 HA THR 54 6.643 2.975 10.724 414 HB THR 54 HB THR 54 5.597 0.394 9.494 415 HG1 THR 54 1HG THR 54 5.515 1.979 7.633 416 HG21 THR 54 3HG2 THR 54 4.428 3.190 9.660 417 HG22 THR 54 1HG2 THR 54 3.904 1.818 10.632 418 HG23 THR 54 2HG2 THR 54 3.669 1.801 8.888 419 H THR 55 H THR 55 5.905 3.116 12.775 420 HA THR 55 HA THR 55 5.826 0.707 14.484 421 HB THR 55 HB THR 55 5.381 3.644 15.195 422 HG1 THR 55 1HG THR 55 7.568 3.329 16.034 423 HG21 THR 55 3HG2 THR 55 4.455 2.076 16.858 424 HG22 THR 55 1HG2 THR 55 5.905 2.850 17.491 425 HG23 THR 55 2HG2 THR 55 5.981 1.194 16.893 426 H MET 56 H MET 56 3.938 -0.388 14.545 427 HA MET 56 HA MET 56 1.349 1.089 14.311 428 HB2 MET 56 2HB MET 56 2.025 -1.730 13.389 429 HB3 MET 56 1HB MET 56 0.447 -0.952 13.277 430 HG2 MET 56 2HG MET 56 1.477 0.833 11.839 431 HG3 MET 56 1HG MET 56 2.994 -0.059 11.896 432 HE1 MET 56 3HE MET 56 -0.835 -0.519 11.246 433 HE2 MET 56 1HE MET 56 -0.820 -1.078 9.569 434 HE3 MET 56 2HE MET 56 -0.201 0.520 9.974 435 H ALA 57 H ALA 57 0.138 0.955 16.097 436 HA ALA 57 HA ALA 57 0.356 -1.408 17.881 437 HB1 ALA 57 1HB ALA 57 0.346 1.483 18.778 438 HB2 ALA 57 2HB ALA 57 1.732 0.393 18.837 439 HB3 ALA 57 3HB ALA 57 0.313 0.070 19.835 440 H ALA 58 H ALA 58 -1.519 -2.115 18.677 441 HA ALA 58 HA ALA 58 -3.974 -1.270 17.500 442 HB1 ALA 58 1HB ALA 58 -3.508 -3.037 19.912 443 HB2 ALA 58 2HB ALA 58 -3.597 -3.579 18.236 444 HB3 ALA 58 3HB ALA 58 -5.022 -2.890 19.014 445 H LYS 59 H LYS 59 -5.758 -0.179 18.479 446 HA LYS 59 HA LYS 59 -5.134 2.047 20.024 447 HB2 LYS 59 2HB LYS 59 -7.139 1.785 18.558 448 HB3 LYS 59 1HB LYS 59 -7.831 0.671 19.736 449 HG2 LYS 59 2HG LYS 59 -7.799 2.447 21.445 450 HG3 LYS 59 1HG LYS 59 -7.069 3.553 20.285 451 HD2 LYS 59 2HD LYS 59 -9.071 3.351 18.841 452 HD3 LYS 59 1HD LYS 59 -9.799 2.251 20.013 453 HE2 LYS 59 2HE LYS 59 -9.736 4.027 21.728 454 HE3 LYS 59 1HE LYS 59 -8.994 5.129 20.568 455 HZ1 LYS 59 3HZ LYS 59 -11.650 4.844 20.984 456 HZ2 LYS 59 1HZ LYS 59 -11.401 3.897 19.600 457 HZ3 LYS 59 2HZ LYS 59 -10.941 5.531 19.603 458 H ASP 60 H ASP 60 -6.376 -1.141 20.970 459 HA ASP 60 HA ASP 60 -6.695 -0.479 23.771 460 HB2 ASP 60 2HB ASP 60 -6.586 -3.150 22.332 461 HB3 ASP 60 1HB ASP 60 -7.065 -2.922 24.015 462 H GLY 61 H GLY 61 -4.038 -1.092 21.782 463 HA2 GLY 61 2HA GLY 61 -1.806 -1.433 22.201 464 HA3 GLY 61 1HA GLY 61 -2.144 -0.975 23.868 465 H SER 62 H SER 62 -3.897 -3.640 22.501 466 HA SER 62 HA SER 62 -2.780 -5.499 24.441 467 HB2 SER 62 2HB SER 62 -4.467 -7.037 23.571 468 HB3 SER 62 1HB SER 62 -5.196 -5.461 23.870 469 HG SER 62 HG SER 62 -5.298 -6.777 21.665 470 H MET 63 H MET 63 -1.986 -4.512 21.308 471 HA MET 63 HA MET 63 0.065 -6.526 21.045 472 HB2 MET 63 2HB MET 63 -1.973 -7.756 20.216 473 HB3 MET 63 1HB MET 63 -2.160 -6.537 18.959 474 HG2 MET 63 2HG MET 63 0.070 -7.108 18.056 475 HG3 MET 63 1HG MET 63 0.298 -8.290 19.344 476 HE1 MET 63 3HE MET 63 -0.108 -10.478 16.205 477 HE2 MET 63 1HE MET 63 0.976 -9.767 17.408 478 HE3 MET 63 2HE MET 63 0.411 -8.802 16.047 479 H SER 64 H SER 64 1.712 -5.753 19.833 480 HA SER 64 HA SER 64 1.295 -3.595 17.877 481 HB2 SER 64 2HB SER 64 3.013 -2.191 18.874 482 HB3 SER 64 1HB SER 64 1.770 -2.503 20.084 483 HG SER 64 HG SER 64 3.311 -4.440 20.489 484 H PHE 65 H PHE 65 3.193 -3.235 16.555 485 HA PHE 65 HA PHE 65 5.376 -5.140 16.629 486 HB2 PHE 65 2HB PHE 65 3.486 -6.449 15.578 487 HB3 PHE 65 1HB PHE 65 3.437 -5.263 14.278 488 HD1 PHE 65 1HD PHE 65 5.571 -7.818 15.967 489 HD2 PHE 65 2HD PHE 65 5.146 -5.282 12.513 490 HE1 PHE 65 1HE PHE 65 7.452 -8.993 14.866 491 HE2 PHE 65 2HE PHE 65 7.026 -6.470 11.421 492 HZ PHE 65 HZ PHE 65 8.178 -8.323 12.593 493 H ASP 66 H ASP 66 6.819 -4.794 14.675 494 HA ASP 66 HA ASP 66 6.623 -2.062 13.519 495 HB2 ASP 66 2HB ASP 66 8.034 -1.952 15.563 496 HB3 ASP 66 1HB ASP 66 9.084 -3.197 14.895 497 H PHE 67 H PHE 67 6.778 -2.270 11.381 498 HA PHE 67 HA PHE 67 8.072 -4.629 10.161 499 HB2 PHE 67 2HB PHE 67 6.458 -2.378 8.899 500 HB3 PHE 67 1HB PHE 67 7.002 -3.848 8.093 501 HD1 PHE 67 1HD PHE 67 6.039 -6.065 8.703 502 HD2 PHE 67 2HD PHE 67 4.591 -2.435 10.498 503 HE1 PHE 67 1HE PHE 67 4.042 -7.273 9.546 504 HE2 PHE 67 2HE PHE 67 2.595 -3.648 11.334 505 HZ PHE 67 HZ PHE 67 2.321 -6.064 10.858 506 H GLY 68 H GLY 68 9.877 -4.491 8.902 507 HA2 GLY 68 2HA GLY 68 10.995 -1.927 8.057 508 HA3 GLY 68 1HA GLY 68 11.926 -2.794 9.282 509 H GLY 69 H GLY 69 12.756 -2.187 6.620 510 HA2 GLY 69 2HA GLY 69 13.847 -4.679 5.820 511 HA3 GLY 69 1HA GLY 69 12.488 -4.263 4.773 512 H VAL 70 H VAL 70 14.435 -4.310 3.228 513 HA VAL 70 HA VAL 70 15.577 -1.562 2.980 514 HB VAL 70 HB VAL 70 17.291 -3.195 3.706 515 HG11 VAL 70 1HG1 VAL 70 16.232 -5.220 2.650 516 HG12 VAL 70 2HG1 VAL 70 17.950 -5.068 2.293 517 HG13 VAL 70 3HG1 VAL 70 16.759 -4.631 1.073 518 HG21 VAL 70 3HG2 VAL 70 18.938 -2.696 1.959 519 HG22 VAL 70 1HG2 VAL 70 17.902 -1.294 2.211 520 HG23 VAL 70 2HG2 VAL 70 17.657 -2.333 0.807 521 H TYR 71 H TYR 71 15.510 -0.660 0.957 522 HA TYR 71 HA TYR 71 13.715 -1.855 -1.008 523 HB2 TYR 71 2HB TYR 71 15.305 0.736 -1.005 524 HB3 TYR 71 1HB TYR 71 14.132 0.282 -2.239 525 HD1 TYR 71 1HD TYR 71 11.724 -0.234 -1.530 526 HD2 TYR 71 2HD TYR 71 14.519 1.770 1.065 527 HE1 TYR 71 1HE TYR 71 9.852 0.591 -0.136 528 HE2 TYR 71 2HE TYR 71 12.632 2.596 2.443 529 HH TYR 71 HH TYR 71 9.259 1.878 1.559 530 H ASP 72 H ASP 72 14.377 -3.148 -2.634 531 HA ASP 72 HA ASP 72 17.189 -3.629 -3.130 532 HB2 ASP 72 2HB ASP 72 15.463 -5.421 -3.242 533 HB3 ASP 72 1HB ASP 72 14.732 -4.616 -4.625 534 H GLN 73 H GLN 73 14.459 -2.246 -4.939 535 HA GLN 73 HA GLN 73 16.282 -0.532 -6.508 536 HB2 GLN 73 2HB GLN 73 14.277 -2.431 -7.797 537 HB3 GLN 73 1HB GLN 73 15.200 -1.186 -8.642 538 HG2 GLN 73 2HG GLN 73 17.321 -2.335 -7.883 539 HG3 GLN 73 1HG GLN 73 16.326 -3.626 -7.218 540 HE21 GLN 73 1HE2 GLN 73 18.010 -2.706 -9.989 541 HE22 GLN 73 2HE2 GLN 73 17.243 -3.737 -11.097 542 H VAL 74 H VAL 74 15.349 1.385 -7.078 543 HA VAL 74 HA VAL 74 12.436 1.798 -6.651 544 HB VAL 74 HB VAL 74 14.615 3.676 -5.638 545 HG11 VAL 74 1HG1 VAL 74 12.723 4.777 -4.491 546 HG12 VAL 74 2HG1 VAL 74 11.603 3.637 -5.227 547 HG13 VAL 74 3HG1 VAL 74 12.484 4.784 -6.234 548 HG21 VAL 74 3HG2 VAL 74 13.886 2.921 -3.360 549 HG22 VAL 74 1HG2 VAL 74 14.635 1.625 -4.293 550 HG23 VAL 74 2HG2 VAL 74 12.880 1.685 -4.118 551 H LYS 75 H LYS 75 11.574 2.744 -8.415 552 HA LYS 75 HA LYS 75 13.159 4.649 -10.022 553 HB2 LYS 75 2HB LYS 75 11.930 2.043 -10.959 554 HB3 LYS 75 1HB LYS 75 12.014 3.390 -12.092 555 HG2 LYS 75 2HG LYS 75 14.509 2.489 -10.588 556 HG3 LYS 75 1HG LYS 75 13.998 1.643 -12.047 557 HD2 LYS 75 2HD LYS 75 14.116 3.720 -13.351 558 HD3 LYS 75 1HD LYS 75 14.545 4.640 -11.916 559 HE2 LYS 75 2HE LYS 75 16.544 4.099 -13.245 560 HE3 LYS 75 1HE LYS 75 16.604 3.316 -11.664 561 HZ1 LYS 75 3HZ LYS 75 15.456 1.921 -13.994 562 HZ2 LYS 75 1HZ LYS 75 16.096 1.264 -12.567 563 HZ3 LYS 75 2HZ LYS 75 17.135 1.933 -13.733 564 H THR 76 H THR 76 12.009 6.437 -10.248 565 HA THR 76 HA THR 76 9.460 6.852 -9.263 566 HB THR 76 HB THR 76 10.758 8.386 -11.544 567 HG1 THR 76 1HG THR 76 11.516 7.980 -9.006 568 HG21 THR 76 3HG2 THR 76 8.782 9.226 -9.394 569 HG22 THR 76 1HG2 THR 76 8.422 9.050 -11.112 570 HG23 THR 76 2HG2 THR 76 9.529 10.305 -10.569 571 H ASN 77 H ASN 77 7.508 6.175 -9.921 572 HA ASN 77 HA ASN 77 5.808 5.327 -11.210 573 HB2 ASN 77 2HB ASN 77 7.099 7.071 -13.326 574 HB3 ASN 77 1HB ASN 77 5.434 6.491 -13.327 575 HD21 ASN 77 1HD2 ASN 77 5.393 6.907 -10.253 576 HD22 ASN 77 2HD2 ASN 77 5.161 8.579 -10.081 577 H ASP 78 H ASP 78 7.117 3.219 -11.023 578 HA ASP 78 HA ASP 78 7.181 1.938 -13.604 579 HB2 ASP 78 2HB ASP 78 9.361 3.064 -13.687 580 HB3 ASP 78 1HB ASP 78 9.797 2.368 -12.134 581 H LEU 79 H LEU 79 9.222 1.150 -10.827 582 HA LEU 79 HA LEU 79 7.325 -0.915 -9.898 583 HB2 LEU 79 2HB LEU 79 8.726 -1.967 -11.677 584 HB3 LEU 79 1HB LEU 79 10.166 -1.555 -10.766 585 HG LEU 79 HG LEU 79 9.290 -2.970 -8.849 586 HD11 LEU 79 1HD1 LEU 79 7.033 -3.476 -10.814 587 HD12 LEU 79 2HD1 LEU 79 6.950 -3.136 -9.091 588 HD13 LEU 79 3HD1 LEU 79 7.470 -4.713 -9.637 589 HD21 LEU 79 3HD2 LEU 79 9.797 -5.137 -9.929 590 HD22 LEU 79 1HD2 LEU 79 10.911 -3.880 -10.470 591 HD23 LEU 79 2HD2 LEU 79 9.588 -4.396 -11.515 592 H ILE 80 H ILE 80 7.494 -1.329 -7.764 593 HA ILE 80 HA ILE 80 9.808 -0.283 -6.215 594 HB ILE 80 HB ILE 80 6.885 0.047 -5.388 595 HG12 ILE 80 2HG1 ILE 80 8.888 2.133 -6.357 596 HG13 ILE 80 1HG1 ILE 80 7.511 1.555 -7.285 597 HG21 ILE 80 1HG2 ILE 80 9.487 1.070 -4.173 598 HG22 ILE 80 2HG2 ILE 80 8.498 -0.222 -3.498 599 HG23 ILE 80 3HG2 ILE 80 7.879 1.418 -3.552 600 HD11 ILE 80 3HD1 ILE 80 6.260 3.183 -6.346 601 HD12 ILE 80 1HD1 ILE 80 7.591 3.655 -5.310 602 HD13 ILE 80 2HD1 ILE 80 6.450 2.427 -4.770 603 H GLU 81 H GLU 81 10.556 -1.787 -4.843 604 HA GLU 81 HA GLU 81 8.827 -3.826 -3.675 605 HB2 GLU 81 2HB GLU 81 10.261 -5.703 -4.502 606 HB3 GLU 81 1HB GLU 81 9.366 -4.911 -5.797 607 HG2 GLU 81 2HG GLU 81 11.363 -3.585 -6.379 608 HG3 GLU 81 1HG GLU 81 12.272 -4.373 -5.094 609 H TYR 82 H TYR 82 9.906 -4.996 -2.008 610 HA TYR 82 HA TYR 82 12.578 -4.192 -1.157 611 HB2 TYR 82 2HB TYR 82 11.633 -3.410 1.123 612 HB3 TYR 82 1HB TYR 82 11.458 -2.290 -0.222 613 HD1 TYR 82 1HD TYR 82 9.658 -4.901 1.747 614 HD2 TYR 82 2HD TYR 82 9.254 -1.626 -1.012 615 HE1 TYR 82 1HE TYR 82 7.199 -4.930 2.056 616 HE2 TYR 82 2HE TYR 82 6.800 -1.661 -0.690 617 HH TYR 82 HH TYR 82 5.171 -2.417 0.952 618 H THR 83 H THR 83 13.275 -5.399 0.741 619 HA THR 83 HA THR 83 11.890 -8.029 0.998 620 HB THR 83 HB THR 83 14.830 -7.360 1.407 621 HG1 THR 83 1HG THR 83 14.073 -7.189 -0.773 622 HG21 THR 83 3HG2 THR 83 14.103 -9.339 2.681 623 HG22 THR 83 1HG2 THR 83 15.086 -9.834 1.303 624 HG23 THR 83 2HG2 THR 83 13.332 -10.002 1.238 625 H ILE 84 H ILE 84 11.318 -8.693 2.989 626 HA ILE 84 HA ILE 84 11.611 -6.868 5.276 627 HB ILE 84 HB ILE 84 10.096 -9.496 5.048 628 HG12 ILE 84 2HG1 ILE 84 9.236 -7.980 3.335 629 HG13 ILE 84 1HG1 ILE 84 8.069 -8.082 4.644 630 HG21 ILE 84 1HG2 ILE 84 9.898 -7.182 7.011 631 HG22 ILE 84 2HG2 ILE 84 10.434 -8.819 7.362 632 HG23 ILE 84 3HG2 ILE 84 8.757 -8.523 6.938 633 HD11 ILE 84 3HD1 ILE 84 9.933 -5.797 3.972 634 HD12 ILE 84 1HD1 ILE 84 9.180 -5.911 5.556 635 HD13 ILE 84 2HD1 ILE 84 8.186 -5.771 4.119 636 H GLY 85 H GLY 85 12.366 -7.632 7.333 637 HA2 GLY 85 2HA GLY 85 14.807 -9.010 7.240 638 HA3 GLY 85 1HA GLY 85 13.898 -8.659 8.704 639 H ASP 86 H ASP 86 11.511 -10.188 7.888 640 HA ASP 86 HA ASP 86 12.252 -12.749 8.875 641 HB2 ASP 86 2HB ASP 86 9.697 -11.751 7.570 642 HB3 ASP 86 1HB ASP 86 9.861 -13.284 8.428 643 H GLY 87 H GLY 87 12.469 -11.351 5.812 644 HA2 GLY 87 2HA GLY 87 13.556 -12.450 3.985 645 HA3 GLY 87 1HA GLY 87 12.869 -13.986 4.497 646 H ARG 88 H ARG 88 10.363 -11.987 4.904 647 HA ARG 88 HA ARG 88 9.017 -12.830 2.500 648 HB2 ARG 88 2HB ARG 88 8.112 -10.741 4.518 649 HB3 ARG 88 1HB ARG 88 7.100 -11.600 3.365 650 HG2 ARG 88 2HG ARG 88 8.643 -12.888 5.649 651 HG3 ARG 88 1HG ARG 88 6.919 -12.546 5.656 652 HD2 ARG 88 2HD ARG 88 6.736 -14.024 3.576 653 HD3 ARG 88 1HD ARG 88 8.387 -14.542 3.903 654 HE ARG 88 HE ARG 88 6.889 -14.857 6.259 655 HH11 ARG 88 1HH2 ARG 88 7.127 -16.122 3.026 656 HH12 ARG 88 2HH2 ARG 88 6.567 -17.702 3.459 657 HH21 ARG 88 1HH1 ARG 88 6.158 -16.940 6.814 658 HH22 ARG 88 2HH1 ARG 88 6.021 -18.162 5.594 659 H LYS 89 H LYS 89 7.971 -11.372 1.013 660 HA LYS 89 HA LYS 89 9.255 -8.748 0.605 661 HB2 LYS 89 2HB LYS 89 9.782 -9.287 -1.735 662 HB3 LYS 89 1HB LYS 89 10.711 -10.259 -0.594 663 HG2 LYS 89 2HG LYS 89 9.386 -12.228 -0.984 664 HG3 LYS 89 1HG LYS 89 8.115 -11.327 -1.799 665 HD2 LYS 89 2HD LYS 89 9.424 -12.505 -3.459 666 HD3 LYS 89 1HD LYS 89 9.684 -10.769 -3.625 667 HE2 LYS 89 2HE LYS 89 11.874 -10.919 -2.617 668 HE3 LYS 89 1HE LYS 89 11.576 -12.561 -2.038 669 HZ1 LYS 89 3HZ LYS 89 11.149 -12.512 -4.795 670 HZ2 LYS 89 1HZ LYS 89 12.359 -13.331 -3.933 671 HZ3 LYS 89 2HZ LYS 89 12.636 -11.750 -4.493 672 H VAL 90 H VAL 90 8.219 -7.486 -1.023 673 HA VAL 90 HA VAL 90 5.489 -8.286 -1.812 674 HB VAL 90 HB VAL 90 6.068 -5.714 -0.283 675 HG11 VAL 90 1HG1 VAL 90 4.243 -5.433 -1.890 676 HG12 VAL 90 2HG1 VAL 90 3.544 -5.549 -0.282 677 HG13 VAL 90 3HG1 VAL 90 3.493 -6.935 -1.366 678 HG21 VAL 90 3HG2 VAL 90 6.164 -7.538 1.315 679 HG22 VAL 90 1HG2 VAL 90 4.755 -8.325 0.598 680 HG23 VAL 90 2HG2 VAL 90 4.572 -6.812 1.484 681 H ARG 91 H ARG 91 5.552 -7.986 -3.954 682 HA ARG 91 HA ARG 91 7.185 -5.824 -5.144 683 HB2 ARG 91 2HB ARG 91 5.615 -8.101 -6.402 684 HB3 ARG 91 1HB ARG 91 6.639 -6.956 -7.273 685 HG2 ARG 91 2HG ARG 91 8.605 -7.716 -5.994 686 HG3 ARG 91 1HG ARG 91 7.593 -8.846 -5.091 687 HD2 ARG 91 2HD ARG 91 8.737 -10.031 -6.907 688 HD3 ARG 91 1HD ARG 91 7.004 -9.986 -7.229 689 HE ARG 91 HE ARG 91 8.256 -7.742 -8.433 690 HH11 ARG 91 1HH2 ARG 91 7.982 -11.194 -8.733 691 HH12 ARG 91 2HH2 ARG 91 8.250 -11.195 -10.444 692 HH21 ARG 91 1HH1 ARG 91 8.600 -7.754 -10.663 693 HH22 ARG 91 2HH1 ARG 91 8.600 -9.249 -11.536 694 H ILE 92 H ILE 92 6.251 -3.948 -5.770 695 HA ILE 92 HA ILE 92 3.291 -3.832 -6.187 696 HB ILE 92 HB ILE 92 5.058 -1.648 -4.983 697 HG12 ILE 92 2HG1 ILE 92 3.014 -3.434 -3.574 698 HG13 ILE 92 1HG1 ILE 92 4.753 -3.667 -3.472 699 HG21 ILE 92 1HG2 ILE 92 2.866 -0.576 -4.479 700 HG22 ILE 92 2HG2 ILE 92 2.037 -1.910 -5.271 701 HG23 ILE 92 3HG2 ILE 92 3.053 -0.827 -6.210 702 HD11 ILE 92 3HD1 ILE 92 5.001 -1.389 -2.524 703 HD12 ILE 92 1HD1 ILE 92 3.983 -2.422 -1.521 704 HD13 ILE 92 2HD1 ILE 92 3.248 -1.202 -2.558 705 H VAL 93 H VAL 93 2.995 -3.561 -8.310 706 HA VAL 93 HA VAL 93 4.884 -1.886 -9.899 707 HB VAL 93 HB VAL 93 4.628 -4.249 -10.615 708 HG11 VAL 93 1HG1 VAL 93 2.205 -4.491 -9.901 709 HG12 VAL 93 2HG1 VAL 93 2.553 -5.114 -11.511 710 HG13 VAL 93 3HG1 VAL 93 1.756 -3.555 -11.327 711 HG21 VAL 93 3HG2 VAL 93 4.230 -3.776 -12.994 712 HG22 VAL 93 1HG2 VAL 93 5.152 -2.460 -12.269 713 HG23 VAL 93 2HG2 VAL 93 3.427 -2.262 -12.583 714 H PHE 94 H PHE 94 4.154 -0.058 -10.803 715 HA PHE 94 HA PHE 94 1.291 0.687 -10.414 716 HB2 PHE 94 2HB PHE 94 3.798 2.343 -10.871 717 HB3 PHE 94 1HB PHE 94 2.166 2.997 -10.770 718 HD1 PHE 94 2HD PHE 94 4.805 1.176 -8.867 719 HD2 PHE 94 1HD PHE 94 1.024 3.219 -8.611 720 HE1 PHE 94 2HE PHE 94 4.940 1.142 -6.397 721 HE2 PHE 94 1HE PHE 94 1.180 3.182 -6.136 722 HZ PHE 94 HZ PHE 94 3.141 2.138 -5.041 723 H THR 95 H THR 95 0.031 0.979 -12.119 724 HA THR 95 HA THR 95 1.173 1.265 -14.848 725 HB THR 95 HB THR 95 -0.618 -0.299 -15.645 726 HG1 THR 95 1HG THR 95 -1.030 -0.449 -12.873 727 HG21 THR 95 3HG2 THR 95 1.250 -1.500 -13.574 728 HG22 THR 95 1HG2 THR 95 1.694 -1.118 -15.238 729 HG23 THR 95 2HG2 THR 95 0.491 -2.368 -14.909 730 H HIS 96 H HIS 96 -0.192 2.339 -16.291 731 HA HIS 96 HA HIS 96 -2.690 3.542 -15.356 732 HB2 HIS 96 2HB HIS 96 -1.868 5.853 -15.742 733 HB3 HIS 96 1HB HIS 96 -0.997 5.073 -14.419 734 HD2 HIS 96 2HD HIS 96 -0.321 6.239 -18.122 735 HE1 HIS 96 1HE HIS 96 3.360 5.081 -16.408 736 HE2 HIS 96 2HE HIS 96 2.269 6.139 -18.442 737 H THR 97 H THR 97 -3.803 4.644 -17.070 738 HA THR 97 HA THR 97 -2.848 4.086 -19.841 739 HB THR 97 HB THR 97 -5.078 3.281 -20.444 740 HG1 THR 97 1HG THR 97 -5.582 3.847 -17.725 741 HG21 THR 97 3HG2 THR 97 -5.052 1.142 -19.237 742 HG22 THR 97 1HG2 THR 97 -4.044 1.848 -17.974 743 HG23 THR 97 2HG2 THR 97 -3.399 1.636 -19.602 744 H GLY 98 H GLY 98 -3.003 6.497 -18.105 745 HA2 GLY 98 2HA GLY 98 -3.277 8.743 -18.630 746 HA3 GLY 98 1HA GLY 98 -4.225 8.298 -20.043 747 H ASP 99 H ASP 99 -4.511 10.039 -17.402 748 HA ASP 99 HA ASP 99 -6.201 10.779 -16.047 749 HB2 ASP 99 2HB ASP 99 -7.955 9.543 -18.193 750 HB3 ASP 99 1HB ASP 99 -8.470 10.725 -16.993 751 H THR 100 H THR 100 -5.310 7.758 -16.112 752 HA THR 100 HA THR 100 -7.038 6.947 -13.891 753 HB THR 100 HB THR 100 -6.770 5.190 -16.367 754 HG1 THR 100 1HG THR 100 -8.174 6.734 -16.923 755 HG21 THR 100 3HG2 THR 100 -7.027 3.913 -14.277 756 HG22 THR 100 1HG2 THR 100 -8.515 3.839 -15.217 757 HG23 THR 100 2HG2 THR 100 -8.410 4.908 -13.821 758 H THR 101 H THR 101 -6.019 5.586 -12.495 759 HA THR 101 HA THR 101 -3.321 4.523 -13.196 760 HB THR 101 HB THR 101 -4.095 5.887 -10.595 761 HG1 THR 101 1HG THR 101 -2.410 6.648 -12.742 762 HG21 THR 101 3HG2 THR 101 -1.632 5.668 -10.127 763 HG22 THR 101 1HG2 THR 101 -1.483 4.652 -11.560 764 HG23 THR 101 2HG2 THR 101 -2.456 4.112 -10.189 765 H ASN 102 H ASN 102 -3.068 2.458 -12.714 766 HA ASN 102 HA ASN 102 -5.003 1.075 -10.899 767 HB2 ASN 102 2HB ASN 102 -3.560 0.020 -13.355 768 HB3 ASN 102 1HB ASN 102 -4.624 -0.917 -12.304 769 HD21 ASN 102 1HD2 ASN 102 -4.567 1.015 -15.115 770 HD22 ASN 102 2HD2 ASN 102 -6.235 1.305 -15.236 771 H ILE 103 H ILE 103 -4.071 0.331 -9.109 772 HA ILE 103 HA ILE 103 -1.108 -0.044 -8.972 773 HB ILE 103 HB ILE 103 -3.157 0.209 -6.738 774 HG12 ILE 103 2HG1 ILE 103 -1.137 2.302 -7.661 775 HG13 ILE 103 1HG1 ILE 103 -2.831 2.325 -8.140 776 HG21 ILE 103 1HG2 ILE 103 -1.164 -1.047 -6.032 777 HG22 ILE 103 2HG2 ILE 103 -1.122 0.550 -5.300 778 HG23 ILE 103 3HG2 ILE 103 -0.115 0.200 -6.703 779 HD11 ILE 103 3HD1 ILE 103 -2.499 3.794 -6.208 780 HD12 ILE 103 1HD1 ILE 103 -1.799 2.461 -5.291 781 HD13 ILE 103 2HD1 ILE 103 -3.504 2.417 -5.748 782 H VAL 104 H VAL 104 -0.369 -2.122 -8.924 783 HA VAL 104 HA VAL 104 -2.208 -4.297 -8.008 784 HB VAL 104 HB VAL 104 -0.240 -4.450 -10.319 785 HG11 VAL 104 1HG1 VAL 104 -1.361 -6.646 -10.731 786 HG12 VAL 104 2HG1 VAL 104 -2.284 -6.425 -9.246 787 HG13 VAL 104 3HG1 VAL 104 -0.533 -6.606 -9.176 788 HG21 VAL 104 3HG2 VAL 104 -2.279 -4.587 -11.736 789 HG22 VAL 104 1HG2 VAL 104 -2.173 -3.041 -10.895 790 HG23 VAL 104 2HG2 VAL 104 -3.273 -4.289 -10.311 791 H GLU 105 H GLU 105 -1.340 -5.629 -6.542 792 HA GLU 105 HA GLU 105 1.595 -5.781 -6.183 793 HB2 GLU 105 2HB GLU 105 1.324 -5.441 -3.731 794 HB3 GLU 105 1HB GLU 105 0.886 -4.005 -4.658 795 HG2 GLU 105 2HG GLU 105 -1.504 -4.609 -4.486 796 HG3 GLU 105 1HG GLU 105 -1.086 -6.040 -3.550 797 H SER 106 H SER 106 2.299 -7.692 -5.333 798 HA SER 106 HA SER 106 0.293 -9.791 -4.667 799 HB2 SER 106 2HB SER 106 1.656 -11.410 -5.935 800 HB3 SER 106 1HB SER 106 1.057 -10.131 -6.988 801 HG SER 106 HG SER 106 3.635 -10.694 -6.126 802 H PHE 107 H PHE 107 0.875 -11.148 -3.013 803 HA PHE 107 HA PHE 107 3.609 -11.160 -1.940 804 HB2 PHE 107 2HB PHE 107 2.746 -10.488 0.360 805 HB3 PHE 107 1HB PHE 107 2.782 -9.185 -0.821 806 HD1 PHE 107 1HD PHE 107 0.562 -11.547 0.995 807 HD2 PHE 107 2HD PHE 107 0.715 -8.232 -1.747 808 HE1 PHE 107 1HE PHE 107 -1.882 -11.212 1.249 809 HE2 PHE 107 2HE PHE 107 -1.726 -7.906 -1.484 810 HZ PHE 107 HZ PHE 107 -3.023 -9.394 0.007 811 H ASP 108 H ASP 108 3.933 -12.816 -0.367 812 HA ASP 108 HA ASP 108 2.161 -15.093 -0.808 813 HB2 ASP 108 2HB ASP 108 3.900 -16.372 0.397 814 HB3 ASP 108 1HB ASP 108 4.571 -15.431 -0.933 815 HA PRO 109 HA PRO 109 0.106 -14.367 3.170 816 HB2 PRO 109 2HB PRO 109 -1.369 -16.636 3.461 817 HB3 PRO 109 1HB PRO 109 -1.745 -15.454 2.197 818 HG2 PRO 109 2HG PRO 109 -0.161 -18.006 1.956 819 HG3 PRO 109 1HG PRO 109 -1.475 -17.418 0.911 820 HD2 PRO 109 2HD PRO 109 1.176 -17.069 0.242 821 HD3 PRO 109 1HD PRO 109 -0.069 -15.877 -0.215 822 H GLU 110 H GLU 110 0.140 -15.121 5.361 823 HA GLU 110 HA GLU 110 2.600 -16.417 6.150 824 HB2 GLU 110 2HB GLU 110 0.181 -15.548 7.760 825 HB3 GLU 110 1HB GLU 110 1.717 -16.072 8.446 826 HG2 GLU 110 2HG GLU 110 2.865 -14.211 7.291 827 HG3 GLU 110 1HG GLU 110 1.326 -13.686 6.612 828 H GLU 111 H GLU 111 2.727 -18.389 7.383 829 HA GLU 111 HA GLU 111 0.875 -20.463 6.464 830 HB2 GLU 111 2HB GLU 111 3.368 -20.591 8.189 831 HB3 GLU 111 1HB GLU 111 2.486 -21.988 7.567 832 HG2 GLU 111 2HG GLU 111 2.911 -21.235 5.253 833 HG3 GLU 111 1HG GLU 111 3.787 -19.832 5.865 834 H THR 112 H THR 112 1.898 -19.002 9.544 835 HA THR 112 HA THR 112 0.413 -20.684 11.255 836 HB THR 112 HB THR 112 0.720 -18.937 12.945 837 HG1 THR 112 1HG THR 112 1.860 -17.315 10.947 838 HG21 THR 112 3HG2 THR 112 2.672 -20.337 12.353 839 HG22 THR 112 1HG2 THR 112 3.162 -18.710 12.824 840 HG23 THR 112 2HG2 THR 112 3.134 -19.162 11.119 841 H ASN 113 H ASN 113 -0.430 -17.531 9.791 842 HA ASN 113 HA ASN 113 -3.131 -17.662 10.926 843 HB2 ASN 113 2HB ASN 113 -1.659 -15.550 9.327 844 HB3 ASN 113 1HB ASN 113 -3.327 -15.364 9.843 845 HD21 ASN 113 1HD2 ASN 113 0.010 -15.227 10.914 846 HD22 ASN 113 2HD2 ASN 113 -0.332 -14.777 12.515 847 HA PRO 114 HA PRO 114 -4.911 -19.332 7.176 848 HB2 PRO 114 2HB PRO 114 -7.433 -18.138 7.156 849 HB3 PRO 114 1HB PRO 114 -6.998 -19.479 8.231 850 HG2 PRO 114 2HG PRO 114 -6.992 -16.525 8.809 851 HG3 PRO 114 1HG PRO 114 -7.662 -17.843 9.792 852 HD2 PRO 114 2HD PRO 114 -5.261 -16.788 10.388 853 HD3 PRO 114 1HD PRO 114 -5.508 -18.549 10.517 854 H ARG 115 H ARG 115 -4.790 -18.859 5.041 855 HA ARG 115 HA ARG 115 -3.878 -16.296 4.152 856 HB2 ARG 115 2HB ARG 115 -3.995 -17.339 1.878 857 HB3 ARG 115 1HB ARG 115 -3.107 -18.320 3.041 858 HG2 ARG 115 2HG ARG 115 -5.110 -19.723 3.408 859 HG3 ARG 115 1HG ARG 115 -6.007 -18.757 2.245 860 HD2 ARG 115 2HD ARG 115 -3.477 -20.265 1.547 861 HD3 ARG 115 1HD ARG 115 -5.108 -20.880 1.278 862 HE ARG 115 HE ARG 115 -4.933 -18.318 0.130 863 HH11 ARG 115 1HH2 ARG 115 -3.661 -21.525 -0.274 864 HH12 ARG 115 2HH2 ARG 115 -3.473 -21.373 -1.989 865 HH21 ARG 115 1HH1 ARG 115 -4.696 -18.131 -2.105 866 HH22 ARG 115 2HH1 ARG 115 -4.058 -19.453 -3.023 867 H GLU 116 H GLU 116 -6.993 -17.979 4.010 868 HA GLU 116 HA GLU 116 -8.325 -16.321 2.213 869 HB2 GLU 116 2HB GLU 116 -10.430 -17.102 3.482 870 HB3 GLU 116 1HB GLU 116 -9.390 -18.377 2.850 871 HG2 GLU 116 2HG GLU 116 -8.363 -18.698 5.037 872 HG3 GLU 116 1HG GLU 116 -9.274 -17.354 5.712 873 H LEU 117 H LEU 117 -7.871 -15.914 5.721 874 HA LEU 117 HA LEU 117 -9.544 -13.662 6.020 875 HB2 LEU 117 2HB LEU 117 -8.682 -15.060 7.883 876 HB3 LEU 117 1HB LEU 117 -7.068 -14.422 7.596 877 HG LEU 117 HG LEU 117 -7.924 -12.118 8.105 878 HD11 LEU 117 1HD1 LEU 117 -10.239 -12.069 7.661 879 HD12 LEU 117 2HD1 LEU 117 -10.231 -12.147 9.413 880 HD13 LEU 117 3HD1 LEU 117 -10.544 -13.602 8.470 881 HD21 LEU 117 3HD2 LEU 117 -8.153 -12.472 10.543 882 HD22 LEU 117 1HD2 LEU 117 -6.873 -13.479 9.866 883 HD23 LEU 117 2HD2 LEU 117 -8.437 -14.190 10.265 884 H GLN 118 H GLN 118 -6.072 -13.975 5.300 885 HA GLN 118 HA GLN 118 -5.404 -11.240 5.398 886 HB2 GLN 118 2HB GLN 118 -4.201 -13.461 3.713 887 HB3 GLN 118 1HB GLN 118 -3.450 -11.890 4.002 888 HG2 GLN 118 2HG GLN 118 -3.420 -12.341 6.426 889 HG3 GLN 118 1HG GLN 118 -4.181 -13.903 6.146 890 HE21 GLN 118 1HE2 GLN 118 -2.574 -15.448 6.488 891 HE22 GLN 118 2HE2 GLN 118 -1.015 -15.380 5.825 892 H GLN 119 H GLN 119 -6.429 -13.277 2.637 893 HA GLN 119 HA GLN 119 -6.223 -11.364 0.627 894 HB2 GLN 119 2HB GLN 119 -6.840 -13.887 0.502 895 HB3 GLN 119 1HB GLN 119 -8.506 -13.379 0.745 896 HG2 GLN 119 2HG GLN 119 -6.688 -12.461 -1.513 897 HG3 GLN 119 1HG GLN 119 -7.970 -13.649 -1.662 898 HE21 GLN 119 1HE2 GLN 119 -10.022 -12.370 -0.161 899 HE22 GLN 119 2HE2 GLN 119 -10.448 -10.925 -0.946 900 H SER 120 H SER 120 -9.004 -12.034 2.760 901 HA SER 120 HA SER 120 -10.711 -10.029 1.715 902 HB2 SER 120 2HB SER 120 -11.518 -11.875 3.136 903 HB3 SER 120 1HB SER 120 -10.636 -11.208 4.507 904 HG SER 120 HG SER 120 -11.983 -9.492 4.545 905 H GLY 121 H GLY 121 -8.351 -10.021 4.383 906 HA2 GLY 121 2HA GLY 121 -8.897 -7.435 5.366 907 HA3 GLY 121 1HA GLY 121 -7.373 -8.296 5.553 908 H TRP 122 H TRP 122 -6.365 -8.491 3.050 909 HA TRP 122 HA TRP 122 -5.385 -5.872 2.530 910 HB2 TRP 122 2HB TRP 122 -5.210 -8.445 0.920 911 HB3 TRP 122 1HB TRP 122 -4.382 -6.962 0.449 912 HD1 TRP 122 HD TRP 122 -3.800 -10.001 2.452 913 HE1 TRP 122 1HE TRP 122 -1.785 -9.700 4.023 914 HE3 TRP 122 3HE TRP 122 -3.154 -4.946 2.100 915 HZ2 TRP 122 2HZ TRP 122 -0.113 -7.595 5.001 916 HZ3 TRP 122 3HZ TRP 122 -1.342 -3.823 3.355 917 HH2 TRP 122 HH TRP 122 0.182 -5.138 4.803 918 H GLN 123 H GLN 123 -7.949 -7.798 1.063 919 HA GLN 123 HA GLN 123 -8.404 -5.977 -1.131 920 HB2 GLN 123 2HB GLN 123 -9.020 -8.403 -1.165 921 HB3 GLN 123 1HB GLN 123 -10.273 -8.076 0.032 922 HG2 GLN 123 2HG GLN 123 -11.381 -6.518 -1.531 923 HG3 GLN 123 1HG GLN 123 -10.103 -6.771 -2.714 924 HE21 GLN 123 1HE2 GLN 123 -12.806 -7.336 -3.362 925 HE22 GLN 123 2HE2 GLN 123 -12.984 -9.013 -3.546 926 H ALA 124 H ALA 124 -9.773 -6.428 2.109 927 HA ALA 124 HA ALA 124 -11.988 -4.712 1.921 928 HB1 ALA 124 1HB ALA 124 -10.245 -5.299 4.326 929 HB2 ALA 124 2HB ALA 124 -11.656 -6.229 3.814 930 HB3 ALA 124 3HB ALA 124 -11.854 -4.577 4.391 931 H ILE 125 H ILE 125 -8.696 -3.941 3.121 932 HA ILE 125 HA ILE 125 -9.194 -1.211 3.636 933 HB ILE 125 HB ILE 125 -7.284 -2.390 4.581 934 HG12 ILE 125 2HG1 ILE 125 -6.238 -0.250 2.667 935 HG13 ILE 125 1HG1 ILE 125 -7.090 0.101 4.162 936 HG21 ILE 125 1HG2 ILE 125 -6.857 -3.899 2.675 937 HG22 ILE 125 2HG2 ILE 125 -5.386 -3.123 3.215 938 HG23 ILE 125 3HG2 ILE 125 -6.191 -2.560 1.757 939 HD11 ILE 125 3HD1 ILE 125 -4.724 0.240 4.595 940 HD12 ILE 125 1HD1 ILE 125 -4.450 -1.340 3.873 941 HD13 ILE 125 2HD1 ILE 125 -5.328 -1.206 5.392 942 H LEU 126 H LEU 126 -8.148 -2.909 0.719 943 HA LEU 126 HA LEU 126 -7.528 -0.617 -0.836 944 HB2 LEU 126 2HB LEU 126 -8.303 -3.471 -1.485 945 HB3 LEU 126 1HB LEU 126 -8.052 -2.310 -2.783 946 HG LEU 126 HG LEU 126 -5.975 -2.975 -0.651 947 HD11 LEU 126 1HD1 LEU 126 -6.366 -4.919 -2.048 948 HD12 LEU 126 2HD1 LEU 126 -4.813 -4.209 -2.482 949 HD13 LEU 126 3HD1 LEU 126 -6.220 -3.948 -3.516 950 HD21 LEU 126 3HD2 LEU 126 -6.031 -0.984 -2.898 951 HD22 LEU 126 1HD2 LEU 126 -4.524 -1.883 -2.721 952 HD23 LEU 126 2HD2 LEU 126 -5.154 -0.941 -1.381 953 H ASN 127 H ASN 127 -10.554 -2.410 -0.324 954 HA ASN 127 HA ASN 127 -12.103 -0.979 -2.232 955 HB2 ASN 127 2HB ASN 127 -12.914 -2.432 0.307 956 HB3 ASN 127 1HB ASN 127 -14.053 -1.844 -0.905 957 HD21 ASN 127 1HD2 ASN 127 -13.425 -4.701 -0.119 958 HD22 ASN 127 2HD2 ASN 127 -12.950 -5.456 -1.562 959 H SER 128 H SER 128 -11.446 -0.461 1.204 960 HA SER 128 HA SER 128 -13.184 1.711 1.645 961 HB2 SER 128 2HB SER 128 -10.519 1.161 2.980 962 HB3 SER 128 1HB SER 128 -11.802 2.195 3.606 963 HG SER 128 HG SER 128 -13.139 0.360 3.694 964 H PHE 129 H PHE 129 -9.945 1.562 0.268 965 HA PHE 129 HA PHE 129 -9.187 4.236 0.441 966 HB2 PHE 129 2HB PHE 129 -7.739 2.353 -0.372 967 HB3 PHE 129 1HB PHE 129 -8.631 2.361 -1.889 968 HD1 PHE 129 2HD PHE 129 -6.228 4.232 0.217 969 HD2 PHE 129 1HD PHE 129 -8.401 4.230 -3.496 970 HE1 PHE 129 2HE PHE 129 -4.805 6.076 -0.623 971 HE2 PHE 129 1HE PHE 129 -6.975 6.078 -4.324 972 HZ PHE 129 HZ PHE 129 -5.178 6.999 -2.891 973 H LYS 130 H LYS 130 -11.090 2.633 -2.123 974 HA LYS 130 HA LYS 130 -11.415 4.914 -3.777 975 HB2 LYS 130 2HB LYS 130 -13.197 2.488 -3.429 976 HB3 LYS 130 1HB LYS 130 -13.345 3.653 -4.746 977 HG2 LYS 130 2HG LYS 130 -10.939 3.116 -5.375 978 HG3 LYS 130 1HG LYS 130 -10.982 1.811 -4.190 979 HD2 LYS 130 2HD LYS 130 -12.851 2.076 -6.583 980 HD3 LYS 130 1HD LYS 130 -11.455 1.009 -6.504 981 HE2 LYS 130 2HE LYS 130 -12.562 -0.065 -4.438 982 HE3 LYS 130 1HE LYS 130 -14.026 0.804 -4.900 983 HZ1 LYS 130 3HZ LYS 130 -14.388 -0.559 -6.592 984 HZ2 LYS 130 1HZ LYS 130 -13.292 -1.606 -5.833 985 HZ3 LYS 130 2HZ LYS 130 -12.759 -0.575 -7.073 986 H SER 131 H SER 131 -13.431 3.548 -1.173 987 HA SER 131 HA SER 131 -15.576 5.372 -1.357 988 HB2 SER 131 2HB SER 131 -14.534 3.922 1.094 989 HB3 SER 131 1HB SER 131 -16.126 4.658 0.930 990 HG SER 131 HG SER 131 -15.143 2.288 -0.056 991 H TYR 132 H TYR 132 -12.584 5.450 0.561 992 HA TYR 132 HA TYR 132 -13.129 7.823 1.991 993 HB2 TYR 132 2HB TYR 132 -11.322 6.229 2.592 994 HB3 TYR 132 1HB TYR 132 -10.434 6.699 1.146 995 HD1 TYR 132 2HD TYR 132 -11.601 7.825 4.487 996 HD2 TYR 132 1HD TYR 132 -9.337 8.909 0.992 997 HE1 TYR 132 2HE TYR 132 -10.664 9.776 5.694 998 HE2 TYR 132 1HE TYR 132 -8.410 10.861 2.203 999 HH TYR 132 HH TYR 132 -8.665 11.237 5.559 1000 H THR 133 H THR 133 -11.457 7.260 -1.098 1001 HA THR 133 HA THR 133 -10.630 9.891 -1.606 1002 HB THR 133 HB THR 133 -11.513 7.836 -3.669 1003 HG1 THR 133 1HG THR 133 -9.146 7.449 -3.581 1004 HG21 THR 133 3HG2 THR 133 -9.559 10.162 -3.809 1005 HG22 THR 133 1HG2 THR 133 -11.109 10.056 -4.644 1006 HG23 THR 133 2HG2 THR 133 -9.798 8.964 -5.079 1007 H GLU 134 H GLU 134 -13.652 8.250 -2.569 1008 HA GLU 134 HA GLU 134 -14.794 10.511 -3.885 1009 HB2 GLU 134 2HB GLU 134 -15.511 8.155 -4.247 1010 HB3 GLU 134 1HB GLU 134 -16.189 8.126 -2.621 1011 HG2 GLU 134 2HG GLU 134 -17.751 9.941 -3.215 1012 HG3 GLU 134 1HG GLU 134 -17.038 10.048 -4.821 1013 H ASN 135 H ASN 135 -15.100 9.182 -0.594 1014 HA ASN 135 HA ASN 135 -17.010 11.053 0.355 1015 HB2 ASN 135 2HB ASN 135 -16.521 8.917 1.506 1016 HB3 ASN 135 1HB ASN 135 -14.916 9.511 1.919 1017 HD21 ASN 135 1HD2 ASN 135 -18.360 10.573 2.252 1018 HD22 ASN 135 2HD2 ASN 135 -18.157 11.220 3.807 1019 H ASN 136 H ASN 136 -13.482 11.103 0.166 1020 HA ASN 136 HA ASN 136 -13.006 13.332 1.837 1021 HB2 ASN 136 2HB ASN 136 -11.213 11.829 1.044 1022 HB3 ASN 136 1HB ASN 136 -11.443 12.418 -0.600 1023 HD21 ASN 136 1HD2 ASN 136 -9.325 13.410 -0.764 1024 HD22 ASN 136 2HD2 ASN 136 -8.898 14.772 0.154 1025 H LEU 137 H LEU 137 -13.708 13.099 -1.652 1026 HA LEU 137 HA LEU 137 -14.739 15.830 -1.642 1027 HB2 LEU 137 2HB LEU 137 -12.303 16.088 -2.108 1028 HB3 LEU 137 1HB LEU 137 -12.467 15.019 -3.491 1029 HG LEU 137 HG LEU 137 -14.077 16.639 -4.527 1030 HD11 LEU 137 1HD1 LEU 137 -13.611 18.148 -1.938 1031 HD12 LEU 137 2HD1 LEU 137 -15.110 17.894 -2.827 1032 HD13 LEU 137 3HD1 LEU 137 -13.938 19.058 -3.412 1033 HD21 LEU 137 3HD2 LEU 137 -11.414 17.848 -3.709 1034 HD22 LEU 137 1HD2 LEU 137 -12.389 18.355 -5.088 1035 HD23 LEU 137 2HD2 LEU 137 -11.669 16.744 -5.061 1036 H GLU 138 H GLU 138 -16.586 15.764 -2.714 1037 HA GLU 138 HA GLU 138 -17.330 13.535 -4.424 1038 HB2 GLU 138 2HB GLU 138 -19.505 14.754 -4.571 1039 HB3 GLU 138 1HB GLU 138 -18.987 14.485 -2.908 1040 HG2 GLU 138 2HG GLU 138 -18.109 16.797 -2.797 1041 HG3 GLU 138 1HG GLU 138 -18.619 17.080 -4.458 1042 H HIS 139 H HIS 139 -15.100 15.119 -5.367 1043 HA HIS 139 HA HIS 139 -14.304 16.148 -7.261 1044 HB2 HIS 139 2HB HIS 139 -16.829 14.986 -8.487 1045 HB3 HIS 139 1HB HIS 139 -15.406 15.533 -9.369 1046 HD2 HIS 139 2HD HIS 139 -16.661 12.369 -7.569 1047 HE1 HIS 139 1HE HIS 139 -12.550 11.772 -8.326 1048 HE2 HIS 139 2HE HIS 139 -14.697 10.647 -7.568 1049 H HIS 140 H HIS 140 -14.691 18.248 -6.236 1050 HA HIS 140 HA HIS 140 -17.092 19.726 -6.667 1051 HB2 HIS 140 2HB HIS 140 -15.453 20.266 -4.883 1052 HB3 HIS 140 1HB HIS 140 -14.289 20.768 -6.107 1053 HD2 HIS 140 2HD HIS 140 -14.517 23.466 -6.708 1054 HE1 HIS 140 1HE HIS 140 -18.477 24.051 -5.369 1055 HE2 HIS 140 2HE HIS 140 -16.440 25.198 -6.357 1056 H HIS 141 H HIS 141 -17.645 21.174 -8.249 1057 HA HIS 141 HA HIS 141 -16.534 20.839 -10.854 1058 HB2 HIS 141 2HB HIS 141 -18.400 23.002 -9.815 1059 HB3 HIS 141 1HB HIS 141 -18.120 22.595 -11.509 1060 HD2 HIS 141 2HD HIS 141 -19.418 20.226 -12.390 1061 HE1 HIS 141 1HE HIS 141 -21.384 19.403 -8.746 1062 HE2 HIS 141 2HE HIS 141 -21.206 18.748 -11.193 1063 H HIS 142 H HIS 142 -15.115 22.090 -11.986 1064 HA HIS 142 HA HIS 142 -14.268 24.718 -11.132 1065 HB2 HIS 142 2HB HIS 142 -11.893 24.076 -10.738 1066 HB3 HIS 142 1HB HIS 142 -12.978 23.376 -9.538 1067 HD2 HIS 142 2HD HIS 142 -10.640 22.190 -12.444 1068 HE1 HIS 142 1HE HIS 142 -12.340 18.755 -10.673 1069 HE2 HIS 142 2HE HIS 142 -10.617 19.581 -12.344 1070 H HIS 143 H HIS 143 -12.844 25.706 -12.653 1071 HA HIS 143 HA HIS 143 -11.911 24.367 -15.003 1072 HB2 HIS 143 2HB HIS 143 -14.352 24.391 -15.515 1073 HB3 HIS 143 1HB HIS 143 -14.360 26.145 -15.343 1074 HD2 HIS 143 2HD HIS 143 -13.660 27.491 -17.674 1075 HE1 HIS 143 1HE HIS 143 -12.016 24.213 -19.767 1076 HE2 HIS 143 2HE HIS 143 -12.621 26.675 -19.927 1077 H HIS 144 H HIS 144 -10.030 25.459 -14.414 1078 HA HIS 144 HA HIS 144 -8.500 27.170 -14.363 1079 HB2 HIS 144 2HB HIS 144 -10.381 28.365 -16.422 1080 HB3 HIS 144 1HB HIS 144 -8.692 28.808 -16.179 1081 HD2 HIS 144 2HD HIS 144 -6.805 26.873 -17.119 1082 HE1 HIS 144 1HE HIS 144 -9.661 24.380 -18.975 1083 HE2 HIS 144 2HE HIS 144 -7.177 24.841 -18.715 Start of MODEL 12 1 H1 GLY 1 1HT GLY 1 -2.721 -19.462 -6.172 2 H2 GLY 1 2HT GLY 1 -1.286 -20.210 -5.655 3 H3 GLY 1 3HT GLY 1 -1.440 -18.519 -5.580 4 HA2 GLY 1 2HA GLY 1 -3.501 -19.137 -4.084 5 HA3 GLY 1 1HA GLY 1 -2.519 -20.576 -3.810 6 H ASN 2 H ASN 2 -0.026 -19.869 -3.622 7 HA ASN 2 HA ASN 2 0.114 -18.266 -1.215 8 HB2 ASN 2 2HB ASN 2 2.309 -19.571 -2.850 9 HB3 ASN 2 1HB ASN 2 2.510 -18.864 -1.248 10 HD21 ASN 2 1HD2 ASN 2 -0.088 -19.853 -0.222 11 HD22 ASN 2 2HD2 ASN 2 0.094 -21.528 -0.021 12 H LYS 3 H LYS 3 -0.284 -17.301 -4.227 13 HA LYS 3 HA LYS 3 1.518 -14.925 -4.038 14 HB2 LYS 3 2HB LYS 3 0.614 -16.403 -6.529 15 HB3 LYS 3 1HB LYS 3 1.565 -14.916 -6.504 16 HG2 LYS 3 2HG LYS 3 3.363 -16.071 -5.270 17 HG3 LYS 3 1HG LYS 3 2.419 -17.564 -5.278 18 HD2 LYS 3 2HD LYS 3 2.465 -17.577 -7.755 19 HD3 LYS 3 1HD LYS 3 3.421 -16.094 -7.743 20 HE2 LYS 3 2HE LYS 3 5.216 -17.252 -6.507 21 HE3 LYS 3 1HE LYS 3 4.262 -18.737 -6.507 22 HZ1 LYS 3 3HZ LYS 3 5.404 -19.138 -8.381 23 HZ2 LYS 3 1HZ LYS 3 5.770 -17.505 -8.653 24 HZ3 LYS 3 2HZ LYS 3 4.249 -18.119 -9.100 25 H ILE 4 H ILE 4 -0.834 -14.713 -2.765 26 HA ILE 4 HA ILE 4 -3.157 -14.061 -4.137 27 HB ILE 4 HB ILE 4 -2.010 -12.611 -1.716 28 HG12 ILE 4 2HG1 ILE 4 -3.973 -14.950 -1.773 29 HG13 ILE 4 1HG1 ILE 4 -2.241 -15.155 -1.519 30 HG21 ILE 4 1HG2 ILE 4 -4.855 -12.797 -2.805 31 HG22 ILE 4 2HG2 ILE 4 -3.879 -11.334 -2.668 32 HG23 ILE 4 3HG2 ILE 4 -4.455 -12.139 -1.221 33 HD11 ILE 4 3HD1 ILE 4 -3.457 -15.066 0.626 34 HD12 ILE 4 1HD1 ILE 4 -4.049 -13.458 0.226 35 HD13 ILE 4 2HD1 ILE 4 -2.330 -13.720 0.461 36 H THR 5 H THR 5 -3.846 -12.331 -5.325 37 HA THR 5 HA THR 5 -2.056 -9.977 -5.662 38 HB THR 5 HB THR 5 -3.470 -11.446 -7.929 39 HG1 THR 5 1HG THR 5 -1.792 -12.698 -7.385 40 HG21 THR 5 3HG2 THR 5 -2.081 -9.957 -9.352 41 HG22 THR 5 1HG2 THR 5 -1.477 -9.153 -7.907 42 HG23 THR 5 2HG2 THR 5 -3.182 -9.031 -8.336 43 H VAL 6 H VAL 6 -3.115 -8.101 -5.632 44 HA VAL 6 HA VAL 6 -6.070 -8.005 -5.967 45 HB VAL 6 HB VAL 6 -6.153 -6.428 -4.022 46 HG11 VAL 6 1HG1 VAL 6 -5.038 -9.174 -3.344 47 HG12 VAL 6 2HG1 VAL 6 -6.723 -8.830 -3.732 48 HG13 VAL 6 3HG1 VAL 6 -5.999 -8.150 -2.275 49 HG21 VAL 6 3HG2 VAL 6 -4.232 -6.384 -2.457 50 HG22 VAL 6 1HG2 VAL 6 -3.768 -5.752 -4.034 51 HG23 VAL 6 2HG2 VAL 6 -3.300 -7.383 -3.566 52 H GLU 7 H GLU 7 -6.838 -5.931 -6.557 53 HA GLU 7 HA GLU 7 -4.866 -3.946 -7.507 54 HB2 GLU 7 2HB GLU 7 -7.137 -4.983 -9.261 55 HB3 GLU 7 1HB GLU 7 -5.858 -3.856 -9.706 56 HG2 GLU 7 2HG GLU 7 -5.071 -5.901 -10.615 57 HG3 GLU 7 1HG GLU 7 -4.212 -5.813 -9.088 58 H VAL 8 H VAL 8 -5.823 -1.871 -7.963 59 HA VAL 8 HA VAL 8 -8.564 -1.383 -6.974 60 HB VAL 8 HB VAL 8 -7.178 -1.136 -4.980 61 HG11 VAL 8 1HG1 VAL 8 -5.017 -0.778 -6.038 62 HG12 VAL 8 2HG1 VAL 8 -5.340 0.504 -4.874 63 HG13 VAL 8 3HG1 VAL 8 -5.519 0.818 -6.593 64 HG21 VAL 8 3HG2 VAL 8 -7.867 1.635 -6.036 65 HG22 VAL 8 1HG2 VAL 8 -7.771 1.138 -4.347 66 HG23 VAL 8 2HG2 VAL 8 -9.049 0.503 -5.382 67 H THR 9 H THR 9 -9.543 0.310 -8.003 68 HA THR 9 HA THR 9 -8.118 1.511 -10.284 69 HB THR 9 HB THR 9 -10.366 2.210 -10.972 70 HG1 THR 9 1HG THR 9 -10.931 2.263 -8.555 71 HG21 THR 9 3HG2 THR 9 -10.299 -0.669 -10.033 72 HG22 THR 9 1HG2 THR 9 -9.602 -0.069 -11.539 73 HG23 THR 9 2HG2 THR 9 -11.348 -0.020 -11.290 74 H VAL 10 H VAL 10 -7.096 3.368 -9.871 75 HA VAL 10 HA VAL 10 -8.312 5.387 -8.023 76 HB VAL 10 HB VAL 10 -5.372 4.928 -8.645 77 HG11 VAL 10 1HG1 VAL 10 -5.798 7.282 -8.134 78 HG12 VAL 10 2HG1 VAL 10 -5.055 6.540 -6.723 79 HG13 VAL 10 3HG1 VAL 10 -6.792 6.842 -6.747 80 HG21 VAL 10 3HG2 VAL 10 -7.010 4.300 -6.161 81 HG22 VAL 10 1HG2 VAL 10 -5.260 4.129 -6.296 82 HG23 VAL 10 2HG2 VAL 10 -6.318 3.116 -7.271 83 H TYR 11 H TYR 11 -8.927 7.207 -8.983 84 HA TYR 11 HA TYR 11 -8.064 7.821 -11.758 85 HB2 TYR 11 2HB TYR 11 -10.292 8.981 -10.047 86 HB3 TYR 11 1HB TYR 11 -9.972 9.393 -11.731 87 HD1 TYR 11 1HD TYR 11 -11.051 6.659 -9.438 88 HD2 TYR 11 2HD TYR 11 -10.613 7.874 -13.543 89 HE1 TYR 11 1HE TYR 11 -12.389 4.705 -10.166 90 HE2 TYR 11 2HE TYR 11 -11.951 5.920 -14.261 91 HH TYR 11 HH TYR 11 -13.723 3.984 -12.035 92 H ALA 12 H ALA 12 -5.986 8.609 -11.238 93 HA ALA 12 HA ALA 12 -5.860 11.417 -10.708 94 HB1 ALA 12 1HB ALA 12 -4.731 9.565 -8.585 95 HB2 ALA 12 2HB ALA 12 -6.117 10.636 -8.380 96 HB3 ALA 12 3HB ALA 12 -4.511 11.315 -8.646 97 H ALA 13 H ALA 13 -3.765 12.273 -11.129 98 HA ALA 13 HA ALA 13 -2.242 10.849 -13.046 99 HB1 ALA 13 1HB ALA 13 -1.485 13.282 -11.400 100 HB2 ALA 13 2HB ALA 13 -2.338 13.311 -12.941 101 HB3 ALA 13 3HB ALA 13 -0.671 12.740 -12.869 102 H ILE 14 H ILE 14 -0.454 9.557 -12.845 103 HA ILE 14 HA ILE 14 0.120 8.250 -10.486 104 HB ILE 14 HB ILE 14 0.775 7.427 -12.724 105 HG12 ILE 14 2HG1 ILE 14 3.015 6.501 -12.075 106 HG13 ILE 14 1HG1 ILE 14 3.100 7.632 -10.753 107 HG21 ILE 14 1HG2 ILE 14 2.731 8.290 -13.883 108 HG22 ILE 14 2HG2 ILE 14 3.086 9.407 -12.568 109 HG23 ILE 14 3HG2 ILE 14 1.649 9.646 -13.566 110 HD11 ILE 14 3HD1 ILE 14 0.720 5.771 -10.936 111 HD12 ILE 14 1HD1 ILE 14 1.462 6.507 -9.511 112 HD13 ILE 14 2HD1 ILE 14 2.260 5.174 -10.329 113 H GLU 15 H GLU 15 1.462 11.243 -11.685 114 HA GLU 15 HA GLU 15 3.738 11.437 -10.061 115 HB2 GLU 15 2HB GLU 15 3.199 12.919 -11.990 116 HB3 GLU 15 1HB GLU 15 1.936 13.682 -11.031 117 HG2 GLU 15 2HG GLU 15 3.626 14.432 -9.386 118 HG3 GLU 15 1HG GLU 15 4.887 13.625 -10.312 119 H LYS 16 H LYS 16 0.347 12.284 -9.419 120 HA LYS 16 HA LYS 16 0.881 13.445 -6.822 121 HB2 LYS 16 2HB LYS 16 -1.078 14.081 -8.239 122 HB3 LYS 16 1HB LYS 16 -1.752 12.471 -7.993 123 HG2 LYS 16 2HG LYS 16 -1.834 12.861 -5.554 124 HG3 LYS 16 1HG LYS 16 -1.103 14.451 -5.776 125 HD2 LYS 16 2HD LYS 16 -3.050 15.147 -7.138 126 HD3 LYS 16 1HD LYS 16 -3.779 13.559 -6.899 127 HE2 LYS 16 2HE LYS 16 -3.820 13.939 -4.458 128 HE3 LYS 16 1HE LYS 16 -3.085 15.524 -4.690 129 HZ1 LYS 16 3HZ LYS 16 -5.756 14.612 -5.587 130 HZ2 LYS 16 1HZ LYS 16 -5.036 16.035 -6.160 131 HZ3 LYS 16 2HZ LYS 16 -5.390 15.872 -4.507 132 H VAL 17 H VAL 17 -0.451 10.363 -8.015 133 HA VAL 17 HA VAL 17 -0.960 9.187 -5.499 134 HB VAL 17 HB VAL 17 -0.282 7.821 -8.121 135 HG11 VAL 17 1HG1 VAL 17 -0.160 6.235 -6.257 136 HG12 VAL 17 2HG1 VAL 17 -1.638 5.947 -7.163 137 HG13 VAL 17 3HG1 VAL 17 -1.703 6.815 -5.631 138 HG21 VAL 17 3HG2 VAL 17 -2.951 8.664 -6.946 139 HG22 VAL 17 1HG2 VAL 17 -2.738 7.738 -8.431 140 HG23 VAL 17 2HG2 VAL 17 -2.161 9.400 -8.342 141 H TRP 18 H TRP 18 1.894 9.067 -7.615 142 HA TRP 18 HA TRP 18 3.422 7.219 -6.191 143 HB2 TRP 18 2HB TRP 18 4.074 8.062 -8.408 144 HB3 TRP 18 1HB TRP 18 4.351 9.667 -7.733 145 HD1 TRP 18 HD TRP 18 6.374 9.887 -5.923 146 HE1 TRP 18 1HE TRP 18 8.578 8.571 -5.722 147 HE3 TRP 18 3HE TRP 18 5.240 5.829 -8.806 148 HZ2 TRP 18 2HZ TRP 18 9.713 6.125 -6.660 149 HZ3 TRP 18 3HZ TRP 18 6.904 4.023 -9.137 150 HH2 TRP 18 HH TRP 18 9.139 4.169 -8.067 151 H LYS 19 H LYS 19 3.208 10.731 -5.803 152 HA LYS 19 HA LYS 19 5.094 10.905 -3.671 153 HB2 LYS 19 2HB LYS 19 4.460 12.830 -5.121 154 HB3 LYS 19 1HB LYS 19 2.852 12.818 -4.396 155 HG2 LYS 19 2HG LYS 19 3.786 13.324 -2.196 156 HG3 LYS 19 1HG LYS 19 5.422 13.146 -2.808 157 HD2 LYS 19 2HD LYS 19 4.895 15.516 -2.618 158 HD3 LYS 19 1HD LYS 19 5.071 15.086 -4.318 159 HE2 LYS 19 2HE LYS 19 3.056 16.590 -3.713 160 HE3 LYS 19 1HE LYS 19 2.695 15.176 -4.690 161 HZ1 LYS 19 3HZ LYS 19 1.280 15.702 -2.613 162 HZ2 LYS 19 1HZ LYS 19 2.565 15.000 -1.753 163 HZ3 LYS 19 2HZ LYS 19 1.730 14.093 -2.924 164 H TYR 20 H TYR 20 1.520 10.729 -3.774 165 HA TYR 20 HA TYR 20 1.123 10.947 -0.972 166 HB2 TYR 20 2HB TYR 20 -0.642 11.350 -2.666 167 HB3 TYR 20 1HB TYR 20 -0.630 9.638 -3.074 168 HD1 TYR 20 2HD TYR 20 -1.381 7.926 -1.394 169 HD2 TYR 20 1HD TYR 20 -1.722 12.144 -0.603 170 HE1 TYR 20 2HE TYR 20 -2.930 7.455 0.479 171 HE2 TYR 20 1HE TYR 20 -3.269 11.661 1.272 172 HH TYR 20 HH TYR 20 -4.914 9.636 1.832 173 H TRP 21 H TRP 21 1.439 8.153 -3.133 174 HA TRP 21 HA TRP 21 0.949 6.165 -1.155 175 HB2 TRP 21 2HB TRP 21 0.711 5.864 -3.650 176 HB3 TRP 21 1HB TRP 21 2.467 5.870 -3.785 177 HD1 TRP 21 HD TRP 21 3.704 3.606 -3.228 178 HE1 TRP 21 1HE TRP 21 2.917 1.292 -2.402 179 HE3 TRP 21 3HE TRP 21 -1.159 4.678 -2.133 180 HZ2 TRP 21 2HZ TRP 21 0.526 0.061 -1.414 181 HZ3 TRP 21 3HZ TRP 21 -2.673 2.925 -1.269 182 HH2 TRP 21 HH TRP 21 -1.840 0.617 -0.901 183 H ASN 22 H ASN 22 3.759 8.041 -1.950 184 HA ASN 22 HA ASN 22 5.630 6.192 -0.550 185 HB2 ASN 22 2HB ASN 22 6.137 8.634 -2.274 186 HB3 ASN 22 1HB ASN 22 7.391 7.628 -1.549 187 HD21 ASN 22 1HD2 ASN 22 5.783 5.096 -2.095 188 HD22 ASN 22 2HD2 ASN 22 5.965 4.834 -3.761 189 H GLU 23 H GLU 23 4.002 9.247 -0.233 190 HA GLU 23 HA GLU 23 5.790 10.502 1.587 191 HB2 GLU 23 2HB GLU 23 2.960 10.933 0.702 192 HB3 GLU 23 1HB GLU 23 3.353 11.629 2.267 193 HG2 GLU 23 2HG GLU 23 4.983 12.153 -0.253 194 HG3 GLU 23 1HG GLU 23 3.691 13.209 0.311 195 HA PRO 24 HA PRO 24 4.730 7.809 5.083 196 HB2 PRO 24 2HB PRO 24 6.065 9.029 7.131 197 HB3 PRO 24 1HB PRO 24 6.928 8.193 5.827 198 HG2 PRO 24 2HG PRO 24 6.361 11.140 6.107 199 HG3 PRO 24 1HG PRO 24 7.899 10.339 5.712 200 HD2 PRO 24 2HD PRO 24 6.280 11.398 3.761 201 HD3 PRO 24 1HD PRO 24 7.263 9.938 3.466 202 H ALA 25 H ALA 25 4.422 11.329 5.492 203 HA ALA 25 HA ALA 25 2.685 11.369 7.676 204 HB1 ALA 25 1HB ALA 25 2.028 13.608 6.920 205 HB2 ALA 25 2HB ALA 25 2.733 13.289 5.333 206 HB3 ALA 25 3HB ALA 25 3.772 13.380 6.754 207 H HIS 26 H HIS 26 2.010 10.888 4.256 208 HA HIS 26 HA HIS 26 -0.859 11.000 4.507 209 HB2 HIS 26 2HB HIS 26 1.007 10.008 2.326 210 HB3 HIS 26 1HB HIS 26 -0.746 9.976 2.165 211 HD2 HIS 26 2HD HIS 26 -1.686 12.877 3.055 212 HE1 HIS 26 1HE HIS 26 1.441 14.460 0.705 213 HE2 HIS 26 2HE HIS 26 -0.737 15.010 1.888 214 H ILE 27 H ILE 27 1.494 8.275 4.267 215 HA ILE 27 HA ILE 27 -0.454 6.223 4.252 216 HB ILE 27 HB ILE 27 2.424 6.225 5.224 217 HG12 ILE 27 2HG1 ILE 27 1.278 5.158 2.602 218 HG13 ILE 27 1HG1 ILE 27 1.912 6.791 2.764 219 HG21 ILE 27 1HG2 ILE 27 1.368 4.271 6.227 220 HG22 ILE 27 2HG2 ILE 27 2.272 3.697 4.835 221 HG23 ILE 27 3HG2 ILE 27 0.524 3.893 4.728 222 HD11 ILE 27 3HD1 ILE 27 3.623 5.247 1.879 223 HD12 ILE 27 1HD1 ILE 27 3.479 4.257 3.330 224 HD13 ILE 27 2HD1 ILE 27 4.097 5.906 3.442 225 H MET 28 H MET 28 1.391 7.580 7.017 226 HA MET 28 HA MET 28 0.213 5.948 8.984 227 HB2 MET 28 2HB MET 28 1.153 7.479 10.603 228 HB3 MET 28 1HB MET 28 2.295 7.286 9.283 229 HG2 MET 28 2HG MET 28 1.339 9.415 8.284 230 HG3 MET 28 1HG MET 28 0.453 9.651 9.782 231 HE1 MET 28 3HE MET 28 1.882 9.185 12.171 232 HE2 MET 28 1HE MET 28 1.378 10.834 11.775 233 HE3 MET 28 2HE MET 28 2.992 10.529 12.407 234 H LYS 29 H LYS 29 -1.152 8.569 7.236 235 HA LYS 29 HA LYS 29 -3.047 9.441 9.213 236 HB2 LYS 29 2HB LYS 29 -2.241 10.810 7.262 237 HB3 LYS 29 1HB LYS 29 -3.192 9.780 6.202 238 HG2 LYS 29 2HG LYS 29 -5.251 10.402 7.393 239 HG3 LYS 29 1HG LYS 29 -4.313 11.404 8.502 240 HD2 LYS 29 2HD LYS 29 -3.564 12.805 6.596 241 HD3 LYS 29 1HD LYS 29 -4.523 11.811 5.499 242 HE2 LYS 29 2HE LYS 29 -6.577 12.445 6.714 243 HE3 LYS 29 1HE LYS 29 -5.619 13.438 7.813 244 HZ1 LYS 29 3HZ LYS 29 -4.889 14.756 5.921 245 HZ2 LYS 29 1HZ LYS 29 -6.579 14.773 6.056 246 HZ3 LYS 29 2HZ LYS 29 -5.833 13.807 4.874 247 H TRP 30 H TRP 30 -3.047 6.962 6.710 248 HA TRP 30 HA TRP 30 -5.722 6.013 7.614 249 HB2 TRP 30 2HB TRP 30 -6.325 5.470 5.293 250 HB3 TRP 30 1HB TRP 30 -6.029 7.197 5.463 251 HD1 TRP 30 HD TRP 30 -3.801 8.172 4.384 252 HE1 TRP 30 1HE TRP 30 -2.211 7.271 2.555 253 HE3 TRP 30 3HE TRP 30 -5.372 3.320 4.157 254 HZ2 TRP 30 2HZ TRP 30 -1.685 4.820 1.176 255 HZ3 TRP 30 3HZ TRP 30 -4.326 1.730 2.599 256 HH2 TRP 30 HH TRP 30 -2.488 2.464 1.106 257 H CYS 31 H CYS 31 -2.659 5.229 7.858 258 HA CYS 31 HA CYS 31 -2.210 2.793 6.577 259 HB2 CYS 31 2HB CYS 31 -0.452 3.885 7.839 260 HB3 CYS 31 1HB CYS 31 -1.409 3.796 9.309 261 HG CYS 31 HG CYS 31 0.096 1.408 7.997 262 H GLN 32 H GLN 32 -2.897 0.743 6.895 263 HA GLN 32 HA GLN 32 -4.049 -1.053 7.674 264 HB2 GLN 32 2HB GLN 32 -2.991 -0.313 9.939 265 HB3 GLN 32 1HB GLN 32 -4.562 0.379 10.309 266 HG2 GLN 32 2HG GLN 32 -4.546 -1.838 11.264 267 HG3 GLN 32 1HG GLN 32 -5.585 -1.907 9.846 268 HE21 GLN 32 1HE2 GLN 32 -5.231 -3.914 8.880 269 HE22 GLN 32 2HE2 GLN 32 -3.705 -4.608 8.616 270 H ALA 33 H ALA 33 -5.426 2.104 8.267 271 HA ALA 33 HA ALA 33 -7.510 2.983 7.989 272 HB1 ALA 33 1HB ALA 33 -7.968 0.613 6.148 273 HB2 ALA 33 2HB ALA 33 -7.099 2.071 5.672 274 HB3 ALA 33 3HB ALA 33 -8.808 2.162 6.112 275 H SER 34 H SER 34 -7.094 1.209 10.222 276 HA SER 34 HA SER 34 -9.852 0.169 10.634 277 HB2 SER 34 2HB SER 34 -7.243 -1.083 11.511 278 HB3 SER 34 1HB SER 34 -8.844 -1.667 11.957 279 HG SER 34 HG SER 34 -8.630 -2.763 10.164 280 HA PRO 35 HA PRO 35 -9.419 2.808 14.292 281 HB2 PRO 35 2HB PRO 35 -11.623 2.127 15.730 282 HB3 PRO 35 1HB PRO 35 -11.777 2.944 14.154 283 HG2 PRO 35 2HG PRO 35 -11.951 -0.010 14.751 284 HG3 PRO 35 1HG PRO 35 -13.092 1.004 13.837 285 HD2 PRO 35 2HD PRO 35 -11.190 -0.494 12.558 286 HD3 PRO 35 1HD PRO 35 -11.681 1.104 11.934 287 H GLU 36 H GLU 36 -9.105 -0.575 14.323 288 HA GLU 36 HA GLU 36 -8.619 -0.883 17.202 289 HB2 GLU 36 2HB GLU 36 -8.360 -2.793 14.854 290 HB3 GLU 36 1HB GLU 36 -8.092 -3.244 16.540 291 HG2 GLU 36 2HG GLU 36 -10.404 -2.590 17.090 292 HG3 GLU 36 1HG GLU 36 -10.678 -2.117 15.416 293 H TRP 37 H TRP 37 -6.915 0.611 14.911 294 HA TRP 37 HA TRP 37 -4.351 0.129 16.231 295 HB2 TRP 37 2HB TRP 37 -4.771 -0.450 13.276 296 HB3 TRP 37 1HB TRP 37 -3.188 -0.292 14.041 297 HD1 TRP 37 HD TRP 37 -6.150 -2.652 13.786 298 HE1 TRP 37 1HE TRP 37 -5.529 -4.914 14.847 299 HE3 TRP 37 3HE TRP 37 -1.694 -1.412 15.928 300 HZ2 TRP 37 2HZ TRP 37 -3.414 -6.047 16.415 301 HZ3 TRP 37 3HZ TRP 37 -0.401 -3.099 17.199 302 HH2 TRP 37 HH TRP 37 -1.254 -5.410 17.444 303 H HIS 38 H HIS 38 -2.779 1.683 15.748 304 HA HIS 38 HA HIS 38 -3.534 4.037 14.151 305 HB2 HIS 38 2HB HIS 38 -4.477 4.440 16.442 306 HB3 HIS 38 1HB HIS 38 -2.863 4.237 17.118 307 HD2 HIS 38 2HD HIS 38 -1.367 6.577 17.119 308 HE1 HIS 38 1HE HIS 38 -3.735 8.782 14.408 309 HE2 HIS 38 2HE HIS 38 -1.723 8.886 15.953 310 H VAL 39 H VAL 39 -1.703 5.547 13.986 311 HA VAL 39 HA VAL 39 0.972 4.283 14.347 312 HB VAL 39 HB VAL 39 -0.032 5.864 11.966 313 HG11 VAL 39 1HG1 VAL 39 2.660 4.557 12.526 314 HG12 VAL 39 2HG1 VAL 39 2.362 6.287 12.366 315 HG13 VAL 39 3HG1 VAL 39 2.174 5.231 10.970 316 HG21 VAL 39 3HG2 VAL 39 -0.973 3.634 11.886 317 HG22 VAL 39 1HG2 VAL 39 0.555 2.899 12.375 318 HG23 VAL 39 2HG2 VAL 39 0.406 3.634 10.786 319 HA PRO 40 HA PRO 40 0.965 8.545 16.185 320 HB2 PRO 40 2HB PRO 40 2.466 8.095 18.409 321 HB3 PRO 40 1HB PRO 40 0.765 7.582 18.323 322 HG2 PRO 40 2HG PRO 40 3.252 5.932 17.928 323 HG3 PRO 40 1HG PRO 40 1.777 5.531 18.835 324 HD2 PRO 40 2HD PRO 40 2.268 4.654 16.244 325 HD3 PRO 40 1HD PRO 40 0.626 4.846 16.903 326 H ALA 41 H ALA 41 3.256 6.634 14.683 327 HA ALA 41 HA ALA 41 4.915 8.874 14.012 328 HB1 ALA 41 1HB ALA 41 6.153 6.713 15.743 329 HB2 ALA 41 2HB ALA 41 5.875 8.381 16.230 330 HB3 ALA 41 3HB ALA 41 7.028 8.019 14.946 331 H ALA 42 H ALA 42 6.360 8.400 12.330 332 HA ALA 42 HA ALA 42 6.761 5.758 11.315 333 HB1 ALA 42 1HB ALA 42 4.876 7.546 9.754 334 HB2 ALA 42 2HB ALA 42 4.416 6.077 10.609 335 HB3 ALA 42 3HB ALA 42 5.500 5.982 9.223 336 H GLN 43 H GLN 43 8.238 5.684 9.594 337 HA GLN 43 HA GLN 43 9.395 8.258 8.658 338 HB2 GLN 43 2HB GLN 43 10.997 5.915 9.749 339 HB3 GLN 43 1HB GLN 43 11.665 7.390 9.054 340 HG2 GLN 43 2HG GLN 43 9.944 7.252 11.553 341 HG3 GLN 43 1HG GLN 43 11.690 7.449 11.531 342 HE21 GLN 43 1HE2 GLN 43 11.998 9.346 9.452 343 HE22 GLN 43 2HE2 GLN 43 11.237 10.793 9.909 344 H ASN 44 H ASN 44 10.430 8.150 6.672 345 HA ASN 44 HA ASN 44 10.650 5.677 5.179 346 HB2 ASN 44 2HB ASN 44 8.199 6.224 4.996 347 HB3 ASN 44 1HB ASN 44 8.636 7.748 4.230 348 HD21 ASN 44 1HD2 ASN 44 7.660 7.145 2.181 349 HD22 ASN 44 2HD2 ASN 44 8.355 5.960 1.184 350 H ASP 45 H ASP 45 12.264 5.880 3.754 351 HA ASP 45 HA ASP 45 13.077 8.571 2.750 352 HB2 ASP 45 2HB ASP 45 14.587 7.804 4.579 353 HB3 ASP 45 1HB ASP 45 14.918 6.333 3.672 354 H LEU 46 H LEU 46 12.156 8.259 0.738 355 HA LEU 46 HA LEU 46 12.261 5.862 -0.755 356 HB2 LEU 46 2HB LEU 46 10.661 7.699 -1.212 357 HB3 LEU 46 1HB LEU 46 11.994 8.729 -1.718 358 HG LEU 46 HG LEU 46 12.491 7.145 -3.581 359 HD11 LEU 46 1HD1 LEU 46 10.187 5.586 -2.378 360 HD12 LEU 46 2HD1 LEU 46 11.757 5.003 -2.939 361 HD13 LEU 46 3HD1 LEU 46 10.532 5.467 -4.106 362 HD21 LEU 46 3HD2 LEU 46 9.605 8.077 -3.522 363 HD22 LEU 46 1HD2 LEU 46 10.551 7.716 -4.967 364 HD23 LEU 46 2HD2 LEU 46 10.996 9.081 -3.943 365 H LYS 47 H LYS 47 14.359 5.023 -0.808 366 HA LYS 47 HA LYS 47 16.061 6.021 -2.883 367 HB2 LYS 47 2HB LYS 47 16.639 7.589 -1.000 368 HB3 LYS 47 1HB LYS 47 17.150 6.203 -0.043 369 HG2 LYS 47 2HG LYS 47 18.862 5.642 -1.722 370 HG3 LYS 47 1HG LYS 47 18.318 6.973 -2.744 371 HD2 LYS 47 2HD LYS 47 18.918 8.580 -0.956 372 HD3 LYS 47 1HD LYS 47 19.476 7.242 0.050 373 HE2 LYS 47 2HE LYS 47 21.373 8.313 -1.113 374 HE3 LYS 47 1HE LYS 47 21.158 6.651 -1.665 375 HZ1 LYS 47 3HZ LYS 47 19.981 7.447 -3.589 376 HZ2 LYS 47 1HZ LYS 47 21.487 8.224 -3.501 377 HZ3 LYS 47 2HZ LYS 47 20.075 9.052 -3.042 378 H ALA 48 H ALA 48 17.425 4.418 -3.608 379 HA ALA 48 HA ALA 48 16.928 1.752 -2.856 380 HB1 ALA 48 1HB ALA 48 18.832 1.209 -4.320 381 HB2 ALA 48 2HB ALA 48 19.306 2.909 -4.338 382 HB3 ALA 48 3HB ALA 48 17.782 2.412 -5.070 383 H GLY 49 H GLY 49 17.926 0.369 -1.456 384 HA2 GLY 49 2HA GLY 49 19.356 -0.416 0.178 385 HA3 GLY 49 1HA GLY 49 20.510 0.833 -0.282 386 H GLY 50 H GLY 50 17.604 2.324 0.223 387 HA2 GLY 50 2HA GLY 50 18.435 3.527 2.730 388 HA3 GLY 50 1HA GLY 50 16.966 3.882 1.823 389 H THR 51 H THR 51 17.379 3.342 4.722 390 HA THR 51 HA THR 51 15.647 0.938 5.101 391 HB THR 51 HB THR 51 16.583 0.710 7.290 392 HG1 THR 51 1HG THR 51 16.632 3.198 7.382 393 HG21 THR 51 3HG2 THR 51 18.899 1.621 5.547 394 HG22 THR 51 1HG2 THR 51 18.120 0.046 5.394 395 HG23 THR 51 2HG2 THR 51 18.967 0.470 6.881 396 H PHE 52 H PHE 52 13.986 1.102 6.694 397 HA PHE 52 HA PHE 52 13.194 3.706 7.731 398 HB2 PHE 52 2HB PHE 52 11.002 3.710 6.603 399 HB3 PHE 52 1HB PHE 52 12.318 3.835 5.440 400 HD1 PHE 52 2HD PHE 52 12.999 1.844 4.072 401 HD2 PHE 52 1HD PHE 52 9.569 1.714 6.667 402 HE1 PHE 52 2HE PHE 52 12.202 -0.201 2.924 403 HE2 PHE 52 1HE PHE 52 8.785 -0.336 5.520 404 HZ PHE 52 HZ PHE 52 10.099 -1.289 3.650 405 H THR 53 H THR 53 11.082 3.493 8.931 406 HA THR 53 HA THR 53 10.315 0.817 9.804 407 HB THR 53 HB THR 53 11.533 2.760 11.808 408 HG1 THR 53 1HG THR 53 12.571 0.299 10.868 409 HG21 THR 53 3HG2 THR 53 10.586 -0.120 12.057 410 HG22 THR 53 1HG2 THR 53 9.803 1.292 12.768 411 HG23 THR 53 2HG2 THR 53 11.398 0.795 13.326 412 H THR 54 H THR 54 8.282 0.801 10.661 413 HA THR 54 HA THR 54 6.879 3.403 11.031 414 HB THR 54 HB THR 54 5.713 0.826 9.924 415 HG1 THR 54 1HG THR 54 6.275 3.233 8.553 416 HG21 THR 54 3HG2 THR 54 4.051 2.261 11.049 417 HG22 THR 54 1HG2 THR 54 3.817 2.310 9.303 418 HG23 THR 54 2HG2 THR 54 4.613 3.652 10.123 419 H THR 55 H THR 55 6.237 3.680 13.093 420 HA THR 55 HA THR 55 6.116 1.405 14.942 421 HB THR 55 HB THR 55 5.546 4.365 15.408 422 HG1 THR 55 1HG THR 55 7.755 4.080 16.374 423 HG21 THR 55 3HG2 THR 55 6.060 3.780 17.770 424 HG22 THR 55 1HG2 THR 55 6.200 2.085 17.310 425 HG23 THR 55 2HG2 THR 55 4.647 2.911 17.181 426 H MET 56 H MET 56 4.265 0.207 14.874 427 HA MET 56 HA MET 56 1.633 1.606 14.773 428 HB2 MET 56 2HB MET 56 2.197 0.427 12.616 429 HB3 MET 56 1HB MET 56 2.305 -1.083 13.511 430 HG2 MET 56 2HG MET 56 -0.052 -0.827 14.227 431 HG3 MET 56 1HG MET 56 -0.152 0.695 13.353 432 HE1 MET 56 3HE MET 56 -0.183 -3.567 11.692 433 HE2 MET 56 1HE MET 56 -0.784 -2.992 13.252 434 HE3 MET 56 2HE MET 56 0.946 -3.041 12.936 435 H ALA 57 H ALA 57 0.769 1.380 16.739 436 HA ALA 57 HA ALA 57 0.904 -1.251 18.124 437 HB1 ALA 57 1HB ALA 57 2.493 0.306 19.182 438 HB2 ALA 57 2HB ALA 57 1.144 -0.057 20.257 439 HB3 ALA 57 3HB ALA 57 1.197 1.482 19.394 440 H ALA 58 H ALA 58 -0.946 -1.915 19.092 441 HA ALA 58 HA ALA 58 -3.421 -0.877 18.215 442 HB1 ALA 58 1HB ALA 58 -3.146 -3.195 18.977 443 HB2 ALA 58 2HB ALA 58 -4.439 -2.387 19.861 444 HB3 ALA 58 3HB ALA 58 -2.866 -2.628 20.623 445 H LYS 59 H LYS 59 -5.016 0.352 19.295 446 HA LYS 59 HA LYS 59 -4.092 2.560 20.774 447 HB2 LYS 59 2HB LYS 59 -6.894 1.415 20.510 448 HB3 LYS 59 1HB LYS 59 -6.532 2.995 21.210 449 HG2 LYS 59 2HG LYS 59 -5.491 3.705 19.083 450 HG3 LYS 59 1HG LYS 59 -5.856 2.130 18.378 451 HD2 LYS 59 2HD LYS 59 -8.272 2.531 18.731 452 HD3 LYS 59 1HD LYS 59 -7.909 4.106 19.430 453 HE2 LYS 59 2HE LYS 59 -6.893 4.829 17.306 454 HE3 LYS 59 1HE LYS 59 -7.226 3.249 16.598 455 HZ1 LYS 59 3HZ LYS 59 -8.953 5.472 16.880 456 HZ2 LYS 59 1HZ LYS 59 -9.607 4.132 17.688 457 HZ3 LYS 59 2HZ LYS 59 -9.209 4.019 16.040 458 H ASP 60 H ASP 60 -5.500 -0.513 21.809 459 HA ASP 60 HA ASP 60 -5.675 0.186 24.610 460 HB2 ASP 60 2HB ASP 60 -5.703 -2.500 23.196 461 HB3 ASP 60 1HB ASP 60 -6.101 -2.247 24.895 462 H GLY 61 H GLY 61 -3.144 -0.566 22.506 463 HA2 GLY 61 2HA GLY 61 -0.892 -0.898 22.839 464 HA3 GLY 61 1HA GLY 61 -1.150 -0.524 24.541 465 H SER 62 H SER 62 -3.101 -3.043 23.237 466 HA SER 62 HA SER 62 -2.165 -4.989 25.046 467 HB2 SER 62 2HB SER 62 -4.419 -5.023 24.059 468 HB3 SER 62 1HB SER 62 -3.726 -5.348 22.473 469 HG SER 62 HG SER 62 -3.364 -6.960 24.784 470 H MET 63 H MET 63 -1.485 -4.439 21.606 471 HA MET 63 HA MET 63 0.982 -6.049 21.817 472 HB2 MET 63 2HB MET 63 -0.823 -7.580 21.002 473 HB3 MET 63 1HB MET 63 -1.113 -6.479 19.657 474 HG2 MET 63 2HG MET 63 1.146 -6.858 18.797 475 HG3 MET 63 1HG MET 63 1.573 -7.802 20.218 476 HE1 MET 63 3HE MET 63 -0.995 -9.053 16.635 477 HE2 MET 63 1HE MET 63 -0.129 -7.536 16.887 478 HE3 MET 63 2HE MET 63 -1.656 -7.831 17.713 479 H SER 64 H SER 64 2.583 -5.427 20.382 480 HA SER 64 HA SER 64 2.041 -3.331 18.390 481 HB2 SER 64 2HB SER 64 2.599 -2.088 20.446 482 HB3 SER 64 1HB SER 64 4.080 -3.026 20.613 483 HG SER 64 HG SER 64 4.759 -1.313 19.501 484 H PHE 65 H PHE 65 3.717 -3.093 16.839 485 HA PHE 65 HA PHE 65 5.989 -4.930 16.902 486 HB2 PHE 65 2HB PHE 65 4.091 -6.319 16.025 487 HB3 PHE 65 1HB PHE 65 3.896 -5.172 14.707 488 HD1 PHE 65 1HD PHE 65 6.091 -7.781 16.154 489 HD2 PHE 65 2HD PHE 65 5.586 -5.012 12.900 490 HE1 PHE 65 1HE PHE 65 7.893 -8.925 14.897 491 HE2 PHE 65 2HE PHE 65 7.387 -6.163 11.647 492 HZ PHE 65 HZ PHE 65 8.540 -8.118 12.644 493 H ASP 66 H ASP 66 7.608 -4.275 15.579 494 HA ASP 66 HA ASP 66 7.353 -1.596 14.345 495 HB2 ASP 66 2HB ASP 66 9.783 -3.310 14.973 496 HB3 ASP 66 1HB ASP 66 9.828 -1.672 14.322 497 H PHE 67 H PHE 67 6.679 -1.700 12.261 498 HA PHE 67 HA PHE 67 7.567 -3.909 10.502 499 HB2 PHE 67 2HB PHE 67 5.154 -3.295 10.561 500 HB3 PHE 67 1HB PHE 67 5.561 -1.679 9.992 501 HD1 PHE 67 1HD PHE 67 5.445 -5.277 9.074 502 HD2 PHE 67 2HD PHE 67 6.291 -1.303 7.661 503 HE1 PHE 67 1HE PHE 67 5.479 -6.110 6.742 504 HE2 PHE 67 2HE PHE 67 6.320 -2.143 5.329 505 HZ PHE 67 HZ PHE 67 5.913 -4.546 4.872 506 H GLY 68 H GLY 68 9.109 -3.615 9.003 507 HA2 GLY 68 2HA GLY 68 9.661 -1.092 7.729 508 HA3 GLY 68 1HA GLY 68 10.892 -1.529 8.915 509 H GLY 69 H GLY 69 11.833 -1.313 6.500 510 HA2 GLY 69 2HA GLY 69 12.854 -3.888 5.850 511 HA3 GLY 69 1HA GLY 69 11.640 -3.397 4.665 512 H VAL 70 H VAL 70 13.747 -3.604 3.353 513 HA VAL 70 HA VAL 70 15.100 -0.941 3.200 514 HB VAL 70 HB VAL 70 16.340 -3.658 2.593 515 HG11 VAL 70 1HG1 VAL 70 18.452 -2.341 2.544 516 HG12 VAL 70 2HG1 VAL 70 17.521 -0.861 2.775 517 HG13 VAL 70 3HG1 VAL 70 17.321 -1.808 1.302 518 HG21 VAL 70 3HG2 VAL 70 15.938 -3.469 5.002 519 HG22 VAL 70 1HG2 VAL 70 16.641 -1.854 5.027 520 HG23 VAL 70 2HG2 VAL 70 17.656 -3.255 4.687 521 H TYR 71 H TYR 71 15.004 0.003 1.240 522 HA TYR 71 HA TYR 71 13.443 -1.169 -0.884 523 HB2 TYR 71 2HB TYR 71 15.119 1.362 -0.765 524 HB3 TYR 71 1HB TYR 71 14.067 0.930 -2.112 525 HD1 TYR 71 1HD TYR 71 11.578 0.491 -1.635 526 HD2 TYR 71 2HD TYR 71 14.162 2.470 1.189 527 HE1 TYR 71 1HE TYR 71 9.604 1.404 -0.457 528 HE2 TYR 71 2HE TYR 71 12.174 3.382 2.353 529 HH TYR 71 HH TYR 71 9.192 3.534 1.071 530 H ASP 72 H ASP 72 14.229 -2.720 -2.179 531 HA ASP 72 HA ASP 72 17.055 -3.196 -2.554 532 HB2 ASP 72 2HB ASP 72 15.399 -5.034 -2.535 533 HB3 ASP 72 1HB ASP 72 14.653 -4.375 -3.988 534 H GLN 73 H GLN 73 14.386 -2.057 -4.619 535 HA GLN 73 HA GLN 73 16.316 -0.598 -6.345 536 HB2 GLN 73 2HB GLN 73 14.085 -2.395 -7.382 537 HB3 GLN 73 1HB GLN 73 15.137 -1.383 -8.368 538 HG2 GLN 73 2HG GLN 73 16.055 -3.701 -6.637 539 HG3 GLN 73 1HG GLN 73 15.869 -3.744 -8.382 540 HE21 GLN 73 1HE2 GLN 73 18.264 -3.599 -6.189 541 HE22 GLN 73 2HE2 GLN 73 19.375 -2.608 -7.004 542 H VAL 74 H VAL 74 15.597 1.360 -6.983 543 HA VAL 74 HA VAL 74 12.742 2.099 -6.554 544 HB VAL 74 HB VAL 74 15.159 3.780 -5.777 545 HG11 VAL 74 1HG1 VAL 74 13.217 5.128 -6.479 546 HG12 VAL 74 2HG1 VAL 74 13.433 5.237 -4.739 547 HG13 VAL 74 3HG1 VAL 74 12.171 4.200 -5.404 548 HG21 VAL 74 3HG2 VAL 74 14.402 3.373 -3.444 549 HG22 VAL 74 1HG2 VAL 74 14.874 1.873 -4.243 550 HG23 VAL 74 2HG2 VAL 74 13.166 2.268 -4.047 551 H LYS 75 H LYS 75 11.904 2.963 -8.367 552 HA LYS 75 HA LYS 75 13.569 4.577 -10.199 553 HB2 LYS 75 2HB LYS 75 12.015 2.080 -10.967 554 HB3 LYS 75 1HB LYS 75 12.534 3.285 -12.151 555 HG2 LYS 75 2HG LYS 75 14.894 2.916 -11.445 556 HG3 LYS 75 1HG LYS 75 14.352 1.673 -10.318 557 HD2 LYS 75 2HD LYS 75 13.412 0.366 -12.189 558 HD3 LYS 75 1HD LYS 75 13.942 1.606 -13.325 559 HE2 LYS 75 2HE LYS 75 15.549 -0.265 -13.257 560 HE3 LYS 75 1HE LYS 75 16.291 1.220 -12.659 561 HZ1 LYS 75 3HZ LYS 75 16.313 0.463 -10.527 562 HZ2 LYS 75 1HZ LYS 75 16.471 -1.020 -11.335 563 HZ3 LYS 75 2HZ LYS 75 14.956 -0.540 -10.733 564 H THR 76 H THR 76 12.484 6.446 -10.232 565 HA THR 76 HA THR 76 9.956 7.007 -9.375 566 HB THR 76 HB THR 76 11.306 8.430 -11.693 567 HG1 THR 76 1HG THR 76 11.612 9.031 -8.963 568 HG21 THR 76 3HG2 THR 76 10.195 10.420 -10.744 569 HG22 THR 76 1HG2 THR 76 9.445 9.416 -9.506 570 HG23 THR 76 2HG2 THR 76 9.005 9.205 -11.201 571 H ASN 77 H ASN 77 8.016 6.261 -9.970 572 HA ASN 77 HA ASN 77 6.270 5.456 -11.217 573 HB2 ASN 77 2HB ASN 77 7.474 7.289 -13.306 574 HB3 ASN 77 1HB ASN 77 5.828 6.657 -13.316 575 HD21 ASN 77 1HD2 ASN 77 5.457 6.939 -10.382 576 HD22 ASN 77 2HD2 ASN 77 5.318 8.603 -10.083 577 H ASP 78 H ASP 78 7.532 3.354 -11.145 578 HA ASP 78 HA ASP 78 7.473 2.124 -13.736 579 HB2 ASP 78 2HB ASP 78 9.652 3.254 -13.933 580 HB3 ASP 78 1HB ASP 78 10.174 2.526 -12.427 581 H LEU 79 H LEU 79 9.434 1.537 -10.782 582 HA LEU 79 HA LEU 79 7.675 -0.708 -10.032 583 HB2 LEU 79 2HB LEU 79 9.475 -1.514 -11.715 584 HB3 LEU 79 1HB LEU 79 10.651 -1.188 -10.454 585 HG LEU 79 HG LEU 79 8.934 -2.708 -8.973 586 HD11 LEU 79 1HD1 LEU 79 7.355 -2.972 -10.904 587 HD12 LEU 79 2HD1 LEU 79 7.935 -4.504 -10.265 588 HD13 LEU 79 3HD1 LEU 79 8.603 -3.866 -11.768 589 HD21 LEU 79 3HD2 LEU 79 11.314 -3.248 -9.297 590 HD22 LEU 79 1HD2 LEU 79 10.977 -3.861 -10.914 591 HD23 LEU 79 2HD2 LEU 79 10.336 -4.699 -9.500 592 H ILE 80 H ILE 80 7.564 -0.928 -7.877 593 HA ILE 80 HA ILE 80 9.674 0.261 -6.127 594 HB ILE 80 HB ILE 80 6.664 0.404 -5.687 595 HG12 ILE 80 2HG1 ILE 80 8.636 2.660 -6.227 596 HG13 ILE 80 1HG1 ILE 80 7.586 1.972 -7.459 597 HG21 ILE 80 1HG2 ILE 80 9.006 1.444 -4.043 598 HG22 ILE 80 2HG2 ILE 80 7.871 0.184 -3.554 599 HG23 ILE 80 3HG2 ILE 80 7.319 1.840 -3.727 600 HD11 ILE 80 3HD1 ILE 80 6.961 4.102 -5.754 601 HD12 ILE 80 1HD1 ILE 80 6.030 2.758 -5.087 602 HD13 ILE 80 2HD1 ILE 80 5.835 3.220 -6.776 603 H GLU 81 H GLU 81 10.493 -1.241 -4.778 604 HA GLU 81 HA GLU 81 8.806 -3.310 -3.607 605 HB2 GLU 81 2HB GLU 81 10.310 -5.153 -4.368 606 HB3 GLU 81 1HB GLU 81 9.435 -4.402 -5.702 607 HG2 GLU 81 2HG GLU 81 11.414 -3.025 -6.236 608 HG3 GLU 81 1HG GLU 81 12.305 -3.779 -4.918 609 H TYR 82 H TYR 82 9.782 -4.282 -1.798 610 HA TYR 82 HA TYR 82 12.453 -3.428 -0.953 611 HB2 TYR 82 2HB TYR 82 11.574 -2.503 1.200 612 HB3 TYR 82 1HB TYR 82 11.121 -1.538 -0.200 613 HD1 TYR 82 2HD TYR 82 8.815 -1.869 -1.254 614 HD2 TYR 82 1HD TYR 82 9.833 -3.479 2.605 615 HE1 TYR 82 2HE TYR 82 6.411 -2.100 -0.708 616 HE2 TYR 82 1HE TYR 82 7.427 -3.691 3.137 617 HH TYR 82 HH TYR 82 4.931 -2.482 0.949 618 H THR 83 H THR 83 13.269 -4.684 0.793 619 HA THR 83 HA THR 83 12.138 -7.360 0.885 620 HB THR 83 HB THR 83 14.571 -6.213 2.307 621 HG1 THR 83 1HG THR 83 14.673 -7.778 -0.004 622 HG21 THR 83 3HG2 THR 83 13.747 -9.060 1.631 623 HG22 THR 83 1HG2 THR 83 13.824 -8.363 3.249 624 HG23 THR 83 2HG2 THR 83 15.300 -8.592 2.318 625 H ILE 84 H ILE 84 10.861 -8.142 2.454 626 HA ILE 84 HA ILE 84 10.059 -6.469 4.701 627 HB ILE 84 HB ILE 84 9.233 -9.333 4.105 628 HG12 ILE 84 2HG1 ILE 84 8.817 -8.068 2.067 629 HG13 ILE 84 1HG1 ILE 84 7.282 -8.311 2.882 630 HG21 ILE 84 1HG2 ILE 84 8.598 -8.489 6.329 631 HG22 ILE 84 2HG2 ILE 84 7.174 -8.682 5.307 632 HG23 ILE 84 3HG2 ILE 84 7.844 -7.076 5.586 633 HD11 ILE 84 3HD1 ILE 84 7.674 -5.964 3.903 634 HD12 ILE 84 1HD1 ILE 84 7.239 -6.063 2.198 635 HD13 ILE 84 2HD1 ILE 84 8.913 -5.791 2.660 636 H GLY 85 H GLY 85 10.425 -6.881 6.867 637 HA2 GLY 85 2HA GLY 85 12.865 -8.002 7.642 638 HA3 GLY 85 1HA GLY 85 11.525 -7.666 8.733 639 H ASP 86 H ASP 86 9.588 -9.443 7.656 640 HA ASP 86 HA ASP 86 10.296 -11.881 8.914 641 HB2 ASP 86 2HB ASP 86 7.986 -11.016 8.729 642 HB3 ASP 86 1HB ASP 86 8.035 -11.262 6.990 643 H GLY 87 H GLY 87 11.251 -10.660 5.970 644 HA2 GLY 87 2HA GLY 87 12.651 -11.678 4.400 645 HA3 GLY 87 1HA GLY 87 12.227 -13.263 5.037 646 H ARG 88 H ARG 88 9.377 -11.600 4.628 647 HA ARG 88 HA ARG 88 8.528 -13.184 2.403 648 HB2 ARG 88 2HB ARG 88 7.294 -10.729 3.707 649 HB3 ARG 88 1HB ARG 88 6.489 -11.695 2.472 650 HG2 ARG 88 2HG ARG 88 6.594 -13.680 3.914 651 HG3 ARG 88 1HG ARG 88 7.460 -12.765 5.145 652 HD2 ARG 88 2HD ARG 88 5.524 -11.236 5.366 653 HD3 ARG 88 1HD ARG 88 4.655 -12.171 4.149 654 HE ARG 88 HE ARG 88 5.453 -13.952 6.160 655 HH11 ARG 88 1HH2 ARG 88 3.390 -11.185 5.754 656 HH12 ARG 88 2HH2 ARG 88 2.284 -11.664 6.997 657 HH21 ARG 88 1HH1 ARG 88 4.000 -14.567 7.787 658 HH22 ARG 88 2HH1 ARG 88 2.628 -13.571 8.145 659 H LYS 89 H LYS 89 7.791 -12.333 0.328 660 HA LYS 89 HA LYS 89 9.470 -10.084 -0.692 661 HB2 LYS 89 2HB LYS 89 8.358 -12.485 -2.187 662 HB3 LYS 89 1HB LYS 89 9.418 -11.245 -2.849 663 HG2 LYS 89 2HG LYS 89 10.189 -13.086 -0.549 664 HG3 LYS 89 1HG LYS 89 10.601 -13.391 -2.232 665 HD2 LYS 89 2HD LYS 89 11.851 -11.229 -2.289 666 HD3 LYS 89 1HD LYS 89 11.502 -10.998 -0.581 667 HE2 LYS 89 2HE LYS 89 12.669 -13.083 -0.027 668 HE3 LYS 89 1HE LYS 89 13.033 -13.338 -1.734 669 HZ1 LYS 89 3HZ LYS 89 13.857 -10.785 -1.242 670 HZ2 LYS 89 1HZ LYS 89 14.858 -12.149 -1.365 671 HZ3 LYS 89 2HZ LYS 89 14.319 -11.626 0.160 672 H VAL 90 H VAL 90 8.506 -8.419 -1.587 673 HA VAL 90 HA VAL 90 5.669 -8.563 -2.460 674 HB VAL 90 HB VAL 90 6.850 -6.347 -0.735 675 HG11 VAL 90 1HG1 VAL 90 4.495 -5.541 -0.660 676 HG12 VAL 90 2HG1 VAL 90 4.034 -6.819 -1.781 677 HG13 VAL 90 3HG1 VAL 90 5.121 -5.537 -2.305 678 HG21 VAL 90 3HG2 VAL 90 5.272 -7.196 0.999 679 HG22 VAL 90 1HG2 VAL 90 6.493 -8.393 0.574 680 HG23 VAL 90 2HG2 VAL 90 4.857 -8.544 -0.062 681 H ARG 91 H ARG 91 5.338 -7.548 -4.358 682 HA ARG 91 HA ARG 91 7.330 -5.595 -5.392 683 HB2 ARG 91 2HB ARG 91 6.172 -7.955 -6.924 684 HB3 ARG 91 1HB ARG 91 7.176 -6.675 -7.614 685 HG2 ARG 91 2HG ARG 91 9.022 -7.295 -6.087 686 HG3 ARG 91 1HG ARG 91 8.024 -8.582 -5.407 687 HD2 ARG 91 2HD ARG 91 7.881 -9.641 -7.645 688 HD3 ARG 91 1HD ARG 91 8.909 -8.369 -8.302 689 HE ARG 91 HE ARG 91 10.245 -9.537 -6.118 690 HH11 ARG 91 1HH2 ARG 91 9.150 -10.341 -9.318 691 HH12 ARG 91 2HH2 ARG 91 10.398 -11.510 -9.593 692 HH21 ARG 91 1HH1 ARG 91 11.873 -11.071 -6.489 693 HH22 ARG 91 2HH1 ARG 91 11.933 -11.921 -7.996 694 H ILE 92 H ILE 92 6.336 -3.804 -6.073 695 HA ILE 92 HA ILE 92 3.407 -3.854 -6.637 696 HB ILE 92 HB ILE 92 5.163 -1.514 -5.794 697 HG12 ILE 92 2HG1 ILE 92 3.106 -3.060 -4.153 698 HG13 ILE 92 1HG1 ILE 92 4.846 -3.282 -4.001 699 HG21 ILE 92 1HG2 ILE 92 3.202 -0.837 -7.135 700 HG22 ILE 92 2HG2 ILE 92 2.969 -0.370 -5.461 701 HG23 ILE 92 3HG2 ILE 92 2.149 -1.795 -6.098 702 HD11 ILE 92 3HD1 ILE 92 3.311 -0.723 -3.454 703 HD12 ILE 92 1HD1 ILE 92 5.070 -0.860 -3.423 704 HD13 ILE 92 2HD1 ILE 92 4.095 -1.761 -2.264 705 H VAL 93 H VAL 93 2.976 -3.781 -8.778 706 HA VAL 93 HA VAL 93 4.963 -2.636 -10.658 707 HB VAL 93 HB VAL 93 2.476 -4.294 -11.232 708 HG11 VAL 93 1HG1 VAL 93 3.575 -4.628 -13.444 709 HG12 VAL 93 2HG1 VAL 93 4.856 -3.519 -12.957 710 HG13 VAL 93 3HG1 VAL 93 3.207 -2.929 -13.152 711 HG21 VAL 93 3HG2 VAL 93 5.393 -5.123 -11.033 712 HG22 VAL 93 1HG2 VAL 93 4.075 -6.162 -11.572 713 HG23 VAL 93 2HG2 VAL 93 4.112 -5.579 -9.910 714 H PHE 94 H PHE 94 4.598 -0.704 -11.593 715 HA PHE 94 HA PHE 94 2.038 0.680 -11.119 716 HB2 PHE 94 2HB PHE 94 3.857 2.103 -10.594 717 HB3 PHE 94 1HB PHE 94 4.852 1.473 -11.902 718 HD1 PHE 94 1HD PHE 94 1.414 2.989 -11.600 719 HD2 PHE 94 2HD PHE 94 5.213 3.083 -13.633 720 HE1 PHE 94 1HE PHE 94 0.603 4.789 -13.091 721 HE2 PHE 94 2HE PHE 94 4.383 4.892 -15.105 722 HZ PHE 94 HZ PHE 94 2.071 5.745 -14.833 723 H THR 95 H THR 95 0.531 0.804 -12.642 724 HA THR 95 HA THR 95 1.222 0.786 -15.498 725 HB THR 95 HB THR 95 -0.825 -1.141 -14.327 726 HG1 THR 95 1HG THR 95 0.814 -2.653 -15.223 727 HG21 THR 95 3HG2 THR 95 -0.818 -2.061 -16.638 728 HG22 THR 95 1HG2 THR 95 0.266 -0.766 -17.140 729 HG23 THR 95 2HG2 THR 95 -1.373 -0.389 -16.607 730 H HIS 96 H HIS 96 -0.183 1.991 -16.697 731 HA HIS 96 HA HIS 96 -2.761 2.875 -15.631 732 HB2 HIS 96 2HB HIS 96 -2.175 5.270 -15.804 733 HB3 HIS 96 1HB HIS 96 -1.174 4.469 -14.596 734 HD2 HIS 96 2HD HIS 96 -0.317 7.120 -16.774 735 HE1 HIS 96 1HE HIS 96 2.723 4.360 -17.763 736 HE2 HIS 96 2HE HIS 96 2.004 6.790 -17.928 737 H THR 97 H THR 97 -4.105 3.703 -17.235 738 HA THR 97 HA THR 97 -3.241 3.125 -20.024 739 HB THR 97 HB THR 97 -5.613 3.093 -20.556 740 HG1 THR 97 1HG THR 97 -6.049 3.696 -17.827 741 HG21 THR 97 3HG2 THR 97 -6.314 1.205 -19.144 742 HG22 THR 97 1HG2 THR 97 -5.051 1.593 -17.978 743 HG23 THR 97 2HG2 THR 97 -4.618 1.040 -19.596 744 H GLY 98 H GLY 98 -3.746 5.698 -17.878 745 HA2 GLY 98 2HA GLY 98 -2.807 7.773 -19.290 746 HA3 GLY 98 1HA GLY 98 -4.467 7.707 -19.882 747 H ASP 99 H ASP 99 -6.098 8.473 -18.629 748 HA ASP 99 HA ASP 99 -5.428 10.132 -16.353 749 HB2 ASP 99 2HB ASP 99 -7.867 10.657 -16.393 750 HB3 ASP 99 1HB ASP 99 -7.097 10.885 -17.962 751 H THR 100 H THR 100 -5.934 6.862 -16.627 752 HA THR 100 HA THR 100 -7.098 6.567 -13.902 753 HB THR 100 HB THR 100 -7.850 4.361 -14.685 754 HG1 THR 100 1HG THR 100 -6.101 4.328 -16.312 755 HG21 THR 100 3HG2 THR 100 -9.354 6.301 -14.948 756 HG22 THR 100 1HG2 THR 100 -9.590 5.128 -16.243 757 HG23 THR 100 2HG2 THR 100 -8.672 6.601 -16.547 758 H THR 101 H THR 101 -5.772 5.729 -12.449 759 HA THR 101 HA THR 101 -3.202 4.473 -13.273 760 HB THR 101 HB THR 101 -4.048 5.639 -10.596 761 HG1 THR 101 1HG THR 101 -3.424 6.850 -12.777 762 HG21 THR 101 3HG2 THR 101 -2.331 3.924 -10.281 763 HG22 THR 101 1HG2 THR 101 -1.581 5.511 -10.123 764 HG23 THR 101 2HG2 THR 101 -1.378 4.586 -11.610 765 H ASN 102 H ASN 102 -2.776 2.382 -12.795 766 HA ASN 102 HA ASN 102 -4.744 0.832 -11.157 767 HB2 ASN 102 2HB ASN 102 -3.091 -0.085 -13.537 768 HB3 ASN 102 1HB ASN 102 -4.224 -1.073 -12.612 769 HD21 ASN 102 1HD2 ASN 102 -6.190 1.189 -12.329 770 HD22 ASN 102 2HD2 ASN 102 -6.903 1.357 -13.859 771 H ILE 103 H ILE 103 -3.845 0.298 -9.266 772 HA ILE 103 HA ILE 103 -0.901 -0.125 -9.054 773 HB ILE 103 HB ILE 103 -3.011 0.183 -6.891 774 HG12 ILE 103 2HG1 ILE 103 -0.954 2.234 -7.825 775 HG13 ILE 103 1HG1 ILE 103 -2.641 2.254 -8.329 776 HG21 ILE 103 1HG2 ILE 103 0.026 0.150 -6.769 777 HG22 ILE 103 2HG2 ILE 103 -1.057 -1.071 -6.097 778 HG23 ILE 103 3HG2 ILE 103 -1.019 0.540 -5.407 779 HD11 ILE 103 3HD1 ILE 103 -3.336 2.382 -5.923 780 HD12 ILE 103 1HD1 ILE 103 -2.381 3.766 -6.447 781 HD13 ILE 103 2HD1 ILE 103 -1.631 2.503 -5.478 782 H VAL 104 H VAL 104 -0.175 -2.167 -8.955 783 HA VAL 104 HA VAL 104 -2.012 -4.384 -8.150 784 HB VAL 104 HB VAL 104 0.281 -4.494 -10.148 785 HG11 VAL 104 1HG1 VAL 104 -0.704 -6.723 -10.690 786 HG12 VAL 104 2HG1 VAL 104 -1.848 -6.516 -9.367 787 HG13 VAL 104 3HG1 VAL 104 -0.123 -6.642 -9.029 788 HG21 VAL 104 3HG2 VAL 104 -2.724 -4.397 -10.603 789 HG22 VAL 104 1HG2 VAL 104 -1.520 -4.709 -11.855 790 HG23 VAL 104 2HG2 VAL 104 -1.561 -3.143 -11.047 791 H GLU 105 H GLU 105 -1.340 -5.469 -6.412 792 HA GLU 105 HA GLU 105 1.537 -5.644 -5.736 793 HB2 GLU 105 2HB GLU 105 1.005 -5.069 -3.361 794 HB3 GLU 105 1HB GLU 105 0.751 -3.715 -4.463 795 HG2 GLU 105 2HG GLU 105 -1.671 -4.216 -4.527 796 HG3 GLU 105 1HG GLU 105 -1.426 -5.560 -3.418 797 H SER 106 H SER 106 2.093 -7.483 -4.675 798 HA SER 106 HA SER 106 -0.027 -9.464 -4.015 799 HB2 SER 106 2HB SER 106 1.351 -11.221 -5.008 800 HB3 SER 106 1HB SER 106 1.002 -9.988 -6.216 801 HG SER 106 HG SER 106 3.351 -10.089 -4.621 802 H PHE 107 H PHE 107 0.425 -10.878 -2.350 803 HA PHE 107 HA PHE 107 2.912 -10.441 -0.766 804 HB2 PHE 107 2HB PHE 107 0.063 -10.366 0.301 805 HB3 PHE 107 1HB PHE 107 1.511 -10.403 1.307 806 HD1 PHE 107 2HD PHE 107 -0.442 -8.361 -1.114 807 HD2 PHE 107 1HD PHE 107 2.943 -8.415 1.542 808 HE1 PHE 107 2HE PHE 107 -0.236 -5.904 -1.313 809 HE2 PHE 107 1HE PHE 107 3.139 -5.956 1.335 810 HZ PHE 107 HZ PHE 107 1.551 -4.698 -0.094 811 H ASP 108 H ASP 108 3.516 -12.156 0.511 812 HA ASP 108 HA ASP 108 2.602 -14.789 -0.382 813 HB2 ASP 108 2HB ASP 108 4.860 -13.966 1.462 814 HB3 ASP 108 1HB ASP 108 4.567 -15.599 0.867 815 HA PRO 109 HA PRO 109 0.234 -14.754 3.593 816 HB2 PRO 109 2HB PRO 109 -1.568 -16.720 3.100 817 HB3 PRO 109 1HB PRO 109 -1.672 -15.159 2.265 818 HG2 PRO 109 2HG PRO 109 -0.467 -17.735 1.274 819 HG3 PRO 109 1HG PRO 109 -1.588 -16.642 0.432 820 HD2 PRO 109 2HD PRO 109 1.150 -16.567 0.039 821 HD3 PRO 109 1HD PRO 109 0.129 -15.123 -0.149 822 H GLU 110 H GLU 110 -0.005 -16.181 5.399 823 HA GLU 110 HA GLU 110 2.200 -18.045 5.724 824 HB2 GLU 110 2HB GLU 110 -0.066 -17.287 7.591 825 HB3 GLU 110 1HB GLU 110 1.363 -18.221 8.035 826 HG2 GLU 110 2HG GLU 110 2.801 -16.303 7.405 827 HG3 GLU 110 1HG GLU 110 1.365 -15.370 6.989 828 H GLU 111 H GLU 111 1.985 -20.227 6.266 829 HA GLU 111 HA GLU 111 -0.113 -21.650 4.840 830 HB2 GLU 111 2HB GLU 111 2.182 -22.664 6.549 831 HB3 GLU 111 1HB GLU 111 1.144 -23.667 5.535 832 HG2 GLU 111 2HG GLU 111 1.865 -22.411 3.538 833 HG3 GLU 111 1HG GLU 111 2.900 -21.397 4.540 834 H THR 112 H THR 112 0.828 -21.153 8.230 835 HA THR 112 HA THR 112 -1.002 -22.961 9.404 836 HB THR 112 HB THR 112 -0.612 -21.697 11.479 837 HG1 THR 112 1HG THR 112 -0.432 -19.687 9.888 838 HG21 THR 112 3HG2 THR 112 1.140 -23.246 10.688 839 HG22 THR 112 1HG2 THR 112 1.844 -21.865 11.527 840 HG23 THR 112 2HG2 THR 112 1.882 -21.937 9.766 841 H ASN 113 H ASN 113 -1.301 -19.466 8.697 842 HA ASN 113 HA ASN 113 -4.042 -19.406 9.701 843 HB2 ASN 113 2HB ASN 113 -2.379 -17.260 8.349 844 HB3 ASN 113 1HB ASN 113 -3.952 -17.010 9.096 845 HD21 ASN 113 1HD2 ASN 113 -4.066 -17.579 11.506 846 HD22 ASN 113 2HD2 ASN 113 -2.675 -17.321 12.443 847 HA PRO 114 HA PRO 114 -5.783 -20.243 5.640 848 HB2 PRO 114 2HB PRO 114 -8.318 -19.206 5.881 849 HB3 PRO 114 1HB PRO 114 -7.807 -20.660 6.772 850 HG2 PRO 114 2HG PRO 114 -7.853 -17.804 7.738 851 HG3 PRO 114 1HG PRO 114 -8.528 -19.247 8.524 852 HD2 PRO 114 2HD PRO 114 -6.105 -18.269 9.249 853 HD3 PRO 114 1HD PRO 114 -6.384 -20.030 9.181 854 H ARG 115 H ARG 115 -5.591 -19.266 3.707 855 HA ARG 115 HA ARG 115 -4.791 -16.553 3.454 856 HB2 ARG 115 2HB ARG 115 -4.903 -16.993 1.009 857 HB3 ARG 115 1HB ARG 115 -4.018 -18.241 1.882 858 HG2 ARG 115 2HG ARG 115 -6.036 -19.677 1.869 859 HG3 ARG 115 1HG ARG 115 -6.916 -18.436 0.978 860 HD2 ARG 115 2HD ARG 115 -5.282 -18.600 -0.871 861 HD3 ARG 115 1HD ARG 115 -4.417 -19.857 0.012 862 HE ARG 115 HE ARG 115 -7.102 -20.654 -0.220 863 HH11 ARG 115 1HH2 ARG 115 -4.327 -20.051 -2.221 864 HH12 ARG 115 2HH2 ARG 115 -4.792 -21.194 -3.436 865 HH21 ARG 115 1HH1 ARG 115 -7.702 -22.146 -1.816 866 HH22 ARG 115 2HH1 ARG 115 -6.697 -22.377 -3.208 867 H GLU 116 H GLU 116 -7.906 -18.173 3.057 868 HA GLU 116 HA GLU 116 -9.373 -16.314 1.671 869 HB2 GLU 116 2HB GLU 116 -10.155 -18.555 2.486 870 HB3 GLU 116 1HB GLU 116 -10.332 -17.870 4.093 871 HG2 GLU 116 2HG GLU 116 -12.510 -17.868 3.011 872 HG3 GLU 116 1HG GLU 116 -11.973 -16.201 3.145 873 H LEU 117 H LEU 117 -8.528 -16.209 5.117 874 HA LEU 117 HA LEU 117 -10.084 -13.823 5.655 875 HB2 LEU 117 2HB LEU 117 -8.036 -15.443 7.168 876 HB3 LEU 117 1HB LEU 117 -8.574 -13.897 7.808 877 HG LEU 117 HG LEU 117 -9.854 -15.863 8.723 878 HD11 LEU 117 1HD1 LEU 117 -10.870 -13.418 8.265 879 HD12 LEU 117 2HD1 LEU 117 -11.860 -14.735 8.873 880 HD13 LEU 117 3HD1 LEU 117 -11.919 -14.316 7.165 881 HD21 LEU 117 3HD2 LEU 117 -11.322 -17.180 7.365 882 HD22 LEU 117 1HD2 LEU 117 -9.786 -17.162 6.506 883 HD23 LEU 117 2HD2 LEU 117 -11.103 -16.132 5.967 884 H GLN 118 H GLN 118 -6.665 -14.533 4.922 885 HA GLN 118 HA GLN 118 -5.670 -11.916 5.399 886 HB2 GLN 118 2HB GLN 118 -4.621 -14.061 3.521 887 HB3 GLN 118 1HB GLN 118 -3.723 -12.636 4.049 888 HG2 GLN 118 2HG GLN 118 -3.930 -13.373 6.392 889 HG3 GLN 118 1HG GLN 118 -4.811 -14.805 5.863 890 HE21 GLN 118 1HE2 GLN 118 -3.416 -16.577 5.972 891 HE22 GLN 118 2HE2 GLN 118 -1.790 -16.561 5.487 892 H GLN 119 H GLN 119 -6.500 -13.529 2.294 893 HA GLN 119 HA GLN 119 -6.042 -11.337 0.632 894 HB2 GLN 119 2HB GLN 119 -7.416 -12.480 -1.016 895 HB3 GLN 119 1HB GLN 119 -6.422 -13.638 -0.157 896 HG2 GLN 119 2HG GLN 119 -8.491 -14.753 -0.122 897 HG3 GLN 119 1HG GLN 119 -8.541 -13.900 1.409 898 HE21 GLN 119 1HE2 GLN 119 -9.319 -13.128 -2.037 899 HE22 GLN 119 2HE2 GLN 119 -10.808 -12.392 -1.687 900 H SER 120 H SER 120 -8.888 -12.227 2.467 901 HA SER 120 HA SER 120 -10.701 -10.324 1.462 902 HB2 SER 120 2HB SER 120 -11.378 -12.171 2.968 903 HB3 SER 120 1HB SER 120 -10.499 -11.416 4.288 904 HG SER 120 HG SER 120 -12.770 -10.468 2.888 905 H GLY 121 H GLY 121 -8.271 -10.141 4.020 906 HA2 GLY 121 2HA GLY 121 -8.918 -7.538 4.971 907 HA3 GLY 121 1HA GLY 121 -7.392 -8.379 5.212 908 H TRP 122 H TRP 122 -6.422 -8.667 2.665 909 HA TRP 122 HA TRP 122 -5.280 -6.148 2.128 910 HB2 TRP 122 2HB TRP 122 -5.483 -8.675 0.442 911 HB3 TRP 122 1HB TRP 122 -4.539 -7.272 -0.056 912 HD1 TRP 122 HD TRP 122 -4.238 -10.377 2.003 913 HE1 TRP 122 1HE TRP 122 -2.046 -10.338 3.348 914 HE3 TRP 122 3HE TRP 122 -2.863 -5.503 1.315 915 HZ2 TRP 122 2HZ TRP 122 0.024 -8.494 4.037 916 HZ3 TRP 122 3HZ TRP 122 -0.771 -4.637 2.324 917 HH2 TRP 122 HH TRP 122 0.673 -6.126 3.682 918 H GLN 123 H GLN 123 -8.053 -7.789 0.651 919 HA GLN 123 HA GLN 123 -8.490 -5.755 -1.360 920 HB2 GLN 123 2HB GLN 123 -10.219 -8.022 -0.326 921 HB3 GLN 123 1HB GLN 123 -10.666 -6.984 -1.676 922 HG2 GLN 123 2HG GLN 123 -8.644 -7.678 -2.883 923 HG3 GLN 123 1HG GLN 123 -8.192 -8.715 -1.533 924 HE21 GLN 123 1HE2 GLN 123 -8.537 -10.826 -2.236 925 HE22 GLN 123 2HE2 GLN 123 -9.955 -11.371 -2.991 926 H ALA 124 H ALA 124 -9.678 -6.404 1.909 927 HA ALA 124 HA ALA 124 -11.867 -4.649 1.962 928 HB1 ALA 124 1HB ALA 124 -11.599 -4.693 4.415 929 HB2 ALA 124 2HB ALA 124 -9.995 -5.404 4.219 930 HB3 ALA 124 3HB ALA 124 -11.427 -6.304 3.721 931 H ILE 125 H ILE 125 -8.492 -4.010 2.988 932 HA ILE 125 HA ILE 125 -8.912 -1.299 3.686 933 HB ILE 125 HB ILE 125 -6.991 -2.547 4.496 934 HG12 ILE 125 2HG1 ILE 125 -5.962 -0.362 2.626 935 HG13 ILE 125 1HG1 ILE 125 -6.775 -0.039 4.151 936 HG21 ILE 125 1HG2 ILE 125 -5.171 -3.274 3.034 937 HG22 ILE 125 2HG2 ILE 125 -6.000 -2.619 1.632 938 HG23 ILE 125 3HG2 ILE 125 -6.681 -3.986 2.499 939 HD11 ILE 125 3HD1 ILE 125 -5.034 -1.359 5.346 940 HD12 ILE 125 1HD1 ILE 125 -4.345 0.014 4.482 941 HD13 ILE 125 2HD1 ILE 125 -4.198 -1.611 3.815 942 H LEU 126 H LEU 126 -7.986 -2.862 0.648 943 HA LEU 126 HA LEU 126 -7.427 -0.486 -0.809 944 HB2 LEU 126 2HB LEU 126 -8.245 -3.287 -1.618 945 HB3 LEU 126 1HB LEU 126 -7.984 -2.041 -2.835 946 HG LEU 126 HG LEU 126 -5.915 -2.899 -0.775 947 HD11 LEU 126 1HD1 LEU 126 -6.175 -3.665 -3.694 948 HD12 LEU 126 2HD1 LEU 126 -6.357 -4.727 -2.297 949 HD13 LEU 126 3HD1 LEU 126 -4.786 -4.024 -2.668 950 HD21 LEU 126 3HD2 LEU 126 -4.422 -1.700 -2.719 951 HD22 LEU 126 1HD2 LEU 126 -5.092 -0.813 -1.357 952 HD23 LEU 126 2HD2 LEU 126 -5.909 -0.778 -2.912 953 H ASN 127 H ASN 127 -10.418 -2.312 -0.261 954 HA ASN 127 HA ASN 127 -12.062 -0.858 -2.056 955 HB2 ASN 127 2HB ASN 127 -12.757 -2.330 0.510 956 HB3 ASN 127 1HB ASN 127 -13.945 -1.733 -0.649 957 HD21 ASN 127 1HD2 ASN 127 -13.417 -4.583 0.055 958 HD22 ASN 127 2HD2 ASN 127 -12.963 -5.343 -1.393 959 H SER 128 H SER 128 -11.195 -0.346 1.338 960 HA SER 128 HA SER 128 -12.942 1.776 1.916 961 HB2 SER 128 2HB SER 128 -11.652 0.580 3.638 962 HB3 SER 128 1HB SER 128 -10.160 1.272 3.008 963 HG SER 128 HG SER 128 -10.659 3.142 3.877 964 H PHE 129 H PHE 129 -9.766 1.734 0.382 965 HA PHE 129 HA PHE 129 -9.195 4.470 0.425 966 HB2 PHE 129 2HB PHE 129 -7.619 2.664 -0.312 967 HB3 PHE 129 1HB PHE 129 -8.528 2.523 -1.812 968 HD1 PHE 129 1HD PHE 129 -8.576 4.416 -3.455 969 HD2 PHE 129 2HD PHE 129 -6.138 4.589 0.084 970 HE1 PHE 129 1HE PHE 129 -7.311 6.317 -4.412 971 HE2 PHE 129 2HE PHE 129 -4.875 6.487 -0.882 972 HZ PHE 129 HZ PHE 129 -5.462 7.354 -3.128 973 H LYS 130 H LYS 130 -10.987 2.598 -2.049 974 HA LYS 130 HA LYS 130 -11.544 4.812 -3.747 975 HB2 LYS 130 2HB LYS 130 -13.036 2.201 -3.366 976 HB3 LYS 130 1HB LYS 130 -13.360 3.342 -4.671 977 HG2 LYS 130 2HG LYS 130 -10.916 3.102 -5.363 978 HG3 LYS 130 1HG LYS 130 -10.776 1.799 -4.190 979 HD2 LYS 130 2HD LYS 130 -12.758 1.835 -6.504 980 HD3 LYS 130 1HD LYS 130 -11.218 0.989 -6.528 981 HE2 LYS 130 2HE LYS 130 -12.022 -0.288 -4.450 982 HE3 LYS 130 1HE LYS 130 -13.622 0.386 -4.773 983 HZ1 LYS 130 3HZ LYS 130 -13.113 -0.505 -7.161 984 HZ2 LYS 130 1HZ LYS 130 -13.731 -1.530 -5.960 985 HZ3 LYS 130 2HZ LYS 130 -12.071 -1.554 -6.323 986 H SER 131 H SER 131 -13.321 3.333 -1.048 987 HA SER 131 HA SER 131 -15.679 4.854 -1.245 988 HB2 SER 131 2HB SER 131 -15.482 2.857 0.179 989 HB3 SER 131 1HB SER 131 -14.360 3.712 1.234 990 HG SER 131 HG SER 131 -15.969 4.901 1.996 991 H TYR 132 H TYR 132 -12.664 5.458 0.537 992 HA TYR 132 HA TYR 132 -13.480 7.839 1.822 993 HB2 TYR 132 2HB TYR 132 -11.467 6.557 2.463 994 HB3 TYR 132 1HB TYR 132 -10.702 6.994 0.937 995 HD1 TYR 132 2HD TYR 132 -11.870 8.277 4.220 996 HD2 TYR 132 1HD TYR 132 -9.879 9.290 0.543 997 HE1 TYR 132 2HE TYR 132 -11.122 10.421 5.209 998 HE2 TYR 132 1HE TYR 132 -9.137 11.432 1.540 999 HH TYR 132 HH TYR 132 -8.944 12.594 3.457 1000 H THR 133 H THR 133 -11.763 7.300 -1.254 1001 HA THR 133 HA THR 133 -11.452 10.011 -1.972 1002 HB THR 133 HB THR 133 -11.777 7.640 -3.846 1003 HG1 THR 133 1HG THR 133 -10.139 7.056 -2.624 1004 HG21 THR 133 3HG2 THR 133 -11.825 9.788 -5.027 1005 HG22 THR 133 1HG2 THR 133 -10.276 8.995 -5.311 1006 HG23 THR 133 2HG2 THR 133 -10.385 10.324 -4.160 1007 H GLU 134 H GLU 134 -14.019 7.673 -2.770 1008 HA GLU 134 HA GLU 134 -15.555 9.456 -4.370 1009 HB2 GLU 134 2HB GLU 134 -15.784 6.981 -4.408 1010 HB3 GLU 134 1HB GLU 134 -16.489 7.034 -2.796 1011 HG2 GLU 134 2HG GLU 134 -18.357 8.413 -3.637 1012 HG3 GLU 134 1HG GLU 134 -17.629 8.435 -5.241 1013 H ASN 135 H ASN 135 -15.461 8.760 -0.911 1014 HA ASN 135 HA ASN 135 -17.839 10.102 -0.165 1015 HB2 ASN 135 2HB ASN 135 -16.608 8.548 1.325 1016 HB3 ASN 135 1HB ASN 135 -15.301 9.722 1.459 1017 HD21 ASN 135 1HD2 ASN 135 -15.664 10.026 3.776 1018 HD22 ASN 135 2HD2 ASN 135 -17.033 10.845 4.357 1019 H ASN 136 H ASN 136 -14.549 11.230 -0.746 1020 HA ASN 136 HA ASN 136 -14.779 13.809 0.375 1021 HB2 ASN 136 2HB ASN 136 -13.097 12.926 -1.992 1022 HB3 ASN 136 1HB ASN 136 -12.851 14.383 -1.031 1023 HD21 ASN 136 1HD2 ASN 136 -10.912 12.179 -1.302 1024 HD22 ASN 136 2HD2 ASN 136 -10.692 11.536 0.254 1025 H LEU 137 H LEU 137 -15.669 12.511 -2.787 1026 HA LEU 137 HA LEU 137 -16.839 13.386 -4.555 1027 HB2 LEU 137 2HB LEU 137 -18.003 15.171 -2.398 1028 HB3 LEU 137 1HB LEU 137 -18.699 14.940 -3.993 1029 HG LEU 137 HG LEU 137 -18.265 12.641 -2.036 1030 HD11 LEU 137 1HD1 LEU 137 -20.774 14.297 -2.478 1031 HD12 LEU 137 2HD1 LEU 137 -19.796 14.271 -1.012 1032 HD13 LEU 137 3HD1 LEU 137 -20.684 12.830 -1.504 1033 HD21 LEU 137 3HD2 LEU 137 -20.086 11.568 -3.477 1034 HD22 LEU 137 1HD2 LEU 137 -18.572 11.836 -4.329 1035 HD23 LEU 137 2HD2 LEU 137 -19.927 12.928 -4.585 1036 H GLU 138 H GLU 138 -17.386 16.552 -3.505 1037 HA GLU 138 HA GLU 138 -15.867 17.723 -5.580 1038 HB2 GLU 138 2HB GLU 138 -16.953 18.976 -3.034 1039 HB3 GLU 138 1HB GLU 138 -16.412 19.865 -4.456 1040 HG2 GLU 138 2HG GLU 138 -18.681 17.837 -4.460 1041 HG3 GLU 138 1HG GLU 138 -18.905 19.579 -4.365 1042 H HIS 139 H HIS 139 -14.264 19.581 -4.978 1043 HA HIS 139 HA HIS 139 -12.541 19.191 -2.712 1044 HB2 HIS 139 2HB HIS 139 -11.859 17.225 -4.050 1045 HB3 HIS 139 1HB HIS 139 -11.521 18.273 -5.424 1046 HD2 HIS 139 2HD HIS 139 -8.979 19.408 -5.388 1047 HE1 HIS 139 1HE HIS 139 -7.956 18.385 -1.421 1048 HE2 HIS 139 2HE HIS 139 -7.100 19.422 -3.575 1049 H HIS 140 H HIS 140 -11.456 21.045 -2.344 1050 HA HIS 140 HA HIS 140 -10.463 22.793 -4.377 1051 HB2 HIS 140 2HB HIS 140 -11.987 24.710 -3.913 1052 HB3 HIS 140 1HB HIS 140 -12.834 23.352 -4.651 1053 HD2 HIS 140 2HD HIS 140 -12.736 25.256 -1.228 1054 HE1 HIS 140 1HE HIS 140 -15.735 22.294 -0.976 1055 HE2 HIS 140 2HE HIS 140 -14.703 24.297 0.196 1056 H HIS 141 H HIS 141 -9.886 21.434 -1.731 1057 HA HIS 141 HA HIS 141 -9.593 23.338 0.327 1058 HB2 HIS 141 2HB HIS 141 -7.890 20.898 -0.280 1059 HB3 HIS 141 1HB HIS 141 -7.913 21.769 1.253 1060 HD2 HIS 141 2HD HIS 141 -10.391 21.490 2.732 1061 HE1 HIS 141 1HE HIS 141 -11.806 18.258 0.413 1062 HE2 HIS 141 2HE HIS 141 -12.178 19.596 2.540 1063 H HIS 142 H HIS 142 -7.391 22.363 -2.288 1064 HA HIS 142 HA HIS 142 -5.434 23.275 -3.078 1065 HB2 HIS 142 2HB HIS 142 -7.039 25.024 -3.757 1066 HB3 HIS 142 1HB HIS 142 -6.816 25.834 -2.208 1067 HD2 HIS 142 2HD HIS 142 -4.612 27.535 -2.113 1068 HE1 HIS 142 1HE HIS 142 -2.828 26.350 -5.752 1069 HE2 HIS 142 2HE HIS 142 -2.688 27.992 -3.818 1070 H HIS 143 H HIS 143 -4.063 22.349 -1.484 1071 HA HIS 143 HA HIS 143 -2.525 22.334 0.217 1072 HB2 HIS 143 2HB HIS 143 -1.574 24.123 -1.234 1073 HB3 HIS 143 1HB HIS 143 -2.476 25.326 -0.316 1074 HD2 HIS 143 2HD HIS 143 0.509 22.786 0.317 1075 HE1 HIS 143 1HE HIS 143 0.526 25.695 3.378 1076 HE2 HIS 143 2HE HIS 143 1.768 23.699 2.415 1077 H HIS 144 H HIS 144 -4.200 21.729 1.743 1078 HA HIS 144 HA HIS 144 -5.367 21.899 3.713 1079 HB2 HIS 144 2HB HIS 144 -3.412 24.168 4.213 1080 HB3 HIS 144 1HB HIS 144 -4.363 23.335 5.440 1081 HD2 HIS 144 2HD HIS 144 -1.030 22.885 3.551 1082 HE1 HIS 144 1HE HIS 144 -1.779 19.253 5.568 1083 HE2 HIS 144 2HE HIS 144 -0.047 20.574 4.263 Start of MODEL 13 1 H1 GLY 1 1HT GLY 1 4.009 -22.142 -3.936 2 H2 GLY 1 2HT GLY 1 3.048 -20.785 -4.289 3 H3 GLY 1 3HT GLY 1 2.369 -22.342 -4.317 4 HA2 GLY 1 2HA GLY 1 2.483 -22.574 -1.999 5 HA3 GLY 1 1HA GLY 1 3.544 -21.171 -1.867 6 H ASN 2 H ASN 2 2.679 -19.068 -2.301 7 HA ASN 2 HA ASN 2 -0.183 -18.693 -2.677 8 HB2 ASN 2 2HB ASN 2 0.008 -19.235 -0.242 9 HB3 ASN 2 1HB ASN 2 1.091 -17.861 -0.041 10 HD21 ASN 2 1HD2 ASN 2 -0.446 -16.727 1.340 11 HD22 ASN 2 2HD2 ASN 2 -1.865 -16.049 0.708 12 H LYS 3 H LYS 3 -0.219 -17.077 -4.075 13 HA LYS 3 HA LYS 3 1.589 -14.724 -3.749 14 HB2 LYS 3 2HB LYS 3 0.707 -16.060 -6.331 15 HB3 LYS 3 1HB LYS 3 1.668 -14.583 -6.210 16 HG2 LYS 3 2HG LYS 3 3.428 -15.833 -4.989 17 HG3 LYS 3 1HG LYS 3 2.473 -17.311 -5.144 18 HD2 LYS 3 2HD LYS 3 2.598 -17.135 -7.606 19 HD3 LYS 3 1HD LYS 3 3.557 -15.662 -7.452 20 HE2 LYS 3 2HE LYS 3 5.306 -16.923 -6.249 21 HE3 LYS 3 1HE LYS 3 4.346 -18.398 -6.403 22 HZ1 LYS 3 3HZ LYS 3 6.161 -17.902 -8.136 23 HZ2 LYS 3 1HZ LYS 3 5.031 -16.817 -8.787 24 HZ3 LYS 3 2HZ LYS 3 4.650 -18.469 -8.668 25 H ILE 4 H ILE 4 -0.710 -14.495 -2.466 26 HA ILE 4 HA ILE 4 -3.078 -13.841 -3.713 27 HB ILE 4 HB ILE 4 -1.801 -12.287 -1.423 28 HG12 ILE 4 2HG1 ILE 4 -3.679 -14.692 -1.303 29 HG13 ILE 4 1HG1 ILE 4 -1.937 -14.796 -1.068 30 HG21 ILE 4 1HG2 ILE 4 -3.766 -11.124 -2.358 31 HG22 ILE 4 2HG2 ILE 4 -4.180 -11.803 -0.798 32 HG23 ILE 4 3HG2 ILE 4 -4.709 -12.608 -2.269 33 HD11 ILE 4 3HD1 ILE 4 -2.120 -13.192 0.833 34 HD12 ILE 4 1HD1 ILE 4 -3.026 -14.673 1.104 35 HD13 ILE 4 2HD1 ILE 4 -3.871 -13.202 0.644 36 H THR 5 H THR 5 -3.844 -12.154 -4.914 37 HA THR 5 HA THR 5 -2.104 -9.802 -5.414 38 HB THR 5 HB THR 5 -3.518 -11.388 -7.603 39 HG1 THR 5 1HG THR 5 -1.583 -12.301 -6.497 40 HG21 THR 5 3HG2 THR 5 -3.262 -8.989 -8.114 41 HG22 THR 5 1HG2 THR 5 -2.150 -9.939 -9.096 42 HG23 THR 5 2HG2 THR 5 -1.553 -9.065 -7.686 43 H VAL 6 H VAL 6 -3.172 -7.947 -5.536 44 HA VAL 6 HA VAL 6 -6.133 -7.908 -5.782 45 HB VAL 6 HB VAL 6 -6.212 -6.239 -3.928 46 HG11 VAL 6 1HG1 VAL 6 -5.051 -8.929 -3.130 47 HG12 VAL 6 2HG1 VAL 6 -6.745 -8.619 -3.502 48 HG13 VAL 6 3HG1 VAL 6 -6.002 -7.866 -2.092 49 HG21 VAL 6 3HG2 VAL 6 -3.843 -5.511 -3.985 50 HG22 VAL 6 1HG2 VAL 6 -3.335 -7.117 -3.467 51 HG23 VAL 6 2HG2 VAL 6 -4.271 -6.091 -2.382 52 H GLU 7 H GLU 7 -6.947 -5.878 -6.441 53 HA GLU 7 HA GLU 7 -5.022 -3.920 -7.528 54 HB2 GLU 7 2HB GLU 7 -7.322 -5.059 -9.187 55 HB3 GLU 7 1HB GLU 7 -6.058 -3.944 -9.711 56 HG2 GLU 7 2HG GLU 7 -5.289 -6.032 -10.545 57 HG3 GLU 7 1HG GLU 7 -4.387 -5.867 -9.044 58 H VAL 8 H VAL 8 -6.018 -1.899 -8.082 59 HA VAL 8 HA VAL 8 -8.753 -1.359 -7.174 60 HB VAL 8 HB VAL 8 -7.503 -1.175 -5.084 61 HG11 VAL 8 1HG1 VAL 8 -5.609 0.397 -4.866 62 HG12 VAL 8 2HG1 VAL 8 -5.686 0.734 -6.584 63 HG13 VAL 8 3HG1 VAL 8 -5.263 -0.884 -6.021 64 HG21 VAL 8 3HG2 VAL 8 -7.955 1.661 -6.110 65 HG22 VAL 8 1HG2 VAL 8 -8.111 1.079 -4.454 66 HG23 VAL 8 2HG2 VAL 8 -9.276 0.581 -5.677 67 H THR 9 H THR 9 -9.609 0.415 -8.177 68 HA THR 9 HA THR 9 -8.028 1.652 -10.344 69 HB THR 9 HB THR 9 -10.231 2.366 -11.161 70 HG1 THR 9 1HG THR 9 -11.004 2.429 -8.877 71 HG21 THR 9 3HG2 THR 9 -10.230 -0.550 -10.339 72 HG22 THR 9 1HG2 THR 9 -9.413 0.100 -11.760 73 HG23 THR 9 2HG2 THR 9 -11.173 0.151 -11.653 74 H VAL 10 H VAL 10 -7.241 3.640 -10.035 75 HA VAL 10 HA VAL 10 -8.564 5.528 -8.130 76 HB VAL 10 HB VAL 10 -5.567 5.177 -8.550 77 HG11 VAL 10 1HG1 VAL 10 -6.172 7.486 -7.973 78 HG12 VAL 10 2HG1 VAL 10 -5.429 6.715 -6.577 79 HG13 VAL 10 3HG1 VAL 10 -7.177 6.917 -6.643 80 HG21 VAL 10 3HG2 VAL 10 -6.502 3.265 -7.325 81 HG22 VAL 10 1HG2 VAL 10 -7.349 4.354 -6.224 82 HG23 VAL 10 2HG2 VAL 10 -5.585 4.290 -6.223 83 H TYR 11 H TYR 11 -9.062 7.422 -9.048 84 HA TYR 11 HA TYR 11 -8.167 8.014 -11.803 85 HB2 TYR 11 2HB TYR 11 -10.228 9.371 -10.024 86 HB3 TYR 11 1HB TYR 11 -9.948 9.704 -11.734 87 HD1 TYR 11 2HD TYR 11 -10.589 8.048 -13.473 88 HD2 TYR 11 1HD TYR 11 -11.330 7.285 -9.303 89 HE1 TYR 11 2HE TYR 11 -12.100 6.184 -14.077 90 HE2 TYR 11 1HE TYR 11 -12.838 5.422 -9.914 91 HH TYR 11 HH TYR 11 -13.207 4.380 -13.278 92 H ALA 12 H ALA 12 -6.011 8.646 -11.328 93 HA ALA 12 HA ALA 12 -5.673 11.423 -10.760 94 HB1 ALA 12 1HB ALA 12 -5.940 10.680 -8.426 95 HB2 ALA 12 2HB ALA 12 -4.283 11.198 -8.721 96 HB3 ALA 12 3HB ALA 12 -4.674 9.480 -8.656 97 H ALA 13 H ALA 13 -3.558 12.130 -11.217 98 HA ALA 13 HA ALA 13 -2.170 10.612 -13.164 99 HB1 ALA 13 1HB ALA 13 -1.149 12.970 -11.544 100 HB2 ALA 13 2HB ALA 13 -2.138 13.097 -12.999 101 HB3 ALA 13 3HB ALA 13 -0.521 12.403 -13.094 102 H ILE 14 H ILE 14 -0.526 9.170 -12.991 103 HA ILE 14 HA ILE 14 0.056 7.816 -10.652 104 HB ILE 14 HB ILE 14 0.519 6.907 -12.867 105 HG12 ILE 14 2HG1 ILE 14 3.167 7.115 -11.337 106 HG13 ILE 14 1HG1 ILE 14 1.821 6.125 -10.773 107 HG21 ILE 14 1HG2 ILE 14 1.351 9.072 -13.867 108 HG22 ILE 14 2HG2 ILE 14 2.382 7.692 -14.231 109 HG23 ILE 14 3HG2 ILE 14 2.868 8.846 -12.995 110 HD11 ILE 14 3HD1 ILE 14 3.431 4.808 -12.054 111 HD12 ILE 14 1HD1 ILE 14 3.187 5.852 -13.455 112 HD13 ILE 14 2HD1 ILE 14 1.858 4.856 -12.853 113 H GLU 15 H GLU 15 1.698 10.615 -12.016 114 HA GLU 15 HA GLU 15 3.969 10.597 -10.341 115 HB2 GLU 15 2HB GLU 15 4.321 12.866 -11.113 116 HB3 GLU 15 1HB GLU 15 3.702 11.901 -12.450 117 HG2 GLU 15 2HG GLU 15 2.292 13.760 -12.677 118 HG3 GLU 15 1HG GLU 15 1.313 12.818 -11.561 119 H LYS 16 H LYS 16 0.706 11.850 -9.956 120 HA LYS 16 HA LYS 16 1.230 13.305 -7.524 121 HB2 LYS 16 2HB LYS 16 -0.706 13.788 -9.078 122 HB3 LYS 16 1HB LYS 16 -1.440 12.269 -8.576 123 HG2 LYS 16 2HG LYS 16 -1.526 13.045 -6.244 124 HG3 LYS 16 1HG LYS 16 -0.698 14.536 -6.691 125 HD2 LYS 16 2HD LYS 16 -2.594 15.137 -8.162 126 HD3 LYS 16 1HD LYS 16 -3.427 13.657 -7.686 127 HE2 LYS 16 2HE LYS 16 -2.588 15.881 -5.793 128 HE3 LYS 16 1HE LYS 16 -4.231 15.593 -6.366 129 HZ1 LYS 16 3HZ LYS 16 -2.902 14.378 -4.217 130 HZ2 LYS 16 1HZ LYS 16 -3.217 13.183 -5.379 131 HZ3 LYS 16 2HZ LYS 16 -4.493 14.119 -4.757 132 H VAL 17 H VAL 17 -0.336 10.180 -8.286 133 HA VAL 17 HA VAL 17 -0.853 9.394 -5.627 134 HB VAL 17 HB VAL 17 -0.362 7.623 -8.048 135 HG11 VAL 17 1HG1 VAL 17 -1.747 7.111 -5.382 136 HG12 VAL 17 2HG1 VAL 17 -0.307 6.296 -5.995 137 HG13 VAL 17 3HG1 VAL 17 -1.863 6.035 -6.773 138 HG21 VAL 17 3HG2 VAL 17 -2.118 9.301 -8.452 139 HG22 VAL 17 1HG2 VAL 17 -2.921 8.835 -6.952 140 HG23 VAL 17 2HG2 VAL 17 -2.821 7.693 -8.292 141 H TRP 18 H TRP 18 1.932 8.801 -7.772 142 HA TRP 18 HA TRP 18 3.343 7.012 -6.174 143 HB2 TRP 18 2HB TRP 18 4.034 7.600 -8.458 144 HB3 TRP 18 1HB TRP 18 4.414 9.241 -7.940 145 HD1 TRP 18 HD TRP 18 6.467 9.509 -6.171 146 HE1 TRP 18 1HE TRP 18 8.582 8.076 -5.844 147 HE3 TRP 18 3HE TRP 18 5.036 5.260 -8.610 148 HZ2 TRP 18 2HZ TRP 18 9.541 5.476 -6.529 149 HZ3 TRP 18 3HZ TRP 18 6.573 3.323 -8.759 150 HH2 TRP 18 HH TRP 18 8.824 3.427 -7.725 151 H LYS 19 H LYS 19 3.205 10.568 -6.001 152 HA LYS 19 HA LYS 19 5.237 10.896 -4.073 153 HB2 LYS 19 2HB LYS 19 4.298 12.711 -5.528 154 HB3 LYS 19 1HB LYS 19 2.818 12.679 -4.570 155 HG2 LYS 19 2HG LYS 19 4.112 13.253 -2.542 156 HG3 LYS 19 1HG LYS 19 5.594 13.256 -3.495 157 HD2 LYS 19 2HD LYS 19 4.699 15.104 -4.870 158 HD3 LYS 19 1HD LYS 19 3.216 15.093 -3.916 159 HE2 LYS 19 2HE LYS 19 4.762 16.854 -3.120 160 HE3 LYS 19 1HE LYS 19 4.515 15.623 -1.879 161 HZ1 LYS 19 3HZ LYS 19 6.655 14.913 -3.601 162 HZ2 LYS 19 1HZ LYS 19 6.657 15.117 -1.917 163 HZ3 LYS 19 2HZ LYS 19 6.921 16.453 -2.933 164 H TYR 20 H TYR 20 1.660 10.899 -3.662 165 HA TYR 20 HA TYR 20 1.787 11.033 -0.807 166 HB2 TYR 20 2HB TYR 20 -0.467 10.253 -2.690 167 HB3 TYR 20 1HB TYR 20 -0.669 10.456 -0.956 168 HD1 TYR 20 1HD TYR 20 0.217 12.697 0.081 169 HD2 TYR 20 2HD TYR 20 -0.779 12.219 -4.073 170 HE1 TYR 20 1HE TYR 20 -0.040 15.140 -0.139 171 HE2 TYR 20 2HE TYR 20 -1.033 14.670 -4.285 172 HH TYR 20 HH TYR 20 -1.609 16.651 -2.144 173 H TRP 21 H TRP 21 1.336 8.372 -3.089 174 HA TRP 21 HA TRP 21 0.761 6.362 -1.209 175 HB2 TRP 21 2HB TRP 21 0.394 6.094 -3.630 176 HB3 TRP 21 1HB TRP 21 2.133 6.135 -3.917 177 HD1 TRP 21 HD TRP 21 3.516 3.972 -3.363 178 HE1 TRP 21 1HE TRP 21 2.870 1.576 -2.685 179 HE3 TRP 21 3HE TRP 21 -1.410 4.685 -2.276 180 HZ2 TRP 21 2HZ TRP 21 0.552 0.147 -1.785 181 HZ3 TRP 21 3HZ TRP 21 -2.817 2.798 -1.506 182 HH2 TRP 21 HH TRP 21 -1.843 0.531 -1.259 183 H ASN 22 H ASN 22 3.701 7.971 -1.977 184 HA ASN 22 HA ASN 22 5.389 5.941 -0.587 185 HB2 ASN 22 2HB ASN 22 6.067 8.283 -2.387 186 HB3 ASN 22 1HB ASN 22 7.258 7.251 -1.597 187 HD21 ASN 22 1HD2 ASN 22 6.781 7.546 -4.546 188 HD22 ASN 22 2HD2 ASN 22 6.396 5.986 -5.095 189 H GLU 23 H GLU 23 3.963 9.088 -0.305 190 HA GLU 23 HA GLU 23 5.866 10.207 1.464 191 HB2 GLU 23 2HB GLU 23 4.142 11.568 0.259 192 HB3 GLU 23 1HB GLU 23 2.915 10.921 1.340 193 HG2 GLU 23 2HG GLU 23 4.109 11.874 3.275 194 HG3 GLU 23 1HG GLU 23 5.378 12.473 2.217 195 HA PRO 24 HA PRO 24 4.564 7.516 4.923 196 HB2 PRO 24 2HB PRO 24 6.171 8.493 6.941 197 HB3 PRO 24 1HB PRO 24 6.802 7.477 5.627 198 HG2 PRO 24 2HG PRO 24 6.865 10.475 5.878 199 HG3 PRO 24 1HG PRO 24 8.173 9.368 5.403 200 HD2 PRO 24 2HD PRO 24 6.719 10.751 3.554 201 HD3 PRO 24 1HD PRO 24 7.338 9.121 3.206 202 H ALA 25 H ALA 25 4.713 11.042 5.281 203 HA ALA 25 HA ALA 25 3.116 11.297 7.596 204 HB1 ALA 25 1HB ALA 25 2.801 13.629 6.877 205 HB2 ALA 25 2HB ALA 25 3.411 13.222 5.270 206 HB3 ALA 25 3HB ALA 25 4.479 13.131 6.670 207 H HIS 26 H HIS 26 2.279 11.127 4.161 208 HA HIS 26 HA HIS 26 -0.492 11.697 4.456 209 HB2 HIS 26 2HB HIS 26 0.720 11.770 2.282 210 HB3 HIS 26 1HB HIS 26 0.868 10.018 2.321 211 HD2 HIS 26 2HD HIS 26 -1.299 8.709 1.207 212 HE1 HIS 26 1HE HIS 26 -4.051 11.908 1.319 213 HE2 HIS 26 2HE HIS 26 -3.708 9.502 0.584 214 H ILE 27 H ILE 27 1.328 8.611 4.341 215 HA ILE 27 HA ILE 27 -0.928 6.905 4.493 216 HB ILE 27 HB ILE 27 1.942 6.463 5.423 217 HG12 ILE 27 2HG1 ILE 27 0.547 5.541 2.861 218 HG13 ILE 27 1HG1 ILE 27 1.537 6.995 2.956 219 HG21 ILE 27 1HG2 ILE 27 0.521 4.792 6.511 220 HG22 ILE 27 2HG2 ILE 27 1.336 3.993 5.182 221 HG23 ILE 27 3HG2 ILE 27 -0.346 4.484 5.008 222 HD11 ILE 27 3HD1 ILE 27 2.495 4.177 3.550 223 HD12 ILE 27 1HD1 ILE 27 3.474 5.640 3.679 224 HD13 ILE 27 2HD1 ILE 27 2.866 5.120 2.108 225 H MET 28 H MET 28 1.154 8.310 7.021 226 HA MET 28 HA MET 28 0.082 7.029 9.234 227 HB2 MET 28 2HB MET 28 2.101 8.411 9.349 228 HB3 MET 28 1HB MET 28 1.145 9.860 9.041 229 HG2 MET 28 2HG MET 28 0.055 9.721 11.178 230 HG3 MET 28 1HG MET 28 0.552 8.060 11.411 231 HE1 MET 28 3HE MET 28 3.146 10.858 10.038 232 HE2 MET 28 1HE MET 28 3.261 11.749 11.560 233 HE3 MET 28 2HE MET 28 1.705 11.578 10.753 234 H LYS 29 H LYS 29 -1.454 9.270 7.175 235 HA LYS 29 HA LYS 29 -3.361 10.257 9.145 236 HB2 LYS 29 2HB LYS 29 -2.523 11.608 7.185 237 HB3 LYS 29 1HB LYS 29 -3.420 10.534 6.117 238 HG2 LYS 29 2HG LYS 29 -5.519 11.122 7.233 239 HG3 LYS 29 1HG LYS 29 -4.647 12.159 8.363 240 HD2 LYS 29 2HD LYS 29 -3.879 13.558 6.458 241 HD3 LYS 29 1HD LYS 29 -4.799 12.534 5.351 242 HE2 LYS 29 2HE LYS 29 -5.953 14.160 7.641 243 HE3 LYS 29 1HE LYS 29 -6.097 14.544 5.925 244 HZ1 LYS 29 3HZ LYS 29 -7.151 12.303 5.669 245 HZ2 LYS 29 1HZ LYS 29 -8.066 13.431 6.545 246 HZ3 LYS 29 2HZ LYS 29 -7.217 12.209 7.365 247 H TRP 30 H TRP 30 -3.144 7.663 6.837 248 HA TRP 30 HA TRP 30 -5.832 6.676 7.617 249 HB2 TRP 30 2HB TRP 30 -6.431 6.184 5.302 250 HB3 TRP 30 1HB TRP 30 -6.097 7.908 5.459 251 HD1 TRP 30 HD TRP 30 -3.760 8.799 4.411 252 HE1 TRP 30 1HE TRP 30 -2.236 7.834 2.571 253 HE3 TRP 30 3HE TRP 30 -5.619 4.045 4.102 254 HZ2 TRP 30 2HZ TRP 30 -1.854 5.386 1.151 255 HZ3 TRP 30 3HZ TRP 30 -4.665 2.432 2.512 256 HH2 TRP 30 HH TRP 30 -2.793 3.090 1.020 257 H CYS 31 H CYS 31 -2.960 5.925 8.199 258 HA CYS 31 HA CYS 31 -2.248 3.601 6.794 259 HB2 CYS 31 2HB CYS 31 -0.873 4.928 8.486 260 HB3 CYS 31 1HB CYS 31 -1.778 4.112 9.747 261 HG CYS 31 HG CYS 31 -0.542 2.142 7.765 262 H GLN 32 H GLN 32 -3.034 1.578 6.823 263 HA GLN 32 HA GLN 32 -4.286 -0.254 7.328 264 HB2 GLN 32 2HB GLN 32 -4.459 0.889 10.136 265 HB3 GLN 32 1HB GLN 32 -4.853 -0.755 9.661 266 HG2 GLN 32 2HG GLN 32 -2.108 0.501 9.288 267 HG3 GLN 32 1HG GLN 32 -2.549 -0.529 10.646 268 HE21 GLN 32 1HE2 GLN 32 -0.928 -0.710 7.786 269 HE22 GLN 32 2HE2 GLN 32 -1.260 -2.320 7.359 270 H ALA 33 H ALA 33 -5.517 2.892 8.139 271 HA ALA 33 HA ALA 33 -7.597 3.815 8.095 272 HB1 ALA 33 1HB ALA 33 -8.072 1.603 6.071 273 HB2 ALA 33 2HB ALA 33 -7.372 3.182 5.710 274 HB3 ALA 33 3HB ALA 33 -9.045 3.063 6.258 275 H SER 34 H SER 34 -7.035 1.680 10.072 276 HA SER 34 HA SER 34 -9.779 0.611 10.479 277 HB2 SER 34 2HB SER 34 -8.149 -1.173 10.101 278 HB3 SER 34 1HB SER 34 -7.158 -0.565 11.424 279 HG SER 34 HG SER 34 -8.390 -1.745 12.641 280 HA PRO 35 HA PRO 35 -9.584 3.166 14.210 281 HB2 PRO 35 2HB PRO 35 -11.849 2.351 15.520 282 HB3 PRO 35 1HB PRO 35 -11.931 3.298 14.016 283 HG2 PRO 35 2HG PRO 35 -12.181 0.316 14.371 284 HG3 PRO 35 1HG PRO 35 -13.209 1.417 13.427 285 HD2 PRO 35 2HD PRO 35 -11.224 -0.071 12.255 286 HD3 PRO 35 1HD PRO 35 -11.670 1.542 11.646 287 H GLU 36 H GLU 36 -9.340 -0.248 14.158 288 HA GLU 36 HA GLU 36 -8.905 -0.629 17.027 289 HB2 GLU 36 2HB GLU 36 -8.612 -2.506 14.662 290 HB3 GLU 36 1HB GLU 36 -8.447 -2.981 16.354 291 HG2 GLU 36 2HG GLU 36 -10.766 -2.241 16.790 292 HG3 GLU 36 1HG GLU 36 -10.932 -1.773 15.098 293 H TRP 37 H TRP 37 -7.117 0.928 14.893 294 HA TRP 37 HA TRP 37 -4.589 0.249 16.215 295 HB2 TRP 37 2HB TRP 37 -5.078 -0.060 13.231 296 HB3 TRP 37 1HB TRP 37 -3.458 0.196 13.882 297 HD1 TRP 37 HD TRP 37 -6.293 -2.366 13.874 298 HE1 TRP 37 1HE TRP 37 -5.363 -4.624 14.676 299 HE3 TRP 37 3HE TRP 37 -1.621 -0.918 15.291 300 HZ2 TRP 37 2HZ TRP 37 -2.940 -5.679 15.791 301 HZ3 TRP 37 3HZ TRP 37 -0.018 -2.560 16.225 302 HH2 TRP 37 HH TRP 37 -0.670 -4.938 16.476 303 H HIS 38 H HIS 38 -2.920 1.791 15.747 304 HA HIS 38 HA HIS 38 -3.746 4.376 14.629 305 HB2 HIS 38 2HB HIS 38 -4.434 4.390 17.060 306 HB3 HIS 38 1HB HIS 38 -2.752 4.099 17.501 307 HD2 HIS 38 2HD HIS 38 -4.637 6.876 15.340 308 HE1 HIS 38 1HE HIS 38 -1.339 8.646 17.284 309 HE2 HIS 38 2HE HIS 38 -3.312 9.085 15.749 310 H VAL 39 H VAL 39 -1.890 5.848 14.506 311 HA VAL 39 HA VAL 39 0.770 4.550 14.581 312 HB VAL 39 HB VAL 39 -0.366 6.023 12.197 313 HG11 VAL 39 1HG1 VAL 39 2.356 4.751 12.690 314 HG12 VAL 39 2HG1 VAL 39 2.042 6.465 12.443 315 HG13 VAL 39 3HG1 VAL 39 1.796 5.331 11.120 316 HG21 VAL 39 3HG2 VAL 39 0.228 3.082 12.733 317 HG22 VAL 39 1HG2 VAL 39 0.046 3.731 11.113 318 HG23 VAL 39 2HG2 VAL 39 -1.305 3.801 12.239 319 HA PRO 40 HA PRO 40 0.927 8.830 16.341 320 HB2 PRO 40 2HB PRO 40 2.595 8.355 18.460 321 HB3 PRO 40 1HB PRO 40 0.870 7.925 18.512 322 HG2 PRO 40 2HG PRO 40 3.239 6.147 18.003 323 HG3 PRO 40 1HG PRO 40 1.788 5.827 18.972 324 HD2 PRO 40 2HD PRO 40 2.139 4.912 16.376 325 HD3 PRO 40 1HD PRO 40 0.541 5.156 17.112 326 H ALA 41 H ALA 41 3.102 6.868 14.723 327 HA ALA 41 HA ALA 41 4.770 9.079 13.940 328 HB1 ALA 41 1HB ALA 41 5.808 8.540 16.107 329 HB2 ALA 41 2HB ALA 41 6.894 8.152 14.772 330 HB3 ALA 41 3HB ALA 41 6.011 6.868 15.599 331 H ALA 42 H ALA 42 6.120 8.558 12.134 332 HA ALA 42 HA ALA 42 6.302 5.879 11.130 333 HB1 ALA 42 1HB ALA 42 3.954 6.353 10.554 334 HB2 ALA 42 2HB ALA 42 4.947 6.227 9.104 335 HB3 ALA 42 3HB ALA 42 4.459 7.812 9.704 336 H GLN 43 H GLN 43 7.759 5.725 9.403 337 HA GLN 43 HA GLN 43 8.791 8.180 8.207 338 HB2 GLN 43 2HB GLN 43 10.010 7.694 10.463 339 HB3 GLN 43 1HB GLN 43 10.728 6.306 9.644 340 HG2 GLN 43 2HG GLN 43 11.576 7.847 7.869 341 HG3 GLN 43 1HG GLN 43 10.916 9.206 8.775 342 HE21 GLN 43 1HE2 GLN 43 12.815 10.242 9.484 343 HE22 GLN 43 2HE2 GLN 43 14.014 9.483 10.417 344 H ASN 44 H ASN 44 10.080 7.770 6.370 345 HA ASN 44 HA ASN 44 10.597 5.099 5.430 346 HB2 ASN 44 2HB ASN 44 8.134 5.271 5.023 347 HB3 ASN 44 1HB ASN 44 8.425 6.673 3.996 348 HD21 ASN 44 1HD2 ASN 44 7.195 4.474 2.820 349 HD22 ASN 44 2HD2 ASN 44 8.279 3.683 1.781 350 H ASP 45 H ASP 45 12.639 5.624 4.848 351 HA ASP 45 HA ASP 45 13.240 8.077 3.351 352 HB2 ASP 45 2HB ASP 45 14.997 5.753 4.222 353 HB3 ASP 45 1HB ASP 45 15.571 7.249 3.485 354 H LEU 46 H LEU 46 12.119 7.745 1.384 355 HA LEU 46 HA LEU 46 12.277 5.357 -0.133 356 HB2 LEU 46 2HB LEU 46 10.534 7.114 -0.494 357 HB3 LEU 46 1HB LEU 46 11.780 8.197 -1.110 358 HG LEU 46 HG LEU 46 12.247 6.549 -2.960 359 HD11 LEU 46 1HD1 LEU 46 10.289 4.815 -3.309 360 HD12 LEU 46 2HD1 LEU 46 10.059 4.974 -1.568 361 HD13 LEU 46 3HD1 LEU 46 11.599 4.413 -2.211 362 HD21 LEU 46 3HD2 LEU 46 9.362 7.436 -2.752 363 HD22 LEU 46 1HD2 LEU 46 10.208 7.034 -4.242 364 HD23 LEU 46 2HD2 LEU 46 10.698 8.442 -3.299 365 H LYS 47 H LYS 47 14.394 4.652 -0.389 366 HA LYS 47 HA LYS 47 15.873 5.802 -2.542 367 HB2 LYS 47 2HB LYS 47 16.491 7.395 -0.696 368 HB3 LYS 47 1HB LYS 47 17.147 6.040 0.217 369 HG2 LYS 47 2HG LYS 47 18.778 5.589 -1.574 370 HG3 LYS 47 1HG LYS 47 18.083 6.883 -2.552 371 HD2 LYS 47 2HD LYS 47 18.698 8.525 -0.800 372 HD3 LYS 47 1HD LYS 47 19.410 7.226 0.157 373 HE2 LYS 47 2HE LYS 47 20.296 8.057 -2.625 374 HE3 LYS 47 1HE LYS 47 21.152 8.410 -1.122 375 HZ1 LYS 47 3HZ LYS 47 22.184 6.506 -1.897 376 HZ2 LYS 47 1HZ LYS 47 20.739 5.810 -2.449 377 HZ3 LYS 47 2HZ LYS 47 21.061 5.887 -0.782 378 H ALA 48 H ALA 48 17.285 4.320 -3.390 379 HA ALA 48 HA ALA 48 17.043 1.611 -2.677 380 HB1 ALA 48 1HB ALA 48 18.884 1.236 -4.266 381 HB2 ALA 48 2HB ALA 48 19.248 2.964 -4.263 382 HB3 ALA 48 3HB ALA 48 17.718 2.388 -4.922 383 H GLY 49 H GLY 49 18.242 0.279 -1.372 384 HA2 GLY 49 2HA GLY 49 19.882 -0.433 0.096 385 HA3 GLY 49 1HA GLY 49 20.838 0.994 -0.301 386 H GLY 50 H GLY 50 17.850 2.128 0.403 387 HA2 GLY 50 2HA GLY 50 18.592 2.971 3.125 388 HA3 GLY 50 1HA GLY 50 17.248 3.569 2.152 389 H THR 51 H THR 51 16.656 3.045 4.677 390 HA THR 51 HA THR 51 14.983 0.582 4.572 391 HB THR 51 HB THR 51 16.861 -0.000 5.997 392 HG1 THR 51 1HG THR 51 14.810 -0.581 6.753 393 HG21 THR 51 3HG2 THR 51 17.678 2.287 6.466 394 HG22 THR 51 1HG2 THR 51 17.472 1.365 7.952 395 HG23 THR 51 2HG2 THR 51 16.277 2.575 7.497 396 H PHE 52 H PHE 52 13.290 0.648 6.251 397 HA PHE 52 HA PHE 52 12.329 3.395 6.911 398 HB2 PHE 52 2HB PHE 52 10.090 2.814 6.138 399 HB3 PHE 52 1HB PHE 52 11.230 2.626 4.807 400 HD1 PHE 52 1HD PHE 52 11.866 0.356 3.994 401 HD2 PHE 52 2HD PHE 52 9.040 0.848 7.199 402 HE1 PHE 52 1HE PHE 52 11.188 -2.018 3.767 403 HE2 PHE 52 2HE PHE 52 8.363 -1.527 6.969 404 HZ PHE 52 HZ PHE 52 9.440 -2.958 5.251 405 H THR 53 H THR 53 10.490 3.302 8.466 406 HA THR 53 HA THR 53 10.149 0.922 10.073 407 HB THR 53 HB THR 53 11.516 3.328 11.345 408 HG1 THR 53 1HG THR 53 13.164 2.444 10.373 409 HG21 THR 53 3HG2 THR 53 10.087 2.025 12.879 410 HG22 THR 53 1HG2 THR 53 11.790 1.783 13.258 411 HG23 THR 53 2HG2 THR 53 10.898 0.539 12.383 412 H THR 54 H THR 54 8.093 0.980 10.753 413 HA THR 54 HA THR 54 6.755 3.603 11.190 414 HB THR 54 HB THR 54 5.450 1.092 10.081 415 HG1 THR 54 1HG THR 54 6.138 1.732 8.233 416 HG21 THR 54 3HG2 THR 54 4.492 3.966 10.302 417 HG22 THR 54 1HG2 THR 54 3.917 2.623 11.286 418 HG23 THR 54 2HG2 THR 54 3.599 2.647 9.553 419 H THR 55 H THR 55 6.016 3.862 13.206 420 HA THR 55 HA THR 55 6.029 1.599 15.081 421 HB THR 55 HB THR 55 5.284 4.526 15.549 422 HG1 THR 55 1HG THR 55 7.316 4.823 15.221 423 HG21 THR 55 3HG2 THR 55 6.135 2.295 17.435 424 HG22 THR 55 1HG2 THR 55 4.524 3.008 17.331 425 HG23 THR 55 2HG2 THR 55 5.881 3.976 17.897 426 H MET 56 H MET 56 4.244 0.321 15.067 427 HA MET 56 HA MET 56 1.540 1.564 14.773 428 HB2 MET 56 2HB MET 56 2.509 -1.210 13.995 429 HB3 MET 56 1HB MET 56 0.864 -0.599 13.822 430 HG2 MET 56 2HG MET 56 1.681 1.169 12.292 431 HG3 MET 56 1HG MET 56 3.323 0.562 12.473 432 HE1 MET 56 3HE MET 56 -0.322 -0.614 11.703 433 HE2 MET 56 1HE MET 56 -0.111 -1.254 10.073 434 HE3 MET 56 2HE MET 56 0.183 0.449 10.392 435 H ALA 57 H ALA 57 0.497 1.555 16.671 436 HA ALA 57 HA ALA 57 0.710 -0.811 18.455 437 HB1 ALA 57 1HB ALA 57 0.870 2.080 19.354 438 HB2 ALA 57 2HB ALA 57 2.215 0.939 19.341 439 HB3 ALA 57 3HB ALA 57 0.839 0.664 20.408 440 H ALA 58 H ALA 58 -1.162 -1.413 19.382 441 HA ALA 58 HA ALA 58 -3.629 -0.476 18.301 442 HB1 ALA 58 1HB ALA 58 -3.364 -2.768 19.129 443 HB2 ALA 58 2HB ALA 58 -4.672 -1.953 19.985 444 HB3 ALA 58 3HB ALA 58 -3.103 -2.161 20.765 445 H LYS 59 H LYS 59 -5.260 0.764 19.271 446 HA LYS 59 HA LYS 59 -4.491 3.030 20.708 447 HB2 LYS 59 2HB LYS 59 -6.955 3.362 21.063 448 HB3 LYS 59 1HB LYS 59 -6.541 2.983 19.391 449 HG2 LYS 59 2HG LYS 59 -7.117 0.596 19.804 450 HG3 LYS 59 1HG LYS 59 -7.592 1.010 21.450 451 HD2 LYS 59 2HD LYS 59 -9.314 2.541 20.571 452 HD3 LYS 59 1HD LYS 59 -8.845 2.121 18.925 453 HE2 LYS 59 2HE LYS 59 -9.430 -0.248 19.373 454 HE3 LYS 59 1HE LYS 59 -9.923 0.189 21.006 455 HZ1 LYS 59 3HZ LYS 59 -11.756 1.307 20.257 456 HZ2 LYS 59 1HZ LYS 59 -11.663 0.076 19.094 457 HZ3 LYS 59 2HZ LYS 59 -11.088 1.633 18.729 458 H ASP 60 H ASP 60 -5.657 -0.094 21.830 459 HA ASP 60 HA ASP 60 -5.868 0.725 24.624 460 HB2 ASP 60 2HB ASP 60 -7.358 -1.009 23.608 461 HB3 ASP 60 1HB ASP 60 -5.960 -2.059 23.398 462 H GLY 61 H GLY 61 -3.360 -0.127 22.539 463 HA2 GLY 61 2HA GLY 61 -1.125 -0.520 22.890 464 HA3 GLY 61 1HA GLY 61 -1.383 -0.123 24.585 465 H SER 62 H SER 62 -3.429 -2.593 23.367 466 HA SER 62 HA SER 62 -2.481 -4.552 25.165 467 HB2 SER 62 2HB SER 62 -4.778 -4.549 24.275 468 HB3 SER 62 1HB SER 62 -4.160 -4.903 22.664 469 HG SER 62 HG SER 62 -3.830 -6.912 23.240 470 H MET 63 H MET 63 -1.897 -4.011 21.706 471 HA MET 63 HA MET 63 0.503 -5.733 21.829 472 HB2 MET 63 2HB MET 63 -1.414 -7.135 20.984 473 HB3 MET 63 1HB MET 63 -1.612 -6.001 19.645 474 HG2 MET 63 2HG MET 63 0.646 -6.508 18.833 475 HG3 MET 63 1HG MET 63 0.962 -7.523 20.240 476 HE1 MET 63 3HE MET 63 -1.692 -6.980 17.399 477 HE2 MET 63 1HE MET 63 -1.542 -8.514 16.535 478 HE3 MET 63 2HE MET 63 -0.161 -7.425 16.654 479 H SER 64 H SER 64 2.125 -5.092 20.485 480 HA SER 64 HA SER 64 1.675 -2.986 18.488 481 HB2 SER 64 2HB SER 64 3.408 -1.553 19.434 482 HB3 SER 64 1HB SER 64 2.165 -1.823 20.652 483 HG SER 64 HG SER 64 4.436 -2.117 21.310 484 H PHE 65 H PHE 65 3.460 -2.710 17.071 485 HA PHE 65 HA PHE 65 5.717 -4.520 17.181 486 HB2 PHE 65 2HB PHE 65 3.845 -5.980 16.321 487 HB3 PHE 65 1HB PHE 65 3.677 -4.890 14.943 488 HD1 PHE 65 1HD PHE 65 5.995 -7.234 16.685 489 HD2 PHE 65 2HD PHE 65 5.303 -4.951 13.104 490 HE1 PHE 65 1HE PHE 65 7.873 -8.399 15.577 491 HE2 PHE 65 2HE PHE 65 7.183 -6.125 12.001 492 HZ PHE 65 HZ PHE 65 8.472 -7.845 13.236 493 H ASP 66 H ASP 66 7.081 -4.252 15.202 494 HA ASP 66 HA ASP 66 6.728 -1.648 13.814 495 HB2 ASP 66 2HB ASP 66 9.090 -1.096 14.265 496 HB3 ASP 66 1HB ASP 66 8.171 -1.225 15.763 497 H PHE 67 H PHE 67 6.907 -1.974 11.698 498 HA PHE 67 HA PHE 67 8.257 -4.388 10.636 499 HB2 PHE 67 2HB PHE 67 6.560 -2.279 9.248 500 HB3 PHE 67 1HB PHE 67 7.166 -3.767 8.518 501 HD1 PHE 67 1HD PHE 67 6.300 -5.986 9.242 502 HD2 PHE 67 2HD PHE 67 4.694 -2.334 10.853 503 HE1 PHE 67 1HE PHE 67 4.359 -7.232 10.146 504 HE2 PHE 67 2HE PHE 67 2.756 -3.584 11.751 505 HZ PHE 67 HZ PHE 67 2.588 -6.033 11.401 506 H GLY 68 H GLY 68 10.002 -4.282 9.274 507 HA2 GLY 68 2HA GLY 68 11.080 -1.737 8.326 508 HA3 GLY 68 1HA GLY 68 12.046 -2.567 9.550 509 H GLY 69 H GLY 69 12.829 -2.057 6.875 510 HA2 GLY 69 2HA GLY 69 13.855 -4.595 6.117 511 HA3 GLY 69 1HA GLY 69 12.510 -4.139 5.067 512 H VAL 70 H VAL 70 14.503 -4.276 3.552 513 HA VAL 70 HA VAL 70 15.682 -1.549 3.259 514 HB VAL 70 HB VAL 70 17.043 -4.202 2.640 515 HG11 VAL 70 1HG1 VAL 70 19.056 -2.753 2.320 516 HG12 VAL 70 2HG1 VAL 70 18.039 -1.330 2.530 517 HG13 VAL 70 3HG1 VAL 70 17.793 -2.397 1.148 518 HG21 VAL 70 3HG2 VAL 70 16.839 -3.837 5.066 519 HG22 VAL 70 1HG2 VAL 70 17.509 -2.213 4.891 520 HG23 VAL 70 2HG2 VAL 70 18.511 -3.626 4.555 521 H TYR 71 H TYR 71 15.492 -0.673 1.278 522 HA TYR 71 HA TYR 71 13.797 -1.935 -0.703 523 HB2 TYR 71 2HB TYR 71 15.394 0.652 -0.796 524 HB3 TYR 71 1HB TYR 71 14.160 0.161 -1.955 525 HD1 TYR 71 1HD TYR 71 11.781 -0.247 -1.160 526 HD2 TYR 71 2HD TYR 71 14.728 1.685 1.316 527 HE1 TYR 71 1HE TYR 71 9.991 0.631 0.297 528 HE2 TYR 71 2HE TYR 71 12.925 2.565 2.763 529 HH TYR 71 HH TYR 71 9.670 2.539 1.874 530 H ASP 72 H ASP 72 14.523 -3.339 -2.192 531 HA ASP 72 HA ASP 72 17.335 -3.785 -2.663 532 HB2 ASP 72 2HB ASP 72 14.889 -4.834 -4.116 533 HB3 ASP 72 1HB ASP 72 16.531 -5.458 -4.275 534 H GLN 73 H GLN 73 14.633 -2.410 -4.522 535 HA GLN 73 HA GLN 73 16.499 -0.793 -6.135 536 HB2 GLN 73 2HB GLN 73 14.484 -2.705 -7.385 537 HB3 GLN 73 1HB GLN 73 15.438 -1.505 -8.255 538 HG2 GLN 73 2HG GLN 73 17.532 -2.649 -7.409 539 HG3 GLN 73 1HG GLN 73 16.507 -3.909 -6.732 540 HE21 GLN 73 1HE2 GLN 73 18.150 -5.011 -8.421 541 HE22 GLN 73 2HE2 GLN 73 17.476 -5.277 -9.957 542 H VAL 74 H VAL 74 15.621 1.145 -6.723 543 HA VAL 74 HA VAL 74 12.703 1.607 -6.394 544 HB VAL 74 HB VAL 74 14.877 3.432 -5.282 545 HG11 VAL 74 1HG1 VAL 74 12.942 4.584 -4.231 546 HG12 VAL 74 2HG1 VAL 74 11.839 3.507 -5.084 547 HG13 VAL 74 3HG1 VAL 74 12.848 4.639 -5.985 548 HG21 VAL 74 3HG2 VAL 74 13.003 1.485 -3.874 549 HG22 VAL 74 1HG2 VAL 74 13.989 2.698 -3.054 550 HG23 VAL 74 2HG2 VAL 74 14.764 1.394 -3.948 551 H LYS 75 H LYS 75 11.918 2.625 -8.132 552 HA LYS 75 HA LYS 75 13.601 4.516 -9.664 553 HB2 LYS 75 2HB LYS 75 12.147 2.160 -10.901 554 HB3 LYS 75 1HB LYS 75 12.934 3.455 -11.788 555 HG2 LYS 75 2HG LYS 75 15.105 2.789 -10.626 556 HG3 LYS 75 1HG LYS 75 14.235 1.404 -9.964 557 HD2 LYS 75 2HD LYS 75 15.200 0.436 -11.892 558 HD3 LYS 75 1HD LYS 75 13.616 0.899 -12.513 559 HE2 LYS 75 2HE LYS 75 15.361 1.579 -14.089 560 HE3 LYS 75 1HE LYS 75 14.659 3.031 -13.380 561 HZ1 LYS 75 3HZ LYS 75 16.968 1.783 -12.078 562 HZ2 LYS 75 1HZ LYS 75 16.500 3.413 -12.107 563 HZ3 LYS 75 2HZ LYS 75 17.223 2.713 -13.475 564 H THR 76 H THR 76 12.441 6.280 -10.109 565 HA THR 76 HA THR 76 9.817 6.654 -9.210 566 HB THR 76 HB THR 76 11.252 8.257 -11.362 567 HG1 THR 76 1HG THR 76 11.922 7.778 -8.846 568 HG21 THR 76 3HG2 THR 76 9.925 10.135 -10.426 569 HG22 THR 76 1HG2 THR 76 9.112 9.010 -9.338 570 HG23 THR 76 2HG2 THR 76 8.883 8.875 -11.083 571 H ASN 77 H ASN 77 7.853 6.409 -10.121 572 HA ASN 77 HA ASN 77 6.219 5.669 -11.544 573 HB2 ASN 77 2HB ASN 77 8.051 6.934 -13.593 574 HB3 ASN 77 1HB ASN 77 6.366 6.501 -13.867 575 HD21 ASN 77 1HD2 ASN 77 7.890 9.213 -13.642 576 HD22 ASN 77 2HD2 ASN 77 6.917 10.107 -12.580 577 H ASP 78 H ASP 78 7.504 3.525 -10.828 578 HA ASP 78 HA ASP 78 7.525 1.832 -13.225 579 HB2 ASP 78 2HB ASP 78 9.909 2.129 -11.405 580 HB3 ASP 78 1HB ASP 78 9.758 0.885 -12.637 581 H LEU 79 H LEU 79 9.042 1.208 -10.108 582 HA LEU 79 HA LEU 79 6.757 -0.095 -8.945 583 HB2 LEU 79 2HB LEU 79 7.370 -2.385 -9.161 584 HB3 LEU 79 1HB LEU 79 7.652 -1.733 -10.767 585 HG LEU 79 HG LEU 79 9.818 -2.173 -8.660 586 HD11 LEU 79 1HD1 LEU 79 8.901 -4.289 -9.490 587 HD12 LEU 79 2HD1 LEU 79 10.544 -4.030 -10.080 588 HD13 LEU 79 3HD1 LEU 79 9.168 -3.759 -11.153 589 HD21 LEU 79 3HD2 LEU 79 9.935 -1.321 -11.583 590 HD22 LEU 79 1HD2 LEU 79 11.345 -1.779 -10.627 591 HD23 LEU 79 2HD2 LEU 79 10.416 -0.351 -10.190 592 H ILE 80 H ILE 80 7.239 -1.053 -6.875 593 HA ILE 80 HA ILE 80 9.816 -0.220 -5.638 594 HB ILE 80 HB ILE 80 7.086 0.268 -4.358 595 HG12 ILE 80 2HG1 ILE 80 9.120 2.287 -5.424 596 HG13 ILE 80 1HG1 ILE 80 7.653 1.838 -6.272 597 HG21 ILE 80 1HG2 ILE 80 8.471 1.444 -2.631 598 HG22 ILE 80 2HG2 ILE 80 9.929 0.942 -3.480 599 HG23 ILE 80 3HG2 ILE 80 8.882 -0.260 -2.732 600 HD11 ILE 80 3HD1 ILE 80 6.296 2.615 -4.357 601 HD12 ILE 80 1HD1 ILE 80 7.273 3.901 -5.062 602 HD13 ILE 80 2HD1 ILE 80 7.774 3.146 -3.551 603 H GLU 81 H GLU 81 10.642 -1.701 -4.287 604 HA GLU 81 HA GLU 81 9.010 -3.861 -3.159 605 HB2 GLU 81 2HB GLU 81 10.560 -5.605 -4.084 606 HB3 GLU 81 1HB GLU 81 9.604 -4.809 -5.332 607 HG2 GLU 81 2HG GLU 81 11.502 -3.329 -5.866 608 HG3 GLU 81 1HG GLU 81 12.472 -4.109 -4.621 609 H TYR 82 H TYR 82 10.124 -4.988 -1.509 610 HA TYR 82 HA TYR 82 12.787 -4.202 -0.669 611 HB2 TYR 82 2HB TYR 82 11.990 -3.332 1.556 612 HB3 TYR 82 1HB TYR 82 11.574 -2.284 0.206 613 HD1 TYR 82 1HD TYR 82 9.254 -2.231 -0.716 614 HD2 TYR 82 2HD TYR 82 10.222 -4.499 2.811 615 HE1 TYR 82 1HE TYR 82 6.851 -2.400 -0.160 616 HE2 TYR 82 2HE TYR 82 7.812 -4.653 3.358 617 HH TYR 82 HH TYR 82 5.597 -4.567 1.954 618 H THR 83 H THR 83 13.540 -5.498 1.089 619 HA THR 83 HA THR 83 12.154 -8.104 1.291 620 HB THR 83 HB THR 83 14.951 -7.295 2.207 621 HG1 THR 83 1HG THR 83 13.946 -8.369 -0.201 622 HG21 THR 83 3HG2 THR 83 13.628 -10.003 1.785 623 HG22 THR 83 1HG2 THR 83 14.113 -9.313 3.335 624 HG23 THR 83 2HG2 THR 83 15.335 -9.757 2.147 625 H ILE 84 H ILE 84 11.258 -8.789 3.158 626 HA ILE 84 HA ILE 84 11.292 -7.003 5.537 627 HB ILE 84 HB ILE 84 9.423 -9.287 4.780 628 HG12 ILE 84 2HG1 ILE 84 8.915 -6.278 4.802 629 HG13 ILE 84 1HG1 ILE 84 9.274 -7.192 3.341 630 HG21 ILE 84 1HG2 ILE 84 9.418 -7.308 7.107 631 HG22 ILE 84 2HG2 ILE 84 9.525 -9.062 7.206 632 HG23 ILE 84 3HG2 ILE 84 8.030 -8.311 6.686 633 HD11 ILE 84 3HD1 ILE 84 6.843 -6.861 3.635 634 HD12 ILE 84 1HD1 ILE 84 6.903 -7.726 5.165 635 HD13 ILE 84 2HD1 ILE 84 7.273 -8.566 3.658 636 H GLY 85 H GLY 85 11.648 -7.907 7.600 637 HA2 GLY 85 2HA GLY 85 13.815 -9.606 7.888 638 HA3 GLY 85 1HA GLY 85 12.637 -9.287 9.157 639 H ASP 86 H ASP 86 10.341 -10.463 8.003 640 HA ASP 86 HA ASP 86 10.623 -13.160 8.714 641 HB2 ASP 86 2HB ASP 86 8.513 -11.747 7.043 642 HB3 ASP 86 1HB ASP 86 8.341 -13.387 7.666 643 H GLY 87 H GLY 87 11.406 -11.498 5.814 644 HA2 GLY 87 2HA GLY 87 12.637 -12.335 4.011 645 HA3 GLY 87 1HA GLY 87 12.255 -13.983 4.496 646 H ARG 88 H ARG 88 9.494 -12.045 4.539 647 HA ARG 88 HA ARG 88 8.304 -13.419 2.302 648 HB2 ARG 88 2HB ARG 88 7.378 -11.014 3.914 649 HB3 ARG 88 1HB ARG 88 6.387 -11.865 2.726 650 HG2 ARG 88 2HG ARG 88 6.606 -13.952 4.021 651 HG3 ARG 88 1HG ARG 88 7.604 -13.119 5.213 652 HD2 ARG 88 2HD ARG 88 4.753 -12.341 4.521 653 HD3 ARG 88 1HD ARG 88 5.215 -13.309 5.920 654 HE ARG 88 HE ARG 88 6.723 -10.937 5.968 655 HH11 ARG 88 1HH2 ARG 88 3.438 -12.020 6.230 656 HH12 ARG 88 2HH2 ARG 88 2.951 -10.722 7.269 657 HH21 ARG 88 1HH1 ARG 88 6.083 -9.235 7.323 658 HH22 ARG 88 2HH1 ARG 88 4.447 -9.146 7.886 659 H LYS 89 H LYS 89 7.991 -12.706 0.233 660 HA LYS 89 HA LYS 89 9.538 -10.359 -0.631 661 HB2 LYS 89 2HB LYS 89 9.680 -12.703 -1.727 662 HB3 LYS 89 1HB LYS 89 8.077 -12.382 -2.375 663 HG2 LYS 89 2HG LYS 89 9.418 -11.600 -4.155 664 HG3 LYS 89 1HG LYS 89 9.197 -10.106 -3.243 665 HD2 LYS 89 2HD LYS 89 11.402 -10.548 -2.098 666 HD3 LYS 89 1HD LYS 89 11.603 -11.976 -3.108 667 HE2 LYS 89 2HE LYS 89 12.825 -10.076 -4.068 668 HE3 LYS 89 1HE LYS 89 11.491 -10.532 -5.131 669 HZ1 LYS 89 3HZ LYS 89 10.231 -8.720 -4.447 670 HZ2 LYS 89 1HZ LYS 89 11.795 -8.076 -4.573 671 HZ3 LYS 89 2HZ LYS 89 11.159 -8.465 -3.046 672 H VAL 90 H VAL 90 8.630 -8.561 -1.438 673 HA VAL 90 HA VAL 90 5.728 -8.457 -2.025 674 HB VAL 90 HB VAL 90 7.196 -6.405 -0.314 675 HG11 VAL 90 1HG1 VAL 90 5.363 -5.440 -1.639 676 HG12 VAL 90 2HG1 VAL 90 4.890 -5.525 0.054 677 HG13 VAL 90 3HG1 VAL 90 4.269 -6.711 -1.092 678 HG21 VAL 90 3HG2 VAL 90 5.232 -8.604 0.458 679 HG22 VAL 90 1HG2 VAL 90 5.723 -7.289 1.525 680 HG23 VAL 90 2HG2 VAL 90 6.913 -8.463 0.969 681 H ARG 91 H ARG 91 5.324 -7.389 -3.842 682 HA ARG 91 HA ARG 91 7.300 -5.484 -4.984 683 HB2 ARG 91 2HB ARG 91 5.921 -7.744 -6.477 684 HB3 ARG 91 1HB ARG 91 6.933 -6.493 -7.204 685 HG2 ARG 91 2HG ARG 91 8.856 -7.258 -5.843 686 HG3 ARG 91 1HG ARG 91 7.845 -8.511 -5.122 687 HD2 ARG 91 2HD ARG 91 9.169 -9.474 -6.943 688 HD3 ARG 91 1HD ARG 91 7.461 -9.472 -7.384 689 HE ARG 91 HE ARG 91 7.943 -7.965 -9.079 690 HH11 ARG 91 1HH2 ARG 91 10.529 -7.992 -6.756 691 HH12 ARG 91 2HH2 ARG 91 11.564 -6.975 -7.701 692 HH21 ARG 91 1HH1 ARG 91 9.296 -6.621 -10.296 693 HH22 ARG 91 2HH1 ARG 91 10.867 -6.202 -9.701 694 H ILE 92 H ILE 92 6.366 -3.696 -5.803 695 HA ILE 92 HA ILE 92 3.381 -3.614 -6.126 696 HB ILE 92 HB ILE 92 5.221 -1.403 -5.094 697 HG12 ILE 92 2HG1 ILE 92 3.110 -3.013 -3.577 698 HG13 ILE 92 1HG1 ILE 92 4.842 -3.317 -3.469 699 HG21 ILE 92 1HG2 ILE 92 2.193 -1.553 -5.431 700 HG22 ILE 92 2HG2 ILE 92 3.291 -0.526 -6.348 701 HG23 ILE 92 3HG2 ILE 92 3.046 -0.233 -4.636 702 HD11 ILE 92 3HD1 ILE 92 5.198 -1.005 -2.657 703 HD12 ILE 92 1HD1 ILE 92 4.132 -1.924 -1.598 704 HD13 ILE 92 2HD1 ILE 92 3.457 -0.729 -2.703 705 H VAL 93 H VAL 93 3.014 -3.442 -8.257 706 HA VAL 93 HA VAL 93 4.877 -1.846 -9.966 707 HB VAL 93 HB VAL 93 2.921 -4.036 -10.779 708 HG11 VAL 93 1HG1 VAL 93 5.085 -2.546 -12.317 709 HG12 VAL 93 2HG1 VAL 93 3.346 -2.427 -12.586 710 HG13 VAL 93 3HG1 VAL 93 4.188 -3.932 -12.935 711 HG21 VAL 93 3HG2 VAL 93 5.945 -4.112 -10.422 712 HG22 VAL 93 1HG2 VAL 93 4.975 -5.404 -11.134 713 HG23 VAL 93 2HG2 VAL 93 4.757 -4.972 -9.440 714 H PHE 94 H PHE 94 4.100 -0.026 -10.806 715 HA PHE 94 HA PHE 94 1.232 0.667 -10.456 716 HB2 PHE 94 2HB PHE 94 3.671 2.319 -11.232 717 HB3 PHE 94 1HB PHE 94 2.039 2.965 -11.053 718 HD1 PHE 94 1HD PHE 94 4.951 1.552 -9.259 719 HD2 PHE 94 2HD PHE 94 0.975 3.143 -8.823 720 HE1 PHE 94 1HE PHE 94 5.284 1.735 -6.819 721 HE2 PHE 94 2HE PHE 94 1.323 3.323 -6.379 722 HZ PHE 94 HZ PHE 94 3.479 2.609 -5.383 723 H THR 95 H THR 95 -0.118 0.785 -12.136 724 HA THR 95 HA THR 95 0.909 0.843 -14.926 725 HB THR 95 HB THR 95 -0.789 -0.850 -15.533 726 HG1 THR 95 1HG THR 95 -1.409 -2.021 -13.383 727 HG21 THR 95 3HG2 THR 95 0.351 -2.803 -14.586 728 HG22 THR 95 1HG2 THR 95 1.037 -1.806 -13.304 729 HG23 THR 95 2HG2 THR 95 1.542 -1.563 -14.976 730 H HIS 96 H HIS 96 -0.603 1.676 -16.421 731 HA HIS 96 HA HIS 96 -3.076 2.897 -15.442 732 HB2 HIS 96 2HB HIS 96 -2.381 5.165 -16.204 733 HB3 HIS 96 1HB HIS 96 -1.398 4.592 -14.855 734 HD2 HIS 96 2HD HIS 96 1.328 4.324 -15.424 735 HE1 HIS 96 1HE HIS 96 1.090 5.135 -19.560 736 HE2 HIS 96 2HE HIS 96 2.680 4.739 -17.619 737 H THR 97 H THR 97 -4.536 3.271 -17.061 738 HA THR 97 HA THR 97 -3.919 2.088 -19.693 739 HB THR 97 HB THR 97 -6.338 2.171 -20.037 740 HG1 THR 97 1HG THR 97 -7.601 3.328 -18.792 741 HG21 THR 97 3HG2 THR 97 -7.015 0.671 -18.210 742 HG22 THR 97 1HG2 THR 97 -5.638 1.200 -17.247 743 HG23 THR 97 2HG2 THR 97 -5.376 0.285 -18.732 744 H GLY 98 H GLY 98 -5.029 5.145 -18.259 745 HA2 GLY 98 2HA GLY 98 -3.742 6.827 -20.062 746 HA3 GLY 98 1HA GLY 98 -5.354 6.554 -20.714 747 H ASP 99 H ASP 99 -7.150 6.807 -19.020 748 HA ASP 99 HA ASP 99 -6.734 9.345 -17.504 749 HB2 ASP 99 2HB ASP 99 -9.271 8.105 -18.618 750 HB3 ASP 99 1HB ASP 99 -9.161 9.644 -17.765 751 H THR 100 H THR 100 -6.375 6.355 -16.716 752 HA THR 100 HA THR 100 -7.496 6.659 -14.040 753 HB THR 100 HB THR 100 -8.295 4.247 -15.730 754 HG1 THR 100 1HG THR 100 -10.264 5.185 -15.861 755 HG21 THR 100 3HG2 THR 100 -9.806 3.801 -13.801 756 HG22 THR 100 1HG2 THR 100 -9.093 5.161 -12.941 757 HG23 THR 100 2HG2 THR 100 -8.111 3.749 -13.325 758 H THR 101 H THR 101 -5.884 6.109 -12.735 759 HA THR 101 HA THR 101 -3.688 4.409 -13.640 760 HB THR 101 HB THR 101 -4.134 5.722 -10.929 761 HG1 THR 101 1HG THR 101 -2.687 6.586 -13.207 762 HG21 THR 101 3HG2 THR 101 -2.464 3.922 -10.853 763 HG22 THR 101 1HG2 THR 101 -1.655 5.486 -10.767 764 HG23 THR 101 2HG2 THR 101 -1.658 4.581 -12.279 765 H ASN 102 H ASN 102 -3.164 2.436 -12.758 766 HA ASN 102 HA ASN 102 -5.146 1.100 -10.976 767 HB2 ASN 102 2HB ASN 102 -5.423 0.354 -13.350 768 HB3 ASN 102 1HB ASN 102 -3.733 -0.151 -13.373 769 HD21 ASN 102 1HD2 ASN 102 -3.858 -2.433 -13.325 770 HD22 ASN 102 2HD2 ASN 102 -4.740 -3.315 -12.174 771 H ILE 103 H ILE 103 -4.199 0.428 -9.182 772 HA ILE 103 HA ILE 103 -1.240 0.088 -9.050 773 HB ILE 103 HB ILE 103 -3.298 0.246 -6.810 774 HG12 ILE 103 2HG1 ILE 103 -1.363 2.401 -7.761 775 HG13 ILE 103 1HG1 ILE 103 -3.075 2.373 -8.170 776 HG21 ILE 103 1HG2 ILE 103 -0.259 0.333 -6.784 777 HG22 ILE 103 2HG2 ILE 103 -1.269 -0.957 -6.134 778 HG23 ILE 103 3HG2 ILE 103 -1.278 0.628 -5.376 779 HD11 ILE 103 3HD1 ILE 103 -1.923 2.564 -5.370 780 HD12 ILE 103 1HD1 ILE 103 -3.644 2.420 -5.744 781 HD13 ILE 103 2HD1 ILE 103 -2.742 3.840 -6.264 782 H VAL 104 H VAL 104 -0.440 -1.929 -9.001 783 HA VAL 104 HA VAL 104 -2.173 -4.218 -8.170 784 HB VAL 104 HB VAL 104 -0.061 -4.209 -10.362 785 HG11 VAL 104 1HG1 VAL 104 -0.262 -6.395 -9.258 786 HG12 VAL 104 2HG1 VAL 104 -1.006 -6.475 -10.851 787 HG13 VAL 104 3HG1 VAL 104 -2.017 -6.337 -9.415 788 HG21 VAL 104 3HG2 VAL 104 -1.994 -4.475 -11.898 789 HG22 VAL 104 1HG2 VAL 104 -2.060 -2.938 -11.039 790 HG23 VAL 104 2HG2 VAL 104 -3.097 -4.273 -10.537 791 H GLU 105 H GLU 105 -1.361 -5.301 -6.531 792 HA GLU 105 HA GLU 105 1.553 -5.501 -6.094 793 HB2 GLU 105 2HB GLU 105 1.256 -4.903 -3.684 794 HB3 GLU 105 1HB GLU 105 0.922 -3.548 -4.760 795 HG2 GLU 105 2HG GLU 105 -1.506 -4.015 -4.590 796 HG3 GLU 105 1HG GLU 105 -1.172 -5.358 -3.505 797 H SER 106 H SER 106 2.149 -7.333 -5.011 798 HA SER 106 HA SER 106 0.045 -9.239 -4.125 799 HB2 SER 106 2HB SER 106 1.225 -11.063 -5.239 800 HB3 SER 106 1HB SER 106 0.803 -9.837 -6.432 801 HG SER 106 HG SER 106 2.864 -9.282 -6.607 802 H PHE 107 H PHE 107 0.649 -10.594 -2.451 803 HA PHE 107 HA PHE 107 3.259 -10.005 -1.100 804 HB2 PHE 107 2HB PHE 107 0.558 -10.632 0.156 805 HB3 PHE 107 1HB PHE 107 2.060 -10.282 1.016 806 HD1 PHE 107 1HD PHE 107 -0.640 -8.849 -1.082 807 HD2 PHE 107 2HD PHE 107 2.953 -7.975 1.117 808 HE1 PHE 107 1HE PHE 107 -1.119 -6.428 -1.259 809 HE2 PHE 107 2HE PHE 107 2.468 -5.553 0.936 810 HZ PHE 107 HZ PHE 107 0.436 -4.778 -0.254 811 H ASP 108 H ASP 108 3.778 -11.794 0.489 812 HA ASP 108 HA ASP 108 2.950 -14.501 -0.440 813 HB2 ASP 108 2HB ASP 108 5.801 -13.548 -0.048 814 HB3 ASP 108 1HB ASP 108 5.305 -15.196 -0.437 815 HA PRO 109 HA PRO 109 3.117 -14.094 4.191 816 HB2 PRO 109 2HB PRO 109 0.578 -14.858 4.830 817 HB3 PRO 109 1HB PRO 109 0.945 -13.205 4.284 818 HG2 PRO 109 2HG PRO 109 -0.250 -15.480 2.735 819 HG3 PRO 109 1HG PRO 109 -0.645 -13.753 2.680 820 HD2 PRO 109 2HD PRO 109 1.012 -15.050 0.815 821 HD3 PRO 109 1HD PRO 109 1.024 -13.296 1.104 822 H GLU 110 H GLU 110 2.135 -15.944 5.823 823 HA GLU 110 HA GLU 110 3.701 -18.230 5.315 824 HB2 GLU 110 2HB GLU 110 3.012 -17.410 7.581 825 HB3 GLU 110 1HB GLU 110 1.383 -17.984 7.259 826 HG2 GLU 110 2HG GLU 110 2.230 -20.288 6.991 827 HG3 GLU 110 1HG GLU 110 3.872 -19.720 7.268 828 H GLU 111 H GLU 111 3.246 -20.180 4.483 829 HA GLU 111 HA GLU 111 1.070 -20.444 2.658 830 HB2 GLU 111 2HB GLU 111 3.323 -21.574 2.404 831 HB3 GLU 111 1HB GLU 111 2.862 -22.678 3.698 832 HG2 GLU 111 2HG GLU 111 2.401 -23.755 1.556 833 HG3 GLU 111 1HG GLU 111 0.861 -23.376 2.318 834 H THR 112 H THR 112 1.690 -21.768 5.882 835 HA THR 112 HA THR 112 -0.499 -23.543 5.994 836 HB THR 112 HB THR 112 -0.201 -23.486 8.419 837 HG1 THR 112 1HG THR 112 0.025 -21.273 8.690 838 HG21 THR 112 3HG2 THR 112 2.203 -23.997 8.533 839 HG22 THR 112 1HG2 THR 112 2.453 -23.223 6.970 840 HG23 THR 112 2HG2 THR 112 1.490 -24.697 7.080 841 H ASN 113 H ASN 113 -0.214 -20.109 6.855 842 HA ASN 113 HA ASN 113 -2.727 -19.828 8.053 843 HB2 ASN 113 2HB ASN 113 -0.962 -17.843 6.589 844 HB3 ASN 113 1HB ASN 113 -2.445 -17.354 7.410 845 HD21 ASN 113 1HD2 ASN 113 -0.959 -16.046 8.845 846 HD22 ASN 113 2HD2 ASN 113 -0.184 -16.824 10.139 847 HA PRO 114 HA PRO 114 -5.446 -20.070 4.503 848 HB2 PRO 114 2HB PRO 114 -7.659 -18.668 5.348 849 HB3 PRO 114 1HB PRO 114 -7.210 -20.240 6.052 850 HG2 PRO 114 2HG PRO 114 -6.602 -17.481 7.100 851 HG3 PRO 114 1HG PRO 114 -7.273 -18.875 7.971 852 HD2 PRO 114 2HD PRO 114 -4.621 -18.280 8.123 853 HD3 PRO 114 1HD PRO 114 -5.178 -19.968 8.100 854 H ARG 115 H ARG 115 -4.808 -19.024 2.710 855 HA ARG 115 HA ARG 115 -4.105 -16.293 2.532 856 HB2 ARG 115 2HB ARG 115 -4.133 -16.686 0.066 857 HB3 ARG 115 1HB ARG 115 -3.245 -17.934 0.939 858 HG2 ARG 115 2HG ARG 115 -5.251 -19.399 0.865 859 HG3 ARG 115 1HG ARG 115 -6.114 -18.163 -0.047 860 HD2 ARG 115 2HD ARG 115 -4.435 -18.300 -1.842 861 HD3 ARG 115 1HD ARG 115 -3.570 -19.542 -0.938 862 HE ARG 115 HE ARG 115 -6.233 -20.391 -1.247 863 HH11 ARG 115 1HH2 ARG 115 -3.409 -19.715 -3.150 864 HH12 ARG 115 2HH2 ARG 115 -3.800 -20.866 -4.384 865 HH21 ARG 115 1HH1 ARG 115 -6.742 -21.897 -2.862 866 HH22 ARG 115 2HH1 ARG 115 -5.687 -22.100 -4.221 867 H GLU 116 H GLU 116 -7.128 -18.011 2.077 868 HA GLU 116 HA GLU 116 -8.590 -16.073 0.696 869 HB2 GLU 116 2HB GLU 116 -9.345 -18.426 1.121 870 HB3 GLU 116 1HB GLU 116 -9.640 -18.000 2.805 871 HG2 GLU 116 2HG GLU 116 -11.306 -16.315 2.112 872 HG3 GLU 116 1HG GLU 116 -10.974 -16.667 0.419 873 H LEU 117 H LEU 117 -8.168 -16.540 4.210 874 HA LEU 117 HA LEU 117 -9.886 -14.435 5.004 875 HB2 LEU 117 2HB LEU 117 -8.731 -16.448 6.348 876 HB3 LEU 117 1HB LEU 117 -7.497 -15.241 6.693 877 HG LEU 117 HG LEU 117 -10.467 -15.031 7.332 878 HD11 LEU 117 1HD1 LEU 117 -8.042 -15.246 9.146 879 HD12 LEU 117 2HD1 LEU 117 -9.187 -16.543 8.808 880 HD13 LEU 117 3HD1 LEU 117 -9.720 -15.102 9.673 881 HD21 LEU 117 3HD2 LEU 117 -9.824 -12.806 6.858 882 HD22 LEU 117 1HD2 LEU 117 -8.224 -12.991 7.578 883 HD23 LEU 117 2HD2 LEU 117 -9.663 -12.911 8.602 884 H GLN 118 H GLN 118 -6.351 -14.560 4.530 885 HA GLN 118 HA GLN 118 -5.805 -11.872 5.237 886 HB2 GLN 118 2HB GLN 118 -4.344 -13.722 3.320 887 HB3 GLN 118 1HB GLN 118 -3.691 -12.214 3.966 888 HG2 GLN 118 2HG GLN 118 -3.911 -13.093 6.257 889 HG3 GLN 118 1HG GLN 118 -4.565 -14.603 5.622 890 HE21 GLN 118 1HE2 GLN 118 -2.968 -16.186 5.666 891 HE22 GLN 118 2HE2 GLN 118 -1.334 -15.930 5.291 892 H GLN 119 H GLN 119 -6.630 -13.391 2.125 893 HA GLN 119 HA GLN 119 -6.209 -11.225 0.433 894 HB2 GLN 119 2HB GLN 119 -6.805 -13.545 -0.294 895 HB3 GLN 119 1HB GLN 119 -8.463 -13.256 0.230 896 HG2 GLN 119 2HG GLN 119 -8.655 -11.384 -1.378 897 HG3 GLN 119 1HG GLN 119 -6.987 -11.640 -1.878 898 HE21 GLN 119 1HE2 GLN 119 -6.818 -12.875 -3.747 899 HE22 GLN 119 2HE2 GLN 119 -7.940 -14.048 -4.247 900 H SER 120 H SER 120 -9.027 -11.993 2.436 901 HA SER 120 HA SER 120 -10.726 -9.938 1.524 902 HB2 SER 120 2HB SER 120 -11.506 -11.809 2.926 903 HB3 SER 120 1HB SER 120 -10.571 -11.186 4.284 904 HG SER 120 HG SER 120 -11.937 -9.539 4.486 905 H GLY 121 H GLY 121 -8.276 -9.997 4.098 906 HA2 GLY 121 2HA GLY 121 -8.765 -7.437 5.171 907 HA3 GLY 121 1HA GLY 121 -7.240 -8.308 5.265 908 H TRP 122 H TRP 122 -6.380 -8.470 2.707 909 HA TRP 122 HA TRP 122 -5.335 -5.893 2.169 910 HB2 TRP 122 2HB TRP 122 -5.479 -8.396 0.440 911 HB3 TRP 122 1HB TRP 122 -4.570 -6.956 -0.012 912 HD1 TRP 122 HD TRP 122 -4.168 -10.114 1.909 913 HE1 TRP 122 1HE TRP 122 -1.991 -10.056 3.277 914 HE3 TRP 122 3HE TRP 122 -2.990 -5.166 1.474 915 HZ2 TRP 122 2HZ TRP 122 -0.004 -8.164 4.078 916 HZ3 TRP 122 3HZ TRP 122 -0.947 -4.264 2.546 917 HH2 TRP 122 HH TRP 122 0.546 -5.756 3.848 918 H GLN 123 H GLN 123 -8.110 -7.633 0.870 919 HA GLN 123 HA GLN 123 -8.677 -5.677 -1.180 920 HB2 GLN 123 2HB GLN 123 -9.350 -8.079 -1.348 921 HB3 GLN 123 1HB GLN 123 -10.495 -7.826 -0.030 922 HG2 GLN 123 2HG GLN 123 -11.686 -6.133 -1.364 923 HG3 GLN 123 1HG GLN 123 -10.512 -6.299 -2.663 924 HE21 GLN 123 1HE2 GLN 123 -12.891 -6.760 -3.642 925 HE22 GLN 123 2HE2 GLN 123 -13.283 -8.408 -3.748 926 H ALA 124 H ALA 124 -9.749 -6.298 2.129 927 HA ALA 124 HA ALA 124 -11.956 -4.581 2.240 928 HB1 ALA 124 1HB ALA 124 -11.597 -4.587 4.689 929 HB2 ALA 124 2HB ALA 124 -9.992 -5.280 4.440 930 HB3 ALA 124 3HB ALA 124 -11.431 -6.205 4.009 931 H ILE 125 H ILE 125 -8.564 -3.888 3.163 932 HA ILE 125 HA ILE 125 -8.968 -1.192 3.864 933 HB ILE 125 HB ILE 125 -6.970 -2.418 4.535 934 HG12 ILE 125 2HG1 ILE 125 -6.148 -0.179 2.623 935 HG13 ILE 125 1HG1 ILE 125 -6.834 0.095 4.224 936 HG21 ILE 125 1HG2 ILE 125 -6.197 -2.427 1.601 937 HG22 ILE 125 2HG2 ILE 125 -6.784 -3.822 2.501 938 HG23 ILE 125 3HG2 ILE 125 -5.250 -3.086 2.927 939 HD11 ILE 125 3HD1 ILE 125 -4.951 -1.212 5.211 940 HD12 ILE 125 1HD1 ILE 125 -4.399 0.218 4.344 941 HD13 ILE 125 2HD1 ILE 125 -4.250 -1.376 3.604 942 H LEU 126 H LEU 126 -8.257 -2.739 0.772 943 HA LEU 126 HA LEU 126 -7.770 -0.373 -0.717 944 HB2 LEU 126 2HB LEU 126 -8.648 -3.181 -1.441 945 HB3 LEU 126 1HB LEU 126 -8.514 -1.956 -2.698 946 HG LEU 126 HG LEU 126 -6.248 -2.769 -0.827 947 HD11 LEU 126 1HD1 LEU 126 -6.835 -4.590 -2.333 948 HD12 LEU 126 2HD1 LEU 126 -5.294 -3.890 -2.827 949 HD13 LEU 126 3HD1 LEU 126 -6.765 -3.509 -3.725 950 HD21 LEU 126 3HD2 LEU 126 -5.475 -0.705 -1.488 951 HD22 LEU 126 1HD2 LEU 126 -6.519 -0.612 -2.899 952 HD23 LEU 126 2HD2 LEU 126 -5.017 -1.536 -2.965 953 H ASN 127 H ASN 127 -10.761 -2.154 -0.006 954 HA ASN 127 HA ASN 127 -12.475 -0.616 -1.676 955 HB2 ASN 127 2HB ASN 127 -13.026 -2.147 0.889 956 HB3 ASN 127 1HB ASN 127 -14.277 -1.516 -0.182 957 HD21 ASN 127 1HD2 ASN 127 -13.464 -4.393 0.493 958 HD22 ASN 127 2HD2 ASN 127 -13.224 -5.119 -1.023 959 H SER 128 H SER 128 -11.392 -0.220 1.685 960 HA SER 128 HA SER 128 -13.072 1.880 2.456 961 HB2 SER 128 2HB SER 128 -10.194 1.413 3.284 962 HB3 SER 128 1HB SER 128 -11.361 2.415 4.144 963 HG SER 128 HG SER 128 -10.959 -0.125 4.473 964 H PHE 129 H PHE 129 -10.088 1.910 0.590 965 HA PHE 129 HA PHE 129 -9.554 4.664 0.615 966 HB2 PHE 129 2HB PHE 129 -8.007 2.925 -0.293 967 HB3 PHE 129 1HB PHE 129 -9.078 2.719 -1.675 968 HD1 PHE 129 1HD PHE 129 -9.304 4.482 -3.394 969 HD2 PHE 129 2HD PHE 129 -6.674 5.003 -0.029 970 HE1 PHE 129 1HE PHE 129 -8.258 6.425 -4.505 971 HE2 PHE 129 2HE PHE 129 -5.627 6.945 -1.154 972 HZ PHE 129 HZ PHE 129 -6.420 7.660 -3.393 973 H LYS 130 H LYS 130 -11.632 2.743 -1.547 974 HA LYS 130 HA LYS 130 -12.353 4.809 -3.332 975 HB2 LYS 130 2HB LYS 130 -13.917 2.352 -2.459 976 HB3 LYS 130 1HB LYS 130 -14.313 3.354 -3.858 977 HG2 LYS 130 2HG LYS 130 -12.097 2.852 -4.841 978 HG3 LYS 130 1HG LYS 130 -11.715 1.837 -3.450 979 HD2 LYS 130 2HD LYS 130 -13.658 0.382 -3.988 980 HD3 LYS 130 1HD LYS 130 -14.007 1.389 -5.393 981 HE2 LYS 130 2HE LYS 130 -11.460 -0.190 -4.924 982 HE3 LYS 130 1HE LYS 130 -12.733 -0.597 -6.075 983 HZ1 LYS 130 3HZ LYS 130 -11.210 0.532 -7.369 984 HZ2 LYS 130 1HZ LYS 130 -10.822 1.644 -6.149 985 HZ3 LYS 130 2HZ LYS 130 -12.309 1.763 -6.963 986 H SER 131 H SER 131 -13.904 3.665 -0.328 987 HA SER 131 HA SER 131 -16.136 5.403 -0.409 988 HB2 SER 131 2HB SER 131 -16.372 4.894 1.981 989 HB3 SER 131 1HB SER 131 -16.002 3.432 1.074 990 HG SER 131 HG SER 131 -14.420 3.266 2.447 991 H TYR 132 H TYR 132 -12.895 5.744 0.978 992 HA TYR 132 HA TYR 132 -13.289 8.182 2.337 993 HB2 TYR 132 2HB TYR 132 -11.298 6.746 2.665 994 HB3 TYR 132 1HB TYR 132 -10.756 7.124 1.029 995 HD1 TYR 132 1HD TYR 132 -11.292 8.501 4.438 996 HD2 TYR 132 2HD TYR 132 -9.828 9.345 0.483 997 HE1 TYR 132 1HE TYR 132 -10.249 10.587 5.267 998 HE2 TYR 132 2HE TYR 132 -8.783 11.431 1.318 999 HH TYR 132 HH TYR 132 -9.249 13.046 3.317 1000 H THR 133 H THR 133 -12.205 7.512 -0.990 1001 HA THR 133 HA THR 133 -11.693 10.154 -1.782 1002 HB THR 133 HB THR 133 -12.772 7.913 -3.537 1003 HG1 THR 133 1HG THR 133 -10.967 7.268 -2.336 1004 HG21 THR 133 3HG2 THR 133 -11.051 10.339 -4.152 1005 HG22 THR 133 1HG2 THR 133 -12.722 10.099 -4.666 1006 HG23 THR 133 2HG2 THR 133 -11.448 9.058 -5.297 1007 H GLU 134 H GLU 134 -14.692 8.240 -2.025 1008 HA GLU 134 HA GLU 134 -16.244 10.295 -3.251 1009 HB2 GLU 134 2HB GLU 134 -16.811 7.854 -3.290 1010 HB3 GLU 134 1HB GLU 134 -17.205 7.942 -1.575 1011 HG2 GLU 134 2HG GLU 134 -18.960 9.623 -2.058 1012 HG3 GLU 134 1HG GLU 134 -18.545 9.570 -3.766 1013 H ASN 135 H ASN 135 -15.840 9.223 0.114 1014 HA ASN 135 HA ASN 135 -17.712 10.997 1.290 1015 HB2 ASN 135 2HB ASN 135 -15.217 9.717 2.456 1016 HB3 ASN 135 1HB ASN 135 -16.468 10.520 3.404 1017 HD21 ASN 135 1HD2 ASN 135 -18.769 9.543 1.949 1018 HD22 ASN 135 2HD2 ASN 135 -18.875 7.870 2.220 1019 H ASN 136 H ASN 136 -14.270 11.312 0.522 1020 HA ASN 136 HA ASN 136 -13.790 13.746 1.892 1021 HB2 ASN 136 2HB ASN 136 -11.988 12.269 1.017 1022 HB3 ASN 136 1HB ASN 136 -12.446 12.701 -0.630 1023 HD21 ASN 136 1HD2 ASN 136 -10.595 13.945 -1.232 1024 HD22 ASN 136 2HD2 ASN 136 -10.117 15.354 -0.416 1025 H LEU 137 H LEU 137 -15.643 13.030 -0.866 1026 HA LEU 137 HA LEU 137 -16.722 14.283 -2.437 1027 HB2 LEU 137 2HB LEU 137 -17.522 15.354 -0.252 1028 HB3 LEU 137 1HB LEU 137 -16.291 16.588 -0.500 1029 HG LEU 137 HG LEU 137 -17.463 16.820 -2.926 1030 HD11 LEU 137 1HD1 LEU 137 -19.745 15.792 -1.200 1031 HD12 LEU 137 2HD1 LEU 137 -19.040 14.925 -2.563 1032 HD13 LEU 137 3HD1 LEU 137 -19.881 16.446 -2.830 1033 HD21 LEU 137 3HD2 LEU 137 -18.958 18.582 -2.002 1034 HD22 LEU 137 1HD2 LEU 137 -17.347 18.652 -1.290 1035 HD23 LEU 137 2HD2 LEU 137 -18.682 17.947 -0.380 1036 H GLU 138 H GLU 138 -14.984 14.082 -3.963 1037 HA GLU 138 HA GLU 138 -12.846 16.008 -4.074 1038 HB2 GLU 138 2HB GLU 138 -12.708 13.686 -5.015 1039 HB3 GLU 138 1HB GLU 138 -13.863 14.150 -6.262 1040 HG2 GLU 138 2HG GLU 138 -12.311 15.899 -7.065 1041 HG3 GLU 138 1HG GLU 138 -11.170 15.478 -5.792 1042 H HIS 139 H HIS 139 -13.949 18.031 -4.016 1043 HA HIS 139 HA HIS 139 -14.981 19.891 -4.883 1044 HB2 HIS 139 2HB HIS 139 -13.051 19.595 -6.449 1045 HB3 HIS 139 1HB HIS 139 -14.096 18.672 -7.527 1046 HD2 HIS 139 2HD HIS 139 -15.272 20.316 -9.417 1047 HE1 HIS 139 1HE HIS 139 -15.210 23.915 -7.210 1048 HE2 HIS 139 2HE HIS 139 -15.854 22.863 -9.428 1049 H HIS 140 H HIS 140 -16.482 17.215 -4.772 1050 HA HIS 140 HA HIS 140 -18.561 16.403 -5.260 1051 HB2 HIS 140 2HB HIS 140 -19.199 18.689 -4.433 1052 HB3 HIS 140 1HB HIS 140 -19.175 19.269 -6.092 1053 HD2 HIS 140 2HD HIS 140 -21.592 18.910 -7.400 1054 HE1 HIS 140 1HE HIS 140 -23.240 16.024 -4.795 1055 HE2 HIS 140 2HE HIS 140 -23.691 17.459 -6.841 1056 H HIS 141 H HIS 141 -20.294 16.371 -7.140 1057 HA HIS 141 HA HIS 141 -19.286 16.918 -9.801 1058 HB2 HIS 141 2HB HIS 141 -18.051 14.828 -9.206 1059 HB3 HIS 141 1HB HIS 141 -19.592 14.013 -8.929 1060 HD2 HIS 141 2HD HIS 141 -17.326 15.090 -11.913 1061 HE1 HIS 141 1HE HIS 141 -20.855 13.456 -13.553 1062 HE2 HIS 141 2HE HIS 141 -18.520 14.294 -14.094 1063 H HIS 142 H HIS 142 -20.909 16.906 -11.310 1064 HA HIS 142 HA HIS 142 -23.467 15.639 -10.901 1065 HB2 HIS 142 2HB HIS 142 -24.777 17.746 -10.750 1066 HB3 HIS 142 1HB HIS 142 -23.745 17.510 -9.341 1067 HD2 HIS 142 2HD HIS 142 -24.057 19.948 -12.392 1068 HE1 HIS 142 1HE HIS 142 -20.856 21.289 -9.989 1069 HE2 HIS 142 2HE HIS 142 -22.328 21.859 -11.980 1070 H HIS 143 H HIS 143 -21.357 17.829 -12.637 1071 HA HIS 143 HA HIS 143 -22.951 18.285 -14.925 1072 HB2 HIS 143 2HB HIS 143 -20.779 18.796 -16.050 1073 HB3 HIS 143 1HB HIS 143 -20.937 19.598 -14.488 1074 HD2 HIS 143 2HD HIS 143 -19.003 18.877 -12.605 1075 HE1 HIS 143 1HE HIS 143 -17.187 15.800 -14.853 1076 HE2 HIS 143 2HE HIS 143 -17.020 17.183 -12.731 1077 H HIS 144 H HIS 144 -23.278 17.130 -16.782 1078 HA HIS 144 HA HIS 144 -23.001 14.313 -16.727 1079 HB2 HIS 144 2HB HIS 144 -24.744 15.550 -18.020 1080 HB3 HIS 144 1HB HIS 144 -23.497 16.110 -19.134 1081 HD2 HIS 144 2HD HIS 144 -25.222 12.691 -18.120 1082 HE1 HIS 144 1HE HIS 144 -23.152 12.125 -21.755 1083 HE2 HIS 144 2HE HIS 144 -24.710 11.034 -20.071 Start of MODEL 14 1 H1 GLY 1 1HT GLY 1 -2.055 -19.179 -4.991 2 H2 GLY 1 2HT GLY 1 -3.656 -18.790 -5.409 3 H3 GLY 1 3HT GLY 1 -3.187 -20.416 -5.251 4 HA2 GLY 1 2HA GLY 1 -4.445 -19.089 -3.338 5 HA3 GLY 1 1HA GLY 1 -3.323 -20.409 -3.018 6 H ASN 2 H ASN 2 -1.019 -19.809 -2.729 7 HA ASN 2 HA ASN 2 -0.702 -17.807 -0.763 8 HB2 ASN 2 2HB ASN 2 1.419 -19.146 -2.473 9 HB3 ASN 2 1HB ASN 2 1.709 -18.273 -0.969 10 HD21 ASN 2 1HD2 ASN 2 1.481 -19.445 0.968 11 HD22 ASN 2 2HD2 ASN 2 0.865 -21.025 1.052 12 H LYS 3 H LYS 3 0.011 -17.846 -4.234 13 HA LYS 3 HA LYS 3 1.227 -15.235 -4.272 14 HB2 LYS 3 2HB LYS 3 0.052 -16.918 -6.514 15 HB3 LYS 3 1HB LYS 3 1.020 -15.460 -6.739 16 HG2 LYS 3 2HG LYS 3 2.912 -16.531 -5.562 17 HG3 LYS 3 1HG LYS 3 1.949 -17.993 -5.345 18 HD2 LYS 3 2HD LYS 3 1.770 -18.252 -7.794 19 HD3 LYS 3 1HD LYS 3 2.718 -16.781 -8.023 20 HE2 LYS 3 2HE LYS 3 4.141 -18.782 -8.251 21 HE3 LYS 3 1HE LYS 3 4.628 -17.828 -6.849 22 HZ1 LYS 3 3HZ LYS 3 4.376 -20.317 -6.529 23 HZ2 LYS 3 1HZ LYS 3 2.703 -20.061 -6.626 24 HZ3 LYS 3 2HZ LYS 3 3.604 -19.317 -5.394 25 H ILE 4 H ILE 4 -0.984 -14.805 -2.829 26 HA ILE 4 HA ILE 4 -3.403 -14.210 -4.064 27 HB ILE 4 HB ILE 4 -2.072 -12.618 -1.831 28 HG12 ILE 4 2HG1 ILE 4 -3.963 -15.009 -1.613 29 HG13 ILE 4 1HG1 ILE 4 -2.218 -15.130 -1.420 30 HG21 ILE 4 1HG2 ILE 4 -5.000 -12.951 -2.629 31 HG22 ILE 4 2HG2 ILE 4 -4.060 -11.469 -2.754 32 HG23 ILE 4 3HG2 ILE 4 -4.455 -12.122 -1.173 33 HD11 ILE 4 3HD1 ILE 4 -4.121 -13.532 0.313 34 HD12 ILE 4 1HD1 ILE 4 -2.366 -13.437 0.447 35 HD13 ILE 4 2HD1 ILE 4 -3.198 -14.954 0.786 36 H THR 5 H THR 5 -4.099 -12.602 -5.389 37 HA THR 5 HA THR 5 -2.315 -10.279 -5.957 38 HB THR 5 HB THR 5 -3.870 -11.887 -8.029 39 HG1 THR 5 1HG THR 5 -2.076 -12.931 -8.385 40 HG21 THR 5 3HG2 THR 5 -3.624 -9.514 -8.638 41 HG22 THR 5 1HG2 THR 5 -2.550 -10.497 -9.629 42 HG23 THR 5 2HG2 THR 5 -1.900 -9.577 -8.274 43 H VAL 6 H VAL 6 -3.360 -8.391 -5.870 44 HA VAL 6 HA VAL 6 -6.304 -8.251 -6.197 45 HB VAL 6 HB VAL 6 -6.395 -6.700 -4.216 46 HG11 VAL 6 1HG1 VAL 6 -7.062 -9.078 -4.010 47 HG12 VAL 6 2HG1 VAL 6 -6.355 -8.476 -2.512 48 HG13 VAL 6 3HG1 VAL 6 -5.406 -9.505 -3.587 49 HG21 VAL 6 3HG2 VAL 6 -4.021 -6.068 -4.103 50 HG22 VAL 6 1HG2 VAL 6 -3.566 -7.736 -3.753 51 HG23 VAL 6 2HG2 VAL 6 -4.501 -6.817 -2.580 52 H GLU 7 H GLU 7 -7.036 -6.095 -6.634 53 HA GLU 7 HA GLU 7 -5.042 -4.104 -7.483 54 HB2 GLU 7 2HB GLU 7 -6.024 -3.959 -9.762 55 HB3 GLU 7 1HB GLU 7 -5.260 -5.519 -9.463 56 HG2 GLU 7 2HG GLU 7 -7.477 -6.503 -8.947 57 HG3 GLU 7 1HG GLU 7 -8.245 -4.954 -9.281 58 H VAL 8 H VAL 8 -6.058 -2.044 -8.130 59 HA VAL 8 HA VAL 8 -8.859 -1.653 -7.279 60 HB VAL 8 HB VAL 8 -7.614 -1.261 -5.225 61 HG11 VAL 8 1HG1 VAL 8 -5.836 0.430 -5.072 62 HG12 VAL 8 2HG1 VAL 8 -5.925 0.684 -6.813 63 HG13 VAL 8 3HG1 VAL 8 -5.405 -0.876 -6.175 64 HG21 VAL 8 3HG2 VAL 8 -8.313 1.008 -4.717 65 HG22 VAL 8 1HG2 VAL 8 -9.504 0.298 -5.805 66 HG23 VAL 8 2HG2 VAL 8 -8.316 1.445 -6.423 67 H THR 9 H THR 9 -9.855 0.018 -8.355 68 HA THR 9 HA THR 9 -8.361 1.202 -10.624 69 HB THR 9 HB THR 9 -11.342 1.232 -9.997 70 HG1 THR 9 1HG THR 9 -10.989 -0.810 -10.451 71 HG21 THR 9 3HG2 THR 9 -11.533 1.774 -12.419 72 HG22 THR 9 1HG2 THR 9 -9.778 1.859 -12.529 73 HG23 THR 9 2HG2 THR 9 -10.658 3.028 -11.546 74 H VAL 10 H VAL 10 -7.494 3.184 -10.305 75 HA VAL 10 HA VAL 10 -8.911 5.148 -8.543 76 HB VAL 10 HB VAL 10 -5.908 4.851 -8.954 77 HG11 VAL 10 1HG1 VAL 10 -5.790 6.505 -7.096 78 HG12 VAL 10 2HG1 VAL 10 -7.547 6.615 -7.093 79 HG13 VAL 10 3HG1 VAL 10 -6.628 7.181 -8.487 80 HG21 VAL 10 3HG2 VAL 10 -7.681 4.118 -6.589 81 HG22 VAL 10 1HG2 VAL 10 -5.916 4.078 -6.584 82 HG23 VAL 10 2HG2 VAL 10 -6.817 2.985 -7.628 83 H TYR 11 H TYR 11 -9.460 6.980 -9.539 84 HA TYR 11 HA TYR 11 -8.513 7.502 -12.306 85 HB2 TYR 11 2HB TYR 11 -10.774 8.772 -10.720 86 HB3 TYR 11 1HB TYR 11 -10.406 9.049 -12.423 87 HD1 TYR 11 1HD TYR 11 -10.854 7.302 -14.124 88 HD2 TYR 11 2HD TYR 11 -11.733 6.612 -9.968 89 HE1 TYR 11 1HE TYR 11 -12.204 5.308 -14.732 90 HE2 TYR 11 2HE TYR 11 -13.083 4.625 -10.589 91 HH TYR 11 HH TYR 11 -13.517 3.682 -13.998 92 H ALA 12 H ALA 12 -6.443 8.287 -11.737 93 HA ALA 12 HA ALA 12 -6.311 11.109 -11.292 94 HB1 ALA 12 1HB ALA 12 -5.264 9.320 -9.074 95 HB2 ALA 12 2HB ALA 12 -6.653 10.399 -8.953 96 HB3 ALA 12 3HB ALA 12 -5.041 11.068 -9.185 97 H ALA 13 H ALA 13 -4.202 11.935 -11.667 98 HA ALA 13 HA ALA 13 -2.656 10.426 -13.494 99 HB1 ALA 13 1HB ALA 13 -1.325 12.382 -13.687 100 HB2 ALA 13 2HB ALA 13 -1.589 12.851 -12.005 101 HB3 ALA 13 3HB ALA 13 -2.890 13.014 -13.182 102 H ILE 14 H ILE 14 -0.942 9.081 -13.196 103 HA ILE 14 HA ILE 14 -0.366 7.866 -10.774 104 HB ILE 14 HB ILE 14 0.230 6.961 -12.995 105 HG12 ILE 14 2HG1 ILE 14 2.674 7.174 -11.171 106 HG13 ILE 14 1HG1 ILE 14 1.306 6.114 -10.843 107 HG21 ILE 14 1HG2 ILE 14 1.180 9.147 -13.906 108 HG22 ILE 14 2HG2 ILE 14 2.180 7.731 -14.219 109 HG23 ILE 14 3HG2 ILE 14 2.628 8.851 -12.935 110 HD11 ILE 14 3HD1 ILE 14 1.686 4.932 -12.942 111 HD12 ILE 14 1HD1 ILE 14 3.147 4.921 -11.959 112 HD13 ILE 14 2HD1 ILE 14 3.023 6.008 -13.332 113 H GLU 15 H GLU 15 1.167 10.694 -12.223 114 HA GLU 15 HA GLU 15 3.393 10.884 -10.522 115 HB2 GLU 15 2HB GLU 15 3.428 13.290 -11.209 116 HB3 GLU 15 1HB GLU 15 3.266 12.183 -12.572 117 HG2 GLU 15 2HG GLU 15 0.811 12.548 -12.557 118 HG3 GLU 15 1HG GLU 15 0.995 13.704 -11.244 119 H LYS 16 H LYS 16 0.047 11.924 -10.117 120 HA LYS 16 HA LYS 16 0.540 13.430 -7.699 121 HB2 LYS 16 2HB LYS 16 -1.385 13.853 -9.242 122 HB3 LYS 16 1HB LYS 16 -2.071 12.298 -8.776 123 HG2 LYS 16 2HG LYS 16 -2.219 13.041 -6.428 124 HG3 LYS 16 1HG LYS 16 -1.466 14.578 -6.857 125 HD2 LYS 16 2HD LYS 16 -3.371 15.081 -8.364 126 HD3 LYS 16 1HD LYS 16 -4.122 13.548 -7.918 127 HE2 LYS 16 2HE LYS 16 -4.232 14.279 -5.562 128 HE3 LYS 16 1HE LYS 16 -3.464 15.807 -5.994 129 HZ1 LYS 16 3HZ LYS 16 -5.684 16.334 -6.028 130 HZ2 LYS 16 1HZ LYS 16 -6.159 14.832 -6.656 131 HZ3 LYS 16 2HZ LYS 16 -5.402 15.972 -7.663 132 H VAL 17 H VAL 17 -0.814 10.225 -8.469 133 HA VAL 17 HA VAL 17 -1.318 9.422 -5.800 134 HB VAL 17 HB VAL 17 -0.739 7.689 -8.227 135 HG11 VAL 17 1HG1 VAL 17 -0.621 6.361 -6.171 136 HG12 VAL 17 2HG1 VAL 17 -2.140 6.008 -6.980 137 HG13 VAL 17 3HG1 VAL 17 -2.122 7.079 -5.581 138 HG21 VAL 17 3HG2 VAL 17 -2.573 9.278 -8.638 139 HG22 VAL 17 1HG2 VAL 17 -3.359 8.786 -7.136 140 HG23 VAL 17 2HG2 VAL 17 -3.210 7.645 -8.471 141 H TRP 18 H TRP 18 1.495 8.947 -7.937 142 HA TRP 18 HA TRP 18 3.004 7.229 -6.360 143 HB2 TRP 18 2HB TRP 18 3.612 7.910 -8.667 144 HB3 TRP 18 1HB TRP 18 3.996 9.529 -8.088 145 HD1 TRP 18 HD TRP 18 6.070 9.719 -6.323 146 HE1 TRP 18 1HE TRP 18 8.188 8.268 -6.086 147 HE3 TRP 18 3HE TRP 18 4.613 5.618 -8.979 148 HZ2 TRP 18 2HZ TRP 18 9.133 5.695 -6.918 149 HZ3 TRP 18 3HZ TRP 18 6.132 3.682 -9.239 150 HH2 TRP 18 HH TRP 18 8.384 3.714 -8.209 151 H LYS 19 H LYS 19 2.790 10.752 -6.247 152 HA LYS 19 HA LYS 19 4.731 11.129 -4.184 153 HB2 LYS 19 2HB LYS 19 2.446 12.895 -5.116 154 HB3 LYS 19 1HB LYS 19 3.705 13.418 -3.997 155 HG2 LYS 19 2HG LYS 19 4.397 12.328 -6.755 156 HG3 LYS 19 1HG LYS 19 4.022 14.030 -6.506 157 HD2 LYS 19 2HD LYS 19 5.881 14.201 -4.871 158 HD3 LYS 19 1HD LYS 19 6.278 12.508 -5.130 159 HE2 LYS 19 2HE LYS 19 6.699 12.955 -7.516 160 HE3 LYS 19 1HE LYS 19 6.325 14.659 -7.254 161 HZ1 LYS 19 3HZ LYS 19 8.130 14.271 -5.359 162 HZ2 LYS 19 1HZ LYS 19 8.533 14.769 -6.930 163 HZ3 LYS 19 2HZ LYS 19 8.677 13.134 -6.497 164 H TYR 20 H TYR 20 1.172 10.918 -4.153 165 HA TYR 20 HA TYR 20 0.916 11.350 -1.353 166 HB2 TYR 20 2HB TYR 20 -0.919 11.629 -3.025 167 HB3 TYR 20 1HB TYR 20 -0.982 9.879 -3.219 168 HD1 TYR 20 1HD TYR 20 -1.816 8.429 -1.383 169 HD2 TYR 20 2HD TYR 20 -1.676 12.705 -0.921 170 HE1 TYR 20 1HE TYR 20 -3.234 8.262 0.644 171 HE2 TYR 20 2HE TYR 20 -3.097 12.527 1.106 172 HH TYR 20 HH TYR 20 -4.875 10.724 1.948 173 H TRP 21 H TRP 21 1.123 8.405 -3.319 174 HA TRP 21 HA TRP 21 0.688 6.548 -1.213 175 HB2 TRP 21 2HB TRP 21 0.407 6.091 -3.672 176 HB3 TRP 21 1HB TRP 21 2.159 6.130 -3.858 177 HD1 TRP 21 HD TRP 21 3.432 3.919 -3.284 178 HE1 TRP 21 1HE TRP 21 2.751 1.637 -2.298 179 HE3 TRP 21 3HE TRP 21 -1.370 4.960 -1.958 180 HZ2 TRP 21 2HZ TRP 21 0.449 0.415 -1.109 181 HZ3 TRP 21 3HZ TRP 21 -2.795 3.225 -0.915 182 HH2 TRP 21 HH TRP 21 -1.894 0.955 -0.492 183 H ASN 22 H ASN 22 3.440 8.429 -2.116 184 HA ASN 22 HA ASN 22 5.342 6.689 -0.607 185 HB2 ASN 22 2HB ASN 22 5.881 8.930 -2.580 186 HB3 ASN 22 1HB ASN 22 7.105 7.946 -1.777 187 HD21 ASN 22 1HD2 ASN 22 5.409 5.444 -2.051 188 HD22 ASN 22 2HD2 ASN 22 5.544 5.021 -3.691 189 H GLU 23 H GLU 23 3.928 9.915 -0.729 190 HA GLU 23 HA GLU 23 5.681 11.385 0.856 191 HB2 GLU 23 2HB GLU 23 2.781 11.571 0.211 192 HB3 GLU 23 1HB GLU 23 3.258 12.447 1.655 193 HG2 GLU 23 2HG GLU 23 4.916 13.731 0.413 194 HG3 GLU 23 1HG GLU 23 4.660 12.767 -1.032 195 HA PRO 24 HA PRO 24 5.352 8.562 4.509 196 HB2 PRO 24 2HB PRO 24 7.005 10.790 5.748 197 HB3 PRO 24 1HB PRO 24 7.241 9.029 5.860 198 HG2 PRO 24 2HG PRO 24 8.800 10.441 4.257 199 HG3 PRO 24 1HG PRO 24 8.136 8.899 3.680 200 HD2 PRO 24 2HD PRO 24 7.198 11.699 3.002 201 HD3 PRO 24 1HD PRO 24 7.388 10.288 1.944 202 H ALA 25 H ALA 25 5.087 12.092 4.823 203 HA ALA 25 HA ALA 25 3.595 12.170 7.195 204 HB1 ALA 25 1HB ALA 25 3.522 14.113 4.877 205 HB2 ALA 25 2HB ALA 25 4.681 14.140 6.203 206 HB3 ALA 25 3HB ALA 25 2.973 14.446 6.521 207 H HIS 26 H HIS 26 2.535 11.847 3.829 208 HA HIS 26 HA HIS 26 -0.269 12.108 4.376 209 HB2 HIS 26 2HB HIS 26 1.239 10.914 2.023 210 HB3 HIS 26 1HB HIS 26 -0.514 11.089 2.064 211 HD2 HIS 26 2HD HIS 26 1.431 14.097 3.601 212 HE1 HIS 26 1HE HIS 26 0.193 15.259 -0.259 213 HE2 HIS 26 2HE HIS 26 1.216 16.074 1.914 214 H ILE 27 H ILE 27 1.916 9.281 4.256 215 HA ILE 27 HA ILE 27 -0.108 7.296 4.283 216 HB ILE 27 HB ILE 27 2.724 7.229 5.396 217 HG12 ILE 27 2HG1 ILE 27 1.598 6.201 2.747 218 HG13 ILE 27 1HG1 ILE 27 2.453 7.730 2.924 219 HG21 ILE 27 1HG2 ILE 27 1.495 5.378 6.409 220 HG22 ILE 27 2HG2 ILE 27 2.474 4.706 5.122 221 HG23 ILE 27 3HG2 ILE 27 0.753 4.961 4.863 222 HD11 ILE 27 3HD1 ILE 27 4.423 6.383 3.860 223 HD12 ILE 27 1HD1 ILE 27 4.071 6.141 2.148 224 HD13 ILE 27 2HD1 ILE 27 3.557 4.940 3.332 225 H MET 28 H MET 28 1.705 8.700 7.053 226 HA MET 28 HA MET 28 0.323 7.258 9.056 227 HB2 MET 28 2HB MET 28 1.182 9.028 10.628 228 HB3 MET 28 1HB MET 28 2.426 8.296 9.615 229 HG2 MET 28 2HG MET 28 2.528 10.221 8.181 230 HG3 MET 28 1HG MET 28 1.043 10.895 8.841 231 HE1 MET 28 3HE MET 28 3.973 9.299 11.229 232 HE2 MET 28 1HE MET 28 5.125 10.607 10.922 233 HE3 MET 28 2HE MET 28 4.519 9.633 9.585 234 H LYS 29 H LYS 29 -0.744 9.866 7.115 235 HA LYS 29 HA LYS 29 -2.565 11.072 8.946 236 HB2 LYS 29 2HB LYS 29 -1.663 12.102 6.818 237 HB3 LYS 29 1HB LYS 29 -2.744 11.052 5.911 238 HG2 LYS 29 2HG LYS 29 -4.692 12.022 7.042 239 HG3 LYS 29 1HG LYS 29 -3.635 13.050 8.011 240 HD2 LYS 29 2HD LYS 29 -2.789 14.125 5.938 241 HD3 LYS 29 1HD LYS 29 -3.880 13.118 4.985 242 HE2 LYS 29 2HE LYS 29 -5.817 14.108 6.148 243 HE3 LYS 29 1HE LYS 29 -4.730 15.109 7.111 244 HZ1 LYS 29 3HZ LYS 29 -3.948 15.576 4.552 245 HZ2 LYS 29 1HZ LYS 29 -4.937 16.588 5.485 246 HZ3 LYS 29 2HZ LYS 29 -5.638 15.466 4.419 247 H TRP 30 H TRP 30 -2.745 8.237 6.907 248 HA TRP 30 HA TRP 30 -5.547 7.716 7.801 249 HB2 TRP 30 2HB TRP 30 -6.029 6.755 5.549 250 HB3 TRP 30 1HB TRP 30 -5.690 8.483 5.480 251 HD1 TRP 30 HD TRP 30 -3.505 9.278 4.303 252 HE1 TRP 30 1HE TRP 30 -1.789 8.135 2.769 253 HE3 TRP 30 3HE TRP 30 -4.755 4.313 5.038 254 HZ2 TRP 30 2HZ TRP 30 -1.034 5.523 1.948 255 HZ3 TRP 30 3HZ TRP 30 -3.476 2.564 3.867 256 HH2 TRP 30 HH TRP 30 -1.637 3.147 2.325 257 H CYS 31 H CYS 31 -2.459 6.669 8.112 258 HA CYS 31 HA CYS 31 -2.679 3.910 7.420 259 HB2 CYS 31 2HB CYS 31 -0.525 5.097 7.777 260 HB3 CYS 31 1HB CYS 31 -0.910 5.247 9.480 261 HG CYS 31 HG CYS 31 -0.488 2.779 9.802 262 H GLN 32 H GLN 32 -4.918 3.741 8.307 263 HA GLN 32 HA GLN 32 -4.851 2.356 10.828 264 HB2 GLN 32 2HB GLN 32 -5.106 4.817 11.494 265 HB3 GLN 32 1HB GLN 32 -6.661 4.811 10.660 266 HG2 GLN 32 2HG GLN 32 -7.411 2.935 12.127 267 HG3 GLN 32 1HG GLN 32 -5.867 3.002 12.963 268 HE21 GLN 32 1HE2 GLN 32 -8.227 3.418 14.428 269 HE22 GLN 32 2HE2 GLN 32 -8.317 5.046 14.898 270 H ALA 33 H ALA 33 -5.253 1.119 8.787 271 HA ALA 33 HA ALA 33 -7.821 1.196 7.542 272 HB1 ALA 33 1HB ALA 33 -7.102 -0.892 6.511 273 HB2 ALA 33 2HB ALA 33 -5.803 -1.056 7.690 274 HB3 ALA 33 3HB ALA 33 -5.768 0.271 6.525 275 H SER 34 H SER 34 -6.948 0.322 10.662 276 HA SER 34 HA SER 34 -9.472 -1.141 11.080 277 HB2 SER 34 2HB SER 34 -8.301 -2.845 12.451 278 HB3 SER 34 1HB SER 34 -7.762 -2.880 10.770 279 HG SER 34 HG SER 34 -5.852 -2.196 11.370 280 HA PRO 35 HA PRO 35 -9.248 1.701 14.618 281 HB2 PRO 35 2HB PRO 35 -11.355 0.870 16.137 282 HB3 PRO 35 1HB PRO 35 -11.612 1.602 14.534 283 HG2 PRO 35 2HG PRO 35 -11.495 -1.326 15.251 284 HG3 PRO 35 1HG PRO 35 -12.738 -0.466 14.313 285 HD2 PRO 35 2HD PRO 35 -10.721 -1.829 13.062 286 HD3 PRO 35 1HD PRO 35 -11.362 -0.314 12.383 287 H GLU 36 H GLU 36 -8.749 -1.687 14.888 288 HA GLU 36 HA GLU 36 -8.121 -1.722 17.742 289 HB2 GLU 36 2HB GLU 36 -7.762 -3.810 15.562 290 HB3 GLU 36 1HB GLU 36 -7.508 -4.094 17.287 291 HG2 GLU 36 2HG GLU 36 -10.140 -3.192 16.058 292 HG3 GLU 36 1HG GLU 36 -9.762 -4.852 16.496 293 H TRP 37 H TRP 37 -6.612 -0.172 15.473 294 HA TRP 37 HA TRP 37 -3.940 -0.622 16.625 295 HB2 TRP 37 2HB TRP 37 -4.558 -0.869 13.649 296 HB3 TRP 37 1HB TRP 37 -2.931 -0.638 14.288 297 HD1 TRP 37 HD TRP 37 -5.784 -3.193 14.241 298 HE1 TRP 37 1HE TRP 37 -4.836 -5.493 14.916 299 HE3 TRP 37 3HE TRP 37 -1.038 -1.841 15.528 300 HZ2 TRP 37 2HZ TRP 37 -2.379 -6.612 15.867 301 HZ3 TRP 37 3HZ TRP 37 0.587 -3.537 16.315 302 HH2 TRP 37 HH TRP 37 -0.078 -5.920 16.487 303 H HIS 38 H HIS 38 -2.678 1.169 16.622 304 HA HIS 38 HA HIS 38 -3.716 3.678 15.383 305 HB2 HIS 38 2HB HIS 38 -4.259 3.600 17.837 306 HB3 HIS 38 1HB HIS 38 -2.541 3.416 18.184 307 HD2 HIS 38 2HD HIS 38 -1.236 5.845 18.439 308 HE1 HIS 38 1HE HIS 38 -4.048 8.250 16.404 309 HE2 HIS 38 2HE HIS 38 -1.857 8.269 17.691 310 H VAL 39 H VAL 39 -1.989 5.328 15.186 311 HA VAL 39 HA VAL 39 0.748 4.167 14.903 312 HB VAL 39 HB VAL 39 -0.607 6.117 13.003 313 HG11 VAL 39 1HG1 VAL 39 2.005 4.574 12.826 314 HG12 VAL 39 2HG1 VAL 39 1.853 6.312 13.072 315 HG13 VAL 39 3HG1 VAL 39 1.330 5.591 11.550 316 HG21 VAL 39 3HG2 VAL 39 -0.209 3.095 12.880 317 HG22 VAL 39 1HG2 VAL 39 -0.564 4.068 11.469 318 HG23 VAL 39 2HG2 VAL 39 -1.728 3.982 12.781 319 HA PRO 40 HA PRO 40 0.905 8.116 17.352 320 HB2 PRO 40 2HB PRO 40 2.523 7.339 19.398 321 HB3 PRO 40 1HB PRO 40 0.806 6.879 19.354 322 HG2 PRO 40 2HG PRO 40 3.217 5.232 18.637 323 HG3 PRO 40 1HG PRO 40 1.750 4.744 19.512 324 HD2 PRO 40 2HD PRO 40 2.181 4.268 16.779 325 HD3 PRO 40 1HD PRO 40 0.570 4.311 17.531 326 H ALA 41 H ALA 41 3.138 6.261 15.613 327 HA ALA 41 HA ALA 41 4.751 8.519 14.946 328 HB1 ALA 41 1HB ALA 41 5.758 8.057 17.156 329 HB2 ALA 41 2HB ALA 41 6.898 7.711 15.857 330 HB3 ALA 41 3HB ALA 41 6.062 6.390 16.673 331 H ALA 42 H ALA 42 6.162 8.073 13.231 332 HA ALA 42 HA ALA 42 6.713 5.460 12.262 333 HB1 ALA 42 1HB ALA 42 4.316 5.496 11.656 334 HB2 ALA 42 2HB ALA 42 5.339 5.478 10.221 335 HB3 ALA 42 3HB ALA 42 4.573 6.979 10.740 336 H GLN 43 H GLN 43 7.959 5.465 10.309 337 HA GLN 43 HA GLN 43 8.780 8.054 9.191 338 HB2 GLN 43 2HB GLN 43 11.209 7.492 9.573 339 HB3 GLN 43 1HB GLN 43 10.328 7.868 11.052 340 HG2 GLN 43 2HG GLN 43 10.068 5.482 11.542 341 HG3 GLN 43 1HG GLN 43 10.889 5.058 10.041 342 HE21 GLN 43 1HE2 GLN 43 12.925 4.290 10.653 343 HE22 GLN 43 2HE2 GLN 43 13.957 5.067 11.755 344 H ASN 44 H ASN 44 9.927 7.853 7.253 345 HA ASN 44 HA ASN 44 10.472 5.302 6.040 346 HB2 ASN 44 2HB ASN 44 7.996 5.366 5.832 347 HB3 ASN 44 1HB ASN 44 8.120 6.873 4.942 348 HD21 ASN 44 1HD2 ASN 44 7.492 6.180 2.835 349 HD22 ASN 44 2HD2 ASN 44 8.291 4.952 1.976 350 H ASP 45 H ASP 45 11.949 5.549 4.464 351 HA ASP 45 HA ASP 45 12.439 8.249 3.283 352 HB2 ASP 45 2HB ASP 45 14.498 6.254 4.292 353 HB3 ASP 45 1HB ASP 45 14.859 7.753 3.439 354 H LEU 46 H LEU 46 11.614 7.829 1.252 355 HA LEU 46 HA LEU 46 11.898 5.326 -0.096 356 HB2 LEU 46 2HB LEU 46 10.126 7.137 -0.509 357 HB3 LEU 46 1HB LEU 46 11.367 8.042 -1.367 358 HG LEU 46 HG LEU 46 11.661 5.695 -2.697 359 HD11 LEU 46 1HD1 LEU 46 9.534 4.529 -3.025 360 HD12 LEU 46 2HD1 LEU 46 8.739 5.601 -1.875 361 HD13 LEU 46 3HD1 LEU 46 9.982 4.480 -1.323 362 HD21 LEU 46 3HD2 LEU 46 9.393 7.639 -3.254 363 HD22 LEU 46 1HD2 LEU 46 10.071 6.505 -4.425 364 HD23 LEU 46 2HD2 LEU 46 11.063 7.816 -3.790 365 H LYS 47 H LYS 47 14.018 4.662 -0.337 366 HA LYS 47 HA LYS 47 15.559 5.880 -2.424 367 HB2 LYS 47 2HB LYS 47 16.043 7.336 -0.323 368 HB3 LYS 47 1HB LYS 47 16.887 5.936 0.323 369 HG2 LYS 47 2HG LYS 47 18.674 7.073 -0.728 370 HG3 LYS 47 1HG LYS 47 18.183 5.994 -2.030 371 HD2 LYS 47 2HD LYS 47 16.776 7.854 -2.975 372 HD3 LYS 47 1HD LYS 47 17.356 8.907 -1.692 373 HE2 LYS 47 2HE LYS 47 19.673 8.601 -2.494 374 HE3 LYS 47 1HE LYS 47 19.085 7.545 -3.778 375 HZ1 LYS 47 3HZ LYS 47 18.064 9.279 -4.862 376 HZ2 LYS 47 1HZ LYS 47 19.462 10.030 -4.267 377 HZ3 LYS 47 2HZ LYS 47 17.977 10.255 -3.473 378 H ALA 48 H ALA 48 16.943 4.406 -3.330 379 HA ALA 48 HA ALA 48 16.708 1.683 -2.670 380 HB1 ALA 48 1HB ALA 48 17.364 2.493 -4.901 381 HB2 ALA 48 2HB ALA 48 18.549 1.346 -4.274 382 HB3 ALA 48 3HB ALA 48 18.893 3.078 -4.244 383 H GLY 49 H GLY 49 17.882 0.329 -1.387 384 HA2 GLY 49 2HA GLY 49 19.498 -0.417 0.103 385 HA3 GLY 49 1HA GLY 49 20.494 0.968 -0.333 386 H GLY 50 H GLY 50 17.479 2.121 0.412 387 HA2 GLY 50 2HA GLY 50 18.338 3.109 3.048 388 HA3 GLY 50 1HA GLY 50 16.932 3.636 2.122 389 H THR 51 H THR 51 16.582 3.128 4.781 390 HA THR 51 HA THR 51 14.943 0.634 4.811 391 HB THR 51 HB THR 51 16.881 0.158 6.177 392 HG1 THR 51 1HG THR 51 15.781 0.205 8.298 393 HG21 THR 51 3HG2 THR 51 17.551 1.619 8.044 394 HG22 THR 51 1HG2 THR 51 16.315 2.788 7.589 395 HG23 THR 51 2HG2 THR 51 17.674 2.477 6.511 396 H PHE 52 H PHE 52 13.281 0.683 6.488 397 HA PHE 52 HA PHE 52 12.297 3.388 7.232 398 HB2 PHE 52 2HB PHE 52 10.069 2.891 6.375 399 HB3 PHE 52 1HB PHE 52 11.240 2.765 5.065 400 HD1 PHE 52 2HD PHE 52 11.882 0.549 4.137 401 HD2 PHE 52 1HD PHE 52 8.964 0.875 7.284 402 HE1 PHE 52 2HE PHE 52 11.181 -1.796 3.741 403 HE2 PHE 52 1HE PHE 52 8.272 -1.476 6.887 404 HZ PHE 52 HZ PHE 52 9.381 -2.805 5.111 405 H THR 53 H THR 53 10.548 3.307 8.824 406 HA THR 53 HA THR 53 10.180 0.793 10.295 407 HB THR 53 HB THR 53 11.334 3.247 11.688 408 HG1 THR 53 1HG THR 53 12.594 0.774 11.147 409 HG21 THR 53 3HG2 THR 53 9.918 1.816 13.122 410 HG22 THR 53 1HG2 THR 53 11.613 1.670 13.580 411 HG23 THR 53 2HG2 THR 53 10.845 0.401 12.630 412 H THR 54 H THR 54 8.194 0.707 11.182 413 HA THR 54 HA THR 54 6.582 3.196 11.482 414 HB THR 54 HB THR 54 4.656 2.003 10.571 415 HG1 THR 54 1HG THR 54 4.925 -0.050 9.745 416 HG21 THR 54 3HG2 THR 54 7.060 1.762 8.738 417 HG22 THR 54 1HG2 THR 54 6.133 3.239 8.996 418 HG23 THR 54 2HG2 THR 54 5.374 1.845 8.228 419 H THR 55 H THR 55 5.988 3.392 13.580 420 HA THR 55 HA THR 55 5.977 1.032 15.344 421 HB THR 55 HB THR 55 5.405 3.968 15.975 422 HG1 THR 55 1HG THR 55 7.507 4.203 16.199 423 HG21 THR 55 3HG2 THR 55 6.192 1.605 17.725 424 HG22 THR 55 1HG2 THR 55 4.614 2.389 17.704 425 HG23 THR 55 2HG2 THR 55 6.027 3.269 18.279 426 H MET 56 H MET 56 4.119 -0.133 15.526 427 HA MET 56 HA MET 56 1.493 1.268 15.451 428 HB2 MET 56 2HB MET 56 2.194 -1.355 14.077 429 HB3 MET 56 1HB MET 56 0.595 -0.618 14.151 430 HG2 MET 56 2HG MET 56 1.513 1.390 12.961 431 HG3 MET 56 1HG MET 56 3.056 0.557 12.824 432 HE1 MET 56 3HE MET 56 -0.229 1.305 11.129 433 HE2 MET 56 1HE MET 56 -0.773 0.076 12.275 434 HE3 MET 56 2HE MET 56 -0.834 -0.243 10.546 435 H ALA 57 H ALA 57 0.372 0.813 17.244 436 HA ALA 57 HA ALA 57 0.636 -1.834 18.550 437 HB1 ALA 57 1HB ALA 57 0.973 0.809 20.002 438 HB2 ALA 57 2HB ALA 57 2.256 -0.356 19.676 439 HB3 ALA 57 3HB ALA 57 0.928 -0.790 20.752 440 H ALA 58 H ALA 58 -1.133 -2.472 19.685 441 HA ALA 58 HA ALA 58 -3.653 -1.467 18.877 442 HB1 ALA 58 1HB ALA 58 -3.332 -3.801 19.564 443 HB2 ALA 58 2HB ALA 58 -4.592 -3.027 20.527 444 HB3 ALA 58 3HB ALA 58 -2.987 -3.274 21.214 445 H LYS 59 H LYS 59 -5.232 -0.322 20.048 446 HA LYS 59 HA LYS 59 -4.352 1.914 21.483 447 HB2 LYS 59 2HB LYS 59 -7.085 0.583 21.462 448 HB3 LYS 59 1HB LYS 59 -6.760 2.200 22.092 449 HG2 LYS 59 2HG LYS 59 -6.059 2.984 19.889 450 HG3 LYS 59 1HG LYS 59 -6.165 1.353 19.230 451 HD2 LYS 59 2HD LYS 59 -8.143 2.625 18.569 452 HD3 LYS 59 1HD LYS 59 -8.618 1.344 19.683 453 HE2 LYS 59 2HE LYS 59 -8.947 2.906 21.482 454 HE3 LYS 59 1HE LYS 59 -8.048 4.179 20.651 455 HZ1 LYS 59 3HZ LYS 59 -10.647 4.103 20.655 456 HZ2 LYS 59 1HZ LYS 59 -10.406 3.059 19.339 457 HZ3 LYS 59 2HZ LYS 59 -9.783 4.640 19.293 458 H ASP 60 H ASP 60 -5.561 -1.216 22.628 459 HA ASP 60 HA ASP 60 -5.527 -0.512 25.435 460 HB2 ASP 60 2HB ASP 60 -5.624 -3.202 24.029 461 HB3 ASP 60 1HB ASP 60 -5.892 -2.951 25.753 462 H GLY 61 H GLY 61 -3.155 -1.229 23.137 463 HA2 GLY 61 2HA GLY 61 -0.869 -1.458 23.318 464 HA3 GLY 61 1HA GLY 61 -1.023 -1.218 25.057 465 H SER 62 H SER 62 -3.079 -3.659 23.913 466 HA SER 62 HA SER 62 -1.834 -5.709 25.400 467 HB2 SER 62 2HB SER 62 -4.228 -5.714 24.852 468 HB3 SER 62 1HB SER 62 -3.845 -5.927 23.146 469 HG SER 62 HG SER 62 -4.210 -7.940 23.994 470 H MET 63 H MET 63 -1.789 -4.935 21.936 471 HA MET 63 HA MET 63 0.428 -6.900 21.540 472 HB2 MET 63 2HB MET 63 -1.799 -7.427 20.395 473 HB3 MET 63 1HB MET 63 -1.570 -5.971 19.430 474 HG2 MET 63 2HG MET 63 -0.725 -7.811 18.108 475 HG3 MET 63 1HG MET 63 0.700 -6.969 18.720 476 HE1 MET 63 3HE MET 63 0.344 -10.186 17.667 477 HE2 MET 63 1HE MET 63 1.694 -10.750 18.665 478 HE3 MET 63 2HE MET 63 1.785 -9.188 17.854 479 H SER 64 H SER 64 2.211 -6.199 20.418 480 HA SER 64 HA SER 64 2.284 -3.470 19.293 481 HB2 SER 64 2HB SER 64 3.024 -3.189 21.614 482 HB3 SER 64 1HB SER 64 4.191 -4.493 21.415 483 HG SER 64 HG SER 64 5.279 -2.610 21.046 484 H PHE 65 H PHE 65 3.635 -3.309 17.555 485 HA PHE 65 HA PHE 65 5.758 -5.218 17.063 486 HB2 PHE 65 2HB PHE 65 3.696 -6.479 16.342 487 HB3 PHE 65 1HB PHE 65 3.374 -5.210 15.163 488 HD1 PHE 65 1HD PHE 65 5.666 -7.977 16.095 489 HD2 PHE 65 2HD PHE 65 4.817 -4.940 13.167 490 HE1 PHE 65 1HE PHE 65 7.261 -9.040 14.521 491 HE2 PHE 65 2HE PHE 65 6.410 -6.017 11.601 492 HZ PHE 65 HZ PHE 65 7.629 -8.062 12.277 493 H ASP 66 H ASP 66 6.939 -4.682 15.091 494 HA ASP 66 HA ASP 66 6.447 -1.955 14.004 495 HB2 ASP 66 2HB ASP 66 9.084 -2.970 15.121 496 HB3 ASP 66 1HB ASP 66 8.838 -1.432 14.299 497 H PHE 67 H PHE 67 6.618 -1.940 11.842 498 HA PHE 67 HA PHE 67 7.742 -4.297 10.442 499 HB2 PHE 67 2HB PHE 67 6.073 -1.952 9.462 500 HB3 PHE 67 1HB PHE 67 6.639 -3.272 8.442 501 HD1 PHE 67 2HD PHE 67 5.753 -5.566 8.717 502 HD2 PHE 67 1HD PHE 67 4.297 -2.324 11.141 503 HE1 PHE 67 2HE PHE 67 3.824 -6.959 9.431 504 HE2 PHE 67 1HE PHE 67 2.376 -3.723 11.851 505 HZ PHE 67 HZ PHE 67 2.137 -6.035 10.993 506 H GLY 68 H GLY 68 9.576 -4.205 9.300 507 HA2 GLY 68 2HA GLY 68 10.727 -1.674 8.379 508 HA3 GLY 68 1HA GLY 68 11.645 -2.529 9.622 509 H GLY 69 H GLY 69 12.483 -1.981 6.944 510 HA2 GLY 69 2HA GLY 69 13.546 -4.505 6.196 511 HA3 GLY 69 1HA GLY 69 12.201 -4.081 5.133 512 H VAL 70 H VAL 70 14.179 -4.181 3.615 513 HA VAL 70 HA VAL 70 15.349 -1.450 3.347 514 HB VAL 70 HB VAL 70 17.020 -3.095 4.147 515 HG11 VAL 70 1HG1 VAL 70 15.969 -5.120 3.094 516 HG12 VAL 70 2HG1 VAL 70 17.700 -4.995 2.786 517 HG13 VAL 70 3HG1 VAL 70 16.550 -4.564 1.522 518 HG21 VAL 70 3HG2 VAL 70 17.698 -1.219 2.659 519 HG22 VAL 70 1HG2 VAL 70 17.481 -2.265 1.254 520 HG23 VAL 70 2HG2 VAL 70 18.725 -2.633 2.445 521 H TYR 71 H TYR 71 15.319 -0.573 1.319 522 HA TYR 71 HA TYR 71 13.570 -1.792 -0.666 523 HB2 TYR 71 2HB TYR 71 15.188 0.787 -0.664 524 HB3 TYR 71 1HB TYR 71 14.075 0.317 -1.947 525 HD1 TYR 71 1HD TYR 71 11.617 0.039 -1.459 526 HD2 TYR 71 2HD TYR 71 14.327 1.660 1.467 527 HE1 TYR 71 1HE TYR 71 9.698 0.927 -0.163 528 HE2 TYR 71 2HE TYR 71 12.397 2.546 2.750 529 HH TYR 71 HH TYR 71 9.091 2.297 1.516 530 H ASP 72 H ASP 72 14.246 -3.168 -2.191 531 HA ASP 72 HA ASP 72 17.037 -3.739 -2.648 532 HB2 ASP 72 2HB ASP 72 15.255 -5.472 -2.762 533 HB3 ASP 72 1HB ASP 72 14.572 -4.664 -4.169 534 H GLN 73 H GLN 73 14.445 -2.049 -4.343 535 HA GLN 73 HA GLN 73 16.290 -0.397 -5.820 536 HB2 GLN 73 2HB GLN 73 15.573 -1.191 -8.088 537 HB3 GLN 73 1HB GLN 73 16.503 -2.396 -7.201 538 HG2 GLN 73 2HG GLN 73 14.404 -3.520 -6.516 539 HG3 GLN 73 1HG GLN 73 13.468 -2.331 -7.414 540 HE21 GLN 73 1HE2 GLN 73 12.620 -3.863 -8.943 541 HE22 GLN 73 2HE2 GLN 73 13.605 -4.627 -10.094 542 H VAL 74 H VAL 74 15.271 1.366 -6.794 543 HA VAL 74 HA VAL 74 12.313 1.545 -6.655 544 HB VAL 74 HB VAL 74 14.195 3.688 -5.581 545 HG11 VAL 74 1HG1 VAL 74 12.076 4.728 -4.807 546 HG12 VAL 74 2HG1 VAL 74 11.162 3.459 -5.603 547 HG13 VAL 74 3HG1 VAL 74 12.117 4.597 -6.552 548 HG21 VAL 74 3HG2 VAL 74 13.210 3.085 -3.359 549 HG22 VAL 74 1HG2 VAL 74 14.144 1.762 -4.055 550 HG23 VAL 74 2HG2 VAL 74 12.380 1.725 -4.117 551 H LYS 75 H LYS 75 11.453 2.560 -8.398 552 HA LYS 75 HA LYS 75 13.139 4.259 -10.145 553 HB2 LYS 75 2HB LYS 75 11.632 1.753 -10.964 554 HB3 LYS 75 1HB LYS 75 12.104 2.989 -12.132 555 HG2 LYS 75 2HG LYS 75 14.476 2.680 -11.457 556 HG3 LYS 75 1HG LYS 75 13.981 1.426 -10.321 557 HD2 LYS 75 2HD LYS 75 13.055 0.092 -12.192 558 HD3 LYS 75 1HD LYS 75 13.562 1.343 -13.329 559 HE2 LYS 75 2HE LYS 75 15.394 -0.286 -11.538 560 HE3 LYS 75 1HE LYS 75 15.219 -0.468 -13.285 561 HZ1 LYS 75 3HZ LYS 75 15.947 1.856 -13.519 562 HZ2 LYS 75 1HZ LYS 75 17.133 0.872 -12.812 563 HZ3 LYS 75 2HZ LYS 75 16.219 1.926 -11.844 564 H THR 76 H THR 76 12.067 6.111 -10.383 565 HA THR 76 HA THR 76 9.533 6.704 -9.475 566 HB THR 76 HB THR 76 10.899 8.048 -11.834 567 HG1 THR 76 1HG THR 76 11.786 7.659 -9.407 568 HG21 THR 76 3HG2 THR 76 8.596 8.844 -11.420 569 HG22 THR 76 1HG2 THR 76 9.771 10.074 -10.963 570 HG23 THR 76 2HG2 THR 76 8.986 9.101 -9.719 571 H ASN 77 H ASN 77 7.572 5.992 -10.070 572 HA ASN 77 HA ASN 77 5.835 5.138 -11.311 573 HB2 ASN 77 2HB ASN 77 7.097 6.899 -13.427 574 HB3 ASN 77 1HB ASN 77 5.453 6.274 -13.467 575 HD21 ASN 77 1HD2 ASN 77 4.994 6.642 -10.551 576 HD22 ASN 77 2HD2 ASN 77 4.860 8.315 -10.306 577 H ASP 78 H ASP 78 7.048 3.016 -11.164 578 HA ASP 78 HA ASP 78 7.035 1.716 -13.725 579 HB2 ASP 78 2HB ASP 78 9.240 2.793 -13.886 580 HB3 ASP 78 1HB ASP 78 9.701 2.100 -12.339 581 H LEU 79 H LEU 79 9.050 1.034 -10.871 582 HA LEU 79 HA LEU 79 7.156 -0.991 -9.904 583 HB2 LEU 79 2HB LEU 79 8.521 -2.136 -11.653 584 HB3 LEU 79 1HB LEU 79 9.981 -1.714 -10.771 585 HG LEU 79 HG LEU 79 9.145 -3.059 -8.806 586 HD11 LEU 79 1HD1 LEU 79 6.795 -3.544 -10.657 587 HD12 LEU 79 2HD1 LEU 79 6.786 -3.137 -8.940 588 HD13 LEU 79 3HD1 LEU 79 7.236 -4.754 -9.452 589 HD21 LEU 79 3HD2 LEU 79 9.530 -5.272 -9.840 590 HD22 LEU 79 1HD2 LEU 79 10.654 -4.072 -10.477 591 HD23 LEU 79 2HD2 LEU 79 9.263 -4.575 -11.438 592 H ILE 80 H ILE 80 7.349 -1.385 -7.758 593 HA ILE 80 HA ILE 80 9.679 -0.292 -6.252 594 HB ILE 80 HB ILE 80 6.762 -0.013 -5.400 595 HG12 ILE 80 2HG1 ILE 80 8.725 2.101 -6.382 596 HG13 ILE 80 1HG1 ILE 80 7.354 1.497 -7.302 597 HG21 ILE 80 1HG2 ILE 80 7.731 1.380 -3.573 598 HG22 ILE 80 2HG2 ILE 80 9.348 1.054 -4.190 599 HG23 ILE 80 3HG2 ILE 80 8.379 -0.250 -3.512 600 HD11 ILE 80 3HD1 ILE 80 7.417 3.576 -5.274 601 HD12 ILE 80 1HD1 ILE 80 6.244 2.341 -4.821 602 HD13 ILE 80 2HD1 ILE 80 6.119 3.155 -6.377 603 H GLU 81 H GLU 81 10.476 -1.745 -4.812 604 HA GLU 81 HA GLU 81 8.779 -3.823 -3.655 605 HB2 GLU 81 2HB GLU 81 10.312 -5.658 -4.416 606 HB3 GLU 81 1HB GLU 81 9.417 -4.922 -5.743 607 HG2 GLU 81 2HG GLU 81 11.377 -3.523 -6.294 608 HG3 GLU 81 1HG GLU 81 12.284 -4.263 -4.981 609 H TYR 82 H TYR 82 9.831 -4.872 -1.890 610 HA TYR 82 HA TYR 82 12.477 -3.993 -1.035 611 HB2 TYR 82 2HB TYR 82 11.602 -3.054 1.126 612 HB3 TYR 82 1HB TYR 82 11.180 -2.081 -0.281 613 HD1 TYR 82 1HD TYR 82 8.866 -2.085 -1.203 614 HD2 TYR 82 2HD TYR 82 9.856 -4.298 2.354 615 HE1 TYR 82 1HE TYR 82 6.454 -2.323 -0.670 616 HE2 TYR 82 2HE TYR 82 7.442 -4.522 2.870 617 HH TYR 82 HH TYR 82 4.966 -2.989 0.847 618 H THR 83 H THR 83 13.243 -5.194 0.801 619 HA THR 83 HA THR 83 11.904 -7.822 1.076 620 HB THR 83 HB THR 83 14.706 -6.946 1.883 621 HG1 THR 83 1HG THR 83 13.855 -8.450 -0.361 622 HG21 THR 83 3HG2 THR 83 13.920 -8.934 3.110 623 HG22 THR 83 1HG2 THR 83 15.124 -9.403 1.915 624 HG23 THR 83 2HG2 THR 83 13.414 -9.687 1.600 625 H ILE 84 H ILE 84 10.903 -8.353 2.932 626 HA ILE 84 HA ILE 84 10.971 -6.496 5.228 627 HB ILE 84 HB ILE 84 9.208 -8.910 4.654 628 HG12 ILE 84 2HG1 ILE 84 8.526 -5.932 4.540 629 HG13 ILE 84 1HG1 ILE 84 8.933 -6.882 3.113 630 HG21 ILE 84 1HG2 ILE 84 7.802 -7.930 6.531 631 HG22 ILE 84 2HG2 ILE 84 9.116 -6.806 6.865 632 HG23 ILE 84 3HG2 ILE 84 9.353 -8.536 7.068 633 HD11 ILE 84 3HD1 ILE 84 7.028 -8.356 3.494 634 HD12 ILE 84 1HD1 ILE 84 6.473 -6.688 3.457 635 HD13 ILE 84 2HD1 ILE 84 6.636 -7.522 4.995 636 H GLY 85 H GLY 85 11.471 -7.206 7.341 637 HA2 GLY 85 2HA GLY 85 13.720 -8.819 7.633 638 HA3 GLY 85 1HA GLY 85 12.633 -8.397 8.951 639 H ASP 86 H ASP 86 10.284 -9.716 8.053 640 HA ASP 86 HA ASP 86 10.659 -12.307 9.031 641 HB2 ASP 86 2HB ASP 86 8.447 -11.165 7.293 642 HB3 ASP 86 1HB ASP 86 8.347 -12.697 8.161 643 H GLY 87 H GLY 87 11.424 -11.003 5.998 644 HA2 GLY 87 2HA GLY 87 12.610 -12.088 4.291 645 HA3 GLY 87 1HA GLY 87 12.078 -13.652 4.897 646 H ARG 88 H ARG 88 9.362 -11.814 4.912 647 HA ARG 88 HA ARG 88 8.199 -13.121 2.650 648 HB2 ARG 88 2HB ARG 88 6.879 -12.362 4.609 649 HB3 ARG 88 1HB ARG 88 7.205 -10.687 4.176 650 HG2 ARG 88 2HG ARG 88 6.026 -10.989 2.024 651 HG3 ARG 88 1HG ARG 88 5.759 -12.688 2.398 652 HD2 ARG 88 2HD ARG 88 4.697 -10.365 4.038 653 HD3 ARG 88 1HD ARG 88 3.755 -11.284 2.867 654 HE ARG 88 HE ARG 88 4.874 -13.109 4.678 655 HH11 ARG 88 1HH2 ARG 88 2.583 -10.493 4.614 656 HH12 ARG 88 2HH2 ARG 88 1.631 -11.125 5.916 657 HH21 ARG 88 1HH1 ARG 88 3.623 -13.920 6.382 658 HH22 ARG 88 2HH1 ARG 88 2.219 -13.058 6.913 659 H LYS 89 H LYS 89 7.912 -12.402 0.558 660 HA LYS 89 HA LYS 89 9.416 -9.980 -0.252 661 HB2 LYS 89 2HB LYS 89 9.903 -12.192 -1.313 662 HB3 LYS 89 1HB LYS 89 8.273 -12.210 -1.978 663 HG2 LYS 89 2HG LYS 89 8.758 -10.019 -3.114 664 HG3 LYS 89 1HG LYS 89 10.413 -10.113 -2.515 665 HD2 LYS 89 2HD LYS 89 9.089 -12.142 -4.341 666 HD3 LYS 89 1HD LYS 89 10.208 -10.887 -4.854 667 HE2 LYS 89 2HE LYS 89 11.900 -11.939 -3.173 668 HE3 LYS 89 1HE LYS 89 10.824 -13.340 -3.175 669 HZ1 LYS 89 3HZ LYS 89 12.665 -12.467 -5.164 670 HZ2 LYS 89 1HZ LYS 89 11.114 -12.693 -5.810 671 HZ3 LYS 89 2HZ LYS 89 11.886 -13.967 -4.992 672 H VAL 90 H VAL 90 8.451 -8.338 -1.346 673 HA VAL 90 HA VAL 90 5.573 -8.445 -2.004 674 HB VAL 90 HB VAL 90 6.761 -6.247 -0.254 675 HG11 VAL 90 1HG1 VAL 90 4.374 -5.523 -0.073 676 HG12 VAL 90 2HG1 VAL 90 3.924 -6.779 -1.226 677 HG13 VAL 90 3HG1 VAL 90 4.954 -5.443 -1.733 678 HG21 VAL 90 3HG2 VAL 90 6.525 -8.250 1.104 679 HG22 VAL 90 1HG2 VAL 90 4.940 -8.601 0.417 680 HG23 VAL 90 2HG2 VAL 90 5.154 -7.213 1.479 681 H ARG 91 H ARG 91 5.099 -7.312 -3.794 682 HA ARG 91 HA ARG 91 7.046 -5.355 -4.892 683 HB2 ARG 91 2HB ARG 91 6.723 -6.388 -7.140 684 HB3 ARG 91 1HB ARG 91 7.534 -7.468 -6.010 685 HG2 ARG 91 2HG ARG 91 5.373 -8.618 -5.565 686 HG3 ARG 91 1HG ARG 91 4.574 -7.559 -6.722 687 HD2 ARG 91 2HD ARG 91 5.128 -9.689 -7.793 688 HD3 ARG 91 1HD ARG 91 6.077 -8.389 -8.512 689 HE ARG 91 HE ARG 91 7.527 -9.564 -6.374 690 HH11 ARG 91 1HH2 ARG 91 6.422 -10.229 -9.605 691 HH12 ARG 91 2HH2 ARG 91 7.723 -11.314 -9.962 692 HH21 ARG 91 1HH1 ARG 91 9.222 -10.976 -6.855 693 HH22 ARG 91 2HH1 ARG 91 9.304 -11.736 -8.410 694 H ILE 92 H ILE 92 6.095 -3.621 -5.846 695 HA ILE 92 HA ILE 92 3.132 -3.640 -6.246 696 HB ILE 92 HB ILE 92 4.758 -1.352 -5.049 697 HG12 ILE 92 2HG1 ILE 92 2.781 -3.222 -3.666 698 HG13 ILE 92 1HG1 ILE 92 4.526 -3.329 -3.488 699 HG21 ILE 92 1HG2 ILE 92 1.748 -1.762 -5.366 700 HG22 ILE 92 2HG2 ILE 92 2.718 -0.681 -6.354 701 HG23 ILE 92 3HG2 ILE 92 2.517 -0.350 -4.642 702 HD11 ILE 92 3HD1 ILE 92 2.769 -0.999 -2.667 703 HD12 ILE 92 1HD1 ILE 92 4.533 -0.961 -2.629 704 HD13 ILE 92 2HD1 ILE 92 3.648 -2.088 -1.600 705 H VAL 93 H VAL 93 2.809 -3.380 -8.368 706 HA VAL 93 HA VAL 93 4.675 -1.699 -9.974 707 HB VAL 93 HB VAL 93 4.450 -4.072 -10.661 708 HG11 VAL 93 1HG1 VAL 93 2.068 -4.372 -9.934 709 HG12 VAL 93 2HG1 VAL 93 2.400 -4.980 -11.552 710 HG13 VAL 93 3HG1 VAL 93 1.566 -3.442 -11.349 711 HG21 VAL 93 3HG2 VAL 93 4.938 -2.291 -12.337 712 HG22 VAL 93 1HG2 VAL 93 3.209 -2.142 -12.660 713 HG23 VAL 93 2HG2 VAL 93 4.055 -3.643 -13.043 714 H PHE 94 H PHE 94 3.925 0.129 -10.879 715 HA PHE 94 HA PHE 94 1.043 0.829 -10.531 716 HB2 PHE 94 2HB PHE 94 3.514 2.539 -10.996 717 HB3 PHE 94 1HB PHE 94 1.865 3.159 -10.872 718 HD1 PHE 94 2HD PHE 94 4.486 1.225 -9.018 719 HD2 PHE 94 1HD PHE 94 0.840 3.495 -8.690 720 HE1 PHE 94 2HE PHE 94 4.676 1.197 -6.544 721 HE2 PHE 94 1HE PHE 94 1.049 3.458 -6.217 722 HZ PHE 94 HZ PHE 94 2.967 2.310 -5.156 723 H THR 95 H THR 95 -0.153 0.570 -12.289 724 HA THR 95 HA THR 95 1.051 0.830 -15.004 725 HB THR 95 HB THR 95 -1.511 -0.578 -14.149 726 HG1 THR 95 1HG THR 95 1.065 -1.562 -14.803 727 HG21 THR 95 3HG2 THR 95 -1.332 -1.578 -16.439 728 HG22 THR 95 1HG2 THR 95 0.024 -0.505 -16.780 729 HG23 THR 95 2HG2 THR 95 -1.583 0.163 -16.489 730 H HIS 96 H HIS 96 -0.105 2.022 -16.560 731 HA HIS 96 HA HIS 96 -2.383 3.669 -15.678 732 HB2 HIS 96 2HB HIS 96 -0.309 4.968 -15.132 733 HB3 HIS 96 1HB HIS 96 0.161 4.887 -16.827 734 HD2 HIS 96 2HD HIS 96 -1.057 6.812 -18.442 735 HE1 HIS 96 1HE HIS 96 -3.839 8.236 -15.603 736 HE2 HIS 96 2HE HIS 96 -2.901 8.591 -17.936 737 H THR 97 H THR 97 -3.691 4.264 -17.315 738 HA THR 97 HA THR 97 -2.935 3.719 -20.126 739 HB THR 97 HB THR 97 -4.947 2.386 -20.501 740 HG1 THR 97 1HG THR 97 -5.385 3.010 -17.789 741 HG21 THR 97 3HG2 THR 97 -3.557 1.268 -18.042 742 HG22 THR 97 1HG2 THR 97 -2.828 1.244 -19.649 743 HG23 THR 97 2HG2 THR 97 -4.318 0.353 -19.339 744 H GLY 98 H GLY 98 -3.186 5.755 -20.878 745 HA2 GLY 98 2HA GLY 98 -4.258 7.651 -21.607 746 HA3 GLY 98 1HA GLY 98 -5.782 6.846 -21.242 747 H ASP 99 H ASP 99 -6.794 7.203 -19.259 748 HA ASP 99 HA ASP 99 -5.600 9.229 -17.419 749 HB2 ASP 99 2HB ASP 99 -7.817 10.304 -17.271 750 HB3 ASP 99 1HB ASP 99 -7.178 10.367 -18.913 751 H THR 100 H THR 100 -5.773 6.307 -17.191 752 HA THR 100 HA THR 100 -7.342 6.147 -14.660 753 HB THR 100 HB THR 100 -7.216 3.946 -16.763 754 HG1 THR 100 1HG THR 100 -9.460 5.482 -16.022 755 HG21 THR 100 3HG2 THR 100 -7.493 3.105 -14.459 756 HG22 THR 100 1HG2 THR 100 -8.999 2.929 -15.354 757 HG23 THR 100 2HG2 THR 100 -8.817 4.240 -14.191 758 H THR 101 H THR 101 -6.113 5.497 -13.010 759 HA THR 101 HA THR 101 -3.499 4.142 -13.541 760 HB THR 101 HB THR 101 -4.399 5.747 -11.124 761 HG1 THR 101 1HG THR 101 -2.297 6.625 -12.593 762 HG21 THR 101 3HG2 THR 101 -2.731 4.066 -10.479 763 HG22 THR 101 1HG2 THR 101 -1.950 5.643 -10.553 764 HG23 THR 101 2HG2 THR 101 -1.725 4.489 -11.865 765 H ASN 102 H ASN 102 -3.347 2.080 -12.986 766 HA ASN 102 HA ASN 102 -5.234 0.897 -10.987 767 HB2 ASN 102 2HB ASN 102 -3.890 -0.411 -13.374 768 HB3 ASN 102 1HB ASN 102 -4.992 -1.193 -12.240 769 HD21 ASN 102 1HD2 ASN 102 -7.191 0.258 -12.018 770 HD22 ASN 102 2HD2 ASN 102 -7.850 0.728 -13.510 771 H ILE 103 H ILE 103 -4.254 0.319 -9.162 772 HA ILE 103 HA ILE 103 -1.314 -0.104 -9.072 773 HB ILE 103 HB ILE 103 -3.336 0.134 -6.805 774 HG12 ILE 103 2HG1 ILE 103 -1.398 2.273 -7.805 775 HG13 ILE 103 1HG1 ILE 103 -3.102 2.241 -8.246 776 HG21 ILE 103 1HG2 ILE 103 -0.296 0.239 -6.842 777 HG22 ILE 103 2HG2 ILE 103 -1.278 -1.047 -6.149 778 HG23 ILE 103 3HG2 ILE 103 -1.288 0.550 -5.415 779 HD11 ILE 103 3HD1 ILE 103 -2.809 3.741 -6.351 780 HD12 ILE 103 1HD1 ILE 103 -1.985 2.481 -5.439 781 HD13 ILE 103 2HD1 ILE 103 -3.704 2.318 -5.813 782 H VAL 104 H VAL 104 -0.571 -2.174 -9.051 783 HA VAL 104 HA VAL 104 -2.381 -4.367 -8.114 784 HB VAL 104 HB VAL 104 -0.323 -4.531 -10.346 785 HG11 VAL 104 1HG1 VAL 104 -1.402 -6.725 -10.783 786 HG12 VAL 104 2HG1 VAL 104 -2.418 -6.488 -9.362 787 HG13 VAL 104 3HG1 VAL 104 -0.673 -6.666 -9.180 788 HG21 VAL 104 3HG2 VAL 104 -3.349 -4.356 -10.473 789 HG22 VAL 104 1HG2 VAL 104 -2.293 -4.677 -11.849 790 HG23 VAL 104 2HG2 VAL 104 -2.216 -3.121 -11.025 791 H GLU 105 H GLU 105 -1.547 -5.587 -6.531 792 HA GLU 105 HA GLU 105 1.378 -5.734 -6.110 793 HB2 GLU 105 2HB GLU 105 1.036 -5.270 -3.679 794 HB3 GLU 105 1HB GLU 105 0.659 -3.882 -4.696 795 HG2 GLU 105 2HG GLU 105 -1.750 -4.428 -4.574 796 HG3 GLU 105 1HG GLU 105 -1.392 -5.816 -3.555 797 H SER 106 H SER 106 2.050 -7.610 -5.195 798 HA SER 106 HA SER 106 0.007 -9.705 -4.587 799 HB2 SER 106 2HB SER 106 2.680 -10.035 -5.979 800 HB3 SER 106 1HB SER 106 1.573 -11.337 -5.554 801 HG SER 106 HG SER 106 0.696 -9.137 -7.074 802 H PHE 107 H PHE 107 0.490 -11.125 -2.926 803 HA PHE 107 HA PHE 107 2.839 -10.473 -1.188 804 HB2 PHE 107 2HB PHE 107 0.007 -11.111 -0.280 805 HB3 PHE 107 1HB PHE 107 1.396 -10.821 0.765 806 HD1 PHE 107 1HD PHE 107 2.525 -8.551 0.766 807 HD2 PHE 107 2HD PHE 107 -1.204 -9.237 -1.268 808 HE1 PHE 107 1HE PHE 107 2.107 -6.106 0.694 809 HE2 PHE 107 2HE PHE 107 -1.614 -6.795 -1.325 810 HZ PHE 107 HZ PHE 107 0.038 -5.230 -0.348 811 H ASP 108 H ASP 108 3.621 -12.193 0.043 812 HA ASP 108 HA ASP 108 2.811 -14.940 -0.811 813 HB2 ASP 108 2HB ASP 108 5.586 -13.878 -0.231 814 HB3 ASP 108 1HB ASP 108 5.180 -15.540 -0.659 815 HA PRO 109 HA PRO 109 2.745 -14.522 3.848 816 HB2 PRO 109 2HB PRO 109 0.237 -15.420 4.379 817 HB3 PRO 109 1HB PRO 109 0.516 -13.763 3.792 818 HG2 PRO 109 2HG PRO 109 -0.375 -16.184 2.240 819 HG3 PRO 109 1HG PRO 109 -0.989 -14.520 2.163 820 HD2 PRO 109 2HD PRO 109 0.852 -15.549 0.350 821 HD3 PRO 109 1HD PRO 109 0.732 -13.814 0.718 822 H GLU 110 H GLU 110 2.154 -16.308 5.506 823 HA GLU 110 HA GLU 110 3.607 -18.681 4.778 824 HB2 GLU 110 2HB GLU 110 2.014 -18.028 7.268 825 HB3 GLU 110 1HB GLU 110 3.105 -19.399 7.092 826 HG2 GLU 110 2HG GLU 110 4.986 -17.859 6.684 827 HG3 GLU 110 1HG GLU 110 3.904 -16.479 6.850 828 H GLU 111 H GLU 111 2.855 -20.782 4.798 829 HA GLU 111 HA GLU 111 0.379 -21.228 3.429 830 HB2 GLU 111 2HB GLU 111 2.234 -23.212 4.786 831 HB3 GLU 111 1HB GLU 111 0.912 -23.641 3.700 832 HG2 GLU 111 2HG GLU 111 1.969 -22.339 1.885 833 HG3 GLU 111 1HG GLU 111 3.291 -21.904 2.963 834 H THR 112 H THR 112 1.428 -21.775 6.773 835 HA THR 112 HA THR 112 -0.932 -23.030 7.704 836 HB THR 112 HB THR 112 -0.101 -22.480 9.948 837 HG1 THR 112 1HG THR 112 0.831 -20.609 10.057 838 HG21 THR 112 3HG2 THR 112 2.143 -23.186 8.034 839 HG22 THR 112 1HG2 THR 112 0.985 -24.326 8.720 840 HG23 THR 112 2HG2 THR 112 2.130 -23.494 9.771 841 H ASN 113 H ASN 113 0.041 -19.607 7.606 842 HA ASN 113 HA ASN 113 -2.050 -18.567 9.136 843 HB2 ASN 113 2HB ASN 113 -0.381 -17.360 6.926 844 HB3 ASN 113 1HB ASN 113 -1.536 -16.404 7.850 845 HD21 ASN 113 1HD2 ASN 113 -0.082 -18.895 9.752 846 HD22 ASN 113 2HD2 ASN 113 1.071 -17.924 10.532 847 HA PRO 114 HA PRO 114 -5.506 -19.027 6.285 848 HB2 PRO 114 2HB PRO 114 -7.306 -17.218 7.270 849 HB3 PRO 114 1HB PRO 114 -6.851 -18.673 8.189 850 HG2 PRO 114 2HG PRO 114 -5.741 -15.884 8.455 851 HG3 PRO 114 1HG PRO 114 -6.348 -16.955 9.734 852 HD2 PRO 114 2HD PRO 114 -3.679 -16.759 9.209 853 HD3 PRO 114 1HD PRO 114 -4.407 -18.314 9.680 854 H ARG 115 H ARG 115 -5.226 -18.405 4.221 855 HA ARG 115 HA ARG 115 -4.240 -15.892 3.350 856 HB2 ARG 115 2HB ARG 115 -5.795 -18.015 1.831 857 HB3 ARG 115 1HB ARG 115 -4.909 -16.682 1.088 858 HG2 ARG 115 2HG ARG 115 -2.811 -17.506 2.112 859 HG3 ARG 115 1HG ARG 115 -3.695 -18.846 2.839 860 HD2 ARG 115 2HD ARG 115 -4.374 -19.597 0.545 861 HD3 ARG 115 1HD ARG 115 -3.382 -18.305 -0.125 862 HE ARG 115 HE ARG 115 -1.487 -19.570 0.325 863 HH11 ARG 115 1HH2 ARG 115 -4.200 -20.776 2.118 864 HH12 ARG 115 2HH2 ARG 115 -3.375 -22.192 2.679 865 HH21 ARG 115 1HH1 ARG 115 -0.407 -21.429 1.060 866 HH22 ARG 115 2HH1 ARG 115 -1.228 -22.561 2.081 867 H GLU 116 H GLU 116 -7.539 -17.234 3.525 868 HA GLU 116 HA GLU 116 -8.964 -15.266 2.212 869 HB2 GLU 116 2HB GLU 116 -9.755 -16.813 4.695 870 HB3 GLU 116 1HB GLU 116 -10.880 -15.952 3.645 871 HG2 GLU 116 2HG GLU 116 -10.215 -17.393 1.750 872 HG3 GLU 116 1HG GLU 116 -9.090 -18.252 2.798 873 H LEU 117 H LEU 117 -7.974 -15.292 5.649 874 HA LEU 117 HA LEU 117 -9.277 -12.894 6.381 875 HB2 LEU 117 2HB LEU 117 -8.200 -14.737 7.867 876 HB3 LEU 117 1HB LEU 117 -6.684 -13.895 7.588 877 HG LEU 117 HG LEU 117 -8.061 -11.742 8.417 878 HD11 LEU 117 1HD1 LEU 117 -9.571 -14.004 9.788 879 HD12 LEU 117 2HD1 LEU 117 -10.254 -12.938 8.566 880 HD13 LEU 117 3HD1 LEU 117 -9.753 -12.282 10.118 881 HD21 LEU 117 3HD2 LEU 117 -7.107 -13.894 10.349 882 HD22 LEU 117 1HD2 LEU 117 -7.349 -12.194 10.756 883 HD23 LEU 117 2HD2 LEU 117 -6.096 -12.655 9.607 884 H GLN 118 H GLN 118 -5.959 -13.535 5.268 885 HA GLN 118 HA GLN 118 -4.989 -10.883 5.480 886 HB2 GLN 118 2HB GLN 118 -4.146 -13.169 3.666 887 HB3 GLN 118 1HB GLN 118 -3.213 -11.689 3.901 888 HG2 GLN 118 2HG GLN 118 -3.019 -12.165 6.301 889 HG3 GLN 118 1HG GLN 118 -3.997 -13.620 6.109 890 HE21 GLN 118 1HE2 GLN 118 -0.898 -12.897 6.657 891 HE22 GLN 118 2HE2 GLN 118 -0.117 -14.072 5.712 892 H GLN 119 H GLN 119 -6.175 -12.695 2.624 893 HA GLN 119 HA GLN 119 -5.993 -10.617 0.769 894 HB2 GLN 119 2HB GLN 119 -6.507 -13.019 0.251 895 HB3 GLN 119 1HB GLN 119 -8.144 -12.768 0.846 896 HG2 GLN 119 2HG GLN 119 -8.507 -11.027 -0.878 897 HG3 GLN 119 1HG GLN 119 -6.861 -11.256 -1.459 898 HE21 GLN 119 1HE2 GLN 119 -7.148 -12.263 -3.470 899 HE22 GLN 119 2HE2 GLN 119 -8.073 -13.665 -3.713 900 H SER 120 H SER 120 -8.611 -11.434 3.007 901 HA SER 120 HA SER 120 -10.503 -9.537 2.126 902 HB2 SER 120 2HB SER 120 -11.059 -11.383 3.661 903 HB3 SER 120 1HB SER 120 -10.077 -10.635 4.920 904 HG SER 120 HG SER 120 -12.490 -9.752 3.750 905 H GLY 121 H GLY 121 -7.916 -9.317 4.565 906 HA2 GLY 121 2HA GLY 121 -8.508 -6.732 5.514 907 HA3 GLY 121 1HA GLY 121 -6.926 -7.500 5.573 908 H TRP 122 H TRP 122 -6.168 -7.745 2.993 909 HA TRP 122 HA TRP 122 -5.400 -5.096 2.274 910 HB2 TRP 122 2HB TRP 122 -5.276 -7.677 0.664 911 HB3 TRP 122 1HB TRP 122 -4.480 -6.171 0.209 912 HD1 TRP 122 HD TRP 122 -3.819 -9.266 2.109 913 HE1 TRP 122 1HE TRP 122 -1.726 -9.004 3.585 914 HE3 TRP 122 3HE TRP 122 -3.161 -4.203 1.831 915 HZ2 TRP 122 2HZ TRP 122 0.003 -6.930 4.522 916 HZ3 TRP 122 3HZ TRP 122 -1.282 -3.118 3.022 917 HH2 TRP 122 HH TRP 122 0.301 -4.471 4.365 918 H GLN 123 H GLN 123 -7.837 -7.341 0.957 919 HA GLN 123 HA GLN 123 -8.638 -5.701 -1.212 920 HB2 GLN 123 2HB GLN 123 -9.173 -8.133 -0.973 921 HB3 GLN 123 1HB GLN 123 -10.329 -7.724 0.297 922 HG2 GLN 123 2HG GLN 123 -11.622 -6.351 -1.295 923 HG3 GLN 123 1HG GLN 123 -10.445 -6.682 -2.561 924 HE21 GLN 123 1HE2 GLN 123 -11.086 -8.340 -3.935 925 HE22 GLN 123 2HE2 GLN 123 -12.098 -9.631 -3.498 926 H ALA 124 H ALA 124 -9.710 -5.903 2.166 927 HA ALA 124 HA ALA 124 -11.980 -4.305 2.040 928 HB1 ALA 124 1HB ALA 124 -11.610 -3.870 4.436 929 HB2 ALA 124 2HB ALA 124 -9.969 -4.498 4.278 930 HB3 ALA 124 3HB ALA 124 -11.349 -5.565 4.034 931 H ILE 125 H ILE 125 -8.671 -3.228 2.856 932 HA ILE 125 HA ILE 125 -9.333 -0.463 2.954 933 HB ILE 125 HB ILE 125 -7.413 -1.346 4.140 934 HG12 ILE 125 2HG1 ILE 125 -6.447 0.498 1.906 935 HG13 ILE 125 1HG1 ILE 125 -7.328 1.032 3.333 936 HG21 ILE 125 1HG2 ILE 125 -6.213 -1.962 1.421 937 HG22 ILE 125 2HG2 ILE 125 -6.828 -3.146 2.571 938 HG23 ILE 125 3HG2 ILE 125 -5.421 -2.185 2.977 939 HD11 ILE 125 3HD1 ILE 125 -4.514 0.529 3.013 940 HD12 ILE 125 1HD1 ILE 125 -5.123 -0.523 4.287 941 HD13 ILE 125 2HD1 ILE 125 -5.362 1.223 4.386 942 H LEU 126 H LEU 126 -8.105 -2.550 0.357 943 HA LEU 126 HA LEU 126 -7.416 -0.500 -1.438 944 HB2 LEU 126 2HB LEU 126 -8.220 -3.384 -1.746 945 HB3 LEU 126 1HB LEU 126 -7.905 -2.434 -3.176 946 HG LEU 126 HG LEU 126 -5.841 -2.656 -0.937 947 HD11 LEU 126 1HD1 LEU 126 -6.345 -4.943 -1.758 948 HD12 LEU 126 2HD1 LEU 126 -4.742 -4.426 -2.274 949 HD13 LEU 126 3HD1 LEU 126 -6.086 -4.407 -3.417 950 HD21 LEU 126 3HD2 LEU 126 -4.248 -2.096 -2.798 951 HD22 LEU 126 1HD2 LEU 126 -5.432 -0.823 -2.572 952 HD23 LEU 126 2HD2 LEU 126 -5.612 -1.956 -3.904 953 H ASN 127 H ASN 127 -10.552 -2.165 -0.927 954 HA ASN 127 HA ASN 127 -11.821 -0.851 -3.137 955 HB2 ASN 127 2HB ASN 127 -13.938 -1.612 -2.187 956 HB3 ASN 127 1HB ASN 127 -12.752 -2.914 -2.174 957 HD21 ASN 127 1HD2 ASN 127 -13.182 -4.100 -0.335 958 HD22 ASN 127 2HD2 ASN 127 -13.393 -3.444 1.214 959 H SER 128 H SER 128 -11.272 0.007 0.206 960 HA SER 128 HA SER 128 -13.060 2.280 0.237 961 HB2 SER 128 2HB SER 128 -12.057 2.782 2.403 962 HB3 SER 128 1HB SER 128 -12.416 1.059 2.297 963 HG SER 128 HG SER 128 -10.365 1.148 3.008 964 H PHE 129 H PHE 129 -9.692 1.741 -0.591 965 HA PHE 129 HA PHE 129 -8.636 4.295 -0.334 966 HB2 PHE 129 2HB PHE 129 -7.354 2.238 -0.959 967 HB3 PHE 129 1HB PHE 129 -8.035 2.334 -2.581 968 HD1 PHE 129 1HD PHE 129 -7.362 4.143 -4.138 969 HD2 PHE 129 2HD PHE 129 -5.698 3.913 -0.176 970 HE1 PHE 129 1HE PHE 129 -5.614 5.782 -4.767 971 HE2 PHE 129 2HE PHE 129 -3.952 5.549 -0.821 972 HZ PHE 129 HZ PHE 129 -3.911 6.483 -3.115 973 H LYS 130 H LYS 130 -10.247 2.944 -3.243 974 HA LYS 130 HA LYS 130 -10.108 5.362 -4.753 975 HB2 LYS 130 2HB LYS 130 -11.717 4.270 -6.263 976 HB3 LYS 130 1HB LYS 130 -10.404 3.176 -5.833 977 HG2 LYS 130 2HG LYS 130 -11.861 2.146 -4.103 978 HG3 LYS 130 1HG LYS 130 -13.185 3.195 -4.600 979 HD2 LYS 130 2HD LYS 130 -13.053 2.217 -6.895 980 HD3 LYS 130 1HD LYS 130 -11.806 1.107 -6.322 981 HE2 LYS 130 2HE LYS 130 -13.392 0.194 -4.651 982 HE3 LYS 130 1HE LYS 130 -14.635 1.301 -5.221 983 HZ1 LYS 130 3HZ LYS 130 -15.153 -0.122 -6.797 984 HZ2 LYS 130 1HZ LYS 130 -13.994 -1.212 -6.214 985 HZ3 LYS 130 2HZ LYS 130 -13.570 -0.084 -7.412 986 H SER 131 H SER 131 -12.489 4.007 -2.536 987 HA SER 131 HA SER 131 -14.648 5.712 -3.082 988 HB2 SER 131 2HB SER 131 -14.823 3.684 -1.681 989 HB3 SER 131 1HB SER 131 -13.876 4.478 -0.429 990 HG SER 131 HG SER 131 -15.605 5.480 0.174 991 H TYR 132 H TYR 132 -11.896 6.092 -0.876 992 HA TYR 132 HA TYR 132 -12.743 8.463 0.388 993 HB2 TYR 132 2HB TYR 132 -10.854 7.070 1.185 994 HB3 TYR 132 1HB TYR 132 -9.914 7.539 -0.230 995 HD1 TYR 132 2HD TYR 132 -9.063 9.859 -0.483 996 HD2 TYR 132 1HD TYR 132 -11.293 8.687 3.006 997 HE1 TYR 132 2HE TYR 132 -8.364 11.941 0.672 998 HE2 TYR 132 1HE TYR 132 -10.595 10.774 4.147 999 HH TYR 132 HH TYR 132 -8.178 12.504 3.500 1000 H THR 133 H THR 133 -10.667 7.979 -2.478 1001 HA THR 133 HA THR 133 -10.298 10.731 -3.061 1002 HB THR 133 HB THR 133 -9.522 9.919 -5.247 1003 HG1 THR 133 1HG THR 133 -10.809 8.316 -5.829 1004 HG21 THR 133 3HG2 THR 133 -7.755 8.404 -4.453 1005 HG22 THR 133 1HG2 THR 133 -8.668 8.106 -2.975 1006 HG23 THR 133 2HG2 THR 133 -8.014 9.712 -3.298 1007 H GLU 134 H GLU 134 -12.720 8.337 -4.058 1008 HA GLU 134 HA GLU 134 -13.987 9.943 -6.038 1009 HB2 GLU 134 2HB GLU 134 -14.226 7.449 -5.816 1010 HB3 GLU 134 1HB GLU 134 -15.209 7.707 -4.378 1011 HG2 GLU 134 2HG GLU 134 -16.706 7.378 -6.271 1012 HG3 GLU 134 1HG GLU 134 -16.813 9.069 -5.798 1013 H ASN 135 H ASN 135 -14.345 9.677 -2.549 1014 HA ASN 135 HA ASN 135 -16.820 10.985 -2.241 1015 HB2 ASN 135 2HB ASN 135 -15.669 9.759 -0.419 1016 HB3 ASN 135 1HB ASN 135 -14.440 11.018 -0.358 1017 HD21 ASN 135 1HD2 ASN 135 -14.933 11.885 1.727 1018 HD22 ASN 135 2HD2 ASN 135 -16.425 12.603 2.101 1019 H ASN 136 H ASN 136 -13.547 12.242 -2.683 1020 HA ASN 136 HA ASN 136 -14.042 14.943 -2.016 1021 HB2 ASN 136 2HB ASN 136 -12.065 13.800 -4.017 1022 HB3 ASN 136 1HB ASN 136 -11.997 15.411 -3.300 1023 HD21 ASN 136 1HD2 ASN 136 -12.632 14.808 -0.604 1024 HD22 ASN 136 2HD2 ASN 136 -11.411 13.819 0.039 1025 H LEU 137 H LEU 137 -14.327 13.162 -5.085 1026 HA LEU 137 HA LEU 137 -15.105 15.499 -6.618 1027 HB2 LEU 137 2HB LEU 137 -14.992 12.514 -7.155 1028 HB3 LEU 137 1HB LEU 137 -15.767 13.594 -8.313 1029 HG LEU 137 HG LEU 137 -13.680 14.895 -8.530 1030 HD11 LEU 137 1HD1 LEU 137 -12.643 14.668 -6.372 1031 HD12 LEU 137 2HD1 LEU 137 -11.560 13.876 -7.506 1032 HD13 LEU 137 3HD1 LEU 137 -12.620 12.905 -6.486 1033 HD21 LEU 137 3HD2 LEU 137 -13.268 11.900 -8.870 1034 HD22 LEU 137 1HD2 LEU 137 -12.343 13.161 -9.689 1035 HD23 LEU 137 2HD2 LEU 137 -14.062 12.967 -10.030 1036 H GLU 138 H GLU 138 -17.138 16.102 -7.239 1037 HA GLU 138 HA GLU 138 -19.314 15.550 -5.507 1038 HB2 GLU 138 2HB GLU 138 -19.301 16.793 -8.281 1039 HB3 GLU 138 1HB GLU 138 -20.629 16.891 -7.121 1040 HG2 GLU 138 2HG GLU 138 -17.818 17.942 -6.597 1041 HG3 GLU 138 1HG GLU 138 -19.171 18.939 -7.119 1042 H HIS 139 H HIS 139 -21.113 14.266 -5.747 1043 HA HIS 139 HA HIS 139 -20.869 11.846 -7.210 1044 HB2 HIS 139 2HB HIS 139 -23.323 13.118 -5.948 1045 HB3 HIS 139 1HB HIS 139 -23.190 11.433 -6.457 1046 HD2 HIS 139 2HD HIS 139 -22.260 13.639 -3.421 1047 HE1 HIS 139 1HE HIS 139 -20.396 9.898 -2.819 1048 HE2 HIS 139 2HE HIS 139 -20.969 12.123 -1.732 1049 H HIS 140 H HIS 140 -22.624 14.860 -7.825 1050 HA HIS 140 HA HIS 140 -24.112 13.986 -10.076 1051 HB2 HIS 140 2HB HIS 140 -23.094 16.766 -9.392 1052 HB3 HIS 140 1HB HIS 140 -24.369 16.394 -10.553 1053 HD2 HIS 140 2HD HIS 140 -26.855 15.627 -9.388 1054 HE1 HIS 140 1HE HIS 140 -25.705 16.387 -5.397 1055 HE2 HIS 140 2HE HIS 140 -27.666 15.844 -6.915 1056 H HIS 141 H HIS 141 -23.656 13.987 -12.245 1057 HA HIS 141 HA HIS 141 -21.001 13.594 -13.104 1058 HB2 HIS 141 2HB HIS 141 -22.023 13.750 -15.417 1059 HB3 HIS 141 1HB HIS 141 -22.847 12.624 -14.337 1060 HD2 HIS 141 2HD HIS 141 -25.424 13.483 -13.442 1061 HE1 HIS 141 1HE HIS 141 -25.645 16.832 -16.005 1062 HE2 HIS 141 2HE HIS 141 -26.961 15.362 -14.405 1063 H HIS 142 H HIS 142 -19.574 15.243 -12.756 1064 HA HIS 142 HA HIS 142 -20.168 18.021 -13.227 1065 HB2 HIS 142 2HB HIS 142 -17.731 18.326 -12.812 1066 HB3 HIS 142 1HB HIS 142 -18.506 17.360 -11.558 1067 HD2 HIS 142 2HD HIS 142 -17.202 14.972 -11.108 1068 HE1 HIS 142 1HE HIS 142 -15.179 14.682 -14.802 1069 HE2 HIS 142 2HE HIS 142 -15.511 13.587 -12.535 1070 H HIS 143 H HIS 143 -19.677 15.488 -15.321 1071 HA HIS 143 HA HIS 143 -17.915 16.483 -17.272 1072 HB2 HIS 143 2HB HIS 143 -20.379 14.740 -17.610 1073 HB3 HIS 143 1HB HIS 143 -19.110 14.941 -18.817 1074 HD2 HIS 143 2HD HIS 143 -16.633 13.651 -18.168 1075 HE1 HIS 143 1HE HIS 143 -18.133 11.574 -14.811 1076 HE2 HIS 143 2HE HIS 143 -16.163 11.789 -16.398 1077 H HIS 144 H HIS 144 -21.455 16.843 -16.988 1078 HA HIS 144 HA HIS 144 -21.690 18.548 -19.308 1079 HB2 HIS 144 2HB HIS 144 -23.607 18.050 -17.004 1080 HB3 HIS 144 1HB HIS 144 -24.011 18.874 -18.511 1081 HD2 HIS 144 2HD HIS 144 -24.391 17.165 -20.733 1082 HE1 HIS 144 1HE HIS 144 -23.722 13.547 -18.665 1083 HE2 HIS 144 2HE HIS 144 -24.500 14.560 -20.860 Start of MODEL 15 1 H1 GLY 1 1HT GLY 1 -2.234 -21.881 -2.908 2 H2 GLY 1 2HT GLY 1 -0.791 -20.986 -2.961 3 H3 GLY 1 3HT GLY 1 -1.631 -21.336 -4.396 4 HA2 GLY 1 2HA GLY 1 -2.742 -19.449 -4.219 5 HA3 GLY 1 1HA GLY 1 -3.424 -20.043 -2.703 6 H ASN 2 H ASN 2 -0.017 -19.902 -2.780 7 HA ASN 2 HA ASN 2 0.066 -17.784 -0.772 8 HB2 ASN 2 2HB ASN 2 2.289 -19.396 -2.070 9 HB3 ASN 2 1HB ASN 2 2.475 -18.314 -0.689 10 HD21 ASN 2 1HD2 ASN 2 1.482 -18.976 1.367 11 HD22 ASN 2 2HD2 ASN 2 1.044 -20.593 1.634 12 H LYS 3 H LYS 3 -0.718 -17.223 -3.612 13 HA LYS 3 HA LYS 3 1.266 -15.076 -4.220 14 HB2 LYS 3 2HB LYS 3 0.637 -15.416 -6.640 15 HB3 LYS 3 1HB LYS 3 1.538 -16.752 -5.924 16 HG2 LYS 3 2HG LYS 3 -0.493 -18.069 -5.635 17 HG3 LYS 3 1HG LYS 3 -1.501 -16.714 -6.130 18 HD2 LYS 3 2HD LYS 3 -1.268 -18.289 -7.991 19 HD3 LYS 3 1HD LYS 3 -0.471 -16.772 -8.390 20 HE2 LYS 3 2HE LYS 3 1.714 -17.730 -8.094 21 HE3 LYS 3 1HE LYS 3 1.075 -19.119 -7.211 22 HZ1 LYS 3 3HZ LYS 3 1.330 -18.695 -10.026 23 HZ2 LYS 3 1HZ LYS 3 -0.231 -19.194 -9.590 24 HZ3 LYS 3 2HZ LYS 3 1.113 -20.140 -9.159 25 H ILE 4 H ILE 4 -0.689 -14.408 -2.518 26 HA ILE 4 HA ILE 4 -3.190 -13.706 -3.494 27 HB ILE 4 HB ILE 4 -1.583 -11.931 -1.607 28 HG12 ILE 4 2HG1 ILE 4 -1.350 -14.207 -0.804 29 HG13 ILE 4 1HG1 ILE 4 -2.498 -13.369 0.221 30 HG21 ILE 4 1HG2 ILE 4 -3.754 -11.017 -2.324 31 HG22 ILE 4 2HG2 ILE 4 -3.817 -11.478 -0.624 32 HG23 ILE 4 3HG2 ILE 4 -4.559 -12.512 -1.844 33 HD11 ILE 4 3HD1 ILE 4 -3.034 -15.485 -1.866 34 HD12 ILE 4 1HD1 ILE 4 -4.333 -14.448 -1.272 35 HD13 ILE 4 2HD1 ILE 4 -3.457 -15.494 -0.163 36 H THR 5 H THR 5 -3.985 -12.153 -4.734 37 HA THR 5 HA THR 5 -2.221 -9.998 -5.796 38 HB THR 5 HB THR 5 -4.063 -11.730 -7.498 39 HG1 THR 5 1HG THR 5 -2.113 -12.743 -6.647 40 HG21 THR 5 3HG2 THR 5 -1.995 -9.620 -8.215 41 HG22 THR 5 1HG2 THR 5 -3.743 -9.440 -8.370 42 HG23 THR 5 2HG2 THR 5 -2.888 -10.607 -9.371 43 H VAL 6 H VAL 6 -3.168 -8.079 -5.724 44 HA VAL 6 HA VAL 6 -6.119 -7.793 -5.823 45 HB VAL 6 HB VAL 6 -5.953 -6.100 -3.964 46 HG11 VAL 6 1HG1 VAL 6 -6.736 -8.401 -3.514 47 HG12 VAL 6 2HG1 VAL 6 -5.845 -7.751 -2.139 48 HG13 VAL 6 3HG1 VAL 6 -5.072 -8.909 -3.220 49 HG21 VAL 6 3HG2 VAL 6 -3.546 -5.606 -4.099 50 HG22 VAL 6 1HG2 VAL 6 -3.155 -7.268 -3.661 51 HG23 VAL 6 2HG2 VAL 6 -3.931 -6.210 -2.489 52 H GLU 7 H GLU 7 -6.794 -5.808 -6.650 53 HA GLU 7 HA GLU 7 -4.810 -3.846 -7.553 54 HB2 GLU 7 2HB GLU 7 -5.628 -3.963 -9.921 55 HB3 GLU 7 1HB GLU 7 -4.776 -5.420 -9.414 56 HG2 GLU 7 2HG GLU 7 -6.941 -6.536 -8.965 57 HG3 GLU 7 1HG GLU 7 -7.796 -5.086 -9.486 58 H VAL 8 H VAL 8 -5.750 -1.899 -8.379 59 HA VAL 8 HA VAL 8 -8.621 -1.454 -8.006 60 HB VAL 8 HB VAL 8 -8.176 0.548 -6.510 61 HG11 VAL 8 1HG1 VAL 8 -9.047 -1.624 -5.614 62 HG12 VAL 8 2HG1 VAL 8 -8.079 -0.726 -4.453 63 HG13 VAL 8 3HG1 VAL 8 -7.385 -2.117 -5.271 64 HG21 VAL 8 3HG2 VAL 8 -5.756 0.758 -6.964 65 HG22 VAL 8 1HG2 VAL 8 -5.469 -0.797 -6.181 66 HG23 VAL 8 2HG2 VAL 8 -6.057 0.574 -5.239 67 H THR 9 H THR 9 -9.284 0.619 -8.797 68 HA THR 9 HA THR 9 -7.461 1.843 -10.796 69 HB THR 9 HB THR 9 -9.441 2.136 -12.185 70 HG1 THR 9 1HG THR 9 -10.763 2.148 -10.128 71 HG21 THR 9 3HG2 THR 9 -8.217 -0.026 -12.355 72 HG22 THR 9 1HG2 THR 9 -9.932 -0.204 -12.729 73 HG23 THR 9 2HG2 THR 9 -9.316 -0.710 -11.157 74 H VAL 10 H VAL 10 -7.116 3.936 -10.383 75 HA VAL 10 HA VAL 10 -9.159 5.542 -8.896 76 HB VAL 10 HB VAL 10 -7.259 4.905 -7.486 77 HG11 VAL 10 1HG1 VAL 10 -5.539 4.696 -9.215 78 HG12 VAL 10 2HG1 VAL 10 -5.010 5.713 -7.876 79 HG13 VAL 10 3HG1 VAL 10 -5.527 6.453 -9.386 80 HG21 VAL 10 3HG2 VAL 10 -7.210 7.852 -8.176 81 HG22 VAL 10 1HG2 VAL 10 -6.716 7.136 -6.642 82 HG23 VAL 10 2HG2 VAL 10 -8.408 7.085 -7.133 83 H TYR 11 H TYR 11 -9.520 7.592 -9.612 84 HA TYR 11 HA TYR 11 -8.468 8.292 -12.260 85 HB2 TYR 11 2HB TYR 11 -10.513 9.677 -10.516 86 HB3 TYR 11 1HB TYR 11 -10.146 10.059 -12.197 87 HD1 TYR 11 1HD TYR 11 -10.821 8.531 -14.030 88 HD2 TYR 11 2HD TYR 11 -11.728 7.597 -9.928 89 HE1 TYR 11 1HE TYR 11 -12.393 6.764 -14.774 90 HE2 TYR 11 2HE TYR 11 -13.299 5.834 -10.682 91 HH TYR 11 HH TYR 11 -14.484 5.087 -12.509 92 H ALA 12 H ALA 12 -6.312 8.736 -11.697 93 HA ALA 12 HA ALA 12 -5.803 11.487 -11.056 94 HB1 ALA 12 1HB ALA 12 -4.470 11.134 -9.023 95 HB2 ALA 12 2HB ALA 12 -4.889 9.420 -9.032 96 HB3 ALA 12 3HB ALA 12 -6.141 10.633 -8.763 97 H ALA 13 H ALA 13 -3.717 12.116 -11.623 98 HA ALA 13 HA ALA 13 -2.367 10.522 -13.542 99 HB1 ALA 13 1HB ALA 13 -0.657 12.300 -13.490 100 HB2 ALA 13 2HB ALA 13 -1.384 12.958 -12.023 101 HB3 ALA 13 3HB ALA 13 -2.282 12.985 -13.541 102 H ILE 14 H ILE 14 -0.626 9.164 -13.370 103 HA ILE 14 HA ILE 14 -0.050 7.835 -11.010 104 HB ILE 14 HB ILE 14 0.506 6.933 -13.204 105 HG12 ILE 14 2HG1 ILE 14 3.072 7.220 -11.561 106 HG13 ILE 14 1HG1 ILE 14 1.742 6.169 -11.080 107 HG21 ILE 14 1HG2 ILE 14 2.427 7.743 -14.481 108 HG22 ILE 14 2HG2 ILE 14 2.781 8.957 -13.254 109 HG23 ILE 14 3HG2 ILE 14 1.307 9.081 -14.216 110 HD11 ILE 14 3HD1 ILE 14 3.267 5.988 -13.683 111 HD12 ILE 14 1HD1 ILE 14 1.942 4.938 -13.183 112 HD13 ILE 14 2HD1 ILE 14 3.463 4.926 -12.291 113 H GLU 15 H GLU 15 1.407 10.787 -12.259 114 HA GLU 15 HA GLU 15 3.700 10.895 -10.656 115 HB2 GLU 15 2HB GLU 15 3.189 12.381 -12.596 116 HB3 GLU 15 1HB GLU 15 1.973 13.200 -11.622 117 HG2 GLU 15 2HG GLU 15 3.718 13.891 -10.011 118 HG3 GLU 15 1HG GLU 15 4.934 13.041 -10.957 119 H LYS 16 H LYS 16 0.363 11.992 -10.005 120 HA LYS 16 HA LYS 16 0.981 13.119 -7.435 121 HB2 LYS 16 2HB LYS 16 -1.032 13.649 -8.982 122 HB3 LYS 16 1HB LYS 16 -1.760 12.173 -8.362 123 HG2 LYS 16 2HG LYS 16 -2.654 13.761 -6.848 124 HG3 LYS 16 1HG LYS 16 -1.215 13.258 -5.964 125 HD2 LYS 16 2HD LYS 16 0.003 15.244 -6.990 126 HD3 LYS 16 1HD LYS 16 -1.528 15.755 -7.692 127 HE2 LYS 16 2HE LYS 16 -0.944 15.423 -4.729 128 HE3 LYS 16 1HE LYS 16 -1.113 16.953 -5.590 129 HZ1 LYS 16 3HZ LYS 16 -3.391 16.067 -6.250 130 HZ2 LYS 16 1HZ LYS 16 -3.189 16.589 -4.649 131 HZ3 LYS 16 2HZ LYS 16 -3.181 14.928 -5.008 132 H VAL 17 H VAL 17 -0.400 10.044 -8.540 133 HA VAL 17 HA VAL 17 -0.927 8.926 -6.002 134 HB VAL 17 HB VAL 17 -0.264 7.507 -8.598 135 HG11 VAL 17 1HG1 VAL 17 -1.640 5.655 -7.607 136 HG12 VAL 17 2HG1 VAL 17 -1.704 6.555 -6.093 137 HG13 VAL 17 3HG1 VAL 17 -0.161 5.954 -6.697 138 HG21 VAL 17 3HG2 VAL 17 -2.930 8.383 -7.428 139 HG22 VAL 17 1HG2 VAL 17 -2.724 7.446 -8.907 140 HG23 VAL 17 2HG2 VAL 17 -2.141 9.105 -8.828 141 H TRP 18 H TRP 18 1.960 8.754 -8.104 142 HA TRP 18 HA TRP 18 3.434 6.914 -6.582 143 HB2 TRP 18 2HB TRP 18 4.101 7.620 -8.839 144 HB3 TRP 18 1HB TRP 18 4.408 9.253 -8.255 145 HD1 TRP 18 HD TRP 18 6.507 9.588 -6.587 146 HE1 TRP 18 1HE TRP 18 8.668 8.214 -6.292 147 HE3 TRP 18 3HE TRP 18 5.128 5.272 -8.936 148 HZ2 TRP 18 2HZ TRP 18 9.676 5.627 -6.966 149 HZ3 TRP 18 3HZ TRP 18 6.707 3.368 -9.094 150 HH2 TRP 18 HH TRP 18 8.976 3.543 -8.111 151 H LYS 19 H LYS 19 3.435 10.486 -6.423 152 HA LYS 19 HA LYS 19 5.275 10.637 -4.232 153 HB2 LYS 19 2HB LYS 19 3.226 12.633 -5.221 154 HB3 LYS 19 1HB LYS 19 4.477 12.999 -4.033 155 HG2 LYS 19 2HG LYS 19 6.211 12.327 -5.736 156 HG3 LYS 19 1HG LYS 19 4.924 12.149 -6.921 157 HD2 LYS 19 2HD LYS 19 5.580 14.716 -5.425 158 HD3 LYS 19 1HD LYS 19 6.062 14.363 -7.080 159 HE2 LYS 19 2HE LYS 19 3.526 14.058 -7.576 160 HE3 LYS 19 1HE LYS 19 3.257 14.864 -6.032 161 HZ1 LYS 19 3HZ LYS 19 3.803 16.041 -8.470 162 HZ2 LYS 19 1HZ LYS 19 5.196 16.264 -7.526 163 HZ3 LYS 19 2HZ LYS 19 3.688 16.799 -6.953 164 H TYR 20 H TYR 20 1.703 10.787 -4.418 165 HA TYR 20 HA TYR 20 1.259 11.235 -1.667 166 HB2 TYR 20 2HB TYR 20 -0.454 11.596 -3.419 167 HB3 TYR 20 1HB TYR 20 -0.532 9.859 -3.694 168 HD1 TYR 20 1HD TYR 20 -1.373 8.321 -1.880 169 HD2 TYR 20 2HD TYR 20 -1.572 12.601 -1.478 170 HE1 TYR 20 1HE TYR 20 -2.981 8.076 -0.011 171 HE2 TYR 20 2HE TYR 20 -3.175 12.347 0.392 172 HH TYR 20 HH TYR 20 -4.007 9.158 1.683 173 H TRP 21 H TRP 21 1.387 8.238 -3.558 174 HA TRP 21 HA TRP 21 0.734 6.497 -1.402 175 HB2 TRP 21 2HB TRP 21 0.550 5.908 -3.829 176 HB3 TRP 21 1HB TRP 21 2.309 5.883 -3.944 177 HD1 TRP 21 HD TRP 21 3.525 3.728 -3.086 178 HE1 TRP 21 1HE TRP 21 2.734 1.489 -2.094 179 HE3 TRP 21 3HE TRP 21 -1.390 4.820 -2.290 180 HZ2 TRP 21 2HZ TRP 21 0.327 0.312 -1.097 181 HZ3 TRP 21 3HZ TRP 21 -2.913 3.123 -1.326 182 HH2 TRP 21 HH TRP 21 -2.063 0.871 -0.728 183 H ASN 22 H ASN 22 3.659 8.138 -2.309 184 HA ASN 22 HA ASN 22 5.384 6.400 -0.628 185 HB2 ASN 22 2HB ASN 22 6.062 8.660 -2.530 186 HB3 ASN 22 1HB ASN 22 7.237 7.678 -1.656 187 HD21 ASN 22 1HD2 ASN 22 5.542 5.179 -2.054 188 HD22 ASN 22 2HD2 ASN 22 5.793 4.753 -3.678 189 H GLU 23 H GLU 23 3.885 9.566 -0.668 190 HA GLU 23 HA GLU 23 5.628 10.905 1.088 191 HB2 GLU 23 2HB GLU 23 3.813 12.002 -0.258 192 HB3 GLU 23 1HB GLU 23 2.628 11.328 0.852 193 HG2 GLU 23 2HG GLU 23 3.099 13.630 1.508 194 HG3 GLU 23 1HG GLU 23 3.774 12.564 2.729 195 HA PRO 24 HA PRO 24 4.443 8.253 4.632 196 HB2 PRO 24 2HB PRO 24 6.097 9.238 6.592 197 HB3 PRO 24 1HB PRO 24 6.704 8.229 5.265 198 HG2 PRO 24 2HG PRO 24 6.733 11.231 5.497 199 HG3 PRO 24 1HG PRO 24 8.053 10.141 5.017 200 HD2 PRO 24 2HD PRO 24 6.553 11.475 3.165 201 HD3 PRO 24 1HD PRO 24 7.185 9.845 2.830 202 H ALA 25 H ALA 25 4.636 11.792 4.969 203 HA ALA 25 HA ALA 25 3.117 12.081 7.298 204 HB1 ALA 25 1HB ALA 25 3.214 13.952 4.918 205 HB2 ALA 25 2HB ALA 25 4.368 13.928 6.248 206 HB3 ALA 25 3HB ALA 25 2.690 14.378 6.547 207 H HIS 26 H HIS 26 2.103 11.462 4.000 208 HA HIS 26 HA HIS 26 -0.716 12.015 4.513 209 HB2 HIS 26 2HB HIS 26 0.652 10.670 2.161 210 HB3 HIS 26 1HB HIS 26 -1.050 11.130 2.226 211 HD2 HIS 26 2HD HIS 26 0.373 12.805 -0.033 212 HE1 HIS 26 1HE HIS 26 1.035 15.868 2.786 213 HE2 HIS 26 2HE HIS 26 0.965 15.320 0.308 214 H ILE 27 H ILE 27 1.342 9.100 4.376 215 HA ILE 27 HA ILE 27 -0.782 7.215 4.414 216 HB ILE 27 HB ILE 27 2.100 6.974 5.378 217 HG12 ILE 27 2HG1 ILE 27 0.750 5.944 2.834 218 HG13 ILE 27 1HG1 ILE 27 1.668 7.446 2.908 219 HG21 ILE 27 1HG2 ILE 27 -0.065 4.839 5.043 220 HG22 ILE 27 2HG2 ILE 27 0.853 5.202 6.504 221 HG23 ILE 27 3HG2 ILE 27 1.649 4.446 5.140 222 HD11 ILE 27 3HD1 ILE 27 3.129 5.708 2.060 223 HD12 ILE 27 1HD1 ILE 27 2.723 4.644 3.404 224 HD13 ILE 27 2HD1 ILE 27 3.662 6.110 3.693 225 H MET 28 H MET 28 1.007 8.769 7.103 226 HA MET 28 HA MET 28 -0.167 7.284 9.190 227 HB2 MET 28 2HB MET 28 0.422 9.311 10.634 228 HB3 MET 28 1HB MET 28 1.758 8.626 9.714 229 HG2 MET 28 2HG MET 28 1.537 10.351 8.018 230 HG3 MET 28 1HG MET 28 0.090 10.989 8.781 231 HE1 MET 28 3HE MET 28 3.606 9.869 10.738 232 HE2 MET 28 1HE MET 28 4.444 11.305 10.141 233 HE3 MET 28 2HE MET 28 3.742 10.163 9.003 234 H LYS 29 H LYS 29 -1.624 9.577 7.104 235 HA LYS 29 HA LYS 29 -3.647 10.507 8.964 236 HB2 LYS 29 2HB LYS 29 -2.820 11.824 6.988 237 HB3 LYS 29 1HB LYS 29 -3.633 10.675 5.929 238 HG2 LYS 29 2HG LYS 29 -5.800 11.217 6.950 239 HG3 LYS 29 1HG LYS 29 -5.013 12.320 8.081 240 HD2 LYS 29 2HD LYS 29 -4.226 13.697 6.175 241 HD3 LYS 29 1HD LYS 29 -5.040 12.603 5.057 242 HE2 LYS 29 2HE LYS 29 -6.424 14.596 5.510 243 HE3 LYS 29 1HE LYS 29 -7.210 13.135 6.109 244 HZ1 LYS 29 3HZ LYS 29 -5.480 14.810 7.829 245 HZ2 LYS 29 1HZ LYS 29 -6.605 13.633 8.302 246 HZ3 LYS 29 2HZ LYS 29 -7.145 15.112 7.662 247 H TRP 30 H TRP 30 -3.309 7.915 6.630 248 HA TRP 30 HA TRP 30 -5.967 6.819 7.422 249 HB2 TRP 30 2HB TRP 30 -6.409 6.139 5.117 250 HB3 TRP 30 1HB TRP 30 -6.186 7.884 5.192 251 HD1 TRP 30 HD TRP 30 -3.859 8.862 4.222 252 HE1 TRP 30 1HE TRP 30 -2.215 7.914 2.466 253 HE3 TRP 30 3HE TRP 30 -5.415 3.996 4.082 254 HZ2 TRP 30 2HZ TRP 30 -1.642 5.424 1.181 255 HZ3 TRP 30 3HZ TRP 30 -4.308 2.374 2.601 256 HH2 TRP 30 HH TRP 30 -2.433 3.069 1.153 257 H CYS 31 H CYS 31 -2.960 6.179 8.061 258 HA CYS 31 HA CYS 31 -2.268 3.769 6.844 259 HB2 CYS 31 2HB CYS 31 -0.772 5.080 8.319 260 HB3 CYS 31 1HB CYS 31 -1.732 4.606 9.713 261 HG CYS 31 HG CYS 31 -0.261 2.485 7.941 262 H GLN 32 H GLN 32 -2.893 1.708 7.072 263 HA GLN 32 HA GLN 32 -3.991 -0.160 7.741 264 HB2 GLN 32 2HB GLN 32 -3.098 0.574 10.069 265 HB3 GLN 32 1HB GLN 32 -4.717 1.190 10.369 266 HG2 GLN 32 2HG GLN 32 -4.653 -1.045 11.284 267 HG3 GLN 32 1HG GLN 32 -5.612 -1.132 9.809 268 HE21 GLN 32 1HE2 GLN 32 -5.128 -3.222 9.028 269 HE22 GLN 32 2HE2 GLN 32 -3.553 -3.788 8.741 270 H ALA 33 H ALA 33 -5.584 2.908 8.285 271 HA ALA 33 HA ALA 33 -7.712 3.659 7.915 272 HB1 ALA 33 1HB ALA 33 -7.141 2.954 5.612 273 HB2 ALA 33 2HB ALA 33 -8.857 2.727 5.954 274 HB3 ALA 33 3HB ALA 33 -7.768 1.342 5.956 275 H SER 34 H SER 34 -7.265 1.793 10.040 276 HA SER 34 HA SER 34 -9.918 0.465 10.311 277 HB2 SER 34 2HB SER 34 -8.088 -1.131 10.124 278 HB3 SER 34 1HB SER 34 -7.258 -0.342 11.457 279 HG SER 34 HG SER 34 -9.260 -0.769 12.666 280 HA PRO 35 HA PRO 35 -9.989 3.673 13.675 281 HB2 PRO 35 2HB PRO 35 -12.467 2.071 14.401 282 HB3 PRO 35 1HB PRO 35 -12.262 3.840 14.332 283 HG2 PRO 35 2HG PRO 35 -13.525 2.633 12.360 284 HG3 PRO 35 1HG PRO 35 -12.296 3.859 11.972 285 HD2 PRO 35 2HD PRO 35 -12.011 0.838 11.876 286 HD3 PRO 35 1HD PRO 35 -11.488 2.066 10.694 287 H GLU 36 H GLU 36 -10.084 0.219 13.917 288 HA GLU 36 HA GLU 36 -9.719 0.047 16.798 289 HB2 GLU 36 2HB GLU 36 -9.575 -1.974 14.540 290 HB3 GLU 36 1HB GLU 36 -9.363 -2.405 16.241 291 HG2 GLU 36 2HG GLU 36 -11.620 -1.510 16.735 292 HG3 GLU 36 1HG GLU 36 -11.824 -1.091 15.037 293 H TRP 37 H TRP 37 -7.739 1.376 14.731 294 HA TRP 37 HA TRP 37 -5.312 0.526 16.155 295 HB2 TRP 37 2HB TRP 37 -5.636 0.291 13.143 296 HB3 TRP 37 1HB TRP 37 -4.070 0.292 13.943 297 HD1 TRP 37 HD TRP 37 -7.255 -1.830 13.628 298 HE1 TRP 37 1HE TRP 37 -6.705 -4.229 14.395 299 HE3 TRP 37 3HE TRP 37 -2.521 -1.116 15.367 300 HZ2 TRP 37 2HZ TRP 37 -4.530 -5.650 15.601 301 HZ3 TRP 37 3HZ TRP 37 -1.228 -3.000 16.320 302 HH2 TRP 37 HH TRP 37 -2.226 -5.267 16.439 303 H HIS 38 H HIS 38 -3.528 1.950 15.828 304 HA HIS 38 HA HIS 38 -4.127 4.589 14.631 305 HB2 HIS 38 2HB HIS 38 -4.726 4.653 17.075 306 HB3 HIS 38 1HB HIS 38 -3.062 4.220 17.463 307 HD2 HIS 38 2HD HIS 38 -4.922 7.232 15.630 308 HE1 HIS 38 1HE HIS 38 -1.219 8.601 17.124 309 HE2 HIS 38 2HE HIS 38 -3.359 9.299 15.948 310 H VAL 39 H VAL 39 -2.170 5.903 14.456 311 HA VAL 39 HA VAL 39 0.335 4.321 14.138 312 HB VAL 39 HB VAL 39 -0.706 4.626 11.979 313 HG11 VAL 39 1HG1 VAL 39 -1.551 6.636 11.101 314 HG12 VAL 39 2HG1 VAL 39 -0.578 7.659 12.142 315 HG13 VAL 39 3HG1 VAL 39 -1.986 6.831 12.792 316 HG21 VAL 39 3HG2 VAL 39 1.791 4.869 12.177 317 HG22 VAL 39 1HG2 VAL 39 1.584 6.620 12.254 318 HG23 VAL 39 2HG2 VAL 39 1.120 5.741 10.801 319 HA PRO 40 HA PRO 40 1.171 8.088 16.733 320 HB2 PRO 40 2HB PRO 40 3.048 7.083 18.434 321 HB3 PRO 40 1HB PRO 40 1.321 6.703 18.628 322 HG2 PRO 40 2HG PRO 40 3.471 5.046 17.317 323 HG3 PRO 40 1HG PRO 40 2.234 4.536 18.489 324 HD2 PRO 40 2HD PRO 40 1.940 4.157 15.787 325 HD3 PRO 40 1HD PRO 40 0.540 4.422 16.848 326 H ALA 41 H ALA 41 3.113 6.228 14.617 327 HA ALA 41 HA ALA 41 4.617 8.495 13.764 328 HB1 ALA 41 1HB ALA 41 5.913 8.018 15.806 329 HB2 ALA 41 2HB ALA 41 6.869 7.696 14.361 330 HB3 ALA 41 3HB ALA 41 6.158 6.358 15.267 331 H ALA 42 H ALA 42 5.884 8.047 11.907 332 HA ALA 42 HA ALA 42 6.034 5.383 10.795 333 HB1 ALA 42 1HB ALA 42 4.642 5.840 8.818 334 HB2 ALA 42 2HB ALA 42 4.199 7.413 9.486 335 HB3 ALA 42 3HB ALA 42 3.680 5.934 10.293 336 H GLN 43 H GLN 43 7.507 5.256 9.120 337 HA GLN 43 HA GLN 43 8.696 7.752 8.041 338 HB2 GLN 43 2HB GLN 43 10.305 5.467 9.256 339 HB3 GLN 43 1HB GLN 43 10.966 6.897 8.466 340 HG2 GLN 43 2HG GLN 43 9.300 6.907 11.005 341 HG3 GLN 43 1HG GLN 43 11.047 7.098 10.930 342 HE21 GLN 43 1HE2 GLN 43 11.383 8.887 8.814 343 HE22 GLN 43 2HE2 GLN 43 10.610 10.354 9.173 344 H ASN 44 H ASN 44 9.803 7.459 6.081 345 HA ASN 44 HA ASN 44 9.889 4.865 4.773 346 HB2 ASN 44 2HB ASN 44 7.500 5.558 4.476 347 HB3 ASN 44 1HB ASN 44 8.051 7.020 3.664 348 HD21 ASN 44 1HD2 ASN 44 6.977 6.309 1.661 349 HD22 ASN 44 2HD2 ASN 44 7.660 5.082 0.708 350 H ASP 45 H ASP 45 11.995 5.111 4.219 351 HA ASP 45 HA ASP 45 12.969 7.607 2.964 352 HB2 ASP 45 2HB ASP 45 14.425 5.067 3.772 353 HB3 ASP 45 1HB ASP 45 15.181 6.539 3.169 354 H LEU 46 H LEU 46 11.763 7.379 0.972 355 HA LEU 46 HA LEU 46 11.891 5.066 -0.666 356 HB2 LEU 46 2HB LEU 46 10.221 6.987 -0.830 357 HB3 LEU 46 1HB LEU 46 11.496 7.942 -1.574 358 HG LEU 46 HG LEU 46 11.662 5.851 -3.264 359 HD11 LEU 46 1HD1 LEU 46 8.785 5.632 -2.300 360 HD12 LEU 46 2HD1 LEU 46 10.037 4.418 -2.038 361 HD13 LEU 46 3HD1 LEU 46 9.483 4.771 -3.672 362 HD21 LEU 46 3HD2 LEU 46 9.376 7.846 -3.395 363 HD22 LEU 46 1HD2 LEU 46 10.006 6.924 -4.762 364 HD23 LEU 46 2HD2 LEU 46 11.022 8.121 -3.964 365 H LYS 47 H LYS 47 14.036 4.351 -0.840 366 HA LYS 47 HA LYS 47 15.588 5.473 -2.959 367 HB2 LYS 47 2HB LYS 47 16.168 7.065 -1.120 368 HB3 LYS 47 1HB LYS 47 16.757 5.717 -0.159 369 HG2 LYS 47 2HG LYS 47 18.485 5.214 -1.809 370 HG3 LYS 47 1HG LYS 47 17.847 6.421 -2.923 371 HD2 LYS 47 2HD LYS 47 18.717 7.300 -0.136 372 HD3 LYS 47 1HD LYS 47 19.942 7.017 -1.366 373 HE2 LYS 47 2HE LYS 47 17.594 8.920 -1.697 374 HE3 LYS 47 1HE LYS 47 19.239 9.398 -1.289 375 HZ1 LYS 47 3HZ LYS 47 19.225 7.683 -3.544 376 HZ2 LYS 47 1HZ LYS 47 19.827 9.262 -3.404 377 HZ3 LYS 47 2HZ LYS 47 18.196 9.010 -3.811 378 H ALA 48 H ALA 48 17.196 4.033 -3.655 379 HA ALA 48 HA ALA 48 16.834 1.303 -3.038 380 HB1 ALA 48 1HB ALA 48 19.209 2.668 -4.346 381 HB2 ALA 48 2HB ALA 48 17.767 2.094 -5.179 382 HB3 ALA 48 3HB ALA 48 18.853 0.942 -4.408 383 H GLY 49 H GLY 49 17.833 -0.052 -1.595 384 HA2 GLY 49 2HA GLY 49 19.201 -0.783 0.106 385 HA3 GLY 49 1HA GLY 49 20.332 0.505 -0.307 386 H GLY 50 H GLY 50 17.438 1.994 0.079 387 HA2 GLY 50 2HA GLY 50 18.128 3.164 2.628 388 HA3 GLY 50 1HA GLY 50 16.678 3.485 1.677 389 H THR 51 H THR 51 16.810 3.084 4.544 390 HA THR 51 HA THR 51 15.238 0.563 4.898 391 HB THR 51 HB THR 51 16.805 2.117 6.985 392 HG1 THR 51 1HG THR 51 18.363 1.191 5.883 393 HG21 THR 51 3HG2 THR 51 16.498 0.026 8.314 394 HG22 THR 51 1HG2 THR 51 15.450 -0.600 7.046 395 HG23 THR 51 2HG2 THR 51 14.970 0.827 7.968 396 H PHE 52 H PHE 52 13.415 0.659 6.223 397 HA PHE 52 HA PHE 52 12.296 3.327 6.914 398 HB2 PHE 52 2HB PHE 52 10.144 2.713 5.941 399 HB3 PHE 52 1HB PHE 52 11.391 2.626 4.698 400 HD1 PHE 52 1HD PHE 52 12.198 0.419 3.861 401 HD2 PHE 52 2HD PHE 52 9.062 0.664 6.797 402 HE1 PHE 52 1HE PHE 52 11.634 -1.959 3.469 403 HE2 PHE 52 2HE PHE 52 8.498 -1.723 6.395 404 HZ PHE 52 HZ PHE 52 9.789 -3.029 4.728 405 H THR 53 H THR 53 10.511 3.202 8.436 406 HA THR 53 HA THR 53 10.125 0.692 9.903 407 HB THR 53 HB THR 53 11.218 3.167 11.297 408 HG1 THR 53 1HG THR 53 12.670 0.873 11.393 409 HG21 THR 53 3HG2 THR 53 9.740 1.812 12.729 410 HG22 THR 53 1HG2 THR 53 11.418 1.617 13.230 411 HG23 THR 53 2HG2 THR 53 10.628 0.354 12.287 412 H THR 54 H THR 54 7.983 0.571 10.071 413 HA THR 54 HA THR 54 6.346 3.033 10.445 414 HB THR 54 HB THR 54 5.493 0.295 9.430 415 HG1 THR 54 1HG THR 54 6.681 2.445 8.234 416 HG21 THR 54 3HG2 THR 54 3.478 1.541 8.676 417 HG22 THR 54 1HG2 THR 54 4.096 2.995 9.456 418 HG23 THR 54 2HG2 THR 54 3.649 1.593 10.427 419 H THR 55 H THR 55 5.853 3.325 12.554 420 HA THR 55 HA THR 55 5.630 1.018 14.388 421 HB THR 55 HB THR 55 5.508 4.009 14.959 422 HG1 THR 55 1HG THR 55 7.678 2.237 15.344 423 HG21 THR 55 3HG2 THR 55 4.525 2.649 16.756 424 HG22 THR 55 1HG2 THR 55 6.092 3.272 17.269 425 HG23 THR 55 2HG2 THR 55 5.937 1.594 16.757 426 H MET 56 H MET 56 3.664 0.156 14.784 427 HA MET 56 HA MET 56 1.258 1.881 14.849 428 HB2 MET 56 2HB MET 56 0.033 0.076 13.539 429 HB3 MET 56 1HB MET 56 1.199 1.000 12.598 430 HG2 MET 56 2HG MET 56 2.858 -0.791 12.803 431 HG3 MET 56 1HG MET 56 1.789 -1.702 13.862 432 HE1 MET 56 3HE MET 56 1.540 -1.225 9.315 433 HE2 MET 56 1HE MET 56 2.938 -0.984 10.369 434 HE3 MET 56 2HE MET 56 1.627 0.192 10.352 435 H ALA 57 H ALA 57 -0.223 1.251 16.341 436 HA ALA 57 HA ALA 57 0.016 -1.348 17.712 437 HB1 ALA 57 1HB ALA 57 0.207 1.312 19.160 438 HB2 ALA 57 2HB ALA 57 1.522 0.156 18.959 439 HB3 ALA 57 3HB ALA 57 0.111 -0.276 19.925 440 H ALA 58 H ALA 58 -1.828 -1.957 18.815 441 HA ALA 58 HA ALA 58 -4.309 -1.005 17.779 442 HB1 ALA 58 1HB ALA 58 -3.775 -2.752 20.196 443 HB2 ALA 58 2HB ALA 58 -3.998 -3.322 18.541 444 HB3 ALA 58 3HB ALA 58 -5.334 -2.549 19.395 445 H LYS 59 H LYS 59 -5.956 0.196 18.835 446 HA LYS 59 HA LYS 59 -5.155 2.418 20.274 447 HB2 LYS 59 2HB LYS 59 -7.302 2.010 18.959 448 HB3 LYS 59 1HB LYS 59 -7.936 1.179 20.376 449 HG2 LYS 59 2HG LYS 59 -7.440 3.280 21.714 450 HG3 LYS 59 1HG LYS 59 -7.035 4.080 20.200 451 HD2 LYS 59 2HD LYS 59 -9.730 2.801 20.822 452 HD3 LYS 59 1HD LYS 59 -9.391 4.523 20.945 453 HE2 LYS 59 2HE LYS 59 -8.701 4.405 18.442 454 HE3 LYS 59 1HE LYS 59 -9.494 2.830 18.427 455 HZ1 LYS 59 3HZ LYS 59 -11.303 4.028 17.991 456 HZ2 LYS 59 1HZ LYS 59 -10.636 5.471 18.583 457 HZ3 LYS 59 2HZ LYS 59 -11.316 4.346 19.660 458 H ASP 60 H ASP 60 -6.362 -0.701 21.420 459 HA ASP 60 HA ASP 60 -6.433 0.068 24.225 460 HB2 ASP 60 2HB ASP 60 -6.605 -2.644 22.870 461 HB3 ASP 60 1HB ASP 60 -6.915 -2.338 24.579 462 H GLY 61 H GLY 61 -3.995 -0.687 22.028 463 HA2 GLY 61 2HA GLY 61 -1.758 -1.147 22.250 464 HA3 GLY 61 1HA GLY 61 -1.925 -0.663 23.934 465 H SER 62 H SER 62 -3.918 -3.245 22.764 466 HA SER 62 HA SER 62 -2.705 -5.140 24.615 467 HB2 SER 62 2HB SER 62 -4.559 -6.586 23.967 468 HB3 SER 62 1HB SER 62 -5.161 -4.965 24.303 469 HG SER 62 HG SER 62 -5.455 -4.620 22.183 470 H MET 63 H MET 63 -2.179 -4.258 21.382 471 HA MET 63 HA MET 63 -0.293 -6.399 20.959 472 HB2 MET 63 2HB MET 63 -2.432 -7.563 20.432 473 HB3 MET 63 1HB MET 63 -2.778 -6.345 19.204 474 HG2 MET 63 2HG MET 63 -0.818 -7.018 17.910 475 HG3 MET 63 1HG MET 63 -0.286 -8.100 19.195 476 HE1 MET 63 3HE MET 63 -3.616 -8.763 16.122 477 HE2 MET 63 1HE MET 63 -2.215 -7.690 16.006 478 HE3 MET 63 2HE MET 63 -3.546 -7.296 17.091 479 H SER 64 H SER 64 1.298 -5.654 19.686 480 HA SER 64 HA SER 64 0.784 -3.649 17.583 481 HB2 SER 64 2HB SER 64 2.500 -2.140 18.400 482 HB3 SER 64 1HB SER 64 1.342 -2.402 19.703 483 HG SER 64 HG SER 64 3.813 -3.758 19.334 484 H PHE 65 H PHE 65 2.712 -3.320 16.212 485 HA PHE 65 HA PHE 65 4.861 -5.289 16.335 486 HB2 PHE 65 2HB PHE 65 2.791 -5.373 14.102 487 HB3 PHE 65 1HB PHE 65 4.354 -6.182 14.030 488 HD1 PHE 65 1HD PHE 65 4.968 -7.734 16.057 489 HD2 PHE 65 2HD PHE 65 0.929 -6.625 15.041 490 HE1 PHE 65 1HE PHE 65 4.108 -9.703 17.286 491 HE2 PHE 65 2HE PHE 65 0.087 -8.601 16.275 492 HZ PHE 65 HZ PHE 65 1.672 -10.135 17.397 493 H ASP 66 H ASP 66 6.632 -4.659 15.179 494 HA ASP 66 HA ASP 66 6.548 -1.982 13.868 495 HB2 ASP 66 2HB ASP 66 8.956 -1.893 14.427 496 HB3 ASP 66 1HB ASP 66 7.963 -2.112 15.865 497 H PHE 67 H PHE 67 6.543 -2.118 11.696 498 HA PHE 67 HA PHE 67 7.759 -4.432 10.302 499 HB2 PHE 67 2HB PHE 67 5.968 -2.131 9.422 500 HB3 PHE 67 1HB PHE 67 6.661 -3.283 8.280 501 HD1 PHE 67 1HD PHE 67 4.310 -2.890 11.134 502 HD2 PHE 67 2HD PHE 67 5.869 -5.599 8.176 503 HE1 PHE 67 1HE PHE 67 2.504 -4.503 11.657 504 HE2 PHE 67 2HE PHE 67 4.056 -7.209 8.704 505 HZ PHE 67 HZ PHE 67 2.377 -6.660 10.444 506 H GLY 68 H GLY 68 9.560 -4.283 9.077 507 HA2 GLY 68 2HA GLY 68 10.685 -1.739 8.198 508 HA3 GLY 68 1HA GLY 68 11.619 -2.581 9.436 509 H GLY 69 H GLY 69 12.492 -2.037 6.788 510 HA2 GLY 69 2HA GLY 69 13.568 -4.542 6.035 511 HA3 GLY 69 1HA GLY 69 12.225 -4.144 4.964 512 H VAL 70 H VAL 70 14.183 -4.231 3.441 513 HA VAL 70 HA VAL 70 15.294 -1.489 3.103 514 HB VAL 70 HB VAL 70 16.784 -4.095 2.623 515 HG11 VAL 70 1HG1 VAL 70 18.740 -2.549 2.293 516 HG12 VAL 70 2HG1 VAL 70 17.636 -1.178 2.398 517 HG13 VAL 70 3HG1 VAL 70 17.494 -2.325 1.067 518 HG21 VAL 70 3HG2 VAL 70 18.178 -3.367 4.548 519 HG22 VAL 70 1HG2 VAL 70 16.504 -3.628 5.031 520 HG23 VAL 70 2HG2 VAL 70 17.107 -1.989 4.795 521 H TYR 71 H TYR 71 15.211 -0.709 1.061 522 HA TYR 71 HA TYR 71 13.555 -2.088 -0.892 523 HB2 TYR 71 2HB TYR 71 15.071 0.543 -1.045 524 HB3 TYR 71 1HB TYR 71 13.911 -0.031 -2.243 525 HD1 TYR 71 1HD TYR 71 11.502 -0.472 -1.549 526 HD2 TYR 71 2HD TYR 71 14.273 1.606 1.009 527 HE1 TYR 71 1HE TYR 71 9.617 0.399 -0.202 528 HE2 TYR 71 2HE TYR 71 12.377 2.474 2.347 529 HH TYR 71 HH TYR 71 9.016 1.569 1.572 530 H ASP 72 H ASP 72 14.304 -3.501 -2.356 531 HA ASP 72 HA ASP 72 17.119 -3.971 -2.743 532 HB2 ASP 72 2HB ASP 72 15.399 -5.769 -2.864 533 HB3 ASP 72 1HB ASP 72 14.744 -5.027 -4.322 534 H GLN 73 H GLN 73 14.522 -2.390 -4.561 535 HA GLN 73 HA GLN 73 16.397 -0.754 -6.023 536 HB2 GLN 73 2HB GLN 73 16.486 -2.932 -7.287 537 HB3 GLN 73 1HB GLN 73 14.760 -2.782 -7.597 538 HG2 GLN 73 2HG GLN 73 15.959 -1.960 -9.551 539 HG3 GLN 73 1HG GLN 73 15.219 -0.579 -8.755 540 HE21 GLN 73 1HE2 GLN 73 16.749 1.048 -9.302 541 HE22 GLN 73 2HE2 GLN 73 18.387 0.977 -8.858 542 H VAL 74 H VAL 74 15.391 1.004 -7.015 543 HA VAL 74 HA VAL 74 12.461 1.177 -7.082 544 HB VAL 74 HB VAL 74 13.023 1.839 -4.779 545 HG11 VAL 74 1HG1 VAL 74 14.710 4.048 -6.021 546 HG12 VAL 74 2HG1 VAL 74 15.362 2.607 -5.242 547 HG13 VAL 74 3HG1 VAL 74 14.433 3.774 -4.304 548 HG21 VAL 74 3HG2 VAL 74 11.174 3.008 -6.077 549 HG22 VAL 74 1HG2 VAL 74 12.310 4.309 -6.424 550 HG23 VAL 74 2HG2 VAL 74 11.843 3.964 -4.764 551 H LYS 75 H LYS 75 11.754 2.497 -8.671 552 HA LYS 75 HA LYS 75 13.556 4.486 -9.916 553 HB2 LYS 75 2HB LYS 75 12.232 2.266 -11.516 554 HB3 LYS 75 1HB LYS 75 13.133 3.623 -12.181 555 HG2 LYS 75 2HG LYS 75 15.150 2.828 -10.881 556 HG3 LYS 75 1HG LYS 75 14.211 1.411 -10.400 557 HD2 LYS 75 2HD LYS 75 13.912 0.791 -12.769 558 HD3 LYS 75 1HD LYS 75 14.859 2.196 -13.257 559 HE2 LYS 75 2HE LYS 75 15.853 -0.112 -11.553 560 HE3 LYS 75 1HE LYS 75 16.274 0.184 -13.238 561 HZ1 LYS 75 3HZ LYS 75 17.207 2.334 -12.549 562 HZ2 LYS 75 1HZ LYS 75 17.999 1.026 -11.819 563 HZ3 LYS 75 2HZ LYS 75 16.884 1.947 -10.927 564 H THR 76 H THR 76 12.463 6.239 -10.641 565 HA THR 76 HA THR 76 9.877 6.772 -9.776 566 HB THR 76 HB THR 76 11.322 8.109 -12.091 567 HG1 THR 76 1HG THR 76 11.736 8.028 -9.374 568 HG21 THR 76 3HG2 THR 76 10.061 10.116 -11.323 569 HG22 THR 76 1HG2 THR 76 9.199 9.110 -10.160 570 HG23 THR 76 2HG2 THR 76 8.986 8.841 -11.891 571 H ASN 77 H ASN 77 7.901 6.279 -10.502 572 HA ASN 77 HA ASN 77 6.203 5.424 -11.766 573 HB2 ASN 77 2HB ASN 77 7.798 6.591 -14.065 574 HB3 ASN 77 1HB ASN 77 6.089 6.166 -14.094 575 HD21 ASN 77 1HD2 ASN 77 5.514 7.166 -11.376 576 HD22 ASN 77 2HD2 ASN 77 5.597 8.860 -11.463 577 H ASP 78 H ASP 78 7.426 3.342 -11.032 578 HA ASP 78 HA ASP 78 7.537 1.537 -13.338 579 HB2 ASP 78 2HB ASP 78 9.906 1.898 -11.489 580 HB3 ASP 78 1HB ASP 78 9.768 0.654 -12.726 581 H LEU 79 H LEU 79 9.024 1.033 -10.169 582 HA LEU 79 HA LEU 79 6.728 -0.208 -8.976 583 HB2 LEU 79 2HB LEU 79 7.243 -2.525 -9.138 584 HB3 LEU 79 1HB LEU 79 7.548 -1.921 -10.759 585 HG LEU 79 HG LEU 79 9.672 -2.465 -8.633 586 HD11 LEU 79 1HD1 LEU 79 8.974 -3.931 -11.188 587 HD12 LEU 79 2HD1 LEU 79 8.691 -4.506 -9.544 588 HD13 LEU 79 3HD1 LEU 79 10.341 -4.300 -10.134 589 HD21 LEU 79 3HD2 LEU 79 11.267 -2.064 -10.550 590 HD22 LEU 79 1HD2 LEU 79 10.371 -0.616 -10.098 591 HD23 LEU 79 2HD2 LEU 79 9.898 -1.531 -11.529 592 H ILE 80 H ILE 80 7.159 -1.114 -6.875 593 HA ILE 80 HA ILE 80 9.716 -0.261 -5.596 594 HB ILE 80 HB ILE 80 6.925 0.180 -4.448 595 HG12 ILE 80 2HG1 ILE 80 8.986 2.220 -5.391 596 HG13 ILE 80 1HG1 ILE 80 7.563 1.765 -6.314 597 HG21 ILE 80 1HG2 ILE 80 9.708 0.848 -3.384 598 HG22 ILE 80 2HG2 ILE 80 8.591 -0.326 -2.692 599 HG23 ILE 80 3HG2 ILE 80 8.207 1.384 -2.634 600 HD11 ILE 80 3HD1 ILE 80 7.086 3.819 -5.113 601 HD12 ILE 80 1HD1 ILE 80 7.597 3.096 -3.589 602 HD13 ILE 80 2HD1 ILE 80 6.136 2.519 -4.393 603 H GLU 81 H GLU 81 10.589 -1.851 -4.367 604 HA GLU 81 HA GLU 81 8.884 -3.950 -3.191 605 HB2 GLU 81 2HB GLU 81 10.384 -5.732 -4.102 606 HB3 GLU 81 1HB GLU 81 9.468 -4.906 -5.361 607 HG2 GLU 81 2HG GLU 81 11.421 -3.483 -5.864 608 HG3 GLU 81 1HG GLU 81 12.351 -4.303 -4.613 609 H TYR 82 H TYR 82 9.945 -5.109 -1.525 610 HA TYR 82 HA TYR 82 12.614 -4.359 -0.651 611 HB2 TYR 82 2HB TYR 82 11.810 -3.446 1.540 612 HB3 TYR 82 1HB TYR 82 11.399 -2.417 0.172 613 HD1 TYR 82 1HD TYR 82 9.078 -2.237 -0.655 614 HD2 TYR 82 2HD TYR 82 10.038 -4.732 2.719 615 HE1 TYR 82 1HE TYR 82 6.674 -2.394 -0.084 616 HE2 TYR 82 2HE TYR 82 7.628 -4.878 3.280 617 HH TYR 82 HH TYR 82 5.484 -4.623 2.263 618 H THR 83 H THR 83 13.331 -5.615 1.156 619 HA THR 83 HA THR 83 11.938 -8.219 1.377 620 HB THR 83 HB THR 83 14.751 -7.407 2.207 621 HG1 THR 83 1HG THR 83 13.612 -8.351 -0.163 622 HG21 THR 83 3HG2 THR 83 13.964 -9.396 3.413 623 HG22 THR 83 1HG2 THR 83 15.129 -9.876 2.180 624 HG23 THR 83 2HG2 THR 83 13.407 -10.119 1.902 625 H ILE 84 H ILE 84 11.026 -8.872 3.243 626 HA ILE 84 HA ILE 84 11.077 -7.084 5.609 627 HB ILE 84 HB ILE 84 9.247 -9.418 4.914 628 HG12 ILE 84 2HG1 ILE 84 8.663 -6.419 4.873 629 HG13 ILE 84 1HG1 ILE 84 9.057 -7.341 3.427 630 HG21 ILE 84 1HG2 ILE 84 9.167 -7.360 7.167 631 HG22 ILE 84 2HG2 ILE 84 9.389 -9.097 7.346 632 HG23 ILE 84 3HG2 ILE 84 7.848 -8.469 6.798 633 HD11 ILE 84 3HD1 ILE 84 6.707 -7.945 5.254 634 HD12 ILE 84 1HD1 ILE 84 7.094 -8.756 3.737 635 HD13 ILE 84 2HD1 ILE 84 6.606 -7.063 3.735 636 H GLY 85 H GLY 85 11.513 -7.928 7.688 637 HA2 GLY 85 2HA GLY 85 13.708 -9.612 7.938 638 HA3 GLY 85 1HA GLY 85 12.601 -9.221 9.248 639 H ASP 86 H ASP 86 10.241 -10.444 8.204 640 HA ASP 86 HA ASP 86 10.532 -13.084 9.089 641 HB2 ASP 86 2HB ASP 86 8.402 -11.792 7.349 642 HB3 ASP 86 1HB ASP 86 8.234 -13.368 8.122 643 H GLY 87 H GLY 87 11.308 -11.625 6.105 644 HA2 GLY 87 2HA GLY 87 12.566 -12.650 4.394 645 HA3 GLY 87 1HA GLY 87 11.983 -14.234 4.893 646 H ARG 88 H ARG 88 9.357 -12.224 4.912 647 HA ARG 88 HA ARG 88 8.222 -13.377 2.511 648 HB2 ARG 88 2HB ARG 88 7.238 -11.157 4.346 649 HB3 ARG 88 1HB ARG 88 6.288 -11.865 3.037 650 HG2 ARG 88 2HG ARG 88 6.448 -14.082 4.108 651 HG3 ARG 88 1HG ARG 88 7.404 -13.387 5.417 652 HD2 ARG 88 2HD ARG 88 5.515 -11.904 6.010 653 HD3 ARG 88 1HD ARG 88 4.557 -12.607 4.707 654 HE ARG 88 HE ARG 88 5.455 -14.700 6.359 655 HH11 ARG 88 1HH2 ARG 88 3.342 -11.940 6.458 656 HH12 ARG 88 2HH2 ARG 88 2.286 -12.631 7.645 657 HH21 ARG 88 1HH1 ARG 88 4.068 -15.590 7.908 658 HH22 ARG 88 2HH1 ARG 88 2.696 -14.691 8.463 659 H LYS 89 H LYS 89 8.081 -12.465 0.496 660 HA LYS 89 HA LYS 89 9.521 -9.911 0.030 661 HB2 LYS 89 2HB LYS 89 10.188 -12.001 -1.223 662 HB3 LYS 89 1HB LYS 89 8.609 -11.984 -2.007 663 HG2 LYS 89 2HG LYS 89 9.080 -9.750 -2.949 664 HG3 LYS 89 1HG LYS 89 10.637 -9.714 -2.123 665 HD2 LYS 89 2HD LYS 89 11.342 -11.711 -3.403 666 HD3 LYS 89 1HD LYS 89 9.789 -11.715 -4.236 667 HE2 LYS 89 2HE LYS 89 11.492 -10.621 -5.633 668 HE3 LYS 89 1HE LYS 89 10.282 -9.442 -5.125 669 HZ1 LYS 89 3HZ LYS 89 11.737 -8.687 -3.395 670 HZ2 LYS 89 1HZ LYS 89 12.580 -8.646 -4.867 671 HZ3 LYS 89 2HZ LYS 89 12.876 -9.896 -3.754 672 H VAL 90 H VAL 90 8.607 -8.311 -1.281 673 HA VAL 90 HA VAL 90 5.697 -8.426 -1.844 674 HB VAL 90 HB VAL 90 7.022 -6.125 -0.343 675 HG11 VAL 90 1HG1 VAL 90 4.128 -6.669 -1.133 676 HG12 VAL 90 2HG1 VAL 90 5.158 -5.388 -1.771 677 HG13 VAL 90 3HG1 VAL 90 4.651 -5.350 -0.086 678 HG21 VAL 90 3HG2 VAL 90 6.832 -8.030 1.167 679 HG22 VAL 90 1HG2 VAL 90 5.185 -8.357 0.629 680 HG23 VAL 90 2HG2 VAL 90 5.537 -6.901 1.556 681 H ARG 91 H ARG 91 5.166 -7.418 -3.700 682 HA ARG 91 HA ARG 91 7.151 -5.662 -5.077 683 HB2 ARG 91 2HB ARG 91 5.540 -7.922 -6.319 684 HB3 ARG 91 1HB ARG 91 6.580 -6.795 -7.192 685 HG2 ARG 91 2HG ARG 91 8.536 -7.593 -5.919 686 HG3 ARG 91 1HG ARG 91 7.504 -8.710 -5.022 687 HD2 ARG 91 2HD ARG 91 8.605 -9.926 -6.838 688 HD3 ARG 91 1HD ARG 91 6.882 -9.811 -7.190 689 HE ARG 91 HE ARG 91 8.217 -7.604 -8.351 690 HH11 ARG 91 1HH2 ARG 91 7.945 -11.055 -8.672 691 HH12 ARG 91 2HH2 ARG 91 8.240 -11.044 -10.379 692 HH21 ARG 91 1HH1 ARG 91 8.599 -7.605 -10.573 693 HH22 ARG 91 2HH1 ARG 91 8.608 -9.097 -11.453 694 H ILE 92 H ILE 92 6.249 -3.803 -5.744 695 HA ILE 92 HA ILE 92 3.276 -3.625 -6.105 696 HB ILE 92 HB ILE 92 5.158 -1.508 -4.969 697 HG12 ILE 92 2HG1 ILE 92 2.965 -3.088 -3.540 698 HG13 ILE 92 1HG1 ILE 92 4.678 -3.469 -3.412 699 HG21 ILE 92 1HG2 ILE 92 2.134 -1.547 -5.335 700 HG22 ILE 92 2HG2 ILE 92 3.261 -0.538 -6.231 701 HG23 ILE 92 3HG2 ILE 92 3.026 -0.271 -4.513 702 HD11 ILE 92 3HD1 ILE 92 3.354 -0.877 -2.564 703 HD12 ILE 92 1HD1 ILE 92 5.094 -1.167 -2.534 704 HD13 ILE 92 2HD1 ILE 92 4.022 -2.115 -1.501 705 H VAL 93 H VAL 93 2.973 -3.426 -8.254 706 HA VAL 93 HA VAL 93 4.901 -1.842 -9.899 707 HB VAL 93 HB VAL 93 2.867 -3.918 -10.821 708 HG11 VAL 93 1HG1 VAL 93 4.183 -3.858 -12.918 709 HG12 VAL 93 2HG1 VAL 93 5.226 -2.611 -12.233 710 HG13 VAL 93 3HG1 VAL 93 3.531 -2.264 -12.551 711 HG21 VAL 93 3HG2 VAL 93 5.860 -4.188 -10.346 712 HG22 VAL 93 1HG2 VAL 93 4.836 -5.411 -11.097 713 HG23 VAL 93 2HG2 VAL 93 4.590 -4.977 -9.410 714 H PHE 94 H PHE 94 4.209 0.031 -10.731 715 HA PHE 94 HA PHE 94 1.340 0.796 -10.500 716 HB2 PHE 94 2HB PHE 94 3.856 2.448 -10.951 717 HB3 PHE 94 1HB PHE 94 2.222 3.104 -10.847 718 HD1 PHE 94 2HD PHE 94 0.955 3.049 -8.707 719 HD2 PHE 94 1HD PHE 94 4.995 1.589 -8.935 720 HE1 PHE 94 2HE PHE 94 1.101 3.050 -6.232 721 HE2 PHE 94 1HE PHE 94 5.126 1.590 -6.463 722 HZ PHE 94 HZ PHE 94 3.188 2.319 -5.117 723 H THR 95 H THR 95 0.121 0.884 -12.252 724 HA THR 95 HA THR 95 1.315 1.228 -14.958 725 HB THR 95 HB THR 95 -0.339 -0.448 -15.785 726 HG1 THR 95 1HG THR 95 -0.825 -1.703 -13.512 727 HG21 THR 95 3HG2 THR 95 1.986 -1.146 -15.226 728 HG22 THR 95 1HG2 THR 95 0.821 -2.442 -14.950 729 HG23 THR 95 2HG2 THR 95 1.452 -1.519 -13.588 730 H HIS 96 H HIS 96 -0.075 2.215 -16.451 731 HA HIS 96 HA HIS 96 -2.673 3.260 -15.605 732 HB2 HIS 96 2HB HIS 96 -2.013 5.616 -15.980 733 HB3 HIS 96 1HB HIS 96 -1.124 4.906 -14.635 734 HD2 HIS 96 2HD HIS 96 -0.396 6.577 -18.035 735 HE1 HIS 96 1HE HIS 96 3.246 4.901 -16.711 736 HE2 HIS 96 2HE HIS 96 2.181 6.437 -18.431 737 H THR 97 H THR 97 -3.686 4.526 -17.391 738 HA THR 97 HA THR 97 -2.648 3.852 -20.106 739 HB THR 97 HB THR 97 -4.237 2.084 -19.657 740 HG1 THR 97 1HG THR 97 -5.479 2.447 -21.364 741 HG21 THR 97 3HG2 THR 97 -6.556 2.578 -18.948 742 HG22 THR 97 1HG2 THR 97 -6.142 4.282 -18.780 743 HG23 THR 97 2HG2 THR 97 -5.391 3.084 -17.726 744 H GLY 98 H GLY 98 -4.006 6.054 -17.941 745 HA2 GLY 98 2HA GLY 98 -3.814 8.247 -19.650 746 HA3 GLY 98 1HA GLY 98 -5.495 7.718 -19.701 747 H ASP 99 H ASP 99 -6.679 8.992 -18.428 748 HA ASP 99 HA ASP 99 -5.614 10.426 -16.164 749 HB2 ASP 99 2HB ASP 99 -7.953 11.205 -15.897 750 HB3 ASP 99 1HB ASP 99 -7.387 11.386 -17.555 751 H THR 100 H THR 100 -6.153 7.243 -16.410 752 HA THR 100 HA THR 100 -7.129 6.928 -13.619 753 HB THR 100 HB THR 100 -7.582 5.024 -15.938 754 HG1 THR 100 1HG THR 100 -9.445 5.965 -16.198 755 HG21 THR 100 3HG2 THR 100 -9.157 3.941 -14.335 756 HG22 THR 100 1HG2 THR 100 -8.609 5.044 -13.075 757 HG23 THR 100 2HG2 THR 100 -7.491 3.870 -13.771 758 H THR 101 H THR 101 -5.753 5.914 -12.259 759 HA THR 101 HA THR 101 -3.356 4.550 -13.474 760 HB THR 101 HB THR 101 -3.698 5.678 -10.675 761 HG1 THR 101 1HG THR 101 -3.452 7.022 -12.780 762 HG21 THR 101 3HG2 THR 101 -1.219 5.388 -10.593 763 HG22 THR 101 1HG2 THR 101 -1.292 4.550 -12.141 764 HG23 THR 101 2HG2 THR 101 -2.068 3.851 -10.720 765 H ASN 102 H ASN 102 -3.003 2.434 -13.056 766 HA ASN 102 HA ASN 102 -4.942 0.984 -11.314 767 HB2 ASN 102 2HB ASN 102 -5.028 0.397 -13.722 768 HB3 ASN 102 1HB ASN 102 -3.327 -0.043 -13.669 769 HD21 ASN 102 1HD2 ASN 102 -6.355 -0.794 -11.831 770 HD22 ASN 102 2HD2 ASN 102 -6.010 -2.449 -11.663 771 H ILE 103 H ILE 103 -4.029 0.606 -9.380 772 HA ILE 103 HA ILE 103 -1.101 0.148 -9.137 773 HB ILE 103 HB ILE 103 -3.238 0.266 -6.958 774 HG12 ILE 103 2HG1 ILE 103 -1.298 2.459 -7.837 775 HG13 ILE 103 1HG1 ILE 103 -3.002 2.422 -8.279 776 HG21 ILE 103 1HG2 ILE 103 -0.192 0.435 -6.848 777 HG22 ILE 103 2HG2 ILE 103 -1.167 -0.911 -6.266 778 HG23 ILE 103 3HG2 ILE 103 -1.257 0.646 -5.462 779 HD11 ILE 103 3HD1 ILE 103 -3.578 2.396 -5.822 780 HD12 ILE 103 1HD1 ILE 103 -2.764 3.867 -6.353 781 HD13 ILE 103 2HD1 ILE 103 -1.863 2.633 -5.475 782 H VAL 104 H VAL 104 -0.328 -1.905 -9.190 783 HA VAL 104 HA VAL 104 -2.087 -4.181 -8.361 784 HB VAL 104 HB VAL 104 0.010 -4.185 -10.567 785 HG11 VAL 104 1HG1 VAL 104 -1.989 -6.285 -9.635 786 HG12 VAL 104 2HG1 VAL 104 -0.233 -6.388 -9.498 787 HG13 VAL 104 3HG1 VAL 104 -0.994 -6.427 -11.083 788 HG21 VAL 104 3HG2 VAL 104 -3.029 -4.193 -10.726 789 HG22 VAL 104 1HG2 VAL 104 -1.939 -4.386 -12.098 790 HG23 VAL 104 2HG2 VAL 104 -1.976 -2.865 -11.211 791 H GLU 105 H GLU 105 -1.277 -5.323 -6.726 792 HA GLU 105 HA GLU 105 1.640 -5.563 -6.306 793 HB2 GLU 105 2HB GLU 105 1.359 -5.056 -3.883 794 HB3 GLU 105 1HB GLU 105 1.001 -3.667 -4.904 795 HG2 GLU 105 2HG GLU 105 -1.424 -4.161 -4.725 796 HG3 GLU 105 1HG GLU 105 -1.068 -5.528 -3.674 797 H SER 106 H SER 106 2.255 -7.466 -5.380 798 HA SER 106 HA SER 106 0.144 -9.414 -4.576 799 HB2 SER 106 2HB SER 106 2.594 -9.977 -6.271 800 HB3 SER 106 1HB SER 106 1.446 -11.183 -5.691 801 HG SER 106 HG SER 106 0.056 -10.558 -7.156 802 H PHE 107 H PHE 107 0.664 -10.799 -2.920 803 HA PHE 107 HA PHE 107 3.181 -10.238 -1.407 804 HB2 PHE 107 2HB PHE 107 0.446 -11.074 -0.370 805 HB3 PHE 107 1HB PHE 107 1.881 -10.767 0.609 806 HD1 PHE 107 2HD PHE 107 2.766 -8.454 0.873 807 HD2 PHE 107 1HD PHE 107 -0.807 -9.214 -1.394 808 HE1 PHE 107 2HE PHE 107 2.222 -6.036 0.917 809 HE2 PHE 107 1HE PHE 107 -1.347 -6.794 -1.343 810 HZ PHE 107 HZ PHE 107 0.167 -5.208 -0.189 811 H ASP 108 H ASP 108 3.837 -12.067 -0.020 812 HA ASP 108 HA ASP 108 3.270 -14.747 -1.198 813 HB2 ASP 108 2HB ASP 108 5.942 -13.641 -0.305 814 HB3 ASP 108 1HB ASP 108 5.644 -15.274 -0.898 815 HA PRO 109 HA PRO 109 2.796 -14.774 3.458 816 HB2 PRO 109 2HB PRO 109 0.360 -15.972 3.671 817 HB3 PRO 109 1HB PRO 109 0.504 -14.240 3.278 818 HG2 PRO 109 2HG PRO 109 0.085 -16.567 1.406 819 HG3 PRO 109 1HG PRO 109 -0.789 -15.020 1.467 820 HD2 PRO 109 2HD PRO 109 1.246 -15.456 -0.309 821 HD3 PRO 109 1HD PRO 109 0.951 -13.844 0.377 822 H GLU 110 H GLU 110 2.689 -16.618 4.937 823 HA GLU 110 HA GLU 110 4.184 -18.870 3.981 824 HB2 GLU 110 2HB GLU 110 2.760 -18.415 6.624 825 HB3 GLU 110 1HB GLU 110 3.906 -19.713 6.301 826 HG2 GLU 110 2HG GLU 110 5.664 -18.052 5.816 827 HG3 GLU 110 1HG GLU 110 4.524 -16.746 6.125 828 H GLU 111 H GLU 111 3.387 -21.104 4.679 829 HA GLU 111 HA GLU 111 0.898 -21.668 3.219 830 HB2 GLU 111 2HB GLU 111 3.025 -23.001 2.929 831 HB3 GLU 111 1HB GLU 111 2.791 -23.650 4.548 832 HG2 GLU 111 2HG GLU 111 0.692 -23.906 2.342 833 HG3 GLU 111 1HG GLU 111 1.922 -25.127 2.638 834 H THR 112 H THR 112 2.197 -22.372 6.467 835 HA THR 112 HA THR 112 -0.142 -23.556 7.512 836 HB THR 112 HB THR 112 0.890 -23.208 9.707 837 HG1 THR 112 1HG THR 112 1.633 -21.114 9.433 838 HG21 THR 112 3HG2 THR 112 1.790 -24.997 8.265 839 HG22 THR 112 1HG2 THR 112 3.058 -24.289 9.264 840 HG23 THR 112 2HG2 THR 112 2.937 -23.856 7.560 841 H ASN 113 H ASN 113 0.976 -20.170 7.582 842 HA ASN 113 HA ASN 113 -0.964 -19.160 9.320 843 HB2 ASN 113 2HB ASN 113 0.407 -17.791 6.986 844 HB3 ASN 113 1HB ASN 113 -0.481 -16.952 8.252 845 HD21 ASN 113 1HD2 ASN 113 1.792 -19.735 8.591 846 HD22 ASN 113 2HD2 ASN 113 2.867 -18.909 9.611 847 HA PRO 114 HA PRO 114 -4.648 -19.408 6.749 848 HB2 PRO 114 2HB PRO 114 -6.290 -17.537 7.879 849 HB3 PRO 114 1HB PRO 114 -5.820 -19.009 8.765 850 HG2 PRO 114 2HG PRO 114 -4.554 -16.269 8.910 851 HG3 PRO 114 1HG PRO 114 -5.134 -17.285 10.248 852 HD2 PRO 114 2HD PRO 114 -2.511 -17.271 9.572 853 HD3 PRO 114 1HD PRO 114 -3.301 -18.790 10.056 854 H ARG 115 H ARG 115 -4.172 -18.780 4.702 855 HA ARG 115 HA ARG 115 -3.312 -16.210 3.873 856 HB2 ARG 115 2HB ARG 115 -4.612 -18.484 2.340 857 HB3 ARG 115 1HB ARG 115 -3.841 -17.092 1.589 858 HG2 ARG 115 2HG ARG 115 -1.705 -17.673 2.702 859 HG3 ARG 115 1HG ARG 115 -2.478 -19.081 3.431 860 HD2 ARG 115 2HD ARG 115 -2.235 -18.602 0.441 861 HD3 ARG 115 1HD ARG 115 -1.192 -19.666 1.379 862 HE ARG 115 HE ARG 115 -3.869 -20.412 1.842 863 HH11 ARG 115 1HH2 ARG 115 -1.473 -20.388 -0.675 864 HH12 ARG 115 2HH2 ARG 115 -2.147 -21.748 -1.510 865 HH21 ARG 115 1HH1 ARG 115 -4.745 -22.186 0.741 866 HH22 ARG 115 2HH1 ARG 115 -3.994 -22.762 -0.711 867 H GLU 116 H GLU 116 -6.514 -17.760 3.889 868 HA GLU 116 HA GLU 116 -7.912 -15.783 2.493 869 HB2 GLU 116 2HB GLU 116 -9.933 -16.802 3.520 870 HB3 GLU 116 1HB GLU 116 -8.823 -18.004 2.861 871 HG2 GLU 116 2HG GLU 116 -7.890 -18.358 5.153 872 HG3 GLU 116 1HG GLU 116 -9.076 -17.220 5.789 873 H LEU 117 H LEU 117 -7.189 -15.993 5.966 874 HA LEU 117 HA LEU 117 -8.900 -13.957 6.860 875 HB2 LEU 117 2HB LEU 117 -7.734 -15.538 8.337 876 HB3 LEU 117 1HB LEU 117 -6.191 -14.839 7.871 877 HG LEU 117 HG LEU 117 -6.810 -12.694 8.944 878 HD11 LEU 117 1HD1 LEU 117 -9.439 -14.117 9.495 879 HD12 LEU 117 2HD1 LEU 117 -9.184 -12.536 8.754 880 HD13 LEU 117 3HD1 LEU 117 -8.905 -12.749 10.475 881 HD21 LEU 117 3HD2 LEU 117 -5.657 -14.423 10.265 882 HD22 LEU 117 1HD2 LEU 117 -7.211 -15.113 10.736 883 HD23 LEU 117 2HD2 LEU 117 -6.761 -13.499 11.285 884 H GLN 118 H GLN 118 -5.448 -13.769 5.937 885 HA GLN 118 HA GLN 118 -5.312 -10.908 6.211 886 HB2 GLN 118 2HB GLN 118 -3.073 -11.159 5.138 887 HB3 GLN 118 1HB GLN 118 -3.304 -12.225 6.524 888 HG2 GLN 118 2HG GLN 118 -3.857 -14.093 5.001 889 HG3 GLN 118 1HG GLN 118 -3.612 -13.037 3.612 890 HE21 GLN 118 1HE2 GLN 118 -2.060 -15.446 5.148 891 HE22 GLN 118 2HE2 GLN 118 -0.451 -14.931 4.990 892 H GLN 119 H GLN 119 -6.143 -13.069 3.562 893 HA GLN 119 HA GLN 119 -5.693 -11.432 1.353 894 HB2 GLN 119 2HB GLN 119 -6.411 -13.800 1.253 895 HB3 GLN 119 1HB GLN 119 -8.009 -13.337 1.832 896 HG2 GLN 119 2HG GLN 119 -8.382 -11.967 -0.176 897 HG3 GLN 119 1HG GLN 119 -6.745 -12.302 -0.735 898 HE21 GLN 119 1HE2 GLN 119 -9.096 -12.993 -2.275 899 HE22 GLN 119 2HE2 GLN 119 -9.171 -14.686 -2.369 900 H SER 120 H SER 120 -8.515 -11.583 3.510 901 HA SER 120 HA SER 120 -10.021 -9.550 2.179 902 HB2 SER 120 2HB SER 120 -11.054 -11.210 3.690 903 HB3 SER 120 1HB SER 120 -10.183 -10.513 5.052 904 HG SER 120 HG SER 120 -12.272 -9.445 3.499 905 H GLY 121 H GLY 121 -7.586 -9.587 4.706 906 HA2 GLY 121 2HA GLY 121 -7.918 -6.996 5.738 907 HA3 GLY 121 1HA GLY 121 -6.414 -7.910 5.752 908 H TRP 122 H TRP 122 -5.711 -8.128 3.145 909 HA TRP 122 HA TRP 122 -4.647 -5.576 2.526 910 HB2 TRP 122 2HB TRP 122 -4.947 -8.020 0.744 911 HB3 TRP 122 1HB TRP 122 -3.933 -6.623 0.386 912 HD1 TRP 122 HD TRP 122 -3.776 -9.911 2.063 913 HE1 TRP 122 1HE TRP 122 -1.627 -10.116 3.468 914 HE3 TRP 122 3HE TRP 122 -2.256 -5.034 2.067 915 HZ2 TRP 122 2HZ TRP 122 0.464 -8.437 4.460 916 HZ3 TRP 122 3HZ TRP 122 -0.182 -4.367 3.246 917 HH2 TRP 122 HH TRP 122 1.179 -6.060 4.441 918 H GLN 123 H GLN 123 -7.480 -7.310 1.311 919 HA GLN 123 HA GLN 123 -8.110 -5.419 -0.757 920 HB2 GLN 123 2HB GLN 123 -8.909 -7.774 -0.744 921 HB3 GLN 123 1HB GLN 123 -9.929 -7.406 0.647 922 HG2 GLN 123 2HG GLN 123 -11.181 -5.745 -0.675 923 HG3 GLN 123 1HG GLN 123 -10.121 -6.018 -2.054 924 HE21 GLN 123 1HE2 GLN 123 -11.557 -7.010 -3.527 925 HE22 GLN 123 2HE2 GLN 123 -12.423 -8.430 -3.189 926 H ALA 124 H ALA 124 -9.058 -5.835 2.627 927 HA ALA 124 HA ALA 124 -11.142 -3.983 2.772 928 HB1 ALA 124 1HB ALA 124 -10.584 -5.567 4.564 929 HB2 ALA 124 2HB ALA 124 -10.684 -3.917 5.180 930 HB3 ALA 124 3HB ALA 124 -9.107 -4.662 4.899 931 H ILE 125 H ILE 125 -7.685 -3.402 3.512 932 HA ILE 125 HA ILE 125 -7.976 -0.648 4.048 933 HB ILE 125 HB ILE 125 -6.007 -1.864 4.774 934 HG12 ILE 125 2HG1 ILE 125 -5.101 0.098 2.621 935 HG13 ILE 125 1HG1 ILE 125 -5.764 0.602 4.175 936 HG21 ILE 125 1HG2 ILE 125 -5.375 -2.254 1.830 937 HG22 ILE 125 2HG2 ILE 125 -5.902 -3.501 2.952 938 HG23 ILE 125 3HG2 ILE 125 -4.342 -2.734 3.174 939 HD11 ILE 125 3HD1 ILE 125 -3.952 -0.645 5.327 940 HD12 ILE 125 1HD1 ILE 125 -3.316 0.603 4.258 941 HD13 ILE 125 2HD1 ILE 125 -3.278 -1.087 3.760 942 H LEU 126 H LEU 126 -7.422 -2.413 1.027 943 HA LEU 126 HA LEU 126 -6.934 -0.150 -0.612 944 HB2 LEU 126 2HB LEU 126 -7.801 -2.995 -1.088 945 HB3 LEU 126 1HB LEU 126 -7.817 -1.890 -2.440 946 HG LEU 126 HG LEU 126 -5.308 -2.285 -0.745 947 HD11 LEU 126 1HD1 LEU 126 -5.949 -4.479 -1.674 948 HD12 LEU 126 2HD1 LEU 126 -4.532 -3.858 -2.517 949 HD13 LEU 126 3HD1 LEU 126 -6.122 -3.763 -3.277 950 HD21 LEU 126 3HD2 LEU 126 -5.261 -0.274 -2.208 951 HD22 LEU 126 1HD2 LEU 126 -5.757 -1.250 -3.589 952 HD23 LEU 126 2HD2 LEU 126 -4.173 -1.490 -2.856 953 H ASN 127 H ASN 127 -9.990 -1.932 0.062 954 HA ASN 127 HA ASN 127 -11.523 -0.105 -1.606 955 HB2 ASN 127 2HB ASN 127 -13.492 -1.352 -0.750 956 HB3 ASN 127 1HB ASN 127 -12.260 -2.399 -1.442 957 HD21 ASN 127 1HD2 ASN 127 -12.410 -4.278 -0.256 958 HD22 ASN 127 2HD2 ASN 127 -12.366 -4.360 1.438 959 H SER 128 H SER 128 -10.776 -0.373 1.810 960 HA SER 128 HA SER 128 -12.733 1.367 2.834 961 HB2 SER 128 2HB SER 128 -9.913 0.836 3.794 962 HB3 SER 128 1HB SER 128 -11.129 1.709 4.726 963 HG SER 128 HG SER 128 -11.571 -0.874 3.654 964 H PHE 129 H PHE 129 -9.532 2.027 1.461 965 HA PHE 129 HA PHE 129 -9.373 4.769 2.042 966 HB2 PHE 129 2HB PHE 129 -7.476 3.431 1.147 967 HB3 PHE 129 1HB PHE 129 -8.285 3.346 -0.416 968 HD1 PHE 129 2HD PHE 129 -6.557 5.594 1.985 969 HD2 PHE 129 1HD PHE 129 -8.440 5.336 -1.876 970 HE1 PHE 129 2HE PHE 129 -5.632 7.812 1.379 971 HE2 PHE 129 1HE PHE 129 -7.514 7.557 -2.471 972 HZ PHE 129 HZ PHE 129 -6.112 8.794 -0.845 973 H LYS 130 H LYS 130 -10.800 3.108 -0.767 974 HA LYS 130 HA LYS 130 -11.508 5.416 -2.237 975 HB2 LYS 130 2HB LYS 130 -12.817 2.677 -2.128 976 HB3 LYS 130 1HB LYS 130 -13.169 3.902 -3.350 977 HG2 LYS 130 2HG LYS 130 -10.805 3.884 -4.058 978 HG3 LYS 130 1HG LYS 130 -10.444 2.663 -2.836 979 HD2 LYS 130 2HD LYS 130 -12.058 1.115 -3.921 980 HD3 LYS 130 1HD LYS 130 -12.378 2.333 -5.158 981 HE2 LYS 130 2HE LYS 130 -9.689 1.060 -4.590 982 HE3 LYS 130 1HE LYS 130 -10.733 0.681 -5.959 983 HZ1 LYS 130 3HZ LYS 130 -9.629 2.290 -7.003 984 HZ2 LYS 130 1HZ LYS 130 -8.954 2.896 -5.572 985 HZ3 LYS 130 2HZ LYS 130 -10.510 3.385 -6.047 986 H SER 131 H SER 131 -13.320 3.523 0.189 987 HA SER 131 HA SER 131 -15.732 4.972 0.030 988 HB2 SER 131 2HB SER 131 -14.522 3.533 2.407 989 HB3 SER 131 1HB SER 131 -16.207 4.033 2.262 990 HG SER 131 HG SER 131 -15.107 2.540 0.181 991 H TYR 132 H TYR 132 -12.945 5.368 2.242 992 HA TYR 132 HA TYR 132 -13.974 7.610 3.634 993 HB2 TYR 132 2HB TYR 132 -12.097 6.253 4.479 994 HB3 TYR 132 1HB TYR 132 -11.088 6.804 3.143 995 HD1 TYR 132 2HD TYR 132 -12.769 7.830 6.293 996 HD2 TYR 132 1HD TYR 132 -10.189 9.102 3.093 997 HE1 TYR 132 2HE TYR 132 -12.167 9.861 7.580 998 HE2 TYR 132 1HE TYR 132 -9.595 11.132 4.385 999 HH TYR 132 HH TYR 132 -9.914 11.500 7.485 1000 H THR 133 H THR 133 -11.760 7.380 0.849 1001 HA THR 133 HA THR 133 -11.332 10.144 0.514 1002 HB THR 133 HB THR 133 -11.314 8.011 -1.652 1003 HG1 THR 133 1HG THR 133 -9.684 7.244 -0.633 1004 HG21 THR 133 3HG2 THR 133 -9.864 10.670 -1.381 1005 HG22 THR 133 1HG2 THR 133 -11.131 10.289 -2.549 1006 HG23 THR 133 2HG2 THR 133 -9.569 9.484 -2.650 1007 H GLU 134 H GLU 134 -13.742 7.979 -0.962 1008 HA GLU 134 HA GLU 134 -14.946 10.011 -2.583 1009 HB2 GLU 134 2HB GLU 134 -15.069 7.554 -3.041 1010 HB3 GLU 134 1HB GLU 134 -16.106 7.368 -1.630 1011 HG2 GLU 134 2HG GLU 134 -17.527 7.487 -3.605 1012 HG3 GLU 134 1HG GLU 134 -17.746 8.978 -2.702 1013 H ASN 135 H ASN 135 -15.579 8.698 0.646 1014 HA ASN 135 HA ASN 135 -17.992 10.302 1.023 1015 HB2 ASN 135 2HB ASN 135 -16.445 8.557 2.965 1016 HB3 ASN 135 1HB ASN 135 -18.025 9.277 3.265 1017 HD21 ASN 135 1HD2 ASN 135 -17.149 6.337 2.957 1018 HD22 ASN 135 2HD2 ASN 135 -18.215 5.719 1.790 1019 H ASN 136 H ASN 136 -14.922 11.224 0.852 1020 HA ASN 136 HA ASN 136 -14.281 12.494 3.260 1021 HB2 ASN 136 2HB ASN 136 -12.715 13.821 1.948 1022 HB3 ASN 136 1HB ASN 136 -12.722 12.167 1.340 1023 HD21 ASN 136 1HD2 ASN 136 -15.251 12.408 -0.154 1024 HD22 ASN 136 2HD2 ASN 136 -14.939 13.427 -1.474 1025 H LEU 137 H LEU 137 -16.318 13.580 0.576 1026 HA LEU 137 HA LEU 137 -16.592 16.278 1.324 1027 HB2 LEU 137 2HB LEU 137 -17.284 15.366 -0.864 1028 HB3 LEU 137 1HB LEU 137 -18.561 14.445 -0.079 1029 HG LEU 137 HG LEU 137 -19.648 16.580 0.634 1030 HD11 LEU 137 1HD1 LEU 137 -17.920 18.195 0.833 1031 HD12 LEU 137 2HD1 LEU 137 -18.775 18.711 -0.611 1032 HD13 LEU 137 3HD1 LEU 137 -17.252 17.831 -0.759 1033 HD21 LEU 137 3HD2 LEU 137 -20.301 15.510 -1.479 1034 HD22 LEU 137 1HD2 LEU 137 -19.035 16.393 -2.336 1035 HD23 LEU 137 2HD2 LEU 137 -20.395 17.264 -1.628 1036 H GLU 138 H GLU 138 -18.592 13.431 2.124 1037 HA GLU 138 HA GLU 138 -20.231 14.956 4.019 1038 HB2 GLU 138 2HB GLU 138 -21.398 12.794 4.370 1039 HB3 GLU 138 1HB GLU 138 -21.335 13.244 2.668 1040 HG2 GLU 138 2HG GLU 138 -19.391 11.742 2.356 1041 HG3 GLU 138 1HG GLU 138 -19.484 11.261 4.044 1042 H HIS 139 H HIS 139 -20.501 14.181 6.231 1043 HA HIS 139 HA HIS 139 -18.399 12.610 7.474 1044 HB2 HIS 139 2HB HIS 139 -17.611 14.460 8.937 1045 HB3 HIS 139 1HB HIS 139 -17.232 14.755 7.240 1046 HD2 HIS 139 2HD HIS 139 -19.157 16.456 10.109 1047 HE1 HIS 139 1HE HIS 139 -20.239 18.487 6.571 1048 HE2 HIS 139 2HE HIS 139 -20.359 18.545 9.107 1049 H HIS 140 H HIS 140 -18.858 12.144 9.669 1050 HA HIS 140 HA HIS 140 -21.332 13.138 10.889 1051 HB2 HIS 140 2HB HIS 140 -20.982 10.210 10.158 1052 HB3 HIS 140 1HB HIS 140 -22.294 10.880 11.126 1053 HD2 HIS 140 2HD HIS 140 -24.168 12.485 9.636 1054 HE1 HIS 140 1HE HIS 140 -22.715 11.329 5.845 1055 HE2 HIS 140 2HE HIS 140 -24.604 12.512 7.062 1056 H HIS 141 H HIS 141 -21.585 12.355 13.088 1057 HA HIS 141 HA HIS 141 -19.150 12.436 14.540 1058 HB2 HIS 141 2HB HIS 141 -21.906 11.546 15.457 1059 HB3 HIS 141 1HB HIS 141 -20.566 12.008 16.508 1060 HD2 HIS 141 2HD HIS 141 -23.487 13.686 14.693 1061 HE1 HIS 141 1HE HIS 141 -20.798 16.790 15.671 1062 HE2 HIS 141 2HE HIS 141 -23.140 16.269 14.839 1063 H HIS 142 H HIS 142 -21.347 9.766 13.696 1064 HA HIS 142 HA HIS 142 -19.246 7.828 13.700 1065 HB2 HIS 142 2HB HIS 142 -19.533 8.106 16.168 1066 HB3 HIS 142 1HB HIS 142 -21.226 7.657 16.006 1067 HD2 HIS 142 2HD HIS 142 -21.645 4.918 16.128 1068 HE1 HIS 142 1HE HIS 142 -17.663 3.683 15.463 1069 HE2 HIS 142 2HE HIS 142 -20.011 2.884 16.005 1070 H HIS 143 H HIS 143 -22.347 8.911 13.042 1071 HA HIS 143 HA HIS 143 -23.778 6.495 12.617 1072 HB2 HIS 143 2HB HIS 143 -24.055 9.182 11.229 1073 HB3 HIS 143 1HB HIS 143 -25.245 7.884 11.182 1074 HD2 HIS 143 2HD HIS 143 -26.816 7.624 13.514 1075 HE1 HIS 143 1HE HIS 143 -25.046 10.811 15.645 1076 HE2 HIS 143 2HE HIS 143 -26.951 9.131 15.643 1077 H HIS 144 H HIS 144 -21.601 8.394 10.576 1078 HA HIS 144 HA HIS 144 -20.890 6.135 8.969 1079 HB2 HIS 144 2HB HIS 144 -23.132 6.651 7.990 1080 HB3 HIS 144 1HB HIS 144 -22.576 8.280 7.616 1081 HD2 HIS 144 2HD HIS 144 -22.332 4.691 6.149 1082 HE1 HIS 144 1HE HIS 144 -19.833 7.158 3.812 1083 HE2 HIS 144 2HE HIS 144 -20.899 4.861 3.974 Start of MODEL 16 1 H1 GLY 1 1HT GLY 1 -1.737 -19.944 -5.399 2 H2 GLY 1 2HT GLY 1 -3.128 -20.871 -5.099 3 H3 GLY 1 3HT GLY 1 -2.038 -20.538 -3.840 4 HA2 GLY 1 2HA GLY 1 -3.418 -18.364 -5.285 5 HA3 GLY 1 1HA GLY 1 -4.175 -19.181 -3.917 6 H ASN 2 H ASN 2 -0.893 -19.353 -3.480 7 HA ASN 2 HA ASN 2 -0.857 -17.630 -1.233 8 HB2 ASN 2 2HB ASN 2 0.679 -19.548 -1.521 9 HB3 ASN 2 1HB ASN 2 1.469 -18.715 -2.854 10 HD21 ASN 2 1HD2 ASN 2 3.183 -17.332 -2.304 11 HD22 ASN 2 2HD2 ASN 2 3.537 -16.825 -0.724 12 H LYS 3 H LYS 3 0.309 -17.226 -4.560 13 HA LYS 3 HA LYS 3 1.391 -14.592 -4.139 14 HB2 LYS 3 2HB LYS 3 1.467 -14.541 -6.670 15 HB3 LYS 3 1HB LYS 3 2.290 -15.925 -5.951 16 HG2 LYS 3 2HG LYS 3 0.368 -17.372 -6.401 17 HG3 LYS 3 1HG LYS 3 -0.561 -16.011 -7.017 18 HD2 LYS 3 2HD LYS 3 1.102 -15.704 -8.831 19 HD3 LYS 3 1HD LYS 3 2.008 -17.091 -8.221 20 HE2 LYS 3 2HE LYS 3 -0.866 -17.160 -9.207 21 HE3 LYS 3 1HE LYS 3 0.537 -17.753 -10.096 22 HZ1 LYS 3 3HZ LYS 3 0.710 -18.925 -7.624 23 HZ2 LYS 3 1HZ LYS 3 0.217 -19.676 -9.062 24 HZ3 LYS 3 2HZ LYS 3 -0.941 -19.012 -8.012 25 H ILE 4 H ILE 4 -1.032 -14.409 -2.992 26 HA ILE 4 HA ILE 4 -3.277 -13.750 -4.468 27 HB ILE 4 HB ILE 4 -2.318 -12.331 -1.947 28 HG12 ILE 4 2HG1 ILE 4 -4.131 -14.784 -2.193 29 HG13 ILE 4 1HG1 ILE 4 -2.420 -14.878 -1.792 30 HG21 ILE 4 1HG2 ILE 4 -5.104 -12.694 -3.143 31 HG22 ILE 4 2HG2 ILE 4 -4.221 -11.173 -3.054 32 HG23 ILE 4 3HG2 ILE 4 -4.771 -11.951 -1.583 33 HD11 ILE 4 3HD1 ILE 4 -3.782 -14.926 0.250 34 HD12 ILE 4 1HD1 ILE 4 -4.503 -13.380 -0.181 35 HD13 ILE 4 2HD1 ILE 4 -2.788 -13.469 0.196 36 H THR 5 H THR 5 -3.977 -11.973 -5.569 37 HA THR 5 HA THR 5 -2.197 -9.601 -5.800 38 HB THR 5 HB THR 5 -3.551 -11.013 -8.139 39 HG1 THR 5 1HG THR 5 -1.146 -11.242 -8.593 40 HG21 THR 5 3HG2 THR 5 -3.266 -8.587 -8.473 41 HG22 THR 5 1HG2 THR 5 -2.124 -9.476 -9.476 42 HG23 THR 5 2HG2 THR 5 -1.573 -8.705 -7.992 43 H VAL 6 H VAL 6 -3.264 -7.734 -5.765 44 HA VAL 6 HA VAL 6 -6.222 -7.659 -6.124 45 HB VAL 6 HB VAL 6 -6.320 -6.045 -4.190 46 HG11 VAL 6 1HG1 VAL 6 -5.269 -8.819 -3.524 47 HG12 VAL 6 2HG1 VAL 6 -6.943 -8.417 -3.901 48 HG13 VAL 6 3HG1 VAL 6 -6.195 -7.781 -2.437 49 HG21 VAL 6 3HG2 VAL 6 -3.480 -7.031 -3.716 50 HG22 VAL 6 1HG2 VAL 6 -4.411 -6.057 -2.586 51 HG23 VAL 6 2HG2 VAL 6 -3.938 -5.387 -4.145 52 H GLU 7 H GLU 7 -6.997 -5.509 -6.580 53 HA GLU 7 HA GLU 7 -4.990 -3.640 -7.690 54 HB2 GLU 7 2HB GLU 7 -7.434 -4.635 -9.205 55 HB3 GLU 7 1HB GLU 7 -6.298 -3.408 -9.765 56 HG2 GLU 7 2HG GLU 7 -4.479 -5.093 -9.717 57 HG3 GLU 7 1HG GLU 7 -5.630 -6.312 -9.192 58 H VAL 8 H VAL 8 -5.823 -1.512 -8.089 59 HA VAL 8 HA VAL 8 -8.324 -0.829 -6.628 60 HB VAL 8 HB VAL 8 -5.793 0.863 -6.430 61 HG11 VAL 8 1HG1 VAL 8 -8.281 0.657 -4.691 62 HG12 VAL 8 2HG1 VAL 8 -7.963 1.923 -5.877 63 HG13 VAL 8 3HG1 VAL 8 -6.939 1.776 -4.450 64 HG21 VAL 8 3HG2 VAL 8 -5.269 -1.386 -5.493 65 HG22 VAL 8 1HG2 VAL 8 -6.691 -1.265 -4.456 66 HG23 VAL 8 2HG2 VAL 8 -5.339 -0.151 -4.253 67 H THR 9 H THR 9 -9.627 0.425 -7.883 68 HA THR 9 HA THR 9 -8.582 1.519 -10.394 69 HB THR 9 HB THR 9 -10.945 1.967 -10.856 70 HG1 THR 9 1HG THR 9 -11.201 2.257 -8.394 71 HG21 THR 9 3HG2 THR 9 -10.091 -0.318 -11.255 72 HG22 THR 9 1HG2 THR 9 -11.789 -0.342 -10.783 73 HG23 THR 9 2HG2 THR 9 -10.545 -0.767 -9.611 74 H VAL 10 H VAL 10 -7.558 3.437 -10.160 75 HA VAL 10 HA VAL 10 -8.879 5.608 -8.578 76 HB VAL 10 HB VAL 10 -5.883 5.175 -8.916 77 HG11 VAL 10 1HG1 VAL 10 -5.742 6.954 -7.168 78 HG12 VAL 10 2HG1 VAL 10 -7.494 7.136 -7.234 79 HG13 VAL 10 3HG1 VAL 10 -6.509 7.547 -8.638 80 HG21 VAL 10 3HG2 VAL 10 -7.693 4.679 -6.521 81 HG22 VAL 10 1HG2 VAL 10 -5.932 4.582 -6.500 82 HG23 VAL 10 2HG2 VAL 10 -6.863 3.442 -7.465 83 H TYR 11 H TYR 11 -9.389 7.317 -9.775 84 HA TYR 11 HA TYR 11 -8.345 7.583 -12.544 85 HB2 TYR 11 2HB TYR 11 -10.644 8.998 -11.144 86 HB3 TYR 11 1HB TYR 11 -10.220 9.137 -12.851 87 HD1 TYR 11 1HD TYR 11 -10.615 7.258 -14.420 88 HD2 TYR 11 2HD TYR 11 -11.655 6.917 -10.258 89 HE1 TYR 11 1HE TYR 11 -11.953 5.228 -14.914 90 HE2 TYR 11 2HE TYR 11 -12.991 4.889 -10.764 91 HH TYR 11 HH TYR 11 -13.668 3.480 -12.322 92 H ALA 12 H ALA 12 -6.295 8.424 -12.032 93 HA ALA 12 HA ALA 12 -6.164 11.266 -11.787 94 HB1 ALA 12 1HB ALA 12 -4.928 11.391 -9.664 95 HB2 ALA 12 2HB ALA 12 -5.144 9.656 -9.423 96 HB3 ALA 12 3HB ALA 12 -6.540 10.731 -9.401 97 H ALA 13 H ALA 13 -4.016 12.062 -12.118 98 HA ALA 13 HA ALA 13 -2.435 10.463 -13.839 99 HB1 ALA 13 1HB ALA 13 -0.824 12.325 -13.720 100 HB2 ALA 13 2HB ALA 13 -1.704 13.002 -12.349 101 HB3 ALA 13 3HB ALA 13 -2.469 12.923 -13.934 102 H ILE 14 H ILE 14 -0.787 9.075 -13.421 103 HA ILE 14 HA ILE 14 -0.284 8.006 -10.904 104 HB ILE 14 HB ILE 14 0.306 6.858 -12.972 105 HG12 ILE 14 2HG1 ILE 14 2.872 7.357 -11.378 106 HG13 ILE 14 1HG1 ILE 14 1.546 6.373 -10.761 107 HG21 ILE 14 1HG2 ILE 14 2.212 7.535 -14.341 108 HG22 ILE 14 2HG2 ILE 14 2.575 8.874 -13.253 109 HG23 ILE 14 3HG2 ILE 14 1.099 8.897 -14.217 110 HD11 ILE 14 3HD1 ILE 14 3.055 5.872 -13.328 111 HD12 ILE 14 1HD1 ILE 14 1.741 4.886 -12.688 112 HD13 ILE 14 2HD1 ILE 14 3.268 4.997 -11.815 113 H GLU 15 H GLU 15 1.264 10.726 -12.525 114 HA GLU 15 HA GLU 15 3.500 11.004 -10.845 115 HB2 GLU 15 2HB GLU 15 3.177 12.175 -13.029 116 HB3 GLU 15 1HB GLU 15 1.955 13.196 -12.279 117 HG2 GLU 15 2HG GLU 15 3.636 14.060 -10.685 118 HG3 GLU 15 1HG GLU 15 4.856 13.005 -11.389 119 H LYS 16 H LYS 16 0.171 12.223 -10.585 120 HA LYS 16 HA LYS 16 0.647 13.814 -8.255 121 HB2 LYS 16 2HB LYS 16 -1.261 14.181 -9.811 122 HB3 LYS 16 1HB LYS 16 -1.970 12.659 -9.270 123 HG2 LYS 16 2HG LYS 16 -2.137 13.520 -6.968 124 HG3 LYS 16 1HG LYS 16 -1.338 15.017 -7.449 125 HD2 LYS 16 2HD LYS 16 -3.209 15.506 -8.998 126 HD3 LYS 16 1HD LYS 16 -4.006 14.015 -8.496 127 HE2 LYS 16 2HE LYS 16 -4.133 14.840 -6.181 128 HE3 LYS 16 1HE LYS 16 -3.300 16.322 -6.650 129 HZ1 LYS 16 3HZ LYS 16 -5.489 16.944 -6.759 130 HZ2 LYS 16 1HZ LYS 16 -6.020 15.431 -7.314 131 HZ3 LYS 16 2HZ LYS 16 -5.204 16.481 -8.370 132 H VAL 17 H VAL 17 -0.763 10.590 -8.780 133 HA VAL 17 HA VAL 17 -1.318 10.018 -6.068 134 HB VAL 17 HB VAL 17 -0.707 8.072 -8.321 135 HG11 VAL 17 1HG1 VAL 17 -2.147 7.719 -5.658 136 HG12 VAL 17 2HG1 VAL 17 -0.651 6.931 -6.152 137 HG13 VAL 17 3HG1 VAL 17 -2.162 6.524 -6.954 138 HG21 VAL 17 3HG2 VAL 17 -3.336 9.281 -7.384 139 HG22 VAL 17 1HG2 VAL 17 -3.167 8.031 -8.617 140 HG23 VAL 17 2HG2 VAL 17 -2.513 9.642 -8.904 141 H TRP 18 H TRP 18 1.555 9.386 -8.085 142 HA TRP 18 HA TRP 18 2.998 7.750 -6.389 143 HB2 TRP 18 2HB TRP 18 3.717 8.411 -8.674 144 HB3 TRP 18 1HB TRP 18 4.097 10.026 -8.079 145 HD1 TRP 18 HD TRP 18 6.173 10.252 -6.374 146 HE1 TRP 18 1HE TRP 18 8.221 8.738 -5.974 147 HE3 TRP 18 3HE TRP 18 4.574 5.997 -8.687 148 HZ2 TRP 18 2HZ TRP 18 9.067 6.066 -6.560 149 HZ3 TRP 18 3HZ TRP 18 6.016 3.984 -8.757 150 HH2 TRP 18 HH TRP 18 8.259 4.012 -7.700 151 H LYS 19 H LYS 19 2.662 11.292 -6.225 152 HA LYS 19 HA LYS 19 4.616 11.691 -4.179 153 HB2 LYS 19 2HB LYS 19 2.187 13.362 -4.880 154 HB3 LYS 19 1HB LYS 19 3.498 13.883 -3.815 155 HG2 LYS 19 2HG LYS 19 5.097 13.431 -5.797 156 HG3 LYS 19 1HG LYS 19 3.655 13.305 -6.799 157 HD2 LYS 19 2HD LYS 19 4.478 15.725 -5.152 158 HD3 LYS 19 1HD LYS 19 4.595 15.576 -6.901 159 HE2 LYS 19 2HE LYS 19 2.060 15.227 -6.926 160 HE3 LYS 19 1HE LYS 19 2.059 15.725 -5.235 161 HZ1 LYS 19 3HZ LYS 19 3.474 17.406 -7.154 162 HZ2 LYS 19 1HZ LYS 19 2.611 17.838 -5.759 163 HZ3 LYS 19 2HZ LYS 19 1.776 17.435 -7.184 164 H TYR 20 H TYR 20 1.041 11.335 -3.999 165 HA TYR 20 HA TYR 20 0.946 11.544 -1.143 166 HB2 TYR 20 2HB TYR 20 -1.014 10.423 -3.177 167 HB3 TYR 20 1HB TYR 20 -1.382 10.572 -1.460 168 HD1 TYR 20 1HD TYR 20 -0.996 12.901 -0.353 169 HD2 TYR 20 2HD TYR 20 -1.451 12.347 -4.601 170 HE1 TYR 20 1HE TYR 20 -1.610 15.286 -0.609 171 HE2 TYR 20 2HE TYR 20 -2.061 14.737 -4.839 172 HH TYR 20 HH TYR 20 -2.897 16.688 -2.233 173 H TRP 21 H TRP 21 1.015 8.787 -3.389 174 HA TRP 21 HA TRP 21 0.689 6.782 -1.415 175 HB2 TRP 21 2HB TRP 21 0.394 6.502 -3.919 176 HB3 TRP 21 1HB TRP 21 2.149 6.512 -4.087 177 HD1 TRP 21 HD TRP 21 3.463 4.358 -3.237 178 HE1 TRP 21 1HE TRP 21 2.695 2.019 -2.487 179 HE3 TRP 21 3HE TRP 21 -1.533 5.209 -2.760 180 HZ2 TRP 21 2HZ TRP 21 0.263 0.685 -1.776 181 HZ3 TRP 21 3HZ TRP 21 -3.058 3.396 -2.050 182 HH2 TRP 21 HH TRP 21 -2.172 1.137 -1.556 183 H ASN 22 H ASN 22 3.356 8.766 -2.274 184 HA ASN 22 HA ASN 22 5.372 7.026 -0.951 185 HB2 ASN 22 2HB ASN 22 5.608 9.510 -2.678 186 HB3 ASN 22 1HB ASN 22 6.981 8.730 -1.909 187 HD21 ASN 22 1HD2 ASN 22 4.233 6.933 -3.307 188 HD22 ASN 22 2HD2 ASN 22 5.131 6.222 -4.558 189 H GLU 23 H GLU 23 3.518 9.942 -0.551 190 HA GLU 23 HA GLU 23 5.204 11.310 1.242 191 HB2 GLU 23 2HB GLU 23 3.225 12.352 0.161 192 HB3 GLU 23 1HB GLU 23 2.177 11.387 1.188 193 HG2 GLU 23 2HG GLU 23 3.142 12.454 3.200 194 HG3 GLU 23 1HG GLU 23 4.248 13.374 2.186 195 HA PRO 24 HA PRO 24 4.583 8.209 4.548 196 HB2 PRO 24 2HB PRO 24 6.126 9.296 6.550 197 HB3 PRO 24 1HB PRO 24 6.831 8.506 5.128 198 HG2 PRO 24 2HG PRO 24 6.406 11.445 5.616 199 HG3 PRO 24 1HG PRO 24 7.857 10.618 5.005 200 HD2 PRO 24 2HD PRO 24 6.093 11.846 3.320 201 HD3 PRO 24 1HD PRO 24 6.958 10.368 2.827 202 H ALA 25 H ALA 25 4.319 11.673 5.302 203 HA ALA 25 HA ALA 25 2.804 11.490 7.636 204 HB1 ALA 25 1HB ALA 25 2.645 13.618 5.486 205 HB2 ALA 25 2HB ALA 25 3.783 13.594 6.833 206 HB3 ALA 25 3HB ALA 25 2.059 13.783 7.143 207 H HIS 26 H HIS 26 1.845 11.129 4.293 208 HA HIS 26 HA HIS 26 -1.003 11.255 4.808 209 HB2 HIS 26 2HB HIS 26 0.017 11.850 2.604 210 HB3 HIS 26 1HB HIS 26 0.453 10.158 2.378 211 HD2 HIS 26 2HD HIS 26 -1.502 8.819 0.985 212 HE1 HIS 26 1HE HIS 26 -4.815 11.163 2.150 213 HE2 HIS 26 2HE HIS 26 -4.077 9.173 0.753 214 H ILE 27 H ILE 27 1.336 8.589 4.188 215 HA ILE 27 HA ILE 27 -0.554 6.501 4.160 216 HB ILE 27 HB ILE 27 2.358 6.487 5.034 217 HG12 ILE 27 2HG1 ILE 27 1.123 5.628 2.371 218 HG13 ILE 27 1HG1 ILE 27 1.791 7.233 2.642 219 HG21 ILE 27 1HG2 ILE 27 2.219 3.992 4.456 220 HG22 ILE 27 2HG2 ILE 27 0.468 4.172 4.400 221 HG23 ILE 27 3HG2 ILE 27 1.340 4.447 5.905 222 HD11 ILE 27 3HD1 ILE 27 3.312 4.619 2.891 223 HD12 ILE 27 1HD1 ILE 27 3.985 6.219 3.208 224 HD13 ILE 27 2HD1 ILE 27 3.464 5.786 1.579 225 H MET 28 H MET 28 1.399 7.706 6.909 226 HA MET 28 HA MET 28 0.395 5.948 8.837 227 HB2 MET 28 2HB MET 28 1.208 7.547 10.504 228 HB3 MET 28 1HB MET 28 2.379 7.362 9.203 229 HG2 MET 28 2HG MET 28 1.431 9.441 8.146 230 HG3 MET 28 1HG MET 28 0.429 9.667 9.574 231 HE1 MET 28 3HE MET 28 2.672 8.745 12.063 232 HE2 MET 28 1HE MET 28 1.206 9.712 11.867 233 HE3 MET 28 2HE MET 28 2.698 10.468 12.408 234 H LYS 29 H LYS 29 -1.236 8.506 7.253 235 HA LYS 29 HA LYS 29 -3.092 9.137 9.380 236 HB2 LYS 29 2HB LYS 29 -2.407 10.705 7.508 237 HB3 LYS 29 1HB LYS 29 -3.372 9.725 6.410 238 HG2 LYS 29 2HG LYS 29 -5.385 10.150 7.754 239 HG3 LYS 29 1HG LYS 29 -4.434 11.109 8.888 240 HD2 LYS 29 2HD LYS 29 -3.848 12.680 7.064 241 HD3 LYS 29 1HD LYS 29 -4.823 11.729 5.942 242 HE2 LYS 29 2HE LYS 29 -6.831 12.164 7.319 243 HE3 LYS 29 1HE LYS 29 -5.854 13.117 8.436 244 HZ1 LYS 29 3HZ LYS 29 -6.646 13.731 5.675 245 HZ2 LYS 29 1HZ LYS 29 -5.211 14.389 6.292 246 HZ3 LYS 29 2HZ LYS 29 -6.691 14.719 7.056 247 H TRP 30 H TRP 30 -3.034 6.952 6.612 248 HA TRP 30 HA TRP 30 -5.601 5.726 7.507 249 HB2 TRP 30 2HB TRP 30 -6.325 5.474 5.188 250 HB3 TRP 30 1HB TRP 30 -6.036 7.179 5.521 251 HD1 TRP 30 HD TRP 30 -3.827 8.276 4.454 252 HE1 TRP 30 1HE TRP 30 -2.367 7.594 2.436 253 HE3 TRP 30 3HE TRP 30 -5.501 3.508 3.730 254 HZ2 TRP 30 2HZ TRP 30 -1.980 5.326 0.729 255 HZ3 TRP 30 3HZ TRP 30 -4.581 2.114 1.918 256 HH2 TRP 30 HH TRP 30 -2.833 3.011 0.417 257 H CYS 31 H CYS 31 -2.567 5.062 7.693 258 HA CYS 31 HA CYS 31 -1.942 2.918 6.030 259 HB2 CYS 31 2HB CYS 31 -0.348 3.953 7.622 260 HB3 CYS 31 1HB CYS 31 -1.228 3.225 8.957 261 HG CYS 31 HG CYS 31 0.888 1.752 8.030 262 H GLN 32 H GLN 32 -2.678 0.896 5.845 263 HA GLN 32 HA GLN 32 -3.780 -1.060 6.225 264 HB2 GLN 32 2HB GLN 32 -2.505 -0.827 8.512 265 HB3 GLN 32 1HB GLN 32 -4.062 -0.352 9.177 266 HG2 GLN 32 2HG GLN 32 -3.878 -2.728 9.530 267 HG3 GLN 32 1HG GLN 32 -5.026 -2.511 8.211 268 HE21 GLN 32 1HE2 GLN 32 -1.416 -2.711 8.462 269 HE22 GLN 32 2HE2 GLN 32 -1.254 -3.827 7.193 270 H ALA 33 H ALA 33 -5.058 1.939 7.183 271 HA ALA 33 HA ALA 33 -7.148 2.853 7.292 272 HB1 ALA 33 1HB ALA 33 -7.182 1.979 4.938 273 HB2 ALA 33 2HB ALA 33 -8.779 2.061 5.684 274 HB3 ALA 33 3HB ALA 33 -7.950 0.514 5.542 275 H SER 34 H SER 34 -6.363 1.041 9.381 276 HA SER 34 HA SER 34 -8.904 -0.293 10.168 277 HB2 SER 34 2HB SER 34 -6.087 -0.713 11.146 278 HB3 SER 34 1HB SER 34 -7.521 -1.585 11.683 279 HG SER 34 HG SER 34 -6.234 -2.594 9.967 280 HA PRO 35 HA PRO 35 -8.833 3.567 12.830 281 HB2 PRO 35 2HB PRO 35 -11.487 2.308 13.600 282 HB3 PRO 35 1HB PRO 35 -11.119 4.018 13.261 283 HG2 PRO 35 2HG PRO 35 -12.361 2.564 11.427 284 HG3 PRO 35 1HG PRO 35 -11.047 3.656 10.934 285 HD2 PRO 35 2HD PRO 35 -10.942 0.644 11.287 286 HD3 PRO 35 1HD PRO 35 -10.224 1.662 10.011 287 H GLU 36 H GLU 36 -9.290 0.219 13.628 288 HA GLU 36 HA GLU 36 -9.270 0.422 16.475 289 HB2 GLU 36 2HB GLU 36 -8.582 -1.825 14.557 290 HB3 GLU 36 1HB GLU 36 -8.731 -2.046 16.304 291 HG2 GLU 36 2HG GLU 36 -10.939 -1.033 14.472 292 HG3 GLU 36 1HG GLU 36 -10.808 -2.682 15.076 293 H TRP 37 H TRP 37 -6.814 0.485 14.028 294 HA TRP 37 HA TRP 37 -4.628 0.247 16.045 295 HB2 TRP 37 2HB TRP 37 -4.684 -0.048 13.016 296 HB3 TRP 37 1HB TRP 37 -3.177 0.080 13.925 297 HD1 TRP 37 HD TRP 37 -6.275 -2.191 13.636 298 HE1 TRP 37 1HE TRP 37 -5.631 -4.544 14.442 299 HE3 TRP 37 3HE TRP 37 -1.534 -1.274 15.270 300 HZ2 TRP 37 2HZ TRP 37 -3.385 -5.870 15.638 301 HZ3 TRP 37 3HZ TRP 37 -0.164 -3.095 16.241 302 HH2 TRP 37 HH TRP 37 -1.081 -5.389 16.426 303 H HIS 38 H HIS 38 -2.813 1.722 15.739 304 HA HIS 38 HA HIS 38 -3.477 4.373 14.578 305 HB2 HIS 38 2HB HIS 38 -2.552 3.876 17.437 306 HB3 HIS 38 1HB HIS 38 -2.738 5.459 16.678 307 HD2 HIS 38 2HD HIS 38 -5.031 2.480 17.878 308 HE1 HIS 38 1HE HIS 38 -7.466 5.864 17.216 309 HE2 HIS 38 2HE HIS 38 -7.439 3.476 18.075 310 H VAL 39 H VAL 39 -1.543 5.736 14.437 311 HA VAL 39 HA VAL 39 1.018 4.226 14.351 312 HB VAL 39 HB VAL 39 0.048 6.204 12.275 313 HG11 VAL 39 1HG1 VAL 39 2.526 4.435 12.456 314 HG12 VAL 39 2HG1 VAL 39 2.496 6.196 12.492 315 HG13 VAL 39 3HG1 VAL 39 2.059 5.338 11.018 316 HG21 VAL 39 3HG2 VAL 39 0.257 3.164 12.220 317 HG22 VAL 39 1HG2 VAL 39 -0.068 4.174 10.816 318 HG23 VAL 39 2HG2 VAL 39 -1.229 4.110 12.136 319 HA PRO 40 HA PRO 40 1.473 8.198 16.729 320 HB2 PRO 40 2HB PRO 40 3.208 7.351 18.672 321 HB3 PRO 40 1HB PRO 40 1.466 6.997 18.748 322 HG2 PRO 40 2HG PRO 40 3.711 5.217 17.828 323 HG3 PRO 40 1HG PRO 40 2.325 4.817 18.865 324 HD2 PRO 40 2HD PRO 40 2.399 4.229 16.174 325 HD3 PRO 40 1HD PRO 40 0.873 4.533 17.035 326 H ALA 41 H ALA 41 3.584 6.285 14.895 327 HA ALA 41 HA ALA 41 5.206 8.525 14.158 328 HB1 ALA 41 1HB ALA 41 7.374 7.661 14.952 329 HB2 ALA 41 2HB ALA 41 6.549 6.352 15.793 330 HB3 ALA 41 3HB ALA 41 6.305 8.018 16.305 331 H ALA 42 H ALA 42 6.550 8.069 12.387 332 HA ALA 42 HA ALA 42 6.806 5.407 11.310 333 HB1 ALA 42 1HB ALA 42 5.027 7.391 9.867 334 HB2 ALA 42 2HB ALA 42 4.482 5.911 10.656 335 HB3 ALA 42 3HB ALA 42 5.536 5.820 9.245 336 H GLN 43 H GLN 43 8.366 5.278 9.692 337 HA GLN 43 HA GLN 43 9.645 7.812 8.786 338 HB2 GLN 43 2HB GLN 43 11.081 5.348 9.846 339 HB3 GLN 43 1HB GLN 43 11.856 6.778 9.168 340 HG2 GLN 43 2HG GLN 43 10.090 6.769 11.643 341 HG3 GLN 43 1HG GLN 43 11.849 6.790 11.666 342 HE21 GLN 43 1HE2 GLN 43 12.784 8.714 10.209 343 HE22 GLN 43 2HE2 GLN 43 11.996 10.205 10.403 344 H ASN 44 H ASN 44 10.665 7.686 6.798 345 HA ASN 44 HA ASN 44 10.718 5.229 5.248 346 HB2 ASN 44 2HB ASN 44 8.333 5.934 5.058 347 HB3 ASN 44 1HB ASN 44 8.866 7.483 4.416 348 HD21 ASN 44 1HD2 ASN 44 7.775 7.030 2.350 349 HD22 ASN 44 2HD2 ASN 44 8.438 5.921 1.250 350 H ASP 45 H ASP 45 12.479 5.357 4.010 351 HA ASP 45 HA ASP 45 13.380 7.977 2.915 352 HB2 ASP 45 2HB ASP 45 14.732 7.394 4.925 353 HB3 ASP 45 1HB ASP 45 15.170 5.864 4.170 354 H LEU 46 H LEU 46 12.627 7.478 0.892 355 HA LEU 46 HA LEU 46 12.989 4.984 -0.427 356 HB2 LEU 46 2HB LEU 46 12.558 7.760 -1.570 357 HB3 LEU 46 1HB LEU 46 12.362 6.256 -2.456 358 HG LEU 46 HG LEU 46 10.750 7.070 -0.013 359 HD11 LEU 46 1HD1 LEU 46 10.207 8.423 -1.989 360 HD12 LEU 46 2HD1 LEU 46 8.892 7.312 -1.627 361 HD13 LEU 46 3HD1 LEU 46 9.993 6.959 -2.955 362 HD21 LEU 46 3HD2 LEU 46 10.759 4.550 -1.720 363 HD22 LEU 46 1HD2 LEU 46 9.263 5.074 -0.939 364 HD23 LEU 46 2HD2 LEU 46 10.672 4.701 0.036 365 H LYS 47 H LYS 47 15.099 4.277 -0.395 366 HA LYS 47 HA LYS 47 16.861 5.440 -2.353 367 HB2 LYS 47 2HB LYS 47 17.180 6.795 -0.152 368 HB3 LYS 47 1HB LYS 47 17.912 5.342 0.507 369 HG2 LYS 47 2HG LYS 47 19.837 6.425 -0.329 370 HG3 LYS 47 1HG LYS 47 19.411 5.447 -1.731 371 HD2 LYS 47 2HD LYS 47 18.159 7.423 -2.665 372 HD3 LYS 47 1HD LYS 47 18.691 8.373 -1.284 373 HE2 LYS 47 2HE LYS 47 21.050 7.969 -1.929 374 HE3 LYS 47 1HE LYS 47 20.497 7.053 -3.333 375 HZ1 LYS 47 3HZ LYS 47 20.724 9.101 -4.257 376 HZ2 LYS 47 1HZ LYS 47 20.371 9.929 -2.821 377 HZ3 LYS 47 2HZ LYS 47 19.115 9.229 -3.726 378 H ALA 48 H ALA 48 18.165 3.881 -3.197 379 HA ALA 48 HA ALA 48 17.731 1.171 -2.591 380 HB1 ALA 48 1HB ALA 48 19.655 0.760 -4.082 381 HB2 ALA 48 2HB ALA 48 20.076 2.472 -4.006 382 HB3 ALA 48 3HB ALA 48 18.564 1.969 -4.764 383 H GLY 49 H GLY 49 18.677 -0.215 -1.173 384 HA2 GLY 49 2HA GLY 49 20.137 -1.065 0.409 385 HA3 GLY 49 1HA GLY 49 21.286 0.201 -0.009 386 H GLY 50 H GLY 50 18.307 1.584 0.593 387 HA2 GLY 50 2HA GLY 50 19.165 2.664 3.182 388 HA3 GLY 50 1HA GLY 50 17.764 3.159 2.236 389 H THR 51 H THR 51 17.540 2.748 4.962 390 HA THR 51 HA THR 51 15.778 0.353 5.134 391 HB THR 51 HB THR 51 16.568 -0.090 7.364 392 HG1 THR 51 1HG THR 51 18.469 1.932 7.298 393 HG21 THR 51 3HG2 THR 51 18.063 -0.861 5.469 394 HG22 THR 51 1HG2 THR 51 18.915 -0.624 6.995 395 HG23 THR 51 2HG2 THR 51 19.031 0.588 5.720 396 H PHE 52 H PHE 52 14.136 0.556 6.790 397 HA PHE 52 HA PHE 52 13.503 3.207 7.842 398 HB2 PHE 52 2HB PHE 52 11.346 3.370 6.714 399 HB3 PHE 52 1HB PHE 52 12.636 3.295 5.517 400 HD1 PHE 52 2HD PHE 52 13.197 1.039 4.431 401 HD2 PHE 52 1HD PHE 52 9.610 1.669 6.729 402 HE1 PHE 52 2HE PHE 52 12.179 -0.977 3.415 403 HE2 PHE 52 1HE PHE 52 8.610 -0.352 5.714 404 HZ PHE 52 HZ PHE 52 9.891 -1.669 4.061 405 H THR 53 H THR 53 11.361 3.101 9.055 406 HA THR 53 HA THR 53 10.545 0.438 9.959 407 HB THR 53 HB THR 53 11.716 2.434 11.946 408 HG1 THR 53 1HG THR 53 13.499 1.634 11.159 409 HG21 THR 53 3HG2 THR 53 10.783 -0.449 12.234 410 HG22 THR 53 1HG2 THR 53 9.972 0.972 12.893 411 HG23 THR 53 2HG2 THR 53 11.555 0.500 13.503 412 H THR 54 H THR 54 8.472 0.449 10.703 413 HA THR 54 HA THR 54 7.094 3.072 11.028 414 HB THR 54 HB THR 54 5.922 0.513 9.885 415 HG1 THR 54 1HG THR 54 6.979 2.845 8.694 416 HG21 THR 54 3HG2 THR 54 4.258 1.976 10.969 417 HG22 THR 54 1HG2 THR 54 4.063 2.023 9.219 418 HG23 THR 54 2HG2 THR 54 4.858 3.357 10.053 419 H THR 55 H THR 55 6.398 3.356 13.064 420 HA THR 55 HA THR 55 6.132 1.044 14.874 421 HB THR 55 HB THR 55 5.897 4.028 15.451 422 HG1 THR 55 1HG THR 55 8.114 2.766 16.337 423 HG21 THR 55 3HG2 THR 55 6.385 3.301 17.778 424 HG22 THR 55 1HG2 THR 55 6.349 1.619 17.254 425 HG23 THR 55 2HG2 THR 55 4.884 2.599 17.187 426 H MET 56 H MET 56 4.175 0.158 15.225 427 HA MET 56 HA MET 56 1.726 1.807 15.125 428 HB2 MET 56 2HB MET 56 0.604 0.028 13.777 429 HB3 MET 56 1HB MET 56 1.866 0.863 12.880 430 HG2 MET 56 2HG MET 56 3.450 -0.993 13.420 431 HG3 MET 56 1HG MET 56 2.134 -1.855 14.211 432 HE1 MET 56 3HE MET 56 -0.104 -3.138 11.494 433 HE2 MET 56 1HE MET 56 -0.298 -2.020 12.849 434 HE3 MET 56 2HE MET 56 0.659 -3.482 13.043 435 H ALA 57 H ALA 57 0.264 1.203 16.636 436 HA ALA 57 HA ALA 57 0.466 -1.409 17.979 437 HB1 ALA 57 1HB ALA 57 0.766 1.227 19.455 438 HB2 ALA 57 2HB ALA 57 2.031 0.019 19.234 439 HB3 ALA 57 3HB ALA 57 0.612 -0.360 20.208 440 H ALA 58 H ALA 58 -1.401 -2.036 18.944 441 HA ALA 58 HA ALA 58 -3.848 -0.975 18.014 442 HB1 ALA 58 1HB ALA 58 -4.917 -2.496 19.612 443 HB2 ALA 58 2HB ALA 58 -3.372 -2.741 20.428 444 HB3 ALA 58 3HB ALA 58 -3.594 -3.304 18.772 445 H LYS 59 H LYS 59 -5.497 0.226 19.113 446 HA LYS 59 HA LYS 59 -4.686 2.472 20.485 447 HB2 LYS 59 2HB LYS 59 -6.923 2.088 19.365 448 HB3 LYS 59 1HB LYS 59 -7.406 1.122 20.753 449 HG2 LYS 59 2HG LYS 59 -7.073 3.056 22.238 450 HG3 LYS 59 1HG LYS 59 -6.528 4.021 20.869 451 HD2 LYS 59 2HD LYS 59 -8.741 3.742 19.794 452 HD3 LYS 59 1HD LYS 59 -9.288 2.789 21.176 453 HE2 LYS 59 2HE LYS 59 -8.368 5.681 21.271 454 HE3 LYS 59 1HE LYS 59 -10.038 5.128 21.385 455 HZ1 LYS 59 3HZ LYS 59 -8.818 3.654 23.272 456 HZ2 LYS 59 1HZ LYS 59 -9.641 5.107 23.571 457 HZ3 LYS 59 2HZ LYS 59 -7.952 5.113 23.378 458 H ASP 60 H ASP 60 -5.772 -0.648 21.783 459 HA ASP 60 HA ASP 60 -5.614 0.204 24.561 460 HB2 ASP 60 2HB ASP 60 -7.229 -1.527 23.756 461 HB3 ASP 60 1HB ASP 60 -5.876 -2.592 23.387 462 H GLY 61 H GLY 61 -3.386 -0.699 22.199 463 HA2 GLY 61 2HA GLY 61 -1.128 -1.125 22.274 464 HA3 GLY 61 1HA GLY 61 -1.167 -0.687 23.979 465 H SER 62 H SER 62 -3.347 -3.164 22.988 466 HA SER 62 HA SER 62 -2.285 -5.096 24.745 467 HB2 SER 62 2HB SER 62 -4.633 -5.087 24.007 468 HB3 SER 62 1HB SER 62 -4.125 -5.477 22.366 469 HG SER 62 HG SER 62 -3.455 -7.450 23.043 470 H MET 63 H MET 63 -1.923 -4.620 21.247 471 HA MET 63 HA MET 63 0.452 -6.394 21.253 472 HB2 MET 63 2HB MET 63 -1.550 -7.731 20.530 473 HB3 MET 63 1HB MET 63 -1.802 -6.591 19.208 474 HG2 MET 63 2HG MET 63 0.388 -7.161 18.255 475 HG3 MET 63 1HG MET 63 0.754 -8.196 19.632 476 HE1 MET 63 3HE MET 63 -2.088 -7.569 16.951 477 HE2 MET 63 1HE MET 63 -1.942 -9.084 16.050 478 HE3 MET 63 2HE MET 63 -0.573 -7.981 16.152 479 H SER 64 H SER 64 2.074 -5.648 19.991 480 HA SER 64 HA SER 64 1.579 -3.641 17.889 481 HB2 SER 64 2HB SER 64 3.230 -2.104 18.800 482 HB3 SER 64 1HB SER 64 1.982 -2.384 20.014 483 HG SER 64 HG SER 64 3.350 -3.731 21.099 484 H PHE 65 H PHE 65 3.430 -3.344 16.512 485 HA PHE 65 HA PHE 65 5.753 -5.056 16.778 486 HB2 PHE 65 2HB PHE 65 3.590 -5.692 14.732 487 HB3 PHE 65 1HB PHE 65 5.263 -6.178 14.481 488 HD1 PHE 65 2HD PHE 65 6.441 -7.521 16.348 489 HD2 PHE 65 1HD PHE 65 2.158 -7.104 16.112 490 HE1 PHE 65 2HE PHE 65 6.159 -9.507 17.801 491 HE2 PHE 65 1HE PHE 65 1.896 -9.093 17.564 492 HZ PHE 65 HZ PHE 65 3.892 -10.291 18.410 493 H ASP 66 H ASP 66 7.429 -4.298 15.625 494 HA ASP 66 HA ASP 66 7.103 -1.732 14.228 495 HB2 ASP 66 2HB ASP 66 9.571 -3.336 14.990 496 HB3 ASP 66 1HB ASP 66 9.584 -1.723 14.277 497 H PHE 67 H PHE 67 6.555 -1.891 12.116 498 HA PHE 67 HA PHE 67 7.483 -4.178 10.493 499 HB2 PHE 67 2HB PHE 67 5.079 -3.449 10.438 500 HB3 PHE 67 1HB PHE 67 5.588 -1.908 9.753 501 HD1 PHE 67 1HD PHE 67 6.551 -1.796 7.457 502 HD2 PHE 67 2HD PHE 67 5.213 -5.531 9.120 503 HE1 PHE 67 1HE PHE 67 6.641 -2.835 5.208 504 HE2 PHE 67 2HE PHE 67 5.300 -6.560 6.867 505 HZ PHE 67 HZ PHE 67 6.013 -5.215 4.913 506 H GLY 68 H GLY 68 9.093 -3.982 9.051 507 HA2 GLY 68 2HA GLY 68 9.803 -1.513 7.744 508 HA3 GLY 68 1HA GLY 68 10.954 -1.967 9.002 509 H GLY 69 H GLY 69 11.993 -1.847 6.593 510 HA2 GLY 69 2HA GLY 69 12.946 -4.480 6.071 511 HA3 GLY 69 1HA GLY 69 11.787 -3.990 4.835 512 H VAL 70 H VAL 70 13.973 -4.349 3.612 513 HA VAL 70 HA VAL 70 15.505 -1.766 3.524 514 HB VAL 70 HB VAL 70 16.437 -4.540 2.652 515 HG11 VAL 70 1HG1 VAL 70 17.573 -2.651 1.524 516 HG12 VAL 70 2HG1 VAL 70 18.666 -3.452 2.648 517 HG13 VAL 70 3HG1 VAL 70 17.919 -1.919 3.089 518 HG21 VAL 70 3HG2 VAL 70 17.831 -4.459 4.742 519 HG22 VAL 70 1HG2 VAL 70 16.104 -4.547 5.079 520 HG23 VAL 70 2HG2 VAL 70 16.954 -3.013 5.236 521 H TYR 71 H TYR 71 15.351 -0.640 1.663 522 HA TYR 71 HA TYR 71 13.682 -1.538 -0.508 523 HB2 TYR 71 2HB TYR 71 15.498 0.880 -0.192 524 HB3 TYR 71 1HB TYR 71 14.429 0.629 -1.569 525 HD1 TYR 71 1HD TYR 71 11.922 0.120 -1.051 526 HD2 TYR 71 2HD TYR 71 14.585 2.013 1.760 527 HE1 TYR 71 1HE TYR 71 9.981 1.029 0.189 528 HE2 TYR 71 2HE TYR 71 12.629 2.922 2.983 529 HH TYR 71 HH TYR 71 9.333 2.478 1.772 530 H ASP 72 H ASP 72 14.346 -3.015 -1.944 531 HA ASP 72 HA ASP 72 17.122 -3.602 -2.462 532 HB2 ASP 72 2HB ASP 72 14.665 -4.493 -4.019 533 HB3 ASP 72 1HB ASP 72 16.256 -5.264 -4.003 534 H GLN 73 H GLN 73 14.511 -1.882 -4.100 535 HA GLN 73 HA GLN 73 16.342 -0.220 -5.560 536 HB2 GLN 73 2HB GLN 73 16.441 -2.368 -6.886 537 HB3 GLN 73 1HB GLN 73 14.715 -2.214 -7.190 538 HG2 GLN 73 2HG GLN 73 15.940 -1.345 -9.111 539 HG3 GLN 73 1HG GLN 73 15.153 0.002 -8.296 540 HE21 GLN 73 1HE2 GLN 73 16.638 1.684 -8.747 541 HE22 GLN 73 2HE2 GLN 73 18.274 1.642 -8.291 542 H VAL 74 H VAL 74 15.311 1.569 -6.461 543 HA VAL 74 HA VAL 74 12.354 1.709 -6.351 544 HB VAL 74 HB VAL 74 14.154 3.846 -5.119 545 HG11 VAL 74 1HG1 VAL 74 11.147 3.429 -5.096 546 HG12 VAL 74 2HG1 VAL 74 12.005 4.677 -5.992 547 HG13 VAL 74 3HG1 VAL 74 12.002 4.699 -4.237 548 HG21 VAL 74 3HG2 VAL 74 14.280 1.843 -3.721 549 HG22 VAL 74 1HG2 VAL 74 12.526 1.651 -3.776 550 HG23 VAL 74 2HG2 VAL 74 13.241 3.024 -2.929 551 H LYS 75 H LYS 75 11.557 2.715 -8.113 552 HA LYS 75 HA LYS 75 13.231 4.630 -9.642 553 HB2 LYS 75 2HB LYS 75 11.860 2.179 -10.791 554 HB3 LYS 75 1HB LYS 75 12.512 3.495 -11.767 555 HG2 LYS 75 2HG LYS 75 14.755 3.058 -10.769 556 HG3 LYS 75 1HG LYS 75 14.065 1.704 -9.872 557 HD2 LYS 75 2HD LYS 75 13.436 0.599 -11.979 558 HD3 LYS 75 1HD LYS 75 14.098 1.951 -12.898 559 HE2 LYS 75 2HE LYS 75 16.335 1.504 -11.950 560 HE3 LYS 75 1HE LYS 75 15.675 0.151 -11.033 561 HZ1 LYS 75 3HZ LYS 75 15.498 -1.130 -12.865 562 HZ2 LYS 75 1HZ LYS 75 16.758 -0.137 -13.417 563 HZ3 LYS 75 2HZ LYS 75 15.159 0.176 -13.899 564 H THR 76 H THR 76 12.090 6.374 -10.126 565 HA THR 76 HA THR 76 9.445 6.762 -9.279 566 HB THR 76 HB THR 76 9.563 8.902 -10.432 567 HG1 THR 76 1HG THR 76 10.467 8.142 -12.362 568 HG21 THR 76 3HG2 THR 76 11.654 9.756 -9.462 569 HG22 THR 76 1HG2 THR 76 12.273 8.114 -9.311 570 HG23 THR 76 2HG2 THR 76 10.883 8.624 -8.351 571 H ASN 77 H ASN 77 7.508 6.527 -10.225 572 HA ASN 77 HA ASN 77 5.890 5.826 -11.687 573 HB2 ASN 77 2HB ASN 77 7.771 6.935 -13.798 574 HB3 ASN 77 1HB ASN 77 6.028 6.710 -13.949 575 HD21 ASN 77 1HD2 ASN 77 5.606 7.645 -11.088 576 HD22 ASN 77 2HD2 ASN 77 5.803 9.330 -11.155 577 H ASP 78 H ASP 78 7.209 3.666 -10.902 578 HA ASP 78 HA ASP 78 7.210 1.923 -13.261 579 HB2 ASP 78 2HB ASP 78 9.634 2.286 -11.497 580 HB3 ASP 78 1HB ASP 78 9.467 1.000 -12.684 581 H LEU 79 H LEU 79 8.789 1.382 -10.148 582 HA LEU 79 HA LEU 79 6.529 0.094 -8.929 583 HB2 LEU 79 2HB LEU 79 7.108 -2.209 -9.111 584 HB3 LEU 79 1HB LEU 79 7.384 -1.591 -10.733 585 HG LEU 79 HG LEU 79 9.563 -2.026 -8.638 586 HD11 LEU 79 1HD1 LEU 79 10.252 -3.901 -10.055 587 HD12 LEU 79 2HD1 LEU 79 8.860 -3.624 -11.102 588 HD13 LEU 79 3HD1 LEU 79 8.620 -4.129 -9.427 589 HD21 LEU 79 3HD2 LEU 79 11.090 -1.653 -10.617 590 HD22 LEU 79 1HD2 LEU 79 10.161 -0.218 -10.196 591 HD23 LEU 79 2HD2 LEU 79 9.678 -1.206 -11.574 592 H ILE 80 H ILE 80 7.034 -0.822 -6.854 593 HA ILE 80 HA ILE 80 9.621 0.041 -5.653 594 HB ILE 80 HB ILE 80 6.889 0.521 -4.383 595 HG12 ILE 80 2HG1 ILE 80 8.919 2.540 -5.448 596 HG13 ILE 80 1HG1 ILE 80 7.453 2.089 -6.296 597 HG21 ILE 80 1HG2 ILE 80 8.655 0.022 -2.715 598 HG22 ILE 80 2HG2 ILE 80 8.273 1.734 -2.653 599 HG23 ILE 80 3HG2 ILE 80 9.729 1.192 -3.478 600 HD11 ILE 80 3HD1 ILE 80 6.101 2.880 -4.366 601 HD12 ILE 80 1HD1 ILE 80 7.075 4.165 -5.079 602 HD13 ILE 80 2HD1 ILE 80 7.584 3.409 -3.574 603 H GLU 81 H GLU 81 10.493 -1.458 -4.313 604 HA GLU 81 HA GLU 81 8.838 -3.588 -3.146 605 HB2 GLU 81 2HB GLU 81 10.382 -5.347 -4.042 606 HB3 GLU 81 1HB GLU 81 9.439 -4.561 -5.305 607 HG2 GLU 81 2HG GLU 81 11.351 -3.096 -5.843 608 HG3 GLU 81 1HG GLU 81 12.310 -3.869 -4.584 609 H TYR 82 H TYR 82 9.976 -4.734 -1.496 610 HA TYR 82 HA TYR 82 12.629 -3.919 -0.673 611 HB2 TYR 82 2HB TYR 82 11.903 -2.943 1.490 612 HB3 TYR 82 1HB TYR 82 11.368 -1.977 0.118 613 HD1 TYR 82 2HD TYR 82 8.988 -2.120 -0.697 614 HD2 TYR 82 1HD TYR 82 10.259 -4.046 2.929 615 HE1 TYR 82 2HE TYR 82 6.624 -2.362 0.009 616 HE2 TYR 82 1HE TYR 82 7.892 -4.292 3.622 617 HH TYR 82 HH TYR 82 5.765 -3.455 3.211 618 H THR 83 H THR 83 13.381 -5.152 1.157 619 HA THR 83 HA THR 83 11.910 -7.718 1.508 620 HB THR 83 HB THR 83 14.249 -8.431 2.386 621 HG1 THR 83 1HG THR 83 14.795 -6.064 2.439 622 HG21 THR 83 3HG2 THR 83 15.136 -8.726 0.091 623 HG22 THR 83 1HG2 THR 83 13.939 -7.580 -0.510 624 HG23 THR 83 2HG2 THR 83 13.417 -9.116 0.178 625 H ILE 84 H ILE 84 11.167 -8.280 3.442 626 HA ILE 84 HA ILE 84 11.451 -6.413 5.717 627 HB ILE 84 HB ILE 84 9.620 -8.808 5.292 628 HG12 ILE 84 2HG1 ILE 84 7.841 -6.954 5.181 629 HG13 ILE 84 1HG1 ILE 84 9.156 -5.791 5.091 630 HG21 ILE 84 1HG2 ILE 84 9.873 -6.830 7.592 631 HG22 ILE 84 2HG2 ILE 84 9.890 -8.584 7.666 632 HG23 ILE 84 3HG2 ILE 84 8.391 -7.742 7.311 633 HD11 ILE 84 3HD1 ILE 84 9.707 -6.404 2.916 634 HD12 ILE 84 1HD1 ILE 84 7.984 -6.721 2.903 635 HD13 ILE 84 2HD1 ILE 84 9.114 -8.054 3.087 636 H GLY 85 H GLY 85 11.849 -7.304 7.867 637 HA2 GLY 85 2HA GLY 85 14.209 -8.763 8.074 638 HA3 GLY 85 1HA GLY 85 13.059 -8.559 9.389 639 H ASP 86 H ASP 86 10.846 -9.965 8.402 640 HA ASP 86 HA ASP 86 11.499 -12.636 9.019 641 HB2 ASP 86 2HB ASP 86 9.248 -11.629 9.319 642 HB3 ASP 86 1HB ASP 86 9.055 -11.560 7.571 643 H GLY 87 H GLY 87 11.913 -10.857 6.152 644 HA2 GLY 87 2HA GLY 87 13.029 -11.585 4.227 645 HA3 GLY 87 1HA GLY 87 12.710 -13.261 4.660 646 H ARG 88 H ARG 88 9.939 -11.323 4.985 647 HA ARG 88 HA ARG 88 8.476 -12.686 3.015 648 HB2 ARG 88 2HB ARG 88 7.562 -11.399 5.018 649 HB3 ARG 88 1HB ARG 88 7.815 -9.917 4.102 650 HG2 ARG 88 2HG ARG 88 6.332 -10.752 2.323 651 HG3 ARG 88 1HG ARG 88 6.080 -12.249 3.219 652 HD2 ARG 88 2HD ARG 88 5.342 -9.465 4.165 653 HD3 ARG 88 1HD ARG 88 4.222 -10.685 3.564 654 HE ARG 88 HE ARG 88 5.493 -11.975 5.601 655 HH11 ARG 88 1HH2 ARG 88 3.842 -8.932 5.322 656 HH12 ARG 88 2HH2 ARG 88 3.274 -8.941 6.957 657 HH21 ARG 88 1HH1 ARG 88 4.749 -11.979 7.738 658 HH22 ARG 88 2HH1 ARG 88 3.786 -10.663 8.323 659 H LYS 89 H LYS 89 7.579 -11.881 0.992 660 HA LYS 89 HA LYS 89 9.359 -9.941 -0.427 661 HB2 LYS 89 2HB LYS 89 7.743 -12.245 -1.573 662 HB3 LYS 89 1HB LYS 89 8.868 -11.203 -2.449 663 HG2 LYS 89 2HG LYS 89 9.614 -13.071 -0.171 664 HG3 LYS 89 1HG LYS 89 9.858 -13.410 -1.882 665 HD2 LYS 89 2HD LYS 89 11.306 -11.282 -1.971 666 HD3 LYS 89 1HD LYS 89 11.231 -11.261 -0.209 667 HE2 LYS 89 2HE LYS 89 12.306 -13.542 -1.882 668 HE3 LYS 89 1HE LYS 89 13.273 -12.392 -0.959 669 HZ1 LYS 89 3HZ LYS 89 11.894 -14.715 -0.065 670 HZ2 LYS 89 1HZ LYS 89 11.410 -13.345 0.810 671 HZ3 LYS 89 2HZ LYS 89 13.053 -13.772 0.743 672 H VAL 90 H VAL 90 8.449 -8.164 -1.128 673 HA VAL 90 HA VAL 90 5.537 -8.057 -1.711 674 HB VAL 90 HB VAL 90 7.057 -5.962 -0.100 675 HG11 VAL 90 1HG1 VAL 90 4.766 -5.020 0.249 676 HG12 VAL 90 2HG1 VAL 90 4.119 -6.235 -0.852 677 HG13 VAL 90 3HG1 VAL 90 5.230 -5.005 -1.449 678 HG21 VAL 90 3HG2 VAL 90 6.713 -7.993 1.239 679 HG22 VAL 90 1HG2 VAL 90 5.014 -8.048 0.770 680 HG23 VAL 90 2HG2 VAL 90 5.611 -6.737 1.789 681 H ARG 91 H ARG 91 5.125 -7.061 -3.582 682 HA ARG 91 HA ARG 91 7.124 -5.224 -4.812 683 HB2 ARG 91 2HB ARG 91 5.693 -7.523 -6.192 684 HB3 ARG 91 1HB ARG 91 6.695 -6.311 -6.993 685 HG2 ARG 91 2HG ARG 91 8.643 -7.030 -5.641 686 HG3 ARG 91 1HG ARG 91 7.640 -8.249 -4.850 687 HD2 ARG 91 2HD ARG 91 8.924 -9.289 -6.661 688 HD3 ARG 91 1HD ARG 91 7.208 -9.301 -7.064 689 HE ARG 91 HE ARG 91 7.661 -7.875 -8.835 690 HH11 ARG 91 1HH2 ARG 91 10.294 -7.816 -6.573 691 HH12 ARG 91 2HH2 ARG 91 11.305 -6.828 -7.574 692 HH21 ARG 91 1HH1 ARG 91 8.981 -6.575 -10.133 693 HH22 ARG 91 2HH1 ARG 91 10.562 -6.128 -9.588 694 H ILE 92 H ILE 92 6.202 -3.431 -5.632 695 HA ILE 92 HA ILE 92 3.221 -3.334 -5.952 696 HB ILE 92 HB ILE 92 5.061 -1.111 -4.952 697 HG12 ILE 92 2HG1 ILE 92 2.954 -2.698 -3.401 698 HG13 ILE 92 1HG1 ILE 92 4.680 -3.024 -3.299 699 HG21 ILE 92 1HG2 ILE 92 2.877 0.053 -4.496 700 HG22 ILE 92 2HG2 ILE 92 2.031 -1.285 -5.263 701 HG23 ILE 92 3HG2 ILE 92 3.108 -0.262 -6.209 702 HD11 ILE 92 3HD1 ILE 92 3.334 -0.406 -2.571 703 HD12 ILE 92 1HD1 ILE 92 5.071 -0.704 -2.519 704 HD13 ILE 92 2HD1 ILE 92 3.991 -1.585 -1.440 705 H VAL 93 H VAL 93 2.832 -3.186 -8.083 706 HA VAL 93 HA VAL 93 4.706 -1.635 -9.822 707 HB VAL 93 HB VAL 93 2.726 -3.812 -10.602 708 HG11 VAL 93 1HG1 VAL 93 4.917 -2.379 -12.156 709 HG12 VAL 93 2HG1 VAL 93 3.185 -2.213 -12.430 710 HG13 VAL 93 3HG1 VAL 93 3.983 -3.744 -12.765 711 HG21 VAL 93 3HG2 VAL 93 5.749 -3.908 -10.283 712 HG22 VAL 93 1HG2 VAL 93 4.752 -5.211 -10.927 713 HG23 VAL 93 2HG2 VAL 93 4.579 -4.720 -9.244 714 H PHE 94 H PHE 94 3.942 0.184 -10.713 715 HA PHE 94 HA PHE 94 1.068 0.883 -10.399 716 HB2 PHE 94 2HB PHE 94 3.504 2.571 -11.088 717 HB3 PHE 94 1HB PHE 94 1.859 3.185 -10.920 718 HD1 PHE 94 2HD PHE 94 0.737 3.256 -8.710 719 HD2 PHE 94 1HD PHE 94 4.775 1.822 -9.101 720 HE1 PHE 94 2HE PHE 94 1.033 3.398 -6.252 721 HE2 PHE 94 1HE PHE 94 5.051 1.962 -6.644 722 HZ PHE 94 HZ PHE 94 3.192 2.745 -5.230 723 H THR 95 H THR 95 -0.199 0.571 -12.099 724 HA THR 95 HA THR 95 0.908 0.776 -14.865 725 HB THR 95 HB THR 95 -1.398 -0.984 -13.924 726 HG1 THR 95 1HG THR 95 0.029 -2.619 -13.946 727 HG21 THR 95 3HG2 THR 95 -1.098 -2.012 -16.179 728 HG22 THR 95 1HG2 THR 95 0.105 -0.784 -16.564 729 HG23 THR 95 2HG2 THR 95 -1.573 -0.320 -16.288 730 H HIS 96 H HIS 96 -0.386 1.800 -16.383 731 HA HIS 96 HA HIS 96 -2.951 2.976 -15.623 732 HB2 HIS 96 2HB HIS 96 -2.161 5.293 -16.109 733 HB3 HIS 96 1HB HIS 96 -1.382 4.608 -14.683 734 HD2 HIS 96 2HD HIS 96 -0.383 6.048 -18.118 735 HE1 HIS 96 1HE HIS 96 3.078 4.231 -16.522 736 HE2 HIS 96 2HE HIS 96 2.196 5.731 -18.372 737 H THR 97 H THR 97 -4.003 3.965 -17.425 738 HA THR 97 HA THR 97 -2.905 3.316 -20.119 739 HB THR 97 HB THR 97 -5.064 2.387 -20.781 740 HG1 THR 97 1HG THR 97 -6.244 3.670 -19.216 741 HG21 THR 97 3HG2 THR 97 -3.364 0.859 -19.768 742 HG22 THR 97 1HG2 THR 97 -5.016 0.316 -19.471 743 HG23 THR 97 2HG2 THR 97 -4.112 1.122 -18.192 744 H GLY 98 H GLY 98 -3.349 5.785 -18.420 745 HA2 GLY 98 2HA GLY 98 -3.649 7.995 -19.122 746 HA3 GLY 98 1HA GLY 98 -4.543 7.439 -20.531 747 H ASP 99 H ASP 99 -4.955 9.272 -17.959 748 HA ASP 99 HA ASP 99 -6.710 10.018 -16.703 749 HB2 ASP 99 2HB ASP 99 -8.383 8.546 -18.763 750 HB3 ASP 99 1HB ASP 99 -8.961 9.779 -17.647 751 H THR 100 H THR 100 -5.736 6.966 -16.696 752 HA THR 100 HA THR 100 -7.400 6.236 -14.380 753 HB THR 100 HB THR 100 -7.003 4.335 -16.733 754 HG1 THR 100 1HG THR 100 -9.037 6.118 -16.031 755 HG21 THR 100 3HG2 THR 100 -8.673 2.965 -15.521 756 HG22 THR 100 1HG2 THR 100 -8.701 4.153 -14.219 757 HG23 THR 100 2HG2 THR 100 -7.235 3.225 -14.534 758 H THR 101 H THR 101 -6.259 5.164 -12.859 759 HA THR 101 HA THR 101 -3.553 4.092 -13.519 760 HB THR 101 HB THR 101 -4.264 5.740 -11.062 761 HG1 THR 101 1HG THR 101 -4.122 7.070 -12.818 762 HG21 THR 101 3HG2 THR 101 -2.506 4.088 -10.599 763 HG22 THR 101 1HG2 THR 101 -1.784 5.691 -10.716 764 HG23 THR 101 2HG2 THR 101 -1.640 4.563 -12.061 765 H ASN 102 H ASN 102 -3.361 2.052 -12.909 766 HA ASN 102 HA ASN 102 -5.190 0.913 -10.844 767 HB2 ASN 102 2HB ASN 102 -3.696 -0.459 -13.100 768 HB3 ASN 102 1HB ASN 102 -4.776 -1.239 -11.944 769 HD21 ASN 102 1HD2 ASN 102 -4.804 -0.339 -15.062 770 HD22 ASN 102 2HD2 ASN 102 -6.415 0.167 -15.234 771 H ILE 103 H ILE 103 -4.231 0.567 -8.944 772 HA ILE 103 HA ILE 103 -1.276 0.302 -8.760 773 HB ILE 103 HB ILE 103 -3.373 0.574 -6.562 774 HG12 ILE 103 2HG1 ILE 103 -1.501 2.687 -7.731 775 HG13 ILE 103 1HG1 ILE 103 -3.220 2.579 -8.097 776 HG21 ILE 103 1HG2 ILE 103 -1.253 -0.481 -5.812 777 HG22 ILE 103 2HG2 ILE 103 -1.412 1.122 -5.131 778 HG23 ILE 103 3HG2 ILE 103 -0.341 0.853 -6.503 779 HD11 ILE 103 3HD1 ILE 103 -3.708 2.827 -5.642 780 HD12 ILE 103 1HD1 ILE 103 -2.921 4.234 -6.355 781 HD13 ILE 103 2HD1 ILE 103 -1.985 3.107 -5.379 782 H VAL 104 H VAL 104 -0.435 -1.717 -8.715 783 HA VAL 104 HA VAL 104 -2.144 -4.025 -7.930 784 HB VAL 104 HB VAL 104 0.494 -4.013 -9.462 785 HG11 VAL 104 1HG1 VAL 104 -0.217 -6.335 -10.064 786 HG12 VAL 104 2HG1 VAL 104 -1.612 -6.165 -9.002 787 HG13 VAL 104 3HG1 VAL 104 0.016 -6.147 -8.327 788 HG21 VAL 104 3HG2 VAL 104 -2.369 -4.162 -10.477 789 HG22 VAL 104 1HG2 VAL 104 -0.939 -4.448 -11.465 790 HG23 VAL 104 2HG2 VAL 104 -1.227 -2.854 -10.771 791 H GLU 105 H GLU 105 -1.641 -5.127 -6.102 792 HA GLU 105 HA GLU 105 1.031 -4.748 -4.828 793 HB2 GLU 105 2HB GLU 105 -1.676 -4.664 -3.443 794 HB3 GLU 105 1HB GLU 105 -0.106 -4.614 -2.640 795 HG2 GLU 105 2HG GLU 105 0.440 -2.524 -3.841 796 HG3 GLU 105 1HG GLU 105 -1.130 -2.580 -4.635 797 H SER 106 H SER 106 1.920 -6.718 -4.817 798 HA SER 106 HA SER 106 0.250 -9.154 -4.616 799 HB2 SER 106 2HB SER 106 1.964 -9.196 -6.348 800 HB3 SER 106 1HB SER 106 3.202 -8.730 -5.185 801 HG SER 106 HG SER 106 3.093 -10.683 -4.265 802 H PHE 107 H PHE 107 0.593 -10.683 -2.955 803 HA PHE 107 HA PHE 107 2.353 -9.929 -0.698 804 HB2 PHE 107 2HB PHE 107 0.045 -8.932 -0.344 805 HB3 PHE 107 1HB PHE 107 -0.601 -10.567 -0.312 806 HD1 PHE 107 1HD PHE 107 2.021 -8.388 1.249 807 HD2 PHE 107 2HD PHE 107 -0.580 -11.777 1.793 808 HE1 PHE 107 1HE PHE 107 2.688 -8.529 3.628 809 HE2 PHE 107 2HE PHE 107 0.096 -11.893 4.175 810 HZ PHE 107 HZ PHE 107 1.723 -10.281 5.087 811 H ASP 108 H ASP 108 3.134 -11.665 0.392 812 HA ASP 108 HA ASP 108 2.327 -14.392 -0.515 813 HB2 ASP 108 2HB ASP 108 4.646 -15.057 0.069 814 HB3 ASP 108 1HB ASP 108 4.575 -13.862 -1.224 815 HA PRO 109 HA PRO 109 1.402 -14.134 4.044 816 HB2 PRO 109 2HB PRO 109 -0.864 -15.640 4.143 817 HB3 PRO 109 1HB PRO 109 -0.901 -13.974 3.529 818 HG2 PRO 109 2HG PRO 109 -0.764 -16.538 1.971 819 HG3 PRO 109 1HG PRO 109 -1.815 -15.133 1.706 820 HD2 PRO 109 2HD PRO 109 0.500 -15.535 0.284 821 HD3 PRO 109 1HD PRO 109 -0.104 -13.898 0.630 822 H GLU 110 H GLU 110 1.359 -15.799 5.730 823 HA GLU 110 HA GLU 110 3.232 -17.918 5.206 824 HB2 GLU 110 2HB GLU 110 1.527 -17.349 7.653 825 HB3 GLU 110 1HB GLU 110 2.860 -18.500 7.585 826 HG2 GLU 110 2HG GLU 110 4.419 -16.678 7.012 827 HG3 GLU 110 1HG GLU 110 3.097 -15.517 7.063 828 H GLU 111 H GLU 111 2.775 -20.171 5.862 829 HA GLU 111 HA GLU 111 0.389 -21.160 4.474 830 HB2 GLU 111 2HB GLU 111 2.629 -22.230 4.179 831 HB3 GLU 111 1HB GLU 111 2.591 -22.732 5.868 832 HG2 GLU 111 2HG GLU 111 0.551 -24.061 5.446 833 HG3 GLU 111 1HG GLU 111 0.525 -23.513 3.774 834 H THR 112 H THR 112 1.550 -20.762 7.756 835 HA THR 112 HA THR 112 -0.180 -22.556 9.080 836 HB THR 112 HB THR 112 0.287 -21.234 11.092 837 HG1 THR 112 1HG THR 112 0.113 -19.174 10.303 838 HG21 THR 112 3HG2 THR 112 2.700 -21.400 9.262 839 HG22 THR 112 1HG2 THR 112 2.065 -22.725 10.238 840 HG23 THR 112 2HG2 THR 112 2.745 -21.299 11.021 841 H ASN 113 H ASN 113 -0.581 -19.098 8.263 842 HA ASN 113 HA ASN 113 -3.270 -19.045 9.382 843 HB2 ASN 113 2HB ASN 113 -3.226 -16.642 8.545 844 HB3 ASN 113 1HB ASN 113 -1.966 -17.051 9.708 845 HD21 ASN 113 1HD2 ASN 113 -0.527 -15.384 8.883 846 HD22 ASN 113 2HD2 ASN 113 0.243 -15.548 7.380 847 HA PRO 114 HA PRO 114 -5.198 -20.108 5.473 848 HB2 PRO 114 2HB PRO 114 -7.731 -19.093 5.776 849 HB3 PRO 114 1HB PRO 114 -7.157 -20.483 6.726 850 HG2 PRO 114 2HG PRO 114 -7.224 -17.577 7.523 851 HG3 PRO 114 1HG PRO 114 -7.811 -18.985 8.432 852 HD2 PRO 114 2HD PRO 114 -5.368 -17.905 8.956 853 HD3 PRO 114 1HD PRO 114 -5.619 -19.667 9.033 854 H ARG 115 H ARG 115 -5.268 -19.258 3.460 855 HA ARG 115 HA ARG 115 -4.412 -16.585 2.969 856 HB2 ARG 115 2HB ARG 115 -5.642 -18.623 1.082 857 HB3 ARG 115 1HB ARG 115 -4.831 -17.136 0.584 858 HG2 ARG 115 2HG ARG 115 -2.754 -17.897 1.679 859 HG3 ARG 115 1HG ARG 115 -3.553 -19.386 2.173 860 HD2 ARG 115 2HD ARG 115 -3.201 -18.497 -0.709 861 HD3 ARG 115 1HD ARG 115 -2.185 -19.680 0.113 862 HE ARG 115 HE ARG 115 -4.878 -20.472 0.378 863 HH11 ARG 115 1HH2 ARG 115 -2.394 -20.117 -2.021 864 HH12 ARG 115 2HH2 ARG 115 -3.022 -21.362 -3.045 865 HH21 ARG 115 1HH1 ARG 115 -5.698 -22.095 -0.965 866 HH22 ARG 115 2HH1 ARG 115 -4.892 -22.482 -2.448 867 H GLU 116 H GLU 116 -7.582 -18.187 2.834 868 HA GLU 116 HA GLU 116 -9.121 -16.283 1.588 869 HB2 GLU 116 2HB GLU 116 -9.860 -17.950 4.009 870 HB3 GLU 116 1HB GLU 116 -11.016 -17.139 2.954 871 HG2 GLU 116 2HG GLU 116 -10.206 -18.470 1.038 872 HG3 GLU 116 1HG GLU 116 -9.049 -19.283 2.091 873 H LEU 117 H LEU 117 -8.221 -16.342 5.050 874 HA LEU 117 HA LEU 117 -9.686 -14.042 5.787 875 HB2 LEU 117 2HB LEU 117 -8.798 -15.702 7.400 876 HB3 LEU 117 1HB LEU 117 -7.159 -15.195 7.007 877 HG LEU 117 HG LEU 117 -7.681 -12.903 7.859 878 HD11 LEU 117 1HD1 LEU 117 -10.001 -12.548 7.623 879 HD12 LEU 117 2HD1 LEU 117 -9.854 -12.805 9.352 880 HD13 LEU 117 3HD1 LEU 117 -10.424 -14.112 8.317 881 HD21 LEU 117 3HD2 LEU 117 -8.283 -15.140 9.820 882 HD22 LEU 117 1HD2 LEU 117 -7.753 -13.513 10.250 883 HD23 LEU 117 2HD2 LEU 117 -6.676 -14.581 9.354 884 H GLN 118 H GLN 118 -6.291 -14.495 4.815 885 HA GLN 118 HA GLN 118 -5.490 -11.798 5.124 886 HB2 GLN 118 2HB GLN 118 -4.380 -13.923 3.259 887 HB3 GLN 118 1HB GLN 118 -3.555 -12.438 3.734 888 HG2 GLN 118 2HG GLN 118 -4.451 -14.604 5.665 889 HG3 GLN 118 1HG GLN 118 -2.812 -14.427 5.054 890 HE21 GLN 118 1HE2 GLN 118 -4.551 -13.800 7.765 891 HE22 GLN 118 2HE2 GLN 118 -3.762 -12.399 8.308 892 H GLN 119 H GLN 119 -6.497 -13.604 2.201 893 HA GLN 119 HA GLN 119 -6.241 -11.582 0.333 894 HB2 GLN 119 2HB GLN 119 -6.845 -13.960 -0.150 895 HB3 GLN 119 1HB GLN 119 -8.463 -13.658 0.466 896 HG2 GLN 119 2HG GLN 119 -7.311 -11.985 -1.817 897 HG3 GLN 119 1HG GLN 119 -8.111 -13.519 -2.125 898 HE21 GLN 119 1HE2 GLN 119 -10.410 -13.680 -1.064 899 HE22 GLN 119 2HE2 GLN 119 -11.359 -12.274 -1.128 900 H SER 120 H SER 120 -9.096 -12.346 2.311 901 HA SER 120 HA SER 120 -10.695 -10.201 1.409 902 HB2 SER 120 2HB SER 120 -10.779 -11.589 4.103 903 HB3 SER 120 1HB SER 120 -12.071 -10.632 3.379 904 HG SER 120 HG SER 120 -11.675 -13.177 3.093 905 H GLY 121 H GLY 121 -8.321 -10.450 4.061 906 HA2 GLY 121 2HA GLY 121 -8.902 -7.980 5.308 907 HA3 GLY 121 1HA GLY 121 -7.366 -8.830 5.395 908 H TRP 122 H TRP 122 -6.364 -8.752 2.895 909 HA TRP 122 HA TRP 122 -5.410 -6.092 2.639 910 HB2 TRP 122 2HB TRP 122 -5.264 -8.496 0.775 911 HB3 TRP 122 1HB TRP 122 -4.479 -6.964 0.395 912 HD1 TRP 122 HD TRP 122 -3.936 -10.105 2.364 913 HE1 TRP 122 1HE TRP 122 -1.800 -9.892 3.784 914 HE3 TRP 122 3HE TRP 122 -2.996 -5.125 1.788 915 HZ2 TRP 122 2HZ TRP 122 0.066 -7.868 4.569 916 HZ3 TRP 122 3HZ TRP 122 -1.026 -4.082 2.866 917 HH2 TRP 122 HH TRP 122 0.509 -5.450 4.251 918 H GLN 123 H GLN 123 -7.942 -7.863 0.910 919 HA GLN 123 HA GLN 123 -8.433 -5.730 -0.969 920 HB2 GLN 123 2HB GLN 123 -9.016 -8.370 -1.030 921 HB3 GLN 123 1HB GLN 123 -10.560 -7.804 -0.407 922 HG2 GLN 123 2HG GLN 123 -9.200 -6.911 -2.986 923 HG3 GLN 123 1HG GLN 123 -10.647 -7.908 -2.853 924 HE21 GLN 123 1HE2 GLN 123 -12.649 -6.839 -2.124 925 HE22 GLN 123 2HE2 GLN 123 -12.797 -5.151 -2.192 926 H ALA 124 H ALA 124 -9.775 -6.663 2.165 927 HA ALA 124 HA ALA 124 -12.082 -5.063 2.172 928 HB1 ALA 124 1HB ALA 124 -11.836 -5.144 4.694 929 HB2 ALA 124 2HB ALA 124 -10.282 -5.941 4.444 930 HB3 ALA 124 3HB ALA 124 -11.769 -6.719 3.906 931 H ILE 125 H ILE 125 -8.819 -4.266 3.393 932 HA ILE 125 HA ILE 125 -9.464 -1.621 4.181 933 HB ILE 125 HB ILE 125 -7.012 -1.281 4.267 934 HG12 ILE 125 2HG1 ILE 125 -6.803 -4.092 3.118 935 HG13 ILE 125 1HG1 ILE 125 -6.449 -2.638 2.202 936 HG21 ILE 125 1HG2 ILE 125 -7.967 -3.969 5.326 937 HG22 ILE 125 2HG2 ILE 125 -8.177 -2.415 6.128 938 HG23 ILE 125 3HG2 ILE 125 -6.564 -3.092 5.931 939 HD11 ILE 125 3HD1 ILE 125 -4.362 -3.507 3.029 940 HD12 ILE 125 1HD1 ILE 125 -4.998 -3.612 4.668 941 HD13 ILE 125 2HD1 ILE 125 -4.718 -2.032 3.932 942 H LEU 126 H LEU 126 -8.411 -2.980 1.116 943 HA LEU 126 HA LEU 126 -7.824 -0.517 -0.180 944 HB2 LEU 126 2HB LEU 126 -8.509 -3.298 -1.175 945 HB3 LEU 126 1HB LEU 126 -8.305 -1.983 -2.323 946 HG LEU 126 HG LEU 126 -6.203 -2.873 -0.302 947 HD11 LEU 126 1HD1 LEU 126 -4.988 -3.728 -2.320 948 HD12 LEU 126 2HD1 LEU 126 -6.410 -3.382 -3.299 949 HD13 LEU 126 3HD1 LEU 126 -6.498 -4.585 -2.010 950 HD21 LEU 126 3HD2 LEU 126 -5.421 -0.742 -0.680 951 HD22 LEU 126 1HD2 LEU 126 -6.358 -0.519 -2.149 952 HD23 LEU 126 2HD2 LEU 126 -4.825 -1.389 -2.202 953 H ASN 127 H ASN 127 -10.825 -2.334 0.244 954 HA ASN 127 HA ASN 127 -12.419 -0.874 -1.582 955 HB2 ASN 127 2HB ASN 127 -13.241 -2.194 1.024 956 HB3 ASN 127 1HB ASN 127 -14.329 -1.716 -0.279 957 HD21 ASN 127 1HD2 ASN 127 -13.304 -4.471 0.892 958 HD22 ASN 127 2HD2 ASN 127 -12.945 -5.349 -0.511 959 H SER 128 H SER 128 -11.625 -0.306 1.822 960 HA SER 128 HA SER 128 -13.324 1.911 2.259 961 HB2 SER 128 2HB SER 128 -12.222 0.683 4.089 962 HB3 SER 128 1HB SER 128 -10.654 1.276 3.550 963 HG SER 128 HG SER 128 -11.174 3.270 4.197 964 H PHE 129 H PHE 129 -10.004 1.662 1.046 965 HA PHE 129 HA PHE 129 -9.349 4.387 1.008 966 HB2 PHE 129 2HB PHE 129 -7.716 2.562 0.608 967 HB3 PHE 129 1HB PHE 129 -8.469 2.234 -0.948 968 HD1 PHE 129 2HD PHE 129 -6.528 4.744 1.004 969 HD2 PHE 129 1HD PHE 129 -8.086 3.708 -2.872 970 HE1 PHE 129 2HE PHE 129 -5.164 6.536 -0.032 971 HE2 PHE 129 1HE PHE 129 -6.723 5.504 -3.896 972 HZ PHE 129 HZ PHE 129 -5.263 6.916 -2.479 973 H LYS 130 H LYS 130 -10.946 2.384 -1.456 974 HA LYS 130 HA LYS 130 -11.163 4.358 -3.468 975 HB2 LYS 130 2HB LYS 130 -12.939 1.969 -2.862 976 HB3 LYS 130 1HB LYS 130 -12.977 2.905 -4.356 977 HG2 LYS 130 2HG LYS 130 -10.658 2.299 -4.855 978 HG3 LYS 130 1HG LYS 130 -10.510 1.467 -3.308 979 HD2 LYS 130 2HD LYS 130 -10.884 -0.176 -5.075 980 HD3 LYS 130 1HD LYS 130 -12.287 -0.135 -4.008 981 HE2 LYS 130 2HE LYS 130 -13.621 0.998 -5.645 982 HE3 LYS 130 1HE LYS 130 -12.210 1.519 -6.567 983 HZ1 LYS 130 3HZ LYS 130 -13.336 -0.313 -7.632 984 HZ2 LYS 130 1HZ LYS 130 -13.142 -1.276 -6.249 985 HZ3 LYS 130 2HZ LYS 130 -11.780 -0.781 -7.136 986 H SER 131 H SER 131 -13.281 3.471 -0.772 987 HA SER 131 HA SER 131 -15.423 5.241 -1.453 988 HB2 SER 131 2HB SER 131 -14.689 4.052 1.237 989 HB3 SER 131 1HB SER 131 -16.237 4.779 0.810 990 HG SER 131 HG SER 131 -16.351 3.161 -0.876 991 H TYR 132 H TYR 132 -12.488 5.544 0.491 992 HA TYR 132 HA TYR 132 -13.096 7.932 1.845 993 HB2 TYR 132 2HB TYR 132 -11.154 6.465 2.361 994 HB3 TYR 132 1HB TYR 132 -10.384 6.974 0.861 995 HD1 TYR 132 2HD TYR 132 -9.538 9.298 0.584 996 HD2 TYR 132 1HD TYR 132 -11.339 8.017 4.276 997 HE1 TYR 132 2HE TYR 132 -8.662 11.321 1.720 998 HE2 TYR 132 1HE TYR 132 -10.465 10.045 5.400 999 HH TYR 132 HH TYR 132 -9.777 12.488 4.497 1000 H THR 133 H THR 133 -11.306 7.485 -1.219 1001 HA THR 133 HA THR 133 -10.999 10.258 -1.762 1002 HB THR 133 HB THR 133 -9.559 8.685 -2.903 1003 HG1 THR 133 1HG THR 133 -11.233 10.364 -4.248 1004 HG21 THR 133 3HG2 THR 133 -11.094 6.763 -2.951 1005 HG22 THR 133 1HG2 THR 133 -10.429 7.076 -4.547 1006 HG23 THR 133 2HG2 THR 133 -12.079 7.564 -4.169 1007 H GLU 134 H GLU 134 -13.560 7.952 -2.477 1008 HA GLU 134 HA GLU 134 -14.985 9.605 -4.335 1009 HB2 GLU 134 2HB GLU 134 -15.253 7.130 -4.139 1010 HB3 GLU 134 1HB GLU 134 -16.035 7.357 -2.577 1011 HG2 GLU 134 2HG GLU 134 -17.828 8.675 -3.643 1012 HG3 GLU 134 1HG GLU 134 -17.027 8.528 -5.204 1013 H ASN 135 H ASN 135 -15.345 8.959 -0.850 1014 HA ASN 135 HA ASN 135 -17.576 10.667 -0.433 1015 HB2 ASN 135 2HB ASN 135 -15.458 9.774 1.544 1016 HB3 ASN 135 1HB ASN 135 -17.043 10.435 1.951 1017 HD21 ASN 135 1HD2 ASN 135 -18.427 8.976 -0.257 1018 HD22 ASN 135 2HD2 ASN 135 -18.471 7.349 0.224 1019 H ASN 136 H ASN 136 -14.148 11.255 -0.668 1020 HA ASN 136 HA ASN 136 -13.999 13.719 0.716 1021 HB2 ASN 136 2HB ASN 136 -12.020 12.385 0.022 1022 HB3 ASN 136 1HB ASN 136 -12.357 12.778 -1.662 1023 HD21 ASN 136 1HD2 ASN 136 -10.287 13.943 -1.835 1024 HD22 ASN 136 2HD2 ASN 136 -10.090 15.468 -1.115 1025 H LEU 137 H LEU 137 -14.682 12.942 -2.682 1026 HA LEU 137 HA LEU 137 -14.951 15.704 -3.495 1027 HB2 LEU 137 2HB LEU 137 -15.934 13.194 -4.908 1028 HB3 LEU 137 1HB LEU 137 -15.660 14.777 -5.635 1029 HG LEU 137 HG LEU 137 -13.521 12.996 -4.407 1030 HD11 LEU 137 1HD1 LEU 137 -12.736 12.741 -6.738 1031 HD12 LEU 137 2HD1 LEU 137 -14.103 13.703 -7.301 1032 HD13 LEU 137 3HD1 LEU 137 -14.380 12.134 -6.544 1033 HD21 LEU 137 3HD2 LEU 137 -12.714 15.220 -4.107 1034 HD22 LEU 137 1HD2 LEU 137 -13.393 15.775 -5.637 1035 HD23 LEU 137 2HD2 LEU 137 -11.977 14.723 -5.620 1036 H GLU 138 H GLU 138 -16.766 16.913 -3.693 1037 HA GLU 138 HA GLU 138 -19.072 16.226 -2.123 1038 HB2 GLU 138 2HB GLU 138 -18.582 18.512 -4.069 1039 HB3 GLU 138 1HB GLU 138 -19.968 18.390 -2.986 1040 HG2 GLU 138 2HG GLU 138 -18.344 19.822 -1.901 1041 HG3 GLU 138 1HG GLU 138 -18.346 18.290 -1.032 1042 H HIS 139 H HIS 139 -21.230 15.978 -2.870 1043 HA HIS 139 HA HIS 139 -21.557 14.194 -5.029 1044 HB2 HIS 139 2HB HIS 139 -23.606 15.914 -3.586 1045 HB3 HIS 139 1HB HIS 139 -24.000 14.573 -4.661 1046 HD2 HIS 139 2HD HIS 139 -23.287 11.974 -3.615 1047 HE1 HIS 139 1HE HIS 139 -22.558 13.357 0.307 1048 HE2 HIS 139 2HE HIS 139 -22.872 11.287 -1.130 1049 H HIS 140 H HIS 140 -23.537 17.122 -5.009 1050 HA HIS 140 HA HIS 140 -24.214 18.474 -6.750 1051 HB2 HIS 140 2HB HIS 140 -21.202 18.417 -7.150 1052 HB3 HIS 140 1HB HIS 140 -22.275 19.563 -7.954 1053 HD2 HIS 140 2HD HIS 140 -22.925 21.781 -6.415 1054 HE1 HIS 140 1HE HIS 140 -21.384 20.392 -2.740 1055 HE2 HIS 140 2HE HIS 140 -22.415 22.385 -3.928 1056 H HIS 141 H HIS 141 -21.678 17.755 -8.933 1057 HA HIS 141 HA HIS 141 -21.713 16.871 -11.057 1058 HB2 HIS 141 2HB HIS 141 -23.125 14.662 -9.520 1059 HB3 HIS 141 1HB HIS 141 -22.429 14.479 -11.130 1060 HD2 HIS 141 2HD HIS 141 -19.905 16.604 -9.415 1061 HE1 HIS 141 1HE HIS 141 -18.835 12.678 -8.294 1062 HE2 HIS 141 2HE HIS 141 -18.053 15.091 -8.368 1063 H HIS 142 H HIS 142 -24.650 15.095 -10.484 1064 HA HIS 142 HA HIS 142 -25.990 16.300 -12.709 1065 HB2 HIS 142 2HB HIS 142 -27.885 14.856 -12.002 1066 HB3 HIS 142 1HB HIS 142 -26.371 13.959 -12.094 1067 HD2 HIS 142 2HD HIS 142 -28.962 15.094 -9.393 1068 HE1 HIS 142 1HE HIS 142 -25.954 12.873 -7.435 1069 HE2 HIS 142 2HE HIS 142 -28.228 13.968 -7.155 1070 H HIS 143 H HIS 143 -27.511 17.895 -12.745 1071 HA HIS 143 HA HIS 143 -27.734 19.687 -10.516 1072 HB2 HIS 143 2HB HIS 143 -29.338 19.538 -13.092 1073 HB3 HIS 143 1HB HIS 143 -29.318 20.901 -11.972 1074 HD2 HIS 143 2HD HIS 143 -26.729 22.252 -11.829 1075 HE1 HIS 143 1HE HIS 143 -25.321 20.582 -15.441 1076 HE2 HIS 143 2HE HIS 143 -24.887 22.357 -13.677 1077 H HIS 144 H HIS 144 -29.340 19.900 -9.021 1078 HA HIS 144 HA HIS 144 -30.991 17.691 -8.393 1079 HB2 HIS 144 2HB HIS 144 -31.242 20.576 -7.481 1080 HB3 HIS 144 1HB HIS 144 -31.984 19.177 -6.702 1081 HD2 HIS 144 2HD HIS 144 -28.726 21.139 -6.491 1082 HE1 HIS 144 1HE HIS 144 -27.901 17.376 -4.766 1083 HE2 HIS 144 2HE HIS 144 -27.032 19.741 -5.081 Start of MODEL 17 1 H1 GLY 1 1HT GLY 1 -3.779 -16.002 -12.260 2 H2 GLY 1 2HT GLY 1 -2.799 -17.390 -12.218 3 H3 GLY 1 3HT GLY 1 -2.279 -15.956 -11.472 4 HA2 GLY 1 2HA GLY 1 -4.672 -16.411 -10.277 5 HA3 GLY 1 1HA GLY 1 -3.982 -18.026 -10.461 6 H ASN 2 H ASN 2 -1.326 -17.658 -10.214 7 HA ASN 2 HA ASN 2 0.257 -17.735 -8.536 8 HB2 ASN 2 2HB ASN 2 0.887 -15.506 -7.729 9 HB3 ASN 2 1HB ASN 2 0.494 -15.459 -9.442 10 HD21 ASN 2 1HD2 ASN 2 -0.609 -14.472 -6.229 11 HD22 ASN 2 2HD2 ASN 2 -1.834 -13.435 -6.780 12 H LYS 3 H LYS 3 0.421 -16.252 -6.101 13 HA LYS 3 HA LYS 3 -1.183 -17.954 -4.402 14 HB2 LYS 3 2HB LYS 3 0.565 -15.568 -3.718 15 HB3 LYS 3 1HB LYS 3 -0.049 -16.775 -2.590 16 HG2 LYS 3 2HG LYS 3 1.184 -18.546 -3.807 17 HG3 LYS 3 1HG LYS 3 1.799 -17.336 -4.932 18 HD2 LYS 3 2HD LYS 3 2.901 -16.161 -3.032 19 HD3 LYS 3 1HD LYS 3 2.338 -17.430 -1.952 20 HE2 LYS 3 2HE LYS 3 3.589 -19.114 -3.230 21 HE3 LYS 3 1HE LYS 3 4.146 -17.859 -4.341 22 HZ1 LYS 3 3HZ LYS 3 4.746 -16.860 -1.894 23 HZ2 LYS 3 1HZ LYS 3 5.839 -17.619 -2.944 24 HZ3 LYS 3 2HZ LYS 3 5.081 -18.515 -1.714 25 H ILE 4 H ILE 4 -0.831 -14.406 -4.344 26 HA ILE 4 HA ILE 4 -3.757 -14.013 -4.302 27 HB ILE 4 HB ILE 4 -1.882 -12.895 -2.166 28 HG12 ILE 4 2HG1 ILE 4 -4.258 -14.793 -1.952 29 HG13 ILE 4 1HG1 ILE 4 -2.575 -15.269 -1.822 30 HG21 ILE 4 1HG2 ILE 4 -3.540 -11.197 -2.785 31 HG22 ILE 4 2HG2 ILE 4 -4.004 -11.877 -1.240 32 HG23 ILE 4 3HG2 ILE 4 -4.834 -12.385 -2.707 33 HD11 ILE 4 3HD1 ILE 4 -3.600 -15.046 0.386 34 HD12 ILE 4 1HD1 ILE 4 -3.962 -13.358 0.065 35 HD13 ILE 4 2HD1 ILE 4 -2.289 -13.885 0.170 36 H THR 5 H THR 5 -4.335 -12.294 -5.471 37 HA THR 5 HA THR 5 -2.404 -10.128 -6.056 38 HB THR 5 HB THR 5 -4.097 -11.512 -8.188 39 HG1 THR 5 1HG THR 5 -2.506 -12.858 -8.106 40 HG21 THR 5 3HG2 THR 5 -2.709 -10.129 -9.730 41 HG22 THR 5 1HG2 THR 5 -1.984 -9.327 -8.339 42 HG23 THR 5 2HG2 THR 5 -3.706 -9.135 -8.670 43 H VAL 6 H VAL 6 -3.333 -8.185 -5.940 44 HA VAL 6 HA VAL 6 -6.273 -7.858 -6.119 45 HB VAL 6 HB VAL 6 -6.184 -6.367 -4.091 46 HG11 VAL 6 1HG1 VAL 6 -6.167 -8.194 -2.446 47 HG12 VAL 6 2HG1 VAL 6 -5.316 -9.238 -3.584 48 HG13 VAL 6 3HG1 VAL 6 -6.966 -8.721 -3.927 49 HG21 VAL 6 3HG2 VAL 6 -3.776 -5.875 -4.070 50 HG22 VAL 6 1HG2 VAL 6 -3.402 -7.576 -3.800 51 HG23 VAL 6 2HG2 VAL 6 -4.221 -6.650 -2.554 52 H GLU 7 H GLU 7 -6.901 -5.757 -6.622 53 HA GLU 7 HA GLU 7 -4.878 -3.767 -7.320 54 HB2 GLU 7 2HB GLU 7 -5.535 -3.617 -9.671 55 HB3 GLU 7 1HB GLU 7 -4.996 -5.252 -9.305 56 HG2 GLU 7 2HG GLU 7 -6.958 -5.859 -10.392 57 HG3 GLU 7 1HG GLU 7 -7.676 -5.581 -8.813 58 H VAL 8 H VAL 8 -5.884 -1.739 -8.067 59 HA VAL 8 HA VAL 8 -8.716 -1.368 -7.386 60 HB VAL 8 HB VAL 8 -8.145 0.593 -5.913 61 HG11 VAL 8 1HG1 VAL 8 -7.667 -0.720 -3.924 62 HG12 VAL 8 2HG1 VAL 8 -7.026 -2.044 -4.889 63 HG13 VAL 8 3HG1 VAL 8 -8.738 -1.652 -4.962 64 HG21 VAL 8 3HG2 VAL 8 -5.854 0.708 -4.971 65 HG22 VAL 8 1HG2 VAL 8 -5.838 0.961 -6.711 66 HG23 VAL 8 2HG2 VAL 8 -5.346 -0.593 -6.044 67 H THR 9 H THR 9 -9.529 0.652 -8.110 68 HA THR 9 HA THR 9 -8.073 1.745 -10.466 69 HB THR 9 HB THR 9 -10.310 0.788 -10.902 70 HG1 THR 9 1HG THR 9 -9.516 2.639 -12.026 71 HG21 THR 9 3HG2 THR 9 -11.505 3.029 -9.242 72 HG22 THR 9 1HG2 THR 9 -11.230 1.429 -8.548 73 HG23 THR 9 2HG2 THR 9 -12.322 1.627 -9.917 74 H VAL 10 H VAL 10 -7.248 3.751 -10.325 75 HA VAL 10 HA VAL 10 -8.361 5.695 -8.351 76 HB VAL 10 HB VAL 10 -5.404 5.267 -8.947 77 HG11 VAL 10 1HG1 VAL 10 -5.951 7.591 -8.355 78 HG12 VAL 10 2HG1 VAL 10 -5.105 6.819 -7.019 79 HG13 VAL 10 3HG1 VAL 10 -6.852 7.038 -6.943 80 HG21 VAL 10 3HG2 VAL 10 -5.292 4.386 -6.631 81 HG22 VAL 10 1HG2 VAL 10 -6.324 3.386 -7.649 82 HG23 VAL 10 2HG2 VAL 10 -7.046 4.513 -6.499 83 H TYR 11 H TYR 11 -8.846 7.583 -9.250 84 HA TYR 11 HA TYR 11 -8.062 8.150 -12.059 85 HB2 TYR 11 2HB TYR 11 -10.158 9.420 -10.262 86 HB3 TYR 11 1HB TYR 11 -9.885 9.803 -11.961 87 HD1 TYR 11 2HD TYR 11 -11.140 7.245 -9.594 88 HD2 TYR 11 1HD TYR 11 -10.528 8.221 -13.739 89 HE1 TYR 11 2HE TYR 11 -12.585 5.345 -10.259 90 HE2 TYR 11 1HE TYR 11 -11.970 6.319 -14.397 91 HH TYR 11 HH TYR 11 -13.568 4.285 -11.943 92 H ALA 12 H ALA 12 -5.933 8.862 -11.640 93 HA ALA 12 HA ALA 12 -5.685 11.653 -11.055 94 HB1 ALA 12 1HB ALA 12 -5.832 10.831 -8.730 95 HB2 ALA 12 2HB ALA 12 -4.226 11.466 -9.078 96 HB3 ALA 12 3HB ALA 12 -4.495 9.722 -9.035 97 H ALA 13 H ALA 13 -3.570 12.445 -11.485 98 HA ALA 13 HA ALA 13 -2.244 11.134 -13.596 99 HB1 ALA 13 1HB ALA 13 -2.134 13.570 -13.250 100 HB2 ALA 13 2HB ALA 13 -0.515 12.876 -13.322 101 HB3 ALA 13 3HB ALA 13 -1.214 13.326 -11.765 102 H ILE 14 H ILE 14 -0.550 9.728 -13.649 103 HA ILE 14 HA ILE 14 0.065 8.133 -11.522 104 HB ILE 14 HB ILE 14 0.559 7.573 -13.885 105 HG12 ILE 14 2HG1 ILE 14 2.730 6.417 -13.485 106 HG13 ILE 14 1HG1 ILE 14 2.985 7.379 -12.036 107 HG21 ILE 14 1HG2 ILE 14 1.571 9.845 -14.437 108 HG22 ILE 14 2HG2 ILE 14 2.508 8.469 -15.020 109 HG23 ILE 14 3HG2 ILE 14 3.030 9.339 -13.577 110 HD11 ILE 14 3HD1 ILE 14 0.476 5.725 -12.275 111 HD12 ILE 14 1HD1 ILE 14 1.356 6.215 -10.828 112 HD13 ILE 14 2HD1 ILE 14 1.997 4.961 -11.865 113 H GLU 15 H GLU 15 1.638 11.090 -12.522 114 HA GLU 15 HA GLU 15 3.910 10.902 -10.817 115 HB2 GLU 15 2HB GLU 15 3.737 12.380 -12.837 116 HB3 GLU 15 1HB GLU 15 2.606 13.407 -11.959 117 HG2 GLU 15 2HG GLU 15 4.331 13.869 -10.250 118 HG3 GLU 15 1HG GLU 15 5.454 12.800 -11.082 119 H LYS 16 H LYS 16 0.641 12.178 -10.364 120 HA LYS 16 HA LYS 16 1.209 13.602 -7.944 121 HB2 LYS 16 2HB LYS 16 -0.739 14.071 -9.447 122 HB3 LYS 16 1HB LYS 16 -1.459 12.539 -8.954 123 HG2 LYS 16 2HG LYS 16 -1.506 13.301 -6.602 124 HG3 LYS 16 1HG LYS 16 -0.738 14.819 -7.075 125 HD2 LYS 16 2HD LYS 16 -2.683 15.341 -8.517 126 HD3 LYS 16 1HD LYS 16 -3.446 13.827 -8.025 127 HE2 LYS 16 2HE LYS 16 -4.309 15.727 -6.692 128 HE3 LYS 16 1HE LYS 16 -3.439 14.580 -5.671 129 HZ1 LYS 16 3HZ LYS 16 -1.954 16.799 -6.885 130 HZ2 LYS 16 1HZ LYS 16 -1.677 15.990 -5.420 131 HZ3 LYS 16 2HZ LYS 16 -2.936 17.123 -5.538 132 H VAL 17 H VAL 17 -0.403 10.471 -8.580 133 HA VAL 17 HA VAL 17 -0.801 9.772 -5.880 134 HB VAL 17 HB VAL 17 -1.997 8.704 -7.751 135 HG11 VAL 17 1HG1 VAL 17 -0.910 7.107 -9.209 136 HG12 VAL 17 2HG1 VAL 17 0.616 7.262 -8.343 137 HG13 VAL 17 3HG1 VAL 17 -0.019 8.615 -9.268 138 HG21 VAL 17 3HG2 VAL 17 -1.749 7.519 -5.535 139 HG22 VAL 17 1HG2 VAL 17 -0.366 6.647 -6.197 140 HG23 VAL 17 2HG2 VAL 17 -1.965 6.427 -6.895 141 H TRP 18 H TRP 18 1.925 9.258 -8.072 142 HA TRP 18 HA TRP 18 3.343 7.365 -6.619 143 HB2 TRP 18 2HB TRP 18 3.938 8.265 -8.892 144 HB3 TRP 18 1HB TRP 18 4.557 9.720 -8.121 145 HD1 TRP 18 HD TRP 18 5.164 5.943 -8.328 146 HE1 TRP 18 1HE TRP 18 7.609 5.465 -7.687 147 HE3 TRP 18 3HE TRP 18 6.662 10.614 -6.865 148 HZ2 TRP 18 2HZ TRP 18 9.860 6.817 -6.714 149 HZ3 TRP 18 3HZ TRP 18 8.990 10.971 -6.075 150 HH2 TRP 18 HH TRP 18 10.589 9.066 -5.995 151 H LYS 19 H LYS 19 3.315 10.876 -6.252 152 HA LYS 19 HA LYS 19 5.258 10.987 -4.130 153 HB2 LYS 19 2HB LYS 19 3.121 12.967 -4.989 154 HB3 LYS 19 1HB LYS 19 4.397 13.313 -3.818 155 HG2 LYS 19 2HG LYS 19 6.108 12.822 -5.536 156 HG3 LYS 19 1HG LYS 19 4.830 12.499 -6.711 157 HD2 LYS 19 2HD LYS 19 4.006 14.812 -6.464 158 HD3 LYS 19 1HD LYS 19 5.269 15.142 -5.277 159 HE2 LYS 19 2HE LYS 19 6.996 14.669 -6.981 160 HE3 LYS 19 1HE LYS 19 5.733 14.342 -8.169 161 HZ1 LYS 19 3HZ LYS 19 6.415 16.572 -8.464 162 HZ2 LYS 19 1HZ LYS 19 6.311 16.909 -6.806 163 HZ3 LYS 19 2HZ LYS 19 4.897 16.631 -7.705 164 H TYR 20 H TYR 20 1.682 11.033 -4.215 165 HA TYR 20 HA TYR 20 1.334 11.322 -1.412 166 HB2 TYR 20 2HB TYR 20 -0.423 11.827 -3.092 167 HB3 TYR 20 1HB TYR 20 -0.543 10.113 -3.474 168 HD1 TYR 20 2HD TYR 20 -1.338 8.478 -1.736 169 HD2 TYR 20 1HD TYR 20 -1.432 12.724 -1.041 170 HE1 TYR 20 2HE TYR 20 -2.861 8.135 0.184 171 HE2 TYR 20 1HE TYR 20 -2.953 12.371 0.883 172 HH TYR 20 HH TYR 20 -4.482 9.353 1.490 173 H TRP 21 H TRP 21 1.530 8.508 -3.549 174 HA TRP 21 HA TRP 21 0.910 6.556 -1.548 175 HB2 TRP 21 2HB TRP 21 0.533 6.165 -3.963 176 HB3 TRP 21 1HB TRP 21 2.271 6.238 -4.258 177 HD1 TRP 21 HD TRP 21 3.680 4.092 -3.697 178 HE1 TRP 21 1HE TRP 21 3.106 1.751 -2.810 179 HE3 TRP 21 3HE TRP 21 -1.203 4.827 -2.419 180 HZ2 TRP 21 2HZ TRP 21 0.854 0.361 -1.705 181 HZ3 TRP 21 3HZ TRP 21 -2.546 2.978 -1.468 182 HH2 TRP 21 HH TRP 21 -1.525 0.746 -1.106 183 H ASN 22 H ASN 22 3.770 8.292 -2.332 184 HA ASN 22 HA ASN 22 5.559 6.337 -0.952 185 HB2 ASN 22 2HB ASN 22 6.120 8.658 -2.823 186 HB3 ASN 22 1HB ASN 22 7.367 7.678 -2.051 187 HD21 ASN 22 1HD2 ASN 22 6.768 7.876 -4.992 188 HD22 ASN 22 2HD2 ASN 22 6.392 6.292 -5.479 189 H GLU 23 H GLU 23 4.078 9.467 -0.727 190 HA GLU 23 HA GLU 23 5.989 10.703 0.946 191 HB2 GLU 23 2HB GLU 23 3.162 11.255 0.198 192 HB3 GLU 23 1HB GLU 23 3.655 11.968 1.723 193 HG2 GLU 23 2HG GLU 23 5.498 13.152 0.667 194 HG3 GLU 23 1HG GLU 23 5.242 12.322 -0.857 195 HA PRO 24 HA PRO 24 5.185 8.303 4.670 196 HB2 PRO 24 2HB PRO 24 6.490 9.776 6.574 197 HB3 PRO 24 1HB PRO 24 7.372 8.928 5.290 198 HG2 PRO 24 2HG PRO 24 6.578 11.828 5.404 199 HG3 PRO 24 1HG PRO 24 8.155 11.118 4.989 200 HD2 PRO 24 2HD PRO 24 6.369 11.907 3.047 201 HD3 PRO 24 1HD PRO 24 7.466 10.524 2.814 202 H ALA 25 H ALA 25 4.637 11.817 4.986 203 HA ALA 25 HA ALA 25 2.906 11.722 7.210 204 HB1 ALA 25 1HB ALA 25 2.228 13.991 6.538 205 HB2 ALA 25 2HB ALA 25 2.978 13.753 4.959 206 HB3 ALA 25 3HB ALA 25 3.976 13.791 6.411 207 H HIS 26 H HIS 26 2.229 11.557 3.731 208 HA HIS 26 HA HIS 26 -0.609 11.607 3.964 209 HB2 HIS 26 2HB HIS 26 1.314 10.662 1.813 210 HB3 HIS 26 1HB HIS 26 -0.428 10.534 1.601 211 HD2 HIS 26 2HD HIS 26 -1.487 13.407 2.568 212 HE1 HIS 26 1HE HIS 26 1.467 15.103 0.092 213 HE2 HIS 26 2HE HIS 26 -0.672 15.563 1.358 214 H ILE 27 H ILE 27 1.721 8.893 3.694 215 HA ILE 27 HA ILE 27 -0.239 6.842 3.680 216 HB ILE 27 HB ILE 27 2.664 6.870 4.587 217 HG12 ILE 27 2HG1 ILE 27 1.455 5.689 2.037 218 HG13 ILE 27 1HG1 ILE 27 2.055 7.342 2.123 219 HG21 ILE 27 1HG2 ILE 27 1.777 4.941 5.683 220 HG22 ILE 27 2HG2 ILE 27 2.455 4.288 4.202 221 HG23 ILE 27 3HG2 ILE 27 0.715 4.537 4.340 222 HD11 ILE 27 3HD1 ILE 27 3.698 4.864 2.747 223 HD12 ILE 27 1HD1 ILE 27 4.283 6.524 2.785 224 HD13 ILE 27 2HD1 ILE 27 3.790 5.802 1.265 225 H MET 28 H MET 28 1.648 8.242 6.385 226 HA MET 28 HA MET 28 0.542 6.641 8.409 227 HB2 MET 28 2HB MET 28 2.570 7.961 8.752 228 HB3 MET 28 1HB MET 28 1.651 9.454 8.618 229 HG2 MET 28 2HG MET 28 0.443 8.982 10.663 230 HG3 MET 28 1HG MET 28 1.043 7.338 10.703 231 HE1 MET 28 3HE MET 28 3.243 11.175 11.871 232 HE2 MET 28 1HE MET 28 1.506 10.862 11.964 233 HE3 MET 28 2HE MET 28 2.292 11.017 10.395 234 H LYS 29 H LYS 29 -0.797 9.334 6.719 235 HA LYS 29 HA LYS 29 -2.656 10.213 8.658 236 HB2 LYS 29 2HB LYS 29 -1.942 11.408 6.564 237 HB3 LYS 29 1HB LYS 29 -2.966 10.322 5.640 238 HG2 LYS 29 2HG LYS 29 -4.923 11.024 6.983 239 HG3 LYS 29 1HG LYS 29 -3.900 12.171 7.849 240 HD2 LYS 29 2HD LYS 29 -4.390 12.185 4.852 241 HD3 LYS 29 1HD LYS 29 -5.198 13.232 6.009 242 HE2 LYS 29 2HE LYS 29 -2.849 14.060 6.690 243 HE3 LYS 29 1HE LYS 29 -2.271 13.270 5.219 244 HZ1 LYS 29 3HZ LYS 29 -2.798 15.542 4.739 245 HZ2 LYS 29 1HZ LYS 29 -4.361 15.369 5.374 246 HZ3 LYS 29 2HZ LYS 29 -3.925 14.538 3.957 247 H TRP 30 H TRP 30 -2.713 7.582 6.337 248 HA TRP 30 HA TRP 30 -5.320 6.630 7.413 249 HB2 TRP 30 2HB TRP 30 -6.042 6.020 5.150 250 HB3 TRP 30 1HB TRP 30 -5.746 7.755 5.238 251 HD1 TRP 30 HD TRP 30 -3.610 8.703 3.946 252 HE1 TRP 30 1HE TRP 30 -2.087 7.719 2.107 253 HE3 TRP 30 3HE TRP 30 -5.095 3.816 4.082 254 HZ2 TRP 30 2HZ TRP 30 -1.573 5.196 0.856 255 HZ3 TRP 30 3HZ TRP 30 -4.089 2.155 2.572 256 HH2 TRP 30 HH TRP 30 -2.333 2.830 0.953 257 H CYS 31 H CYS 31 -2.216 5.937 7.480 258 HA CYS 31 HA CYS 31 -1.844 3.460 6.259 259 HB2 CYS 31 2HB CYS 31 0.038 4.568 7.264 260 HB3 CYS 31 1HB CYS 31 -0.767 4.642 8.817 261 HG CYS 31 HG CYS 31 0.031 2.338 9.315 262 H GLN 32 H GLN 32 -2.306 1.410 6.825 263 HA GLN 32 HA GLN 32 -3.278 -0.377 7.822 264 HB2 GLN 32 2HB GLN 32 -2.225 0.708 9.960 265 HB3 GLN 32 1HB GLN 32 -3.850 1.274 10.318 266 HG2 GLN 32 2HG GLN 32 -3.597 -0.813 11.486 267 HG3 GLN 32 1HG GLN 32 -4.637 -1.147 10.105 268 HE21 GLN 32 1HE2 GLN 32 -1.069 -0.914 10.532 269 HE22 GLN 32 2HE2 GLN 32 -0.738 -2.410 9.803 270 H ALA 33 H ALA 33 -4.898 2.669 8.505 271 HA ALA 33 HA ALA 33 -7.067 3.354 8.320 272 HB1 ALA 33 1HB ALA 33 -8.309 2.534 6.371 273 HB2 ALA 33 2HB ALA 33 -7.172 1.201 6.180 274 HB3 ALA 33 3HB ALA 33 -6.635 2.862 5.926 275 H SER 34 H SER 34 -6.546 1.498 10.399 276 HA SER 34 HA SER 34 -9.079 -0.043 10.500 277 HB2 SER 34 2HB SER 34 -6.428 -0.797 11.699 278 HB3 SER 34 1HB SER 34 -7.930 -1.686 11.927 279 HG SER 34 HG SER 34 -7.962 -1.653 9.505 280 HA PRO 35 HA PRO 35 -9.769 2.512 14.146 281 HB2 PRO 35 2HB PRO 35 -11.964 1.298 15.243 282 HB3 PRO 35 1HB PRO 35 -12.057 2.182 13.702 283 HG2 PRO 35 2HG PRO 35 -11.790 -0.781 14.152 284 HG3 PRO 35 1HG PRO 35 -12.882 0.085 13.054 285 HD2 PRO 35 2HD PRO 35 -10.518 -1.031 12.181 286 HD3 PRO 35 1HD PRO 35 -11.204 0.441 11.447 287 H GLU 36 H GLU 36 -9.392 -0.983 14.466 288 HA GLU 36 HA GLU 36 -8.969 -0.978 17.337 289 HB2 GLU 36 2HB GLU 36 -8.521 -3.091 15.204 290 HB3 GLU 36 1HB GLU 36 -8.296 -3.373 16.929 291 HG2 GLU 36 2HG GLU 36 -10.656 -2.775 17.335 292 HG3 GLU 36 1HG GLU 36 -10.880 -2.477 15.618 293 H TRP 37 H TRP 37 -7.158 0.355 15.025 294 HA TRP 37 HA TRP 37 -4.650 0.004 16.528 295 HB2 TRP 37 2HB TRP 37 -4.866 -0.462 13.536 296 HB3 TRP 37 1HB TRP 37 -3.367 -0.411 14.461 297 HD1 TRP 37 HD TRP 37 -6.508 -2.528 13.993 298 HE1 TRP 37 1HE TRP 37 -6.066 -4.901 14.888 299 HE3 TRP 37 3HE TRP 37 -1.903 -1.828 16.057 300 HZ2 TRP 37 2HZ TRP 37 -4.022 -6.317 16.292 301 HZ3 TRP 37 3HZ TRP 37 -0.729 -3.711 17.166 302 HH2 TRP 37 HH TRP 37 -1.781 -5.950 17.279 303 H HIS 38 H HIS 38 -3.099 1.603 16.043 304 HA HIS 38 HA HIS 38 -3.969 3.956 14.481 305 HB2 HIS 38 2HB HIS 38 -3.645 5.487 16.347 306 HB3 HIS 38 1HB HIS 38 -4.849 4.289 16.813 307 HD2 HIS 38 2HD HIS 38 -1.946 5.871 18.467 308 HE1 HIS 38 1HE HIS 38 -1.751 1.897 19.863 309 HE2 HIS 38 2HE HIS 38 -0.893 4.255 20.225 310 H VAL 39 H VAL 39 -2.219 5.395 14.025 311 HA VAL 39 HA VAL 39 0.487 4.204 14.393 312 HB VAL 39 HB VAL 39 -0.450 5.880 12.056 313 HG11 VAL 39 1HG1 VAL 39 2.077 4.248 12.564 314 HG12 VAL 39 2HG1 VAL 39 1.974 6.003 12.474 315 HG13 VAL 39 3HG1 VAL 39 1.668 5.026 11.037 316 HG21 VAL 39 3HG2 VAL 39 -0.209 2.863 12.446 317 HG22 VAL 39 1HG2 VAL 39 -0.325 3.625 10.870 318 HG23 VAL 39 2HG2 VAL 39 -1.652 3.773 12.006 319 HA PRO 40 HA PRO 40 0.567 8.400 16.356 320 HB2 PRO 40 2HB PRO 40 2.030 7.802 18.585 321 HB3 PRO 40 1HB PRO 40 0.299 7.415 18.470 322 HG2 PRO 40 2HG PRO 40 2.666 5.598 18.128 323 HG3 PRO 40 1HG PRO 40 1.111 5.276 18.920 324 HD2 PRO 40 2HD PRO 40 1.739 4.477 16.317 325 HD3 PRO 40 1HD PRO 40 0.076 4.672 16.915 326 H ALA 41 H ALA 41 2.803 6.445 14.831 327 HA ALA 41 HA ALA 41 4.591 8.630 14.284 328 HB1 ALA 41 1HB ALA 41 5.634 6.316 15.950 329 HB2 ALA 41 2HB ALA 41 5.414 7.971 16.518 330 HB3 ALA 41 3HB ALA 41 6.607 7.620 15.267 331 H ALA 42 H ALA 42 5.920 8.194 12.533 332 HA ALA 42 HA ALA 42 6.163 5.519 11.450 333 HB1 ALA 42 1HB ALA 42 5.056 5.971 9.334 334 HB2 ALA 42 2HB ALA 42 4.701 7.623 9.836 335 HB3 ALA 42 3HB ALA 42 3.913 6.267 10.644 336 H GLN 43 H GLN 43 7.894 5.316 10.106 337 HA GLN 43 HA GLN 43 9.358 7.755 9.250 338 HB2 GLN 43 2HB GLN 43 10.632 5.343 10.601 339 HB3 GLN 43 1HB GLN 43 11.479 6.749 9.968 340 HG2 GLN 43 2HG GLN 43 9.429 6.813 12.211 341 HG3 GLN 43 1HG GLN 43 11.173 6.877 12.432 342 HE21 GLN 43 1HE2 GLN 43 12.036 8.675 10.549 343 HE22 GLN 43 2HE2 GLN 43 11.288 10.184 10.763 344 H ASN 44 H ASN 44 10.242 7.617 7.304 345 HA ASN 44 HA ASN 44 10.789 5.151 5.933 346 HB2 ASN 44 2HB ASN 44 8.289 5.306 5.724 347 HB3 ASN 44 1HB ASN 44 8.487 6.836 4.884 348 HD21 ASN 44 1HD2 ASN 44 7.772 6.141 2.799 349 HD22 ASN 44 2HD2 ASN 44 8.593 4.964 1.894 350 H ASP 45 H ASP 45 12.258 5.486 4.365 351 HA ASP 45 HA ASP 45 12.761 8.250 3.362 352 HB2 ASP 45 2HB ASP 45 14.427 7.646 5.129 353 HB3 ASP 45 1HB ASP 45 14.883 6.231 4.185 354 H LEU 46 H LEU 46 11.906 7.917 1.364 355 HA LEU 46 HA LEU 46 12.153 5.524 -0.133 356 HB2 LEU 46 2HB LEU 46 10.441 7.423 -0.472 357 HB3 LEU 46 1HB LEU 46 11.726 8.327 -1.259 358 HG LEU 46 HG LEU 46 11.980 6.089 -2.730 359 HD11 LEU 46 1HD1 LEU 46 10.308 4.769 -1.444 360 HD12 LEU 46 2HD1 LEU 46 9.825 4.965 -3.122 361 HD13 LEU 46 3HD1 LEU 46 9.068 5.943 -1.874 362 HD21 LEU 46 3HD2 LEU 46 10.354 7.001 -4.371 363 HD22 LEU 46 1HD2 LEU 46 11.382 8.260 -3.690 364 HD23 LEU 46 2HD2 LEU 46 9.719 8.076 -3.130 365 H LYS 47 H LYS 47 14.285 4.839 -0.279 366 HA LYS 47 HA LYS 47 15.862 5.998 -2.359 367 HB2 LYS 47 2HB LYS 47 16.366 7.599 -0.485 368 HB3 LYS 47 1HB LYS 47 16.989 6.254 0.466 369 HG2 LYS 47 2HG LYS 47 18.707 5.815 -1.253 370 HG3 LYS 47 1HG LYS 47 18.053 7.115 -2.251 371 HD2 LYS 47 2HD LYS 47 18.576 8.744 -0.458 372 HD3 LYS 47 1HD LYS 47 19.238 7.441 0.528 373 HE2 LYS 47 2HE LYS 47 21.039 8.644 -0.657 374 HE3 LYS 47 1HE LYS 47 20.926 6.977 -1.223 375 HZ1 LYS 47 3HZ LYS 47 19.661 9.313 -2.548 376 HZ2 LYS 47 1HZ LYS 47 19.644 7.712 -3.106 377 HZ3 LYS 47 2HZ LYS 47 21.107 8.575 -3.050 378 H ALA 48 H ALA 48 17.345 4.530 -3.118 379 HA ALA 48 HA ALA 48 17.077 1.823 -2.431 380 HB1 ALA 48 1HB ALA 48 19.378 3.209 -3.840 381 HB2 ALA 48 2HB ALA 48 17.914 2.608 -4.614 382 HB3 ALA 48 3HB ALA 48 19.046 1.477 -3.874 383 H GLY 49 H GLY 49 18.123 0.517 -1.009 384 HA2 GLY 49 2HA GLY 49 19.598 -0.205 0.613 385 HA3 GLY 49 1HA GLY 49 20.662 1.140 0.213 386 H GLY 50 H GLY 50 17.632 2.381 0.722 387 HA2 GLY 50 2HA GLY 50 18.308 3.457 3.358 388 HA3 GLY 50 1HA GLY 50 16.913 3.875 2.364 389 H THR 51 H THR 51 16.824 3.306 5.152 390 HA THR 51 HA THR 51 15.226 0.781 5.258 391 HB THR 51 HB THR 51 17.161 0.538 6.693 392 HG1 THR 51 1HG THR 51 14.936 1.376 8.235 393 HG21 THR 51 3HG2 THR 51 17.681 2.189 8.455 394 HG22 THR 51 1HG2 THR 51 16.400 3.237 7.854 395 HG23 THR 51 2HG2 THR 51 17.812 2.907 6.852 396 H PHE 52 H PHE 52 13.515 0.838 6.881 397 HA PHE 52 HA PHE 52 12.376 3.497 7.497 398 HB2 PHE 52 2HB PHE 52 10.208 2.870 6.544 399 HB3 PHE 52 1HB PHE 52 11.447 2.846 5.293 400 HD1 PHE 52 2HD PHE 52 9.238 0.761 7.413 401 HD2 PHE 52 1HD PHE 52 12.224 0.695 4.314 402 HE1 PHE 52 2HE PHE 52 8.712 -1.621 6.958 403 HE2 PHE 52 1HE PHE 52 11.696 -1.687 3.865 404 HZ PHE 52 HZ PHE 52 9.945 -2.843 5.185 405 H THR 53 H THR 53 10.630 3.370 9.032 406 HA THR 53 HA THR 53 10.215 0.848 10.470 407 HB THR 53 HB THR 53 11.263 3.321 11.910 408 HG1 THR 53 1HG THR 53 13.187 2.453 11.808 409 HG21 THR 53 3HG2 THR 53 10.753 0.472 12.835 410 HG22 THR 53 1HG2 THR 53 9.802 1.888 13.283 411 HG23 THR 53 2HG2 THR 53 11.477 1.748 13.812 412 H THR 54 H THR 54 8.102 0.727 10.880 413 HA THR 54 HA THR 54 6.481 3.209 11.219 414 HB THR 54 HB THR 54 4.633 1.955 10.187 415 HG1 THR 54 1HG THR 54 6.080 -0.076 10.787 416 HG21 THR 54 3HG2 THR 54 7.151 1.891 8.498 417 HG22 THR 54 1HG2 THR 54 6.146 3.319 8.753 418 HG23 THR 54 2HG2 THR 54 5.497 1.926 7.888 419 H THR 55 H THR 55 5.629 3.378 13.219 420 HA THR 55 HA THR 55 5.603 1.035 15.013 421 HB THR 55 HB THR 55 4.813 3.941 15.547 422 HG1 THR 55 1HG THR 55 6.900 4.156 16.310 423 HG21 THR 55 3HG2 THR 55 3.964 2.353 17.229 424 HG22 THR 55 1HG2 THR 55 5.277 3.314 17.903 425 HG23 THR 55 2HG2 THR 55 5.573 1.650 17.400 426 H MET 56 H MET 56 3.808 -0.233 15.024 427 HA MET 56 HA MET 56 1.116 1.007 14.685 428 HB2 MET 56 2HB MET 56 2.108 -1.638 13.558 429 HB3 MET 56 1HB MET 56 0.453 -1.033 13.467 430 HG2 MET 56 2HG MET 56 1.295 0.965 12.219 431 HG3 MET 56 1HG MET 56 2.907 0.254 12.235 432 HE1 MET 56 3HE MET 56 1.820 -0.057 8.588 433 HE2 MET 56 1HE MET 56 3.305 -0.117 9.545 434 HE3 MET 56 2HE MET 56 2.123 1.155 9.828 435 H ALA 57 H ALA 57 0.431 0.940 16.764 436 HA ALA 57 HA ALA 57 0.457 -1.695 18.186 437 HB1 ALA 57 1HB ALA 57 2.059 -0.110 19.229 438 HB2 ALA 57 2HB ALA 57 0.693 -0.456 20.287 439 HB3 ALA 57 3HB ALA 57 0.759 1.071 19.410 440 H ALA 58 H ALA 58 -1.308 -2.029 19.581 441 HA ALA 58 HA ALA 58 -3.831 -1.065 18.514 442 HB1 ALA 58 1HB ALA 58 -3.615 -3.385 19.226 443 HB2 ALA 58 2HB ALA 58 -4.830 -2.557 20.203 444 HB3 ALA 58 3HB ALA 58 -3.222 -2.865 20.868 445 H LYS 59 H LYS 59 -5.375 0.160 19.630 446 HA LYS 59 HA LYS 59 -4.421 2.367 21.074 447 HB2 LYS 59 2HB LYS 59 -7.231 1.233 20.991 448 HB3 LYS 59 1HB LYS 59 -6.800 2.866 21.509 449 HG2 LYS 59 2HG LYS 59 -5.765 3.213 19.199 450 HG3 LYS 59 1HG LYS 59 -6.494 1.679 18.720 451 HD2 LYS 59 2HD LYS 59 -7.967 4.159 19.707 452 HD3 LYS 59 1HD LYS 59 -7.929 3.556 18.052 453 HE2 LYS 59 2HE LYS 59 -9.312 2.321 20.462 454 HE3 LYS 59 1HE LYS 59 -10.019 2.786 18.918 455 HZ1 LYS 59 3HZ LYS 59 -8.455 0.417 19.611 456 HZ2 LYS 59 1HZ LYS 59 -8.290 1.038 18.040 457 HZ3 LYS 59 2HZ LYS 59 -9.819 0.572 18.611 458 H ASP 60 H ASP 60 -5.874 -0.669 22.177 459 HA ASP 60 HA ASP 60 -6.024 0.051 24.954 460 HB2 ASP 60 2HB ASP 60 -6.376 -2.414 25.272 461 HB3 ASP 60 1HB ASP 60 -7.453 -1.712 24.066 462 H GLY 61 H GLY 61 -3.449 -0.634 22.897 463 HA2 GLY 61 2HA GLY 61 -1.187 -0.839 23.279 464 HA3 GLY 61 1HA GLY 61 -1.499 -0.553 24.989 465 H SER 62 H SER 62 -3.419 -3.055 23.774 466 HA SER 62 HA SER 62 -2.259 -5.041 25.416 467 HB2 SER 62 2HB SER 62 -4.615 -5.111 24.711 468 HB3 SER 62 1HB SER 62 -4.115 -5.364 23.039 469 HG SER 62 HG SER 62 -4.429 -7.374 23.826 470 H MET 63 H MET 63 -1.941 -4.308 21.978 471 HA MET 63 HA MET 63 0.298 -6.271 21.724 472 HB2 MET 63 2HB MET 63 -1.758 -5.408 19.657 473 HB3 MET 63 1HB MET 63 -0.383 -6.466 19.335 474 HG2 MET 63 2HG MET 63 -2.518 -7.079 21.393 475 HG3 MET 63 1HG MET 63 -2.558 -7.683 19.744 476 HE1 MET 63 3HE MET 63 -1.632 -10.072 19.227 477 HE2 MET 63 1HE MET 63 0.104 -10.302 19.476 478 HE3 MET 63 2HE MET 63 -0.490 -8.855 18.662 479 H SER 64 H SER 64 2.025 -5.653 20.531 480 HA SER 64 HA SER 64 2.211 -2.916 19.448 481 HB2 SER 64 2HB SER 64 4.214 -2.410 20.745 482 HB3 SER 64 1HB SER 64 2.865 -2.735 21.833 483 HG SER 64 HG SER 64 3.712 -4.972 21.827 484 H PHE 65 H PHE 65 3.301 -2.971 17.589 485 HA PHE 65 HA PHE 65 5.608 -4.665 17.172 486 HB2 PHE 65 2HB PHE 65 3.709 -6.244 16.733 487 HB3 PHE 65 1HB PHE 65 3.125 -5.156 15.477 488 HD1 PHE 65 1HD PHE 65 5.839 -7.491 16.444 489 HD2 PHE 65 2HD PHE 65 4.349 -4.910 13.341 490 HE1 PHE 65 1HE PHE 65 7.450 -8.481 14.844 491 HE2 PHE 65 2HE PHE 65 5.962 -5.909 11.744 492 HZ PHE 65 HZ PHE 65 7.515 -7.690 12.497 493 H ASP 66 H ASP 66 6.692 -4.164 15.231 494 HA ASP 66 HA ASP 66 5.770 -1.804 13.707 495 HB2 ASP 66 2HB ASP 66 7.984 -0.742 13.946 496 HB3 ASP 66 1HB ASP 66 7.192 -0.914 15.509 497 H PHE 67 H PHE 67 6.441 -1.758 11.600 498 HA PHE 67 HA PHE 67 7.734 -4.212 10.539 499 HB2 PHE 67 2HB PHE 67 6.193 -1.965 9.180 500 HB3 PHE 67 1HB PHE 67 6.889 -3.349 8.343 501 HD1 PHE 67 1HD PHE 67 5.979 -5.624 8.666 502 HD2 PHE 67 2HD PHE 67 4.213 -2.234 10.634 503 HE1 PHE 67 1HE PHE 67 3.992 -6.987 9.238 504 HE2 PHE 67 2HE PHE 67 2.225 -3.603 11.203 505 HZ PHE 67 HZ PHE 67 2.115 -5.980 10.505 506 H GLY 68 H GLY 68 9.594 -4.128 9.362 507 HA2 GLY 68 2HA GLY 68 10.890 -1.584 8.689 508 HA3 GLY 68 1HA GLY 68 11.703 -2.597 9.886 509 H GLY 69 H GLY 69 12.564 -1.851 7.217 510 HA2 GLY 69 2HA GLY 69 13.626 -4.322 6.336 511 HA3 GLY 69 1HA GLY 69 12.280 -3.848 5.297 512 H VAL 70 H VAL 70 14.255 -3.873 3.785 513 HA VAL 70 HA VAL 70 15.396 -1.128 3.606 514 HB VAL 70 HB VAL 70 17.118 -2.756 4.343 515 HG11 VAL 70 1HG1 VAL 70 16.081 -4.762 3.220 516 HG12 VAL 70 2HG1 VAL 70 17.812 -4.605 2.932 517 HG13 VAL 70 3HG1 VAL 70 16.664 -4.147 1.672 518 HG21 VAL 70 3HG2 VAL 70 18.793 -2.208 2.640 519 HG22 VAL 70 1HG2 VAL 70 17.733 -0.824 2.887 520 HG23 VAL 70 2HG2 VAL 70 17.532 -1.848 1.464 521 H TYR 71 H TYR 71 15.406 -0.207 1.601 522 HA TYR 71 HA TYR 71 13.644 -1.344 -0.417 523 HB2 TYR 71 2HB TYR 71 15.262 1.226 -0.231 524 HB3 TYR 71 1HB TYR 71 14.292 0.820 -1.646 525 HD1 TYR 71 1HD TYR 71 11.816 0.517 -1.442 526 HD2 TYR 71 2HD TYR 71 14.177 1.991 1.841 527 HE1 TYR 71 1HE TYR 71 9.765 1.314 -0.321 528 HE2 TYR 71 2HE TYR 71 12.115 2.795 2.949 529 HH TYR 71 HH TYR 71 9.006 2.729 1.315 530 H ASP 72 H ASP 72 14.314 -2.710 -1.938 531 HA ASP 72 HA ASP 72 17.111 -3.265 -2.400 532 HB2 ASP 72 2HB ASP 72 15.344 -5.012 -2.529 533 HB3 ASP 72 1HB ASP 72 14.653 -4.192 -3.929 534 H GLN 73 H GLN 73 14.469 -1.675 -4.149 535 HA GLN 73 HA GLN 73 16.223 0.135 -5.501 536 HB2 GLN 73 2HB GLN 73 16.629 -1.973 -6.810 537 HB3 GLN 73 1HB GLN 73 14.921 -2.003 -7.236 538 HG2 GLN 73 2HG GLN 73 15.117 0.125 -8.415 539 HG3 GLN 73 1HG GLN 73 16.780 0.328 -7.870 540 HE21 GLN 73 1HE2 GLN 73 15.150 -2.597 -9.208 541 HE22 GLN 73 2HE2 GLN 73 16.231 -2.787 -10.504 542 H VAL 74 H VAL 74 15.088 1.793 -6.546 543 HA VAL 74 HA VAL 74 12.113 1.704 -6.486 544 HB VAL 74 HB VAL 74 13.837 4.008 -5.478 545 HG11 VAL 74 1HG1 VAL 74 10.823 3.603 -5.556 546 HG12 VAL 74 2HG1 VAL 74 11.735 4.784 -6.493 547 HG13 VAL 74 3HG1 VAL 74 11.636 4.933 -4.755 548 HG21 VAL 74 3HG2 VAL 74 13.880 2.116 -3.913 549 HG22 VAL 74 1HG2 VAL 74 12.119 2.000 -3.966 550 HG23 VAL 74 2HG2 VAL 74 12.893 3.417 -3.255 551 H LYS 75 H LYS 75 11.194 2.606 -8.241 552 HA LYS 75 HA LYS 75 12.808 4.301 -10.076 553 HB2 LYS 75 2HB LYS 75 11.100 1.923 -10.883 554 HB3 LYS 75 1HB LYS 75 11.884 3.061 -11.986 555 HG2 LYS 75 2HG LYS 75 14.091 2.417 -11.043 556 HG3 LYS 75 1HG LYS 75 13.282 1.242 -10.001 557 HD2 LYS 75 2HD LYS 75 12.384 0.096 -12.036 558 HD3 LYS 75 1HD LYS 75 13.272 1.245 -13.041 559 HE2 LYS 75 2HE LYS 75 14.475 -0.697 -11.054 560 HE3 LYS 75 1HE LYS 75 14.578 -0.815 -12.809 561 HZ1 LYS 75 3HZ LYS 75 16.534 0.231 -12.352 562 HZ2 LYS 75 1HZ LYS 75 15.931 1.037 -10.986 563 HZ3 LYS 75 2HZ LYS 75 15.534 1.592 -12.542 564 H THR 76 H THR 76 11.727 6.114 -10.442 565 HA THR 76 HA THR 76 9.198 6.685 -9.416 566 HB THR 76 HB THR 76 10.393 8.144 -11.811 567 HG1 THR 76 1HG THR 76 11.153 8.299 -9.082 568 HG21 THR 76 3HG2 THR 76 8.130 8.825 -10.795 569 HG22 THR 76 1HG2 THR 76 9.356 10.095 -10.842 570 HG23 THR 76 2HG2 THR 76 9.020 9.245 -9.334 571 H ASN 77 H ASN 77 7.147 6.363 -10.133 572 HA ASN 77 HA ASN 77 5.468 5.396 -11.380 573 HB2 ASN 77 2HB ASN 77 5.141 6.551 -13.585 574 HB3 ASN 77 1HB ASN 77 5.387 7.637 -12.221 575 HD21 ASN 77 1HD2 ASN 77 6.944 9.160 -12.476 576 HD22 ASN 77 2HD2 ASN 77 8.198 9.084 -13.597 577 H ASP 78 H ASP 78 7.126 3.391 -11.258 578 HA ASP 78 HA ASP 78 6.944 2.090 -13.868 579 HB2 ASP 78 2HB ASP 78 9.556 2.798 -12.525 580 HB3 ASP 78 1HB ASP 78 9.463 1.487 -13.693 581 H LEU 79 H LEU 79 9.085 1.453 -11.106 582 HA LEU 79 HA LEU 79 7.349 -0.710 -10.136 583 HB2 LEU 79 2HB LEU 79 8.870 -1.597 -12.022 584 HB3 LEU 79 1HB LEU 79 10.230 -1.281 -10.957 585 HG LEU 79 HG LEU 79 8.709 -2.733 -9.205 586 HD11 LEU 79 1HD1 LEU 79 7.943 -3.886 -11.912 587 HD12 LEU 79 2HD1 LEU 79 6.853 -3.001 -10.851 588 HD13 LEU 79 3HD1 LEU 79 7.531 -4.539 -10.329 589 HD21 LEU 79 3HD2 LEU 79 11.000 -3.330 -9.851 590 HD22 LEU 79 1HD2 LEU 79 10.426 -3.950 -11.398 591 HD23 LEU 79 2HD2 LEU 79 9.970 -4.759 -9.898 592 H ILE 80 H ILE 80 7.487 -0.957 -8.022 593 HA ILE 80 HA ILE 80 9.843 0.057 -6.507 594 HB ILE 80 HB ILE 80 6.936 0.498 -5.697 595 HG12 ILE 80 2HG1 ILE 80 8.998 2.493 -6.732 596 HG13 ILE 80 1HG1 ILE 80 7.630 1.905 -7.658 597 HG21 ILE 80 1HG2 ILE 80 9.569 1.462 -4.506 598 HG22 ILE 80 2HG2 ILE 80 8.510 0.245 -3.800 599 HG23 ILE 80 3HG2 ILE 80 7.970 1.908 -3.921 600 HD11 ILE 80 3HD1 ILE 80 7.540 3.599 -5.164 601 HD12 ILE 80 1HD1 ILE 80 6.113 2.798 -5.826 602 HD13 ILE 80 2HD1 ILE 80 6.967 4.003 -6.776 603 H GLU 81 H GLU 81 10.544 -1.343 -5.003 604 HA GLU 81 HA GLU 81 8.801 -3.354 -3.806 605 HB2 GLU 81 2HB GLU 81 10.303 -5.232 -4.504 606 HB3 GLU 81 1HB GLU 81 9.439 -4.511 -5.861 607 HG2 GLU 81 2HG GLU 81 11.425 -3.159 -6.422 608 HG3 GLU 81 1HG GLU 81 12.303 -3.871 -5.072 609 H TYR 82 H TYR 82 9.918 -4.480 -2.089 610 HA TYR 82 HA TYR 82 12.525 -3.592 -1.200 611 HB2 TYR 82 2HB TYR 82 11.651 -2.622 0.945 612 HB3 TYR 82 1HB TYR 82 11.237 -1.657 -0.471 613 HD1 TYR 82 1HD TYR 82 8.944 -1.701 -1.431 614 HD2 TYR 82 2HD TYR 82 9.887 -3.791 2.211 615 HE1 TYR 82 1HE TYR 82 6.533 -1.904 -0.919 616 HE2 TYR 82 2HE TYR 82 7.469 -3.980 2.711 617 HH TYR 82 HH TYR 82 5.226 -2.272 1.669 618 H THR 83 H THR 83 13.218 -4.771 0.693 619 HA THR 83 HA THR 83 11.818 -7.376 1.001 620 HB THR 83 HB THR 83 14.661 -6.595 1.789 621 HG1 THR 83 1HG THR 83 14.043 -8.225 -0.388 622 HG21 THR 83 3HG2 THR 83 15.000 -9.050 1.821 623 HG22 THR 83 1HG2 THR 83 13.293 -9.289 1.459 624 HG23 THR 83 2HG2 THR 83 13.777 -8.561 2.990 625 H ILE 84 H ILE 84 10.807 -7.791 2.864 626 HA ILE 84 HA ILE 84 10.985 -5.911 5.126 627 HB ILE 84 HB ILE 84 9.159 -8.298 4.638 628 HG12 ILE 84 2HG1 ILE 84 8.560 -5.312 4.433 629 HG13 ILE 84 1HG1 ILE 84 8.891 -6.337 3.041 630 HG21 ILE 84 1HG2 ILE 84 9.185 -6.142 6.799 631 HG22 ILE 84 2HG2 ILE 84 9.344 -7.879 7.025 632 HG23 ILE 84 3HG2 ILE 84 7.813 -7.205 6.510 633 HD11 ILE 84 3HD1 ILE 84 6.945 -7.740 3.570 634 HD12 ILE 84 1HD1 ILE 84 6.461 -6.059 3.395 635 HD13 ILE 84 2HD1 ILE 84 6.606 -6.763 4.995 636 H GLY 85 H GLY 85 11.413 -6.650 7.250 637 HA2 GLY 85 2HA GLY 85 13.657 -8.257 7.584 638 HA3 GLY 85 1HA GLY 85 12.527 -7.847 8.869 639 H ASP 86 H ASP 86 10.210 -9.163 7.924 640 HA ASP 86 HA ASP 86 10.555 -11.768 8.870 641 HB2 ASP 86 2HB ASP 86 8.395 -10.518 7.143 642 HB3 ASP 86 1HB ASP 86 8.244 -12.115 7.876 643 H GLY 87 H GLY 87 11.451 -10.431 5.895 644 HA2 GLY 87 2HA GLY 87 12.584 -11.429 4.129 645 HA3 GLY 87 1HA GLY 87 12.230 -13.017 4.799 646 H ARG 88 H ARG 88 9.443 -11.097 4.633 647 HA ARG 88 HA ARG 88 8.225 -12.741 2.619 648 HB2 ARG 88 2HB ARG 88 7.358 -10.121 3.890 649 HB3 ARG 88 1HB ARG 88 6.332 -11.106 2.845 650 HG2 ARG 88 2HG ARG 88 6.526 -12.995 4.410 651 HG3 ARG 88 1HG ARG 88 7.576 -12.046 5.454 652 HD2 ARG 88 2HD ARG 88 5.744 -10.383 5.749 653 HD3 ARG 88 1HD ARG 88 4.686 -11.405 4.774 654 HE ARG 88 HE ARG 88 5.386 -11.789 7.531 655 HH11 ARG 88 1HH2 ARG 88 4.634 -13.467 4.578 656 HH12 ARG 88 2HH2 ARG 88 4.048 -14.884 5.385 657 HH21 ARG 88 1HH1 ARG 88 4.635 -13.632 8.569 658 HH22 ARG 88 2HH1 ARG 88 4.054 -14.973 7.646 659 H LYS 89 H LYS 89 7.563 -12.126 0.523 660 HA LYS 89 HA LYS 89 9.280 -10.074 -0.771 661 HB2 LYS 89 2HB LYS 89 7.638 -12.321 -2.003 662 HB3 LYS 89 1HB LYS 89 8.833 -11.312 -2.821 663 HG2 LYS 89 2HG LYS 89 9.400 -13.260 -0.555 664 HG3 LYS 89 1HG LYS 89 9.739 -13.535 -2.262 665 HD2 LYS 89 2HD LYS 89 11.238 -11.440 -2.167 666 HD3 LYS 89 1HD LYS 89 11.066 -11.513 -0.412 667 HE2 LYS 89 2HE LYS 89 12.174 -13.734 -2.154 668 HE3 LYS 89 1HE LYS 89 13.114 -12.669 -1.107 669 HZ1 LYS 89 3HZ LYS 89 11.506 -13.481 0.702 670 HZ2 LYS 89 1HZ LYS 89 12.758 -14.515 0.214 671 HZ3 LYS 89 2HZ LYS 89 11.179 -14.763 -0.362 672 H VAL 90 H VAL 90 8.420 -8.287 -1.511 673 HA VAL 90 HA VAL 90 5.536 -8.110 -2.167 674 HB VAL 90 HB VAL 90 7.014 -6.080 -0.435 675 HG11 VAL 90 1HG1 VAL 90 4.747 -5.113 -0.152 676 HG12 VAL 90 2HG1 VAL 90 4.100 -6.303 -1.280 677 HG13 VAL 90 3HG1 VAL 90 5.249 -5.089 -1.839 678 HG21 VAL 90 3HG2 VAL 90 4.973 -8.226 0.297 679 HG22 VAL 90 1HG2 VAL 90 5.436 -6.902 1.361 680 HG23 VAL 90 2HG2 VAL 90 6.633 -8.096 0.879 681 H ARG 91 H ARG 91 5.236 -7.093 -4.004 682 HA ARG 91 HA ARG 91 7.208 -5.171 -5.081 683 HB2 ARG 91 2HB ARG 91 7.020 -6.283 -7.303 684 HB3 ARG 91 1HB ARG 91 7.793 -7.315 -6.100 685 HG2 ARG 91 2HG ARG 91 5.614 -8.468 -5.719 686 HG3 ARG 91 1HG ARG 91 4.881 -7.467 -6.971 687 HD2 ARG 91 2HD ARG 91 7.233 -9.330 -7.405 688 HD3 ARG 91 1HD ARG 91 5.562 -9.680 -7.847 689 HE ARG 91 HE ARG 91 6.245 -7.226 -9.018 690 HH11 ARG 91 1HH2 ARG 91 7.133 -10.569 -9.162 691 HH12 ARG 91 2HH2 ARG 91 7.598 -10.517 -10.830 692 HH21 ARG 91 1HH1 ARG 91 6.854 -7.148 -11.200 693 HH22 ARG 91 2HH1 ARG 91 7.440 -8.577 -11.984 694 H ILE 92 H ILE 92 6.275 -3.539 -6.220 695 HA ILE 92 HA ILE 92 3.291 -3.521 -6.512 696 HB ILE 92 HB ILE 92 5.145 -1.147 -5.991 697 HG12 ILE 92 2HG1 ILE 92 3.149 -2.474 -4.097 698 HG13 ILE 92 1HG1 ILE 92 4.886 -2.733 -4.023 699 HG21 ILE 92 1HG2 ILE 92 3.134 -0.559 -7.289 700 HG22 ILE 92 2HG2 ILE 92 2.987 0.071 -5.656 701 HG23 ILE 92 3HG2 ILE 92 2.111 -1.386 -6.120 702 HD11 ILE 92 3HD1 ILE 92 4.243 -1.031 -2.405 703 HD12 ILE 92 1HD1 ILE 92 3.494 -0.065 -3.674 704 HD13 ILE 92 2HD1 ILE 92 5.240 -0.311 -3.668 705 H VAL 93 H VAL 93 2.632 -3.341 -8.562 706 HA VAL 93 HA VAL 93 4.522 -2.370 -10.659 707 HB VAL 93 HB VAL 93 2.171 -4.276 -11.013 708 HG11 VAL 93 1HG1 VAL 93 3.237 -4.720 -13.196 709 HG12 VAL 93 2HG1 VAL 93 4.502 -3.550 -12.823 710 HG13 VAL 93 3HG1 VAL 93 2.839 -3.013 -13.029 711 HG21 VAL 93 3HG2 VAL 93 5.135 -4.903 -10.738 712 HG22 VAL 93 1HG2 VAL 93 3.898 -6.061 -11.226 713 HG23 VAL 93 2HG2 VAL 93 3.863 -5.365 -9.608 714 H PHE 94 H PHE 94 3.937 -0.544 -11.625 715 HA PHE 94 HA PHE 94 1.227 0.590 -11.167 716 HB2 PHE 94 2HB PHE 94 3.875 1.755 -12.116 717 HB3 PHE 94 1HB PHE 94 2.372 2.664 -12.054 718 HD1 PHE 94 1HD PHE 94 4.918 0.896 -10.011 719 HD2 PHE 94 2HD PHE 94 1.432 3.416 -9.910 720 HE1 PHE 94 1HE PHE 94 5.273 1.303 -7.596 721 HE2 PHE 94 2HE PHE 94 1.802 3.824 -7.497 722 HZ PHE 94 HZ PHE 94 3.719 2.766 -6.338 723 H THR 95 H THR 95 -0.210 0.530 -12.745 724 HA THR 95 HA THR 95 0.633 0.417 -15.599 725 HB THR 95 HB THR 95 -1.235 -1.188 -15.984 726 HG1 THR 95 1HG THR 95 -1.292 -1.320 -13.158 727 HG21 THR 95 3HG2 THR 95 1.083 -2.023 -15.633 728 HG22 THR 95 1HG2 THR 95 -0.122 -3.163 -15.031 729 HG23 THR 95 2HG2 THR 95 0.755 -2.132 -13.904 730 H HIS 96 H HIS 96 -0.637 1.571 -16.949 731 HA HIS 96 HA HIS 96 -3.154 2.772 -16.099 732 HB2 HIS 96 2HB HIS 96 -2.339 5.086 -16.510 733 HB3 HIS 96 1HB HIS 96 -1.523 4.341 -15.138 734 HD2 HIS 96 2HD HIS 96 1.227 4.430 -15.335 735 HE1 HIS 96 1HE HIS 96 1.505 5.101 -19.494 736 HE2 HIS 96 2HE HIS 96 2.835 4.884 -17.342 737 H THR 97 H THR 97 -4.250 3.784 -17.836 738 HA THR 97 HA THR 97 -3.292 2.930 -20.564 739 HB THR 97 HB THR 97 -5.263 1.658 -20.002 740 HG1 THR 97 1HG THR 97 -6.355 3.832 -21.404 741 HG21 THR 97 3HG2 THR 97 -6.501 4.306 -19.190 742 HG22 THR 97 1HG2 THR 97 -6.053 2.993 -18.099 743 HG23 THR 97 2HG2 THR 97 -7.353 2.766 -19.266 744 H GLY 98 H GLY 98 -4.457 5.519 -18.558 745 HA2 GLY 98 2HA GLY 98 -3.547 7.550 -20.252 746 HA3 GLY 98 1HA GLY 98 -5.266 7.338 -20.576 747 H ASP 99 H ASP 99 -6.640 8.461 -19.328 748 HA ASP 99 HA ASP 99 -5.681 10.129 -17.168 749 HB2 ASP 99 2HB ASP 99 -8.492 9.621 -18.186 750 HB3 ASP 99 1HB ASP 99 -8.022 10.899 -17.066 751 H THR 100 H THR 100 -6.064 6.973 -17.109 752 HA THR 100 HA THR 100 -7.210 6.848 -14.370 753 HB THR 100 HB THR 100 -7.966 4.562 -15.015 754 HG1 THR 100 1HG THR 100 -6.387 4.856 -16.961 755 HG21 THR 100 3HG2 THR 100 -9.030 6.761 -16.800 756 HG22 THR 100 1HG2 THR 100 -9.539 6.468 -15.139 757 HG23 THR 100 2HG2 THR 100 -9.881 5.273 -16.389 758 H THR 101 H THR 101 -6.135 5.596 -12.959 759 HA THR 101 HA THR 101 -3.566 4.329 -13.806 760 HB THR 101 HB THR 101 -4.104 5.838 -11.208 761 HG1 THR 101 1HG THR 101 -3.400 7.521 -12.194 762 HG21 THR 101 3HG2 THR 101 -1.607 4.550 -12.375 763 HG22 THR 101 1HG2 THR 101 -2.441 4.079 -10.895 764 HG23 THR 101 2HG2 THR 101 -1.610 5.625 -10.984 765 H ASN 102 H ASN 102 -3.347 2.290 -13.198 766 HA ASN 102 HA ASN 102 -5.223 1.116 -11.185 767 HB2 ASN 102 2HB ASN 102 -5.566 0.299 -13.524 768 HB3 ASN 102 1HB ASN 102 -3.889 -0.239 -13.564 769 HD21 ASN 102 1HD2 ASN 102 -4.228 -2.530 -13.565 770 HD22 ASN 102 2HD2 ASN 102 -5.031 -3.348 -12.313 771 H ILE 103 H ILE 103 -4.232 0.527 -9.380 772 HA ILE 103 HA ILE 103 -1.288 0.049 -9.319 773 HB ILE 103 HB ILE 103 -3.246 0.489 -7.014 774 HG12 ILE 103 2HG1 ILE 103 -1.269 2.472 -8.232 775 HG13 ILE 103 1HG1 ILE 103 -2.998 2.488 -8.554 776 HG21 ILE 103 1HG2 ILE 103 -1.229 -0.741 -6.352 777 HG22 ILE 103 2HG2 ILE 103 -1.143 0.888 -5.708 778 HG23 ILE 103 3HG2 ILE 103 -0.203 0.455 -7.132 779 HD11 ILE 103 3HD1 ILE 103 -1.715 2.840 -5.835 780 HD12 ILE 103 1HD1 ILE 103 -3.453 2.771 -6.138 781 HD13 ILE 103 2HD1 ILE 103 -2.490 4.085 -6.803 782 H VAL 104 H VAL 104 -0.596 -1.997 -9.062 783 HA VAL 104 HA VAL 104 -2.501 -4.129 -8.182 784 HB VAL 104 HB VAL 104 -0.145 -4.382 -10.099 785 HG11 VAL 104 1HG1 VAL 104 -0.603 -6.459 -8.867 786 HG12 VAL 104 2HG1 VAL 104 -1.134 -6.632 -10.535 787 HG13 VAL 104 3HG1 VAL 104 -2.319 -6.339 -9.262 788 HG21 VAL 104 3HG2 VAL 104 -1.965 -3.078 -11.115 789 HG22 VAL 104 1HG2 VAL 104 -3.135 -4.314 -10.652 790 HG23 VAL 104 2HG2 VAL 104 -1.886 -4.678 -11.842 791 H GLU 105 H GLU 105 -1.860 -5.309 -6.476 792 HA GLU 105 HA GLU 105 0.972 -5.280 -5.583 793 HB2 GLU 105 2HB GLU 105 -1.447 -4.785 -3.798 794 HB3 GLU 105 1HB GLU 105 0.230 -4.931 -3.266 795 HG2 GLU 105 2HG GLU 105 0.820 -2.952 -4.657 796 HG3 GLU 105 1HG GLU 105 -0.869 -2.797 -5.115 797 H SER 106 H SER 106 1.588 -7.137 -4.583 798 HA SER 106 HA SER 106 -0.367 -9.373 -4.285 799 HB2 SER 106 2HB SER 106 1.277 -10.886 -5.274 800 HB3 SER 106 1HB SER 106 0.886 -9.608 -6.424 801 HG SER 106 HG SER 106 3.132 -9.721 -4.683 802 H PHE 107 H PHE 107 0.137 -10.839 -2.648 803 HA PHE 107 HA PHE 107 2.516 -10.325 -0.942 804 HB2 PHE 107 2HB PHE 107 -0.342 -10.401 0.103 805 HB3 PHE 107 1HB PHE 107 1.123 -10.248 1.074 806 HD1 PHE 107 1HD PHE 107 2.515 -8.182 0.964 807 HD2 PHE 107 2HD PHE 107 -1.194 -8.498 -1.194 808 HE1 PHE 107 1HE PHE 107 2.513 -5.735 0.598 809 HE2 PHE 107 2HE PHE 107 -1.189 -6.050 -1.555 810 HZ PHE 107 HZ PHE 107 0.666 -4.667 -0.662 811 H ASP 108 H ASP 108 3.236 -12.161 0.100 812 HA ASP 108 HA ASP 108 2.100 -14.691 -0.819 813 HB2 ASP 108 2HB ASP 108 4.581 -14.081 0.784 814 HB3 ASP 108 1HB ASP 108 4.130 -15.677 0.179 815 HA PRO 109 HA PRO 109 0.054 -14.837 3.288 816 HB2 PRO 109 2HB PRO 109 -1.684 -16.887 2.892 817 HB3 PRO 109 1HB PRO 109 -1.914 -15.323 2.089 818 HG2 PRO 109 2HG PRO 109 -0.670 -17.830 0.982 819 HG3 PRO 109 1HG PRO 109 -1.893 -16.781 0.236 820 HD2 PRO 109 2HD PRO 109 0.787 -16.575 -0.352 821 HD3 PRO 109 1HD PRO 109 -0.289 -15.167 -0.431 822 H GLU 110 H GLU 110 0.072 -16.269 5.121 823 HA GLU 110 HA GLU 110 2.387 -18.023 5.227 824 HB2 GLU 110 2HB GLU 110 0.258 -17.349 7.273 825 HB3 GLU 110 1HB GLU 110 1.695 -18.301 7.615 826 HG2 GLU 110 2HG GLU 110 3.108 -16.390 6.957 827 HG3 GLU 110 1HG GLU 110 1.666 -15.434 6.620 828 H GLU 111 H GLU 111 2.267 -20.236 5.900 829 HA GLU 111 HA GLU 111 0.162 -21.721 4.538 830 HB2 GLU 111 2HB GLU 111 2.581 -22.385 4.464 831 HB3 GLU 111 1HB GLU 111 2.505 -22.759 6.184 832 HG2 GLU 111 2HG GLU 111 0.746 -24.445 5.749 833 HG3 GLU 111 1HG GLU 111 0.780 -24.046 4.034 834 H THR 112 H THR 112 1.280 -21.228 7.877 835 HA THR 112 HA THR 112 -0.457 -23.075 9.122 836 HB THR 112 HB THR 112 -0.008 -21.819 11.188 837 HG1 THR 112 1HG THR 112 0.730 -19.818 11.124 838 HG21 THR 112 3HG2 THR 112 2.419 -21.969 9.375 839 HG22 THR 112 1HG2 THR 112 1.751 -23.311 10.308 840 HG23 THR 112 2HG2 THR 112 2.447 -21.919 11.139 841 H ASN 113 H ASN 113 -0.829 -19.589 8.456 842 HA ASN 113 HA ASN 113 -3.494 -19.572 9.591 843 HB2 ASN 113 2HB ASN 113 -1.926 -17.434 8.139 844 HB3 ASN 113 1HB ASN 113 -3.485 -17.165 8.893 845 HD21 ASN 113 1HD2 ASN 113 -2.810 -15.801 10.606 846 HD22 ASN 113 2HD2 ASN 113 -1.746 -16.301 11.828 847 HA PRO 114 HA PRO 114 -5.646 -20.532 5.789 848 HB2 PRO 114 2HB PRO 114 -7.971 -19.007 6.067 849 HB3 PRO 114 1HB PRO 114 -7.691 -20.534 6.922 850 HG2 PRO 114 2HG PRO 114 -7.257 -17.724 7.896 851 HG3 PRO 114 1HG PRO 114 -8.048 -19.076 8.725 852 HD2 PRO 114 2HD PRO 114 -5.518 -18.412 9.310 853 HD3 PRO 114 1HD PRO 114 -5.979 -20.127 9.221 854 H ARG 115 H ARG 115 -5.528 -19.808 3.718 855 HA ARG 115 HA ARG 115 -4.292 -17.311 3.084 856 HB2 ARG 115 2HB ARG 115 -5.699 -19.349 1.323 857 HB3 ARG 115 1HB ARG 115 -4.714 -18.014 0.714 858 HG2 ARG 115 2HG ARG 115 -2.749 -18.892 1.914 859 HG3 ARG 115 1HG ARG 115 -3.723 -20.211 2.568 860 HD2 ARG 115 2HD ARG 115 -2.447 -20.961 0.601 861 HD3 ARG 115 1HD ARG 115 -4.182 -21.017 0.282 862 HE ARG 115 HE ARG 115 -3.131 -18.503 -0.527 863 HH11 ARG 115 1HH2 ARG 115 -3.142 -21.863 -1.375 864 HH12 ARG 115 2HH2 ARG 115 -2.903 -21.577 -3.066 865 HH21 ARG 115 1HH1 ARG 115 -2.827 -18.127 -2.741 866 HH22 ARG 115 2HH1 ARG 115 -2.724 -19.464 -3.837 867 H GLU 116 H GLU 116 -7.622 -18.537 2.782 868 HA GLU 116 HA GLU 116 -8.788 -16.462 1.372 869 HB2 GLU 116 2HB GLU 116 -10.926 -17.086 2.633 870 HB3 GLU 116 1HB GLU 116 -10.108 -18.430 1.840 871 HG2 GLU 116 2HG GLU 116 -9.049 -19.069 3.956 872 HG3 GLU 116 1HG GLU 116 -9.811 -17.710 4.775 873 H LEU 117 H LEU 117 -7.984 -16.599 4.817 874 HA LEU 117 HA LEU 117 -9.347 -14.230 5.560 875 HB2 LEU 117 2HB LEU 117 -8.604 -15.916 7.196 876 HB3 LEU 117 1HB LEU 117 -6.920 -15.550 6.818 877 HG LEU 117 HG LEU 117 -7.264 -13.223 7.659 878 HD11 LEU 117 1HD1 LEU 117 -9.532 -12.677 7.362 879 HD12 LEU 117 2HD1 LEU 117 -9.446 -12.931 9.096 880 HD13 LEU 117 3HD1 LEU 117 -10.108 -14.191 8.056 881 HD21 LEU 117 3HD2 LEU 117 -7.411 -13.813 10.046 882 HD22 LEU 117 1HD2 LEU 117 -6.437 -14.994 9.169 883 HD23 LEU 117 2HD2 LEU 117 -8.097 -15.382 9.624 884 H GLN 118 H GLN 118 -6.018 -14.885 4.536 885 HA GLN 118 HA GLN 118 -4.975 -12.308 4.951 886 HB2 GLN 118 2HB GLN 118 -4.206 -14.349 2.838 887 HB3 GLN 118 1HB GLN 118 -3.212 -12.979 3.345 888 HG2 GLN 118 2HG GLN 118 -4.152 -15.198 5.196 889 HG3 GLN 118 1HG GLN 118 -2.563 -15.132 4.449 890 HE21 GLN 118 1HE2 GLN 118 -1.097 -13.370 5.144 891 HE22 GLN 118 2HE2 GLN 118 -1.347 -12.593 6.632 892 H GLN 119 H GLN 119 -6.296 -13.744 1.957 893 HA GLN 119 HA GLN 119 -6.015 -11.533 0.300 894 HB2 GLN 119 2HB GLN 119 -6.740 -13.819 -0.416 895 HB3 GLN 119 1HB GLN 119 -8.322 -13.517 0.301 896 HG2 GLN 119 2HG GLN 119 -8.667 -11.606 -1.218 897 HG3 GLN 119 1HG GLN 119 -7.068 -11.848 -1.906 898 HE21 GLN 119 1HE2 GLN 119 -9.409 -11.944 -3.518 899 HE22 GLN 119 2HE2 GLN 119 -9.622 -13.535 -4.073 900 H SER 120 H SER 120 -8.668 -12.368 2.503 901 HA SER 120 HA SER 120 -10.352 -10.183 1.903 902 HB2 SER 120 2HB SER 120 -10.073 -11.668 4.535 903 HB3 SER 120 1HB SER 120 -11.434 -10.661 4.048 904 HG SER 120 HG SER 120 -11.566 -12.134 2.183 905 H GLY 121 H GLY 121 -7.694 -10.562 4.251 906 HA2 GLY 121 2HA GLY 121 -8.035 -8.073 5.570 907 HA3 GLY 121 1HA GLY 121 -6.549 -9.013 5.512 908 H TRP 122 H TRP 122 -5.796 -9.006 2.937 909 HA TRP 122 HA TRP 122 -4.694 -6.425 2.550 910 HB2 TRP 122 2HB TRP 122 -4.965 -8.753 0.607 911 HB3 TRP 122 1HB TRP 122 -3.975 -7.324 0.313 912 HD1 TRP 122 HD TRP 122 -3.694 -10.705 1.761 913 HE1 TRP 122 1HE TRP 122 -1.560 -10.917 3.182 914 HE3 TRP 122 3HE TRP 122 -2.379 -5.773 2.144 915 HZ2 TRP 122 2HZ TRP 122 0.440 -9.234 4.323 916 HZ3 TRP 122 3HZ TRP 122 -0.353 -5.115 3.403 917 HH2 TRP 122 HH TRP 122 1.060 -6.838 4.491 918 H GLN 123 H GLN 123 -7.521 -8.023 1.166 919 HA GLN 123 HA GLN 123 -8.078 -5.955 -0.750 920 HB2 GLN 123 2HB GLN 123 -8.873 -8.346 -0.925 921 HB3 GLN 123 1HB GLN 123 -10.005 -8.022 0.387 922 HG2 GLN 123 2HG GLN 123 -11.034 -6.215 -0.963 923 HG3 GLN 123 1HG GLN 123 -9.902 -6.544 -2.268 924 HE21 GLN 123 1HE2 GLN 123 -12.712 -6.744 -2.661 925 HE22 GLN 123 2HE2 GLN 123 -13.105 -8.374 -2.925 926 H ALA 124 H ALA 124 -9.067 -6.616 2.585 927 HA ALA 124 HA ALA 124 -11.189 -4.796 2.802 928 HB1 ALA 124 1HB ALA 124 -10.722 -6.472 4.525 929 HB2 ALA 124 2HB ALA 124 -10.723 -4.866 5.247 930 HB3 ALA 124 3HB ALA 124 -9.193 -5.680 4.907 931 H ILE 125 H ILE 125 -7.734 -4.305 3.613 932 HA ILE 125 HA ILE 125 -8.000 -1.592 4.363 933 HB ILE 125 HB ILE 125 -6.062 -2.885 5.045 934 HG12 ILE 125 2HG1 ILE 125 -5.073 -0.772 3.068 935 HG13 ILE 125 1HG1 ILE 125 -5.804 -0.378 4.625 936 HG21 ILE 125 1HG2 ILE 125 -5.325 -3.055 2.101 937 HG22 ILE 125 2HG2 ILE 125 -5.934 -4.374 3.090 938 HG23 ILE 125 3HG2 ILE 125 -4.370 -3.671 3.446 939 HD11 ILE 125 3HD1 ILE 125 -3.326 -2.096 4.244 940 HD12 ILE 125 1HD1 ILE 125 -4.058 -1.668 5.789 941 HD13 ILE 125 2HD1 ILE 125 -3.335 -0.417 4.778 942 H LEU 126 H LEU 126 -7.290 -3.141 1.269 943 HA LEU 126 HA LEU 126 -6.744 -0.770 -0.173 944 HB2 LEU 126 2HB LEU 126 -7.526 -3.581 -0.909 945 HB3 LEU 126 1HB LEU 126 -7.514 -2.381 -2.187 946 HG LEU 126 HG LEU 126 -5.081 -2.829 -0.391 947 HD11 LEU 126 1HD1 LEU 126 -5.619 -4.958 -1.523 948 HD12 LEU 126 2HD1 LEU 126 -4.160 -4.244 -2.205 949 HD13 LEU 126 3HD1 LEU 126 -5.691 -4.126 -3.077 950 HD21 LEU 126 3HD2 LEU 126 -5.068 -0.712 -1.724 951 HD22 LEU 126 1HD2 LEU 126 -5.378 -1.633 -3.185 952 HD23 LEU 126 2HD2 LEU 126 -3.860 -1.826 -2.323 953 H ASN 127 H ASN 127 -9.761 -2.475 0.486 954 HA ASN 127 HA ASN 127 -11.414 -0.978 -1.261 955 HB2 ASN 127 2HB ASN 127 -11.999 -2.375 1.370 956 HB3 ASN 127 1HB ASN 127 -13.247 -1.729 0.303 957 HD21 ASN 127 1HD2 ASN 127 -12.967 -4.545 0.952 958 HD22 ASN 127 2HD2 ASN 127 -12.624 -5.360 -0.494 959 H SER 128 H SER 128 -10.318 -0.397 2.062 960 HA SER 128 HA SER 128 -11.957 1.779 2.705 961 HB2 SER 128 2HB SER 128 -10.504 0.647 4.349 962 HB3 SER 128 1HB SER 128 -9.085 1.319 3.555 963 HG SER 128 HG SER 128 -9.450 2.875 4.939 964 H PHE 129 H PHE 129 -9.040 1.601 0.774 965 HA PHE 129 HA PHE 129 -8.356 4.313 0.647 966 HB2 PHE 129 2HB PHE 129 -6.981 2.409 -0.268 967 HB3 PHE 129 1HB PHE 129 -8.102 2.298 -1.620 968 HD1 PHE 129 2HD PHE 129 -8.243 4.106 -3.319 969 HD2 PHE 129 1HD PHE 129 -5.443 4.332 -0.063 970 HE1 PHE 129 2HE PHE 129 -7.050 5.951 -4.467 971 HE2 PHE 129 1HE PHE 129 -4.257 6.176 -1.212 972 HZ PHE 129 HZ PHE 129 -5.060 6.988 -3.413 973 H LYS 130 H LYS 130 -10.664 2.442 -1.305 974 HA LYS 130 HA LYS 130 -11.348 4.451 -3.161 975 HB2 LYS 130 2HB LYS 130 -13.023 2.179 -2.039 976 HB3 LYS 130 1HB LYS 130 -13.439 3.120 -3.472 977 HG2 LYS 130 2HG LYS 130 -11.340 2.394 -4.560 978 HG3 LYS 130 1HG LYS 130 -10.926 1.448 -3.128 979 HD2 LYS 130 2HD LYS 130 -13.000 0.106 -3.435 980 HD3 LYS 130 1HD LYS 130 -13.364 1.030 -4.894 981 HE2 LYS 130 2HE LYS 130 -10.906 -0.685 -4.442 982 HE3 LYS 130 1HE LYS 130 -12.267 -1.087 -5.488 983 HZ1 LYS 130 3HZ LYS 130 -10.036 0.620 -5.997 984 HZ2 LYS 130 1HZ LYS 130 -11.506 1.418 -6.273 985 HZ3 LYS 130 2HZ LYS 130 -11.165 -0.035 -7.086 986 H SER 131 H SER 131 -12.703 3.638 0.023 987 HA SER 131 HA SER 131 -14.852 5.464 0.011 988 HB2 SER 131 2HB SER 131 -13.250 4.472 2.391 989 HB3 SER 131 1HB SER 131 -14.860 5.190 2.447 990 HG SER 131 HG SER 131 -15.285 3.078 2.344 991 H TYR 132 H TYR 132 -11.464 5.808 0.977 992 HA TYR 132 HA TYR 132 -11.623 8.357 2.162 993 HB2 TYR 132 2HB TYR 132 -9.645 6.883 2.349 994 HB3 TYR 132 1HB TYR 132 -9.307 7.116 0.637 995 HD1 TYR 132 2HD TYR 132 -9.377 8.767 3.959 996 HD2 TYR 132 1HD TYR 132 -8.386 9.242 -0.200 997 HE1 TYR 132 2HE TYR 132 -8.179 10.869 4.481 998 HE2 TYR 132 1HE TYR 132 -7.190 11.348 0.330 999 HH TYR 132 HH TYR 132 -7.221 12.700 3.613 1000 H THR 133 H THR 133 -10.853 7.440 -1.208 1001 HA THR 133 HA THR 133 -10.502 10.043 -2.214 1002 HB THR 133 HB THR 133 -10.925 8.998 -4.422 1003 HG1 THR 133 1HG THR 133 -11.440 6.626 -2.992 1004 HG21 THR 133 3HG2 THR 133 -9.282 7.277 -2.553 1005 HG22 THR 133 1HG2 THR 133 -8.716 8.731 -3.372 1006 HG23 THR 133 2HG2 THR 133 -9.145 7.300 -4.309 1007 H GLU 134 H GLU 134 -13.400 8.022 -1.864 1008 HA GLU 134 HA GLU 134 -15.169 9.766 -3.257 1009 HB2 GLU 134 2HB GLU 134 -15.629 7.332 -2.709 1010 HB3 GLU 134 1HB GLU 134 -15.869 7.803 -1.029 1011 HG2 GLU 134 2HG GLU 134 -18.045 7.664 -2.115 1012 HG3 GLU 134 1HG GLU 134 -17.711 9.359 -1.783 1013 H ASN 135 H ASN 135 -14.315 9.408 0.173 1014 HA ASN 135 HA ASN 135 -16.118 11.343 1.184 1015 HB2 ASN 135 2HB ASN 135 -14.966 9.668 2.601 1016 HB3 ASN 135 1HB ASN 135 -13.434 10.489 2.320 1017 HD21 ASN 135 1HD2 ASN 135 -13.220 11.061 4.620 1018 HD22 ASN 135 2HD2 ASN 135 -14.206 12.253 5.320 1019 H ASN 136 H ASN 136 -12.844 11.573 -0.111 1020 HA ASN 136 HA ASN 136 -12.295 14.238 0.673 1021 HB2 ASN 136 2HB ASN 136 -10.566 12.659 -0.163 1022 HB3 ASN 136 1HB ASN 136 -11.285 12.737 -1.768 1023 HD21 ASN 136 1HD2 ASN 136 -9.498 13.817 -2.816 1024 HD22 ASN 136 2HD2 ASN 136 -9.025 15.396 -2.413 1025 H LEU 137 H LEU 137 -13.931 12.846 -2.152 1026 HA LEU 137 HA LEU 137 -14.102 15.189 -3.695 1027 HB2 LEU 137 2HB LEU 137 -14.638 12.920 -4.583 1028 HB3 LEU 137 1HB LEU 137 -16.078 12.880 -3.574 1029 HG LEU 137 HG LEU 137 -16.992 14.855 -4.808 1030 HD11 LEU 137 1HD1 LEU 137 -14.338 14.715 -6.257 1031 HD12 LEU 137 2HD1 LEU 137 -15.190 16.120 -5.618 1032 HD13 LEU 137 3HD1 LEU 137 -15.766 15.345 -7.082 1033 HD21 LEU 137 3HD2 LEU 137 -17.497 13.669 -6.898 1034 HD22 LEU 137 1HD2 LEU 137 -17.525 12.547 -5.536 1035 HD23 LEU 137 2HD2 LEU 137 -16.138 12.577 -6.626 1036 H GLU 138 H GLU 138 -16.270 13.865 -1.218 1037 HA GLU 138 HA GLU 138 -18.351 15.747 -1.470 1038 HB2 GLU 138 2HB GLU 138 -17.391 14.227 0.980 1039 HB3 GLU 138 1HB GLU 138 -18.937 15.070 0.858 1040 HG2 GLU 138 2HG GLU 138 -19.585 13.627 -1.035 1041 HG3 GLU 138 1HG GLU 138 -18.040 12.788 -0.934 1042 H HIS 139 H HIS 139 -15.442 15.750 0.580 1043 HA HIS 139 HA HIS 139 -16.031 18.299 1.792 1044 HB2 HIS 139 2HB HIS 139 -14.620 16.567 2.897 1045 HB3 HIS 139 1HB HIS 139 -13.394 16.778 1.648 1046 HD2 HIS 139 2HD HIS 139 -11.513 18.661 2.406 1047 HE1 HIS 139 1HE HIS 139 -13.933 20.927 5.022 1048 HE2 HIS 139 2HE HIS 139 -11.605 20.702 4.033 1049 H HIS 140 H HIS 140 -15.506 20.293 1.073 1050 HA HIS 140 HA HIS 140 -14.605 20.703 -1.611 1051 HB2 HIS 140 2HB HIS 140 -14.840 22.681 0.685 1052 HB3 HIS 140 1HB HIS 140 -14.706 23.088 -1.026 1053 HD2 HIS 140 2HD HIS 140 -17.013 21.993 -2.588 1054 HE1 HIS 140 1HE HIS 140 -19.545 22.039 0.791 1055 HE2 HIS 140 2HE HIS 140 -19.477 21.833 -1.739 1056 H HIS 141 H HIS 141 -12.542 20.269 -2.171 1057 HA HIS 141 HA HIS 141 -10.317 20.389 -0.351 1058 HB2 HIS 141 2HB HIS 141 -8.974 19.904 -2.385 1059 HB3 HIS 141 1HB HIS 141 -10.343 18.804 -2.219 1060 HD2 HIS 141 2HD HIS 141 -9.340 21.925 -4.448 1061 HE1 HIS 141 1HE HIS 141 -12.610 19.961 -6.259 1062 HE2 HIS 141 2HE HIS 141 -10.905 21.824 -6.535 1063 H HIS 142 H HIS 142 -11.962 22.682 -2.301 1064 HA HIS 142 HA HIS 142 -9.855 24.473 -2.924 1065 HB2 HIS 142 2HB HIS 142 -12.796 25.058 -2.420 1066 HB3 HIS 142 1HB HIS 142 -11.653 26.148 -3.208 1067 HD2 HIS 142 2HD HIS 142 -10.733 25.216 -5.798 1068 HE1 HIS 142 1HE HIS 142 -13.763 22.306 -6.200 1069 HE2 HIS 142 2HE HIS 142 -11.921 23.554 -7.424 1070 H HIS 143 H HIS 143 -8.609 25.588 -1.559 1071 HA HIS 143 HA HIS 143 -9.187 25.809 1.262 1072 HB2 HIS 143 2HB HIS 143 -7.025 27.137 -0.415 1073 HB3 HIS 143 1HB HIS 143 -7.057 27.028 1.347 1074 HD2 HIS 143 2HD HIS 143 -5.831 24.964 -1.639 1075 HE1 HIS 143 1HE HIS 143 -5.909 22.319 1.650 1076 HE2 HIS 143 2HE HIS 143 -5.118 22.618 -0.745 1077 H HIS 144 H HIS 144 -9.964 27.545 2.374 1078 HA HIS 144 HA HIS 144 -11.516 29.510 1.060 1079 HB2 HIS 144 2HB HIS 144 -11.683 30.531 3.337 1080 HB3 HIS 144 1HB HIS 144 -12.005 28.797 3.342 1081 HD2 HIS 144 2HD HIS 144 -10.303 27.314 4.971 1082 HE1 HIS 144 1HE HIS 144 -7.514 30.374 5.793 1083 HE2 HIS 144 2HE HIS 144 -8.189 27.990 6.346 Start of MODEL 18 1 H1 GLY 1 1HT GLY 1 -4.929 -21.387 -4.837 2 H2 GLY 1 2HT GLY 1 -5.496 -20.152 -3.816 3 H3 GLY 1 3HT GLY 1 -4.072 -20.992 -3.426 4 HA2 GLY 1 2HA GLY 1 -3.290 -20.117 -5.745 5 HA3 GLY 1 1HA GLY 1 -4.514 -18.888 -5.417 6 H ASN 2 H ASN 2 -1.466 -20.253 -4.412 7 HA ASN 2 HA ASN 2 -1.052 -18.775 -2.032 8 HB2 ASN 2 2HB ASN 2 1.003 -19.822 -4.003 9 HB3 ASN 2 1HB ASN 2 1.315 -19.345 -2.333 10 HD21 ASN 2 1HD2 ASN 2 -0.700 -20.519 -0.887 11 HD22 ASN 2 2HD2 ASN 2 -0.708 -22.200 -1.111 12 H LYS 3 H LYS 3 -0.385 -18.060 -5.431 13 HA LYS 3 HA LYS 3 1.067 -15.631 -4.937 14 HB2 LYS 3 2HB LYS 3 -0.339 -16.655 -7.431 15 HB3 LYS 3 1HB LYS 3 0.733 -15.252 -7.387 16 HG2 LYS 3 2HG LYS 3 2.581 -16.690 -6.592 17 HG3 LYS 3 1HG LYS 3 1.513 -18.093 -6.644 18 HD2 LYS 3 2HD LYS 3 1.206 -17.788 -9.072 19 HD3 LYS 3 1HD LYS 3 2.250 -16.366 -9.033 20 HE2 LYS 3 2HE LYS 3 3.506 -18.352 -9.781 21 HE3 LYS 3 1HE LYS 3 4.128 -17.765 -8.239 22 HZ1 LYS 3 3HZ LYS 3 3.171 -20.301 -8.821 23 HZ2 LYS 3 1HZ LYS 3 2.020 -19.590 -7.798 24 HZ3 LYS 3 2HZ LYS 3 3.642 -19.695 -7.305 25 H ILE 4 H ILE 4 -0.966 -15.253 -3.303 26 HA ILE 4 HA ILE 4 -3.357 -14.173 -4.296 27 HB ILE 4 HB ILE 4 -1.844 -13.472 -1.752 28 HG12 ILE 4 2HG1 ILE 4 -4.195 -15.406 -2.086 29 HG13 ILE 4 1HG1 ILE 4 -2.513 -15.939 -2.137 30 HG21 ILE 4 1HG2 ILE 4 -3.498 -11.736 -2.122 31 HG22 ILE 4 2HG2 ILE 4 -4.199 -12.827 -0.934 32 HG23 ILE 4 3HG2 ILE 4 -4.712 -12.914 -2.619 33 HD11 ILE 4 3HD1 ILE 4 -2.136 -15.057 0.093 34 HD12 ILE 4 1HD1 ILE 4 -3.474 -16.202 0.103 35 HD13 ILE 4 2HD1 ILE 4 -3.799 -14.470 0.169 36 H THR 5 H THR 5 -3.835 -12.294 -5.224 37 HA THR 5 HA THR 5 -1.990 -9.981 -5.083 38 HB THR 5 HB THR 5 -1.454 -11.059 -7.196 39 HG1 THR 5 1HG THR 5 -2.742 -8.687 -7.009 40 HG21 THR 5 3HG2 THR 5 -3.183 -11.539 -8.880 41 HG22 THR 5 1HG2 THR 5 -4.440 -11.037 -7.752 42 HG23 THR 5 2HG2 THR 5 -3.467 -12.468 -7.412 43 H VAL 6 H VAL 6 -3.007 -8.010 -5.306 44 HA VAL 6 HA VAL 6 -5.972 -7.944 -5.465 45 HB VAL 6 HB VAL 6 -6.019 -6.351 -3.562 46 HG11 VAL 6 1HG1 VAL 6 -5.731 -8.017 -1.783 47 HG12 VAL 6 2HG1 VAL 6 -4.781 -9.035 -2.865 48 HG13 VAL 6 3HG1 VAL 6 -6.492 -8.750 -3.192 49 HG21 VAL 6 3HG2 VAL 6 -4.020 -6.231 -2.055 50 HG22 VAL 6 1HG2 VAL 6 -3.694 -5.539 -3.641 51 HG23 VAL 6 2HG2 VAL 6 -3.096 -7.148 -3.245 52 H GLU 7 H GLU 7 -6.789 -5.844 -5.979 53 HA GLU 7 HA GLU 7 -4.872 -3.865 -6.992 54 HB2 GLU 7 2HB GLU 7 -5.904 -3.810 -9.224 55 HB3 GLU 7 1HB GLU 7 -5.190 -5.384 -8.890 56 HG2 GLU 7 2HG GLU 7 -7.305 -5.923 -9.838 57 HG3 GLU 7 1HG GLU 7 -7.577 -6.103 -8.109 58 H VAL 8 H VAL 8 -5.906 -1.868 -7.643 59 HA VAL 8 HA VAL 8 -8.671 -1.407 -6.749 60 HB VAL 8 HB VAL 8 -7.414 -1.109 -4.684 61 HG11 VAL 8 1HG1 VAL 8 -5.690 0.840 -6.224 62 HG12 VAL 8 2HG1 VAL 8 -5.199 -0.740 -5.611 63 HG13 VAL 8 3HG1 VAL 8 -5.607 0.552 -4.487 64 HG21 VAL 8 3HG2 VAL 8 -8.091 1.152 -4.102 65 HG22 VAL 8 1HG2 VAL 8 -9.279 0.516 -5.240 66 HG23 VAL 8 2HG2 VAL 8 -8.050 1.656 -5.790 67 H THR 9 H THR 9 -9.626 0.315 -7.762 68 HA THR 9 HA THR 9 -8.146 1.526 -10.015 69 HB THR 9 HB THR 9 -11.107 1.625 -9.305 70 HG1 THR 9 1HG THR 9 -9.860 -0.431 -9.961 71 HG21 THR 9 3HG2 THR 9 -11.350 2.276 -11.697 72 HG22 THR 9 1HG2 THR 9 -9.593 2.334 -11.844 73 HG23 THR 9 2HG2 THR 9 -10.433 3.469 -10.787 74 H VAL 10 H VAL 10 -7.238 3.479 -9.707 75 HA VAL 10 HA VAL 10 -8.513 5.451 -7.846 76 HB VAL 10 HB VAL 10 -5.536 5.059 -8.359 77 HG11 VAL 10 1HG1 VAL 10 -6.117 7.390 -7.816 78 HG12 VAL 10 2HG1 VAL 10 -5.308 6.646 -6.442 79 HG13 VAL 10 3HG1 VAL 10 -7.061 6.851 -6.427 80 HG21 VAL 10 3HG2 VAL 10 -7.255 4.323 -5.957 81 HG22 VAL 10 1HG2 VAL 10 -5.496 4.220 -6.015 82 HG23 VAL 10 2HG2 VAL 10 -6.471 3.189 -7.057 83 H TYR 11 H TYR 11 -9.059 7.310 -8.810 84 HA TYR 11 HA TYR 11 -8.198 7.848 -11.593 85 HB2 TYR 11 2HB TYR 11 -10.337 9.157 -9.882 86 HB3 TYR 11 1HB TYR 11 -10.034 9.480 -11.588 87 HD1 TYR 11 2HD TYR 11 -11.301 6.976 -9.160 88 HD2 TYR 11 1HD TYR 11 -10.650 7.839 -13.326 89 HE1 TYR 11 2HE TYR 11 -12.736 5.054 -9.790 90 HE2 TYR 11 1HE TYR 11 -12.081 5.915 -13.943 91 HH TYR 11 HH TYR 11 -13.136 4.084 -13.175 92 H ALA 12 H ALA 12 -6.117 8.636 -11.280 93 HA ALA 12 HA ALA 12 -5.885 11.427 -10.691 94 HB1 ALA 12 1HB ALA 12 -4.316 11.178 -8.754 95 HB2 ALA 12 2HB ALA 12 -4.720 9.461 -8.701 96 HB3 ALA 12 3HB ALA 12 -5.961 10.666 -8.373 97 H ALA 13 H ALA 13 -3.787 12.254 -11.203 98 HA ALA 13 HA ALA 13 -2.484 10.906 -13.324 99 HB1 ALA 13 1HB ALA 13 -2.551 13.420 -12.855 100 HB2 ALA 13 2HB ALA 13 -0.983 12.785 -13.351 101 HB3 ALA 13 3HB ALA 13 -1.292 13.151 -11.650 102 H ILE 14 H ILE 14 -0.736 9.552 -13.359 103 HA ILE 14 HA ILE 14 -0.037 8.003 -11.209 104 HB ILE 14 HB ILE 14 0.468 7.601 -13.682 105 HG12 ILE 14 2HG1 ILE 14 2.617 6.315 -13.201 106 HG13 ILE 14 1HG1 ILE 14 2.655 7.084 -11.615 107 HG21 ILE 14 1HG2 ILE 14 2.511 8.426 -14.667 108 HG22 ILE 14 2HG2 ILE 14 3.053 9.126 -13.145 109 HG23 ILE 14 3HG2 ILE 14 1.678 9.831 -14.000 110 HD11 ILE 14 3HD1 ILE 14 1.500 4.676 -12.084 111 HD12 ILE 14 1HD1 ILE 14 0.090 5.693 -12.316 112 HD13 ILE 14 2HD1 ILE 14 0.975 5.742 -10.792 113 H GLU 15 H GLU 15 1.534 10.949 -12.305 114 HA GLU 15 HA GLU 15 3.743 10.879 -10.542 115 HB2 GLU 15 2HB GLU 15 3.939 13.302 -11.079 116 HB3 GLU 15 1HB GLU 15 3.735 12.304 -12.517 117 HG2 GLU 15 2HG GLU 15 1.300 12.836 -12.513 118 HG3 GLU 15 1HG GLU 15 1.549 13.893 -11.127 119 H LYS 16 H LYS 16 0.442 12.073 -10.186 120 HA LYS 16 HA LYS 16 0.887 13.458 -7.711 121 HB2 LYS 16 2HB LYS 16 -1.023 13.919 -9.251 122 HB3 LYS 16 1HB LYS 16 -1.706 12.347 -8.847 123 HG2 LYS 16 2HG LYS 16 -1.886 13.008 -6.479 124 HG3 LYS 16 1HG LYS 16 -1.138 14.562 -6.843 125 HD2 LYS 16 2HD LYS 16 -3.026 15.097 -8.365 126 HD3 LYS 16 1HD LYS 16 -3.776 13.552 -7.964 127 HE2 LYS 16 2HE LYS 16 -3.150 15.764 -5.978 128 HE3 LYS 16 1HE LYS 16 -4.747 15.399 -6.628 129 HZ1 LYS 16 3HZ LYS 16 -3.558 14.269 -4.414 130 HZ2 LYS 16 1HZ LYS 16 -3.522 13.058 -5.599 131 HZ3 LYS 16 2HZ LYS 16 -4.998 13.772 -5.164 132 H VAL 17 H VAL 17 -0.413 10.246 -8.554 133 HA VAL 17 HA VAL 17 -1.007 9.382 -5.943 134 HB VAL 17 HB VAL 17 -0.177 7.706 -8.339 135 HG11 VAL 17 1HG1 VAL 17 -1.518 5.914 -7.186 136 HG12 VAL 17 2HG1 VAL 17 -1.658 6.969 -5.782 137 HG13 VAL 17 3HG1 VAL 17 -0.079 6.368 -6.282 138 HG21 VAL 17 3HG2 VAL 17 -2.917 8.563 -7.349 139 HG22 VAL 17 1HG2 VAL 17 -2.609 7.501 -8.723 140 HG23 VAL 17 2HG2 VAL 17 -2.109 9.188 -8.786 141 H TRP 18 H TRP 18 1.987 9.181 -7.842 142 HA TRP 18 HA TRP 18 3.445 7.493 -6.184 143 HB2 TRP 18 2HB TRP 18 4.202 8.332 -8.409 144 HB3 TRP 18 1HB TRP 18 4.513 9.912 -7.692 145 HD1 TRP 18 HD TRP 18 6.461 10.011 -5.784 146 HE1 TRP 18 1HE TRP 18 8.550 8.534 -5.447 147 HE3 TRP 18 3HE TRP 18 5.203 6.027 -8.713 148 HZ2 TRP 18 2HZ TRP 18 9.555 6.008 -6.314 149 HZ3 TRP 18 3HZ TRP 18 6.743 4.101 -8.942 150 HH2 TRP 18 HH TRP 18 8.914 4.087 -7.742 151 H LYS 19 H LYS 19 2.905 10.997 -5.915 152 HA LYS 19 HA LYS 19 4.680 11.456 -3.733 153 HB2 LYS 19 2HB LYS 19 2.219 12.984 -4.648 154 HB3 LYS 19 1HB LYS 19 3.381 13.580 -3.462 155 HG2 LYS 19 2HG LYS 19 5.182 13.454 -5.139 156 HG3 LYS 19 1HG LYS 19 4.040 12.836 -6.331 157 HD2 LYS 19 2HD LYS 19 2.713 14.926 -6.131 158 HD3 LYS 19 1HD LYS 19 3.885 15.545 -4.967 159 HE2 LYS 19 2HE LYS 19 4.476 14.790 -7.847 160 HE3 LYS 19 1HE LYS 19 4.357 16.432 -7.213 161 HZ1 LYS 19 3HZ LYS 19 6.142 15.603 -5.564 162 HZ2 LYS 19 1HZ LYS 19 6.606 16.036 -7.137 163 HZ3 LYS 19 2HZ LYS 19 6.426 14.397 -6.727 164 H TYR 20 H TYR 20 1.091 11.067 -3.802 165 HA TYR 20 HA TYR 20 0.803 11.157 -0.978 166 HB2 TYR 20 2HB TYR 20 -0.971 10.217 -3.242 167 HB3 TYR 20 1HB TYR 20 -1.479 9.997 -1.567 168 HD1 TYR 20 1HD TYR 20 -1.719 11.991 -0.041 169 HD2 TYR 20 2HD TYR 20 -1.030 12.455 -4.258 170 HE1 TYR 20 1HE TYR 20 -2.432 14.359 0.098 171 HE2 TYR 20 2HE TYR 20 -1.747 14.822 -4.114 172 HH TYR 20 HH TYR 20 -3.339 16.161 -2.429 173 H TRP 21 H TRP 21 1.128 8.468 -3.245 174 HA TRP 21 HA TRP 21 0.711 6.394 -1.379 175 HB2 TRP 21 2HB TRP 21 0.680 6.204 -3.907 176 HB3 TRP 21 1HB TRP 21 2.442 6.275 -3.893 177 HD1 TRP 21 HD TRP 21 3.658 3.999 -3.475 178 HE1 TRP 21 1HE TRP 21 2.912 1.645 -2.733 179 HE3 TRP 21 3HE TRP 21 -1.219 4.954 -2.366 180 HZ2 TRP 21 2HZ TRP 21 0.539 0.343 -1.797 181 HZ3 TRP 21 3HZ TRP 21 -2.707 3.149 -1.562 182 HH2 TRP 21 HH TRP 21 -1.836 0.845 -1.276 183 H ASN 22 H ASN 22 3.405 8.505 -1.857 184 HA ASN 22 HA ASN 22 5.271 6.747 -0.322 185 HB2 ASN 22 2HB ASN 22 5.827 9.152 -2.077 186 HB3 ASN 22 1HB ASN 22 7.045 8.202 -1.227 187 HD21 ASN 22 1HD2 ASN 22 4.838 5.895 -2.119 188 HD22 ASN 22 2HD2 ASN 22 5.472 5.478 -3.639 189 H GLU 23 H GLU 23 3.593 9.836 -0.248 190 HA GLU 23 HA GLU 23 5.140 11.286 1.557 191 HB2 GLU 23 2HB GLU 23 2.251 11.250 0.850 192 HB3 GLU 23 1HB GLU 23 2.639 12.076 2.346 193 HG2 GLU 23 2HG GLU 23 4.154 13.595 1.210 194 HG3 GLU 23 1HG GLU 23 4.036 12.696 -0.294 195 HA PRO 24 HA PRO 24 4.902 8.190 4.987 196 HB2 PRO 24 2HB PRO 24 6.132 10.513 6.516 197 HB3 PRO 24 1HB PRO 24 6.609 8.797 6.519 198 HG2 PRO 24 2HG PRO 24 8.054 10.559 5.161 199 HG3 PRO 24 1HG PRO 24 7.691 8.979 4.446 200 HD2 PRO 24 2HD PRO 24 6.411 11.644 3.813 201 HD3 PRO 24 1HD PRO 24 6.872 10.320 2.716 202 H ALA 25 H ALA 25 4.163 11.628 5.471 203 HA ALA 25 HA ALA 25 2.477 11.395 7.694 204 HB1 ALA 25 1HB ALA 25 2.343 13.437 5.462 205 HB2 ALA 25 2HB ALA 25 3.382 13.535 6.882 206 HB3 ALA 25 3HB ALA 25 1.630 13.610 7.066 207 H HIS 26 H HIS 26 1.811 10.996 4.260 208 HA HIS 26 HA HIS 26 -1.053 10.901 4.545 209 HB2 HIS 26 2HB HIS 26 0.104 11.526 2.419 210 HB3 HIS 26 1HB HIS 26 0.656 9.862 2.254 211 HD2 HIS 26 2HD HIS 26 -1.184 8.222 0.977 212 HE1 HIS 26 1HE HIS 26 -4.573 10.706 1.390 213 HE2 HIS 26 2HE HIS 26 -3.711 8.535 0.397 214 H ILE 27 H ILE 27 1.497 8.391 4.263 215 HA ILE 27 HA ILE 27 -0.247 6.177 4.085 216 HB ILE 27 HB ILE 27 2.577 6.386 5.214 217 HG12 ILE 27 2HG1 ILE 27 1.626 5.427 2.468 218 HG13 ILE 27 1HG1 ILE 27 2.185 7.069 2.778 219 HG21 ILE 27 1HG2 ILE 27 2.673 3.893 4.700 220 HG22 ILE 27 2HG2 ILE 27 0.933 3.935 4.433 221 HG23 ILE 27 3HG2 ILE 27 1.593 4.297 6.027 222 HD11 ILE 27 3HD1 ILE 27 3.813 4.542 3.163 223 HD12 ILE 27 1HD1 ILE 27 4.366 6.173 3.548 224 HD13 ILE 27 2HD1 ILE 27 4.015 5.730 1.878 225 H MET 28 H MET 28 1.236 7.730 6.945 226 HA MET 28 HA MET 28 0.108 5.896 8.838 227 HB2 MET 28 2HB MET 28 0.901 7.481 10.528 228 HB3 MET 28 1HB MET 28 2.145 7.213 9.316 229 HG2 MET 28 2HG MET 28 1.305 9.315 8.169 230 HG3 MET 28 1HG MET 28 0.320 9.626 9.590 231 HE1 MET 28 3HE MET 28 2.512 8.535 12.040 232 HE2 MET 28 1HE MET 28 1.137 9.639 11.896 233 HE3 MET 28 2HE MET 28 2.702 10.240 12.427 234 H LYS 29 H LYS 29 -1.372 8.268 6.973 235 HA LYS 29 HA LYS 29 -3.301 9.188 8.957 236 HB2 LYS 29 2HB LYS 29 -2.425 10.620 7.076 237 HB3 LYS 29 1HB LYS 29 -3.314 9.607 5.944 238 HG2 LYS 29 2HG LYS 29 -5.434 10.181 7.035 239 HG3 LYS 29 1HG LYS 29 -4.572 11.142 8.240 240 HD2 LYS 29 2HD LYS 29 -3.720 12.621 6.437 241 HD3 LYS 29 1HD LYS 29 -4.616 11.673 5.249 242 HE2 LYS 29 2HE LYS 29 -5.829 13.207 7.568 243 HE3 LYS 29 1HE LYS 29 -5.874 13.693 5.874 244 HZ1 LYS 29 3HZ LYS 29 -6.921 11.400 5.507 245 HZ2 LYS 29 1HZ LYS 29 -7.887 12.622 6.182 246 HZ3 LYS 29 2HZ LYS 29 -7.222 11.419 7.180 247 H TRP 30 H TRP 30 -3.148 6.745 6.437 248 HA TRP 30 HA TRP 30 -5.876 5.785 7.168 249 HB2 TRP 30 2HB TRP 30 -6.340 5.252 4.813 250 HB3 TRP 30 1HB TRP 30 -6.068 6.982 5.013 251 HD1 TRP 30 HD TRP 30 -3.767 7.972 4.101 252 HE1 TRP 30 1HE TRP 30 -2.066 7.102 2.366 253 HE3 TRP 30 3HE TRP 30 -5.336 3.127 3.672 254 HZ2 TRP 30 2HZ TRP 30 -1.466 4.679 0.973 255 HZ3 TRP 30 3HZ TRP 30 -4.194 1.568 2.141 256 HH2 TRP 30 HH TRP 30 -2.265 2.332 0.790 257 H CYS 31 H CYS 31 -2.876 4.965 7.669 258 HA CYS 31 HA CYS 31 -2.162 2.645 6.411 259 HB2 CYS 31 2HB CYS 31 -1.046 2.009 8.493 260 HB3 CYS 31 1HB CYS 31 -0.893 3.747 8.243 261 HG CYS 31 HG CYS 31 -2.255 4.167 10.277 262 H GLN 32 H GLN 32 -3.004 0.632 6.192 263 HA GLN 32 HA GLN 32 -4.390 -1.179 6.416 264 HB2 GLN 32 2HB GLN 32 -3.328 -1.151 8.737 265 HB3 GLN 32 1HB GLN 32 -4.764 -0.321 9.315 266 HG2 GLN 32 2HG GLN 32 -6.167 -2.213 8.602 267 HG3 GLN 32 1HG GLN 32 -4.749 -3.044 7.977 268 HE21 GLN 32 1HE2 GLN 32 -6.408 -4.162 10.051 269 HE22 GLN 32 2HE2 GLN 32 -5.488 -4.237 11.476 270 H ALA 33 H ALA 33 -5.452 1.970 6.932 271 HA ALA 33 HA ALA 33 -7.442 3.070 6.799 272 HB1 ALA 33 1HB ALA 33 -8.274 0.620 5.217 273 HB2 ALA 33 2HB ALA 33 -7.365 1.976 4.556 274 HB3 ALA 33 3HB ALA 33 -9.013 2.217 5.138 275 H SER 34 H SER 34 -7.048 1.346 9.144 276 HA SER 34 HA SER 34 -9.863 0.634 9.816 277 HB2 SER 34 2HB SER 34 -8.438 -1.348 9.707 278 HB3 SER 34 1HB SER 34 -7.278 -0.595 10.793 279 HG SER 34 HG SER 34 -8.584 -1.855 12.041 280 HA PRO 35 HA PRO 35 -9.019 3.758 13.045 281 HB2 PRO 35 2HB PRO 35 -11.341 3.715 14.436 282 HB3 PRO 35 1HB PRO 35 -11.316 4.262 12.740 283 HG2 PRO 35 2HG PRO 35 -12.012 1.525 13.805 284 HG3 PRO 35 1HG PRO 35 -12.945 2.549 12.688 285 HD2 PRO 35 2HD PRO 35 -11.290 0.558 11.765 286 HD3 PRO 35 1HD PRO 35 -11.520 2.073 10.854 287 H GLU 36 H GLU 36 -9.360 0.401 13.572 288 HA GLU 36 HA GLU 36 -9.188 0.351 16.457 289 HB2 GLU 36 2HB GLU 36 -8.598 -1.772 14.365 290 HB3 GLU 36 1HB GLU 36 -8.696 -2.067 16.103 291 HG2 GLU 36 2HG GLU 36 -11.036 -1.258 16.105 292 HG3 GLU 36 1HG GLU 36 -10.938 -0.981 14.368 293 H TRP 37 H TRP 37 -6.940 0.629 13.831 294 HA TRP 37 HA TRP 37 -4.585 0.205 15.602 295 HB2 TRP 37 2HB TRP 37 -4.947 0.200 12.574 296 HB3 TRP 37 1HB TRP 37 -3.352 0.259 13.333 297 HD1 TRP 37 HD TRP 37 -6.446 -2.011 13.105 298 HE1 TRP 37 1HE TRP 37 -5.736 -4.420 13.673 299 HE3 TRP 37 3HE TRP 37 -1.592 -1.198 14.463 300 HZ2 TRP 37 2HZ TRP 37 -3.412 -5.820 14.588 301 HZ3 TRP 37 3HZ TRP 37 -0.154 -3.085 15.178 302 HH2 TRP 37 HH TRP 37 -1.060 -5.393 15.241 303 H HIS 38 H HIS 38 -2.888 1.719 15.564 304 HA HIS 38 HA HIS 38 -3.486 4.453 14.594 305 HB2 HIS 38 2HB HIS 38 -4.200 4.296 17.000 306 HB3 HIS 38 1HB HIS 38 -2.572 3.775 17.423 307 HD2 HIS 38 2HD HIS 38 -0.867 5.892 17.949 308 HE1 HIS 38 1HE HIS 38 -3.081 8.929 16.026 309 HE2 HIS 38 2HE HIS 38 -1.008 8.443 17.408 310 H VAL 39 H VAL 39 -1.473 5.788 14.670 311 HA VAL 39 HA VAL 39 1.034 4.198 14.454 312 HB VAL 39 HB VAL 39 0.191 6.411 12.563 313 HG11 VAL 39 1HG1 VAL 39 2.628 6.193 12.762 314 HG12 VAL 39 2HG1 VAL 39 2.117 5.517 11.218 315 HG13 VAL 39 3HG1 VAL 39 2.523 4.445 12.551 316 HG21 VAL 39 3HG2 VAL 39 0.167 3.393 12.191 317 HG22 VAL 39 1HG2 VAL 39 -0.111 4.578 10.913 318 HG23 VAL 39 2HG2 VAL 39 -1.244 4.451 12.256 319 HA PRO 40 HA PRO 40 1.675 7.935 17.132 320 HB2 PRO 40 2HB PRO 40 3.536 6.929 18.873 321 HB3 PRO 40 1HB PRO 40 1.803 6.560 19.030 322 HG2 PRO 40 2HG PRO 40 3.982 4.877 17.817 323 HG3 PRO 40 1HG PRO 40 2.658 4.386 18.897 324 HD2 PRO 40 2HD PRO 40 2.567 4.041 16.161 325 HD3 PRO 40 1HD PRO 40 1.096 4.258 17.138 326 H ALA 41 H ALA 41 3.705 6.142 15.060 327 HA ALA 41 HA ALA 41 5.238 8.445 14.316 328 HB1 ALA 41 1HB ALA 41 6.457 7.879 16.386 329 HB2 ALA 41 2HB ALA 41 7.463 7.598 14.967 330 HB3 ALA 41 3HB ALA 41 6.704 6.237 15.798 331 H ALA 42 H ALA 42 6.436 8.104 12.429 332 HA ALA 42 HA ALA 42 6.644 5.453 11.246 333 HB1 ALA 42 1HB ALA 42 4.973 7.606 9.917 334 HB2 ALA 42 2HB ALA 42 4.359 6.117 10.621 335 HB3 ALA 42 3HB ALA 42 5.405 6.046 9.209 336 H GLN 43 H GLN 43 8.264 5.315 9.757 337 HA GLN 43 HA GLN 43 9.597 7.796 8.798 338 HB2 GLN 43 2HB GLN 43 10.983 5.438 10.129 339 HB3 GLN 43 1HB GLN 43 11.796 6.792 9.339 340 HG2 GLN 43 2HG GLN 43 10.716 8.354 10.946 341 HG3 GLN 43 1HG GLN 43 9.964 6.980 11.753 342 HE21 GLN 43 1HE2 GLN 43 11.088 6.704 13.699 343 HE22 GLN 43 2HE2 GLN 43 12.780 6.673 13.834 344 H ASN 44 H ASN 44 10.470 7.616 6.788 345 HA ASN 44 HA ASN 44 10.934 5.104 5.452 346 HB2 ASN 44 2HB ASN 44 8.464 5.227 5.286 347 HB3 ASN 44 1HB ASN 44 8.600 6.794 4.517 348 HD21 ASN 44 1HD2 ASN 44 7.299 5.060 2.953 349 HD22 ASN 44 2HD2 ASN 44 8.285 4.418 1.731 350 H ASP 45 H ASP 45 12.392 5.397 3.859 351 HA ASP 45 HA ASP 45 12.920 8.140 2.799 352 HB2 ASP 45 2HB ASP 45 14.962 6.072 3.684 353 HB3 ASP 45 1HB ASP 45 15.327 7.622 2.926 354 H LEU 46 H LEU 46 12.156 7.901 0.751 355 HA LEU 46 HA LEU 46 12.370 5.471 -0.772 356 HB2 LEU 46 2HB LEU 46 11.542 8.326 -1.347 357 HB3 LEU 46 1HB LEU 46 11.754 7.220 -2.695 358 HG LEU 46 HG LEU 46 9.380 7.357 -1.899 359 HD11 LEU 46 1HD1 LEU 46 8.916 5.146 -2.320 360 HD12 LEU 46 2HD1 LEU 46 10.152 4.523 -1.227 361 HD13 LEU 46 3HD1 LEU 46 10.603 5.123 -2.825 362 HD21 LEU 46 3HD2 LEU 46 9.983 7.707 0.534 363 HD22 LEU 46 1HD2 LEU 46 10.353 5.981 0.629 364 HD23 LEU 46 2HD2 LEU 46 8.715 6.515 0.260 365 H LYS 47 H LYS 47 14.510 4.858 -0.884 366 HA LYS 47 HA LYS 47 16.073 5.954 -3.002 367 HB2 LYS 47 2HB LYS 47 18.011 6.719 -1.690 368 HB3 LYS 47 1HB LYS 47 16.590 7.690 -1.316 369 HG2 LYS 47 2HG LYS 47 16.202 6.105 0.683 370 HG3 LYS 47 1HG LYS 47 17.815 5.475 0.368 371 HD2 LYS 47 2HD LYS 47 17.139 8.375 0.998 372 HD3 LYS 47 1HD LYS 47 17.846 7.218 2.121 373 HE2 LYS 47 2HE LYS 47 19.773 6.956 0.434 374 HE3 LYS 47 1HE LYS 47 19.124 8.393 -0.363 375 HZ1 LYS 47 3HZ LYS 47 19.720 8.326 2.536 376 HZ2 LYS 47 1HZ LYS 47 19.467 9.681 1.548 377 HZ3 LYS 47 2HZ LYS 47 20.886 8.762 1.380 378 H ALA 48 H ALA 48 17.856 4.604 -3.511 379 HA ALA 48 HA ALA 48 17.533 1.875 -2.836 380 HB1 ALA 48 1HB ALA 48 18.560 2.634 -4.942 381 HB2 ALA 48 2HB ALA 48 19.633 1.539 -4.075 382 HB3 ALA 48 3HB ALA 48 19.936 3.277 -4.046 383 H GLY 49 H GLY 49 18.515 0.580 -1.329 384 HA2 GLY 49 2HA GLY 49 19.841 -0.070 0.449 385 HA3 GLY 49 1HA GLY 49 20.887 1.310 0.124 386 H GLY 50 H GLY 50 17.813 2.493 0.314 387 HA2 GLY 50 2HA GLY 50 18.241 3.786 2.849 388 HA3 GLY 50 1HA GLY 50 16.793 3.883 1.852 389 H THR 51 H THR 51 17.082 3.520 4.758 390 HA THR 51 HA THR 51 15.758 0.875 5.166 391 HB THR 51 HB THR 51 16.446 1.062 7.485 392 HG1 THR 51 1HG THR 51 16.673 2.988 8.235 393 HG21 THR 51 3HG2 THR 51 18.889 1.039 7.241 394 HG22 THR 51 1HG2 THR 51 18.757 1.848 5.680 395 HG23 THR 51 2HG2 THR 51 18.141 0.210 5.880 396 H PHE 52 H PHE 52 13.782 0.817 6.176 397 HA PHE 52 HA PHE 52 12.430 3.401 6.837 398 HB2 PHE 52 2HB PHE 52 10.375 2.512 5.874 399 HB3 PHE 52 1HB PHE 52 11.643 2.500 4.651 400 HD1 PHE 52 1HD PHE 52 9.590 0.397 6.914 401 HD2 PHE 52 2HD PHE 52 12.615 0.368 3.858 402 HE1 PHE 52 1HE PHE 52 9.295 -2.050 6.649 403 HE2 PHE 52 2HE PHE 52 12.315 -2.075 3.596 404 HZ PHE 52 HZ PHE 52 10.659 -3.285 4.987 405 H THR 53 H THR 53 10.863 3.274 8.477 406 HA THR 53 HA THR 53 10.535 0.777 9.982 407 HB THR 53 HB THR 53 11.657 3.277 11.315 408 HG1 THR 53 1HG THR 53 13.446 2.520 10.544 409 HG21 THR 53 3HG2 THR 53 10.253 1.906 12.804 410 HG22 THR 53 1HG2 THR 53 11.951 1.742 13.248 411 HG23 THR 53 2HG2 THR 53 11.150 0.460 12.340 412 H THR 54 H THR 54 8.406 0.652 10.261 413 HA THR 54 HA THR 54 6.804 3.119 10.773 414 HB THR 54 HB THR 54 5.849 0.519 9.514 415 HG1 THR 54 1HG THR 54 5.808 2.588 7.866 416 HG21 THR 54 3HG2 THR 54 4.089 1.873 10.635 417 HG22 THR 54 1HG2 THR 54 3.891 1.889 8.885 418 HG23 THR 54 2HG2 THR 54 4.591 3.282 9.704 419 H THR 55 H THR 55 6.235 3.225 12.868 420 HA THR 55 HA THR 55 6.074 0.771 14.506 421 HB THR 55 HB THR 55 5.771 3.697 15.313 422 HG1 THR 55 1HG THR 55 7.816 3.200 14.427 423 HG21 THR 55 3HG2 THR 55 6.301 1.172 16.923 424 HG22 THR 55 1HG2 THR 55 4.817 2.125 16.954 425 HG23 THR 55 2HG2 THR 55 6.316 2.812 17.571 426 H MET 56 H MET 56 4.162 -0.259 14.575 427 HA MET 56 HA MET 56 1.606 1.294 14.407 428 HB2 MET 56 2HB MET 56 2.213 -1.564 13.563 429 HB3 MET 56 1HB MET 56 0.632 -0.786 13.493 430 HG2 MET 56 2HG MET 56 1.571 0.936 11.954 431 HG3 MET 56 1HG MET 56 3.116 0.089 11.994 432 HE1 MET 56 3HE MET 56 -0.730 -1.108 9.826 433 HE2 MET 56 1HE MET 56 -0.155 0.514 10.225 434 HE3 MET 56 2HE MET 56 -0.728 -0.557 11.497 435 H ALA 57 H ALA 57 0.337 1.191 16.160 436 HA ALA 57 HA ALA 57 0.547 -1.100 18.038 437 HB1 ALA 57 1HB ALA 57 0.499 0.431 19.942 438 HB2 ALA 57 2HB ALA 57 0.524 1.817 18.849 439 HB3 ALA 57 3HB ALA 57 1.917 0.738 18.940 440 H ALA 58 H ALA 58 -1.324 -1.824 18.754 441 HA ALA 58 HA ALA 58 -3.798 -0.939 17.621 442 HB1 ALA 58 1HB ALA 58 -4.824 -2.645 19.063 443 HB2 ALA 58 2HB ALA 58 -3.300 -2.841 19.932 444 HB3 ALA 58 3HB ALA 58 -3.411 -3.292 18.229 445 H LYS 59 H LYS 59 -5.584 0.060 18.701 446 HA LYS 59 HA LYS 59 -4.967 2.225 20.330 447 HB2 LYS 59 2HB LYS 59 -7.022 1.966 18.933 448 HB3 LYS 59 1HB LYS 59 -7.634 0.782 20.085 449 HG2 LYS 59 2HG LYS 59 -7.579 2.486 21.871 450 HG3 LYS 59 1HG LYS 59 -6.937 3.660 20.727 451 HD2 LYS 59 2HD LYS 59 -8.993 3.446 19.363 452 HD3 LYS 59 1HD LYS 59 -9.629 2.274 20.516 453 HE2 LYS 59 2HE LYS 59 -10.551 4.517 20.958 454 HE3 LYS 59 1HE LYS 59 -9.540 3.987 22.302 455 HZ1 LYS 59 3HZ LYS 59 -9.176 6.326 21.451 456 HZ2 LYS 59 1HZ LYS 59 -8.472 5.620 20.079 457 HZ3 LYS 59 2HZ LYS 59 -7.792 5.356 21.614 458 H ASP 60 H ASP 60 -6.086 -1.036 21.178 459 HA ASP 60 HA ASP 60 -6.315 -0.502 24.015 460 HB2 ASP 60 2HB ASP 60 -6.189 -3.102 22.453 461 HB3 ASP 60 1HB ASP 60 -6.596 -2.968 24.163 462 H GLY 61 H GLY 61 -3.727 -0.977 21.892 463 HA2 GLY 61 2HA GLY 61 -1.468 -1.230 22.219 464 HA3 GLY 61 1HA GLY 61 -1.753 -0.909 23.926 465 H SER 62 H SER 62 -3.555 -3.502 22.568 466 HA SER 62 HA SER 62 -2.160 -5.458 24.230 467 HB2 SER 62 2HB SER 62 -3.967 -6.950 23.575 468 HB3 SER 62 1HB SER 62 -4.644 -5.390 24.042 469 HG SER 62 HG SER 62 -4.110 -5.174 21.508 470 H MET 63 H MET 63 -1.847 -4.290 21.066 471 HA MET 63 HA MET 63 -0.013 -6.468 20.361 472 HB2 MET 63 2HB MET 63 -2.302 -7.184 19.530 473 HB3 MET 63 1HB MET 63 -2.326 -5.760 18.493 474 HG2 MET 63 2HG MET 63 -0.248 -6.547 17.379 475 HG3 MET 63 1HG MET 63 -0.241 -7.965 18.422 476 HE1 MET 63 3HE MET 63 -1.135 -9.290 14.881 477 HE2 MET 63 1HE MET 63 -0.186 -9.617 16.338 478 HE3 MET 63 2HE MET 63 0.029 -8.102 15.465 479 H SER 64 H SER 64 1.775 -5.484 19.632 480 HA SER 64 HA SER 64 1.595 -3.223 17.755 481 HB2 SER 64 2HB SER 64 3.240 -3.158 20.301 482 HB3 SER 64 1HB SER 64 3.273 -1.941 19.026 483 HG SER 64 HG SER 64 1.540 -2.248 21.064 484 H PHE 65 H PHE 65 3.373 -3.025 16.404 485 HA PHE 65 HA PHE 65 5.739 -4.678 16.696 486 HB2 PHE 65 2HB PHE 65 3.628 -5.321 14.599 487 HB3 PHE 65 1HB PHE 65 5.312 -5.801 14.404 488 HD1 PHE 65 2HD PHE 65 6.424 -7.191 16.251 489 HD2 PHE 65 1HD PHE 65 2.156 -6.690 15.982 490 HE1 PHE 65 2HE PHE 65 6.094 -9.184 17.680 491 HE2 PHE 65 1HE PHE 65 1.844 -8.688 17.411 492 HZ PHE 65 HZ PHE 65 3.806 -9.932 18.261 493 H ASP 66 H ASP 66 7.221 -4.350 14.868 494 HA ASP 66 HA ASP 66 6.807 -1.829 13.360 495 HB2 ASP 66 2HB ASP 66 9.097 -1.125 13.969 496 HB3 ASP 66 1HB ASP 66 8.058 -1.241 15.387 497 H PHE 67 H PHE 67 7.207 -2.175 11.276 498 HA PHE 67 HA PHE 67 8.730 -4.564 10.412 499 HB2 PHE 67 2HB PHE 67 7.127 -2.553 8.784 500 HB3 PHE 67 1HB PHE 67 7.813 -4.070 8.197 501 HD1 PHE 67 2HD PHE 67 6.931 -6.264 9.003 502 HD2 PHE 67 1HD PHE 67 5.099 -2.548 10.164 503 HE1 PHE 67 2HE PHE 67 4.922 -7.491 9.780 504 HE2 PHE 67 1HE PHE 67 3.097 -3.781 10.942 505 HZ PHE 67 HZ PHE 67 3.006 -6.253 10.749 506 H GLY 68 H GLY 68 10.546 -4.445 9.129 507 HA2 GLY 68 2HA GLY 68 11.667 -1.841 8.346 508 HA3 GLY 68 1HA GLY 68 12.585 -2.788 9.519 509 H GLY 69 H GLY 69 13.349 -2.022 6.843 510 HA2 GLY 69 2HA GLY 69 14.479 -4.453 5.931 511 HA3 GLY 69 1HA GLY 69 13.088 -4.034 4.929 512 H VAL 70 H VAL 70 14.996 -3.986 3.347 513 HA VAL 70 HA VAL 70 16.057 -1.198 3.154 514 HB VAL 70 HB VAL 70 17.506 -3.749 2.325 515 HG11 VAL 70 1HG1 VAL 70 19.440 -2.193 2.052 516 HG12 VAL 70 2HG1 VAL 70 18.373 -0.834 2.406 517 HG13 VAL 70 3HG1 VAL 70 18.118 -1.802 0.955 518 HG21 VAL 70 3HG2 VAL 70 17.932 -1.926 4.722 519 HG22 VAL 70 1HG2 VAL 70 19.010 -3.236 4.244 520 HG23 VAL 70 2HG2 VAL 70 17.370 -3.595 4.773 521 H TYR 71 H TYR 71 15.752 -0.227 1.217 522 HA TYR 71 HA TYR 71 14.012 -1.459 -0.733 523 HB2 TYR 71 2HB TYR 71 15.593 1.141 -0.815 524 HB3 TYR 71 1HB TYR 71 14.392 0.659 -2.009 525 HD1 TYR 71 2HD TYR 71 12.022 0.039 -1.164 526 HD2 TYR 71 1HD TYR 71 14.831 2.313 1.181 527 HE1 TYR 71 2HE TYR 71 10.176 0.876 0.253 528 HE2 TYR 71 1HE TYR 71 12.970 3.145 2.585 529 HH TYR 71 HH TYR 71 9.599 2.190 1.933 530 H ASP 72 H ASP 72 14.625 -2.804 -2.320 531 HA ASP 72 HA ASP 72 17.406 -3.337 -2.900 532 HB2 ASP 72 2HB ASP 72 14.849 -4.260 -4.255 533 HB3 ASP 72 1HB ASP 72 16.457 -4.888 -4.607 534 H GLN 73 H GLN 73 14.749 -1.604 -4.465 535 HA GLN 73 HA GLN 73 16.568 0.051 -5.982 536 HB2 GLN 73 2HB GLN 73 16.489 -2.034 -7.368 537 HB3 GLN 73 1HB GLN 73 14.744 -1.847 -7.510 538 HG2 GLN 73 2HG GLN 73 15.051 0.328 -8.636 539 HG3 GLN 73 1HG GLN 73 16.797 0.186 -8.451 540 HE21 GLN 73 1HE2 GLN 73 15.119 0.275 -10.969 541 HE22 GLN 73 2HE2 GLN 73 15.535 -1.129 -11.825 542 H VAL 74 H VAL 74 15.558 1.912 -6.726 543 HA VAL 74 HA VAL 74 12.616 2.190 -6.429 544 HB VAL 74 HB VAL 74 14.614 4.183 -5.271 545 HG11 VAL 74 1HG1 VAL 74 12.523 5.227 -6.033 546 HG12 VAL 74 2HG1 VAL 74 12.586 5.206 -4.275 547 HG13 VAL 74 3HG1 VAL 74 11.585 4.034 -5.133 548 HG21 VAL 74 3HG2 VAL 74 14.610 2.140 -3.926 549 HG22 VAL 74 1HG2 VAL 74 12.846 2.140 -3.879 550 HG23 VAL 74 2HG2 VAL 74 13.755 3.413 -3.060 551 H LYS 75 H LYS 75 11.758 3.239 -8.133 552 HA LYS 75 HA LYS 75 13.305 5.204 -9.684 553 HB2 LYS 75 2HB LYS 75 12.320 2.540 -10.744 554 HB3 LYS 75 1HB LYS 75 12.429 3.926 -11.832 555 HG2 LYS 75 2HG LYS 75 14.833 4.154 -11.265 556 HG3 LYS 75 1HG LYS 75 14.708 2.752 -10.203 557 HD2 LYS 75 2HD LYS 75 14.071 1.335 -12.111 558 HD3 LYS 75 1HD LYS 75 14.136 2.728 -13.188 559 HE2 LYS 75 2HE LYS 75 16.477 1.612 -11.612 560 HE3 LYS 75 1HE LYS 75 16.209 1.403 -13.343 561 HZ1 LYS 75 3HZ LYS 75 17.050 3.775 -11.863 562 HZ2 LYS 75 1HZ LYS 75 16.036 4.021 -13.199 563 HZ3 LYS 75 2HZ LYS 75 17.524 3.230 -13.400 564 H THR 76 H THR 76 12.044 6.892 -10.010 565 HA THR 76 HA THR 76 9.440 7.181 -9.159 566 HB THR 76 HB THR 76 9.380 9.244 -10.477 567 HG1 THR 76 1HG THR 76 10.464 8.039 -12.288 568 HG21 THR 76 3HG2 THR 76 11.464 10.264 -9.656 569 HG22 THR 76 1HG2 THR 76 12.159 8.666 -9.395 570 HG23 THR 76 2HG2 THR 76 10.777 9.193 -8.435 571 H ASN 77 H ASN 77 7.568 6.398 -9.834 572 HA ASN 77 HA ASN 77 5.918 5.445 -11.125 573 HB2 ASN 77 2HB ASN 77 7.178 7.185 -13.264 574 HB3 ASN 77 1HB ASN 77 5.562 6.486 -13.323 575 HD21 ASN 77 1HD2 ASN 77 6.957 9.375 -12.786 576 HD22 ASN 77 2HD2 ASN 77 5.918 10.010 -11.603 577 H ASP 78 H ASP 78 7.564 3.506 -10.791 578 HA ASP 78 HA ASP 78 7.707 2.089 -13.346 579 HB2 ASP 78 2HB ASP 78 10.165 2.794 -11.721 580 HB3 ASP 78 1HB ASP 78 10.166 1.524 -12.941 581 H LEU 79 H LEU 79 9.631 1.427 -10.458 582 HA LEU 79 HA LEU 79 7.719 -0.635 -9.530 583 HB2 LEU 79 2HB LEU 79 9.301 -1.617 -11.322 584 HB3 LEU 79 1HB LEU 79 10.613 -1.350 -10.181 585 HG LEU 79 HG LEU 79 8.952 -2.722 -8.504 586 HD11 LEU 79 1HD1 LEU 79 7.157 -2.906 -10.232 587 HD12 LEU 79 2HD1 LEU 79 7.715 -4.469 -9.656 588 HD13 LEU 79 3HD1 LEU 79 8.237 -3.873 -11.231 589 HD21 LEU 79 3HD2 LEU 79 11.236 -3.452 -9.050 590 HD22 LEU 79 1HD2 LEU 79 10.699 -4.042 -10.624 591 HD23 LEU 79 2HD2 LEU 79 10.137 -4.824 -9.145 592 H ILE 80 H ILE 80 7.777 -0.923 -7.377 593 HA ILE 80 HA ILE 80 10.099 0.083 -5.789 594 HB ILE 80 HB ILE 80 7.162 0.479 -5.064 595 HG12 ILE 80 2HG1 ILE 80 9.269 2.542 -5.851 596 HG13 ILE 80 1HG1 ILE 80 7.990 1.980 -6.919 597 HG21 ILE 80 1HG2 ILE 80 8.586 0.141 -3.082 598 HG22 ILE 80 2HG2 ILE 80 8.117 1.825 -3.182 599 HG23 ILE 80 3HG2 ILE 80 9.735 1.337 -3.679 600 HD11 ILE 80 3HD1 ILE 80 7.860 4.108 -5.035 601 HD12 ILE 80 1HD1 ILE 80 6.774 2.861 -4.422 602 HD13 ILE 80 2HD1 ILE 80 6.562 3.497 -6.048 603 H GLU 81 H GLU 81 10.848 -1.448 -4.456 604 HA GLU 81 HA GLU 81 9.077 -3.412 -3.222 605 HB2 GLU 81 2HB GLU 81 10.469 -5.342 -4.041 606 HB3 GLU 81 1HB GLU 81 9.536 -4.563 -5.316 607 HG2 GLU 81 2HG GLU 81 11.516 -3.283 -6.017 608 HG3 GLU 81 1HG GLU 81 12.463 -4.026 -4.733 609 H TYR 82 H TYR 82 10.321 -4.768 -1.676 610 HA TYR 82 HA TYR 82 12.964 -3.917 -0.866 611 HB2 TYR 82 2HB TYR 82 12.152 -3.156 1.426 612 HB3 TYR 82 1HB TYR 82 11.804 -2.044 0.108 613 HD1 TYR 82 2HD TYR 82 9.514 -1.767 -0.770 614 HD2 TYR 82 1HD TYR 82 10.315 -4.449 2.500 615 HE1 TYR 82 2HE TYR 82 7.095 -1.894 -0.275 616 HE2 TYR 82 1HE TYR 82 7.883 -4.566 2.981 617 HH TYR 82 HH TYR 82 5.536 -3.595 0.861 618 H THR 83 H THR 83 13.821 -5.223 0.826 619 HA THR 83 HA THR 83 12.601 -7.896 0.932 620 HB THR 83 HB THR 83 15.269 -6.903 2.020 621 HG1 THR 83 1HG THR 83 16.091 -7.464 0.109 622 HG21 THR 83 3HG2 THR 83 14.544 -9.012 3.061 623 HG22 THR 83 1HG2 THR 83 15.851 -9.328 1.922 624 HG23 THR 83 2HG2 THR 83 14.186 -9.695 1.473 625 H ILE 84 H ILE 84 11.564 -8.670 2.683 626 HA ILE 84 HA ILE 84 11.407 -7.016 5.155 627 HB ILE 84 HB ILE 84 9.620 -9.272 4.176 628 HG12 ILE 84 2HG1 ILE 84 9.077 -6.272 4.239 629 HG13 ILE 84 1HG1 ILE 84 9.560 -7.138 2.784 630 HG21 ILE 84 1HG2 ILE 84 9.318 -7.308 6.488 631 HG22 ILE 84 2HG2 ILE 84 9.600 -9.037 6.644 632 HG23 ILE 84 3HG2 ILE 84 8.085 -8.459 5.981 633 HD11 ILE 84 3HD1 ILE 84 7.562 -8.601 3.004 634 HD12 ILE 84 1HD1 ILE 84 7.136 -6.900 2.824 635 HD13 ILE 84 2HD1 ILE 84 7.052 -7.663 4.408 636 H GLY 85 H GLY 85 11.745 -7.971 7.185 637 HA2 GLY 85 2HA GLY 85 13.857 -9.759 7.441 638 HA3 GLY 85 1HA GLY 85 12.703 -9.399 8.722 639 H ASP 86 H ASP 86 10.330 -10.481 7.622 640 HA ASP 86 HA ASP 86 10.604 -13.209 8.267 641 HB2 ASP 86 2HB ASP 86 8.258 -13.379 7.344 642 HB3 ASP 86 1HB ASP 86 8.470 -12.102 8.537 643 H GLY 87 H GLY 87 11.219 -11.504 5.348 644 HA2 GLY 87 2HA GLY 87 12.344 -12.334 3.470 645 HA3 GLY 87 1HA GLY 87 11.989 -13.984 3.975 646 H ARG 88 H ARG 88 9.202 -12.135 4.203 647 HA ARG 88 HA ARG 88 7.848 -13.483 2.114 648 HB2 ARG 88 2HB ARG 88 7.181 -10.956 3.664 649 HB3 ARG 88 1HB ARG 88 6.040 -11.735 2.572 650 HG2 ARG 88 2HG ARG 88 7.312 -13.318 4.847 651 HG3 ARG 88 1HG ARG 88 5.913 -12.296 5.153 652 HD2 ARG 88 2HD ARG 88 4.581 -13.549 3.540 653 HD3 ARG 88 1HD ARG 88 5.971 -14.507 3.057 654 HE ARG 88 HE ARG 88 4.342 -14.915 5.397 655 HH11 ARG 88 1HH2 ARG 88 7.539 -15.239 4.084 656 HH12 ARG 88 2HH2 ARG 88 7.986 -16.539 5.137 657 HH21 ARG 88 1HH1 ARG 88 4.932 -16.619 6.772 658 HH22 ARG 88 2HH1 ARG 88 6.513 -17.318 6.656 659 H LYS 89 H LYS 89 7.407 -12.886 0.003 660 HA LYS 89 HA LYS 89 9.076 -10.755 -1.123 661 HB2 LYS 89 2HB LYS 89 8.859 -13.131 -2.093 662 HB3 LYS 89 1HB LYS 89 7.228 -12.690 -2.574 663 HG2 LYS 89 2HG LYS 89 8.420 -12.164 -4.540 664 HG3 LYS 89 1HG LYS 89 8.429 -10.600 -3.730 665 HD2 LYS 89 2HD LYS 89 10.711 -11.173 -2.793 666 HD3 LYS 89 1HD LYS 89 10.676 -12.664 -3.729 667 HE2 LYS 89 2HE LYS 89 11.935 -10.937 -4.938 668 HE3 LYS 89 1HE LYS 89 10.449 -11.309 -5.815 669 HZ1 LYS 89 3HZ LYS 89 10.242 -9.220 -3.817 670 HZ2 LYS 89 1HZ LYS 89 9.586 -9.296 -5.378 671 HZ3 LYS 89 2HZ LYS 89 11.209 -8.839 -5.162 672 H VAL 90 H VAL 90 8.295 -8.821 -1.679 673 HA VAL 90 HA VAL 90 5.419 -8.440 -2.274 674 HB VAL 90 HB VAL 90 6.946 -6.666 -0.317 675 HG11 VAL 90 1HG1 VAL 90 4.036 -6.702 -1.205 676 HG12 VAL 90 2HG1 VAL 90 5.223 -5.460 -1.599 677 HG13 VAL 90 3HG1 VAL 90 4.692 -5.669 0.064 678 HG21 VAL 90 3HG2 VAL 90 4.840 -8.820 0.158 679 HG22 VAL 90 1HG2 VAL 90 5.311 -7.626 1.370 680 HG23 VAL 90 2HG2 VAL 90 6.491 -8.791 0.779 681 H ARG 91 H ARG 91 5.221 -7.326 -4.088 682 HA ARG 91 HA ARG 91 7.245 -5.308 -4.888 683 HB2 ARG 91 2HB ARG 91 7.157 -6.192 -7.210 684 HB3 ARG 91 1HB ARG 91 7.840 -7.363 -6.082 685 HG2 ARG 91 2HG ARG 91 5.654 -8.505 -5.940 686 HG3 ARG 91 1HG ARG 91 4.967 -7.357 -7.085 687 HD2 ARG 91 2HD ARG 91 6.609 -8.072 -8.786 688 HD3 ARG 91 1HD ARG 91 7.275 -9.238 -7.645 689 HE ARG 91 HE ARG 91 4.511 -9.709 -7.862 690 HH11 ARG 91 1HH2 ARG 91 7.394 -9.875 -9.791 691 HH12 ARG 91 2HH2 ARG 91 6.812 -11.172 -10.782 692 HH21 ARG 91 1HH1 ARG 91 3.759 -11.405 -9.165 693 HH22 ARG 91 2HH1 ARG 91 4.762 -12.034 -10.429 694 H ILE 92 H ILE 92 6.403 -3.571 -5.952 695 HA ILE 92 HA ILE 92 3.433 -3.470 -6.331 696 HB ILE 92 HB ILE 92 5.313 -1.212 -5.505 697 HG12 ILE 92 2HG1 ILE 92 3.199 -2.661 -3.834 698 HG13 ILE 92 1HG1 ILE 92 4.927 -2.980 -3.712 699 HG21 ILE 92 1HG2 ILE 92 2.277 -1.368 -5.770 700 HG22 ILE 92 2HG2 ILE 92 3.356 -0.440 -6.810 701 HG23 ILE 92 3HG2 ILE 92 3.156 0.018 -5.128 702 HD11 ILE 92 3HD1 ILE 92 4.281 -1.417 -1.962 703 HD12 ILE 92 1HD1 ILE 92 3.562 -0.331 -3.149 704 HD13 ILE 92 2HD1 ILE 92 5.307 -0.584 -3.127 705 H VAL 93 H VAL 93 2.941 -3.333 -8.435 706 HA VAL 93 HA VAL 93 4.879 -2.156 -10.363 707 HB VAL 93 HB VAL 93 2.451 -3.889 -10.955 708 HG11 VAL 93 1HG1 VAL 93 3.196 -2.483 -12.838 709 HG12 VAL 93 2HG1 VAL 93 3.554 -4.179 -13.149 710 HG13 VAL 93 3HG1 VAL 93 4.842 -3.086 -12.644 711 HG21 VAL 93 3HG2 VAL 93 4.092 -5.722 -11.280 712 HG22 VAL 93 1HG2 VAL 93 4.091 -5.150 -9.614 713 HG23 VAL 93 2HG2 VAL 93 5.380 -4.659 -10.712 714 H PHE 94 H PHE 94 4.466 -0.200 -11.120 715 HA PHE 94 HA PHE 94 1.815 1.060 -10.663 716 HB2 PHE 94 2HB PHE 94 4.587 2.095 -11.397 717 HB3 PHE 94 1HB PHE 94 3.164 3.126 -11.362 718 HD1 PHE 94 1HD PHE 94 5.411 1.011 -9.289 719 HD2 PHE 94 2HD PHE 94 2.134 3.800 -9.238 720 HE1 PHE 94 1HE PHE 94 5.639 1.247 -6.832 721 HE2 PHE 94 2HE PHE 94 2.374 4.034 -6.785 722 HZ PHE 94 HZ PHE 94 4.124 2.757 -5.580 723 H THR 95 H THR 95 0.398 1.129 -12.270 724 HA THR 95 HA THR 95 1.285 1.373 -15.083 725 HB THR 95 HB THR 95 -0.809 -0.635 -14.144 726 HG1 THR 95 1HG THR 95 0.732 -2.157 -14.504 727 HG21 THR 95 3HG2 THR 95 -1.215 0.227 -16.417 728 HG22 THR 95 1HG2 THR 95 -0.637 -1.437 -16.496 729 HG23 THR 95 2HG2 THR 95 0.460 -0.106 -16.859 730 H HIS 96 H HIS 96 -0.151 2.478 -16.369 731 HA HIS 96 HA HIS 96 -2.727 3.406 -15.312 732 HB2 HIS 96 2HB HIS 96 -2.094 5.795 -15.704 733 HB3 HIS 96 1HB HIS 96 -1.168 5.062 -14.394 734 HD2 HIS 96 2HD HIS 96 1.565 4.341 -15.170 735 HE1 HIS 96 1HE HIS 96 1.578 6.887 -18.538 736 HE2 HIS 96 2HE HIS 96 3.032 5.475 -17.008 737 H THR 97 H THR 97 -3.894 4.657 -16.955 738 HA THR 97 HA THR 97 -3.052 4.152 -19.768 739 HB THR 97 HB THR 97 -4.502 2.278 -19.214 740 HG1 THR 97 1HG THR 97 -6.462 3.394 -20.496 741 HG21 THR 97 3HG2 THR 97 -6.782 2.607 -18.379 742 HG22 THR 97 1HG2 THR 97 -6.538 4.351 -18.329 743 HG23 THR 97 2HG2 THR 97 -5.630 3.301 -17.241 744 H GLY 98 H GLY 98 -3.301 6.494 -17.886 745 HA2 GLY 98 2HA GLY 98 -3.611 8.748 -18.395 746 HA3 GLY 98 1HA GLY 98 -4.604 8.312 -19.781 747 H ASP 99 H ASP 99 -4.826 10.002 -17.107 748 HA ASP 99 HA ASP 99 -6.478 10.682 -15.677 749 HB2 ASP 99 2HB ASP 99 -8.274 9.443 -17.786 750 HB3 ASP 99 1HB ASP 99 -8.789 10.564 -16.528 751 H THR 100 H THR 100 -5.518 7.681 -15.810 752 HA THR 100 HA THR 100 -7.144 6.822 -13.536 753 HB THR 100 HB THR 100 -6.958 5.103 -16.036 754 HG1 THR 100 1HG THR 100 -9.310 6.169 -14.945 755 HG21 THR 100 3HG2 THR 100 -7.051 3.764 -13.977 756 HG22 THR 100 1HG2 THR 100 -8.602 3.681 -14.811 757 HG23 THR 100 2HG2 THR 100 -8.417 4.718 -13.399 758 H THR 101 H THR 101 -6.033 5.515 -12.173 759 HA THR 101 HA THR 101 -3.317 4.547 -12.973 760 HB THR 101 HB THR 101 -4.167 5.778 -10.328 761 HG1 THR 101 1HG THR 101 -2.224 7.095 -11.176 762 HG21 THR 101 3HG2 THR 101 -2.546 4.100 -9.764 763 HG22 THR 101 1HG2 THR 101 -1.612 5.585 -9.912 764 HG23 THR 101 2HG2 THR 101 -1.600 4.400 -11.213 765 H ASN 102 H ASN 102 -2.966 2.451 -12.617 766 HA ASN 102 HA ASN 102 -4.909 0.876 -10.973 767 HB2 ASN 102 2HB ASN 102 -3.098 0.010 -13.258 768 HB3 ASN 102 1HB ASN 102 -4.212 -1.029 -12.368 769 HD21 ASN 102 1HD2 ASN 102 -4.109 0.106 -15.309 770 HD22 ASN 102 2HD2 ASN 102 -5.701 0.645 -15.548 771 H ILE 103 H ILE 103 -4.097 0.344 -9.035 772 HA ILE 103 HA ILE 103 -1.148 -0.017 -8.669 773 HB ILE 103 HB ILE 103 -3.322 0.391 -6.576 774 HG12 ILE 103 2HG1 ILE 103 -1.294 2.430 -7.580 775 HG13 ILE 103 1HG1 ILE 103 -2.979 2.398 -8.084 776 HG21 ILE 103 1HG2 ILE 103 -1.361 -0.793 -5.704 777 HG22 ILE 103 2HG2 ILE 103 -1.378 0.841 -5.070 778 HG23 ILE 103 3HG2 ILE 103 -0.290 0.425 -6.393 779 HD11 ILE 103 3HD1 ILE 103 -3.664 2.614 -5.672 780 HD12 ILE 103 1HD1 ILE 103 -2.769 4.002 -6.291 781 HD13 ILE 103 2HD1 ILE 103 -1.956 2.824 -5.264 782 H VAL 104 H VAL 104 -0.502 -2.087 -8.554 783 HA VAL 104 HA VAL 104 -2.304 -4.157 -7.383 784 HB VAL 104 HB VAL 104 -2.410 -4.364 -9.806 785 HG11 VAL 104 1HG1 VAL 104 -0.482 -4.823 -11.199 786 HG12 VAL 104 2HG1 VAL 104 0.573 -4.794 -9.790 787 HG13 VAL 104 3HG1 VAL 104 -0.216 -3.310 -10.332 788 HG21 VAL 104 3HG2 VAL 104 -2.432 -6.422 -8.395 789 HG22 VAL 104 1HG2 VAL 104 -0.696 -6.589 -8.665 790 HG23 VAL 104 2HG2 VAL 104 -1.814 -6.717 -10.018 791 H GLU 105 H GLU 105 -1.333 -5.575 -6.099 792 HA GLU 105 HA GLU 105 1.582 -5.759 -6.084 793 HB2 GLU 105 2HB GLU 105 1.675 -5.389 -3.606 794 HB3 GLU 105 1HB GLU 105 1.185 -3.949 -4.498 795 HG2 GLU 105 2HG GLU 105 -1.193 -4.460 -4.004 796 HG3 GLU 105 1HG GLU 105 -0.691 -5.876 -3.084 797 H SER 106 H SER 106 2.380 -7.663 -5.362 798 HA SER 106 HA SER 106 0.452 -9.873 -4.970 799 HB2 SER 106 2HB SER 106 2.321 -11.335 -5.453 800 HB3 SER 106 1HB SER 106 2.303 -10.063 -6.673 801 HG SER 106 HG SER 106 4.155 -10.646 -4.748 802 H PHE 107 H PHE 107 0.709 -11.363 -3.173 803 HA PHE 107 HA PHE 107 2.539 -10.619 -1.007 804 HB2 PHE 107 2HB PHE 107 0.538 -9.165 -0.647 805 HB3 PHE 107 1HB PHE 107 -0.472 -10.605 -0.584 806 HD1 PHE 107 2HD PHE 107 2.400 -8.866 1.059 807 HD2 PHE 107 1HD PHE 107 -0.606 -11.919 1.466 808 HE1 PHE 107 2HE PHE 107 2.968 -9.114 3.461 809 HE2 PHE 107 1HE PHE 107 -0.032 -12.158 3.865 810 HZ PHE 107 HZ PHE 107 1.755 -10.756 4.863 811 H ASP 108 H ASP 108 3.044 -12.352 0.212 812 HA ASP 108 HA ASP 108 2.064 -14.977 -0.676 813 HB2 ASP 108 2HB ASP 108 4.324 -14.207 1.188 814 HB3 ASP 108 1HB ASP 108 3.962 -15.854 0.676 815 HA PRO 109 HA PRO 109 -0.487 -15.243 3.056 816 HB2 PRO 109 2HB PRO 109 -1.214 -17.873 3.051 817 HB3 PRO 109 1HB PRO 109 -1.801 -16.757 1.801 818 HG2 PRO 109 2HG PRO 109 0.529 -18.658 1.658 819 HG3 PRO 109 1HG PRO 109 -0.799 -18.437 0.493 820 HD2 PRO 109 2HD PRO 109 1.631 -17.221 0.120 821 HD3 PRO 109 1HD PRO 109 0.120 -16.423 -0.364 822 H GLU 110 H GLU 110 -0.260 -15.749 5.222 823 HA GLU 110 HA GLU 110 2.340 -16.803 6.097 824 HB2 GLU 110 2HB GLU 110 0.005 -15.533 7.580 825 HB3 GLU 110 1HB GLU 110 1.471 -16.104 8.372 826 HG2 GLU 110 2HG GLU 110 1.680 -13.710 7.979 827 HG3 GLU 110 1HG GLU 110 2.811 -14.553 6.925 828 H GLU 111 H GLU 111 2.507 -18.509 7.626 829 HA GLU 111 HA GLU 111 0.727 -20.722 7.115 830 HB2 GLU 111 2HB GLU 111 2.237 -21.950 8.635 831 HB3 GLU 111 1HB GLU 111 3.132 -21.075 7.394 832 HG2 GLU 111 2HG GLU 111 3.513 -19.219 9.059 833 HG3 GLU 111 1HG GLU 111 2.754 -20.222 10.292 834 H THR 112 H THR 112 1.337 -18.504 9.833 835 HA THR 112 HA THR 112 -0.337 -19.846 11.710 836 HB THR 112 HB THR 112 0.430 -16.905 11.676 837 HG1 THR 112 1HG THR 112 2.029 -18.136 13.224 838 HG21 THR 112 3HG2 THR 112 -1.270 -17.493 13.373 839 HG22 THR 112 1HG2 THR 112 0.279 -17.137 14.133 840 HG23 THR 112 2HG2 THR 112 -0.246 -18.811 13.947 841 H ASN 113 H ASN 113 -0.933 -17.023 9.583 842 HA ASN 113 HA ASN 113 -3.735 -16.919 10.402 843 HB2 ASN 113 2HB ASN 113 -2.435 -14.833 10.108 844 HB3 ASN 113 1HB ASN 113 -2.263 -15.196 8.395 845 HD21 ASN 113 1HD2 ASN 113 -4.633 -15.832 7.408 846 HD22 ASN 113 2HD2 ASN 113 -5.852 -14.717 7.802 847 HA PRO 114 HA PRO 114 -4.944 -19.576 6.881 848 HB2 PRO 114 2HB PRO 114 -7.492 -17.963 6.801 849 HB3 PRO 114 1HB PRO 114 -7.287 -19.724 6.903 850 HG2 PRO 114 2HG PRO 114 -8.028 -18.203 9.022 851 HG3 PRO 114 1HG PRO 114 -7.077 -19.696 9.200 852 HD2 PRO 114 2HD PRO 114 -6.174 -16.846 9.493 853 HD3 PRO 114 1HD PRO 114 -5.520 -18.329 10.227 854 H ARG 115 H ARG 115 -4.977 -19.380 4.640 855 HA ARG 115 HA ARG 115 -4.003 -16.950 3.496 856 HB2 ARG 115 2HB ARG 115 -4.129 -18.183 1.368 857 HB3 ARG 115 1HB ARG 115 -3.373 -19.161 2.622 858 HG2 ARG 115 2HG ARG 115 -5.589 -20.285 3.010 859 HG3 ARG 115 1HG ARG 115 -6.252 -19.371 1.658 860 HD2 ARG 115 2HD ARG 115 -4.581 -20.376 0.146 861 HD3 ARG 115 1HD ARG 115 -3.930 -21.307 1.493 862 HE ARG 115 HE ARG 115 -6.694 -21.821 1.311 863 HH11 ARG 115 1HH2 ARG 115 -3.753 -22.349 -0.455 864 HH12 ARG 115 2HH2 ARG 115 -4.308 -23.810 -1.202 865 HH21 ARG 115 1HH1 ARG 115 -7.413 -23.735 0.332 866 HH22 ARG 115 2HH1 ARG 115 -6.374 -24.593 -0.757 867 H GLU 116 H GLU 116 -7.168 -18.521 3.690 868 HA GLU 116 HA GLU 116 -8.513 -16.914 1.785 869 HB2 GLU 116 2HB GLU 116 -9.648 -18.335 4.221 870 HB3 GLU 116 1HB GLU 116 -10.573 -17.777 2.832 871 HG2 GLU 116 2HG GLU 116 -8.371 -19.864 2.741 872 HG3 GLU 116 1HG GLU 116 -10.095 -20.210 2.719 873 H LEU 117 H LEU 117 -8.291 -16.621 5.353 874 HA LEU 117 HA LEU 117 -9.996 -14.366 5.526 875 HB2 LEU 117 2HB LEU 117 -9.044 -16.100 7.348 876 HB3 LEU 117 1HB LEU 117 -7.831 -14.855 7.582 877 HG LEU 117 HG LEU 117 -9.600 -14.471 9.185 878 HD11 LEU 117 1HD1 LEU 117 -8.610 -12.457 7.986 879 HD12 LEU 117 2HD1 LEU 117 -10.169 -12.193 8.763 880 HD13 LEU 117 3HD1 LEU 117 -10.089 -12.410 7.019 881 HD21 LEU 117 3HD2 LEU 117 -11.874 -14.607 8.823 882 HD22 LEU 117 1HD2 LEU 117 -11.384 -15.674 7.515 883 HD23 LEU 117 2HD2 LEU 117 -11.794 -13.995 7.171 884 H GLN 118 H GLN 118 -6.411 -14.563 5.695 885 HA GLN 118 HA GLN 118 -5.977 -11.779 5.889 886 HB2 GLN 118 2HB GLN 118 -3.673 -12.220 5.147 887 HB3 GLN 118 1HB GLN 118 -4.201 -13.376 6.353 888 HG2 GLN 118 2HG GLN 118 -3.330 -14.921 4.850 889 HG3 GLN 118 1HG GLN 118 -4.921 -14.779 4.122 890 HE21 GLN 118 1HE2 GLN 118 -3.983 -11.893 3.233 891 HE22 GLN 118 2HE2 GLN 118 -3.069 -12.231 1.847 892 H GLN 119 H GLN 119 -6.529 -13.793 3.002 893 HA GLN 119 HA GLN 119 -5.792 -11.939 1.028 894 HB2 GLN 119 2HB GLN 119 -6.320 -14.279 0.536 895 HB3 GLN 119 1HB GLN 119 -7.990 -14.034 1.036 896 HG2 GLN 119 2HG GLN 119 -8.386 -12.509 -0.836 897 HG3 GLN 119 1HG GLN 119 -6.684 -12.554 -1.277 898 HE21 GLN 119 1HE2 GLN 119 -6.295 -13.944 -3.004 899 HE22 GLN 119 2HE2 GLN 119 -7.187 -15.348 -3.350 900 H SER 120 H SER 120 -8.916 -12.440 2.664 901 HA SER 120 HA SER 120 -10.323 -10.376 1.322 902 HB2 SER 120 2HB SER 120 -10.834 -11.500 4.094 903 HB3 SER 120 1HB SER 120 -11.979 -10.595 3.106 904 HG SER 120 HG SER 120 -10.728 -12.861 2.030 905 H GLY 121 H GLY 121 -8.235 -10.390 4.156 906 HA2 GLY 121 2HA GLY 121 -8.916 -7.904 5.262 907 HA3 GLY 121 1HA GLY 121 -7.347 -8.686 5.417 908 H TRP 122 H TRP 122 -6.336 -8.678 2.899 909 HA TRP 122 HA TRP 122 -5.424 -6.018 2.568 910 HB2 TRP 122 2HB TRP 122 -5.337 -8.326 0.596 911 HB3 TRP 122 1HB TRP 122 -4.373 -6.854 0.490 912 HD1 TRP 122 HD TRP 122 -4.237 -10.261 1.884 913 HE1 TRP 122 1HE TRP 122 -2.291 -10.502 3.551 914 HE3 TRP 122 3HE TRP 122 -3.021 -5.349 2.521 915 HZ2 TRP 122 2HZ TRP 122 -0.455 -8.828 4.966 916 HZ3 TRP 122 3HZ TRP 122 -1.169 -4.698 4.034 917 HH2 TRP 122 HH TRP 122 0.115 -6.431 5.255 918 H GLN 123 H GLN 123 -7.923 -7.887 0.895 919 HA GLN 123 HA GLN 123 -8.488 -5.878 -1.079 920 HB2 GLN 123 2HB GLN 123 -9.010 -8.310 -1.361 921 HB3 GLN 123 1HB GLN 123 -10.269 -8.155 -0.138 922 HG2 GLN 123 2HG GLN 123 -11.448 -6.496 -1.528 923 HG3 GLN 123 1HG GLN 123 -10.165 -6.567 -2.730 924 HE21 GLN 123 1HE2 GLN 123 -12.919 -7.206 -3.318 925 HE22 GLN 123 2HE2 GLN 123 -12.990 -8.853 -3.725 926 H ALA 124 H ALA 124 -9.803 -6.697 2.101 927 HA ALA 124 HA ALA 124 -12.103 -5.113 2.081 928 HB1 ALA 124 1HB ALA 124 -11.626 -6.768 3.835 929 HB2 ALA 124 2HB ALA 124 -11.959 -5.190 4.546 930 HB3 ALA 124 3HB ALA 124 -10.296 -5.770 4.423 931 H ILE 125 H ILE 125 -8.843 -4.246 3.277 932 HA ILE 125 HA ILE 125 -9.551 -1.587 3.982 933 HB ILE 125 HB ILE 125 -7.121 -1.217 4.152 934 HG12 ILE 125 2HG1 ILE 125 -6.831 -4.021 2.990 935 HG13 ILE 125 1HG1 ILE 125 -6.451 -2.547 2.109 936 HG21 ILE 125 1HG2 ILE 125 -7.935 -3.964 5.181 937 HG22 ILE 125 2HG2 ILE 125 -8.386 -2.444 5.947 938 HG23 ILE 125 3HG2 ILE 125 -6.693 -2.919 5.872 939 HD11 ILE 125 3HD1 ILE 125 -4.809 -1.969 3.972 940 HD12 ILE 125 1HD1 ILE 125 -4.381 -3.371 2.990 941 HD13 ILE 125 2HD1 ILE 125 -5.078 -3.601 4.592 942 H LEU 126 H LEU 126 -8.458 -3.040 0.985 943 HA LEU 126 HA LEU 126 -7.867 -0.601 -0.391 944 HB2 LEU 126 2HB LEU 126 -8.461 -3.434 -1.260 945 HB3 LEU 126 1HB LEU 126 -8.262 -2.177 -2.476 946 HG LEU 126 HG LEU 126 -6.185 -2.833 -0.336 947 HD11 LEU 126 1HD1 LEU 126 -6.439 -4.736 -1.812 948 HD12 LEU 126 2HD1 LEU 126 -4.921 -3.930 -2.185 949 HD13 LEU 126 3HD1 LEU 126 -6.316 -3.713 -3.243 950 HD21 LEU 126 3HD2 LEU 126 -6.286 -0.773 -2.547 951 HD22 LEU 126 1HD2 LEU 126 -4.737 -1.580 -2.290 952 HD23 LEU 126 2HD2 LEU 126 -5.504 -0.706 -0.974 953 H ASN 127 H ASN 127 -10.819 -2.510 0.041 954 HA ASN 127 HA ASN 127 -12.414 -1.161 -1.875 955 HB2 ASN 127 2HB ASN 127 -13.203 -2.529 0.721 956 HB3 ASN 127 1HB ASN 127 -14.334 -2.030 -0.537 957 HD21 ASN 127 1HD2 ASN 127 -13.442 -4.823 0.469 958 HD22 ASN 127 2HD2 ASN 127 -13.030 -5.644 -0.957 959 H SER 128 H SER 128 -11.781 -0.511 1.553 960 HA SER 128 HA SER 128 -13.587 1.637 1.872 961 HB2 SER 128 2HB SER 128 -12.282 2.215 3.855 962 HB3 SER 128 1HB SER 128 -12.477 0.466 3.760 963 HG SER 128 HG SER 128 -10.342 0.836 4.146 964 H PHE 129 H PHE 129 -10.328 1.478 0.567 965 HA PHE 129 HA PHE 129 -9.677 4.209 0.621 966 HB2 PHE 129 2HB PHE 129 -8.096 2.327 0.048 967 HB3 PHE 129 1HB PHE 129 -8.859 2.222 -1.534 968 HD1 PHE 129 1HD PHE 129 -8.587 4.035 -3.207 969 HD2 PHE 129 2HD PHE 129 -6.700 4.283 0.652 970 HE1 PHE 129 1HE PHE 129 -7.162 5.896 -4.016 971 HE2 PHE 129 2HE PHE 129 -5.278 6.140 -0.166 972 HZ PHE 129 HZ PHE 129 -5.511 6.948 -2.497 973 H LYS 130 H LYS 130 -11.551 2.321 -1.721 974 HA LYS 130 HA LYS 130 -11.772 4.241 -3.764 975 HB2 LYS 130 2HB LYS 130 -13.762 2.129 -2.869 976 HB3 LYS 130 1HB LYS 130 -13.833 2.989 -4.408 977 HG2 LYS 130 2HG LYS 130 -11.631 2.078 -5.038 978 HG3 LYS 130 1HG LYS 130 -11.528 1.232 -3.493 979 HD2 LYS 130 2HD LYS 130 -13.559 -0.060 -4.059 980 HD3 LYS 130 1HD LYS 130 -13.665 0.780 -5.607 981 HE2 LYS 130 2HE LYS 130 -11.462 -0.125 -6.256 982 HE3 LYS 130 1HE LYS 130 -11.345 -0.961 -4.707 983 HZ1 LYS 130 3HZ LYS 130 -13.110 -2.364 -5.249 984 HZ2 LYS 130 1HZ LYS 130 -12.202 -2.280 -6.680 985 HZ3 LYS 130 2HZ LYS 130 -13.635 -1.380 -6.530 986 H SER 131 H SER 131 -13.847 3.657 -0.912 987 HA SER 131 HA SER 131 -15.749 5.694 -1.492 988 HB2 SER 131 2HB SER 131 -16.396 5.453 0.884 989 HB3 SER 131 1HB SER 131 -16.221 3.887 0.101 990 HG SER 131 HG SER 131 -14.286 3.603 1.106 991 H TYR 132 H TYR 132 -12.725 5.649 0.354 992 HA TYR 132 HA TYR 132 -12.903 8.234 1.472 993 HB2 TYR 132 2HB TYR 132 -11.272 6.554 2.236 994 HB3 TYR 132 1HB TYR 132 -10.438 6.649 0.687 995 HD1 TYR 132 2HD TYR 132 -11.232 8.497 3.818 996 HD2 TYR 132 1HD TYR 132 -9.011 8.579 0.133 997 HE1 TYR 132 2HE TYR 132 -9.949 10.457 4.627 998 HE2 TYR 132 1HE TYR 132 -7.737 10.540 0.949 999 HH TYR 132 HH TYR 132 -7.348 11.400 3.862 1000 H THR 133 H THR 133 -11.474 7.087 -1.576 1001 HA THR 133 HA THR 133 -10.395 9.519 -2.457 1002 HB THR 133 HB THR 133 -11.575 7.321 -4.196 1003 HG1 THR 133 1HG THR 133 -10.092 6.581 -2.602 1004 HG21 THR 133 3HG2 THR 133 -10.963 9.335 -5.467 1005 HG22 THR 133 1HG2 THR 133 -9.802 8.048 -5.786 1006 HG23 THR 133 2HG2 THR 133 -9.378 9.363 -4.693 1007 H GLU 134 H GLU 134 -13.624 8.125 -3.074 1008 HA GLU 134 HA GLU 134 -14.563 10.287 -4.676 1009 HB2 GLU 134 2HB GLU 134 -15.564 8.004 -4.622 1010 HB3 GLU 134 1HB GLU 134 -16.164 8.320 -2.997 1011 HG2 GLU 134 2HG GLU 134 -17.518 10.206 -3.849 1012 HG3 GLU 134 1HG GLU 134 -16.882 9.940 -5.469 1013 H ASN 135 H ASN 135 -14.805 9.531 -1.221 1014 HA ASN 135 HA ASN 135 -16.452 11.718 -0.476 1015 HB2 ASN 135 2HB ASN 135 -14.442 10.101 1.125 1016 HB3 ASN 135 1HB ASN 135 -15.577 11.246 1.834 1017 HD21 ASN 135 1HD2 ASN 135 -15.423 8.241 2.163 1018 HD22 ASN 135 2HD2 ASN 135 -16.962 7.675 1.721 1019 H ASN 136 H ASN 136 -12.964 11.364 -0.870 1020 HA ASN 136 HA ASN 136 -12.164 13.750 0.437 1021 HB2 ASN 136 2HB ASN 136 -10.603 11.927 -0.189 1022 HB3 ASN 136 1HB ASN 136 -10.829 12.325 -1.890 1023 HD21 ASN 136 1HD2 ASN 136 -8.976 13.411 -2.580 1024 HD22 ASN 136 2HD2 ASN 136 -8.195 14.644 -1.714 1025 H LEU 137 H LEU 137 -12.870 13.085 -3.010 1026 HA LEU 137 HA LEU 137 -12.579 15.887 -3.765 1027 HB2 LEU 137 2HB LEU 137 -13.284 13.314 -5.204 1028 HB3 LEU 137 1HB LEU 137 -13.603 14.857 -5.993 1029 HG LEU 137 HG LEU 137 -11.222 15.480 -5.766 1030 HD11 LEU 137 1HD1 LEU 137 -10.571 14.307 -3.756 1031 HD12 LEU 137 2HD1 LEU 137 -9.583 13.682 -5.070 1032 HD13 LEU 137 3HD1 LEU 137 -10.955 12.741 -4.477 1033 HD21 LEU 137 3HD2 LEU 137 -11.625 12.733 -7.010 1034 HD22 LEU 137 1HD2 LEU 137 -10.323 13.859 -7.401 1035 HD23 LEU 137 2HD2 LEU 137 -11.991 14.272 -7.791 1036 H GLU 138 H GLU 138 -14.209 17.307 -4.247 1037 HA GLU 138 HA GLU 138 -16.242 18.339 -3.992 1038 HB2 GLU 138 2HB GLU 138 -17.223 15.591 -4.827 1039 HB3 GLU 138 1HB GLU 138 -18.173 17.074 -4.876 1040 HG2 GLU 138 2HG GLU 138 -16.561 18.065 -6.461 1041 HG3 GLU 138 1HG GLU 138 -15.594 16.595 -6.405 1042 H HIS 139 H HIS 139 -18.522 16.156 -3.252 1043 HA HIS 139 HA HIS 139 -18.009 15.749 -0.410 1044 HB2 HIS 139 2HB HIS 139 -20.254 17.587 -1.328 1045 HB3 HIS 139 1HB HIS 139 -19.979 17.035 0.325 1046 HD2 HIS 139 2HD HIS 139 -17.774 18.272 1.647 1047 HE1 HIS 139 1HE HIS 139 -16.902 21.017 -1.439 1048 HE2 HIS 139 2HE HIS 139 -16.377 20.368 0.958 1049 H HIS 140 H HIS 140 -19.794 14.539 0.598 1050 HA HIS 140 HA HIS 140 -20.602 12.363 -0.998 1051 HB2 HIS 140 2HB HIS 140 -20.356 12.262 1.468 1052 HB3 HIS 140 1HB HIS 140 -21.768 13.300 1.647 1053 HD2 HIS 140 2HD HIS 140 -24.180 11.923 1.629 1054 HE1 HIS 140 1HE HIS 140 -22.720 8.224 0.211 1055 HE2 HIS 140 2HE HIS 140 -24.772 9.438 1.088 1056 H HIS 141 H HIS 141 -22.371 15.246 0.097 1057 HA HIS 141 HA HIS 141 -24.898 14.534 -0.989 1058 HB2 HIS 141 2HB HIS 141 -23.732 17.290 -0.461 1059 HB3 HIS 141 1HB HIS 141 -25.441 16.919 -0.698 1060 HD2 HIS 141 2HD HIS 141 -22.884 17.018 2.163 1061 HE1 HIS 141 1HE HIS 141 -26.213 14.876 3.627 1062 HE2 HIS 141 2HE HIS 141 -24.027 15.997 4.275 1063 H HIS 142 H HIS 142 -25.746 14.782 -2.999 1064 HA HIS 142 HA HIS 142 -24.007 15.169 -5.243 1065 HB2 HIS 142 2HB HIS 142 -27.042 15.069 -5.118 1066 HB3 HIS 142 1HB HIS 142 -26.058 14.894 -6.573 1067 HD2 HIS 142 2HD HIS 142 -24.697 12.392 -6.796 1068 HE1 HIS 142 1HE HIS 142 -26.512 10.625 -3.419 1069 HE2 HIS 142 2HE HIS 142 -25.060 10.181 -5.456 1070 H HIS 143 H HIS 143 -23.839 16.899 -6.638 1071 HA HIS 143 HA HIS 143 -24.226 19.508 -5.604 1072 HB2 HIS 143 2HB HIS 143 -23.557 20.250 -7.884 1073 HB3 HIS 143 1HB HIS 143 -22.481 19.007 -7.248 1074 HD2 HIS 143 2HD HIS 143 -24.736 19.575 -10.308 1075 HE1 HIS 143 1HE HIS 143 -23.759 15.469 -10.297 1076 HE2 HIS 143 2HE HIS 143 -24.798 17.343 -11.660 1077 H HIS 144 H HIS 144 -25.775 21.059 -6.013 1078 HA HIS 144 HA HIS 144 -28.424 20.223 -6.546 1079 HB2 HIS 144 2HB HIS 144 -27.258 23.026 -6.639 1080 HB3 HIS 144 1HB HIS 144 -28.970 22.620 -6.505 1081 HD2 HIS 144 2HD HIS 144 -29.784 21.728 -3.935 1082 HE1 HIS 144 1HE HIS 144 -26.040 22.273 -2.061 1083 HE2 HIS 144 2HE HIS 144 -28.494 21.757 -1.664 Start of MODEL 19 1 H1 GLY 1 1HT GLY 1 -4.300 -20.772 -2.825 2 H2 GLY 1 2HT GLY 1 -3.451 -20.113 -1.508 3 H3 GLY 1 3HT GLY 1 -2.686 -21.216 -2.550 4 HA2 GLY 1 2HA GLY 1 -2.248 -19.684 -4.117 5 HA3 GLY 1 1HA GLY 1 -3.769 -18.840 -3.819 6 H ASN 2 H ASN 2 -0.603 -19.502 -2.329 7 HA ASN 2 HA ASN 2 -0.709 -17.488 -0.345 8 HB2 ASN 2 2HB ASN 2 1.723 -18.668 -1.726 9 HB3 ASN 2 1HB ASN 2 1.728 -17.784 -0.201 10 HD21 ASN 2 1HD2 ASN 2 0.999 -18.887 1.701 11 HD22 ASN 2 2HD2 ASN 2 0.619 -20.540 1.707 12 H LYS 3 H LYS 3 0.403 -17.491 -3.679 13 HA LYS 3 HA LYS 3 1.476 -14.822 -3.655 14 HB2 LYS 3 2HB LYS 3 1.460 -15.116 -6.168 15 HB3 LYS 3 1HB LYS 3 2.303 -16.401 -5.305 16 HG2 LYS 3 2HG LYS 3 0.323 -17.856 -5.477 17 HG3 LYS 3 1HG LYS 3 -0.568 -16.580 -6.297 18 HD2 LYS 3 2HD LYS 3 1.111 -16.609 -8.131 19 HD3 LYS 3 1HD LYS 3 1.956 -17.925 -7.315 20 HE2 LYS 3 2HE LYS 3 -0.907 -18.008 -8.321 21 HE3 LYS 3 1HE LYS 3 0.473 -18.816 -9.066 22 HZ1 LYS 3 3HZ LYS 3 -0.572 -20.427 -7.746 23 HZ2 LYS 3 1HZ LYS 3 -0.765 -19.367 -6.436 24 HZ3 LYS 3 2HZ LYS 3 0.782 -19.938 -6.843 25 H ILE 4 H ILE 4 -0.910 -14.523 -2.444 26 HA ILE 4 HA ILE 4 -3.187 -14.057 -3.975 27 HB ILE 4 HB ILE 4 -2.271 -12.460 -1.547 28 HG12 ILE 4 2HG1 ILE 4 -4.011 -14.974 -1.642 29 HG13 ILE 4 1HG1 ILE 4 -2.305 -14.981 -1.214 30 HG21 ILE 4 1HG2 ILE 4 -5.033 -12.941 -2.749 31 HG22 ILE 4 2HG2 ILE 4 -4.173 -11.403 -2.710 32 HG23 ILE 4 3HG2 ILE 4 -4.738 -12.125 -1.218 33 HD11 ILE 4 3HD1 ILE 4 -3.638 -14.948 0.823 34 HD12 ILE 4 1HD1 ILE 4 -4.497 -13.511 0.274 35 HD13 ILE 4 2HD1 ILE 4 -2.780 -13.417 0.661 36 H THR 5 H THR 5 -3.909 -12.375 -5.197 37 HA THR 5 HA THR 5 -2.138 -10.018 -5.635 38 HB THR 5 HB THR 5 -1.808 -11.470 -7.548 39 HG1 THR 5 1HG THR 5 -2.145 -9.268 -7.983 40 HG21 THR 5 3HG2 THR 5 -4.832 -11.573 -7.808 41 HG22 THR 5 1HG2 THR 5 -3.822 -12.901 -7.246 42 HG23 THR 5 2HG2 THR 5 -3.671 -12.317 -8.898 43 H VAL 6 H VAL 6 -3.150 -8.112 -5.725 44 HA VAL 6 HA VAL 6 -6.103 -7.951 -5.942 45 HB VAL 6 HB VAL 6 -6.075 -6.297 -4.028 46 HG11 VAL 6 1HG1 VAL 6 -5.165 -9.112 -3.331 47 HG12 VAL 6 2HG1 VAL 6 -6.824 -8.634 -3.693 48 HG13 VAL 6 3HG1 VAL 6 -6.021 -8.007 -2.255 49 HG21 VAL 6 3HG2 VAL 6 -3.301 -7.462 -3.556 50 HG22 VAL 6 1HG2 VAL 6 -4.145 -6.347 -2.488 51 HG23 VAL 6 2HG2 VAL 6 -3.629 -5.814 -4.086 52 H GLU 7 H GLU 7 -6.846 -5.820 -6.491 53 HA GLU 7 HA GLU 7 -4.860 -3.884 -7.476 54 HB2 GLU 7 2HB GLU 7 -5.930 -3.830 -9.730 55 HB3 GLU 7 1HB GLU 7 -5.141 -5.370 -9.393 56 HG2 GLU 7 2HG GLU 7 -7.327 -6.350 -8.749 57 HG3 GLU 7 1HG GLU 7 -8.119 -4.818 -9.111 58 H VAL 8 H VAL 8 -5.786 -1.838 -8.050 59 HA VAL 8 HA VAL 8 -8.581 -1.322 -7.271 60 HB VAL 8 HB VAL 8 -7.362 -1.068 -5.163 61 HG11 VAL 8 1HG1 VAL 8 -5.119 -0.709 -6.013 62 HG12 VAL 8 2HG1 VAL 8 -5.551 0.633 -4.957 63 HG13 VAL 8 3HG1 VAL 8 -5.576 0.850 -6.695 64 HG21 VAL 8 3HG2 VAL 8 -9.200 0.561 -5.772 65 HG22 VAL 8 1HG2 VAL 8 -7.958 1.701 -6.285 66 HG23 VAL 8 2HG2 VAL 8 -8.047 1.191 -4.601 67 H THR 9 H THR 9 -9.446 0.473 -8.272 68 HA THR 9 HA THR 9 -7.839 1.684 -10.455 69 HB THR 9 HB THR 9 -10.842 1.801 -9.932 70 HG1 THR 9 1HG THR 9 -10.225 0.378 -12.054 71 HG21 THR 9 3HG2 THR 9 -10.926 2.499 -12.313 72 HG22 THR 9 1HG2 THR 9 -9.165 2.483 -12.374 73 HG23 THR 9 2HG2 THR 9 -10.003 3.646 -11.348 74 H VAL 10 H VAL 10 -6.973 3.650 -10.079 75 HA VAL 10 HA VAL 10 -8.316 5.549 -8.198 76 HB VAL 10 HB VAL 10 -5.323 5.163 -8.612 77 HG11 VAL 10 1HG1 VAL 10 -5.910 7.471 -7.988 78 HG12 VAL 10 2HG1 VAL 10 -5.167 6.663 -6.614 79 HG13 VAL 10 3HG1 VAL 10 -6.916 6.880 -6.667 80 HG21 VAL 10 3HG2 VAL 10 -7.120 4.333 -6.300 81 HG22 VAL 10 1HG2 VAL 10 -5.359 4.223 -6.310 82 HG23 VAL 10 2HG2 VAL 10 -6.307 3.242 -7.422 83 H TYR 11 H TYR 11 -8.827 7.439 -9.133 84 HA TYR 11 HA TYR 11 -7.845 8.066 -11.844 85 HB2 TYR 11 2HB TYR 11 -10.281 8.194 -11.309 86 HB3 TYR 11 1HB TYR 11 -9.944 9.467 -10.143 87 HD1 TYR 11 1HD TYR 11 -9.890 8.574 -13.756 88 HD2 TYR 11 2HD TYR 11 -9.388 11.747 -10.892 89 HE1 TYR 11 1HE TYR 11 -9.894 10.234 -15.591 90 HE2 TYR 11 2HE TYR 11 -9.398 13.403 -12.734 91 HH TYR 11 HH TYR 11 -9.092 13.585 -15.041 92 H ALA 12 H ALA 12 -5.759 8.761 -11.496 93 HA ALA 12 HA ALA 12 -5.390 11.494 -10.750 94 HB1 ALA 12 1HB ALA 12 -3.809 10.990 -8.806 95 HB2 ALA 12 2HB ALA 12 -4.469 9.352 -8.813 96 HB3 ALA 12 3HB ALA 12 -5.519 10.717 -8.465 97 H ALA 13 H ALA 13 -3.312 12.255 -11.264 98 HA ALA 13 HA ALA 13 -2.011 10.925 -13.398 99 HB1 ALA 13 1HB ALA 13 -2.049 13.418 -12.960 100 HB2 ALA 13 2HB ALA 13 -0.458 12.775 -13.364 101 HB3 ALA 13 3HB ALA 13 -0.858 13.160 -11.687 102 H ILE 14 H ILE 14 -0.166 9.693 -13.498 103 HA ILE 14 HA ILE 14 0.536 8.010 -11.431 104 HB ILE 14 HB ILE 14 1.131 7.589 -13.775 105 HG12 ILE 14 2HG1 ILE 14 3.472 6.751 -13.442 106 HG13 ILE 14 1HG1 ILE 14 3.593 7.669 -11.950 107 HG21 ILE 14 1HG2 ILE 14 1.785 9.964 -14.312 108 HG22 ILE 14 2HG2 ILE 14 2.943 8.767 -14.890 109 HG23 ILE 14 3HG2 ILE 14 3.300 9.700 -13.442 110 HD11 ILE 14 3HD1 ILE 14 1.372 5.638 -12.317 111 HD12 ILE 14 1HD1 ILE 14 2.079 6.266 -10.824 112 HD13 ILE 14 2HD1 ILE 14 2.992 5.155 -11.827 113 H GLU 15 H GLU 15 1.948 11.169 -12.220 114 HA GLU 15 HA GLU 15 4.135 11.005 -10.403 115 HB2 GLU 15 2HB GLU 15 4.323 13.436 -10.780 116 HB3 GLU 15 1HB GLU 15 4.140 12.549 -12.293 117 HG2 GLU 15 2HG GLU 15 1.691 13.079 -12.258 118 HG3 GLU 15 1HG GLU 15 1.946 14.059 -10.819 119 H LYS 16 H LYS 16 0.784 12.096 -10.061 120 HA LYS 16 HA LYS 16 1.129 13.407 -7.538 121 HB2 LYS 16 2HB LYS 16 -0.769 13.793 -9.116 122 HB3 LYS 16 1HB LYS 16 -1.387 12.187 -8.734 123 HG2 LYS 16 2HG LYS 16 -1.645 12.825 -6.365 124 HG3 LYS 16 1HG LYS 16 -0.958 14.414 -6.704 125 HD2 LYS 16 2HD LYS 16 -2.829 14.882 -8.261 126 HD3 LYS 16 1HD LYS 16 -3.514 13.295 -7.906 127 HE2 LYS 16 2HE LYS 16 -4.618 15.049 -6.569 128 HE3 LYS 16 1HE LYS 16 -3.742 13.929 -5.525 129 HZ1 LYS 16 3HZ LYS 16 -2.126 15.462 -5.080 130 HZ2 LYS 16 1HZ LYS 16 -3.463 16.491 -5.250 131 HZ3 LYS 16 2HZ LYS 16 -2.360 16.315 -6.530 132 H VAL 17 H VAL 17 -0.151 10.200 -8.427 133 HA VAL 17 HA VAL 17 -0.596 9.294 -5.788 134 HB VAL 17 HB VAL 17 -0.731 7.044 -6.845 135 HG11 VAL 17 1HG1 VAL 17 -2.620 7.567 -8.335 136 HG12 VAL 17 2HG1 VAL 17 -2.092 9.250 -8.404 137 HG13 VAL 17 3HG1 VAL 17 -2.675 8.570 -6.883 138 HG21 VAL 17 3HG2 VAL 17 1.060 7.247 -8.493 139 HG22 VAL 17 1HG2 VAL 17 0.175 8.537 -9.286 140 HG23 VAL 17 2HG2 VAL 17 -0.452 6.903 -9.308 141 H TRP 18 H TRP 18 2.233 9.154 -7.917 142 HA TRP 18 HA TRP 18 3.738 7.279 -6.479 143 HB2 TRP 18 2HB TRP 18 4.363 8.141 -8.708 144 HB3 TRP 18 1HB TRP 18 4.712 9.718 -8.005 145 HD1 TRP 18 HD TRP 18 6.904 9.939 -6.490 146 HE1 TRP 18 1HE TRP 18 8.998 8.452 -6.255 147 HE3 TRP 18 3HE TRP 18 5.225 5.686 -8.761 148 HZ2 TRP 18 2HZ TRP 18 9.848 5.815 -6.940 149 HZ3 TRP 18 3HZ TRP 18 6.698 3.702 -8.956 150 HH2 TRP 18 HH TRP 18 9.003 3.761 -8.046 151 H LYS 19 H LYS 19 3.657 10.833 -6.172 152 HA LYS 19 HA LYS 19 5.480 10.953 -3.966 153 HB2 LYS 19 2HB LYS 19 3.374 12.915 -4.893 154 HB3 LYS 19 1HB LYS 19 4.618 13.280 -3.699 155 HG2 LYS 19 2HG LYS 19 6.369 12.720 -5.415 156 HG3 LYS 19 1HG LYS 19 5.089 12.514 -6.607 157 HD2 LYS 19 2HD LYS 19 5.619 15.082 -5.057 158 HD3 LYS 19 1HD LYS 19 6.161 14.781 -6.701 159 HE2 LYS 19 2HE LYS 19 3.653 14.378 -7.277 160 HE3 LYS 19 1HE LYS 19 3.311 15.144 -5.724 161 HZ1 LYS 19 3HZ LYS 19 3.694 17.114 -6.595 162 HZ2 LYS 19 1HZ LYS 19 3.859 16.390 -8.120 163 HZ3 LYS 19 2HZ LYS 19 5.230 16.643 -7.150 164 H TYR 20 H TYR 20 1.910 11.013 -4.173 165 HA TYR 20 HA TYR 20 1.443 11.328 -1.401 166 HB2 TYR 20 2HB TYR 20 -0.265 11.756 -3.129 167 HB3 TYR 20 1HB TYR 20 -0.298 10.045 -3.519 168 HD1 TYR 20 2HD TYR 20 -1.246 8.382 -1.929 169 HD2 TYR 20 1HD TYR 20 -1.306 12.594 -1.054 170 HE1 TYR 20 2HE TYR 20 -2.871 7.984 -0.098 171 HE2 TYR 20 1HE TYR 20 -2.926 12.190 0.777 172 HH TYR 20 HH TYR 20 -4.631 9.316 1.118 173 H TRP 21 H TRP 21 1.651 8.436 -3.439 174 HA TRP 21 HA TRP 21 1.042 6.581 -1.346 175 HB2 TRP 21 2HB TRP 21 0.764 6.134 -3.803 176 HB3 TRP 21 1HB TRP 21 2.516 6.059 -3.962 177 HD1 TRP 21 HD TRP 21 3.717 3.865 -3.100 178 HE1 TRP 21 1HE TRP 21 2.858 1.600 -2.226 179 HE3 TRP 21 3HE TRP 21 -1.213 4.995 -2.442 180 HZ2 TRP 21 2HZ TRP 21 0.400 0.419 -1.372 181 HZ3 TRP 21 3HZ TRP 21 -2.793 3.281 -1.607 182 HH2 TRP 21 HH TRP 21 -1.995 0.995 -1.071 183 H ASN 22 H ASN 22 3.923 8.286 -2.237 184 HA ASN 22 HA ASN 22 5.704 6.437 -0.731 185 HB2 ASN 22 2HB ASN 22 6.296 8.770 -2.575 186 HB3 ASN 22 1HB ASN 22 7.520 7.813 -1.746 187 HD21 ASN 22 1HD2 ASN 22 4.587 6.297 -3.093 188 HD22 ASN 22 2HD2 ASN 22 5.396 5.472 -4.335 189 H GLU 23 H GLU 23 4.217 9.600 -0.566 190 HA GLU 23 HA GLU 23 6.023 10.836 1.226 191 HB2 GLU 23 2HB GLU 23 3.207 11.315 0.335 192 HB3 GLU 23 1HB GLU 23 3.629 12.056 1.873 193 HG2 GLU 23 2HG GLU 23 5.495 13.252 0.847 194 HG3 GLU 23 1HG GLU 23 5.224 12.438 -0.687 195 HA PRO 24 HA PRO 24 4.995 8.318 4.849 196 HB2 PRO 24 2HB PRO 24 6.324 9.630 6.827 197 HB3 PRO 24 1HB PRO 24 7.212 8.830 5.513 198 HG2 PRO 24 2HG PRO 24 6.435 11.735 5.726 199 HG3 PRO 24 1HG PRO 24 8.044 11.045 5.394 200 HD2 PRO 24 2HD PRO 24 6.436 11.894 3.363 201 HD3 PRO 24 1HD PRO 24 7.472 10.457 3.167 202 H ALA 25 H ALA 25 4.604 11.850 5.123 203 HA ALA 25 HA ALA 25 2.884 11.933 7.325 204 HB1 ALA 25 1HB ALA 25 2.909 13.774 4.916 205 HB2 ALA 25 2HB ALA 25 3.948 13.927 6.333 206 HB3 ALA 25 3HB ALA 25 2.204 14.143 6.492 207 H HIS 26 H HIS 26 2.235 11.253 3.945 208 HA HIS 26 HA HIS 26 -0.646 11.411 4.173 209 HB2 HIS 26 2HB HIS 26 1.137 10.212 2.032 210 HB3 HIS 26 1HB HIS 26 -0.606 10.441 1.888 211 HD2 HIS 26 2HD HIS 26 0.655 13.502 3.683 212 HE1 HIS 26 1HE HIS 26 0.905 14.484 -0.413 213 HE2 HIS 26 2HE HIS 26 0.989 15.419 1.945 214 H ILE 27 H ILE 27 1.721 8.718 4.139 215 HA ILE 27 HA ILE 27 -0.206 6.635 4.127 216 HB ILE 27 HB ILE 27 2.655 6.736 5.157 217 HG12 ILE 27 2HG1 ILE 27 1.542 5.493 2.593 218 HG13 ILE 27 1HG1 ILE 27 2.170 7.136 2.662 219 HG21 ILE 27 1HG2 ILE 27 1.617 4.827 6.269 220 HG22 ILE 27 2HG2 ILE 27 2.548 4.182 4.930 221 HG23 ILE 27 3HG2 ILE 27 0.800 4.339 4.786 222 HD11 ILE 27 3HD1 ILE 27 3.892 5.558 1.877 223 HD12 ILE 27 1HD1 ILE 27 3.741 4.642 3.377 224 HD13 ILE 27 2HD1 ILE 27 4.351 6.297 3.411 225 H MET 28 H MET 28 1.424 8.285 6.857 226 HA MET 28 HA MET 28 0.208 6.677 8.873 227 HB2 MET 28 2HB MET 28 1.066 8.328 10.452 228 HB3 MET 28 1HB MET 28 2.285 7.969 9.233 229 HG2 MET 28 2HG MET 28 1.520 10.017 7.973 230 HG3 MET 28 1HG MET 28 0.508 10.429 9.351 231 HE1 MET 28 3HE MET 28 2.798 11.260 12.178 232 HE2 MET 28 1HE MET 28 2.614 9.520 11.949 233 HE3 MET 28 2HE MET 28 1.252 10.598 11.662 234 H LYS 29 H LYS 29 -1.138 9.060 6.877 235 HA LYS 29 HA LYS 29 -3.057 10.105 8.789 236 HB2 LYS 29 2HB LYS 29 -2.209 11.402 6.824 237 HB3 LYS 29 1HB LYS 29 -3.070 10.298 5.759 238 HG2 LYS 29 2HG LYS 29 -5.211 10.909 6.803 239 HG3 LYS 29 1HG LYS 29 -4.372 11.978 7.927 240 HD2 LYS 29 2HD LYS 29 -3.555 13.332 6.023 241 HD3 LYS 29 1HD LYS 29 -4.410 12.268 4.905 242 HE2 LYS 29 2HE LYS 29 -6.556 12.878 5.963 243 HE3 LYS 29 1HE LYS 29 -5.702 13.940 7.084 244 HZ1 LYS 29 3HZ LYS 29 -5.810 14.198 4.128 245 HZ2 LYS 29 1HZ LYS 29 -4.839 15.154 5.137 246 HZ3 LYS 29 2HZ LYS 29 -6.530 15.235 5.268 247 H TRP 30 H TRP 30 -2.884 7.472 6.505 248 HA TRP 30 HA TRP 30 -5.545 6.480 7.382 249 HB2 TRP 30 2HB TRP 30 -6.118 5.808 5.089 250 HB3 TRP 30 1HB TRP 30 -5.893 7.553 5.182 251 HD1 TRP 30 HD TRP 30 -3.631 8.553 4.131 252 HE1 TRP 30 1HE TRP 30 -2.026 7.649 2.318 253 HE3 TRP 30 3HE TRP 30 -5.159 3.680 3.946 254 HZ2 TRP 30 2HZ TRP 30 -1.479 5.190 0.966 255 HZ3 TRP 30 3HZ TRP 30 -4.083 2.090 2.402 256 HH2 TRP 30 HH TRP 30 -2.255 2.828 0.912 257 H CYS 31 H CYS 31 -2.545 5.747 7.874 258 HA CYS 31 HA CYS 31 -1.953 3.333 6.596 259 HB2 CYS 31 2HB CYS 31 -0.289 4.439 7.979 260 HB3 CYS 31 1HB CYS 31 -1.314 4.300 9.403 261 HG CYS 31 HG CYS 31 -0.656 1.897 9.668 262 H GLN 32 H GLN 32 -2.688 1.299 6.783 263 HA GLN 32 HA GLN 32 -3.882 -0.523 7.405 264 HB2 GLN 32 2HB GLN 32 -2.869 0.050 9.722 265 HB3 GLN 32 1HB GLN 32 -4.429 0.764 10.110 266 HG2 GLN 32 2HG GLN 32 -4.492 -1.507 10.930 267 HG3 GLN 32 1HG GLN 32 -5.505 -1.467 9.489 268 HE21 GLN 32 1HE2 GLN 32 -5.190 -3.577 8.663 269 HE22 GLN 32 2HE2 GLN 32 -3.670 -4.224 8.276 270 H ALA 33 H ALA 33 -5.249 2.622 8.027 271 HA ALA 33 HA ALA 33 -7.330 3.515 7.739 272 HB1 ALA 33 1HB ALA 33 -8.625 2.647 5.848 273 HB2 ALA 33 2HB ALA 33 -7.647 1.183 5.827 274 HB3 ALA 33 3HB ALA 33 -6.914 2.734 5.430 275 H SER 34 H SER 34 -6.975 1.666 9.924 276 HA SER 34 HA SER 34 -9.750 0.644 10.267 277 HB2 SER 34 2HB SER 34 -8.790 -1.184 11.601 278 HB3 SER 34 1HB SER 34 -8.121 -1.191 9.968 279 HG SER 34 HG SER 34 -6.883 -0.814 12.357 280 HA PRO 35 HA PRO 35 -9.360 3.365 13.887 281 HB2 PRO 35 2HB PRO 35 -11.667 2.848 15.211 282 HB3 PRO 35 1HB PRO 35 -11.700 3.609 13.600 283 HG2 PRO 35 2HG PRO 35 -12.014 0.684 14.281 284 HG3 PRO 35 1HG PRO 35 -13.095 1.707 13.303 285 HD2 PRO 35 2HD PRO 35 -11.219 0.127 12.117 286 HD3 PRO 35 1HD PRO 35 -11.604 1.736 11.456 287 H GLU 36 H GLU 36 -9.356 -0.077 14.044 288 HA GLU 36 HA GLU 36 -9.100 -0.349 16.918 289 HB2 GLU 36 2HB GLU 36 -9.970 -2.155 15.430 290 HB3 GLU 36 1HB GLU 36 -8.371 -2.309 14.708 291 HG2 GLU 36 2HG GLU 36 -7.419 -2.929 16.898 292 HG3 GLU 36 1HG GLU 36 -8.989 -2.702 17.661 293 H TRP 37 H TRP 37 -6.965 0.296 14.252 294 HA TRP 37 HA TRP 37 -4.547 0.040 15.994 295 HB2 TRP 37 2HB TRP 37 -4.871 -0.204 12.978 296 HB3 TRP 37 1HB TRP 37 -3.306 -0.137 13.794 297 HD1 TRP 37 HD TRP 37 -6.334 -2.420 13.309 298 HE1 TRP 37 1HE TRP 37 -5.728 -4.785 14.135 299 HE3 TRP 37 3HE TRP 37 -1.788 -1.478 15.435 300 HZ2 TRP 37 2HZ TRP 37 -3.600 -6.104 15.521 301 HZ3 TRP 37 3HZ TRP 37 -0.496 -3.304 16.500 302 HH2 TRP 37 HH TRP 37 -1.394 -5.614 16.544 303 H HIS 38 H HIS 38 -3.221 1.734 16.217 304 HA HIS 38 HA HIS 38 -3.903 4.316 14.888 305 HB2 HIS 38 2HB HIS 38 -4.378 4.267 17.342 306 HB3 HIS 38 1HB HIS 38 -2.690 3.880 17.650 307 HD2 HIS 38 2HD HIS 38 -4.320 6.785 15.426 308 HE1 HIS 38 1HE HIS 38 -1.315 8.422 17.898 309 HE2 HIS 38 2HE HIS 38 -3.033 8.953 16.104 310 H VAL 39 H VAL 39 -2.063 5.764 14.696 311 HA VAL 39 HA VAL 39 0.567 4.422 14.298 312 HB VAL 39 HB VAL 39 -0.565 4.560 12.157 313 HG11 VAL 39 1HG1 VAL 39 -1.732 6.404 11.342 314 HG12 VAL 39 2HG1 VAL 39 -0.645 7.579 12.072 315 HG13 VAL 39 3HG1 VAL 39 -1.892 6.813 13.043 316 HG21 VAL 39 3HG2 VAL 39 1.917 4.993 12.321 317 HG22 VAL 39 1HG2 VAL 39 1.581 6.725 12.333 318 HG23 VAL 39 2HG2 VAL 39 1.174 5.757 10.922 319 HA PRO 40 HA PRO 40 1.051 8.398 16.663 320 HB2 PRO 40 2HB PRO 40 2.682 7.555 18.664 321 HB3 PRO 40 1HB PRO 40 0.944 7.171 18.670 322 HG2 PRO 40 2HG PRO 40 3.251 5.419 17.854 323 HG3 PRO 40 1HG PRO 40 1.826 5.003 18.832 324 HD2 PRO 40 2HD PRO 40 2.041 4.460 16.113 325 HD3 PRO 40 1HD PRO 40 0.483 4.645 16.945 326 H ALA 41 H ALA 41 3.112 6.385 14.874 327 HA ALA 41 HA ALA 41 4.806 8.546 14.089 328 HB1 ALA 41 1HB ALA 41 5.869 8.080 16.264 329 HB2 ALA 41 2HB ALA 41 6.943 7.656 14.933 330 HB3 ALA 41 3HB ALA 41 6.076 6.391 15.807 331 H ALA 42 H ALA 42 6.172 7.984 12.363 332 HA ALA 42 HA ALA 42 6.462 5.323 11.382 333 HB1 ALA 42 1HB ALA 42 5.050 5.509 9.378 334 HB2 ALA 42 2HB ALA 42 4.468 7.081 9.925 335 HB3 ALA 42 3HB ALA 42 4.068 5.627 10.838 336 H GLN 43 H GLN 43 7.756 5.225 9.506 337 HA GLN 43 HA GLN 43 8.870 7.762 8.446 338 HB2 GLN 43 2HB GLN 43 10.523 5.478 9.587 339 HB3 GLN 43 1HB GLN 43 11.170 6.873 8.720 340 HG2 GLN 43 2HG GLN 43 10.199 8.372 10.468 341 HG3 GLN 43 1HG GLN 43 9.642 6.949 11.348 342 HE21 GLN 43 1HE2 GLN 43 11.011 6.699 13.113 343 HE22 GLN 43 2HE2 GLN 43 12.705 6.780 13.040 344 H ASN 44 H ASN 44 9.950 7.498 6.432 345 HA ASN 44 HA ASN 44 9.971 4.931 5.076 346 HB2 ASN 44 2HB ASN 44 7.584 5.626 4.854 347 HB3 ASN 44 1HB ASN 44 8.107 7.110 4.067 348 HD21 ASN 44 1HD2 ASN 44 7.208 6.628 1.981 349 HD22 ASN 44 2HD2 ASN 44 7.778 5.351 1.020 350 H ASP 45 H ASP 45 12.060 5.175 4.475 351 HA ASP 45 HA ASP 45 13.003 7.674 3.189 352 HB2 ASP 45 2HB ASP 45 14.487 5.161 4.033 353 HB3 ASP 45 1HB ASP 45 15.228 6.622 3.381 354 H LEU 46 H LEU 46 11.819 7.429 1.217 355 HA LEU 46 HA LEU 46 11.925 5.094 -0.402 356 HB2 LEU 46 2HB LEU 46 10.249 7.008 -0.568 357 HB3 LEU 46 1HB LEU 46 11.514 7.966 -1.324 358 HG LEU 46 HG LEU 46 11.684 5.845 -2.987 359 HD11 LEU 46 1HD1 LEU 46 8.800 5.675 -2.054 360 HD12 LEU 46 2HD1 LEU 46 10.035 4.458 -1.751 361 HD13 LEU 46 3HD1 LEU 46 9.510 4.781 -3.396 362 HD21 LEU 46 3HD2 LEU 46 9.473 7.910 -3.154 363 HD22 LEU 46 1HD2 LEU 46 10.028 6.924 -4.506 364 HD23 LEU 46 2HD2 LEU 46 11.114 8.088 -3.753 365 H LYS 47 H LYS 47 14.079 4.381 -0.611 366 HA LYS 47 HA LYS 47 15.588 5.536 -2.753 367 HB2 LYS 47 2HB LYS 47 16.149 7.083 -0.846 368 HB3 LYS 47 1HB LYS 47 16.841 5.722 0.018 369 HG2 LYS 47 2HG LYS 47 18.427 5.358 -1.879 370 HG3 LYS 47 1HG LYS 47 17.751 6.770 -2.689 371 HD2 LYS 47 2HD LYS 47 19.047 6.835 0.069 372 HD3 LYS 47 1HD LYS 47 19.888 7.240 -1.421 373 HE2 LYS 47 2HE LYS 47 18.031 9.017 -1.804 374 HE3 LYS 47 1HE LYS 47 17.610 8.761 -0.110 375 HZ1 LYS 47 3HZ LYS 47 20.423 9.160 -0.703 376 HZ2 LYS 47 1HZ LYS 47 19.494 9.701 0.609 377 HZ3 LYS 47 2HZ LYS 47 19.407 10.510 -0.883 378 H ALA 48 H ALA 48 17.137 4.064 -3.528 379 HA ALA 48 HA ALA 48 16.818 1.344 -2.913 380 HB1 ALA 48 1HB ALA 48 18.859 0.987 -4.259 381 HB2 ALA 48 2HB ALA 48 19.208 2.716 -4.187 382 HB3 ALA 48 3HB ALA 48 17.780 2.140 -5.042 383 H GLY 49 H GLY 49 17.790 -0.023 -1.472 384 HA2 GLY 49 2HA GLY 49 19.160 -0.789 0.213 385 HA3 GLY 49 1HA GLY 49 20.281 0.523 -0.145 386 H GLY 50 H GLY 50 17.341 1.943 0.225 387 HA2 GLY 50 2HA GLY 50 17.963 3.045 2.834 388 HA3 GLY 50 1HA GLY 50 16.554 3.407 1.842 389 H THR 51 H THR 51 16.389 3.015 4.630 390 HA THR 51 HA THR 51 14.823 0.474 4.846 391 HB THR 51 HB THR 51 15.585 0.214 7.104 392 HG1 THR 51 1HG THR 51 16.112 1.877 8.244 393 HG21 THR 51 3HG2 THR 51 17.998 0.040 6.887 394 HG22 THR 51 1HG2 THR 51 18.017 1.245 5.601 395 HG23 THR 51 2HG2 THR 51 17.302 -0.339 5.314 396 H PHE 52 H PHE 52 13.026 0.544 6.285 397 HA PHE 52 HA PHE 52 11.986 3.226 7.041 398 HB2 PHE 52 2HB PHE 52 9.802 2.699 6.087 399 HB3 PHE 52 1HB PHE 52 11.026 2.614 4.824 400 HD1 PHE 52 2HD PHE 52 11.815 0.391 3.965 401 HD2 PHE 52 1HD PHE 52 8.623 0.670 6.841 402 HE1 PHE 52 2HE PHE 52 11.181 -1.959 3.501 403 HE2 PHE 52 1HE PHE 52 7.998 -1.687 6.374 404 HZ PHE 52 HZ PHE 52 9.279 -2.996 4.701 405 H THR 53 H THR 53 10.326 3.159 8.635 406 HA THR 53 HA THR 53 9.848 0.624 10.053 407 HB THR 53 HB THR 53 11.003 3.063 11.465 408 HG1 THR 53 1HG THR 53 12.849 1.798 11.636 409 HG21 THR 53 3HG2 THR 53 10.371 0.246 12.421 410 HG22 THR 53 1HG2 THR 53 9.518 1.716 12.895 411 HG23 THR 53 2HG2 THR 53 11.195 1.476 13.374 412 H THR 54 H THR 54 7.705 0.564 10.241 413 HA THR 54 HA THR 54 6.129 3.066 10.629 414 HB THR 54 HB THR 54 5.203 0.323 9.702 415 HG1 THR 54 1HG THR 54 5.021 2.168 7.834 416 HG21 THR 54 3HG2 THR 54 3.188 1.578 8.976 417 HG22 THR 54 1HG2 THR 54 3.848 3.041 9.702 418 HG23 THR 54 2HG2 THR 54 3.409 1.669 10.720 419 H THR 55 H THR 55 5.718 3.399 12.763 420 HA THR 55 HA THR 55 5.508 1.121 14.627 421 HB THR 55 HB THR 55 5.413 4.121 15.162 422 HG1 THR 55 1HG THR 55 7.591 3.839 15.684 423 HG21 THR 55 3HG2 THR 55 6.049 3.410 17.468 424 HG22 THR 55 1HG2 THR 55 5.872 1.726 16.982 425 HG23 THR 55 2HG2 THR 55 4.467 2.791 17.003 426 H MET 56 H MET 56 3.551 0.249 15.017 427 HA MET 56 HA MET 56 1.161 1.981 15.211 428 HB2 MET 56 2HB MET 56 -0.141 0.341 13.851 429 HB3 MET 56 1HB MET 56 1.092 1.171 12.911 430 HG2 MET 56 2HG MET 56 2.618 -0.766 13.194 431 HG3 MET 56 1HG MET 56 1.362 -1.619 14.087 432 HE1 MET 56 3HE MET 56 -1.196 -2.721 11.589 433 HE2 MET 56 1HE MET 56 -1.203 -1.663 13.003 434 HE3 MET 56 2HE MET 56 -0.275 -3.157 13.025 435 H ALA 57 H ALA 57 -0.306 1.300 16.708 436 HA ALA 57 HA ALA 57 -0.021 -1.356 17.974 437 HB1 ALA 57 1HB ALA 57 0.058 -0.369 20.220 438 HB2 ALA 57 2HB ALA 57 0.083 1.251 19.523 439 HB3 ALA 57 3HB ALA 57 1.444 0.160 19.266 440 H ALA 58 H ALA 58 -1.823 -2.018 19.151 441 HA ALA 58 HA ALA 58 -4.348 -1.166 18.120 442 HB1 ALA 58 1HB ALA 58 -3.714 -2.969 20.469 443 HB2 ALA 58 2HB ALA 58 -3.925 -3.491 18.797 444 HB3 ALA 58 3HB ALA 58 -5.289 -2.812 19.688 445 H LYS 59 H LYS 59 -6.054 -0.098 19.212 446 HA LYS 59 HA LYS 59 -5.342 2.101 20.805 447 HB2 LYS 59 2HB LYS 59 -8.046 0.738 20.579 448 HB3 LYS 59 1HB LYS 59 -7.779 2.371 21.183 449 HG2 LYS 59 2HG LYS 59 -6.979 1.517 18.366 450 HG3 LYS 59 1HG LYS 59 -8.564 2.189 18.737 451 HD2 LYS 59 2HD LYS 59 -7.428 4.246 19.642 452 HD3 LYS 59 1HD LYS 59 -5.884 3.585 19.122 453 HE2 LYS 59 2HE LYS 59 -8.229 4.207 17.314 454 HE3 LYS 59 1HE LYS 59 -6.734 5.136 17.432 455 HZ1 LYS 59 3HZ LYS 59 -5.899 3.791 15.903 456 HZ2 LYS 59 1HZ LYS 59 -7.261 2.782 15.944 457 HZ3 LYS 59 2HZ LYS 59 -5.975 2.516 17.023 458 H ASP 60 H ASP 60 -6.544 -1.097 21.718 459 HA ASP 60 HA ASP 60 -6.697 -0.462 24.550 460 HB2 ASP 60 2HB ASP 60 -7.098 -2.913 24.781 461 HB3 ASP 60 1HB ASP 60 -8.174 -2.162 23.606 462 H GLY 61 H GLY 61 -4.174 -0.990 22.414 463 HA2 GLY 61 2HA GLY 61 -1.929 -1.387 22.687 464 HA3 GLY 61 1HA GLY 61 -2.169 -1.041 24.397 465 H SER 62 H SER 62 -4.119 -3.548 23.093 466 HA SER 62 HA SER 62 -3.068 -5.525 24.848 467 HB2 SER 62 2HB SER 62 -4.597 -7.051 23.649 468 HB3 SER 62 1HB SER 62 -5.398 -5.541 24.073 469 HG SER 62 HG SER 62 -4.380 -5.028 21.787 470 H MET 63 H MET 63 -2.306 -4.549 21.599 471 HA MET 63 HA MET 63 -0.046 -6.433 21.500 472 HB2 MET 63 2HB MET 63 -1.972 -7.605 20.402 473 HB3 MET 63 1HB MET 63 -2.106 -6.272 19.258 474 HG2 MET 63 2HG MET 63 0.174 -6.719 18.440 475 HG3 MET 63 1HG MET 63 0.374 -7.994 19.641 476 HE1 MET 63 3HE MET 63 1.187 -9.316 17.662 477 HE2 MET 63 1HE MET 63 0.674 -8.283 16.321 478 HE3 MET 63 2HE MET 63 0.197 -9.978 16.365 479 H SER 64 H SER 64 1.649 -5.695 20.262 480 HA SER 64 HA SER 64 1.368 -3.203 18.701 481 HB2 SER 64 2HB SER 64 2.013 -2.481 20.964 482 HB3 SER 64 1HB SER 64 3.370 -3.603 20.945 483 HG SER 64 HG SER 64 3.903 -1.422 20.318 484 H PHE 65 H PHE 65 2.851 -3.025 17.040 485 HA PHE 65 HA PHE 65 5.130 -4.812 16.820 486 HB2 PHE 65 2HB PHE 65 3.229 -6.285 16.120 487 HB3 PHE 65 1HB PHE 65 2.816 -5.124 14.860 488 HD1 PHE 65 2HD PHE 65 5.405 -7.530 16.035 489 HD2 PHE 65 1HD PHE 65 4.174 -4.952 12.811 490 HE1 PHE 65 2HE PHE 65 7.104 -8.557 14.559 491 HE2 PHE 65 1HE PHE 65 5.881 -5.989 11.343 492 HZ PHE 65 HZ PHE 65 7.345 -7.788 12.214 493 H ASP 66 H ASP 66 6.339 -4.383 14.824 494 HA ASP 66 HA ASP 66 5.736 -1.793 13.504 495 HB2 ASP 66 2HB ASP 66 8.087 -1.100 13.806 496 HB3 ASP 66 1HB ASP 66 7.267 -1.290 15.354 497 H PHE 67 H PHE 67 6.032 -1.881 11.371 498 HA PHE 67 HA PHE 67 7.222 -4.304 10.149 499 HB2 PHE 67 2HB PHE 67 5.544 -2.012 9.059 500 HB3 PHE 67 1HB PHE 67 6.221 -3.274 8.033 501 HD1 PHE 67 2HD PHE 67 3.758 -2.542 10.712 502 HD2 PHE 67 1HD PHE 67 5.376 -5.578 8.132 503 HE1 PHE 67 2HE PHE 67 1.872 -4.043 11.287 504 HE2 PHE 67 1HE PHE 67 3.491 -7.076 8.713 505 HZ PHE 67 HZ PHE 67 1.737 -6.306 10.288 506 H GLY 68 H GLY 68 9.060 -4.264 8.978 507 HA2 GLY 68 2HA GLY 68 10.304 -1.760 8.097 508 HA3 GLY 68 1HA GLY 68 11.180 -2.687 9.314 509 H GLY 69 H GLY 69 12.007 -2.095 6.634 510 HA2 GLY 69 2HA GLY 69 12.949 -4.665 5.821 511 HA3 GLY 69 1HA GLY 69 11.683 -4.087 4.736 512 H VAL 70 H VAL 70 13.801 -4.323 3.360 513 HA VAL 70 HA VAL 70 15.159 -1.660 3.231 514 HB VAL 70 HB VAL 70 16.363 -4.367 2.508 515 HG11 VAL 70 1HG1 VAL 70 18.487 -3.069 2.474 516 HG12 VAL 70 2HG1 VAL 70 17.576 -1.591 2.781 517 HG13 VAL 70 3HG1 VAL 70 17.342 -2.476 1.275 518 HG21 VAL 70 3HG2 VAL 70 16.007 -4.279 4.929 519 HG22 VAL 70 1HG2 VAL 70 16.719 -2.671 5.011 520 HG23 VAL 70 2HG2 VAL 70 17.721 -4.058 4.593 521 H TYR 71 H TYR 71 15.055 -0.668 1.285 522 HA TYR 71 HA TYR 71 13.460 -1.808 -0.854 523 HB2 TYR 71 2HB TYR 71 15.071 0.764 -0.682 524 HB3 TYR 71 1HB TYR 71 14.009 0.343 -2.021 525 HD1 TYR 71 2HD TYR 71 11.541 -0.081 -1.583 526 HD2 TYR 71 1HD TYR 71 14.118 1.683 1.379 527 HE1 TYR 71 2HE TYR 71 9.564 0.725 -0.337 528 HE2 TYR 71 1HE TYR 71 12.131 2.484 2.623 529 HH TYR 71 HH TYR 71 8.841 1.951 1.364 530 H ASP 72 H ASP 72 14.263 -3.259 -2.242 531 HA ASP 72 HA ASP 72 17.094 -3.684 -2.620 532 HB2 ASP 72 2HB ASP 72 14.671 -4.793 -4.078 533 HB3 ASP 72 1HB ASP 72 16.325 -5.358 -4.308 534 H GLN 73 H GLN 73 14.442 -2.342 -4.586 535 HA GLN 73 HA GLN 73 16.331 -0.690 -6.110 536 HB2 GLN 73 2HB GLN 73 14.552 -2.734 -7.503 537 HB3 GLN 73 1HB GLN 73 15.482 -1.470 -8.308 538 HG2 GLN 73 2HG GLN 73 17.582 -2.489 -7.315 539 HG3 GLN 73 1HG GLN 73 16.595 -3.824 -6.728 540 HE21 GLN 73 1HE2 GLN 73 18.762 -3.584 -8.943 541 HE22 GLN 73 2HE2 GLN 73 18.036 -4.354 -10.269 542 H VAL 74 H VAL 74 15.349 1.109 -7.020 543 HA VAL 74 HA VAL 74 12.422 1.372 -6.991 544 HB VAL 74 HB VAL 74 13.122 2.053 -4.721 545 HG11 VAL 74 1HG1 VAL 74 14.752 4.240 -6.081 546 HG12 VAL 74 2HG1 VAL 74 15.449 2.792 -5.359 547 HG13 VAL 74 3HG1 VAL 74 14.597 3.955 -4.350 548 HG21 VAL 74 3HG2 VAL 74 12.022 4.233 -4.708 549 HG22 VAL 74 1HG2 VAL 74 11.214 3.202 -5.876 550 HG23 VAL 74 2HG2 VAL 74 12.325 4.453 -6.422 551 H LYS 75 H LYS 75 11.706 2.689 -8.602 552 HA LYS 75 HA LYS 75 13.573 4.559 -9.949 553 HB2 LYS 75 2HB LYS 75 12.036 2.375 -11.396 554 HB3 LYS 75 1HB LYS 75 12.922 3.683 -12.175 555 HG2 LYS 75 2HG LYS 75 15.011 2.861 -11.069 556 HG3 LYS 75 1HG LYS 75 14.089 1.515 -10.396 557 HD2 LYS 75 2HD LYS 75 13.518 0.745 -12.666 558 HD3 LYS 75 1HD LYS 75 14.428 2.089 -13.354 559 HE2 LYS 75 2HE LYS 75 16.493 1.245 -12.294 560 HE3 LYS 75 1HE LYS 75 15.589 -0.099 -11.595 561 HZ1 LYS 75 3HZ LYS 75 16.661 0.172 -14.208 562 HZ2 LYS 75 1HZ LYS 75 14.988 -0.104 -14.285 563 HZ3 LYS 75 2HZ LYS 75 15.991 -1.197 -13.458 564 H THR 76 H THR 76 12.562 6.414 -10.466 565 HA THR 76 HA THR 76 10.003 7.027 -9.564 566 HB THR 76 HB THR 76 11.516 8.430 -11.796 567 HG1 THR 76 1HG THR 76 11.997 8.103 -9.135 568 HG21 THR 76 3HG2 THR 76 9.449 9.416 -9.795 569 HG22 THR 76 1HG2 THR 76 9.215 9.260 -11.537 570 HG23 THR 76 2HG2 THR 76 10.354 10.445 -10.903 571 H ASN 77 H ASN 77 8.003 6.716 -10.336 572 HA ASN 77 HA ASN 77 6.276 6.024 -11.659 573 HB2 ASN 77 2HB ASN 77 7.968 7.317 -13.811 574 HB3 ASN 77 1HB ASN 77 6.261 6.912 -13.961 575 HD21 ASN 77 1HD2 ASN 77 7.801 9.610 -13.822 576 HD22 ASN 77 2HD2 ASN 77 6.940 10.483 -12.650 577 H ASP 78 H ASP 78 7.205 3.778 -11.133 578 HA ASP 78 HA ASP 78 7.170 2.200 -13.550 579 HB2 ASP 78 2HB ASP 78 9.518 2.964 -13.557 580 HB3 ASP 78 1HB ASP 78 9.729 2.301 -11.948 581 H LEU 79 H LEU 79 8.879 1.463 -10.518 582 HA LEU 79 HA LEU 79 6.606 0.131 -9.326 583 HB2 LEU 79 2HB LEU 79 7.118 -2.140 -9.643 584 HB3 LEU 79 1HB LEU 79 7.579 -1.470 -11.201 585 HG LEU 79 HG LEU 79 9.519 -2.084 -8.919 586 HD11 LEU 79 1HD1 LEU 79 8.591 -4.114 -9.919 587 HD12 LEU 79 2HD1 LEU 79 10.286 -3.919 -10.355 588 HD13 LEU 79 3HD1 LEU 79 9.024 -3.537 -11.528 589 HD21 LEU 79 3HD2 LEU 79 10.248 -0.207 -10.408 590 HD22 LEU 79 1HD2 LEU 79 10.031 -1.256 -11.803 591 HD23 LEU 79 2HD2 LEU 79 11.264 -1.627 -10.602 592 H ILE 80 H ILE 80 7.092 -0.848 -7.276 593 HA ILE 80 HA ILE 80 9.647 -0.003 -5.995 594 HB ILE 80 HB ILE 80 6.889 0.423 -4.763 595 HG12 ILE 80 2HG1 ILE 80 8.897 2.480 -5.778 596 HG13 ILE 80 1HG1 ILE 80 7.423 2.038 -6.617 597 HG21 ILE 80 1HG2 ILE 80 9.700 1.114 -3.801 598 HG22 ILE 80 2HG2 ILE 80 8.643 -0.104 -3.093 599 HG23 ILE 80 3HG2 ILE 80 8.219 1.591 -2.978 600 HD11 ILE 80 3HD1 ILE 80 7.580 3.309 -3.873 601 HD12 ILE 80 1HD1 ILE 80 6.092 2.777 -4.656 602 HD13 ILE 80 2HD1 ILE 80 7.042 4.086 -5.359 603 H GLU 81 H GLU 81 10.485 -1.536 -4.648 604 HA GLU 81 HA GLU 81 8.800 -3.678 -3.547 605 HB2 GLU 81 2HB GLU 81 10.361 -5.434 -4.452 606 HB3 GLU 81 1HB GLU 81 9.409 -4.634 -5.702 607 HG2 GLU 81 2HG GLU 81 11.303 -3.160 -6.242 608 HG3 GLU 81 1HG GLU 81 12.269 -3.912 -4.977 609 H TYR 82 H TYR 82 9.864 -4.856 -1.873 610 HA TYR 82 HA TYR 82 12.522 -4.088 -0.981 611 HB2 TYR 82 2HB TYR 82 11.818 -3.113 1.149 612 HB3 TYR 82 1HB TYR 82 11.146 -2.176 -0.182 613 HD1 TYR 82 2HD TYR 82 8.719 -2.272 -0.716 614 HD2 TYR 82 1HD TYR 82 10.361 -4.511 2.572 615 HE1 TYR 82 2HE TYR 82 6.437 -2.659 0.168 616 HE2 TYR 82 1HE TYR 82 8.079 -4.895 3.448 617 HH TYR 82 HH TYR 82 5.895 -4.686 3.041 618 H THR 83 H THR 83 13.186 -5.315 0.916 619 HA THR 83 HA THR 83 11.788 -7.932 1.123 620 HB THR 83 HB THR 83 14.622 -7.157 1.933 621 HG1 THR 83 1HG THR 83 14.794 -7.156 -0.169 622 HG21 THR 83 3HG2 THR 83 13.242 -9.850 1.624 623 HG22 THR 83 1HG2 THR 83 13.772 -9.127 3.144 624 HG23 THR 83 2HG2 THR 83 14.961 -9.623 1.942 625 H ILE 84 H ILE 84 10.799 -8.458 2.993 626 HA ILE 84 HA ILE 84 10.938 -6.618 5.287 627 HB ILE 84 HB ILE 84 8.749 -7.301 4.277 628 HG12 ILE 84 2HG1 ILE 84 9.001 -8.366 7.119 629 HG13 ILE 84 1HG1 ILE 84 9.023 -6.648 6.751 630 HG21 ILE 84 1HG2 ILE 84 9.331 -9.596 3.645 631 HG22 ILE 84 2HG2 ILE 84 7.891 -9.559 4.658 632 HG23 ILE 84 3HG2 ILE 84 9.429 -10.047 5.342 633 HD11 ILE 84 3HD1 ILE 84 6.772 -7.471 7.411 634 HD12 ILE 84 1HD1 ILE 84 6.768 -8.530 6.005 635 HD13 ILE 84 2HD1 ILE 84 6.793 -6.782 5.788 636 H GLY 85 H GLY 85 10.896 -7.684 7.482 637 HA2 GLY 85 2HA GLY 85 13.206 -9.252 7.891 638 HA3 GLY 85 1HA GLY 85 11.948 -8.950 9.087 639 H ASP 86 H ASP 86 9.734 -10.143 7.623 640 HA ASP 86 HA ASP 86 10.012 -12.841 8.410 641 HB2 ASP 86 2HB ASP 86 8.006 -11.563 6.515 642 HB3 ASP 86 1HB ASP 86 7.855 -13.170 7.209 643 H GLY 87 H GLY 87 11.050 -11.171 5.604 644 HA2 GLY 87 2HA GLY 87 12.422 -11.979 3.904 645 HA3 GLY 87 1HA GLY 87 12.124 -13.628 4.442 646 H ARG 88 H ARG 88 9.247 -11.794 4.056 647 HA ARG 88 HA ARG 88 8.441 -13.438 1.777 648 HB2 ARG 88 2HB ARG 88 6.986 -11.150 3.141 649 HB3 ARG 88 1HB ARG 88 6.292 -12.256 1.964 650 HG2 ARG 88 2HG ARG 88 6.720 -14.159 3.464 651 HG3 ARG 88 1HG ARG 88 7.450 -13.075 4.650 652 HD2 ARG 88 2HD ARG 88 4.582 -12.840 3.673 653 HD3 ARG 88 1HD ARG 88 5.060 -13.635 5.171 654 HE ARG 88 HE ARG 88 6.158 -11.033 5.145 655 HH11 ARG 88 1HH2 ARG 88 3.106 -12.678 5.345 656 HH12 ARG 88 2HH2 ARG 88 2.336 -11.419 6.250 657 HH21 ARG 88 1HH1 ARG 88 5.140 -9.390 6.332 658 HH22 ARG 88 2HH1 ARG 88 3.486 -9.562 6.807 659 H LYS 89 H LYS 89 7.958 -12.671 -0.312 660 HA LYS 89 HA LYS 89 9.577 -10.394 -1.175 661 HB2 LYS 89 2HB LYS 89 8.850 -11.086 -3.442 662 HB3 LYS 89 1HB LYS 89 9.657 -12.372 -2.546 663 HG2 LYS 89 2HG LYS 89 7.646 -13.595 -2.175 664 HG3 LYS 89 1HG LYS 89 6.614 -12.197 -2.421 665 HD2 LYS 89 2HD LYS 89 6.430 -13.670 -4.339 666 HD3 LYS 89 1HD LYS 89 7.214 -12.157 -4.811 667 HE2 LYS 89 2HE LYS 89 8.321 -14.250 -5.746 668 HE3 LYS 89 1HE LYS 89 9.404 -13.217 -4.818 669 HZ1 LYS 89 3HZ LYS 89 9.213 -14.639 -2.945 670 HZ2 LYS 89 1HZ LYS 89 9.541 -15.630 -4.283 671 HZ3 LYS 89 2HZ LYS 89 7.962 -15.537 -3.664 672 H VAL 90 H VAL 90 8.741 -8.644 -2.378 673 HA VAL 90 HA VAL 90 5.841 -8.134 -2.327 674 HB VAL 90 HB VAL 90 7.824 -6.148 -1.125 675 HG11 VAL 90 1HG1 VAL 90 5.920 -5.040 -2.202 676 HG12 VAL 90 2HG1 VAL 90 5.698 -4.963 -0.458 677 HG13 VAL 90 3HG1 VAL 90 4.783 -6.131 -1.409 678 HG21 VAL 90 3HG2 VAL 90 5.821 -8.028 0.202 679 HG22 VAL 90 1HG2 VAL 90 6.567 -6.660 1.028 680 HG23 VAL 90 2HG2 VAL 90 7.567 -7.985 0.449 681 H ARG 91 H ARG 91 5.228 -7.185 -4.177 682 HA ARG 91 HA ARG 91 7.149 -5.568 -5.765 683 HB2 ARG 91 2HB ARG 91 7.121 -7.906 -6.667 684 HB3 ARG 91 1HB ARG 91 5.383 -7.766 -6.920 685 HG2 ARG 91 2HG ARG 91 5.736 -5.879 -8.471 686 HG3 ARG 91 1HG ARG 91 7.474 -5.951 -8.182 687 HD2 ARG 91 2HD ARG 91 5.813 -8.207 -9.356 688 HD3 ARG 91 1HD ARG 91 6.809 -7.094 -10.295 689 HE ARG 91 HE ARG 91 8.447 -8.224 -8.319 690 HH11 ARG 91 1HH2 ARG 91 6.634 -9.200 -11.121 691 HH12 ARG 91 2HH2 ARG 91 7.682 -10.526 -11.496 692 HH21 ARG 91 1HH1 ARG 91 9.809 -9.958 -8.822 693 HH22 ARG 91 2HH1 ARG 91 9.473 -10.953 -10.199 694 H ILE 92 H ILE 92 6.232 -3.645 -6.154 695 HA ILE 92 HA ILE 92 3.260 -3.436 -6.446 696 HB ILE 92 HB ILE 92 5.157 -1.361 -5.263 697 HG12 ILE 92 2HG1 ILE 92 3.074 -3.095 -3.854 698 HG13 ILE 92 1HG1 ILE 92 4.807 -3.388 -3.789 699 HG21 ILE 92 1HG2 ILE 92 2.121 -1.451 -5.502 700 HG22 ILE 92 2HG2 ILE 92 3.187 -0.384 -6.409 701 HG23 ILE 92 3HG2 ILE 92 3.030 -0.190 -4.673 702 HD11 ILE 92 3HD1 ILE 92 3.362 -0.937 -2.756 703 HD12 ILE 92 1HD1 ILE 92 5.117 -1.100 -2.816 704 HD13 ILE 92 2HD1 ILE 92 4.166 -2.178 -1.796 705 H VAL 93 H VAL 93 2.864 -3.072 -8.542 706 HA VAL 93 HA VAL 93 4.687 -1.312 -10.123 707 HB VAL 93 HB VAL 93 4.726 -3.678 -10.842 708 HG11 VAL 93 1HG1 VAL 93 1.791 -3.341 -11.565 709 HG12 VAL 93 2HG1 VAL 93 2.351 -4.214 -10.139 710 HG13 VAL 93 3HG1 VAL 93 2.773 -4.789 -11.751 711 HG21 VAL 93 3HG2 VAL 93 4.313 -3.264 -13.226 712 HG22 VAL 93 1HG2 VAL 93 5.022 -1.823 -12.501 713 HG23 VAL 93 2HG2 VAL 93 3.293 -1.882 -12.842 714 H PHE 94 H PHE 94 3.828 0.439 -10.991 715 HA PHE 94 HA PHE 94 0.925 0.980 -10.691 716 HB2 PHE 94 2HB PHE 94 3.260 2.784 -11.398 717 HB3 PHE 94 1HB PHE 94 1.594 3.307 -11.134 718 HD1 PHE 94 1HD PHE 94 4.583 1.775 -9.504 719 HD2 PHE 94 2HD PHE 94 0.707 3.535 -8.871 720 HE1 PHE 94 1HE PHE 94 5.019 1.885 -7.072 721 HE2 PHE 94 2HE PHE 94 1.154 3.639 -6.441 722 HZ PHE 94 HZ PHE 94 3.310 2.814 -5.539 723 H THR 95 H THR 95 -0.212 0.276 -12.417 724 HA THR 95 HA THR 95 0.907 0.446 -15.154 725 HB THR 95 HB THR 95 -1.633 -0.880 -14.131 726 HG1 THR 95 1HG THR 95 0.152 -1.906 -13.304 727 HG21 THR 95 3HG2 THR 95 -1.511 -2.089 -16.315 728 HG22 THR 95 1HG2 THR 95 -0.165 -1.058 -16.788 729 HG23 THR 95 2HG2 THR 95 -1.763 -0.360 -16.530 730 H HIS 96 H HIS 96 0.360 2.137 -16.376 731 HA HIS 96 HA HIS 96 -1.961 3.835 -15.658 732 HB2 HIS 96 2HB HIS 96 0.286 4.914 -15.823 733 HB3 HIS 96 1HB HIS 96 0.374 4.427 -17.515 734 HD2 HIS 96 2HD HIS 96 -2.597 6.255 -15.560 735 HE1 HIS 96 1HE HIS 96 -1.753 8.377 -19.109 736 HE2 HIS 96 2HE HIS 96 -3.257 8.283 -17.065 737 H THR 97 H THR 97 -3.498 4.358 -17.167 738 HA THR 97 HA THR 97 -3.437 3.134 -19.853 739 HB THR 97 HB THR 97 -5.691 2.658 -17.867 740 HG1 THR 97 1HG THR 97 -3.923 1.450 -17.297 741 HG21 THR 97 3HG2 THR 97 -5.171 1.591 -20.666 742 HG22 THR 97 1HG2 THR 97 -6.462 2.700 -20.200 743 HG23 THR 97 2HG2 THR 97 -6.461 1.045 -19.597 744 H GLY 98 H GLY 98 -3.506 5.094 -20.870 745 HA2 GLY 98 2HA GLY 98 -4.383 7.040 -21.713 746 HA3 GLY 98 1HA GLY 98 -5.953 6.358 -21.310 747 H ASP 99 H ASP 99 -7.008 7.000 -19.458 748 HA ASP 99 HA ASP 99 -5.773 9.145 -17.788 749 HB2 ASP 99 2HB ASP 99 -7.340 10.082 -19.484 750 HB3 ASP 99 1HB ASP 99 -8.627 9.078 -18.827 751 H THR 100 H THR 100 -5.672 6.544 -16.969 752 HA THR 100 HA THR 100 -7.199 6.642 -14.508 753 HB THR 100 HB THR 100 -7.688 4.320 -16.422 754 HG1 THR 100 1HG THR 100 -9.187 6.599 -15.721 755 HG21 THR 100 3HG2 THR 100 -7.774 3.653 -14.057 756 HG22 THR 100 1HG2 THR 100 -9.400 3.689 -14.730 757 HG23 THR 100 2HG2 THR 100 -8.848 5.004 -13.696 758 H THR 101 H THR 101 -5.708 6.068 -13.024 759 HA THR 101 HA THR 101 -3.454 4.323 -13.798 760 HB THR 101 HB THR 101 -3.880 5.891 -11.226 761 HG1 THR 101 1HG THR 101 -3.517 6.837 -13.578 762 HG21 THR 101 3HG2 THR 101 -1.416 5.598 -11.036 763 HG22 THR 101 1HG2 THR 101 -1.427 4.583 -12.467 764 HG23 THR 101 2HG2 THR 101 -2.250 4.055 -11.001 765 H ASN 102 H ASN 102 -3.069 2.380 -12.871 766 HA ASN 102 HA ASN 102 -5.012 1.289 -10.885 767 HB2 ASN 102 2HB ASN 102 -3.812 -0.140 -13.282 768 HB3 ASN 102 1HB ASN 102 -4.897 -0.846 -12.083 769 HD21 ASN 102 1HD2 ASN 102 -6.572 1.629 -11.889 770 HD22 ASN 102 2HD2 ASN 102 -7.468 1.689 -13.327 771 H ILE 103 H ILE 103 -4.064 0.457 -9.148 772 HA ILE 103 HA ILE 103 -1.108 0.067 -9.082 773 HB ILE 103 HB ILE 103 -3.092 0.287 -6.780 774 HG12 ILE 103 2HG1 ILE 103 -1.164 2.423 -7.779 775 HG13 ILE 103 1HG1 ILE 103 -2.877 2.411 -8.168 776 HG21 ILE 103 1HG2 ILE 103 -0.052 0.342 -6.863 777 HG22 ILE 103 2HG2 ILE 103 -1.048 -0.936 -6.171 778 HG23 ILE 103 3HG2 ILE 103 -1.016 0.652 -5.420 779 HD11 ILE 103 3HD1 ILE 103 -1.685 2.600 -5.388 780 HD12 ILE 103 1HD1 ILE 103 -3.414 2.465 -5.732 781 HD13 ILE 103 2HD1 ILE 103 -2.510 3.884 -6.269 782 H VAL 104 H VAL 104 -0.379 -2.007 -9.066 783 HA VAL 104 HA VAL 104 -2.203 -4.205 -8.172 784 HB VAL 104 HB VAL 104 -0.101 -4.310 -10.367 785 HG11 VAL 104 1HG1 VAL 104 -2.150 -6.341 -9.403 786 HG12 VAL 104 2HG1 VAL 104 -0.399 -6.477 -9.248 787 HG13 VAL 104 3HG1 VAL 104 -1.146 -6.536 -10.840 788 HG21 VAL 104 3HG2 VAL 104 -2.044 -2.950 -11.047 789 HG22 VAL 104 1HG2 VAL 104 -3.135 -4.240 -10.540 790 HG23 VAL 104 2HG2 VAL 104 -2.044 -4.489 -11.903 791 H GLU 105 H GLU 105 -1.424 -5.341 -6.528 792 HA GLU 105 HA GLU 105 1.478 -5.602 -6.069 793 HB2 GLU 105 2HB GLU 105 1.169 -5.044 -3.660 794 HB3 GLU 105 1HB GLU 105 0.846 -3.671 -4.716 795 HG2 GLU 105 2HG GLU 105 -1.579 -4.112 -4.563 796 HG3 GLU 105 1HG GLU 105 -1.270 -5.482 -3.506 797 H SER 106 H SER 106 2.076 -7.462 -5.066 798 HA SER 106 HA SER 106 -0.018 -9.389 -4.194 799 HB2 SER 106 2HB SER 106 0.585 -9.961 -6.506 800 HB3 SER 106 1HB SER 106 2.292 -9.969 -6.074 801 HG SER 106 HG SER 106 0.467 -11.913 -5.807 802 H PHE 107 H PHE 107 0.555 -10.697 -2.536 803 HA PHE 107 HA PHE 107 3.287 -10.420 -1.352 804 HB2 PHE 107 2HB PHE 107 0.616 -10.525 0.101 805 HB3 PHE 107 1HB PHE 107 2.206 -10.450 0.859 806 HD1 PHE 107 2HD PHE 107 -0.290 -8.563 -1.146 807 HD2 PHE 107 1HD PHE 107 3.501 -8.355 0.879 808 HE1 PHE 107 2HE PHE 107 -0.317 -6.093 -1.332 809 HE2 PHE 107 1HE PHE 107 3.467 -5.884 0.680 810 HZ PHE 107 HZ PHE 107 1.558 -4.755 -0.424 811 H ASP 108 H ASP 108 3.677 -12.170 0.248 812 HA ASP 108 HA ASP 108 2.408 -14.781 -0.469 813 HB2 ASP 108 2HB ASP 108 5.372 -14.225 -0.171 814 HB3 ASP 108 1HB ASP 108 4.642 -15.812 -0.417 815 HA PRO 109 HA PRO 109 2.453 -14.010 4.148 816 HB2 PRO 109 2HB PRO 109 -0.068 -15.654 3.851 817 HB3 PRO 109 1HB PRO 109 0.209 -14.195 4.835 818 HG2 PRO 109 2HG PRO 109 -1.186 -14.004 2.581 819 HG3 PRO 109 1HG PRO 109 0.029 -12.761 2.969 820 HD2 PRO 109 2HD PRO 109 0.309 -15.112 1.062 821 HD3 PRO 109 1HD PRO 109 0.780 -13.414 0.820 822 H GLU 110 H GLU 110 2.406 -15.691 5.912 823 HA GLU 110 HA GLU 110 4.131 -17.848 5.318 824 HB2 GLU 110 2HB GLU 110 2.314 -17.455 7.719 825 HB3 GLU 110 1HB GLU 110 3.661 -18.590 7.636 826 HG2 GLU 110 2HG GLU 110 3.938 -15.579 7.298 827 HG3 GLU 110 1HG GLU 110 4.251 -16.441 8.799 828 H GLU 111 H GLU 111 3.589 -20.130 5.906 829 HA GLU 111 HA GLU 111 1.362 -21.040 4.245 830 HB2 GLU 111 2HB GLU 111 3.402 -22.620 5.846 831 HB3 GLU 111 1HB GLU 111 2.289 -23.284 4.649 832 HG2 GLU 111 2HG GLU 111 4.392 -21.167 4.045 833 HG3 GLU 111 1HG GLU 111 4.595 -22.884 3.731 834 H THR 112 H THR 112 2.305 -21.286 7.665 835 HA THR 112 HA THR 112 0.072 -22.823 8.510 836 HB THR 112 HB THR 112 2.068 -22.706 9.885 837 HG1 THR 112 1HG THR 112 0.386 -23.035 11.173 838 HG21 THR 112 3HG2 THR 112 2.789 -20.654 10.990 839 HG22 THR 112 1HG2 THR 112 1.438 -19.764 10.297 840 HG23 THR 112 2HG2 THR 112 2.727 -20.362 9.254 841 H ASN 113 H ASN 113 0.588 -19.336 8.217 842 HA ASN 113 HA ASN 113 -1.731 -18.539 9.638 843 HB2 ASN 113 2HB ASN 113 -0.137 -17.129 7.483 844 HB3 ASN 113 1HB ASN 113 -1.397 -16.352 8.440 845 HD21 ASN 113 1HD2 ASN 113 1.231 -15.359 8.569 846 HD22 ASN 113 2HD2 ASN 113 1.892 -15.710 10.093 847 HA PRO 114 HA PRO 114 -4.819 -19.501 6.508 848 HB2 PRO 114 2HB PRO 114 -6.909 -17.890 7.241 849 HB3 PRO 114 1HB PRO 114 -6.380 -19.248 8.262 850 HG2 PRO 114 2HG PRO 114 -5.631 -16.339 8.503 851 HG3 PRO 114 1HG PRO 114 -6.237 -17.425 9.767 852 HD2 PRO 114 2HD PRO 114 -3.574 -16.937 9.502 853 HD3 PRO 114 1HD PRO 114 -4.163 -18.555 9.959 854 H ARG 115 H ARG 115 -4.634 -18.917 4.423 855 HA ARG 115 HA ARG 115 -3.734 -16.378 3.517 856 HB2 ARG 115 2HB ARG 115 -5.087 -18.654 2.033 857 HB3 ARG 115 1HB ARG 115 -4.300 -17.280 1.252 858 HG2 ARG 115 2HG ARG 115 -2.162 -17.886 2.350 859 HG3 ARG 115 1HG ARG 115 -2.948 -19.272 3.108 860 HD2 ARG 115 2HD ARG 115 -2.728 -18.827 0.114 861 HD3 ARG 115 1HD ARG 115 -1.700 -19.909 1.045 862 HE ARG 115 HE ARG 115 -4.391 -20.432 0.169 863 HH11 ARG 115 1HH2 ARG 115 -2.071 -21.056 2.675 864 HH12 ARG 115 2HH2 ARG 115 -2.800 -22.549 3.163 865 HH21 ARG 115 1HH1 ARG 115 -5.340 -22.388 0.808 866 HH22 ARG 115 2HH1 ARG 115 -4.650 -23.302 2.108 867 H GLU 116 H GLU 116 -6.967 -17.854 3.706 868 HA GLU 116 HA GLU 116 -8.430 -16.012 2.240 869 HB2 GLU 116 2HB GLU 116 -9.249 -17.487 4.762 870 HB3 GLU 116 1HB GLU 116 -10.365 -16.721 3.631 871 HG2 GLU 116 2HG GLU 116 -9.575 -18.197 1.827 872 HG3 GLU 116 1HG GLU 116 -8.432 -18.956 2.932 873 H LEU 117 H LEU 117 -7.548 -15.854 5.694 874 HA LEU 117 HA LEU 117 -8.976 -13.520 6.338 875 HB2 LEU 117 2HB LEU 117 -7.730 -15.221 7.876 876 HB3 LEU 117 1HB LEU 117 -6.293 -14.265 7.544 877 HG LEU 117 HG LEU 117 -7.876 -12.210 8.298 878 HD11 LEU 117 1HD1 LEU 117 -9.454 -12.836 10.071 879 HD12 LEU 117 2HD1 LEU 117 -9.094 -14.544 9.822 880 HD13 LEU 117 3HD1 LEU 117 -9.912 -13.623 8.565 881 HD21 LEU 117 3HD2 LEU 117 -5.794 -12.841 9.457 882 HD22 LEU 117 1HD2 LEU 117 -6.636 -14.148 10.288 883 HD23 LEU 117 2HD2 LEU 117 -7.053 -12.468 10.630 884 H GLN 118 H GLN 118 -5.666 -13.972 5.149 885 HA GLN 118 HA GLN 118 -4.863 -11.254 5.263 886 HB2 GLN 118 2HB GLN 118 -3.911 -13.486 3.438 887 HB3 GLN 118 1HB GLN 118 -3.061 -11.963 3.714 888 HG2 GLN 118 2HG GLN 118 -3.744 -13.951 5.915 889 HG3 GLN 118 1HG GLN 118 -2.189 -13.880 5.101 890 HE21 GLN 118 1HE2 GLN 118 -0.761 -12.101 5.605 891 HE22 GLN 118 2HE2 GLN 118 -1.071 -11.037 6.889 892 H GLN 119 H GLN 119 -6.324 -13.209 2.666 893 HA GLN 119 HA GLN 119 -6.179 -11.359 0.592 894 HB2 GLN 119 2HB GLN 119 -6.939 -13.733 0.387 895 HB3 GLN 119 1HB GLN 119 -8.462 -13.287 1.149 896 HG2 GLN 119 2HG GLN 119 -8.921 -11.697 -0.701 897 HG3 GLN 119 1HG GLN 119 -7.387 -12.133 -1.452 898 HE21 GLN 119 1HE2 GLN 119 -7.636 -13.666 -3.080 899 HE22 GLN 119 2HE2 GLN 119 -8.844 -14.858 -3.120 900 H SER 120 H SER 120 -8.652 -11.709 3.122 901 HA SER 120 HA SER 120 -10.300 -9.558 2.195 902 HB2 SER 120 2HB SER 120 -11.343 -9.704 4.430 903 HB3 SER 120 1HB SER 120 -11.174 -11.296 3.695 904 HG SER 120 HG SER 120 -9.861 -11.836 5.239 905 H GLY 121 H GLY 121 -7.544 -9.833 4.409 906 HA2 GLY 121 2HA GLY 121 -7.700 -7.255 5.563 907 HA3 GLY 121 1HA GLY 121 -6.244 -8.235 5.436 908 H TRP 122 H TRP 122 -5.729 -8.410 2.799 909 HA TRP 122 HA TRP 122 -4.655 -5.858 2.152 910 HB2 TRP 122 2HB TRP 122 -5.035 -8.342 0.435 911 HB3 TRP 122 1HB TRP 122 -4.095 -6.934 -0.055 912 HD1 TRP 122 HD TRP 122 -3.669 -10.171 1.677 913 HE1 TRP 122 1HE TRP 122 -1.421 -10.252 2.923 914 HE3 TRP 122 3HE TRP 122 -2.366 -5.225 1.495 915 HZ2 TRP 122 2HZ TRP 122 0.656 -8.473 3.736 916 HZ3 TRP 122 3HZ TRP 122 -0.242 -4.454 2.515 917 HH2 TRP 122 HH TRP 122 1.269 -6.072 3.632 918 H GLN 123 H GLN 123 -7.584 -7.550 1.121 919 HA GLN 123 HA GLN 123 -8.296 -5.641 -0.915 920 HB2 GLN 123 2HB GLN 123 -9.100 -8.009 -0.860 921 HB3 GLN 123 1HB GLN 123 -10.082 -7.619 0.552 922 HG2 GLN 123 2HG GLN 123 -11.328 -5.936 -0.763 923 HG3 GLN 123 1HG GLN 123 -10.319 -6.277 -2.168 924 HE21 GLN 123 1HE2 GLN 123 -12.443 -6.876 -3.243 925 HE22 GLN 123 2HE2 GLN 123 -13.072 -8.431 -2.977 926 H ALA 124 H ALA 124 -9.068 -6.055 2.520 927 HA ALA 124 HA ALA 124 -11.154 -4.198 2.747 928 HB1 ALA 124 1HB ALA 124 -9.036 -4.925 4.779 929 HB2 ALA 124 2HB ALA 124 -10.589 -5.735 4.557 930 HB3 ALA 124 3HB ALA 124 -10.541 -4.078 5.148 931 H ILE 125 H ILE 125 -7.666 -3.644 3.321 932 HA ILE 125 HA ILE 125 -7.908 -0.898 3.886 933 HB ILE 125 HB ILE 125 -5.924 -2.157 4.488 934 HG12 ILE 125 2HG1 ILE 125 -5.121 -0.125 2.353 935 HG13 ILE 125 1HG1 ILE 125 -5.704 0.326 3.954 936 HG21 ILE 125 1HG2 ILE 125 -5.926 -3.737 2.610 937 HG22 ILE 125 2HG2 ILE 125 -4.348 -2.994 2.792 938 HG23 ILE 125 3HG2 ILE 125 -5.426 -2.456 1.510 939 HD11 ILE 125 3HD1 ILE 125 -3.843 -0.953 4.978 940 HD12 ILE 125 1HD1 ILE 125 -3.250 0.319 3.911 941 HD13 ILE 125 2HD1 ILE 125 -3.248 -1.358 3.370 942 H LEU 126 H LEU 126 -7.561 -2.647 0.833 943 HA LEU 126 HA LEU 126 -7.126 -0.374 -0.830 944 HB2 LEU 126 2HB LEU 126 -8.134 -3.188 -1.312 945 HB3 LEU 126 1HB LEU 126 -8.045 -2.040 -2.642 946 HG LEU 126 HG LEU 126 -5.681 -2.822 -0.889 947 HD11 LEU 126 1HD1 LEU 126 -4.925 -4.085 -2.918 948 HD12 LEU 126 2HD1 LEU 126 -6.499 -3.780 -3.651 949 HD13 LEU 126 3HD1 LEU 126 -6.381 -4.739 -2.173 950 HD21 LEU 126 3HD2 LEU 126 -4.918 -0.815 -1.750 951 HD22 LEU 126 1HD2 LEU 126 -6.017 -0.832 -3.119 952 HD23 LEU 126 2HD2 LEU 126 -4.545 -1.790 -3.160 953 H ASN 127 H ASN 127 -10.141 -2.191 -0.068 954 HA ASN 127 HA ASN 127 -11.756 -0.348 -1.618 955 HB2 ASN 127 2HB ASN 127 -13.676 -1.607 -0.646 956 HB3 ASN 127 1HB ASN 127 -12.484 -2.640 -1.427 957 HD21 ASN 127 1HD2 ASN 127 -12.516 -4.534 -0.256 958 HD22 ASN 127 2HD2 ASN 127 -12.378 -4.636 1.431 959 H SER 128 H SER 128 -10.868 -0.673 1.764 960 HA SER 128 HA SER 128 -12.748 1.106 2.874 961 HB2 SER 128 2HB SER 128 -9.920 0.473 3.738 962 HB3 SER 128 1HB SER 128 -11.072 1.374 4.717 963 HG SER 128 HG SER 128 -12.401 -0.420 4.747 964 H PHE 129 H PHE 129 -9.574 1.685 1.400 965 HA PHE 129 HA PHE 129 -9.285 4.396 2.024 966 HB2 PHE 129 2HB PHE 129 -7.505 3.001 0.975 967 HB3 PHE 129 1HB PHE 129 -8.401 3.029 -0.543 968 HD1 PHE 129 2HD PHE 129 -6.451 5.082 1.868 969 HD2 PHE 129 1HD PHE 129 -8.524 5.092 -1.906 970 HE1 PHE 129 2HE PHE 129 -5.454 7.284 1.317 971 HE2 PHE 129 1HE PHE 129 -7.522 7.294 -2.446 972 HZ PHE 129 HZ PHE 129 -5.989 8.390 -0.835 973 H LYS 130 H LYS 130 -10.977 2.868 -0.696 974 HA LYS 130 HA LYS 130 -11.656 5.213 -2.106 975 HB2 LYS 130 2HB LYS 130 -13.130 2.571 -1.891 976 HB3 LYS 130 1HB LYS 130 -13.477 3.820 -3.087 977 HG2 LYS 130 2HG LYS 130 -11.211 3.617 -4.010 978 HG3 LYS 130 1HG LYS 130 -10.786 2.442 -2.769 979 HD2 LYS 130 2HD LYS 130 -11.319 1.240 -4.817 980 HD3 LYS 130 1HD LYS 130 -12.574 0.916 -3.629 981 HE2 LYS 130 2HE LYS 130 -13.010 3.192 -5.588 982 HE3 LYS 130 1HE LYS 130 -13.256 1.533 -6.130 983 HZ1 LYS 130 3HZ LYS 130 -15.070 1.292 -4.884 984 HZ2 LYS 130 1HZ LYS 130 -15.107 2.988 -4.869 985 HZ3 LYS 130 2HZ LYS 130 -14.427 2.142 -3.561 986 H SER 131 H SER 131 -13.284 3.540 0.587 987 HA SER 131 HA SER 131 -15.695 4.967 0.545 988 HB2 SER 131 2HB SER 131 -14.234 3.909 2.980 989 HB3 SER 131 1HB SER 131 -15.947 4.297 2.883 990 HG SER 131 HG SER 131 -14.515 2.152 1.839 991 H TYR 132 H TYR 132 -12.660 5.712 2.282 992 HA TYR 132 HA TYR 132 -13.616 8.108 3.500 993 HB2 TYR 132 2HB TYR 132 -10.787 7.205 2.844 994 HB3 TYR 132 1HB TYR 132 -11.173 8.619 3.822 995 HD1 TYR 132 1HD TYR 132 -12.755 8.281 5.857 996 HD2 TYR 132 2HD TYR 132 -10.640 5.048 3.958 997 HE1 TYR 132 1HE TYR 132 -13.037 6.893 7.887 998 HE2 TYR 132 2HE TYR 132 -10.931 3.669 5.992 999 HH TYR 132 HH TYR 132 -11.286 4.167 8.512 1000 H THR 133 H THR 133 -12.021 7.435 0.411 1001 HA THR 133 HA THR 133 -11.481 10.086 -0.369 1002 HB THR 133 HB THR 133 -12.152 7.664 -2.067 1003 HG1 THR 133 1HG THR 133 -10.246 7.072 -1.537 1004 HG21 THR 133 3HG2 THR 133 -12.355 9.621 -3.482 1005 HG22 THR 133 1HG2 THR 133 -10.782 8.891 -3.808 1006 HG23 THR 133 2HG2 THR 133 -10.887 10.331 -2.797 1007 H GLU 134 H GLU 134 -14.330 8.044 -1.009 1008 HA GLU 134 HA GLU 134 -15.755 10.075 -2.451 1009 HB2 GLU 134 2HB GLU 134 -16.707 7.547 -1.080 1010 HB3 GLU 134 1HB GLU 134 -17.682 8.516 -2.181 1011 HG2 GLU 134 2HG GLU 134 -15.042 7.200 -2.922 1012 HG3 GLU 134 1HG GLU 134 -16.626 6.533 -3.298 1013 H ASN 135 H ASN 135 -15.804 8.932 0.915 1014 HA ASN 135 HA ASN 135 -17.965 10.580 1.772 1015 HB2 ASN 135 2HB ASN 135 -15.687 9.417 3.398 1016 HB3 ASN 135 1HB ASN 135 -17.193 10.063 4.049 1017 HD21 ASN 135 1HD2 ASN 135 -18.858 8.910 1.857 1018 HD22 ASN 135 2HD2 ASN 135 -18.911 7.241 2.149 1019 H ASN 136 H ASN 136 -14.578 11.214 1.228 1020 HA ASN 136 HA ASN 136 -14.218 13.443 2.926 1021 HB2 ASN 136 2HB ASN 136 -12.358 12.295 1.770 1022 HB3 ASN 136 1HB ASN 136 -12.950 12.893 0.226 1023 HD21 ASN 136 1HD2 ASN 136 -10.678 13.539 2.579 1024 HD22 ASN 136 2HD2 ASN 136 -10.482 15.204 2.316 1025 H LEU 137 H LEU 137 -15.462 13.190 -0.392 1026 HA LEU 137 HA LEU 137 -16.527 14.704 -1.769 1027 HB2 LEU 137 2HB LEU 137 -17.455 15.833 0.889 1028 HB3 LEU 137 1HB LEU 137 -18.222 16.118 -0.670 1029 HG LEU 137 HG LEU 137 -17.929 13.348 0.580 1030 HD11 LEU 137 1HD1 LEU 137 -19.383 14.786 1.972 1031 HD12 LEU 137 2HD1 LEU 137 -20.332 13.545 1.155 1032 HD13 LEU 137 3HD1 LEU 137 -20.341 15.204 0.551 1033 HD21 LEU 137 3HD2 LEU 137 -19.817 12.827 -1.093 1034 HD22 LEU 137 1HD2 LEU 137 -18.247 13.137 -1.813 1035 HD23 LEU 137 2HD2 LEU 137 -19.482 14.389 -1.832 1036 H GLU 138 H GLU 138 -14.992 15.905 -2.804 1037 HA GLU 138 HA GLU 138 -14.586 18.650 -1.944 1038 HB2 GLU 138 2HB GLU 138 -12.861 17.389 -0.637 1039 HB3 GLU 138 1HB GLU 138 -12.177 16.794 -2.147 1040 HG2 GLU 138 2HG GLU 138 -11.699 19.111 -2.856 1041 HG3 GLU 138 1HG GLU 138 -12.431 19.724 -1.377 1042 H HIS 139 H HIS 139 -14.506 19.886 -3.732 1043 HA HIS 139 HA HIS 139 -14.593 18.732 -6.355 1044 HB2 HIS 139 2HB HIS 139 -14.199 21.627 -5.516 1045 HB3 HIS 139 1HB HIS 139 -14.654 21.067 -7.126 1046 HD2 HIS 139 2HD HIS 139 -16.373 22.070 -3.868 1047 HE1 HIS 139 1HE HIS 139 -19.227 19.843 -6.041 1048 HE2 HIS 139 2HE HIS 139 -18.883 21.366 -4.038 1049 H HIS 140 H HIS 140 -13.048 18.731 -7.971 1050 HA HIS 140 HA HIS 140 -10.325 18.478 -7.199 1051 HB2 HIS 140 2HB HIS 140 -11.499 18.868 -9.975 1052 HB3 HIS 140 1HB HIS 140 -9.878 18.277 -9.613 1053 HD2 HIS 140 2HD HIS 140 -13.439 16.881 -10.004 1054 HE1 HIS 140 1HE HIS 140 -11.162 13.838 -8.164 1055 HE2 HIS 140 2HE HIS 140 -13.376 14.370 -9.290 1056 H HIS 141 H HIS 141 -8.591 19.856 -7.418 1057 HA HIS 141 HA HIS 141 -8.716 22.387 -8.773 1058 HB2 HIS 141 2HB HIS 141 -10.067 22.926 -6.756 1059 HB3 HIS 141 1HB HIS 141 -8.721 22.434 -5.730 1060 HD2 HIS 141 2HD HIS 141 -9.793 25.478 -7.937 1061 HE1 HIS 141 1HE HIS 141 -5.997 26.362 -6.313 1062 HE2 HIS 141 2HE HIS 141 -7.960 27.311 -7.615 1063 H HIS 142 H HIS 142 -6.761 22.073 -9.682 1064 HA HIS 142 HA HIS 142 -4.367 22.259 -8.041 1065 HB2 HIS 142 2HB HIS 142 -3.336 20.206 -8.987 1066 HB3 HIS 142 1HB HIS 142 -4.739 19.835 -7.989 1067 HD2 HIS 142 2HD HIS 142 -7.140 19.202 -9.562 1068 HE1 HIS 142 1HE HIS 142 -4.939 18.311 -13.053 1069 HE2 HIS 142 2HE HIS 142 -7.215 18.131 -11.942 1070 H HIS 143 H HIS 143 -2.407 22.429 -9.450 1071 HA HIS 143 HA HIS 143 -2.843 23.112 -12.272 1072 HB2 HIS 143 2HB HIS 143 -1.877 25.169 -10.256 1073 HB3 HIS 143 1HB HIS 143 -1.920 25.388 -12.006 1074 HD2 HIS 143 2HD HIS 143 -4.303 25.674 -8.972 1075 HE1 HIS 143 1HE HIS 143 -6.678 26.067 -12.442 1076 HE2 HIS 143 2HE HIS 143 -6.661 26.293 -9.912 1077 H HIS 144 H HIS 144 -0.694 22.854 -9.486 1078 HA HIS 144 HA HIS 144 1.582 22.507 -9.309 1079 HB2 HIS 144 2HB HIS 144 2.285 20.421 -10.433 1080 HB3 HIS 144 1HB HIS 144 0.696 20.261 -9.689 1081 HD2 HIS 144 2HD HIS 144 -1.389 19.709 -11.475 1082 HE1 HIS 144 1HE HIS 144 0.875 20.007 -15.026 1083 HE2 HIS 144 2HE HIS 144 -1.384 19.361 -14.063 Start of MODEL 20 1 H1 GLY 1 1HT GLY 1 1.479 -21.805 -4.596 2 H2 GLY 1 2HT GLY 1 1.469 -22.287 -6.226 3 H3 GLY 1 3HT GLY 1 0.007 -22.116 -5.376 4 HA2 GLY 1 2HA GLY 1 1.508 -20.159 -6.792 5 HA3 GLY 1 1HA GLY 1 -0.132 -20.058 -6.150 6 H ASN 2 H ASN 2 -0.320 -19.718 -3.773 7 HA ASN 2 HA ASN 2 0.039 -18.371 -1.952 8 HB2 ASN 2 2HB ASN 2 2.953 -19.069 -2.435 9 HB3 ASN 2 1HB ASN 2 2.251 -18.488 -0.928 10 HD21 ASN 2 1HD2 ASN 2 3.440 -21.241 -2.090 11 HD22 ASN 2 2HD2 ASN 2 2.370 -22.373 -1.416 12 H LYS 3 H LYS 3 -0.074 -17.073 -4.524 13 HA LYS 3 HA LYS 3 1.560 -14.639 -3.988 14 HB2 LYS 3 2HB LYS 3 2.309 -16.027 -6.027 15 HB3 LYS 3 1HB LYS 3 0.787 -15.571 -6.785 16 HG2 LYS 3 2HG LYS 3 1.378 -13.174 -6.528 17 HG3 LYS 3 1HG LYS 3 2.889 -13.630 -5.745 18 HD2 LYS 3 2HD LYS 3 3.591 -14.820 -7.798 19 HD3 LYS 3 1HD LYS 3 2.086 -14.339 -8.585 20 HE2 LYS 3 2HE LYS 3 2.688 -11.959 -8.293 21 HE3 LYS 3 1HE LYS 3 4.194 -12.437 -7.508 22 HZ1 LYS 3 3HZ LYS 3 4.916 -13.499 -9.502 23 HZ2 LYS 3 1HZ LYS 3 4.440 -11.918 -9.890 24 HZ3 LYS 3 2HZ LYS 3 3.420 -13.224 -10.261 25 H ILE 4 H ILE 4 -0.749 -14.632 -2.757 26 HA ILE 4 HA ILE 4 -3.140 -14.051 -3.991 27 HB ILE 4 HB ILE 4 -1.975 -12.571 -1.601 28 HG12 ILE 4 2HG1 ILE 4 -3.735 -15.065 -1.655 29 HG13 ILE 4 1HG1 ILE 4 -1.990 -15.111 -1.423 30 HG21 ILE 4 1HG2 ILE 4 -4.856 -12.983 -2.501 31 HG22 ILE 4 2HG2 ILE 4 -3.991 -11.448 -2.471 32 HG23 ILE 4 3HG2 ILE 4 -4.382 -12.259 -0.970 33 HD11 ILE 4 3HD1 ILE 4 -2.260 -13.630 0.581 34 HD12 ILE 4 1HD1 ILE 4 -3.056 -15.192 0.754 35 HD13 ILE 4 2HD1 ILE 4 -4.007 -13.753 0.391 36 H THR 5 H THR 5 -3.685 -12.629 -5.523 37 HA THR 5 HA THR 5 -2.111 -10.116 -5.879 38 HB THR 5 HB THR 5 -3.764 -11.640 -7.936 39 HG1 THR 5 1HG THR 5 -1.778 -12.338 -8.682 40 HG21 THR 5 3HG2 THR 5 -2.531 -10.185 -9.538 41 HG22 THR 5 1HG2 THR 5 -1.797 -9.332 -8.183 42 HG23 THR 5 2HG2 THR 5 -3.539 -9.239 -8.447 43 H VAL 6 H VAL 6 -3.149 -8.252 -5.642 44 HA VAL 6 HA VAL 6 -6.117 -8.106 -5.802 45 HB VAL 6 HB VAL 6 -6.076 -6.593 -3.801 46 HG11 VAL 6 1HG1 VAL 6 -4.983 -9.385 -3.315 47 HG12 VAL 6 2HG1 VAL 6 -6.680 -8.981 -3.570 48 HG13 VAL 6 3HG1 VAL 6 -5.841 -8.396 -2.134 49 HG21 VAL 6 3HG2 VAL 6 -3.205 -7.584 -3.570 50 HG22 VAL 6 1HG2 VAL 6 -4.059 -6.679 -2.327 51 HG23 VAL 6 2HG2 VAL 6 -3.702 -5.923 -3.876 52 H GLU 7 H GLU 7 -6.900 -6.009 -6.246 53 HA GLU 7 HA GLU 7 -4.998 -3.965 -7.148 54 HB2 GLU 7 2HB GLU 7 -6.136 -3.828 -9.394 55 HB3 GLU 7 1HB GLU 7 -5.184 -5.291 -9.168 56 HG2 GLU 7 2HG GLU 7 -8.191 -5.197 -8.650 57 HG3 GLU 7 1HG GLU 7 -7.500 -5.642 -10.205 58 H VAL 8 H VAL 8 -6.068 -1.941 -7.728 59 HA VAL 8 HA VAL 8 -8.848 -1.605 -6.802 60 HB VAL 8 HB VAL 8 -7.547 -1.258 -4.768 61 HG11 VAL 8 1HG1 VAL 8 -5.949 0.768 -6.348 62 HG12 VAL 8 2HG1 VAL 8 -5.372 -0.795 -5.771 63 HG13 VAL 8 3HG1 VAL 8 -5.803 0.466 -4.617 64 HG21 VAL 8 3HG2 VAL 8 -9.493 0.287 -5.282 65 HG22 VAL 8 1HG2 VAL 8 -8.325 1.476 -5.862 66 HG23 VAL 8 2HG2 VAL 8 -8.304 0.973 -4.175 67 H THR 9 H THR 9 -9.883 0.107 -7.784 68 HA THR 9 HA THR 9 -8.519 1.291 -10.112 69 HB THR 9 HB THR 9 -11.427 1.477 -9.224 70 HG1 THR 9 1HG THR 9 -10.293 -0.631 -9.886 71 HG21 THR 9 3HG2 THR 9 -11.805 2.090 -11.600 72 HG22 THR 9 1HG2 THR 9 -10.063 2.072 -11.873 73 HG23 THR 9 2HG2 THR 9 -10.778 3.266 -10.791 74 H VAL 10 H VAL 10 -7.514 3.202 -9.849 75 HA VAL 10 HA VAL 10 -8.659 5.250 -7.991 76 HB VAL 10 HB VAL 10 -5.717 4.744 -8.593 77 HG11 VAL 10 1HG1 VAL 10 -5.381 6.365 -6.705 78 HG12 VAL 10 2HG1 VAL 10 -7.120 6.655 -6.682 79 HG13 VAL 10 3HG1 VAL 10 -6.169 7.108 -8.095 80 HG21 VAL 10 3HG2 VAL 10 -5.620 3.956 -6.242 81 HG22 VAL 10 1HG2 VAL 10 -6.688 2.945 -7.214 82 HG23 VAL 10 2HG2 VAL 10 -7.369 4.141 -6.112 83 H TYR 11 H TYR 11 -9.169 7.102 -8.952 84 HA TYR 11 HA TYR 11 -8.314 7.627 -11.754 85 HB2 TYR 11 2HB TYR 11 -10.504 8.919 -10.084 86 HB3 TYR 11 1HB TYR 11 -10.186 9.211 -11.797 87 HD1 TYR 11 2HD TYR 11 -10.618 7.432 -13.495 88 HD2 TYR 11 1HD TYR 11 -11.575 6.825 -9.343 89 HE1 TYR 11 2HE TYR 11 -12.010 5.475 -14.097 90 HE2 TYR 11 1HE TYR 11 -12.966 4.871 -9.952 91 HH TYR 11 HH TYR 11 -13.907 3.742 -11.645 92 H ALA 12 H ALA 12 -6.220 8.384 -11.278 93 HA ALA 12 HA ALA 12 -6.039 11.197 -10.765 94 HB1 ALA 12 1HB ALA 12 -4.680 11.095 -8.715 95 HB2 ALA 12 2HB ALA 12 -4.909 9.347 -8.639 96 HB3 ALA 12 3HB ALA 12 -6.285 10.428 -8.428 97 H ALA 13 H ALA 13 -3.926 12.017 -11.185 98 HA ALA 13 HA ALA 13 -2.473 10.550 -13.129 99 HB1 ALA 13 1HB ALA 13 -2.638 13.123 -12.733 100 HB2 ALA 13 2HB ALA 13 -1.096 12.480 -13.285 101 HB3 ALA 13 3HB ALA 13 -1.318 12.903 -11.584 102 H ILE 14 H ILE 14 -0.762 9.171 -12.943 103 HA ILE 14 HA ILE 14 -0.142 7.855 -10.605 104 HB ILE 14 HB ILE 14 0.412 7.052 -12.884 105 HG12 ILE 14 2HG1 ILE 14 2.859 7.130 -11.058 106 HG13 ILE 14 1HG1 ILE 14 1.476 6.073 -10.796 107 HG21 ILE 14 1HG2 ILE 14 2.851 8.885 -12.740 108 HG22 ILE 14 2HG2 ILE 14 1.402 9.280 -13.666 109 HG23 ILE 14 3HG2 ILE 14 2.354 7.860 -14.088 110 HD11 ILE 14 3HD1 ILE 14 3.291 4.921 -11.967 111 HD12 ILE 14 1HD1 ILE 14 3.203 6.085 -13.281 112 HD13 ILE 14 2HD1 ILE 14 1.836 5.021 -12.956 113 H GLU 15 H GLU 15 1.413 10.716 -11.947 114 HA GLU 15 HA GLU 15 3.658 10.815 -10.273 115 HB2 GLU 15 2HB GLU 15 3.655 13.276 -10.811 116 HB3 GLU 15 1HB GLU 15 3.515 12.240 -12.232 117 HG2 GLU 15 2HG GLU 15 1.061 12.568 -12.221 118 HG3 GLU 15 1HG GLU 15 1.208 13.630 -10.828 119 H LYS 16 H LYS 16 0.328 11.843 -9.750 120 HA LYS 16 HA LYS 16 0.860 13.181 -7.252 121 HB2 LYS 16 2HB LYS 16 -1.119 13.567 -8.897 122 HB3 LYS 16 1HB LYS 16 -1.832 12.122 -8.194 123 HG2 LYS 16 2HG LYS 16 -2.790 13.790 -6.813 124 HG3 LYS 16 1HG LYS 16 -1.365 13.376 -5.863 125 HD2 LYS 16 2HD LYS 16 -0.153 15.307 -6.954 126 HD3 LYS 16 1HD LYS 16 -1.643 15.718 -7.792 127 HE2 LYS 16 2HE LYS 16 -2.776 16.040 -5.623 128 HE3 LYS 16 1HE LYS 16 -1.281 15.623 -4.784 129 HZ1 LYS 16 3HZ LYS 16 -0.877 17.637 -6.765 130 HZ2 LYS 16 1HZ LYS 16 -0.466 17.646 -5.118 131 HZ3 LYS 16 2HZ LYS 16 -2.023 18.118 -5.607 132 H VAL 17 H VAL 17 -0.489 10.042 -8.212 133 HA VAL 17 HA VAL 17 -1.028 9.071 -5.614 134 HB VAL 17 HB VAL 17 -0.371 7.503 -8.130 135 HG11 VAL 17 1HG1 VAL 17 -1.820 6.706 -5.576 136 HG12 VAL 17 2HG1 VAL 17 -0.273 6.068 -6.134 137 HG13 VAL 17 3HG1 VAL 17 -1.741 5.718 -7.034 138 HG21 VAL 17 3HG2 VAL 17 -2.830 7.430 -8.429 139 HG22 VAL 17 1HG2 VAL 17 -2.232 9.088 -8.458 140 HG23 VAL 17 2HG2 VAL 17 -3.030 8.464 -7.016 141 H TRP 18 H TRP 18 1.843 8.764 -7.712 142 HA TRP 18 HA TRP 18 3.330 6.991 -6.166 143 HB2 TRP 18 2HB TRP 18 4.024 7.740 -8.406 144 HB3 TRP 18 1HB TRP 18 4.317 9.363 -7.786 145 HD1 TRP 18 HD TRP 18 6.333 9.629 -5.979 146 HE1 TRP 18 1HE TRP 18 8.495 8.259 -5.668 147 HE3 TRP 18 3HE TRP 18 5.111 5.460 -8.647 148 HZ2 TRP 18 2HZ TRP 18 9.564 5.730 -6.459 149 HZ3 TRP 18 3HZ TRP 18 6.717 3.585 -8.856 150 HH2 TRP 18 HH TRP 18 8.940 3.720 -7.763 151 H LYS 19 H LYS 19 3.157 10.527 -5.938 152 HA LYS 19 HA LYS 19 5.026 10.778 -3.780 153 HB2 LYS 19 2HB LYS 19 2.814 12.625 -4.743 154 HB3 LYS 19 1HB LYS 19 4.007 13.070 -3.519 155 HG2 LYS 19 2HG LYS 19 5.829 12.683 -5.130 156 HG3 LYS 19 1HG LYS 19 4.658 12.214 -6.360 157 HD2 LYS 19 2HD LYS 19 3.622 14.472 -6.212 158 HD3 LYS 19 1HD LYS 19 4.836 14.933 -5.017 159 HE2 LYS 19 2HE LYS 19 5.392 14.074 -7.875 160 HE3 LYS 19 1HE LYS 19 5.498 15.721 -7.251 161 HZ1 LYS 19 3HZ LYS 19 7.066 14.529 -5.524 162 HZ2 LYS 19 1HZ LYS 19 7.648 15.093 -7.014 163 HZ3 LYS 19 2HZ LYS 19 7.278 13.446 -6.816 164 H TYR 20 H TYR 20 1.450 10.630 -3.896 165 HA TYR 20 HA TYR 20 1.066 10.938 -1.106 166 HB2 TYR 20 2HB TYR 20 -0.700 11.307 -2.802 167 HB3 TYR 20 1HB TYR 20 -0.704 9.581 -3.159 168 HD1 TYR 20 2HD TYR 20 -1.504 7.931 -1.457 169 HD2 TYR 20 1HD TYR 20 -1.715 12.167 -0.726 170 HE1 TYR 20 2HE TYR 20 -3.045 7.532 0.440 171 HE2 TYR 20 1HE TYR 20 -3.252 11.758 1.173 172 HH TYR 20 HH TYR 20 -4.344 10.244 2.359 173 H TRP 21 H TRP 21 1.334 8.082 -3.173 174 HA TRP 21 HA TRP 21 0.842 6.163 -1.133 175 HB2 TRP 21 2HB TRP 21 0.584 5.740 -3.597 176 HB3 TRP 21 1HB TRP 21 2.336 5.790 -3.772 177 HD1 TRP 21 HD TRP 21 3.676 3.632 -3.068 178 HE1 TRP 21 1HE TRP 21 3.000 1.322 -2.155 179 HE3 TRP 21 3HE TRP 21 -1.255 4.490 -2.117 180 HZ2 TRP 21 2HZ TRP 21 0.661 0.008 -1.158 181 HZ3 TRP 21 3HZ TRP 21 -2.693 2.692 -1.213 182 HH2 TRP 21 HH TRP 21 -1.744 0.453 -0.725 183 H ASN 22 H ASN 22 3.603 8.068 -1.870 184 HA ASN 22 HA ASN 22 5.491 6.245 -0.440 185 HB2 ASN 22 2HB ASN 22 5.982 8.590 -2.294 186 HB3 ASN 22 1HB ASN 22 7.242 7.650 -1.507 187 HD21 ASN 22 1HD2 ASN 22 5.714 5.061 -1.898 188 HD22 ASN 22 2HD2 ASN 22 5.891 4.702 -3.548 189 H GLU 23 H GLU 23 3.911 9.358 -0.310 190 HA GLU 23 HA GLU 23 5.691 10.648 1.480 191 HB2 GLU 23 2HB GLU 23 2.885 11.106 0.536 192 HB3 GLU 23 1HB GLU 23 3.302 11.894 2.051 193 HG2 GLU 23 2HG GLU 23 5.193 13.040 1.002 194 HG3 GLU 23 1HG GLU 23 4.942 12.170 -0.505 195 HA PRO 24 HA PRO 24 4.435 7.936 4.945 196 HB2 PRO 24 2HB PRO 24 6.127 8.829 6.915 197 HB3 PRO 24 1HB PRO 24 6.690 7.822 5.566 198 HG2 PRO 24 2HG PRO 24 6.843 10.815 5.867 199 HG3 PRO 24 1HG PRO 24 8.108 9.685 5.337 200 HD2 PRO 24 2HD PRO 24 6.623 11.136 3.553 201 HD3 PRO 24 1HD PRO 24 7.217 9.506 3.153 202 H ALA 25 H ALA 25 4.707 11.441 5.267 203 HA ALA 25 HA ALA 25 3.244 11.797 7.629 204 HB1 ALA 25 1HB ALA 25 3.325 13.626 5.211 205 HB2 ALA 25 2HB ALA 25 4.510 13.600 6.517 206 HB3 ALA 25 3HB ALA 25 2.847 14.089 6.845 207 H HIS 26 H HIS 26 2.165 11.273 4.322 208 HA HIS 26 HA HIS 26 -0.641 11.774 4.926 209 HB2 HIS 26 2HB HIS 26 0.696 10.586 2.475 210 HB3 HIS 26 1HB HIS 26 -1.005 11.038 2.598 211 HD2 HIS 26 2HD HIS 26 0.998 12.729 0.527 212 HE1 HIS 26 1HE HIS 26 0.628 15.822 3.370 213 HE2 HIS 26 2HE HIS 26 1.302 15.279 0.982 214 H ILE 27 H ILE 27 1.405 8.865 4.417 215 HA ILE 27 HA ILE 27 -0.712 6.986 4.456 216 HB ILE 27 HB ILE 27 2.221 6.726 5.209 217 HG12 ILE 27 2HG1 ILE 27 0.782 5.764 2.691 218 HG13 ILE 27 1HG1 ILE 27 1.560 7.340 2.796 219 HG21 ILE 27 1HG2 ILE 27 0.099 4.556 4.884 220 HG22 ILE 27 2HG2 ILE 27 1.113 4.847 6.297 221 HG23 ILE 27 3HG2 ILE 27 1.826 4.210 4.825 222 HD11 ILE 27 3HD1 ILE 27 3.059 5.660 1.785 223 HD12 ILE 27 1HD1 ILE 27 2.955 4.682 3.243 224 HD13 ILE 27 2HD1 ILE 27 3.713 6.272 3.295 225 H MET 28 H MET 28 1.335 8.216 7.124 226 HA MET 28 HA MET 28 0.298 6.557 9.130 227 HB2 MET 28 2HB MET 28 1.205 8.187 10.720 228 HB3 MET 28 1HB MET 28 2.341 7.902 9.410 229 HG2 MET 28 2HG MET 28 1.453 9.959 8.294 230 HG3 MET 28 1HG MET 28 0.492 10.291 9.725 231 HE1 MET 28 3HE MET 28 1.322 10.424 12.000 232 HE2 MET 28 1HE MET 28 2.874 11.124 12.475 233 HE3 MET 28 2HE MET 28 2.733 9.391 12.211 234 H LYS 29 H LYS 29 -1.280 9.028 7.417 235 HA LYS 29 HA LYS 29 -3.093 9.867 9.516 236 HB2 LYS 29 2HB LYS 29 -2.341 11.291 7.546 237 HB3 LYS 29 1HB LYS 29 -3.376 10.306 6.520 238 HG2 LYS 29 2HG LYS 29 -5.343 10.926 7.860 239 HG3 LYS 29 1HG LYS 29 -4.322 11.883 8.936 240 HD2 LYS 29 2HD LYS 29 -3.665 13.320 7.019 241 HD3 LYS 29 1HD LYS 29 -4.720 12.377 5.967 242 HE2 LYS 29 2HE LYS 29 -6.673 13.022 7.325 243 HE3 LYS 29 1HE LYS 29 -5.625 13.944 8.403 244 HZ1 LYS 29 3HZ LYS 29 -5.464 15.614 6.952 245 HZ2 LYS 29 1HZ LYS 29 -6.854 14.953 6.241 246 HZ3 LYS 29 2HZ LYS 29 -5.321 14.586 5.607 247 H TRP 30 H TRP 30 -3.262 7.658 6.725 248 HA TRP 30 HA TRP 30 -5.932 6.676 7.658 249 HB2 TRP 30 2HB TRP 30 -6.452 6.140 5.325 250 HB3 TRP 30 1HB TRP 30 -6.086 7.855 5.488 251 HD1 TRP 30 HD TRP 30 -3.718 8.695 4.539 252 HE1 TRP 30 1HE TRP 30 -2.150 7.719 2.727 253 HE3 TRP 30 3HE TRP 30 -5.611 3.954 4.177 254 HZ2 TRP 30 2HZ TRP 30 -1.758 5.269 1.324 255 HZ3 TRP 30 3HZ TRP 30 -4.623 2.332 2.607 256 HH2 TRP 30 HH TRP 30 -2.703 2.979 1.183 257 H CYS 31 H CYS 31 -3.008 5.764 8.211 258 HA CYS 31 HA CYS 31 -2.529 3.347 6.899 259 HB2 CYS 31 2HB CYS 31 -1.016 4.615 8.498 260 HB3 CYS 31 1HB CYS 31 -1.929 3.882 9.813 261 HG CYS 31 HG CYS 31 -0.087 2.173 9.419 262 H GLN 32 H GLN 32 -3.308 1.316 7.109 263 HA GLN 32 HA GLN 32 -4.592 -0.453 7.747 264 HB2 GLN 32 2HB GLN 32 -4.978 0.946 10.420 265 HB3 GLN 32 1HB GLN 32 -5.236 -0.755 10.067 266 HG2 GLN 32 2HG GLN 32 -2.846 -1.017 9.519 267 HG3 GLN 32 1HG GLN 32 -2.584 0.689 9.865 268 HE21 GLN 32 1HE2 GLN 32 -1.409 0.706 11.795 269 HE22 GLN 32 2HE2 GLN 32 -1.869 -0.127 13.201 270 H ALA 33 H ALA 33 -5.774 2.768 8.126 271 HA ALA 33 HA ALA 33 -7.791 3.769 7.798 272 HB1 ALA 33 1HB ALA 33 -7.523 2.718 5.568 273 HB2 ALA 33 2HB ALA 33 -9.217 2.800 6.054 274 HB3 ALA 33 3HB ALA 33 -8.343 1.274 6.161 275 H SER 34 H SER 34 -7.378 1.893 10.091 276 HA SER 34 HA SER 34 -10.230 1.209 10.656 277 HB2 SER 34 2HB SER 34 -9.020 -0.855 10.477 278 HB3 SER 34 1HB SER 34 -7.667 -0.209 11.404 279 HG SER 34 HG SER 34 -10.213 -1.031 12.255 280 HA PRO 35 HA PRO 35 -9.465 4.054 14.099 281 HB2 PRO 35 2HB PRO 35 -11.711 3.702 15.603 282 HB3 PRO 35 1HB PRO 35 -11.797 4.435 13.982 283 HG2 PRO 35 2HG PRO 35 -12.300 1.562 14.764 284 HG3 PRO 35 1HG PRO 35 -13.315 2.638 13.775 285 HD2 PRO 35 2HD PRO 35 -11.593 0.843 12.625 286 HD3 PRO 35 1HD PRO 35 -11.925 2.425 11.876 287 H GLU 36 H GLU 36 -9.522 0.668 14.345 288 HA GLU 36 HA GLU 36 -9.066 0.463 17.225 289 HB2 GLU 36 2HB GLU 36 -8.853 -1.579 14.989 290 HB3 GLU 36 1HB GLU 36 -8.742 -1.951 16.710 291 HG2 GLU 36 2HG GLU 36 -11.157 -0.670 15.370 292 HG3 GLU 36 1HG GLU 36 -11.025 -2.379 15.773 293 H TRP 37 H TRP 37 -7.212 1.769 14.973 294 HA TRP 37 HA TRP 37 -4.719 1.085 16.362 295 HB2 TRP 37 2HB TRP 37 -5.142 0.572 13.386 296 HB3 TRP 37 1HB TRP 37 -3.553 0.643 14.156 297 HD1 TRP 37 HD TRP 37 -6.629 -1.568 13.868 298 HE1 TRP 37 1HE TRP 37 -6.127 -3.854 14.946 299 HE3 TRP 37 3HE TRP 37 -2.125 -0.542 16.033 300 HZ2 TRP 37 2HZ TRP 37 -4.080 -5.083 16.533 301 HZ3 TRP 37 3HZ TRP 37 -0.926 -2.285 17.324 302 HH2 TRP 37 HH TRP 37 -1.897 -4.546 17.578 303 H HIS 38 H HIS 38 -3.006 2.521 15.878 304 HA HIS 38 HA HIS 38 -3.605 4.974 14.364 305 HB2 HIS 38 2HB HIS 38 -4.451 5.377 16.696 306 HB3 HIS 38 1HB HIS 38 -2.839 5.030 17.314 307 HD2 HIS 38 2HD HIS 38 -1.148 7.237 17.306 308 HE1 HIS 38 1HE HIS 38 -3.431 9.702 14.749 309 HE2 HIS 38 2HE HIS 38 -1.355 9.597 16.208 310 H VAL 39 H VAL 39 -1.657 6.342 14.203 311 HA VAL 39 HA VAL 39 0.887 4.787 14.340 312 HB VAL 39 HB VAL 39 0.004 6.789 12.251 313 HG11 VAL 39 1HG1 VAL 39 2.068 5.930 11.052 314 HG12 VAL 39 2HG1 VAL 39 2.523 5.086 12.529 315 HG13 VAL 39 3HG1 VAL 39 2.438 6.849 12.511 316 HG21 VAL 39 3HG2 VAL 39 0.229 3.753 12.197 317 HG22 VAL 39 1HG2 VAL 39 0.006 4.761 10.769 318 HG23 VAL 39 2HG2 VAL 39 -1.242 4.712 12.016 319 HA PRO 40 HA PRO 40 1.460 8.749 16.697 320 HB2 PRO 40 2HB PRO 40 3.124 7.870 18.675 321 HB3 PRO 40 1HB PRO 40 1.377 7.541 18.714 322 HG2 PRO 40 2HG PRO 40 3.612 5.727 17.833 323 HG3 PRO 40 1HG PRO 40 2.210 5.353 18.858 324 HD2 PRO 40 2HD PRO 40 2.302 4.763 16.161 325 HD3 PRO 40 1HD PRO 40 0.774 5.079 17.011 326 H ALA 41 H ALA 41 3.521 6.744 14.891 327 HA ALA 41 HA ALA 41 5.254 8.930 14.197 328 HB1 ALA 41 1HB ALA 41 7.365 7.919 14.961 329 HB2 ALA 41 2HB ALA 41 6.465 6.622 15.751 330 HB3 ALA 41 3HB ALA 41 6.311 8.280 16.330 331 H ALA 42 H ALA 42 6.547 8.464 12.394 332 HA ALA 42 HA ALA 42 6.655 5.821 11.240 333 HB1 ALA 42 1HB ALA 42 5.007 7.949 9.852 334 HB2 ALA 42 2HB ALA 42 4.375 6.484 10.598 335 HB3 ALA 42 3HB ALA 42 5.422 6.370 9.187 336 H GLN 43 H GLN 43 8.214 5.637 9.655 337 HA GLN 43 HA GLN 43 9.619 8.092 8.741 338 HB2 GLN 43 2HB GLN 43 10.973 5.635 9.920 339 HB3 GLN 43 1HB GLN 43 11.790 7.039 9.236 340 HG2 GLN 43 2HG GLN 43 9.974 7.083 11.670 341 HG3 GLN 43 1HG GLN 43 11.730 7.129 11.711 342 HE21 GLN 43 1HE2 GLN 43 9.238 9.162 12.146 343 HE22 GLN 43 2HE2 GLN 43 9.876 10.591 11.490 344 H ASN 44 H ASN 44 10.550 7.931 6.751 345 HA ASN 44 HA ASN 44 10.787 5.435 5.312 346 HB2 ASN 44 2HB ASN 44 8.315 5.940 5.166 347 HB3 ASN 44 1HB ASN 44 8.716 7.432 4.320 348 HD21 ASN 44 1HD2 ASN 44 7.436 6.409 2.494 349 HD22 ASN 44 2HD2 ASN 44 8.231 5.318 1.466 350 H ASP 45 H ASP 45 12.326 5.640 3.790 351 HA ASP 45 HA ASP 45 13.079 8.335 2.761 352 HB2 ASP 45 2HB ASP 45 14.972 6.179 3.762 353 HB3 ASP 45 1HB ASP 45 15.445 7.704 3.013 354 H LEU 46 H LEU 46 12.272 8.028 0.717 355 HA LEU 46 HA LEU 46 12.472 5.583 -0.748 356 HB2 LEU 46 2HB LEU 46 11.809 8.455 -1.434 357 HB3 LEU 46 1HB LEU 46 12.008 7.295 -2.741 358 HG LEU 46 HG LEU 46 9.627 7.572 -2.028 359 HD11 LEU 46 1HD1 LEU 46 10.769 5.249 -2.830 360 HD12 LEU 46 2HD1 LEU 46 9.074 5.364 -2.384 361 HD13 LEU 46 3HD1 LEU 46 10.239 4.732 -1.226 362 HD21 LEU 46 3HD2 LEU 46 10.445 6.236 0.577 363 HD22 LEU 46 1HD2 LEU 46 8.856 6.853 0.139 364 HD23 LEU 46 2HD2 LEU 46 10.182 7.975 0.419 365 H LYS 47 H LYS 47 14.551 4.829 -0.843 366 HA LYS 47 HA LYS 47 16.264 5.957 -2.848 367 HB2 LYS 47 2HB LYS 47 16.789 7.432 -0.878 368 HB3 LYS 47 1HB LYS 47 17.298 6.003 0.017 369 HG2 LYS 47 2HG LYS 47 19.042 5.547 -1.672 370 HG3 LYS 47 1HG LYS 47 18.509 6.944 -2.607 371 HD2 LYS 47 2HD LYS 47 19.068 8.424 -0.701 372 HD3 LYS 47 1HD LYS 47 19.611 7.022 0.221 373 HE2 LYS 47 2HE LYS 47 21.336 6.564 -1.489 374 HE3 LYS 47 1HE LYS 47 20.793 7.967 -2.411 375 HZ1 LYS 47 3HZ LYS 47 22.529 8.815 -1.186 376 HZ2 LYS 47 1HZ LYS 47 22.180 7.878 0.184 377 HZ3 LYS 47 2HZ LYS 47 21.200 9.211 -0.203 378 H ALA 48 H ALA 48 17.849 4.488 -3.503 379 HA ALA 48 HA ALA 48 17.293 1.747 -3.034 380 HB1 ALA 48 1HB ALA 48 18.313 2.582 -5.113 381 HB2 ALA 48 2HB ALA 48 19.326 1.343 -4.368 382 HB3 ALA 48 3HB ALA 48 19.763 3.047 -4.223 383 H GLY 49 H GLY 49 18.199 0.274 -1.647 384 HA2 GLY 49 2HA GLY 49 19.473 -0.596 0.067 385 HA3 GLY 49 1HA GLY 49 20.683 0.638 -0.277 386 H GLY 50 H GLY 50 17.714 2.098 0.147 387 HA2 GLY 50 2HA GLY 50 18.448 3.222 2.737 388 HA3 GLY 50 1HA GLY 50 17.039 3.637 1.760 389 H THR 51 H THR 51 17.181 3.035 4.635 390 HA THR 51 HA THR 51 15.447 0.604 4.809 391 HB THR 51 HB THR 51 16.172 0.356 7.082 392 HG1 THR 51 1HG THR 51 16.238 2.694 7.409 393 HG21 THR 51 3HG2 THR 51 17.774 -0.451 5.352 394 HG22 THR 51 1HG2 THR 51 18.584 0.045 6.839 395 HG23 THR 51 2HG2 THR 51 18.606 1.104 5.432 396 H PHE 52 H PHE 52 13.727 0.715 6.389 397 HA PHE 52 HA PHE 52 12.743 3.415 7.109 398 HB2 PHE 52 2HB PHE 52 10.530 2.918 6.168 399 HB3 PHE 52 1HB PHE 52 11.755 2.890 4.904 400 HD1 PHE 52 1HD PHE 52 12.465 0.753 3.866 401 HD2 PHE 52 2HD PHE 52 9.473 0.813 6.957 402 HE1 PHE 52 1HE PHE 52 11.862 -1.585 3.336 403 HE2 PHE 52 2HE PHE 52 8.867 -1.535 6.417 404 HZ PHE 52 HZ PHE 52 10.065 -2.731 4.603 405 H THR 53 H THR 53 10.833 3.266 8.552 406 HA THR 53 HA THR 53 10.304 0.772 9.918 407 HB THR 53 HB THR 53 11.708 2.984 11.468 408 HG1 THR 53 1HG THR 53 12.617 0.453 10.575 409 HG21 THR 53 3HG2 THR 53 11.776 1.270 13.261 410 HG22 THR 53 1HG2 THR 53 10.846 0.174 12.241 411 HG23 THR 53 2HG2 THR 53 10.117 1.673 12.822 412 H THR 54 H THR 54 8.237 0.843 10.582 413 HA THR 54 HA THR 54 6.945 3.482 11.075 414 HB THR 54 HB THR 54 5.634 1.024 9.856 415 HG1 THR 54 1HG THR 54 6.331 3.431 8.556 416 HG21 THR 54 3HG2 THR 54 3.855 2.662 9.275 417 HG22 THR 54 1HG2 THR 54 4.725 3.912 10.160 418 HG23 THR 54 2HG2 THR 54 4.066 2.521 11.019 419 H THR 55 H THR 55 6.224 3.698 13.106 420 HA THR 55 HA THR 55 6.038 1.335 14.855 421 HB THR 55 HB THR 55 5.707 4.296 15.510 422 HG1 THR 55 1HG THR 55 7.805 4.389 15.618 423 HG21 THR 55 3HG2 THR 55 4.798 2.790 17.238 424 HG22 THR 55 1HG2 THR 55 6.294 3.529 17.805 425 HG23 THR 55 2HG2 THR 55 6.297 1.861 17.238 426 H MET 56 H MET 56 4.113 0.301 14.964 427 HA MET 56 HA MET 56 1.573 1.884 14.847 428 HB2 MET 56 2HB MET 56 2.147 -0.947 13.894 429 HB3 MET 56 1HB MET 56 0.552 -0.189 13.925 430 HG2 MET 56 2HG MET 56 1.387 1.600 12.413 431 HG3 MET 56 1HG MET 56 2.952 0.789 12.348 432 HE1 MET 56 3HE MET 56 1.586 0.152 8.838 433 HE2 MET 56 1HE MET 56 3.075 0.365 9.771 434 HE3 MET 56 2HE MET 56 1.778 1.549 9.892 435 H ALA 57 H ALA 57 0.292 1.685 16.591 436 HA ALA 57 HA ALA 57 0.529 -0.630 18.397 437 HB1 ALA 57 1HB ALA 57 0.841 2.233 19.330 438 HB2 ALA 57 2HB ALA 57 2.129 1.032 19.264 439 HB3 ALA 57 3HB ALA 57 0.771 0.808 20.369 440 H ALA 58 H ALA 58 -1.368 -1.221 19.270 441 HA ALA 58 HA ALA 58 -3.810 -0.101 18.327 442 HB1 ALA 58 1HB ALA 58 -4.895 -1.597 19.948 443 HB2 ALA 58 2HB ALA 58 -3.340 -1.905 20.721 444 HB3 ALA 58 3HB ALA 58 -3.624 -2.441 19.066 445 H LYS 59 H LYS 59 -5.375 1.152 19.436 446 HA LYS 59 HA LYS 59 -4.398 3.307 20.963 447 HB2 LYS 59 2HB LYS 59 -7.221 2.217 20.677 448 HB3 LYS 59 1HB LYS 59 -6.826 3.769 21.418 449 HG2 LYS 59 2HG LYS 59 -5.864 4.589 19.327 450 HG3 LYS 59 1HG LYS 59 -6.069 3.011 18.571 451 HD2 LYS 59 2HD LYS 59 -7.870 4.488 17.837 452 HD3 LYS 59 1HD LYS 59 -8.539 3.214 18.849 453 HE2 LYS 59 2HE LYS 59 -8.879 4.716 20.686 454 HE3 LYS 59 1HE LYS 59 -7.787 5.927 20.007 455 HZ1 LYS 59 3HZ LYS 59 -9.999 5.197 18.300 456 HZ2 LYS 59 1HZ LYS 59 -9.372 6.727 18.681 457 HZ3 LYS 59 2HZ LYS 59 -10.448 5.962 19.750 458 H ASP 60 H ASP 60 -5.946 0.267 21.935 459 HA ASP 60 HA ASP 60 -6.073 0.913 24.750 460 HB2 ASP 60 2HB ASP 60 -6.233 -1.739 23.282 461 HB3 ASP 60 1HB ASP 60 -6.620 -1.498 24.984 462 H GLY 61 H GLY 61 -3.593 0.052 22.617 463 HA2 GLY 61 2HA GLY 61 -1.358 -0.389 22.940 464 HA3 GLY 61 1HA GLY 61 -1.589 -0.023 24.646 465 H SER 62 H SER 62 -3.682 -2.424 23.340 466 HA SER 62 HA SER 62 -2.823 -4.436 25.116 467 HB2 SER 62 2HB SER 62 -4.414 -4.712 22.552 468 HB3 SER 62 1HB SER 62 -4.319 -5.910 23.840 469 HG SER 62 HG SER 62 -5.001 -3.907 25.157 470 H MET 63 H MET 63 -2.100 -3.829 21.700 471 HA MET 63 HA MET 63 0.288 -5.551 21.878 472 HB2 MET 63 2HB MET 63 -1.575 -7.003 21.043 473 HB3 MET 63 1HB MET 63 -1.821 -5.877 19.706 474 HG2 MET 63 2HG MET 63 0.413 -6.338 18.835 475 HG3 MET 63 1HG MET 63 0.823 -7.293 20.257 476 HE1 MET 63 3HE MET 63 -1.695 -8.512 16.644 477 HE2 MET 63 1HE MET 63 -0.415 -7.296 16.743 478 HE3 MET 63 2HE MET 63 -1.983 -6.995 17.487 479 H SER 64 H SER 64 1.887 -5.022 20.377 480 HA SER 64 HA SER 64 1.407 -2.844 18.463 481 HB2 SER 64 2HB SER 64 2.093 -1.698 20.535 482 HB3 SER 64 1HB SER 64 3.523 -2.719 20.628 483 HG SER 64 HG SER 64 3.946 -1.877 18.417 484 H PHE 65 H PHE 65 2.971 -2.690 16.842 485 HA PHE 65 HA PHE 65 5.206 -4.558 16.739 486 HB2 PHE 65 2HB PHE 65 4.418 -5.687 14.690 487 HB3 PHE 65 1HB PHE 65 3.352 -6.020 16.053 488 HD1 PHE 65 2HD PHE 65 3.716 -4.072 12.903 489 HD2 PHE 65 1HD PHE 65 1.049 -5.155 16.103 490 HE1 PHE 65 2HE PHE 65 1.806 -3.140 11.635 491 HE2 PHE 65 1HE PHE 65 -0.852 -4.218 14.825 492 HZ PHE 65 HZ PHE 65 -0.477 -3.210 12.593 493 H ASP 66 H ASP 66 6.589 -4.143 14.946 494 HA ASP 66 HA ASP 66 6.063 -1.677 13.372 495 HB2 ASP 66 2HB ASP 66 8.348 -0.885 13.866 496 HB3 ASP 66 1HB ASP 66 7.376 -0.989 15.330 497 H PHE 67 H PHE 67 6.606 -1.913 11.300 498 HA PHE 67 HA PHE 67 8.043 -4.365 10.433 499 HB2 PHE 67 2HB PHE 67 6.199 -2.382 9.061 500 HB3 PHE 67 1HB PHE 67 7.225 -3.442 8.099 501 HD1 PHE 67 2HD PHE 67 6.916 -5.885 8.126 502 HD2 PHE 67 1HD PHE 67 4.320 -3.315 10.395 503 HE1 PHE 67 2HE PHE 67 5.323 -7.759 8.427 504 HE2 PHE 67 1HE PHE 67 2.730 -5.199 10.693 505 HZ PHE 67 HZ PHE 67 3.231 -7.416 9.711 506 H GLY 68 H GLY 68 9.860 -4.302 9.197 507 HA2 GLY 68 2HA GLY 68 11.130 -1.749 8.465 508 HA3 GLY 68 1HA GLY 68 11.967 -2.757 9.648 509 H GLY 69 H GLY 69 12.822 -2.017 6.982 510 HA2 GLY 69 2HA GLY 69 13.869 -4.478 6.081 511 HA3 GLY 69 1HA GLY 69 12.493 -4.036 5.069 512 H VAL 70 H VAL 70 14.392 -4.030 3.482 513 HA VAL 70 HA VAL 70 15.454 -1.260 3.248 514 HB VAL 70 HB VAL 70 17.224 -2.798 4.073 515 HG11 VAL 70 1HG1 VAL 70 16.335 -4.876 2.985 516 HG12 VAL 70 2HG1 VAL 70 18.055 -4.622 2.692 517 HG13 VAL 70 3HG1 VAL 70 16.886 -4.263 1.426 518 HG21 VAL 70 3HG2 VAL 70 17.642 -1.883 1.203 519 HG22 VAL 70 1HG2 VAL 70 18.909 -2.206 2.386 520 HG23 VAL 70 2HG2 VAL 70 17.796 -0.862 2.636 521 H TYR 71 H TYR 71 15.550 -0.445 1.180 522 HA TYR 71 HA TYR 71 13.780 -1.714 -0.773 523 HB2 TYR 71 2HB TYR 71 15.370 0.875 -0.918 524 HB3 TYR 71 1HB TYR 71 14.137 0.351 -2.063 525 HD1 TYR 71 2HD TYR 71 11.791 -0.267 -1.083 526 HD2 TYR 71 1HD TYR 71 14.653 2.202 0.981 527 HE1 TYR 71 2HE TYR 71 9.985 0.656 0.334 528 HE2 TYR 71 1HE TYR 71 12.840 3.120 2.387 529 HH TYR 71 HH TYR 71 9.717 2.994 1.687 530 H ASP 72 H ASP 72 14.463 -2.997 -2.386 531 HA ASP 72 HA ASP 72 17.311 -3.470 -2.833 532 HB2 ASP 72 2HB ASP 72 14.871 -4.628 -4.221 533 HB3 ASP 72 1HB ASP 72 16.529 -5.213 -4.369 534 H GLN 73 H GLN 73 14.688 -1.706 -4.301 535 HA GLN 73 HA GLN 73 16.455 -0.246 -6.030 536 HB2 GLN 73 2HB GLN 73 16.332 -2.279 -7.368 537 HB3 GLN 73 1HB GLN 73 14.576 -2.285 -7.277 538 HG2 GLN 73 2HG GLN 73 15.982 0.145 -8.459 539 HG3 GLN 73 1HG GLN 73 15.787 -1.296 -9.450 540 HE21 GLN 73 1HE2 GLN 73 13.561 -2.001 -9.953 541 HE22 GLN 73 2HE2 GLN 73 12.273 -0.899 -9.846 542 H VAL 74 H VAL 74 15.537 1.657 -6.655 543 HA VAL 74 HA VAL 74 12.615 2.079 -6.326 544 HB VAL 74 HB VAL 74 14.737 3.955 -5.191 545 HG11 VAL 74 1HG1 VAL 74 12.806 5.075 -4.151 546 HG12 VAL 74 2HG1 VAL 74 11.714 3.949 -4.957 547 HG13 VAL 74 3HG1 VAL 74 12.667 5.087 -5.906 548 HG21 VAL 74 3HG2 VAL 74 13.888 3.199 -2.969 549 HG22 VAL 74 1HG2 VAL 74 14.668 1.898 -3.868 550 HG23 VAL 74 2HG2 VAL 74 12.906 1.979 -3.784 551 H LYS 75 H LYS 75 11.808 3.081 -8.079 552 HA LYS 75 HA LYS 75 13.410 5.048 -9.588 553 HB2 LYS 75 2HB LYS 75 12.269 2.484 -10.750 554 HB3 LYS 75 1HB LYS 75 12.643 3.879 -11.761 555 HG2 LYS 75 2HG LYS 75 15.001 3.777 -10.969 556 HG3 LYS 75 1HG LYS 75 14.604 2.350 -10.011 557 HD2 LYS 75 2HD LYS 75 13.961 1.135 -12.054 558 HD3 LYS 75 1HD LYS 75 14.323 2.559 -13.028 559 HE2 LYS 75 2HE LYS 75 16.682 2.465 -12.292 560 HE3 LYS 75 1HE LYS 75 16.319 1.039 -11.319 561 HZ1 LYS 75 3HZ LYS 75 17.263 0.460 -13.480 562 HZ2 LYS 75 1HZ LYS 75 15.976 1.238 -14.264 563 HZ3 LYS 75 2HZ LYS 75 15.683 -0.141 -13.314 564 H THR 76 H THR 76 12.165 6.762 -9.919 565 HA THR 76 HA THR 76 9.581 7.086 -9.061 566 HB THR 76 HB THR 76 10.815 8.566 -11.410 567 HG1 THR 76 1HG THR 76 11.453 8.417 -8.754 568 HG21 THR 76 3HG2 THR 76 8.442 9.118 -11.012 569 HG22 THR 76 1HG2 THR 76 9.481 10.462 -10.537 570 HG23 THR 76 2HG2 THR 76 8.792 9.405 -9.308 571 H ASN 77 H ASN 77 7.701 6.214 -9.673 572 HA ASN 77 HA ASN 77 6.052 5.208 -10.913 573 HB2 ASN 77 2HB ASN 77 7.208 7.038 -13.033 574 HB3 ASN 77 1HB ASN 77 5.646 6.229 -13.139 575 HD21 ASN 77 1HD2 ASN 77 6.141 9.162 -13.010 576 HD22 ASN 77 2HD2 ASN 77 5.326 9.707 -11.626 577 H ASP 78 H ASP 78 7.328 3.169 -10.706 578 HA ASP 78 HA ASP 78 7.552 1.857 -13.249 579 HB2 ASP 78 2HB ASP 78 9.704 3.049 -13.279 580 HB3 ASP 78 1HB ASP 78 10.091 2.399 -11.697 581 H LEU 79 H LEU 79 9.508 1.209 -10.349 582 HA LEU 79 HA LEU 79 7.614 -0.863 -9.450 583 HB2 LEU 79 2HB LEU 79 9.166 -1.858 -11.243 584 HB3 LEU 79 1HB LEU 79 10.495 -1.578 -10.127 585 HG LEU 79 HG LEU 79 8.907 -2.950 -8.406 586 HD11 LEU 79 1HD1 LEU 79 7.027 -3.100 -10.058 587 HD12 LEU 79 2HD1 LEU 79 7.578 -4.664 -9.487 588 HD13 LEU 79 3HD1 LEU 79 8.048 -4.096 -11.090 589 HD21 LEU 79 3HD2 LEU 79 11.155 -3.693 -9.091 590 HD22 LEU 79 1HD2 LEU 79 10.504 -4.307 -10.610 591 HD23 LEU 79 2HD2 LEU 79 10.036 -5.053 -9.081 592 H ILE 80 H ILE 80 7.647 -1.134 -7.316 593 HA ILE 80 HA ILE 80 9.962 -0.137 -5.707 594 HB ILE 80 HB ILE 80 7.013 0.224 -5.018 595 HG12 ILE 80 2HG1 ILE 80 9.112 2.314 -5.747 596 HG13 ILE 80 1HG1 ILE 80 7.871 1.737 -6.851 597 HG21 ILE 80 1HG2 ILE 80 9.566 1.084 -3.590 598 HG22 ILE 80 2HG2 ILE 80 8.410 -0.116 -3.010 599 HG23 ILE 80 3HG2 ILE 80 7.943 1.572 -3.111 600 HD11 ILE 80 3HD1 ILE 80 6.344 3.146 -5.986 601 HD12 ILE 80 1HD1 ILE 80 7.642 3.891 -5.068 602 HD13 ILE 80 2HD1 ILE 80 6.651 2.630 -4.328 603 H GLU 81 H GLU 81 10.701 -1.620 -4.310 604 HA GLU 81 HA GLU 81 8.963 -3.649 -3.143 605 HB2 GLU 81 2HB GLU 81 10.454 -5.522 -3.893 606 HB3 GLU 81 1HB GLU 81 9.554 -4.782 -5.216 607 HG2 GLU 81 2HG GLU 81 11.522 -3.427 -5.818 608 HG3 GLU 81 1HG GLU 81 12.438 -4.148 -4.497 609 H TYR 82 H TYR 82 10.188 -4.946 -1.557 610 HA TYR 82 HA TYR 82 12.744 -3.955 -0.611 611 HB2 TYR 82 2HB TYR 82 11.722 -3.357 1.677 612 HB3 TYR 82 1HB TYR 82 11.450 -2.196 0.384 613 HD1 TYR 82 1HD TYR 82 9.884 -5.105 2.162 614 HD2 TYR 82 2HD TYR 82 9.186 -1.640 -0.298 615 HE1 TYR 82 1HE TYR 82 7.446 -5.373 2.465 616 HE2 TYR 82 2HE TYR 82 6.749 -1.919 0.016 617 HH TYR 82 HH TYR 82 5.138 -3.158 0.890 618 H THR 83 H THR 83 13.427 -5.139 1.373 619 HA THR 83 HA THR 83 12.255 -7.881 1.476 620 HB THR 83 HB THR 83 15.136 -7.022 1.977 621 HG1 THR 83 1HG THR 83 15.107 -6.941 -0.119 622 HG21 THR 83 3HG2 THR 83 15.560 -9.470 1.829 623 HG22 THR 83 1HG2 THR 83 13.826 -9.752 1.697 624 HG23 THR 83 2HG2 THR 83 14.500 -9.076 3.179 625 H ILE 84 H ILE 84 11.528 -8.526 3.402 626 HA ILE 84 HA ILE 84 11.931 -6.823 5.798 627 HB ILE 84 HB ILE 84 9.980 -9.113 5.368 628 HG12 ILE 84 2HG1 ILE 84 9.498 -7.392 3.693 629 HG13 ILE 84 1HG1 ILE 84 8.266 -7.345 4.946 630 HG21 ILE 84 1HG2 ILE 84 10.373 -8.571 7.724 631 HG22 ILE 84 2HG2 ILE 84 8.762 -8.038 7.253 632 HG23 ILE 84 3HG2 ILE 84 10.071 -6.864 7.404 633 HD11 ILE 84 3HD1 ILE 84 9.669 -5.439 6.019 634 HD12 ILE 84 1HD1 ILE 84 8.813 -5.074 4.523 635 HD13 ILE 84 2HD1 ILE 84 10.538 -5.398 4.487 636 H GLY 85 H GLY 85 12.607 -7.681 7.749 637 HA2 GLY 85 2HA GLY 85 14.703 -9.522 7.715 638 HA3 GLY 85 1HA GLY 85 13.821 -9.056 9.166 639 H ASP 86 H ASP 86 11.258 -10.052 8.463 640 HA ASP 86 HA ASP 86 11.422 -12.719 9.306 641 HB2 ASP 86 2HB ASP 86 9.204 -11.226 7.869 642 HB3 ASP 86 1HB ASP 86 8.995 -12.792 8.652 643 H GLY 87 H GLY 87 11.913 -11.348 6.215 644 HA2 GLY 87 2HA GLY 87 12.865 -12.555 4.403 645 HA3 GLY 87 1HA GLY 87 12.099 -14.035 4.968 646 H ARG 88 H ARG 88 9.769 -11.722 5.269 647 HA ARG 88 HA ARG 88 8.214 -12.681 3.086 648 HB2 ARG 88 2HB ARG 88 7.885 -10.148 4.733 649 HB3 ARG 88 1HB ARG 88 6.656 -10.849 3.684 650 HG2 ARG 88 2HG ARG 88 6.613 -12.893 5.044 651 HG3 ARG 88 1HG ARG 88 7.894 -12.256 6.075 652 HD2 ARG 88 2HD ARG 88 5.742 -11.897 7.177 653 HD3 ARG 88 1HD ARG 88 6.402 -10.341 6.685 654 HE ARG 88 HE ARG 88 4.642 -10.104 5.182 655 HH11 ARG 88 1HH2 ARG 88 4.877 -13.393 6.256 656 HH12 ARG 88 2HH2 ARG 88 3.391 -13.884 5.518 657 HH21 ARG 88 1HH1 ARG 88 2.698 -10.748 4.205 658 HH22 ARG 88 2HH1 ARG 88 2.161 -12.388 4.347 659 H LYS 89 H LYS 89 7.780 -11.766 1.082 660 HA LYS 89 HA LYS 89 9.443 -9.443 0.234 661 HB2 LYS 89 2HB LYS 89 10.106 -11.828 -0.611 662 HB3 LYS 89 1HB LYS 89 8.640 -11.750 -1.579 663 HG2 LYS 89 2HG LYS 89 10.189 -10.851 -3.117 664 HG3 LYS 89 1HG LYS 89 9.638 -9.368 -2.342 665 HD2 LYS 89 2HD LYS 89 11.613 -9.513 -0.781 666 HD3 LYS 89 1HD LYS 89 12.155 -10.941 -1.654 667 HE2 LYS 89 2HE LYS 89 12.317 -9.604 -3.732 668 HE3 LYS 89 1HE LYS 89 11.792 -8.174 -2.841 669 HZ1 LYS 89 3HZ LYS 89 14.110 -9.740 -1.916 670 HZ2 LYS 89 1HZ LYS 89 13.732 -8.116 -1.614 671 HZ3 LYS 89 2HZ LYS 89 14.294 -8.584 -3.146 672 H VAL 90 H VAL 90 8.458 -7.911 -0.950 673 HA VAL 90 HA VAL 90 5.633 -8.281 -1.817 674 HB VAL 90 HB VAL 90 6.739 -5.833 -0.380 675 HG11 VAL 90 1HG1 VAL 90 4.332 -5.137 -0.364 676 HG12 VAL 90 2HG1 VAL 90 3.944 -6.540 -1.357 677 HG13 VAL 90 3HG1 VAL 90 4.975 -5.263 -2.000 678 HG21 VAL 90 3HG2 VAL 90 5.227 -6.522 1.468 679 HG22 VAL 90 1HG2 VAL 90 6.475 -7.729 1.167 680 HG23 VAL 90 2HG2 VAL 90 4.833 -7.997 0.585 681 H ARG 91 H ARG 91 5.255 -7.512 -3.809 682 HA ARG 91 HA ARG 91 7.268 -5.745 -5.139 683 HB2 ARG 91 2HB ARG 91 7.456 -8.125 -5.898 684 HB3 ARG 91 1HB ARG 91 5.766 -8.083 -6.395 685 HG2 ARG 91 2HG ARG 91 6.275 -6.240 -7.976 686 HG3 ARG 91 1HG ARG 91 7.960 -6.270 -7.463 687 HD2 ARG 91 2HD ARG 91 8.153 -8.604 -8.255 688 HD3 ARG 91 1HD ARG 91 6.464 -8.565 -8.766 689 HE ARG 91 HE ARG 91 7.991 -6.422 -9.924 690 HH11 ARG 91 1HH2 ARG 91 7.281 -9.809 -10.190 691 HH12 ARG 91 2HH2 ARG 91 7.623 -9.877 -11.887 692 HH21 ARG 91 1HH1 ARG 91 8.436 -6.519 -12.135 693 HH22 ARG 91 2HH1 ARG 91 8.276 -8.020 -12.984 694 H ILE 92 H ILE 92 6.339 -3.909 -5.758 695 HA ILE 92 HA ILE 92 3.387 -3.781 -6.199 696 HB ILE 92 HB ILE 92 5.325 -1.528 -5.491 697 HG12 ILE 92 2HG1 ILE 92 3.281 -2.933 -3.710 698 HG13 ILE 92 1HG1 ILE 92 5.012 -3.235 -3.639 699 HG21 ILE 92 1HG2 ILE 92 3.327 -0.782 -6.746 700 HG22 ILE 92 2HG2 ILE 92 3.212 -0.262 -5.075 701 HG23 ILE 92 3HG2 ILE 92 2.285 -1.654 -5.627 702 HD11 ILE 92 3HD1 ILE 92 5.383 -0.819 -3.134 703 HD12 ILE 92 1HD1 ILE 92 4.420 -1.639 -1.908 704 HD13 ILE 92 2HD1 ILE 92 3.635 -0.590 -3.085 705 H VAL 93 H VAL 93 2.782 -3.514 -8.268 706 HA VAL 93 HA VAL 93 4.716 -2.393 -10.251 707 HB VAL 93 HB VAL 93 2.382 -4.276 -10.806 708 HG11 VAL 93 1HG1 VAL 93 3.503 -4.556 -12.981 709 HG12 VAL 93 2HG1 VAL 93 4.783 -3.451 -12.484 710 HG13 VAL 93 3HG1 VAL 93 3.145 -2.855 -12.705 711 HG21 VAL 93 3HG2 VAL 93 4.052 -5.431 -9.410 712 HG22 VAL 93 1HG2 VAL 93 5.343 -4.904 -10.493 713 HG23 VAL 93 2HG2 VAL 93 4.118 -6.037 -11.062 714 H PHE 94 H PHE 94 4.169 -0.447 -11.004 715 HA PHE 94 HA PHE 94 1.423 0.598 -10.562 716 HB2 PHE 94 2HB PHE 94 4.023 1.919 -11.427 717 HB3 PHE 94 1HB PHE 94 2.489 2.765 -11.224 718 HD1 PHE 94 1HD PHE 94 5.113 0.805 -9.430 719 HD2 PHE 94 2HD PHE 94 1.645 3.319 -9.001 720 HE1 PHE 94 1HE PHE 94 5.541 0.995 -6.999 721 HE2 PHE 94 2HE PHE 94 2.084 3.506 -6.575 722 HZ PHE 94 HZ PHE 94 4.031 2.344 -5.571 723 H THR 95 H THR 95 -0.011 0.568 -12.139 724 HA THR 95 HA THR 95 0.826 0.729 -14.992 725 HB THR 95 HB THR 95 -0.913 -0.943 -15.534 726 HG1 THR 95 1HG THR 95 -1.865 -2.078 -13.824 727 HG21 THR 95 3HG2 THR 95 1.018 -1.949 -13.429 728 HG22 THR 95 1HG2 THR 95 1.438 -1.679 -15.121 729 HG23 THR 95 2HG2 THR 95 0.258 -2.919 -14.689 730 H HIS 96 H HIS 96 -0.667 1.734 -16.334 731 HA HIS 96 HA HIS 96 -3.155 2.812 -15.256 732 HB2 HIS 96 2HB HIS 96 -2.507 5.161 -15.742 733 HB3 HIS 96 1HB HIS 96 -1.515 4.462 -14.463 734 HD2 HIS 96 2HD HIS 96 1.155 3.654 -15.381 735 HE1 HIS 96 1HE HIS 96 1.008 6.092 -18.825 736 HE2 HIS 96 2HE HIS 96 2.527 4.693 -17.345 737 H THR 97 H THR 97 -4.351 4.008 -16.929 738 HA THR 97 HA THR 97 -3.528 3.558 -19.717 739 HB THR 97 HB THR 97 -6.133 2.426 -18.613 740 HG1 THR 97 1HG THR 97 -4.622 1.061 -17.933 741 HG21 THR 97 3HG2 THR 97 -4.804 2.243 -21.342 742 HG22 THR 97 1HG2 THR 97 -6.298 3.107 -20.965 743 HG23 THR 97 2HG2 THR 97 -6.243 1.349 -20.857 744 H GLY 98 H GLY 98 -3.892 5.451 -20.687 745 HA2 GLY 98 2HA GLY 98 -4.856 7.445 -21.296 746 HA3 GLY 98 1HA GLY 98 -6.392 6.725 -20.825 747 H ASP 99 H ASP 99 -7.261 7.160 -18.804 748 HA ASP 99 HA ASP 99 -5.849 9.120 -17.047 749 HB2 ASP 99 2HB ASP 99 -8.749 9.197 -17.931 750 HB3 ASP 99 1HB ASP 99 -8.002 10.288 -16.764 751 H THR 100 H THR 100 -6.168 6.193 -16.810 752 HA THR 100 HA THR 100 -7.585 6.115 -14.184 753 HB THR 100 HB THR 100 -7.622 3.905 -16.283 754 HG1 THR 100 1HG THR 100 -10.016 4.844 -15.682 755 HG21 THR 100 3HG2 THR 100 -9.029 4.217 -13.604 756 HG22 THR 100 1HG2 THR 100 -7.770 3.042 -13.984 757 HG23 THR 100 2HG2 THR 100 -9.345 2.929 -14.762 758 H THR 101 H THR 101 -6.233 5.506 -12.614 759 HA THR 101 HA THR 101 -3.667 4.160 -13.276 760 HB THR 101 HB THR 101 -4.536 5.555 -10.716 761 HG1 THR 101 1HG THR 101 -3.400 6.384 -13.092 762 HG21 THR 101 3HG2 THR 101 -2.077 5.501 -10.234 763 HG22 THR 101 1HG2 THR 101 -1.841 4.497 -11.663 764 HG23 THR 101 2HG2 THR 101 -2.776 3.887 -10.296 765 H ASN 102 H ASN 102 -3.276 2.120 -12.630 766 HA ASN 102 HA ASN 102 -5.197 0.749 -10.786 767 HB2 ASN 102 2HB ASN 102 -3.746 -0.346 -13.223 768 HB3 ASN 102 1HB ASN 102 -4.754 -1.289 -12.124 769 HD21 ASN 102 1HD2 ASN 102 -5.225 -0.739 -15.034 770 HD22 ASN 102 2HD2 ASN 102 -6.737 0.027 -15.111 771 H ILE 103 H ILE 103 -4.208 0.285 -8.928 772 HA ILE 103 HA ILE 103 -1.258 -0.076 -8.825 773 HB ILE 103 HB ILE 103 -3.283 0.134 -6.552 774 HG12 ILE 103 2HG1 ILE 103 -1.427 2.301 -7.632 775 HG13 ILE 103 1HG1 ILE 103 -3.151 2.224 -7.985 776 HG21 ILE 103 1HG2 ILE 103 -1.249 0.601 -5.183 777 HG22 ILE 103 2HG2 ILE 103 -0.250 0.343 -6.609 778 HG23 ILE 103 3HG2 ILE 103 -1.176 -0.988 -5.929 779 HD11 ILE 103 3HD1 ILE 103 -3.594 2.291 -5.489 780 HD12 ILE 103 1HD1 ILE 103 -2.856 3.752 -6.144 781 HD13 ILE 103 2HD1 ILE 103 -1.865 2.593 -5.262 782 H VAL 104 H VAL 104 -0.423 -2.093 -8.616 783 HA VAL 104 HA VAL 104 -2.203 -4.367 -7.825 784 HB VAL 104 HB VAL 104 0.183 -4.421 -9.714 785 HG11 VAL 104 1HG1 VAL 104 -0.162 -6.557 -8.539 786 HG12 VAL 104 2HG1 VAL 104 -0.657 -6.719 -10.220 787 HG13 VAL 104 3HG1 VAL 104 -1.875 -6.529 -8.957 788 HG21 VAL 104 3HG2 VAL 104 -1.713 -3.206 -10.713 789 HG22 VAL 104 1HG2 VAL 104 -2.799 -4.533 -10.295 790 HG23 VAL 104 2HG2 VAL 104 -1.519 -4.778 -11.485 791 H GLU 105 H GLU 105 -1.543 -5.484 -6.071 792 HA GLU 105 HA GLU 105 1.281 -5.267 -5.133 793 HB2 GLU 105 2HB GLU 105 -1.231 -5.093 -3.428 794 HB3 GLU 105 1HB GLU 105 0.428 -5.100 -2.829 795 HG2 GLU 105 2HG GLU 105 0.884 -3.021 -4.093 796 HG3 GLU 105 1HG GLU 105 -0.775 -3.018 -4.670 797 H SER 106 H SER 106 2.130 -7.249 -5.048 798 HA SER 106 HA SER 106 0.388 -9.639 -4.719 799 HB2 SER 106 2HB SER 106 1.862 -9.837 -6.623 800 HB3 SER 106 1HB SER 106 3.242 -9.273 -5.686 801 HG SER 106 HG SER 106 2.520 -11.729 -6.037 802 H PHE 107 H PHE 107 0.817 -11.139 -3.096 803 HA PHE 107 HA PHE 107 2.765 -10.417 -0.961 804 HB2 PHE 107 2HB PHE 107 -0.142 -11.198 -0.516 805 HB3 PHE 107 1HB PHE 107 1.064 -10.913 0.743 806 HD1 PHE 107 2HD PHE 107 1.960 -8.619 1.150 807 HD2 PHE 107 1HD PHE 107 -1.143 -9.317 -1.750 808 HE1 PHE 107 2HE PHE 107 1.464 -6.194 1.088 809 HE2 PHE 107 1HE PHE 107 -1.630 -6.892 -1.806 810 HZ PHE 107 HZ PHE 107 -0.328 -5.330 -0.389 811 H ASP 108 H ASP 108 3.537 -12.179 0.215 812 HA ASP 108 HA ASP 108 2.779 -14.901 -0.718 813 HB2 ASP 108 2HB ASP 108 4.877 -14.145 -1.832 814 HB3 ASP 108 1HB ASP 108 5.604 -13.895 -0.248 815 HA PRO 109 HA PRO 109 2.977 -14.722 3.905 816 HB2 PRO 109 2HB PRO 109 0.427 -15.398 4.545 817 HB3 PRO 109 1HB PRO 109 0.831 -13.750 4.011 818 HG2 PRO 109 2HG PRO 109 -0.446 -15.977 2.450 819 HG3 PRO 109 1HG PRO 109 -0.797 -14.239 2.424 820 HD2 PRO 109 2HD PRO 109 0.841 -15.584 0.540 821 HD3 PRO 109 1HD PRO 109 0.842 -13.826 0.802 822 H GLU 110 H GLU 110 1.871 -16.633 5.411 823 HA GLU 110 HA GLU 110 3.361 -18.962 4.756 824 HB2 GLU 110 2HB GLU 110 1.185 -18.489 6.819 825 HB3 GLU 110 1HB GLU 110 2.162 -19.951 6.741 826 HG2 GLU 110 2HG GLU 110 3.168 -18.483 8.392 827 HG3 GLU 110 1HG GLU 110 4.228 -18.499 6.986 828 H GLU 111 H GLU 111 2.842 -20.668 3.602 829 HA GLU 111 HA GLU 111 0.488 -20.811 2.012 830 HB2 GLU 111 2HB GLU 111 1.310 -23.059 1.364 831 HB3 GLU 111 1HB GLU 111 2.580 -21.839 1.279 832 HG2 GLU 111 2HG GLU 111 3.373 -22.565 3.546 833 HG3 GLU 111 1HG GLU 111 2.162 -23.847 3.528 834 H THR 112 H THR 112 1.387 -22.248 5.097 835 HA THR 112 HA THR 112 -0.721 -24.135 5.309 836 HB THR 112 HB THR 112 -0.184 -24.142 7.711 837 HG1 THR 112 1HG THR 112 0.338 -22.247 8.440 838 HG21 THR 112 3HG2 THR 112 2.293 -23.845 5.980 839 HG22 THR 112 1HG2 THR 112 1.335 -25.319 6.139 840 HG23 THR 112 2HG2 THR 112 2.209 -24.679 7.531 841 H ASN 113 H ASN 113 -0.458 -20.718 6.230 842 HA ASN 113 HA ASN 113 -2.871 -20.558 7.689 843 HB2 ASN 113 2HB ASN 113 -1.209 -18.479 6.227 844 HB3 ASN 113 1HB ASN 113 -2.651 -18.034 7.134 845 HD21 ASN 113 1HD2 ASN 113 -1.322 -16.815 8.677 846 HD22 ASN 113 2HD2 ASN 113 -0.381 -17.619 9.839 847 HA PRO 114 HA PRO 114 -5.852 -20.623 4.348 848 HB2 PRO 114 2HB PRO 114 -7.991 -19.287 5.425 849 HB3 PRO 114 1HB PRO 114 -7.458 -20.859 6.072 850 HG2 PRO 114 2HG PRO 114 -6.735 -18.099 7.059 851 HG3 PRO 114 1HG PRO 114 -7.391 -19.467 7.990 852 HD2 PRO 114 2HD PRO 114 -4.730 -18.993 7.973 853 HD3 PRO 114 1HD PRO 114 -5.335 -20.665 7.913 854 H ARG 115 H ARG 115 -5.129 -19.474 2.623 855 HA ARG 115 HA ARG 115 -4.563 -16.705 2.555 856 HB2 ARG 115 2HB ARG 115 -5.239 -18.620 0.299 857 HB3 ARG 115 1HB ARG 115 -4.578 -16.999 0.071 858 HG2 ARG 115 2HG ARG 115 -2.581 -17.623 1.391 859 HG3 ARG 115 1HG ARG 115 -3.235 -19.246 1.616 860 HD2 ARG 115 2HD ARG 115 -2.613 -17.994 -1.084 861 HD3 ARG 115 1HD ARG 115 -1.571 -19.139 -0.241 862 HE ARG 115 HE ARG 115 -4.105 -20.315 -0.434 863 HH11 ARG 115 1HH2 ARG 115 -1.554 -19.217 -2.522 864 HH12 ARG 115 2HH2 ARG 115 -1.888 -20.382 -3.758 865 HH21 ARG 115 1HH1 ARG 115 -4.537 -21.830 -2.054 866 HH22 ARG 115 2HH1 ARG 115 -3.574 -21.858 -3.494 867 H GLU 116 H GLU 116 -7.516 -18.538 1.955 868 HA GLU 116 HA GLU 116 -9.100 -16.774 0.580 869 HB2 GLU 116 2HB GLU 116 -9.892 -18.512 2.937 870 HB3 GLU 116 1HB GLU 116 -11.031 -17.798 1.796 871 HG2 GLU 116 2HG GLU 116 -9.970 -19.034 -0.053 872 HG3 GLU 116 1HG GLU 116 -8.808 -19.737 1.070 873 H LEU 117 H LEU 117 -8.684 -16.818 4.137 874 HA LEU 117 HA LEU 117 -10.317 -14.512 4.598 875 HB2 LEU 117 2HB LEU 117 -8.130 -15.620 6.394 876 HB3 LEU 117 1HB LEU 117 -9.493 -14.612 6.877 877 HG LEU 117 HG LEU 117 -9.663 -17.443 5.770 878 HD11 LEU 117 1HD1 LEU 117 -10.220 -16.356 8.549 879 HD12 LEU 117 2HD1 LEU 117 -8.812 -17.313 8.091 880 HD13 LEU 117 3HD1 LEU 117 -10.421 -18.031 8.038 881 HD21 LEU 117 3HD2 LEU 117 -11.687 -16.413 5.059 882 HD22 LEU 117 1HD2 LEU 117 -11.823 -15.436 6.521 883 HD23 LEU 117 2HD2 LEU 117 -12.138 -17.172 6.578 884 H GLN 118 H GLN 118 -6.833 -14.973 4.147 885 HA GLN 118 HA GLN 118 -6.020 -12.357 4.828 886 HB2 GLN 118 2HB GLN 118 -4.796 -14.277 2.823 887 HB3 GLN 118 1HB GLN 118 -3.985 -12.865 3.498 888 HG2 GLN 118 2HG GLN 118 -5.062 -15.169 5.167 889 HG3 GLN 118 1HG GLN 118 -3.384 -15.023 4.651 890 HE21 GLN 118 1HE2 GLN 118 -5.189 -14.569 7.334 891 HE22 GLN 118 2HE2 GLN 118 -4.380 -13.248 8.029 892 H GLN 119 H GLN 119 -6.943 -13.759 1.675 893 HA GLN 119 HA GLN 119 -6.446 -11.522 0.082 894 HB2 GLN 119 2HB GLN 119 -7.054 -13.808 -0.748 895 HB3 GLN 119 1HB GLN 119 -8.717 -13.517 -0.247 896 HG2 GLN 119 2HG GLN 119 -8.855 -11.587 -1.786 897 HG3 GLN 119 1HG GLN 119 -7.178 -11.843 -2.262 898 HE21 GLN 119 1HE2 GLN 119 -9.378 -11.948 -4.137 899 HE22 GLN 119 2HE2 GLN 119 -9.486 -13.539 -4.717 900 H SER 120 H SER 120 -9.316 -12.400 1.950 901 HA SER 120 HA SER 120 -10.939 -10.216 1.187 902 HB2 SER 120 2HB SER 120 -10.947 -11.753 3.801 903 HB3 SER 120 1HB SER 120 -12.250 -10.733 3.195 904 HG SER 120 HG SER 120 -12.793 -12.247 1.824 905 H GLY 121 H GLY 121 -8.554 -10.623 3.813 906 HA2 GLY 121 2HA GLY 121 -9.064 -8.158 5.122 907 HA3 GLY 121 1HA GLY 121 -7.570 -9.084 5.217 908 H TRP 122 H TRP 122 -6.531 -9.027 2.746 909 HA TRP 122 HA TRP 122 -5.444 -6.414 2.527 910 HB2 TRP 122 2HB TRP 122 -5.400 -8.741 0.566 911 HB3 TRP 122 1HB TRP 122 -4.435 -7.278 0.383 912 HD1 TRP 122 HD TRP 122 -4.205 -10.644 1.871 913 HE1 TRP 122 1HE TRP 122 -2.250 -10.784 3.536 914 HE3 TRP 122 3HE TRP 122 -3.119 -5.670 2.397 915 HZ2 TRP 122 2HZ TRP 122 -0.459 -9.032 4.909 916 HZ3 TRP 122 3HZ TRP 122 -1.283 -4.944 3.889 917 HH2 TRP 122 HH TRP 122 0.049 -6.615 5.144 918 H GLN 123 H GLN 123 -8.058 -8.049 0.799 919 HA GLN 123 HA GLN 123 -8.416 -5.980 -1.166 920 HB2 GLN 123 2HB GLN 123 -9.148 -8.379 -1.433 921 HB3 GLN 123 1HB GLN 123 -10.430 -8.073 -0.263 922 HG2 GLN 123 2HG GLN 123 -11.331 -6.290 -1.731 923 HG3 GLN 123 1HG GLN 123 -10.048 -6.597 -2.893 924 HE21 GLN 123 1HE2 GLN 123 -11.125 -7.571 -4.636 925 HE22 GLN 123 2HE2 GLN 123 -12.142 -8.923 -4.495 926 H ALA 124 H ALA 124 -9.798 -6.673 2.022 927 HA ALA 124 HA ALA 124 -11.948 -4.881 1.995 928 HB1 ALA 124 1HB ALA 124 -11.659 -6.551 3.760 929 HB2 ALA 124 2HB ALA 124 -11.775 -4.947 4.475 930 HB3 ALA 124 3HB ALA 124 -10.201 -5.732 4.320 931 H ILE 125 H ILE 125 -8.621 -4.313 3.197 932 HA ILE 125 HA ILE 125 -9.032 -1.604 3.893 933 HB ILE 125 HB ILE 125 -7.166 -2.845 4.801 934 HG12 ILE 125 2HG1 ILE 125 -5.990 -0.747 2.917 935 HG13 ILE 125 1HG1 ILE 125 -6.876 -0.346 4.388 936 HG21 ILE 125 1HG2 ILE 125 -6.792 -4.378 2.926 937 HG22 ILE 125 2HG2 ILE 125 -5.286 -3.615 3.400 938 HG23 ILE 125 3HG2 ILE 125 -6.130 -3.068 1.958 939 HD11 ILE 125 3HD1 ILE 125 -4.446 -0.351 4.806 940 HD12 ILE 125 1HD1 ILE 125 -4.346 -2.023 4.255 941 HD13 ILE 125 2HD1 ILE 125 -5.240 -1.632 5.719 942 H LEU 126 H LEU 126 -7.989 -3.140 0.873 943 HA LEU 126 HA LEU 126 -7.342 -0.749 -0.505 944 HB2 LEU 126 2HB LEU 126 -8.101 -3.542 -1.367 945 HB3 LEU 126 1HB LEU 126 -7.871 -2.301 -2.589 946 HG LEU 126 HG LEU 126 -5.711 -2.902 -0.508 947 HD11 LEU 126 1HD1 LEU 126 -6.032 -4.152 -3.260 948 HD12 LEU 126 2HD1 LEU 126 -6.167 -4.999 -1.720 949 HD13 LEU 126 3HD1 LEU 126 -4.617 -4.328 -2.223 950 HD21 LEU 126 3HD2 LEU 126 -4.213 -1.934 -2.274 951 HD22 LEU 126 1HD2 LEU 126 -5.428 -0.772 -1.764 952 HD23 LEU 126 2HD2 LEU 126 -5.622 -1.632 -3.284 953 H ASN 127 H ASN 127 -10.386 -2.517 -0.121 954 HA ASN 127 HA ASN 127 -11.890 -1.017 -1.992 955 HB2 ASN 127 2HB ASN 127 -12.744 -2.549 0.491 956 HB3 ASN 127 1HB ASN 127 -13.872 -1.870 -0.684 957 HD21 ASN 127 1HD2 ASN 127 -13.503 -4.748 -0.097 958 HD22 ASN 127 2HD2 ASN 127 -13.011 -5.464 -1.553 959 H SER 128 H SER 128 -11.238 -0.601 1.466 960 HA SER 128 HA SER 128 -12.965 1.536 1.986 961 HB2 SER 128 2HB SER 128 -10.256 0.979 3.219 962 HB3 SER 128 1HB SER 128 -11.496 2.030 3.899 963 HG SER 128 HG SER 128 -12.321 -0.513 3.187 964 H PHE 129 H PHE 129 -9.835 1.472 0.433 965 HA PHE 129 HA PHE 129 -9.001 4.092 0.644 966 HB2 PHE 129 2HB PHE 129 -7.749 2.244 -0.492 967 HB3 PHE 129 1HB PHE 129 -8.818 2.412 -1.881 968 HD1 PHE 129 2HD PHE 129 -6.248 4.155 0.184 969 HD2 PHE 129 1HD PHE 129 -8.542 4.267 -3.457 970 HE1 PHE 129 2HE PHE 129 -4.840 6.012 -0.652 971 HE2 PHE 129 1HE PHE 129 -7.131 6.124 -4.282 972 HZ PHE 129 HZ PHE 129 -5.280 6.998 -2.883 973 H LYS 130 H LYS 130 -11.761 2.887 -0.999 974 HA LYS 130 HA LYS 130 -12.141 4.993 -2.906 975 HB2 LYS 130 2HB LYS 130 -14.276 3.977 -3.311 976 HB3 LYS 130 1HB LYS 130 -13.170 2.658 -2.932 977 HG2 LYS 130 2HG LYS 130 -14.028 2.805 -0.499 978 HG3 LYS 130 1HG LYS 130 -15.272 3.892 -1.097 979 HD2 LYS 130 2HD LYS 130 -16.096 2.173 -2.642 980 HD3 LYS 130 1HD LYS 130 -14.834 1.064 -2.102 981 HE2 LYS 130 2HE LYS 130 -16.978 0.600 -0.960 982 HE3 LYS 130 1HE LYS 130 -15.744 1.123 0.186 983 HZ1 LYS 130 3HZ LYS 130 -18.221 2.233 -0.148 984 HZ2 LYS 130 1HZ LYS 130 -17.176 3.327 -0.917 985 HZ3 LYS 130 2HZ LYS 130 -16.920 2.911 0.710 986 H SER 131 H SER 131 -13.213 4.428 0.414 987 HA SER 131 HA SER 131 -15.094 6.476 0.657 988 HB2 SER 131 2HB SER 131 -13.223 5.388 2.776 989 HB3 SER 131 1HB SER 131 -14.699 6.302 3.084 990 HG SER 131 HG SER 131 -15.190 4.133 3.194 991 H TYR 132 H TYR 132 -11.583 6.550 1.220 992 HA TYR 132 HA TYR 132 -11.434 9.213 2.158 993 HB2 TYR 132 2HB TYR 132 -9.405 7.498 0.683 994 HB3 TYR 132 1HB TYR 132 -9.014 9.042 1.439 995 HD1 TYR 132 1HD TYR 132 -10.235 5.573 2.115 996 HD2 TYR 132 2HD TYR 132 -8.741 9.209 3.863 997 HE1 TYR 132 1HE TYR 132 -9.962 4.421 4.288 998 HE2 TYR 132 2HE TYR 132 -8.477 8.052 6.032 999 HH TYR 132 HH TYR 132 -9.580 4.720 6.490 1000 H THR 133 H THR 133 -10.955 7.895 -1.139 1001 HA THR 133 HA THR 133 -10.555 10.405 -2.399 1002 HB THR 133 HB THR 133 -10.973 9.139 -4.475 1003 HG1 THR 133 1HG THR 133 -12.678 7.855 -3.650 1004 HG21 THR 133 3HG2 THR 133 -8.772 8.943 -3.366 1005 HG22 THR 133 1HG2 THR 133 -9.212 7.445 -4.189 1006 HG23 THR 133 2HG2 THR 133 -9.374 7.569 -2.436 1007 H GLU 134 H GLU 134 -13.436 8.419 -1.815 1008 HA GLU 134 HA GLU 134 -15.245 10.026 -3.327 1009 HB2 GLU 134 2HB GLU 134 -15.681 7.653 -2.646 1010 HB3 GLU 134 1HB GLU 134 -15.872 8.192 -0.981 1011 HG2 GLU 134 2HG GLU 134 -17.760 9.649 -1.663 1012 HG3 GLU 134 1HG GLU 134 -17.551 9.132 -3.335 1013 H ASN 135 H ASN 135 -14.117 10.075 0.022 1014 HA ASN 135 HA ASN 135 -16.019 11.888 1.061 1015 HB2 ASN 135 2HB ASN 135 -14.498 10.566 2.484 1016 HB3 ASN 135 1HB ASN 135 -13.125 11.491 1.881 1017 HD21 ASN 135 1HD2 ASN 135 -15.861 11.550 4.082 1018 HD22 ASN 135 2HD2 ASN 135 -15.511 13.059 4.778 1019 H ASN 136 H ASN 136 -12.878 12.431 -0.561 1020 HA ASN 136 HA ASN 136 -12.805 15.237 -0.185 1021 HB2 ASN 136 2HB ASN 136 -10.846 13.889 -0.872 1022 HB3 ASN 136 1HB ASN 136 -11.609 13.578 -2.429 1023 HD21 ASN 136 1HD2 ASN 136 -10.199 14.781 -3.796 1024 HD22 ASN 136 2HD2 ASN 136 -9.957 16.454 -3.642 1025 H LEU 137 H LEU 137 -14.126 13.215 -2.818 1026 HA LEU 137 HA LEU 137 -15.245 15.603 -4.157 1027 HB2 LEU 137 2HB LEU 137 -14.034 13.891 -5.514 1028 HB3 LEU 137 1HB LEU 137 -15.223 12.689 -5.029 1029 HG LEU 137 HG LEU 137 -17.020 14.052 -6.131 1030 HD11 LEU 137 1HD1 LEU 137 -16.069 15.848 -7.822 1031 HD12 LEU 137 2HD1 LEU 137 -14.709 15.930 -6.701 1032 HD13 LEU 137 3HD1 LEU 137 -16.341 16.300 -6.145 1033 HD21 LEU 137 3HD2 LEU 137 -16.337 13.559 -8.450 1034 HD22 LEU 137 1HD2 LEU 137 -15.879 12.243 -7.369 1035 HD23 LEU 137 2HD2 LEU 137 -14.662 13.392 -7.926 1036 H GLU 138 H GLU 138 -17.140 16.236 -3.278 1037 HA GLU 138 HA GLU 138 -19.447 14.576 -3.453 1038 HB2 GLU 138 2HB GLU 138 -18.395 13.662 -1.336 1039 HB3 GLU 138 1HB GLU 138 -18.553 15.260 -0.621 1040 HG2 GLU 138 2HG GLU 138 -20.451 13.914 0.095 1041 HG3 GLU 138 1HG GLU 138 -21.050 15.129 -1.026 1042 H HIS 139 H HIS 139 -20.345 16.271 -4.567 1043 HA HIS 139 HA HIS 139 -20.260 18.997 -3.745 1044 HB2 HIS 139 2HB HIS 139 -22.263 17.587 -5.544 1045 HB3 HIS 139 1HB HIS 139 -22.007 19.330 -5.440 1046 HD2 HIS 139 2HD HIS 139 -20.585 16.318 -7.348 1047 HE1 HIS 139 1HE HIS 139 -17.828 19.470 -7.888 1048 HE2 HIS 139 2HE HIS 139 -18.487 17.144 -8.666 1049 H HIS 140 H HIS 140 -20.790 18.802 -1.491 1050 HA HIS 140 HA HIS 140 -22.169 18.955 0.322 1051 HB2 HIS 140 2HB HIS 140 -23.176 20.763 -1.080 1052 HB3 HIS 140 1HB HIS 140 -24.313 19.594 -1.740 1053 HD2 HIS 140 2HD HIS 140 -26.592 19.278 -0.201 1054 HE1 HIS 140 1HE HIS 140 -25.174 21.131 3.318 1055 HE2 HIS 140 2HE HIS 140 -27.205 20.088 2.205 1056 H HIS 141 H HIS 141 -23.988 17.918 1.459 1057 HA HIS 141 HA HIS 141 -25.438 15.741 0.271 1058 HB2 HIS 141 2HB HIS 141 -24.313 13.920 1.564 1059 HB3 HIS 141 1HB HIS 141 -23.260 14.635 0.342 1060 HD2 HIS 141 2HD HIS 141 -21.275 16.472 1.446 1061 HE1 HIS 141 1HE HIS 141 -21.652 14.981 5.376 1062 HE2 HIS 141 2HE HIS 141 -20.238 16.428 3.841 1063 H HIS 142 H HIS 142 -26.785 14.627 1.838 1064 HA HIS 142 HA HIS 142 -27.899 16.394 3.772 1065 HB2 HIS 142 2HB HIS 142 -28.265 13.392 3.459 1066 HB3 HIS 142 1HB HIS 142 -29.314 14.472 4.380 1067 HD2 HIS 142 2HD HIS 142 -30.897 16.254 2.757 1068 HE1 HIS 142 1HE HIS 142 -30.033 14.303 -0.885 1069 HE2 HIS 142 2HE HIS 142 -31.510 16.043 0.228 1070 H HIS 143 H HIS 143 -27.487 16.627 5.918 1071 HA HIS 143 HA HIS 143 -25.100 15.540 7.047 1072 HB2 HIS 143 2HB HIS 143 -26.051 17.749 7.692 1073 HB3 HIS 143 1HB HIS 143 -27.419 16.933 8.444 1074 HD2 HIS 143 2HD HIS 143 -23.474 17.072 8.988 1075 HE1 HIS 143 1HE HIS 143 -25.323 15.919 12.604 1076 HE2 HIS 143 2HE HIS 143 -23.107 16.497 11.507 1077 H HIS 144 H HIS 144 -24.796 13.760 8.293 1078 HA HIS 144 HA HIS 144 -26.723 11.692 8.384 1079 HB2 HIS 144 2HB HIS 144 -24.272 11.307 8.498 1080 HB3 HIS 144 1HB HIS 144 -24.237 12.047 10.097 1081 HD2 HIS 144 2HD HIS 144 -24.630 10.207 12.124 1082 HE1 HIS 144 1HE HIS 144 -26.488 7.180 9.840 1083 HE2 HIS 144 2HE HIS 144 -25.624 7.792 12.148
Contact the webmaster for help, if required. Thursday, May 16, 2024 9:24:02 AM GMT (wattos1)